A0A5K4F4Y3_SCHMA Loading...

Serine/threonine-protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F4Y3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,865 aa.

						>A0A5K4F4Y3_SCHMA|A0A5K4F4Y3
MPYSSSSHVPLLPSDARHKLQLRKCYNDSAGMGKTDIRRHVRDTEHDTSLRLGIKRRYNSRGNSNVVNYHSGEQKRIRKSSPGYGYPSAESHNSDEEWNLGINKTVPRKVTSLSRNPLLSTRPHGYGNRFHGYDPNQAAVPNKFKNYKLDVNNANQNMDNEQLLMLYYSHMYQQYYRTYTATALSLSNYPNADLLPAVAAAAANNSGIPSDLTSIGSVLSSGNSFDFSKHSRDVDIRGRRPKKYHKHESSNVSSRSPEQRQHSHSRTFRSNRTNDSSRSSVKDTVPKGKGFRKRESPVKVKKTEYTSEESDDHCLDYVSNDQLCEENSADDDNESQQKSSRRVVRRRSTVETTTSTGQKEESVHDEDNSKVVTSNTSEIVTESKQSFGANNEVSTTEAVSPNETESVEEGEAKDDDTYGEESEENEGVLEESSSENEADSSRETVDSNQQSQKKANNLLESKSSKVQKTSTSSTSNRVAAEGKRRHVEVLPTDTLLPMSTEFDHERGPLLPTPVDVDRRHLRFRNAGNDLSLFPGCATAPHIPNVLEAAALMSGLCPSLFPSMNPSNLLNTLRCPPVDFAPPFCDLFNLPNPIEIQKQINCLKMNCHPPSESSESKSGRSKYENSKIRSDVREIRSTFNKHYNMKTRHGNDSESESNCSSGSDYQANVVVRKSVNRPPSSDRCMLEAPKNKHSGKFSTTRKVKDKMKKEQEPVSDKQEFPRKSNKYMSPDDSPGPPDTNSNKPVSRVPRGPRTPSSPPLSSQDEGDSGGTCSHYDLSRESCSRSSLNNKTRRQNEITSSVSGRCLDSSNSNENLSVRKPVVCTNSQSSNNRSPKTRSSKHNTKIMRGRDHHSSNCSNSSTSASTSRSNSYEAPNVCNTSNKKKRSTNRHITHSNVGMSYEDNSPNQSSQFAHFRSDDTGDSSDSSDQQNRALPAAYANPHQSDRHQSHSSGDVEPPPAPSPRSSSSSTSSSSSSRSYCHIRSSSSNPPENNKIQAISSGSSRHSSTSQSQDRVRHTQSKSRRQGIKPKSKKLNDSDDHNQQTRSLKEKKKMSTSLCHRSSDSVDDINDNNRREISNPVYSYRDSSSDLKDISSKESSILRRGEDTRSDVSEDESSTSGGRNMCRQSSRSRSSSYTSSRSTDRNVSNRRNKERVIENKYKHSKRKPCTPDSSLSNTRKYGQTKNRNEHNIEEKHFNSNRKRALLPPPTSTKPETKIWRSRKGYVNEVPASSLRHPQLPNSHHSVNKKVFHGQVTSKTSRRSSAMKNQREESSWSTMAHERHTRDDHYGSGSFKSGTMHIDMTDSSSRPRPPRFGHTTNNKDTHGVRQNYTSRNYPVKHLHIKTDVHDSKLHWSKSGNTRNFRPPVTSSSRSPIGKVGKHIGASTDHHHHQNARKKQTDIVWEPGPKSIKKVNNNYSTKVSSSKALLKTPETTSRRADHHYHSQHESSRDSESHNSDSSSSSSSPEEEDDDEVVDDVDGHLIYSIGDRLLNRYEIVKTLGEGTFGKVVECKDHVQNRRIALKIIKNVDKYREAAMLEINVLNFLNERSANVEHLCVTLLDWFDYHGHICLAFDILGLSVFDFLKENNYVGYPMEHVRHISYQLCYAVRFLHDNQLTHTDLKPENILFVDSDYISVHNRKKRRHERMVKCSDIRLIDFGSATFDYDHHSTIVSTRHYRAPEVILELGWSQPCDVWSIGCIMFELYTGYTLFQTHDNREHLAMMERTLGHIPYRMTRKSRTGFFYHGRLDWDFYNQEGRYVRENCRPLLRYCKDESQDTLDLFDLMSKMLEYDPADRIPLSAALTHPFFLHLPSHQRLTYTPYPLDTIPPNERRTSGSRSGTTNQQPSTTANNGSSSSSSVSSDFKRNR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	37	Very low	27.7	Very low	147 Å²	147	131.2 Å²	131.2	72%	0.724	74%	0.741	S	S	*	*				0	126.6	0	-55.7	179.9	176.1	0	0	108.1	G1837	M1-G1837 WeakPolarHBondContact CE-O 3.34Å; M1-G1837 WeakPolarHBondContact CG-O 3.43Å
2	P	24.8	Very low	27.6	Very low	68 Å²	68	129.6 Å²	129.6	44%	0.442	73%	0.728	S	S	.	*			trans	-134.5	138.5	-173	37.1	-19.9	0	0	0	116.7
3	Y	25.5	Very low	28.1	Very low	241 Å²	241	127.9 Å²	127.9	95%	0.945	73%	0.726	S	S	*	*			trans	-58.4	135.5	149.6	-75.8	-117.5	0	0	0	110
4	S	29.2	Very low	28.3	Very low	94 Å²	94	125.4 Å²	125.4	66%	0.657	72%	0.72	S	S	*	*			trans	-172.9	124.6	151.4	4	0	0	0	0	108.6
5	S	25.7	Very low	28.5	Very low	110 Å²	110	127.2 Å²	127.2	77%	0.769	73%	0.727	S	S	*	*			cis	100.4	106.2	23.5	77.4	0	0	0	0	114.4
6	S	26	Very low	28.7	Very low	128 Å²	128	123.1 Å²	123.1	90%	0.895	71%	0.713	S	S	*	*			trans	66.5	139.8	169	-134.9	0	0	0	0	116
7	S	29.2	Very low	28.7	Very low	107 Å²	107	128.1 Å²	128.1	75%	0.748	72%	0.717	S	S	*	*			cis	-122.6	141	17.2	45.2	0	0	0	0	113.6
8	H	27.4	Very low	29.2	Very low	183 Å²	183	129 Å²	129	85%	0.847	72%	0.715	S	S	*	*			trans	-85.8	128.2	169.4	-112.3	-85.3	0	0	0	109.3
9	V	26.2	Very low	29.3	Very low	101 Å²	101	130.5 Å²	130.5	61%	0.612	71%	0.713	S	S	*	*			trans	-124.5	110	154.2	178.6	0	0	0	0	106.4	L11	V9-L11 PolarHBondContact O-N 2.88Å
10	P	25.7	Very low	29.3	Very low	100 Å²	100	132.2 Å²	132.2	65%	0.649	72%	0.72	S	S	*	*			trans	-77.2	92.1	175.4	31.1	-31.8	0	0	0	109.2	L12	P10-L12 VanDerWaalsContact C-N 3.25Å; P10-L12 PolarHBondContact O-N 2.94Å
11	L	28	Very low	29.5	Very low	164 Å²	164	133.1 Å²	133.1	86%	0.859	72%	0.72	S	S	*	*			trans	-69.2	94.8	154	-69.5	178.1	0	0	0	106.8	V9	V9-L11 PolarHBondContact O-N 2.88Å
12	L	27	Very low	29.2	Very low	112 Å²	112	131.9 Å²	131.9	59%	0.586	72%	0.715	S	S	*	*			trans	-60.6	137.3	171.1	-67.6	160.5	0	0	0	108.8	P10 A16	P10-L12 VanDerWaalsContact C-N 3.25Å; P10-L12 PolarHBondContact O-N 2.94Å; L12-A16 HydrophobicContact CD2-CB 4.41Å
13	P	33.5	Very low	29.3	Very low	108 Å²	108	139.3 Å²	139.3	70%	0.701	74%	0.735	S	S	*	*			trans	-53.3	141.1	153.3	-20.1	33	0	0	0	109	D15	P13-D15 PolarHBondContact O-N 2.67Å; P13-D15 VanDerWaalsContact O-N 3.08Å
14	S	30.5	Very low	29.4	Very low	93 Å²	93	135.3 Å²	135.3	65%	0.65	72%	0.722	S	S	*	*	S	Bend	trans	-62.2	-22.4	-165.8	-63.5	0	0	0	0	114.8	A16 R17	S14-A16 PolarHBondContact O-N 3.06Å; S14-R17 PolarHBondContact O-N 2.86Å
15	D	32	Very low	29.4	Very low	152 Å²	152	136.4 Å²	136.4	81%	0.813	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	43.3	178.3	-60.9	-55.8	0	0	0	114.8	P13	P13-D15 PolarHBondContact O-N 2.67Å; P13-D15 VanDerWaalsContact O-N 3.08Å
16	A	32.2	Very low	29.4	Very low	62 Å²	62	141.8 Å²	141.8	51%	0.512	73%	0.734	S	S	.	*	T	Hydrogen-bonded Turn	trans	-136.5	1.3	174	0	0	0	0	0	113.8	L12 S14	L12-A16 HydrophobicContact CD2-CB 4.41Å; S14-A16 PolarHBondContact O-N 3.06Å
17	R	28.7	Very low	29.5	Very low	208 Å²	208	142.6 Å²	142.6	79%	0.785	73%	0.728	S	S	*	*	S	Bend	trans	-119.5	-4.5	-173	-124.5	178.3	-174.1	-178.5	1.5	117.9	S14	S14-R17 PolarHBondContact O-N 2.86Å
18	H	36.6	Very low	29.5	Very low	144 Å²	144	143.1 Å²	143.1	67%	0.667	72%	0.722	S	S	*	*	S	Bend	trans	-84.2	-26.8	170.2	-88.9	117.3	0	0	0	114.4	L20 Q21	H18-L20 PolarHBondContact O-N 3.15Å; H18-Q21 PolarHBondContact O-N 2.71Å
19	K	32.6	Very low	29.5	Very low	157 Å²	157	140.8 Å²	140.8	68%	0.683	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	14.2	175	-77.6	-155.9	171	-168.3	0	115.6	E423	K19-E423 IonicContact NZ-OE2 2.7Å; K19-E423 PolarHBondContact NZ-OE2 2.81Å
20	L	28.9	Very low	29.6	Very low	164 Å²	164	140.3 Å²	140.3	86%	0.859	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.9	31	168.4	-149.2	79.9	0	0	0	115.4	H18	H18-L20 PolarHBondContact O-N 3.15Å
21	Q	32.7	Very low	29.7	Very low	153 Å²	153	138.4 Å²	138.4	72%	0.715	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	-11.2	170	-121.8	161.5	-2.5	0	0	117	H18 R23	H18-Q21 PolarHBondContact O-N 2.71Å; Q21-R23 PolarHBondContact O-N 2.8Å
22	L	30.8	Very low	29.7	Very low	120 Å²	120	139 Å²	139	63%	0.628	73%	0.732	S	S	*	*	S	Bend	trans	-74.2	45.9	166.5	-75.5	172.8	0	0	0	113.8
23	R	27.2	Very low	29.8	Very low	224 Å²	224	137.2 Å²	137.2	85%	0.845	74%	0.741	S	S	*	*	S	Bend	trans	-129.6	33.8	160.2	-154.7	174.9	-175.3	171.5	4.7	111.3	Q21	Q21-R23 PolarHBondContact O-N 2.8Å
24	K	27.3	Very low	29.7	Very low	157 Å²	157	142.1 Å²	142.1	68%	0.683	75%	0.752	S	S	*	*	S	Bend	trans	-158.5	40.8	180	-130.9	174.4	-175	-177.6	0	117
25	C	28.9	Very low	29.7	Very low	117 Å²	117	143.8 Å²	143.8	79%	0.791	76%	0.758	S	S	*	*	S	Bend	trans	-146.9	10.6	164.6	-99.4	0	0	0	0	116.4
26	Y	27	Very low	29.7	Very low	224 Å²	224	143.6 Å²	143.6	88%	0.878	76%	0.757	S	S	*	*	S	Bend	trans	-109.7	133	148.3	-106.1	-103	0	0	0	106.8
27	N	26.8	Very low	29.5	Very low	145 Å²	145	147.8 Å²	147.8	78%	0.775	77%	0.769	S	S	*	*	S	Bend	trans	66.9	65.7	-161.5	-53.9	-57.3	0	0	0	115.6
28	D	28.6	Very low	29.3	Very low	117 Å²	117	148.1 Å²	148.1	63%	0.626	77%	0.77	S	S	*	*			trans	-151.5	51.4	140.5	-115.1	-25.2	0	0	0	114.1
29	S	28.6	Very low	28.8	Very low	135 Å²	135	150.9 Å²	150.9	94%	0.944	78%	0.775	S	S	*	*	S	Bend	trans	-122.8	38.8	155.7	-79.8	0	0	0	0	111.1
30	A	29	Very low	28.6	Very low	91 Å²	91	151.3 Å²	151.3	75%	0.752	78%	0.779	S	S	*	*			trans	-134.5	15.5	173.6	0	0	0	0	0	112.3	M32	A30-M32 PolarHBondContact O-N 2.83Å
31	G	27.3	Very low	28.7	Very low	59 Å²	59	148.9 Å²	148.9	61%	0.608	77%	0.77	S	S	*	*			trans	-90.6	65.2	-170.8	0	0	0	0	0	115.6
32	M	27.7	Very low	28.4	Very low	176 Å²	176	150.9 Å²	150.9	87%	0.867	77%	0.771	S	S	*	*	S	Bend	trans	-178.9	120	149.6	-108.6	-173	149.2	0	0	112.4	A30 M706	A30-M32 PolarHBondContact O-N 2.83Å; M32-M706 HydrophobicContact CE-CE 4.45Å
33	G	29.6	Very low	28.4	Very low	76 Å²	76	151.3 Å²	151.3	78%	0.784	77%	0.774	S	S	*	*			trans	142.7	34.1	166.8	0	0	0	0	0	119.7	T35	G33-T35 PolarHBondContact O-N 3.2Å
34	K	31.4	Very low	28.5	Very low	211 Å²	211	144.7 Å²	144.7	92%	0.917	76%	0.759	S	S	*	*			trans	-72.8	113	172.4	-75	-175.2	177.5	179.5	0	112
35	T	29.6	Very low	28.7	Very low	128 Å²	128	144 Å²	144	79%	0.785	76%	0.758	S	S	*	*			trans	-159.2	162	155.4	14.5	0	0	0	0	110.8	G33	G33-T35 PolarHBondContact O-N 3.2Å
36	D	31.7	Very low	28.8	Very low	148 Å²	148	145.8 Å²	145.8	79%	0.791	76%	0.755	S	S	*	*			trans	64.9	51.7	167	-61.1	-4.6	0	0	0	119.1
37	I	27.7	Very low	28.9	Very low	149 Å²	149	140.6 Å²	140.6	76%	0.764	74%	0.742	S	S	*	*				20.4	131.3	112.9	-63.7	174.9	0	0	0	118.3
38	R	25.2	Very low	29	Very low	215 Å²	215	137.9 Å²	137.9	81%	0.811	73%	0.731	S	S	*	*			trans	90.3	125.5	153	-87.7	167.1	179.7	169.8	-0.1	121.6
39	R	26.3	Very low	28.9	Very low	203 Å²	203	137 Å²	137	77%	0.766	73%	0.734	S	S	*	*			trans	73.9	132.8	160.8	-56.5	169.2	-169.3	154.5	1.5	115.3
40	H	28.4	Very low	28.9	Very low	166 Å²	166	135.2 Å²	135.2	77%	0.769	71%	0.713	S	S	*	*			cis	-130	145.4	0.3	-78.7	-82.6	0	0	0	108
41	V	30.6	Very low	28.7	Very low	112 Å²	112	137.7 Å²	137.7	68%	0.679	70%	0.703	S	S	*	*			cis	65.2	89.3	18	-168.7	0	0	0	0	115.2
42	R	26.6	Very low	28.7	Very low	195 Å²	195	142.5 Å²	142.5	74%	0.736	71%	0.714	S	S	*	*			trans	165.5	133.2	135	-90.7	-163.7	-169	153.4	4.4	109.1
43	D	30.7	Very low	28.5	Very low	129 Å²	129	137.4 Å²	137.4	69%	0.69	71%	0.707	S	S	*	*			cis	-131.3	143.2	-4.5	-57.4	-72.3	0	0	0	107.4
44	T	30.3	Very low	28.4	Very low	85 Å²	85	140.9 Å²	140.9	52%	0.521	71%	0.706	S	S	.	*			cis	70.2	138.1	36	70.7	0	0	0	0	114.4
45	E	31.7	Very low	28.1	Very low	144 Å²	144	138.8 Å²	138.8	67%	0.673	70%	0.697	S	S	*	*			cis	-173.9	-176.5	-10.8	-107.7	152.3	178.4	0	0	106.5
46	H	30.4	Very low	27.9	Very low	153 Å²	153	142.6 Å²	142.6	71%	0.708	70%	0.697	S	S	*	*			trans	70.2	145.7	149.1	-65	-42.1	0	0	0	120.3
47	D	29.2	Very low	27.6	Very low	116 Å²	116	144.8 Å²	144.8	62%	0.62	69%	0.694	S	S	*	*			cis	-158.7	162.4	-12.1	-129.2	23.2	0	0	0	116.9
48	T	28.4	Very low	27.5	Very low	87 Å²	87	146.5 Å²	146.5	53%	0.534	69%	0.692	S	S	.	*			trans	13.4	145	149.4	57.4	0	0	0	0	124
49	S	26.5	Very low	27.6	Very low	99 Å²	99	142.4 Å²	142.4	69%	0.692	69%	0.687	S	S	*	*				137.3	102.9	128.5	-161.4	0	0	0	0	118
50	L	28.5	Very low	27.7	Very low	97 Å²	97	137 Å²	137	51%	0.508	68%	0.679	S	S	.	*			trans	51.7	147.6	137.7	-64.1	-175.1	0	0	0	126.7	S433 S434	L50-S433 WeakPolarHBondContact CD1-O 3.34Å; L50-S434 WeakPolarHBondContact CD1-O 3.31Å
51	R	24.9	Very low	27.8	Very low	143 Å²	143	140.8 Å²	140.8	54%	0.54	69%	0.687	S	S	.	*			trans	78	117.5	145.1	-91.2	-172.3	154.9	106.1	-12.5	122.6	E435	R51-E435 PolarHBondContact NH1-O 3.4Å
52	L	27.1	Very low	27.6	Very low	160 Å²	160	138.8 Å²	138.8	84%	0.838	69%	0.689	S	S	*	*			trans	57.3	131	135.1	-63.4	166.7	0	0	0	121.1
53	G	24.9	Very low	27.7	Very low	70 Å²	70	136.4 Å²	136.4	72%	0.722	69%	0.691	S	S	*	*			trans	128	93.6	140	0	0	0	0	0	120.1
54	I	27.2	Very low	27.7	Very low	148 Å²	148	134.2 Å²	134.2	76%	0.759	69%	0.686	S	S	*	*				38.4	113.1	129.3	-58.7	-179.4	0	0	0	119.7
55	K	25.3	Very low	27.7	Very low	167 Å²	167	137 Å²	137	73%	0.726	70%	0.698	S	S	*	*			trans	72.7	120.7	147.6	-70.4	169	-170.6	160.2	0	122
56	R	24.6	Very low	27.6	Very low	208 Å²	208	134.5 Å²	134.5	79%	0.785	69%	0.692	S	S	*	*				70.1	123.4	127	-65.3	175.3	175.2	-175.8	-2.1	120.9
57	R	25.8	Very low	27.6	Very low	194 Å²	194	132.6 Å²	132.6	73%	0.732	69%	0.691	S	S	*	*			trans	42.8	123.2	137.5	-48.5	-178.5	-174.7	-176.1	2.6	117.7
58	Y	24.5	Very low	27.4	Very low	185 Å²	185	132.7 Å²	132.7	73%	0.725	69%	0.691	S	S	*	*				-176.2	133.5	71.3	-91.2	-82	0	0	0	105.9
59	N	27.8	Very low	27.5	Very low	130 Å²	130	137.3 Å²	137.3	70%	0.695	70%	0.7	S	S	*	*				93.2	123.5	57.6	-171.9	22	0	0	0	113.9
60	S	29.4	Very low	27.8	Very low	88 Å²	88	140 Å²	140	62%	0.615	70%	0.701	S	S	*	*			trans	75.3	159.1	160.1	90.6	0	0	0	0	116.8
61	R	29.9	Very low	27.8	Very low	246 Å²	246	140.8 Å²	140.8	93%	0.928	72%	0.715	S	S	*	*			cis	-163.3	154.9	3.1	-140.5	159.6	-169.2	160.4	-2	111.7
62	G	27	Very low	27.9	Very low	70 Å²	70	137.1 Å²	137.1	72%	0.722	72%	0.722	S	S	*	*			trans	138.4	133.3	162.2	0	0	0	0	0	112.8
63	N	27.7	Very low	28.1	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	72%	0.718	S	S	*	*	S	Bend	cis	-153.5	150	-7.3	-152.3	16.7	0	0	0	106.8
64	S	31.8	Very low	28.1	Very low	82 Å²	82	140.7 Å²	140.7	57%	0.573	72%	0.716	S	S	*	*	S	Bend	cis	-150	178.3	16	63.9	0	0	0	0	109.4
65	N	29.8	Very low	28.2	Very low	145 Å²	145	140.5 Å²	140.5	78%	0.775	71%	0.709	S	S	*	*			cis	-139.7	158.3	10.7	-90	-61.1	0	0	0	109.5
66	V	28.5	Very low	28.2	Very low	91 Å²	91	143 Å²	143	55%	0.552	71%	0.714	S	S	*	*			cis	-175.3	-179.6	-31.7	120.1	0	0	0	0	106.9
67	V	30.1	Very low	28.4	Very low	112 Å²	112	138.2 Å²	138.2	68%	0.679	70%	0.703	S	S	*	*			trans	83.6	86.5	-177	-166.5	0	0	0	0	112
68	N	26.9	Very low	28.4	Very low	119 Å²	119	139.1 Å²	139.1	64%	0.636	71%	0.707	S	S	*	*				82.8	121.7	59.8	-61.9	12.6	0	0	0	112.6
69	Y	29.7	Very low	28.5	Very low	184 Å²	184	139.7 Å²	139.7	72%	0.722	71%	0.713	S	S	*	*				179.6	132.9	99.6	-104.3	-82	0	0	0	111.6
70	H	33.1	Very low	28.4	Very low	154 Å²	154	139.3 Å²	139.3	71%	0.713	72%	0.72	S	S	*	*			trans	42.8	122.7	154.9	-63.1	-12.3	0	0	0	120.5
71	S	28.4	Very low	28.5	Very low	114 Å²	114	140.4 Å²	140.4	80%	0.797	73%	0.728	S	S	*	*				56.9	139.9	72.2	73.6	0	0	0	0	114.3
72	G	26.9	Very low	28.8	Very low	67 Å²	67	134.9 Å²	134.9	69%	0.691	72%	0.724	S	S	*	*			cis	173.2	-168.6	4.2	0	0	0	0	0	109.8
73	E	31	Very low	28.9	Very low	161 Å²	161	134.5 Å²	134.5	75%	0.752	72%	0.72	S	S	*	*			trans	64.7	135.1	-179.5	-63.3	-158	96.5	0	0	115.9	K75	E73-K75 IonicContact OE1-NZ 2.86Å; E73-K75 PolarHBondContact OE1-NZ 3.41Å
74	Q	25.5	Very low	28.9	Very low	143 Å²	143	139.5 Å²	139.5	67%	0.668	73%	0.73	S	S	*	*			cis	100.5	144.9	33	-79.9	-163.9	5.7	0	0	114.9
75	K	28.4	Very low	28.7	Very low	144 Å²	144	139.3 Å²	139.3	63%	0.626	74%	0.74	S	S	*	*			trans	79.1	117.9	159.7	-65.8	136	178.6	143.5	0	120.1	E73	E73-K75 IonicContact OE1-NZ 2.86Å; E73-K75 PolarHBondContact OE1-NZ 3.41Å
76	R	25.8	Very low	28.7	Very low	219 Å²	219	142 Å²	142	83%	0.826	74%	0.741	S	S	*	*				90.8	116.4	125.5	-77.7	-178.1	155.1	-166.3	-3.9	122.6
77	I	27.8	Very low	28.9	Very low	108 Å²	108	142.9 Å²	142.9	55%	0.554	75%	0.748	S	S	*	*				91.2	122.8	117.9	-72.5	174.4	0	0	0	121.1
78	R	26.4	Very low	28.7	Very low	214 Å²	214	143.2 Å²	143.2	81%	0.808	76%	0.756	S	S	*	*			trans	62.4	127.4	155.3	-70.2	163.5	-165.9	163.8	-0	117
79	K	26.6	Very low	28.8	Very low	197 Å²	197	141.6 Å²	141.6	86%	0.857	76%	0.759	S	S	*	*				65.9	96	60.2	-71.7	-168	176.1	-172	0	113.9
80	S	26.5	Very low	28.5	Very low	122 Å²	122	141.5 Å²	141.5	85%	0.853	77%	0.765	S	S	*	*				179.2	140.7	124.7	53	0	0	0	0	112.9
81	S	30.5	Very low	28.1	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	76%	0.761	S	S	*	*			trans	-78	-167	157.6	-34.4	0	0	0	0	109.7
82	P	37.3	Very low	28.1	Very low	130 Å²	130	140.8 Å²	140.8	84%	0.844	76%	0.759	S	S	*	*			cis	-133	-167.9	-12.6	41.4	-24.2	0	0	0	113.2
83	G	29.1	Very low	28	Very low	61 Å²	61	144.5 Å²	144.5	63%	0.629	76%	0.763	S	S	*	*			trans	143.5	126.9	143.3	0	0	0	0	0	119.1
84	Y	26.7	Very low	27.7	Very low	252 Å²	252	141.5 Å²	141.5	99%	0.988	76%	0.76	S	S	*	*			trans	33.7	139.5	139	-64.8	-89.2	0	0	0	122.8
85	G	26.7	Very low	27.7	Very low	78 Å²	78	141.8 Å²	141.8	80%	0.804	77%	0.766	S	S	*	*			trans	159.3	71.2	154.4	0	0	0	0	0	119.1
86	Y	29.9	Very low	27.7	Very low	202 Å²	202	142.3 Å²	142.3	79%	0.792	77%	0.771	S	S	*	*			trans	-65.5	175.5	160.3	-100.5	-136	0	0	0	112.4
87	P	32.6	Very low	27.7	Very low	108 Å²	108	139 Å²	139	70%	0.701	77%	0.765	S	S	*	*			cis	-142.8	-164.6	-18.9	38.3	-16.8	0	0	0	115.4
88	S	27.7	Very low	27.8	Very low	119 Å²	119	144 Å²	144	83%	0.832	78%	0.776	S	S	*	*			trans	-31.6	151.1	161.3	-39.9	0	0	0	0	120.2
89	A	27	Very low	27.7	Very low	86 Å²	86	139.5 Å²	139.5	71%	0.711	77%	0.769	S	S	*	*			trans	-157.6	131	139.2	0	0	0	0	0	111.4
90	E	25	Very low	27.8	Very low	182 Å²	182	136.7 Å²	136.7	85%	0.85	76%	0.762	S	S	*	*				18.5	145.8	118.8	-71	156.3	-162.3	0	0	118.7
91	S	25.1	Very low	27.8	Very low	88 Å²	88	134 Å²	134	62%	0.615	75%	0.753	S	S	*	*			cis	-177.7	179	9.5	43.3	0	0	0	0	111.4
92	H	27.6	Very low	27.7	Very low	164 Å²	164	135.5 Å²	135.5	76%	0.759	75%	0.751	S	S	*	*			trans	67.2	139.7	172.4	-57	-77.6	0	0	0	116.6
93	N	24.4	Very low	27.2	Very low	146 Å²	146	137 Å²	137	78%	0.781	75%	0.752	S	S	*	*			cis	70.8	157.4	37.1	-69.5	-6	0	0	0	114.7
94	S	25.1	Very low	27.2	Very low	97 Å²	97	142 Å²	142	68%	0.678	76%	0.757	S	S	*	*			trans	71.5	117.6	-165	66	0	0	0	0	113.7
95	D	25.7	Very low	27.4	Very low	150 Å²	150	135.4 Å²	135.4	80%	0.802	74%	0.743	S	S	*	*				84.2	145.3	73.1	-55.9	-33.1	0	0	0	110.7
96	E	27.2	Very low	27.6	Very low	154 Å²	154	138.1 Å²	138.1	72%	0.72	74%	0.743	S	S	*	*			cis	-119.4	150.6	-6.1	-81.7	120.1	-175.8	0	0	109.6
97	E	27.5	Very low	27.5	Very low	150 Å²	150	133.7 Å²	133.7	70%	0.701	74%	0.739	S	S	*	*				43.3	68.3	73.7	-163.4	167	-157.3	0	0	116.3	N99	E97-N99 HydrophobicContact CG-CB 3.79Å; E97-N99 PolarHBondContact O-N 2.8Å; E97-N99 PolarHBondContact OE1-ND2 2.87Å
98	W	28.6	Very low	27.2	Very low	212 Å²	212	133.9 Å²	133.9	80%	0.803	73%	0.726	S	S	*	*			trans	-87.5	59.5	157.1	-85.8	79.2	0	0	0	112.5	L100	W98-L100 VanDerWaalsContact C-N 3.32Å; W98-L100 HydrophobicContact CE3-CD1 3.99Å; W98-L100 HydrophobicContact CE3-CG 4.36Å; W98-L100 HydrophobicContact CZ3-CD1 3.66Å; W98-L100 HydrophobicContact CZ3-CG 4.41Å; W98-L100 PolarHBondContact O-N 3.25Å
99	N	25.5	Very low	27.2	Very low	120 Å²	120	135.5 Å²	135.5	64%	0.642	72%	0.718	S	S	*	*			trans	-74.3	81.8	166.2	-99.4	-36.3	0	0	0	110.9	E97	E97-N99 HydrophobicContact CG-CB 3.79Å; E97-N99 PolarHBondContact O-N 2.8Å; E97-N99 PolarHBondContact OE1-ND2 2.87Å
100	L	28.5	Very low	27.1	Very low	139 Å²	139	134.2 Å²	134.2	73%	0.728	70%	0.701	S	S	*	*			trans	-116.8	93.3	157.9	-72.9	-178.2	0	0	0	108.4	W98	W98-L100 VanDerWaalsContact C-N 3.32Å; W98-L100 HydrophobicContact CE3-CD1 3.99Å; W98-L100 HydrophobicContact CE3-CG 4.36Å; W98-L100 HydrophobicContact CZ3-CD1 3.66Å; W98-L100 HydrophobicContact CZ3-CG 4.41Å; W98-L100 PolarHBondContact O-N 3.25Å
101	G	25.4	Very low	27.4	Very low	64 Å²	64	129.2 Å²	129.2	66%	0.66	68%	0.683	S	S	*	*			cis	93.4	31.8	20.5	0	0	0	0	0	112.6
102	I	29.8	Very low	27.4	Very low	144 Å²	144	128.1 Å²	128.1	74%	0.738	68%	0.676	S	S	*	*			trans	-98.3	81.9	165.8	-57.3	-173	0	0	0	109.9	K104	I102-K104 HydrophobicContact CG2-CB 4.24Å; I102-K104 HydrophobicContact CG2-CD 4.01Å; I102-K104 PolarHBondContact O-N 2.81Å; I102-K104 VanDerWaalsContact O-N 3.14Å
103	N	25.7	Very low	27.4	Very low	160 Å²	160	125.5 Å²	125.5	86%	0.856	67%	0.667	S	S	*	*			trans	-57.5	107	153.2	-117.2	-44.3	0	0	0	108.8
104	K	30.3	Very low	27.5	Very low	167 Å²	167	124.1 Å²	124.1	73%	0.726	67%	0.668	S	S	*	*			trans	-158	97.5	162.8	-103.5	131.1	-170.1	175.7	0	113.7	I102	I102-K104 HydrophobicContact CG2-CB 4.24Å; I102-K104 HydrophobicContact CG2-CD 4.01Å; I102-K104 PolarHBondContact O-N 2.81Å; I102-K104 VanDerWaalsContact O-N 3.14Å
105	T	30.2	Very low	27.7	Very low	114 Å²	114	126.6 Å²	126.6	70%	0.699	66%	0.663	S	S	*	*				41.4	108	125.5	58.1	0	0	0	0	118.9
106	V	30.4	Very low	28	Very low	135 Å²	135	124.6 Å²	124.6	82%	0.818	65%	0.652	S	S	*	*				5.4	116.5	121.6	178.9	0	0	0	0	113.2
107	P	28.5	Very low	28.1	Very low	108 Å²	108	121.1 Å²	121.1	70%	0.701	64%	0.643	S	S	*	*				-150.4	155.5	85.8	40.1	-23.1	0	0	0	118.8
108	R	25.7	Very low	28.1	Very low	112 Å²	112	118.4 Å²	118.4	42%	0.423	63%	0.633	S	S	.	*			trans	2.3	136	132	-51.9	167.3	172.8	162.4	-5.9	117.7	H1193 N1195	R108-H1193 VanDerWaalsContact CA-NE2 3.27Å; R108-H1193 WeakPolarHBondContact CA-NE2 3.3Å; R108-H1193 VanDerWaalsContact CB-NE2 3.26Å; R108-H1193 WeakPolarHBondContact CB-NE2 3.4Å; R108-H1193 WeakPolarHBondContact CG-NE2 3.15Å; R108-N1195 PolarHBondContact NE-ND2 3.49Å; R108-N1195 PolarHBondContact NE-OD1 2.83Å; R108-N1195 VanDerWaalsContact NE-OD1 3.13Å; R108-N1195 VanDerWaalsContact NH2-CG 3.3Å; R108-N1195 PolarHBondContact NH2-OD1 3.14Å
109	K	27.3	Very low	28	Very low	153 Å²	153	114.7 Å²	114.7	67%	0.665	63%	0.628	S	S	*	*				-172.9	139.3	108	-109.9	-175.4	175.5	-175.4	0	115.1	K1192	K109-K1192 WeakPolarHBondContact O-CD 3.41Å; K109-K1192 WeakPolarHBondContact O-CE 3.12Å; K109-K1192 PolarHBondContact O-NZ 2.65Å
110	V	26	Very low	28	Very low	60 Å²	60	113.8 Å²	113.8	36%	0.364	63%	0.631	S	S	.	*			trans	-19.4	135.3	153.3	-147.2	0	0	0	0	111.3	H1193	V110-H1193 HydrophobicContact CG2-CB 4.2Å
111	T	30.2	Very low	28	Very low	76 Å²	76	112.9 Å²	112.9	47%	0.466	63%	0.632	S	S	.	*				-157.9	133	60.8	44.8	0	0	0	0	111.2	E1190	T111-E1190 WeakPolarHBondContact O-CB 3.34Å
112	S	26	Very low	28	Very low	66 Å²	66	121 Å²	121	46%	0.462	64%	0.642	S	S	.	*				61.6	64.4	65.4	82.5	0	0	0	0	112.8	E1190 E1191	S112-E1190 VanDerWaalsContact CA-O 3.25Å; S112-E1190 WeakPolarHBondContact CA-O 3.35Å; S112-E1190 PolarHBondContact N-O 3.13Å; S112-E1191 PolarHBondContact N-O 3.45Å
113	L	28.4	Very low	27.9	Very low	108 Å²	108	119.1 Å²	119.1	57%	0.565	64%	0.639	S	S	*	*			trans	-113.4	98.6	156.5	-82.3	178.8	0	0	0	111.8	N1188 I1189 E1190	L113-N1188 VanDerWaalsContact O-O 3.08Å; L113-I1189 PolarHBondContact N-O 3.43Å; L113-E1190 PolarHBondContact N-O 2.92Å
114	S	25.2	Very low	27.8	Very low	117 Å²	117	119.7 Å²	119.7	82%	0.818	64%	0.637	S	S	*	*			trans	-71.9	127.9	160.3	58.6	0	0	0	0	110.3
115	R	28.7	Very low	27.5	Very low	149 Å²	149	114.6 Å²	114.6	56%	0.562	63%	0.631	S	S	*	*			trans	-147.6	140.7	158.8	-93	-173.5	-166.5	-151.3	8.5	105.6	N1185 E1186 H1187	R115-N1185 CarbonylContact C-O 3.55Å; R115-N1185 VanDerWaalsContact C-O 3.23Å; R115-N1185 WeakPolarHBondContact CA-O 3.47Å; R115-N1185 WeakPolarHBondContact CB-O 3.45Å; R115-N1185 WeakPolarHBondContact CG-O 3.37Å; R115-E1186 CarbonylContact C-O 3.22Å; R115-E1186 HydrophobicContact CB-CB 4.09Å; R115-E1186 WeakPolarHBondContact CB-O 3.29Å; R115-E1186 HydrophobicContact CG-CB 4.35Å; R115-E1186 IonicContact CZ-OE2 2.72Å; R115-E1186 IonicContact NH1-OE2 3.3Å; R115-E1186 PolarHBondContact NH1-OE2 3.07Å; R115-H1187 WeakPolarHBondContact CB-O 3.17Å
116	N	32.2	Very low	27.3	Very low	108 Å²	108	120.9 Å²	120.9	58%	0.578	64%	0.644	S	S	*	*			trans	-161.4	104.6	-174.9	-173.3	-11.2	0	0	0	115.1	R1184 N1185 E1186	N116-R1184 VanDerWaalsContact C-C 3.44Å; N116-R1184 PolarHBondContact N-O 3.18Å; N116-R1184 CarbonylContact O-C 2.93Å; N116-R1184 WeakPolarHBondContact O-CA 3.49Å; N116-R1184 PolarHBondContact O-N 2.93Å; N116-N1185 VanDerWaalsContact C-N 3.32Å; N116-N1185 PolarHBondContact N-O 3.48Å; N116-N1185 PolarHBondContact O-N 2.98Å; N116-E1186 PolarHBondContact N-O 3.12Å
117	P	30.7	Very low	27.2	Very low	82 Å²	82	117.9 Å²	117.9	53%	0.532	64%	0.64	S	S	.	*			trans	-91.3	137.9	-174.7	33.5	-26.4	0	0	0	113.6
118	L	26.1	Very low	27.1	Very low	93 Å²	93	119.3 Å²	119.3	49%	0.487	64%	0.642	S	S	.	*			cis	68.2	43.3	-5.7	-62.9	-178.3	0	0	0	120.1	N1183	L118-N1183 VanDerWaalsContact CD1-CA 3.48Å
119	L	28	Very low	27.2	Very low	134 Å²	134	124.9 Å²	124.9	70%	0.702	66%	0.663	S	S	*	*			trans	-131.7	114.1	131.6	-84.4	170.1	0	0	0	106
120	S	24.9	Very low	27.1	Very low	100 Å²	100	125 Å²	125	70%	0.699	66%	0.664	S	S	*	*			cis	77.9	41.7	17.6	-163.4	0	0	0	0	116.9
121	T	27.4	Very low	27.2	Very low	121 Å²	121	130 Å²	130	74%	0.742	68%	0.683	S	S	*	*			trans	-141.5	124.9	156	37.9	0	0	0	0	106.2
122	R	25.4	Very low	27.2	Very low	235 Å²	235	129.3 Å²	129.3	89%	0.887	69%	0.69	S	S	*	*			cis	59.2	132.6	20.4	-111.8	-167.3	-170.8	-147.5	4.4	113.2
123	P	27.9	Very low	27.2	Very low	103 Å²	103	135.8 Å²	135.8	67%	0.669	71%	0.706	S	S	*	*			cis	-124.4	-139.7	-4.3	39.8	-20.8	0	0	0	111.2
124	H	25	Very low	27.4	Very low	173 Å²	173	137.1 Å²	137.1	80%	0.801	71%	0.714	S	S	*	*			trans	7.9	129.2	161.3	-51.5	-55.1	0	0	0	118
125	G	23.8	Very low	27.6	Very low	59 Å²	59	136.4 Å²	136.4	61%	0.608	71%	0.707	S	S	*	*				98.8	156.5	58.6	0	0	0	0	0	109.3
126	Y	26.1	Very low	27.6	Very low	247 Å²	247	135.3 Å²	135.3	97%	0.969	71%	0.712	S	S	*	*			trans	63.5	140.5	-158.1	-49.6	-90.9	0	0	0	112.9
127	G	27.5	Very low	27.5	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	72%	0.723	S	S	*	*			cis	-177.7	171.5	-7	0	0	0	0	0	113.1	R129	G127-R129 PolarHBondContact O-N 3.15Å
128	N	25.8	Very low	27.3	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	74%	0.738	S	S	*	*			trans	-61.9	131	178.1	-64.6	-36	0	0	0	113	F130	N128-F130 HydrophobicContact CB-CE2 4.5Å
129	R	27.7	Very low	27.3	Very low	228 Å²	228	139.3 Å²	139.3	86%	0.86	75%	0.75	S	S	*	*			trans	-162.9	129.2	130.2	-103.3	151.6	-93.9	-150.4	2.2	108.1	G127	G127-R129 PolarHBondContact O-N 3.15Å
130	F	26.3	Very low	27.4	Very low	157 Å²	157	138.5 Å²	138.5	69%	0.689	75%	0.75	S	S	*	*				62	133.6	59.2	-68.1	-62	0	0	0	111.4	N128	N128-F130 HydrophobicContact CB-CE2 4.5Å
131	H	28.3	Very low	27.4	Very low	164 Å²	164	138.1 Å²	138.1	76%	0.759	75%	0.745	S	S	*	*			cis	-139.3	176.9	-2.4	-86.7	-78.4	0	0	0	107.5
132	G	31	Very low	27.4	Very low	61 Å²	61	139 Å²	139	63%	0.629	75%	0.746	S	S	*	*			cis	-163.8	153.7	0.8	0	0	0	0	0	108.4
133	Y	25.3	Very low	27.6	Very low	203 Å²	203	136.7 Å²	136.7	80%	0.796	74%	0.742	S	S	*	*				59.9	93.4	81.1	-93.3	-79.3	0	0	0	115.5
134	D	32.9	Very low	27.6	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	75%	0.748	S	S	*	*			trans	-122.6	115.7	140.2	-174.4	-9	0	0	0	107.8	N136	D134-N136 PolarHBondContact O-N 2.93Å
135	P	28.9	Very low	27.6	Very low	102 Å²	102	140.9 Å²	140.9	66%	0.662	75%	0.748	S	S	*	*			trans	-91.8	61.7	-169.9	37.3	-36.9	0	0	0	113.7
136	N	29.4	Very low	27.7	Very low	126 Å²	126	145.3 Å²	145.3	67%	0.674	76%	0.757	S	S	*	*			trans	-144.5	76.6	174.2	-78.1	-70.7	0	0	0	114.1	D134	D134-N136 PolarHBondContact O-N 2.93Å
137	Q	30.4	Very low	27.8	Very low	175 Å²	175	145 Å²	145	82%	0.818	76%	0.756	S	S	*	*			trans	-153.3	45.6	159.6	-136.1	160.3	103.2	0	0	114.7
138	A	26	Very low	27.9	Very low	102 Å²	102	148.5 Å²	148.5	84%	0.843	75%	0.751	S	S	*	*			trans	-69.8	151.7	149.8	0	0	0	0	0	108.9
139	A	26.4	Very low	28.3	Very low	89 Å²	89	148.2 Å²	148.2	74%	0.736	75%	0.749	S	S	*	*			trans	64.9	73.6	-173.8	0	0	0	0	0	115.8
140	V	28.3	Very low	28.6	Very low	117 Å²	117	141.7 Å²	141.7	71%	0.709	73%	0.731	S	S	*	*				-80	116.3	129.8	-179.4	0	0	0	0	105.6
141	P	25.5	Very low	29.4	Very low	92 Å²	92	138.5 Å²	138.5	60%	0.597	72%	0.724	S	S	*	*			trans	-77.7	171.1	-172.3	32.5	-37.1	0	0	0	112.2	K143	P141-K143 PolarHBondContact O-N 3.32Å
142	N	27.8	Very low	29.9	Very low	139 Å²	139	137.6 Å²	137.6	74%	0.743	73%	0.725	S	S	*	*			trans	-45.1	109.5	158.4	-76.4	-13.9	0	0	0	110.3	F144	N142-F144 HydrophobicContact CB-CB 4.47Å
143	K	28.7	Very low	30.3	Very low	187 Å²	187	141.8 Å²	141.8	81%	0.813	73%	0.733	S	S	*	*			trans	-87.5	14.9	160.1	-80.1	-164.7	171.5	-172.2	0	113.1	P141 K145	P141-K143 PolarHBondContact O-N 3.32Å; K143-K145 PolarHBondContact O-N 3.41Å
144	F	27.9	Very low	30.9	Very low	181 Å²	181	135 Å²	135	79%	0.794	72%	0.719	S	S	*	*			trans	-66.1	73.8	144.9	-78.6	-81.5	0	0	0	110.1	N142	N142-F144 HydrophobicContact CB-CB 4.47Å
145	K	26	Very low	31.2	Very low	183 Å²	183	135.6 Å²	135.6	80%	0.796	72%	0.722	S	S	*	*	S	Bend	trans	-177.5	146.7	154.6	-103.2	154.5	-172	179.1	0	110	K143	K143-K145 PolarHBondContact O-N 3.41Å
146	N	25.9	Very low	31.8	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	73%	0.734	S	S	*	*			trans	72.5	43.9	176.5	-53.5	-0.5	0	0	0	116.9	K148	N146-K148 PolarHBondContact O-N 3.49Å
147	Y	29	Very low	32.6	Very low	240 Å²	240	141 Å²	141	94%	0.941	74%	0.739	S	S	*	*			trans	-78.3	74	132.1	-86.2	-78.9	0	0	0	108.3
148	K	28	Very low	33.8	Very low	147 Å²	147	136.3 Å²	136.3	64%	0.639	72%	0.718	S	S	*	*			trans	-80.9	113.3	158.2	-179	-173.7	174.5	-113.9	0	104.8	N146 D150	N146-K148 PolarHBondContact O-N 3.49Å; K148-D150 IonicContact NZ-OD1 3.9Å; K148-D150 PolarHBondContact NZ-OD1 3.33Å; K148-D150 PolarHBondContact O-N 3.33Å; K148-D150 VanDerWaalsContact O-N 3.13Å
149	L	34.5	Very low	36.1	Very low	132 Å²	132	135 Å²	135	69%	0.691	70%	0.697	S	S	*	*			trans	-60.4	118.3	164.7	-94.2	109.3	0	0	0	107.4	V151	L149-V151 HydrophobicContact CB-CG2 4Å; L149-V151 PolarHBondContact O-N 2.81Å
150	D	34.5	Very low	37.8	Very low	91 Å²	91	137.8 Å²	137.8	49%	0.487	70%	0.699	S	S	.	*			trans	-76.8	79.7	159	-84.2	-30.7	0	0	0	107.5	K148 N152 N153	K148-D150 IonicContact NZ-OD1 3.9Å; K148-D150 PolarHBondContact NZ-OD1 3.33Å; K148-D150 PolarHBondContact O-N 3.33Å; K148-D150 VanDerWaalsContact O-N 3.13Å; D150-N152 PolarHBondContact O-N 2.84Å; D150-N153 PolarHBondContact O-N 2.74Å
151	V	41.8	Very low	39.5	Very low	89 Å²	89	139.5 Å²	139.5	54%	0.539	70%	0.7	S	S	.	*	G	3₁₀ helix	trans	-50.6	-26.3	172.2	-176.7	0	0	0	0	111	L149 N153	L149-V151 HydrophobicContact CB-CG2 4Å; L149-V151 PolarHBondContact O-N 2.81Å; V151-N153 PolarHBondContact O-N 3.27Å; V151-N153 VanDerWaalsContact O-N 3.12Å
152	N	39.5	Very low	41.7	Very low	145 Å²	145	138.8 Å²	138.8	78%	0.775	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-65.4	-3.6	173.8	-57.1	-20.6	0	0	0	115.4	D150	D150-N152 PolarHBondContact O-N 2.84Å
153	N	39.5	Very low	43.6	Very low	150 Å²	150	136.3 Å²	136.3	80%	0.802	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-127.4	5.3	-175.4	-121	3	0	0	0	113.9	D150 V151	D150-N153 PolarHBondContact O-N 2.74Å; V151-N153 PolarHBondContact O-N 3.27Å; V151-N153 VanDerWaalsContact O-N 3.12Å
154	A	37.8	Very low	45.5	Very low	60 Å²	60	131.8 Å²	131.8	50%	0.496	66%	0.659	S	S	.	*	S	Bend	trans	-82.3	153.7	159.5	0	0	0	0	0	109.3
155	N	38.5	Very low	47.4	Very low	148 Å²	148	129.4 Å²	129.4	79%	0.791	65%	0.652	S	S	*	*			trans	-61.8	144.8	-179.4	-72.8	-38	0	0	0	111.4	N157	N155-N157 PolarHBondContact O-N 2.78Å
156	Q	42.8	Very low	49.6	Very low	198 Å²	198	125.7 Å²	125.7	93%	0.925	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	21.5	-170.6	-59.3	-178.1	-58.3	0	0	115.1
157	N	46.7	Very low	51.6	Low	143 Å²	143	124.9 Å²	124.9	77%	0.765	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.5	11.8	-172.8	-74	47.8	0	0	0	113.3	N155	N155-N157 PolarHBondContact O-N 2.78Å
158	M	54	Low	53.7	Low	78 Å²	78	120.5 Å²	120.5	38%	0.384	61%	0.609	S	S	.	*			trans	-77	121.4	166.9	-59.9	-76.1	-68	0	0	108.3	Q162 L163	M158-Q162 HydrophobicContact CE-CB 3.76Å; M158-Q162 HydrophobicContact SD-CB 4.48Å; M158-Q162 PolarHBondContact SD-OE1 3.1Å; M158-L163 HydrophobicContact CB-CD1 4.49Å
159	D	75.1	Confident	55.7	Low	75 Å²	75	116.5 Å²	116.5	40%	0.401	60%	0.6	S	S	.	*			trans	-75.9	177.4	168.7	60.7	57.2	0	0	0	111.8	E161 Q162 L163	D159-E161 VanDerWaalsContact C-N 3.26Å; D159-E161 PolarHBondContact O-N 3.33Å; D159-E161 WeakPolarHBondContact OD1-CA 3.31Å; D159-E161 WeakPolarHBondContact OD1-CB 3.36Å; D159-E161 PolarHBondContact OD1-N 3.37Å; D159-Q162 WeakPolarHBondContact OD1-CG 3.21Å; D159-Q162 PolarHBondContact OD1-N 3.46Å; D159-Q162 PolarHBondContact OD2-NE2 3.03Å; D159-L163 WeakPolarHBondContact O-CB 2.86Å; D159-L163 PolarHBondContact O-N 3.43Å; D159-L163 VanDerWaalsContact O-N 3.16Å
160	N	61.7	Low	57.2	Low	146 Å²	146	115 Å²	115	78%	0.781	59%	0.589	S	S	*	*	H	α-helix	trans	-66.9	-26.7	-178.8	-67.8	-38.4	0	0	0	113.2	L164	N160-L164 VanDerWaalsContact O-CB 3.28Å; N160-L164 WeakPolarHBondContact O-CB 3.13Å; N160-L164 PolarHBondContact O-N 2.98Å
161	E	65.4	Low	59.1	Low	154 Å²	154	114.8 Å²	114.8	72%	0.72	59%	0.586	S	S	*	*	H	α-helix	trans	-80.4	-45.3	-175.2	-170.9	171.9	175.2	0	0	110.3	D159 L163 L164 M165	D159-E161 VanDerWaalsContact C-N 3.26Å; D159-E161 PolarHBondContact O-N 3.33Å; D159-E161 WeakPolarHBondContact OD1-CA 3.31Å; D159-E161 WeakPolarHBondContact OD1-CB 3.36Å; D159-E161 PolarHBondContact OD1-N 3.37Å; E161-L163 VanDerWaalsContact C-N 3.26Å; E161-L163 PolarHBondContact O-N 3.21Å; E161-L164 PolarHBondContact O-N 3.14Å; E161-L164 VanDerWaalsContact O-N 3.17Å; E161-M165 WeakPolarHBondContact O-CB 3.33Å; E161-M165 PolarHBondContact O-N 2.57Å
162	Q	70.5	Confident	60.5	Low	76 Å²	76	115.7 Å²	115.7	36%	0.355	58%	0.581	S	S	.	*	H	α-helix	trans	-56.9	-39.5	167.7	-66	179.3	49	0	0	111.7	M158 D159 L166	M158-Q162 HydrophobicContact CE-CB 3.76Å; M158-Q162 HydrophobicContact SD-CB 4.48Å; M158-Q162 PolarHBondContact SD-OE1 3.1Å; D159-Q162 WeakPolarHBondContact OD1-CG 3.21Å; D159-Q162 PolarHBondContact OD1-N 3.46Å; D159-Q162 PolarHBondContact OD2-NE2 3.03Å; Q162-L166 WeakPolarHBondContact O-CB 3.19Å; Q162-L166 PolarHBondContact O-N 3.47Å; Q162-L166 VanDerWaalsContact O-N 3.08Å
163	L	67	Low	61.9	Low	88 Å²	88	112.7 Å²	112.7	46%	0.461	56%	0.562	S	S	.	*	H	α-helix	trans	-67.1	-39.5	177.3	-149	83	0	0	0	112.3	M158 D159 E161 Y167	M158-L163 HydrophobicContact CB-CD1 4.49Å; D159-L163 WeakPolarHBondContact O-CB 2.86Å; D159-L163 PolarHBondContact O-N 3.43Å; D159-L163 VanDerWaalsContact O-N 3.16Å; E161-L163 VanDerWaalsContact C-N 3.26Å; E161-L163 PolarHBondContact O-N 3.21Å; L163-Y167 PolarHBondContact O-N 3.49Å
164	L	69.5	Low	62.9	Low	91 Å²	91	109.2 Å²	109.2	48%	0.476	54%	0.541	S	S	.	.	H	α-helix	trans	-70.5	-42.7	178.5	-174.6	65	0	0	0	111.8	N160 E161 L166 Y167 Y168	N160-L164 VanDerWaalsContact O-CB 3.28Å; N160-L164 WeakPolarHBondContact O-CB 3.13Å; N160-L164 PolarHBondContact O-N 2.98Å; E161-L164 PolarHBondContact O-N 3.14Å; E161-L164 VanDerWaalsContact O-N 3.17Å; L164-L166 PolarHBondContact O-N 2.66Å; L164-Y167 WeakPolarHBondContact O-CB 3.02Å; L164-Y167 PolarHBondContact O-N 3.38Å; L164-Y168 HydrophobicContact CD1-CD2 4.1Å; L164-Y168 HydrophobicContact CD1-CE2 3.58Å; L164-Y168 HydrophobicContact CD2-CE2 4.15Å; L164-Y168 HydrophobicContact CG-CD2 3.92Å; L164-Y168 HydrophobicContact CG-CE2 3.63Å; L164-Y168 WeakPolarHBondContact O-CD2 3.2Å; L164-Y168 PolarHBondContact O-N 3.43Å
165	M	68.7	Low	64.3	Low	132 Å²	132	112.7 Å²	112.7	65%	0.65	54%	0.542	S	S	*	.	H	α-helix	trans	-62.5	-41.2	175.4	-175.3	174.5	60.5	0	0	111.7	E161 Y167 Y168 S169	E161-M165 WeakPolarHBondContact O-CB 3.33Å; E161-M165 PolarHBondContact O-N 2.57Å; M165-Y167 VanDerWaalsContact C-N 3.3Å; M165-Y167 PolarHBondContact O-N 3.25Å; M165-Y168 PolarHBondContact O-N 3.49Å; M165-S169 WeakPolarHBondContact O-CB 3.15Å; M165-S169 PolarHBondContact O-N 2.73Å
166	L	70.4	Confident	65.8	Low	104 Å²	104	110.9 Å²	110.9	55%	0.545	53%	0.525	S	S	.	.	H	α-helix	trans	-63.6	-35.9	174.8	-154.5	92.4	0	0	0	112.1	Q162 L164 H170	Q162-L166 WeakPolarHBondContact O-CB 3.19Å; Q162-L166 PolarHBondContact O-N 3.47Å; Q162-L166 VanDerWaalsContact O-N 3.08Å; L164-L166 PolarHBondContact O-N 2.66Å; L166-H170 PolarHBondContact O-N 2.71Å
167	Y	69.6	Low	66.7	Low	135 Å²	135	108.5 Å²	108.5	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-67.1	-50.2	176.3	175.3	-95.8	0	0	0	112	L163 L164 M165 H170 M171	L163-Y167 PolarHBondContact O-N 3.49Å; L164-Y167 WeakPolarHBondContact O-CB 3.02Å; L164-Y167 PolarHBondContact O-N 3.38Å; M165-Y167 VanDerWaalsContact C-N 3.3Å; M165-Y167 PolarHBondContact O-N 3.25Å; Y167-H170 PolarHBondContact O-N 2.88Å; Y167-M171 HydrophobicContact CD1-CG 4.45Å; Y167-M171 HydrophobicContact CE1-CG 4.07Å; Y167-M171 WeakPolarHBondContact O-CG 3.46Å; Y167-M171 PolarHBondContact O-N 2.87Å
168	Y	73.2	Confident	67.6	Low	148 Å²	148	105.7 Å²	105.7	58%	0.58	50%	0.496	S	S	*	.	H	α-helix	trans	-63.6	-42.1	178.4	-77	-58.9	0	0	0	112.7	L164 M165 H170 M171 Y172	L164-Y168 HydrophobicContact CD1-CD2 4.1Å; L164-Y168 HydrophobicContact CD1-CE2 3.58Å; L164-Y168 HydrophobicContact CD2-CE2 4.15Å; L164-Y168 HydrophobicContact CG-CD2 3.92Å; L164-Y168 HydrophobicContact CG-CE2 3.63Å; L164-Y168 WeakPolarHBondContact O-CD2 3.2Å; L164-Y168 PolarHBondContact O-N 3.43Å; M165-Y168 PolarHBondContact O-N 3.49Å; Y168-H170 VanDerWaalsContact C-N 3.29Å; Y168-H170 PolarHBondContact O-N 2.8Å; Y168-M171 PolarHBondContact O-N 2.86Å; Y168-M171 VanDerWaalsContact O-N 3.11Å; Y168-Y172 PolarHBondContact O-N 3.03Å
169	S	69.4	Low	68.2	Low	63 Å²	63	108 Å²	108	44%	0.441	50%	0.501	S	S	.	.	H	α-helix	trans	-56.8	-42.3	175.3	-176.2	0	0	0	0	112.1	M165 Q173	M165-S169 WeakPolarHBondContact O-CB 3.15Å; M165-S169 PolarHBondContact O-N 2.73Å; S169-Q173 WeakPolarHBondContact O-CG 3.1Å; S169-Q173 PolarHBondContact O-N 3.05Å
170	H	65.7	Low	67.7	Low	101 Å²	101	107.2 Å²	107.2	47%	0.468	50%	0.499	S	S	.	.	H	α-helix	trans	-66.6	-41.7	175.1	178.2	-96.5	0	0	0	112.6	L166 Y167 Y168 Q173 Q174	L166-H170 PolarHBondContact O-N 2.71Å; Y167-H170 PolarHBondContact O-N 2.88Å; Y168-H170 VanDerWaalsContact C-N 3.29Å; Y168-H170 PolarHBondContact O-N 2.8Å; H170-Q173 PolarHBondContact O-N 2.6Å; H170-Q174 PolarHBondContact CE1-NE2 3.39Å; H170-Q174 PolarHBondContact NE2-NE2 3.46Å; H170-Q174 WeakPolarHBondContact O-CG 3.16Å; H170-Q174 PolarHBondContact O-N 2.79Å; H170-Q174 VanDerWaalsContact O-N 3.16Å
171	M	74.8	Confident	67.6	Low	86 Å²	86	102.7 Å²	102.7	42%	0.424	48%	0.482	S	S	.	.	H	α-helix	trans	-60	-46.6	176.6	-72.7	-64.8	-71.5	0	0	111.8	Y167 Y168 Q173 Q174 Y175	Y167-M171 HydrophobicContact CD1-CG 4.45Å; Y167-M171 HydrophobicContact CE1-CG 4.07Å; Y167-M171 WeakPolarHBondContact O-CG 3.46Å; Y167-M171 PolarHBondContact O-N 2.87Å; Y168-M171 PolarHBondContact O-N 2.86Å; Y168-M171 VanDerWaalsContact O-N 3.11Å; M171-Q173 VanDerWaalsContact C-N 3.35Å; M171-Q173 PolarHBondContact O-N 3.43Å; M171-Q174 PolarHBondContact O-N 3.43Å; M171-Q174 VanDerWaalsContact O-N 3.11Å; M171-Y175 PolarHBondContact O-N 2.7Å
172	Y	70.2	Confident	67.6	Low	108 Å²	108	98.7 Å²	98.7	42%	0.424	47%	0.468	S	S	.	.	H	α-helix	trans	-60.3	-42.7	178.7	-160.7	-85	0	0	0	112	Y168 Q174 Y175 Y176	Y168-Y172 PolarHBondContact O-N 3.03Å; Y172-Q174 VanDerWaalsContact C-N 3.33Å; Y172-Q174 PolarHBondContact O-N 3.34Å; Y172-Y175 PolarHBondContact O-N 2.84Å; Y172-Y176 AromaticContact CE1-CD2 3.88Å; Y172-Y176 HydrophobicContact CE1-CD2 3.88Å; Y172-Y176 HydrophobicContact CE1-CE2 4.46Å; Y172-Y176 PolarHBondContact O-N 2.9Å
173	Q	69.5	Low	67.2	Low	82 Å²	82	97.3 Å²	97.3	38%	0.383	47%	0.47	S	S	.	.	H	α-helix	trans	-62.4	-35	175.2	-72.5	-175.9	33.9	0	0	113.4	S169 H170 M171 R177	S169-Q173 WeakPolarHBondContact O-CG 3.1Å; S169-Q173 PolarHBondContact O-N 3.05Å; H170-Q173 PolarHBondContact O-N 2.6Å; M171-Q173 VanDerWaalsContact C-N 3.35Å; M171-Q173 PolarHBondContact O-N 3.43Å; Q173-R177 WeakPolarHBondContact O-CB 2.95Å; Q173-R177 WeakPolarHBondContact O-CD 3.24Å; Q173-R177 WeakPolarHBondContact O-CG 3.28Å; Q173-R177 PolarHBondContact O-N 3.32Å
174	Q	60.2	Low	67	Low	78 Å²	78	98.8 Å²	98.8	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-73	-40.7	176.3	-62.7	-65.3	-10.4	0	0	111.6	H170 M171 Y172 T178	H170-Q174 PolarHBondContact CE1-NE2 3.39Å; H170-Q174 PolarHBondContact NE2-NE2 3.46Å; H170-Q174 WeakPolarHBondContact O-CG 3.16Å; H170-Q174 PolarHBondContact O-N 2.79Å; H170-Q174 VanDerWaalsContact O-N 3.16Å; M171-Q174 PolarHBondContact O-N 3.43Å; M171-Q174 VanDerWaalsContact O-N 3.11Å; Y172-Q174 VanDerWaalsContact C-N 3.33Å; Y172-Q174 PolarHBondContact O-N 3.34Å; Q174-T178 WeakPolarHBondContact O-CB 3.11Å; Q174-T178 PolarHBondContact O-N 2.83Å; Q174-T178 PolarHBondContact O-OG1 2.92Å
175	Y	68.5	Low	66.1	Low	132 Å²	132	98 Å²	98	52%	0.518	48%	0.48	S	S	.	.	H	α-helix	trans	-59.2	-53.6	175.5	-179	-105.7	0	0	0	111.1	M171 Y172 R177 T178 Y179	M171-Y175 PolarHBondContact O-N 2.7Å; Y172-Y175 PolarHBondContact O-N 2.84Å; Y175-R177 VanDerWaalsContact C-N 3.33Å; Y175-R177 PolarHBondContact O-N 3.47Å; Y175-T178 PolarHBondContact O-N 2.75Å; Y175-Y179 PolarHBondContact O-N 2.85Å
176	Y	68	Low	65.3	Low	111 Å²	111	96.6 Å²	96.6	44%	0.435	47%	0.474	S	S	.	.	H	α-helix	trans	-62.9	-37.2	-177.3	-141	-78.3	0	0	0	112.8	Y172 T180	Y172-Y176 AromaticContact CE1-CD2 3.88Å; Y172-Y176 HydrophobicContact CE1-CD2 3.88Å; Y172-Y176 HydrophobicContact CE1-CE2 4.46Å; Y172-Y176 PolarHBondContact O-N 2.9Å; Y176-T180 HydrophobicContact CD1-CG2 3.96Å; Y176-T180 HydrophobicContact CE1-CG2 4.07Å; Y176-T180 WeakPolarHBondContact O-CB 3.18Å; Y176-T180 WeakPolarHBondContact O-CG2 2.84Å; Y176-T180 PolarHBondContact O-N 2.69Å; Y176-T180 PolarHBondContact O-OG1 2.85Å
177	R	63.4	Low	64.2	Low	147 Å²	147	95.7 Å²	95.7	56%	0.555	48%	0.476	S	S	*	.	H	α-helix	trans	-66.2	-36.8	173.1	-75.2	173.5	-178.2	-176.7	4.6	112.7	Q173 Y175 T180 A181	Q173-R177 WeakPolarHBondContact O-CB 2.95Å; Q173-R177 WeakPolarHBondContact O-CD 3.24Å; Q173-R177 WeakPolarHBondContact O-CG 3.28Å; Q173-R177 PolarHBondContact O-N 3.32Å; Y175-R177 VanDerWaalsContact C-N 3.33Å; Y175-R177 PolarHBondContact O-N 3.47Å; R177-T180 WeakPolarHBondContact CA-OG1 2.94Å; R177-T180 PolarHBondContact O-OG1 3.39Å; R177-A181 WeakPolarHBondContact O-CB 3.35Å; R177-A181 PolarHBondContact O-N 3.32Å
178	T	64.9	Low	63.1	Low	84 Å²	84	95.3 Å²	95.3	52%	0.515	48%	0.484	S	S	.	.	H	α-helix	trans	-74	-41.8	179.1	-53.8	0	0	0	0	110.9	Q174 Y175 T182	Q174-T178 WeakPolarHBondContact O-CB 3.11Å; Q174-T178 PolarHBondContact O-N 2.83Å; Q174-T178 PolarHBondContact O-OG1 2.92Å; Y175-T178 PolarHBondContact O-N 2.75Å; T178-T182 WeakPolarHBondContact O-CB 3.49Å; T178-T182 PolarHBondContact O-N 2.79Å; T178-T182 PolarHBondContact O-OG1 2.79Å
179	Y	66.2	Low	61.6	Low	128 Å²	128	96.9 Å²	96.9	50%	0.502	49%	0.49	S	S	.	.	H	α-helix	trans	-60.7	-51.3	174.8	-173.1	-93.3	0	0	0	111.6	Y175 A181 T182 A183	Y175-Y179 PolarHBondContact O-N 2.85Å; Y179-A181 PolarHBondContact O-N 3.15Å; Y179-T182 PolarHBondContact O-N 3.48Å; Y179-T182 VanDerWaalsContact O-N 3.13Å; Y179-A183 PolarHBondContact O-N 2.97Å
180	T	65.5	Low	60.6	Low	57 Å²	57	98.9 Å²	98.9	35%	0.35	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-40.8	178.2	49.4	0	0	0	0	112.9	Y176 R177 T182 A183 L184	Y176-T180 HydrophobicContact CD1-CG2 3.96Å; Y176-T180 HydrophobicContact CE1-CG2 4.07Å; Y176-T180 WeakPolarHBondContact O-CB 3.18Å; Y176-T180 WeakPolarHBondContact O-CG2 2.84Å; Y176-T180 PolarHBondContact O-N 2.69Å; Y176-T180 PolarHBondContact O-OG1 2.85Å; R177-T180 WeakPolarHBondContact CA-OG1 2.94Å; R177-T180 PolarHBondContact O-OG1 3.39Å; T180-T182 VanDerWaalsContact C-N 3.29Å; T180-T182 PolarHBondContact O-N 2.79Å; T180-A183 PolarHBondContact O-N 3.05Å; T180-L184 WeakPolarHBondContact O-CB 3.22Å; T180-L184 VanDerWaalsContact O-CG 3.29Å; T180-L184 WeakPolarHBondContact O-CG 3.18Å; T180-L184 PolarHBondContact O-N 2.86Å
181	A	59.5	Low	59.7	Low	51 Å²	51	100 Å²	100	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-34.9	173.3	0	0	0	0	0	112.7	R177 Y179 S185	R177-A181 WeakPolarHBondContact O-CB 3.35Å; R177-A181 PolarHBondContact O-N 3.32Å; Y179-A181 PolarHBondContact O-N 3.15Å; A181-S185 WeakPolarHBondContact O-CB 3.47Å; A181-S185 PolarHBondContact O-N 2.8Å; A181-S185 PolarHBondContact O-OG 2.67Å
182	T	64.4	Low	58.4	Low	70 Å²	70	98.7 Å²	98.7	43%	0.429	51%	0.514	S	S	.	.	H	α-helix	trans	-71.7	-46.2	176.7	-56.7	0	0	0	0	111.1	T178 Y179 T180 L184 S185 L186	T178-T182 WeakPolarHBondContact O-CB 3.49Å; T178-T182 PolarHBondContact O-N 2.79Å; T178-T182 PolarHBondContact O-OG1 2.79Å; Y179-T182 PolarHBondContact O-N 3.48Å; Y179-T182 VanDerWaalsContact O-N 3.13Å; T180-T182 VanDerWaalsContact C-N 3.29Å; T180-T182 PolarHBondContact O-N 2.79Å; T182-L184 VanDerWaalsContact C-N 3.35Å; T182-L184 PolarHBondContact O-N 2.93Å; T182-S185 WeakPolarHBondContact O-CB 3.48Å; T182-S185 PolarHBondContact O-N 2.85Å; T182-S185 VanDerWaalsContact O-N 3.08Å; T182-L186 HydrophobicContact CG2-CD1 4.05Å; T182-L186 HydrophobicContact CG2-CG 4.4Å; T182-L186 WeakPolarHBondContact O-CG 3.48Å; T182-L186 PolarHBondContact O-N 2.63Å
183	A	61.6	Low	57.5	Low	48 Å²	48	100.6 Å²	100.6	40%	0.397	53%	0.531	S	S	.	.	H	α-helix	trans	-58.7	-43.5	174.8	0	0	0	0	0	112.2	Y179 T180 S185 L186 S187	Y179-A183 PolarHBondContact O-N 2.97Å; T180-A183 PolarHBondContact O-N 3.05Å; A183-S185 VanDerWaalsContact C-N 3.35Å; A183-S185 PolarHBondContact O-N 2.97Å; A183-L186 PolarHBondContact O-N 2.8Å; A183-S187 WeakPolarHBondContact O-CB 3.3Å; A183-S187 PolarHBondContact O-N 3.36Å
184	L	63.1	Low	56.5	Low	119 Å²	119	101.9 Å²	101.9	62%	0.623	54%	0.54	S	S	*	.	H	α-helix	trans	-62.9	-39.2	173.1	-72.7	169.8	0	0	0	112.1	T180 T182 S187 N188	T180-L184 WeakPolarHBondContact O-CB 3.22Å; T180-L184 VanDerWaalsContact O-CG 3.29Å; T180-L184 WeakPolarHBondContact O-CG 3.18Å; T180-L184 PolarHBondContact O-N 2.86Å; T182-L184 VanDerWaalsContact C-N 3.35Å; T182-L184 PolarHBondContact O-N 2.93Å; L184-S187 PolarHBondContact O-N 2.84Å; L184-S187 PolarHBondContact O-OG 3.44Å; L184-N188 PolarHBondContact O-ND2 2.87Å
185	S	52.4	Low	55.8	Low	74 Å²	74	103.1 Å²	103.1	52%	0.517	55%	0.548	S	S	.	.	H	α-helix	trans	-66.9	-42	176.4	-60.4	0	0	0	0	112.3	A181 T182 A183 S187 N188	A181-S185 WeakPolarHBondContact O-CB 3.47Å; A181-S185 PolarHBondContact O-N 2.8Å; A181-S185 PolarHBondContact O-OG 2.67Å; T182-S185 WeakPolarHBondContact O-CB 3.48Å; T182-S185 PolarHBondContact O-N 2.85Å; T182-S185 VanDerWaalsContact O-N 3.08Å; A183-S185 VanDerWaalsContact C-N 3.35Å; A183-S185 PolarHBondContact O-N 2.97Å; S185-S187 VanDerWaalsContact C-N 3.35Å; S185-N188 PolarHBondContact O-N 2.74Å
186	L	50.2	Low	54.8	Low	103 Å²	103	101.7 Å²	101.7	54%	0.539	56%	0.555	S	S	.	*	H	α-helix	trans	-65	-36.6	176	-70.4	169.7	0	0	0	112	T182 A183 N188 Y189	T182-L186 HydrophobicContact CG2-CD1 4.05Å; T182-L186 HydrophobicContact CG2-CG 4.4Å; T182-L186 WeakPolarHBondContact O-CG 3.48Å; T182-L186 PolarHBondContact O-N 2.63Å; A183-L186 PolarHBondContact O-N 2.8Å; L186-N188 PolarHBondContact O-N 3.29Å; L186-Y189 PolarHBondContact O-N 3.44Å; L186-Y189 VanDerWaalsContact O-N 3.1Å
187	S	48.5	Very low	53.7	Low	84 Å²	84	99.3 Å²	99.3	59%	0.587	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-11.9	178.9	78.6	0	0	0	0	115	A183 L184 S185	A183-S187 WeakPolarHBondContact O-CB 3.3Å; A183-S187 PolarHBondContact O-N 3.36Å; L184-S187 PolarHBondContact O-N 2.84Å; L184-S187 PolarHBondContact O-OG 3.44Å; S185-S187 VanDerWaalsContact C-N 3.35Å
188	N	45.5	Very low	52.8	Low	128 Å²	128	96.6 Å²	96.6	68%	0.684	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-2.8	178.6	-75.9	-81.3	0	0	0	114.4	L184 S185 L186	L184-N188 PolarHBondContact O-ND2 2.87Å; S185-N188 PolarHBondContact O-N 2.74Å; L186-N188 PolarHBondContact O-N 3.29Å
189	Y	42.8	Very low	51.7	Low	181 Å²	181	95.6 Å²	95.6	71%	0.71	56%	0.558	S	S	*	*			trans	-96.5	119.9	-179.4	-79.2	-84.4	0	0	0	112.7	L186 N191	L186-Y189 PolarHBondContact O-N 3.44Å; L186-Y189 VanDerWaalsContact O-N 3.1Å; Y189-N191 VanDerWaalsContact C-N 3.3Å; Y189-N191 PolarHBondContact O-N 2.97Å
190	P	47.7	Very low	50.6	Low	104 Å²	104	92 Å²	92	68%	0.675	56%	0.555	S	S	*	*	S	Bend	trans	-72.2	-7.8	-173.4	-22.9	35.2	0	0	0	117.6
191	N	47.4	Very low	49.4	Very low	125 Å²	125	92.1 Å²	92.1	67%	0.668	56%	0.562	S	S	*	*			trans	-129	85.1	-169.5	-63.4	-5.2	0	0	0	110.4	Y189	Y189-N191 VanDerWaalsContact C-N 3.3Å; Y189-N191 PolarHBondContact O-N 2.97Å
192	A	47.6	Very low	48.5	Very low	59 Å²	59	93.3 Å²	93.3	49%	0.488	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-77.7	-19.9	-177.4	0	0	0	0	0	113.9	L194 L195	A192-L194 PolarHBondContact O-N 2.86Å; A192-L195 HydrophobicContact CB-CD1 4.29Å; A192-L195 WeakPolarHBondContact O-CB 3.45Å; A192-L195 WeakPolarHBondContact O-CD1 3.34Å; A192-L195 VanDerWaalsContact O-CG 3.31Å; A192-L195 WeakPolarHBondContact O-CG 3.25Å; A192-L195 PolarHBondContact O-N 2.85Å; A192-L195 VanDerWaalsContact O-N 3.1Å
193	D	50.9	Low	47.3	Very low	147 Å²	147	94 Å²	94	79%	0.786	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-70.1	-0.2	-166.8	-46.3	-51.6	0	0	0	115.1
194	L	49.1	Very low	46.4	Very low	109 Å²	109	97.8 Å²	97.8	57%	0.571	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-103.3	0.2	176.2	-69	172.5	0	0	0	113.8	A192 A197 V198	A192-L194 PolarHBondContact O-N 2.86Å; L194-A197 PolarHBondContact O-N 3.36Å; L194-A197 VanDerWaalsContact O-N 3.08Å; L194-V198 HydrophobicContact CB-CG2 4.27Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.05Å
195	L	45.1	Very low	45	Very low	104 Å²	104	98.6 Å²	98.6	55%	0.545	60%	0.603	S	S	.	*	H	α-helix	trans	-52.9	-45.2	-174	-82.5	165.1	0	0	0	114.7	A192 A197 V198 A199	A192-L195 HydrophobicContact CB-CD1 4.29Å; A192-L195 WeakPolarHBondContact O-CB 3.45Å; A192-L195 WeakPolarHBondContact O-CD1 3.34Å; A192-L195 VanDerWaalsContact O-CG 3.31Å; A192-L195 WeakPolarHBondContact O-CG 3.25Å; A192-L195 PolarHBondContact O-N 2.85Å; A192-L195 VanDerWaalsContact O-N 3.1Å; L195-A197 VanDerWaalsContact C-N 3.35Å; L195-A197 PolarHBondContact O-N 2.99Å; L195-V198 PolarHBondContact O-N 3.06Å; L195-A199 WeakPolarHBondContact O-CB 3.44Å; L195-A199 PolarHBondContact O-N 3.39Å
196	P	46.7	Very low	44.1	Very low	102 Å²	102	100.7 Å²	100.7	66%	0.662	62%	0.618	S	S	*	*	H	α-helix	trans	-62.1	-39.6	177	-23.8	34.8	0	0	0	113.2	A200	P196-A200 VanDerWaalsContact O-CB 3.3Å; P196-A200 WeakPolarHBondContact O-CB 3.43Å; P196-A200 PolarHBondContact O-N 3.33Å
197	A	45.4	Very low	43.3	Very low	61 Å²	61	99.5 Å²	99.5	50%	0.504	63%	0.63	S	S	.	*	H	α-helix	trans	-71.8	-36.6	179.9	0	0	0	0	0	112.3	L194 L195 A201	L194-A197 PolarHBondContact O-N 3.36Å; L194-A197 VanDerWaalsContact O-N 3.08Å; L195-A197 VanDerWaalsContact C-N 3.35Å; L195-A197 PolarHBondContact O-N 2.99Å; A197-A201 VanDerWaalsContact O-CB 3.31Å; A197-A201 WeakPolarHBondContact O-CB 3.25Å; A197-A201 PolarHBondContact O-N 2.99Å
198	V	43.6	Very low	42.4	Very low	91 Å²	91	103.3 Å²	103.3	55%	0.552	64%	0.642	S	S	*	*	H	α-helix	trans	-72.3	-38.9	176.5	176.2	0	0	0	0	111.2	L194 L195 A201 A202	L194-V198 HydrophobicContact CB-CG2 4.27Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.05Å; L195-V198 PolarHBondContact O-N 3.06Å; V198-A201 PolarHBondContact O-N 3.01Å; V198-A202 WeakPolarHBondContact O-CB 3.15Å; V198-A202 PolarHBondContact O-N 2.74Å
199	A	43	Very low	41.7	Very low	62 Å²	62	101.9 Å²	101.9	51%	0.512	64%	0.64	S	S	.	*	H	α-helix	trans	-62.2	-47.6	172.4	0	0	0	0	0	111.5	L195 A201 A202 A203	L195-A199 WeakPolarHBondContact O-CB 3.44Å; L195-A199 PolarHBondContact O-N 3.39Å; A199-A201 VanDerWaalsContact C-N 3.31Å; A199-A201 PolarHBondContact O-N 3.5Å; A199-A202 PolarHBondContact O-N 3.23Å; A199-A203 WeakPolarHBondContact O-CB 3.47Å; A199-A203 PolarHBondContact O-N 3.12Å
200	A	42.9	Very low	40.9	Very low	53 Å²	53	96.9 Å²	96.9	44%	0.438	63%	0.631	S	S	.	*	H	α-helix	trans	-62.1	-35	175.8	0	0	0	0	0	113.1	P196 N204	P196-A200 VanDerWaalsContact O-CB 3.3Å; P196-A200 WeakPolarHBondContact O-CB 3.43Å; P196-A200 PolarHBondContact O-N 3.33Å; A200-N204 PolarHBondContact O-ND2 3.38Å
201	A	39.2	Very low	40.1	Very low	59 Å²	59	98 Å²	98	49%	0.488	63%	0.632	S	S	.	*	H	α-helix	trans	-72	-34.7	175.3	0	0	0	0	0	113.1	A197 V198 A199 N205	A197-A201 VanDerWaalsContact O-CB 3.31Å; A197-A201 WeakPolarHBondContact O-CB 3.25Å; A197-A201 PolarHBondContact O-N 2.99Å; V198-A201 PolarHBondContact O-N 3.01Å; A199-A201 VanDerWaalsContact C-N 3.31Å; A199-A201 PolarHBondContact O-N 3.5Å; A201-N205 PolarHBondContact O-ND2 2.67Å
202	A	41.2	Very low	39.3	Very low	77 Å²	77	99 Å²	99	64%	0.636	64%	0.637	S	S	*	*	H	α-helix	trans	-73.1	-40.1	177.9	0	0	0	0	0	112.5	V198 A199 N204	V198-A202 WeakPolarHBondContact O-CB 3.15Å; V198-A202 PolarHBondContact O-N 2.74Å; A199-A202 PolarHBondContact O-N 3.23Å; A202-N204 PolarHBondContact O-N 2.93Å
203	A	40.3	Very low	38.3	Very low	83 Å²	83	101.6 Å²	101.6	69%	0.686	65%	0.646	S	S	*	*	H	α-helix	trans	-68.3	-16	-179.1	0	0	0	0	0	114.6	A199	A199-A203 WeakPolarHBondContact O-CB 3.47Å; A199-A203 PolarHBondContact O-N 3.12Å
204	N	41	Very low	37.3	Very low	129 Å²	129	99.5 Å²	99.5	69%	0.69	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	17	-171.2	-81.6	-68.9	0	0	0	115	A200 A202	A200-N204 PolarHBondContact O-ND2 3.38Å; A202-N204 PolarHBondContact O-N 2.93Å
205	N	34.5	Very low	36.2	Very low	135 Å²	135	99.5 Å²	99.5	72%	0.722	64%	0.643	S	S	*	*			trans	-133.9	74.1	-171.1	-81.9	-74.4	0	0	0	115.7	A201	A201-N205 PolarHBondContact O-ND2 2.67Å
206	S	33.7	Very low	35.4	Very low	119 Å²	119	97 Å²	97	83%	0.832	64%	0.642	S	S	*	*			trans	-132.4	63.9	168.3	49.3	0	0	0	0	112.3
207	G	32.9	Very low	34.5	Very low	77 Å²	77	95.6 Å²	95.6	79%	0.794	63%	0.634	S	S	*	*			trans	-168.6	88.7	-178.7	0	0	0	0	0	116.3
208	I	29.9	Very low	33.6	Very low	164 Å²	164	97 Å²	97	84%	0.841	64%	0.636	S	S	*	*			trans	-95.2	133.7	174.4	-58.2	171	0	0	0	106.8
209	P	30.4	Very low	32.8	Very low	99 Å²	99	97.4 Å²	97.4	64%	0.643	64%	0.635	S	S	*	*				-158.9	170	66.5	45.4	-24.7	0	0	0	120.4
210	S	27.3	Very low	32	Very low	75 Å²	75	97.4 Å²	97.4	52%	0.524	63%	0.632	S	S	.	*			trans	30.9	120.9	144.7	64.8	0	0	0	0	119.4
211	D	29.4	Very low	31.3	Very low	128 Å²	128	98.9 Å²	98.9	68%	0.684	64%	0.638	S	S	*	*				-177.3	167.7	68.8	-102.3	-34.5	0	0	0	112.2	T1053	D211-T1053 HydrophobicContact CB-CG2 4.08Å
212	L	30.3	Very low	30.8	Very low	147 Å²	147	99.8 Å²	99.8	77%	0.77	65%	0.653	S	S	*	*			trans	63.5	152.6	168.3	-61.4	172.7	0	0	0	117.4
213	T	27.3	Very low	30.2	Very low	112 Å²	112	104 Å²	104	69%	0.687	67%	0.666	S	S	*	*			cis	-173.4	166.7	-48.7	24.8	0	0	0	0	105.8
214	S	29.1	Very low	29.5	Very low	103 Å²	103	104.9 Å²	104.9	72%	0.72	67%	0.666	S	S	*	*			trans	75.8	123.3	-178	-52	0	0	0	0	113.6
215	I	27.6	Very low	28.8	Very low	110 Å²	110	107.4 Å²	107.4	56%	0.564	67%	0.671	S	S	*	*			cis	66.7	122	48.2	-48.2	161.7	0	0	0	110.6
216	G	27.4	Very low	28.4	Very low	52 Å²	52	106.9 Å²	106.9	54%	0.536	67%	0.669	S	S	.	*			cis	158.1	148.6	-5.9	0	0	0	0	0	112.3
217	S	27.6	Very low	28.1	Very low	71 Å²	71	109 Å²	109	50%	0.497	66%	0.663	S	S	.	*			trans	67	116.9	172.2	-60.1	0	0	0	0	119
218	V	26.3	Very low	27.8	Very low	90 Å²	90	109.3 Å²	109.3	55%	0.545	65%	0.653	S	S	.	*				45.2	109.2	129.7	-158.8	0	0	0	0	119.9	P904	V218-P904 VanDerWaalsContact CG1-O 3.24Å; V218-P904 WeakPolarHBondContact CG1-O 3.16Å; V218-P904 WeakPolarHBondContact O-CD 3.44Å; V218-P904 VanDerWaalsContact O-CG 3.28Å; V218-P904 WeakPolarHBondContact O-CG 3.45Å
219	L	26.6	Very low	27.8	Very low	100 Å²	100	106.5 Å²	106.5	52%	0.524	64%	0.635	S	S	.	*			trans	73.7	122	144.7	-77	158.6	0	0	0	124	P904 N905	L219-P904 HydrophobicContact CB-CG 4.48Å; L219-N905 HydrophobicContact CD1-CB 3.72Å
220	S	27.5	Very low	27.8	Very low	63 Å²	63	110 Å²	110	44%	0.441	64%	0.642	S	S	.	*				98.2	138.1	128.4	-157.4	0	0	0	0	121.5	Q906 S907	S220-Q906 WeakPolarHBondContact CB-O 3.39Å; S220-Q906 PolarHBondContact OG-O 2.96Å; S220-S907 PolarHBondContact OG-N 2.8Å
221	S	28.5	Very low	27.9	Very low	83 Å²	83	111.2 Å²	111.2	58%	0.58	65%	0.651	S	S	*	*			trans	48.5	122.9	143.7	56.3	0	0	0	0	120.7	S907	S221-S907 WeakPolarHBondContact CB-O 3.41Å; S221-S907 PolarHBondContact OG-N 3.25Å; S221-S907 PolarHBondContact OG-O 2.67Å
222	G	28	Very low	27.9	Very low	78 Å²	78	116 Å²	116	80%	0.804	66%	0.659	S	S	*	*			trans	152.1	109.8	154.9	0	0	0	0	0	114.4
223	N	28.5	Very low	27.8	Very low	167 Å²	167	115.6 Å²	115.6	89%	0.893	66%	0.658	S	S	*	*			trans	-64.4	152.6	164.3	-59	-17.5	0	0	0	110.1
224	S	26.4	Very low	27.9	Very low	100 Å²	100	115.9 Å²	115.9	70%	0.699	66%	0.659	S	S	*	*				162.2	113.1	117.4	-175.1	0	0	0	0	114.2
225	F	25.5	Very low	27.9	Very low	182 Å²	182	117 Å²	117	80%	0.798	66%	0.657	S	S	*	*			trans	62.7	141.2	143.5	-77.5	-104.4	0	0	0	123.9
226	D	27	Very low	28.1	Very low	125 Å²	125	116.7 Å²	116.7	67%	0.668	66%	0.656	S	S	*	*			trans	62.1	116.4	148.8	-64.6	-22.6	0	0	0	125.3
227	F	26.7	Very low	28.1	Very low	163 Å²	163	123.1 Å²	123.1	72%	0.715	66%	0.664	S	S	*	*				29.3	148.9	102.3	-70	-72.6	0	0	0	120
228	S	27.6	Very low	28.2	Very low	83 Å²	83	123 Å²	123	58%	0.58	67%	0.673	S	S	*	*			cis	-162.6	160.4	13	-141.8	0	0	0	0	115.3
229	K	28.3	Very low	28.5	Very low	105 Å²	105	130 Å²	130	46%	0.457	69%	0.69	S	S	.	*			trans	54.8	163.9	148.7	-77.2	179.3	177.5	-177.2	0	121.4	D1061	K229-D1061 IonicContact NZ-OD1 2.87Å; K229-D1061 PolarHBondContact NZ-OD1 2.74Å; K229-D1061 VanDerWaalsContact NZ-OD1 3.14Å; K229-D1061 IonicContact NZ-OD2 3.92Å; K229-D1061 PolarHBondContact NZ-OD2 3.27Å
230	H	31.7	Very low	28.6	Very low	173 Å²	173	135.8 Å²	135.8	80%	0.801	71%	0.705	S	S	*	*			trans	70.9	123.2	178.4	-54.7	-70.5	0	0	0	117.7
231	S	27.8	Very low	28.9	Very low	101 Å²	101	137.5 Å²	137.5	71%	0.706	72%	0.715	S	S	*	*			cis	90.3	144.2	22.1	-164.6	0	0	0	0	116
232	R	31.1	Very low	28.9	Very low	227 Å²	227	142.8 Å²	142.8	86%	0.857	73%	0.727	S	S	*	*			trans	98.4	142.9	-169.4	-63.1	164.1	-176.5	170.3	3	114.4
233	D	27	Very low	28.8	Very low	140 Å²	140	146 Å²	146	75%	0.749	72%	0.719	S	S	*	*			cis	160	178.4	-23.1	-106.7	-52.3	0	0	0	106.4
234	V	29.9	Very low	28.6	Very low	117 Å²	117	145.7 Å²	145.7	71%	0.709	71%	0.706	S	S	*	*			trans	77.2	98.3	171.9	-168.3	0	0	0	0	113.5	I236	V234-I236 HydrophobicContact CG1-CD1 4.21Å; V234-I236 HydrophobicContact CG1-CG1 4.24Å
235	D	28.2	Very low	28.6	Very low	126 Å²	126	147.2 Å²	147.2	67%	0.674	70%	0.702	S	S	*	*				79.2	165.8	62.3	-171.9	35	0	0	0	113.6	R237	D235-R237 IonicContact OD2-CZ 3.5Å; D235-R237 IonicContact OD2-NE 2.67Å; D235-R237 IonicContact OD2-NH2 3.78Å; D235-R237 PolarHBondContact OD2-NH2 2.81Å
236	I	32.2	Very low	28.6	Very low	104 Å²	104	145.4 Å²	145.4	53%	0.533	69%	0.694	S	S	.	*			trans	103.8	78.6	155.6	-49.4	-168.7	0	0	0	118.1	V234	V234-I236 HydrophobicContact CG1-CD1 4.21Å; V234-I236 HydrophobicContact CG1-CG1 4.24Å
237	R	28.6	Very low	28.5	Very low	188 Å²	188	144.9 Å²	144.9	71%	0.709	69%	0.687	S	S	*	*				63.6	78.3	118.7	-60.4	161.4	-130.7	168.6	3.1	121.5	D235	D235-R237 IonicContact OD2-CZ 3.5Å; D235-R237 IonicContact OD2-NE 2.67Å; D235-R237 IonicContact OD2-NH2 3.78Å; D235-R237 PolarHBondContact OD2-NH2 2.81Å
238	G	29.6	Very low	28.4	Very low	67 Å²	67	144 Å²	144	69%	0.691	69%	0.685	S	S	*	*				71.2	-148	115.4	0	0	0	0	0	121.9
239	R	31.6	Very low	28.4	Very low	239 Å²	239	145.2 Å²	145.2	90%	0.902	69%	0.694	S	S	*	*			trans	66.8	70.5	-179	-60.8	-168	-178.5	-143.2	1.2	119.9
240	R	28.6	Very low	28.4	Very low	220 Å²	220	144.2 Å²	144.2	83%	0.83	70%	0.7	S	S	*	*				-3.7	155.7	110.8	-143.5	-162.8	-162.7	-170.8	8.8	115.6
241	P	33.5	Very low	28.2	Very low	100 Å²	100	143 Å²	143	65%	0.649	70%	0.699	S	S	*	*				-126.3	-179.9	-63	42.1	-29	0	0	0	111.8
242	K	28.3	Very low	28.3	Very low	194 Å²	194	143.5 Å²	143.5	84%	0.843	70%	0.698	S	S	*	*			trans	-170.2	137.3	141.7	-97.4	140.5	-170.8	-177	0	108.5
243	K	26	Very low	28	Very low	144 Å²	144	134.4 Å²	134.4	63%	0.626	67%	0.669	S	S	*	*			cis	80	126.1	27.5	-161.4	-166	-173.7	-159.2	0	112.1
244	Y	24.4	Very low	27.9	Very low	162 Å²	162	130.4 Å²	130.4	64%	0.635	65%	0.652	S	S	*	*			trans	71.9	148.5	-175.3	-49.2	-64.1	0	0	0	113.9
245	H	26.9	Very low	27.9	Very low	131 Å²	131	133.8 Å²	133.8	61%	0.606	65%	0.652	S	S	*	*			cis	-133.9	150.3	-13.9	-108	-35.9	0	0	0	106.8
246	K	24.9	Very low	27.9	Very low	144 Å²	144	133 Å²	133	63%	0.626	66%	0.656	S	S	*	*				55.3	147.4	67.3	-162.6	-159.9	168.3	-146.8	0	111
247	H	25.8	Very low	27.9	Very low	114 Å²	114	133.3 Å²	133.3	53%	0.528	67%	0.665	S	S	.	*			trans	68.9	140.6	-173.7	-55.9	-83.9	0	0	0	112.8
248	E	24.4	Very low	27.8	Very low	146 Å²	146	131.2 Å²	131.2	68%	0.682	66%	0.663	S	S	*	*			cis	-169.8	164.2	-31	-133.6	143.4	-136.3	0	0	107.1
249	S	27.3	Very low	27.7	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	66%	0.659	S	S	*	*			trans	67.4	161.9	157.6	89.9	0	0	0	0	115.8
250	S	28.9	Very low	27.5	Very low	83 Å²	83	131.3 Å²	131.3	58%	0.58	65%	0.648	S	S	*	*			cis	-145.7	141	-4.9	-0.7	0	0	0	0	110.1
251	N	27.1	Very low	27.4	Very low	148 Å²	148	127.2 Å²	127.2	79%	0.791	64%	0.638	S	S	*	*			trans	65.6	162.4	148.8	-52.6	-16.3	0	0	0	118.2
252	V	29.2	Very low	27.1	Very low	112 Å²	112	129.5 Å²	129.5	68%	0.679	64%	0.64	S	S	*	*			trans	66	138.7	150	159.6	0	0	0	0	119.5	H1385	V252-H1385 WeakPolarHBondContact CG1-NE2 3.48Å
253	S	26.6	Very low	27	Very low	36 Å²	36	124 Å²	124	25%	0.252	63%	0.626	S	S	.	*			cis	176.8	153	-42.1	149.4	0	0	0	0	109.1	H1385 H1386	S253-H1385 WeakPolarHBondContact CB-CE1 3.4Å; S253-H1385 VanDerWaalsContact CB-NE2 3.35Å; S253-H1385 WeakPolarHBondContact CB-NE2 3.38Å; S253-H1385 PolarHBondContact O-CE1 2.68Å; S253-H1385 PolarHBondContact OG-CD2 3.44Å; S253-H1385 PolarHBondContact OG-CE1 3.1Å; S253-H1385 VanDerWaalsContact OG-CG 3.25Å; S253-H1385 PolarHBondContact OG-ND1 3.25Å; S253-H1385 VanDerWaalsContact OG-ND1 3.09Å; S253-H1385 PolarHBondContact OG-NE2 2.81Å; S253-H1386 PolarHBondContact OG-ND1 2.99Å
254	S	24.9	Very low	27.1	Very low	55 Å²	55	125.1 Å²	125.1	39%	0.385	63%	0.633	S	S	.	*			trans	71.3	131.1	166.6	82	0	0	0	0	115	H1385 H1386	S254-H1385 PolarHBondContact OG-N 3.24Å; S254-H1385 PolarHBondContact OG-ND1 3.35Å; S254-H1386 WeakPolarHBondContact CB-O 3.13Å
255	R	28.7	Very low	27.1	Very low	189 Å²	189	121.3 Å²	121.3	71%	0.713	63%	0.631	S	S	*	*				75.1	145.7	88.1	-68	-177.6	167.7	-179.2	-4.7	114.3
256	S	28	Very low	27	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	64%	0.644	S	S	*	*			trans	-6.6	150	143.6	-49	0	0	0	0	117.1
257	P	32.4	Very low	27	Very low	110 Å²	110	124.7 Å²	124.7	71%	0.714	65%	0.647	S	S	*	*			cis	-148	-173.4	44.3	42.9	-22.5	0	0	0	118.6
258	E	25.9	Very low	27	Very low	145 Å²	145	126.9 Å²	126.9	68%	0.678	66%	0.655	S	S	*	*			trans	-19.3	164.3	145.2	-41.2	167	63.5	0	0	117.9
259	Q	28.4	Very low	27.2	Very low	129 Å²	129	130.2 Å²	130.2	60%	0.603	66%	0.661	S	S	*	*			trans	66.2	147.1	146.9	-76.5	-176.1	74.9	0	0	115.7
260	R	27	Very low	27.3	Very low	179 Å²	179	129.1 Å²	129.1	68%	0.675	65%	0.654	S	S	*	*			cis	-172	167.7	-9.9	-128.9	176.3	173.3	156.1	-15.3	106.3
261	Q	27.6	Very low	27.4	Very low	133 Å²	133	132.4 Å²	132.4	62%	0.621	67%	0.665	S	S	*	*			trans	65.1	154.2	141.4	-77.8	172.6	-35.5	0	0	121.8
262	H	27.3	Very low	27.7	Very low	148 Å²	148	136 Å²	136	69%	0.685	67%	0.667	S	S	*	*			trans	40.1	134.3	137.4	-55.2	-33	0	0	0	120.6
263	S	24.9	Very low	27.9	Very low	79 Å²	79	135.4 Å²	135.4	55%	0.552	66%	0.664	S	S	*	*			cis	-164.5	-129.5	3	55.9	0	0	0	0	111.7
264	H	27.9	Very low	28.2	Very low	167 Å²	167	140 Å²	140	77%	0.773	69%	0.686	S	S	*	*			trans	62.9	86.9	-176.9	-42.1	-61.3	0	0	0	113.9
265	S	24.4	Very low	28.7	Very low	83 Å²	83	143.4 Å²	143.4	58%	0.58	70%	0.7	S	S	*	*			cis	62.9	135	19.8	103.3	0	0	0	0	115.1
266	R	25.1	Very low	29	Very low	233 Å²	233	138.5 Å²	138.5	88%	0.879	70%	0.695	S	S	*	*			trans	68.7	146.5	-173.3	-49	176.5	179.6	177.4	-0.2	112.6
267	T	25.5	Very low	29.3	Very low	113 Å²	113	138.3 Å²	138.3	69%	0.693	69%	0.693	S	S	*	*			cis	-145.8	161.9	-1.3	-11.5	0	0	0	0	108.2
268	F	24.8	Very low	29.4	Very low	160 Å²	160	143.6 Å²	143.6	70%	0.702	70%	0.699	S	S	*	*				-166.5	133.3	81.1	-108.5	-91.3	0	0	0	111.8
269	R	28.6	Very low	29.6	Very low	215 Å²	215	141 Å²	141	81%	0.811	70%	0.697	S	S	*	*			trans	55.4	140	152.7	-71.4	172.5	-172.6	167.7	1.3	118.8
270	S	29.8	Very low	29.7	Very low	86 Å²	86	139.3 Å²	139.3	60%	0.601	70%	0.699	S	S	*	*			cis	-178	149.9	-4.6	47.2	0	0	0	0	110.3
271	N	30.9	Very low	29.9	Very low	151 Å²	151	136.7 Å²	136.7	81%	0.807	70%	0.703	S	S	*	*			trans	62.1	145.4	149.4	-57.8	-3.7	0	0	0	117
272	R	33.7	Very low	30	Very low	223 Å²	223	138 Å²	138	84%	0.842	71%	0.706	S	S	*	*			cis	-163.9	153.6	5.1	-119.2	-169.2	174.4	177.9	-2	104.6
273	T	34	Very low	30.2	Very low	100 Å²	100	136.1 Å²	136.1	61%	0.613	70%	0.701	S	S	*	*			cis	-175.8	156.3	-14.2	12.9	0	0	0	0	106.9
274	N	32.5	Very low	30.4	Very low	134 Å²	134	138.2 Å²	138.2	72%	0.717	71%	0.711	S	S	*	*			trans	65.9	163.1	160.2	-67.5	40.9	0	0	0	115.6
275	D	34.7	Very low	30.4	Very low	126 Å²	126	135.7 Å²	135.7	67%	0.674	71%	0.707	S	S	*	*			cis	-160.5	165.5	-9.9	-114.2	-33.8	0	0	0	106.8
276	S	36.2	Very low	31	Very low	86 Å²	86	136.9 Å²	136.9	60%	0.601	71%	0.713	S	S	*	*			cis	-161.4	147.5	-16.8	-141.9	0	0	0	0	109.5
277	S	34.2	Very low	31.2	Very low	104 Å²	104	135.4 Å²	135.4	73%	0.727	71%	0.713	S	S	*	*			trans	66.6	161.9	149.2	90.9	0	0	0	0	117.7
278	R	33.3	Very low	31.3	Very low	221 Å²	221	133.2 Å²	133.2	83%	0.834	71%	0.713	S	S	*	*			cis	-154.9	150	-8.1	-142.5	178.1	176.7	130.9	-4.6	110.1
279	S	31.2	Very low	31.4	Very low	92 Å²	92	135.9 Å²	135.9	64%	0.643	72%	0.724	S	S	*	*			trans	42.1	142.1	140.5	57.7	0	0	0	0	122.5
280	S	30.7	Very low	31.4	Very low	92 Å²	92	129 Å²	129	64%	0.643	72%	0.72	S	S	*	*			cis	169.5	173.6	-9.3	50.3	0	0	0	0	108.6
281	V	29.6	Very low	31.3	Very low	124 Å²	124	133.3 Å²	133.3	75%	0.752	73%	0.728	S	S	*	*			trans	70.4	128.1	139.1	149.7	0	0	0	0	115.7
282	K	30.4	Very low	31.1	Very low	160 Å²	160	136.2 Å²	136.2	70%	0.696	73%	0.728	S	S	*	*			cis	-174.8	-171.7	2.1	-133.5	178.4	175.9	-164.3	0	110.3
283	D	32	Very low	30.8	Very low	109 Å²	109	134.3 Å²	134.3	58%	0.583	73%	0.726	S	S	*	*			trans	64.2	112.1	144.6	-65.1	-5.9	0	0	0	118
284	T	28.5	Very low	30.5	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	73%	0.733	S	S	*	*				67.4	141.9	73.2	70.5	0	0	0	0	113.4
285	V	28.4	Very low	30.2	Very low	114 Å²	114	138.8 Å²	138.8	69%	0.691	73%	0.727	S	S	*	*			cis	-156.4	159.5	11.8	105	0	0	0	0	109.4
286	P	37.1	Very low	29.8	Very low	109 Å²	109	137.9 Å²	137.9	71%	0.708	73%	0.73	S	S	*	*			trans	-85.7	164.9	-175	35.7	-37	0	0	0	114.4
287	K	28.7	Very low	29.7	Very low	202 Å²	202	139 Å²	139	88%	0.878	74%	0.736	S	S	*	*			trans	-172.6	162.1	159.6	-101.3	141.8	-172.7	178.1	0	112.7
288	G	28.8	Very low	29.6	Very low	67 Å²	67	140.6 Å²	140.6	69%	0.691	74%	0.741	S	S	*	*			trans	84.9	113.5	173.3	0	0	0	0	0	113
289	K	26.9	Very low	29.2	Very low	216 Å²	216	139.2 Å²	139.2	94%	0.939	74%	0.741	S	S	*	*			cis	63.4	111.2	29.3	-64.5	-169.9	177.4	-177	0	115.2
290	G	28.6	Very low	29.4	Very low	71 Å²	71	140.6 Å²	140.6	73%	0.732	75%	0.745	S	S	*	*			trans	125.8	148.9	159	0	0	0	0	0	113.4
291	F	26.7	Very low	29.2	Very low	175 Å²	175	145.9 Å²	145.9	77%	0.768	76%	0.757	S	S	*	*			cis	176.2	133.8	-27.3	-134.2	-128.3	0	0	0	104.5
292	R	27.4	Very low	29.2	Very low	212 Å²	212	148.8 Å²	148.8	80%	0.8	76%	0.759	S	S	*	*			trans	69.1	136	167.6	-57.6	168.6	179.7	167.5	-1	115.1
293	K	26.9	Very low	29.1	Very low	184 Å²	184	145.3 Å²	145.3	80%	0.8	75%	0.752	S	S	*	*			cis	82.2	136.8	34.7	-170.4	-178.5	-178.8	177.2	0	112
294	R	27	Very low	28.8	Very low	200 Å²	200	147.5 Å²	147.5	76%	0.755	76%	0.758	S	S	*	*			trans	91.3	148.3	-177.5	-57	-171.9	165.9	-118.7	6.1	114.6
295	E	27.3	Very low	28.8	Very low	127 Å²	127	151 Å²	151	59%	0.593	76%	0.759	S	S	*	*			cis	-164.8	131.3	-20.8	-112.4	148.3	-163.5	0	0	111.6
296	S	26.1	Very low	28.6	Very low	107 Å²	107	150.9 Å²	150.9	75%	0.748	76%	0.758	S	S	*	*			trans	62.8	-172.2	131.8	-40.7	0	0	0	0	118.5
297	P	33.2	Very low	28	Very low	111 Å²	111	150.7 Å²	150.7	72%	0.721	76%	0.76	S	S	*	*				-141.9	136.8	-116.4	35.8	-11.1	0	0	0	118.8
298	V	31.8	Very low	28	Very low	137 Å²	137	149.8 Å²	149.8	83%	0.83	76%	0.759	S	S	*	*			trans	-134.3	124.3	164.5	-174.1	0	0	0	0	108.2	V300	V298-V300 HydrophobicContact CG1-CG2 4.26Å
299	K	26.3	Very low	27.9	Very low	191 Å²	191	155.1 Å²	155.1	83%	0.83	77%	0.766	S	S	*	*			cis	92.1	45.1	15.2	-142.8	-175.5	-173.9	-174	0	117
300	V	34.1	Very low	28	Very low	122 Å²	122	150.3 Å²	150.3	74%	0.739	76%	0.76	S	S	*	*			trans	-135.9	128.3	154.6	-176.1	0	0	0	0	105.8	V298	V298-V300 HydrophobicContact CG1-CG2 4.26Å
301	K	26.4	Very low	27.9	Very low	202 Å²	202	153.3 Å²	153.3	88%	0.878	76%	0.759	S	S	*	*			cis	77.9	59.1	1.2	-134	-163.2	-173.3	-158.2	0	119
302	K	30.4	Very low	28.2	Very low	185 Å²	185	152.6 Å²	152.6	80%	0.804	76%	0.763	S	S	*	*			trans	-173.4	155.6	148.1	-102.2	-157.4	170.5	-167.5	0	108.4
303	T	27.6	Very low	28.1	Very low	88 Å²	88	149.4 Å²	149.4	54%	0.54	76%	0.757	S	S	.	*			cis	-172	138.2	-33.4	16.4	0	0	0	0	107
304	E	25.8	Very low	28.1	Very low	154 Å²	154	144.8 Å²	144.8	72%	0.72	75%	0.747	S	S	*	*			trans	66.6	171.6	148.3	-62.3	162.2	142.7	0	0	119.7
305	Y	28.8	Very low	28.2	Very low	197 Å²	197	141.9 Å²	141.9	77%	0.773	75%	0.745	S	S	*	*			trans	61	96.4	179.4	-55.7	-80.8	0	0	0	115.6
306	T	25.2	Very low	28.2	Very low	111 Å²	111	141.7 Å²	141.7	68%	0.681	75%	0.749	S	S	*	*				66.1	114.5	54.7	78.7	0	0	0	0	115
307	S	24.3	Very low	28.2	Very low	106 Å²	106	146.5 Å²	146.5	74%	0.741	75%	0.752	S	S	*	*			trans	61.2	168.1	154	64.2	0	0	0	0	116.2
308	E	27.5	Very low	28.1	Very low	183 Å²	183	147 Å²	147	86%	0.855	75%	0.752	S	S	*	*			cis	-127.5	-162.6	7.8	-74.2	178.9	150.2	0	0	112.2
309	E	27.5	Very low	27.7	Very low	179 Å²	179	145.6 Å²	145.6	84%	0.836	75%	0.749	S	S	*	*			trans	-77.2	149.6	-174.5	-62.4	155.9	132.3	0	0	113.7
310	S	28.2	Very low	27.8	Very low	115 Å²	115	143 Å²	143	80%	0.804	74%	0.744	S	S	*	*			trans	-162.1	118	159.6	-55.5	0	0	0	0	105.5
311	D	27.1	Very low	27.5	Very low	134 Å²	134	142.8 Å²	142.8	72%	0.717	74%	0.739	S	S	*	*			cis	63.9	54.6	26	-83.2	2.4	0	0	0	114.9
312	D	32.4	Very low	27.6	Very low	160 Å²	160	140.7 Å²	140.7	86%	0.856	73%	0.732	S	S	*	*			trans	-97.5	106.9	136.8	-90.1	-44.6	0	0	0	106.6
313	H	27.1	Very low	27.5	Very low	144 Å²	144	139.5 Å²	139.5	67%	0.667	73%	0.733	S	S	*	*			cis	51.4	138.2	45.4	-88.2	-53.4	0	0	0	112.1
314	C	26.8	Very low	27.5	Very low	87 Å²	87	139.8 Å²	139.8	59%	0.588	74%	0.738	S	S	*	*			cis	-157.6	-157	-13.1	-159.8	0	0	0	0	107
315	L	27.5	Very low	27.6	Very low	140 Å²	140	139.5 Å²	139.5	73%	0.733	74%	0.737	S	S	*	*			trans	74.7	129.1	158.4	-42.2	-171.1	0	0	0	115.9
316	D	27.8	Very low	27.5	Very low	123 Å²	123	133.8 Å²	133.8	66%	0.658	72%	0.717	S	S	*	*			cis	-159.5	172.2	-13	-131.5	-19.9	0	0	0	113.4
317	Y	26.1	Very low	27.7	Very low	207 Å²	207	131.7 Å²	131.7	81%	0.812	70%	0.702	S	S	*	*			trans	-38.7	152.1	144.9	-71.6	-107.7	0	0	0	111.1
318	V	31.2	Very low	28	Very low	122 Å²	122	131.3 Å²	131.3	74%	0.739	70%	0.699	S	S	*	*				-160.6	134.3	57.1	162	0	0	0	0	106.7	N320	V318-N320 PolarHBondContact O-N 2.87Å
319	S	24.6	Very low	28.3	Very low	107 Å²	107	126.1 Å²	126.1	75%	0.748	69%	0.688	S	S	*	*			trans	-58.3	126.4	164.8	-46.7	0	0	0	0	109.9
320	N	27.7	Very low	28.5	Very low	138 Å²	138	120.5 Å²	120.5	74%	0.738	66%	0.663	S	S	*	*			trans	-169.8	110.7	139.2	-92.8	-21	0	0	0	110.4	V318	V318-N320 PolarHBondContact O-N 2.87Å
321	D	27.4	Very low	28.7	Very low	117 Å²	117	120.2 Å²	120.2	63%	0.626	65%	0.653	S	S	*	*				57.4	140.9	117.9	-79	35.5	0	0	0	122.6
322	Q	28.1	Very low	29.2	Very low	157 Å²	157	120.4 Å²	120.4	73%	0.734	65%	0.654	S	S	*	*			trans	66.4	112.4	141.6	-68.6	171.1	58.2	0	0	116
323	L	29.3	Very low	29.1	Very low	160 Å²	160	119.5 Å²	119.5	84%	0.838	65%	0.649	S	S	*	*			cis	-153.1	169.6	35.3	-94.6	131.9	0	0	0	113.9
324	C	27.1	Very low	29.3	Very low	94 Å²	94	120.4 Å²	120.4	64%	0.635	65%	0.653	S	S	*	*			trans	-82	174.6	179.8	-52.5	0	0	0	0	112.6
325	E	28.2	Very low	29.3	Very low	148 Å²	148	119.9 Å²	119.9	69%	0.692	65%	0.65	S	S	*	*			trans	70.8	143.2	151.1	-66.7	143.6	-149.3	0	0	117
326	E	27.6	Very low	29.6	Very low	77 Å²	77	120.2 Å²	120.2	36%	0.36	65%	0.648	S	S	.	*			cis	-160.6	166.9	-3.4	-125.5	171.8	-149.2	0	0	113.6	T1167	E326-T1167 VanDerWaalsContact CD-CB 3.43Å; E326-T1167 HydrophobicContact CG-CG2 4.13Å; E326-T1167 WeakPolarHBondContact OE1-CB 3.25Å; E326-T1167 WeakPolarHBondContact OE1-CG2 3.42Å; E326-T1167 PolarHBondContact OE1-OG1 2.98Å; E326-T1167 VanDerWaalsContact OE1-OG1 3.11Å; E326-T1167 WeakPolarHBondContact OE2-CB 3.44Å; E326-T1167 PolarHBondContact OE2-OG1 3.3Å
327	N	29.5	Very low	29.6	Very low	68 Å²	68	121.3 Å²	121.3	36%	0.364	65%	0.65	S	S	.	*			trans	68.1	132.7	144.5	-71.1	-20.6	0	0	0	126.2	C1166 T1167	N327-C1166 WeakPolarHBondContact OD1-CB 3.27Å; N327-C1166 PolarHBondContact OD1-O 2.86Å; N327-T1167 PolarHBondContact ND2-OG1 3.36Å; N327-T1167 PolarHBondContact OD1-OG1 3.14Å
328	S	30.1	Very low	30	Very low	98 Å²	98	120.3 Å²	120.3	69%	0.685	65%	0.649	S	S	*	*			trans	72.8	154.8	139.7	76.8	0	0	0	0	120.2
329	A	33	Very low	29.9	Very low	74 Å²	74	119.5 Å²	119.5	61%	0.612	65%	0.649	S	S	*	*			cis	-162.5	123.8	-31.8	0	0	0	0	0	111.3	P1165	A329-P1165 HydrophobicContact CB-CG 4.37Å
330	D	32.9	Very low	30	Very low	61 Å²	61	118.6 Å²	118.6	33%	0.326	64%	0.643	S	S	.	*				47.8	81.1	125	-122.9	-64.2	0	0	0	121.3	R1163 K1164	D330-R1163 VanDerWaalsContact CG-NE 3.28Å; D330-R1163 PolarHBondContact O-NE 3Å; D330-R1163 PolarHBondContact O-NH1 3.39Å; D330-R1163 PolarHBondContact O-NH2 2.91Å; D330-R1163 IonicContact OD1-CZ 3.23Å; D330-R1163 IonicContact OD1-NE 3.39Å; D330-R1163 PolarHBondContact OD1-NE 2.87Å; D330-R1163 IonicContact OD1-NH2 3.89Å; D330-R1163 PolarHBondContact OD1-NH2 2.95Å; D330-R1163 VanDerWaalsContact OD2-CA 3.3Å; D330-R1163 WeakPolarHBondContact OD2-CA 3.42Å; D330-K1164 PolarHBondContact OD2-N 2.8Å
331	D	32.4	Very low	30.2	Very low	109 Å²	109	123.5 Å²	123.5	58%	0.583	65%	0.651	S	S	*	*			trans	-157.7	162.4	144.1	-112.5	-39.6	0	0	0	111.2	K1162 R1163	D331-K1162 IonicContact OD1-NZ 3.4Å; D331-R1163 IonicContact OD1-CZ 3.59Å; D331-R1163 VanDerWaalsContact OD1-CZ 3.3Å; D331-R1163 IonicContact OD1-NH1 3.61Å; D331-R1163 PolarHBondContact OD1-NH1 3.11Å; D331-R1163 VanDerWaalsContact OD1-NH1 3.1Å; D331-R1163 IonicContact OD1-NH2 2.79Å; D331-R1163 PolarHBondContact OD1-NH2 3.24Å; D331-R1163 IonicContact OD2-CZ 2.74Å; D331-R1163 IonicContact OD2-NH1 2.93Å; D331-R1163 PolarHBondContact OD2-NH1 3.25Å; D331-R1163 IonicContact OD2-NH2 3.84Å
332	D	36.1	Very low	30.2	Very low	138 Å²	138	128.8 Å²	128.8	74%	0.738	66%	0.662	S	S	*	*			cis	-122.3	-177.2	26.5	-78.1	-60.8	0	0	0	115.3	K1162	D332-K1162 VanDerWaalsContact C-NZ 3.32Å; D332-K1162 PolarHBondContact O-NZ 3.42Å
333	N	30.8	Very low	30.2	Very low	140 Å²	140	126.6 Å²	126.6	75%	0.749	66%	0.659	S	S	*	*			trans	-163.5	95.9	148.2	-175.8	42.9	0	0	0	111.8
334	E	30.8	Very low	30.2	Very low	164 Å²	164	124.9 Å²	124.9	77%	0.766	66%	0.655	S	S	*	*			trans	-143.8	165.2	173.6	-89.9	-139.4	92.2	0	0	110.1
335	S	27.7	Very low	30.2	Very low	75 Å²	75	129.8 Å²	129.8	52%	0.524	66%	0.66	S	S	.	*			cis	-175.6	-169.1	-36.1	67.8	0	0	0	0	107.3
336	Q	32.4	Very low	30.2	Very low	147 Å²	147	133 Å²	133	69%	0.687	67%	0.666	S	S	*	*			trans	81.2	108.8	163.1	-39.1	-157.4	6.3	0	0	122.2
337	Q	28.9	Very low	30.3	Very low	147 Å²	147	134.7 Å²	134.7	69%	0.687	67%	0.669	S	S	*	*				55.9	106.3	121.2	-57.1	175.1	15.6	0	0	121.7
338	K	33.9	Very low	30.3	Very low	186 Å²	186	132.9 Å²	132.9	81%	0.809	66%	0.661	S	S	*	*				173.2	126.7	116.8	-88.9	144.4	-164.8	159.8	0	108.9
339	S	29.4	Very low	30.1	Very low	104 Å²	104	131.4 Å²	131.4	73%	0.727	65%	0.649	S	S	*	*				69	127.4	66.8	-179.5	0	0	0	0	112.5
340	S	27.7	Very low	29.9	Very low	89 Å²	89	132.2 Å²	132.2	62%	0.622	65%	0.646	S	S	*	*			cis	-171.1	155.4	-6.3	-101.8	0	0	0	0	111.4
341	R	30	Very low	29.7	Very low	240 Å²	240	135.9 Å²	135.9	91%	0.906	66%	0.661	S	S	*	*			trans	68.5	162.3	165.4	-57.9	151.2	178.9	171.1	-1.4	113.6
342	R	28.1	Very low	29.5	Very low	229 Å²	229	135.8 Å²	135.8	86%	0.864	67%	0.665	S	S	*	*			cis	-152.8	140.4	12.3	-156	174.1	-171.3	160.3	1.3	111.6
343	V	27.9	Very low	29.1	Very low	111 Å²	111	135 Å²	135	67%	0.673	66%	0.664	S	S	*	*			trans	14.5	129.5	144.2	-167.4	0	0	0	0	117.4
344	V	29.2	Very low	28.9	Very low	123 Å²	123	133.5 Å²	133.5	75%	0.745	66%	0.661	S	S	*	*				-150.3	151.4	81.9	164.9	0	0	0	0	114.4
345	R	28.7	Very low	28.7	Very low	198 Å²	198	130.8 Å²	130.8	75%	0.747	66%	0.66	S	S	*	*			trans	-57.3	169.1	175.7	-68.6	169.6	157.5	104.8	-6.2	114.3
346	R	28	Very low	28.7	Very low	216 Å²	216	133.8 Å²	133.8	82%	0.815	68%	0.675	S	S	*	*			cis	-139.4	138.4	30.4	-74.8	175.5	165.4	116.4	-6.5	110.9	N1359	R346-N1359 CarbonylContact C-O 3.44Å; R346-N1359 VanDerWaalsContact C-O 3.27Å
347	R	29.5	Very low	28.7	Very low	112 Å²	112	129.8 Å²	129.8	42%	0.423	67%	0.673	S	S	.	*			cis	90.8	125.9	41.7	178.1	-167.6	-158.5	-127	5.9	110.9	E900 N1359 F1360 R1361	R347-E900 IonicContact CZ-OE1 2.64Å; R347-E900 IonicContact CZ-OE2 3.98Å; R347-E900 IonicContact NH1-OE1 2.81Å; R347-E900 IonicContact NH1-OE2 3.71Å; R347-E900 PolarHBondContact NH1-OE2 3.38Å; R347-E900 IonicContact NH2-OE1 3.83Å; R347-E900 PolarHBondContact NH2-OE1 2.96Å; R347-E900 IonicContact NH2-OE2 3.18Å; R347-E900 PolarHBondContact NH2-OE2 2.67Å; R347-N1359 PolarHBondContact N-O 2.67Å; R347-F1360 CarbonylContact C-O 3.5Å; R347-F1360 WeakPolarHBondContact CA-O 3.43Å; R347-F1360 PolarHBondContact N-O 2.95Å; R347-R1361 CarbonylContact C-O 3.13Å
348	S	28.3	Very low	28.8	Very low	29 Å²	29	131.5 Å²	131.5	20%	0.203	68%	0.681	C	S	.	*			cis	-161.2	-177.4	21.5	34.5	0	0	0	0	115.4	F1360 R1361 P1362	S348-F1360 PolarHBondContact N-O 3.1Å; S348-R1361 VanDerWaalsContact N-C 3.34Å; S348-R1361 PolarHBondContact N-O 2.72Å; S348-R1361 CarbonylContact O-C 3.51Å; S348-R1361 WeakPolarHBondContact O-CB 3.22Å; S348-R1361 WeakPolarHBondContact O-CG 3.47Å; S348-P1362 VanDerWaalsContact O-CB 3.25Å; S348-P1362 WeakPolarHBondContact O-CB 3.48Å; S348-P1362 WeakPolarHBondContact O-CD 3.43Å; S348-P1362 VanDerWaalsContact O-CG 3.3Å; S348-P1362 WeakPolarHBondContact O-CG 3.49Å
349	T	27.2	Very low	28.6	Very low	68 Å²	68	130.2 Å²	130.2	42%	0.417	68%	0.676	S	S	.	*			trans	-37.7	158.4	163.3	44.1	0	0	0	0	118
350	V	28.9	Very low	28.7	Very low	91 Å²	91	132 Å²	132	55%	0.552	67%	0.672	S	S	*	*			cis	57.4	158.5	-28	177.2	0	0	0	0	120.5	R1361 P1362	V350-R1361 HydrophobicContact CB-CG 3.85Å; V350-R1361 HydrophobicContact CG1-CG 4.32Å; V350-R1361 HydrophobicContact CG2-CG 4.21Å; V350-R1361 PolarHBondContact O-NH1 2.95Å; V350-P1362 HydrophobicContact CG2-CB 4.04Å
351	E	27.9	Very low	28.7	Very low	138 Å²	138	135.7 Å²	135.7	65%	0.645	68%	0.68	S	S	*	*			trans	84.7	162.4	-152.5	-82.8	129.4	-149.4	0	0	112.6	R1361	E351-R1361 IonicContact OE1-CZ 2.7Å; E351-R1361 IonicContact OE1-NH1 2.84Å; E351-R1361 PolarHBondContact OE1-NH1 3.12Å; E351-R1361 VanDerWaalsContact OE1-NH1 3.1Å; E351-R1361 IonicContact OE1-NH2 3.79Å; E351-R1361 PolarHBondContact OE1-NH2 3.11Å; E351-R1361 IonicContact OE2-CZ 3.24Å; E351-R1361 IonicContact OE2-NH1 3.88Å; E351-R1361 PolarHBondContact OE2-NH1 2.94Å; E351-R1361 IonicContact OE2-NH2 3.35Å
352	T	28.5	Very low	28.5	Very low	107 Å²	107	127.6 Å²	127.6	66%	0.656	66%	0.66	S	S	*	*			cis	-177.3	176.3	-39.6	-69.3	0	0	0	0	105
353	T	26.7	Very low	28.6	Very low	120 Å²	120	118 Å²	118	74%	0.736	63%	0.627	S	S	*	*			trans	75.8	166.5	159.7	75.1	0	0	0	0	116.8
354	T	26.7	Very low	28.9	Very low	109 Å²	109	117.6 Å²	117.6	67%	0.669	62%	0.618	S	S	*	*			cis	-150.5	148.3	3.6	-22.3	0	0	0	0	112.4
355	S	27.3	Very low	29	Very low	107 Å²	107	115.1 Å²	115.1	75%	0.748	60%	0.6	S	S	*	*			trans	62.2	169.3	145.8	73.6	0	0	0	0	117.8
356	T	28.2	Very low	29.2	Very low	138 Å²	138	113.7 Å²	113.7	85%	0.847	60%	0.602	S	S	*	*			cis	-127.9	159.9	-10.5	44.2	0	0	0	0	106.9
357	G	31.5	Very low	29.5	Very low	63 Å²	63	110.5 Å²	110.5	65%	0.649	60%	0.601	S	S	*	*			cis	154.2	-171.1	13.7	0	0	0	0	0	108.1
358	Q	30.5	Very low	29.5	Very low	183 Å²	183	111.7 Å²	111.7	86%	0.855	62%	0.616	S	S	*	*			trans	71.3	120.5	-179	-54.1	-170	-2.9	0	0	113.3
359	K	30.8	Very low	29.4	Very low	160 Å²	160	114.5 Å²	114.5	70%	0.696	64%	0.635	S	S	*	*				67.7	135.8	91.6	-70.3	173.6	151.1	-111	0	112.9
360	E	30.6	Very low	29.5	Very low	140 Å²	140	120.1 Å²	120.1	65%	0.654	65%	0.654	S	S	*	*			cis	-154.8	176	6	-130.8	143.8	-166.8	0	0	112.7
361	E	27.8	Very low	29.4	Very low	168 Å²	168	121.8 Å²	121.8	79%	0.785	66%	0.664	S	S	*	*			trans	-44.1	156.8	157.6	-75.6	170.9	133	0	0	112.8
362	S	27.3	Very low	29.3	Very low	70 Å²	70	121.1 Å²	121.1	49%	0.49	67%	0.669	S	S	.	*			cis	176.2	160.1	1.7	48	0	0	0	0	112.8
363	V	29.9	Very low	29.3	Very low	28 Å²	28	121.2 Å²	121.2	17%	0.17	67%	0.67	C	S	.	*			trans	75.5	106.2	138.5	-63	0	0	0	0	127.5	K1150 E1151 R1152	V363-K1150 HydrophobicContact CB-CB 3.58Å; V363-K1150 HydrophobicContact CB-CD 4.07Å; V363-K1150 VanDerWaalsContact CB-CE 3.41Å; V363-K1150 HydrophobicContact CB-CG 4.12Å; V363-K1150 HydrophobicContact CG1-CB 3.63Å; V363-K1150 HydrophobicContact CG2-CB 3.91Å; V363-K1150 HydrophobicContact CG2-CD 3.68Å; V363-K1150 HydrophobicContact CG2-CG 4.23Å; V363-K1150 WeakPolarHBondContact O-CE 3.35Å; V363-K1150 PolarHBondContact O-NZ 3.09Å; V363-E1151 WeakPolarHBondContact CA-OE2 3.38Å; V363-E1151 HydrophobicContact CB-CB 4.42Å; V363-E1151 HydrophobicContact CB-CG 4.39Å; V363-E1151 HydrophobicContact CG1-CB 3.68Å; V363-E1151 HydrophobicContact CG1-CG 4.16Å; V363-E1151 WeakPolarHBondContact CG1-O 3.42Å; V363-E1151 PolarHBondContact N-OE2 3.1Å; V363-R1152 HydrophobicContact CG1-CB 4.43Å
364	H	33.7	Very low	29.4	Very low	101 Å²	101	119 Å²	119	47%	0.468	66%	0.659	S	S	.	*			trans	173.9	124.1	131.3	-100.3	-35.8	0	0	0	110.1	N1149 K1150 E1151	H364-N1149 PolarHBondContact CE1-ND2 2.95Å; H364-N1149 VanDerWaalsContact CE1-ND2 3.32Å; H364-N1149 PolarHBondContact ND1-ND2 3.33Å; H364-K1150 WeakPolarHBondContact CD2-CE 3.49Å; H364-K1150 PolarHBondContact CD2-NZ 2.78Å; H364-K1150 WeakPolarHBondContact CE1-CE 3.41Å; H364-K1150 VanDerWaalsContact ND1-CE 3.31Å; H364-K1150 WeakPolarHBondContact ND1-CE 3.35Å; H364-K1150 WeakPolarHBondContact NE2-CE 3.35Å; H364-K1150 PolarHBondContact NE2-NZ 2.79Å; H364-K1150 VanDerWaalsContact NE2-NZ 3.12Å; H364-E1151 PolarHBondContact N-OE1 2.96Å; H364-E1151 VanDerWaalsContact N-OE1 3.1Å
365	D	32.1	Very low	29.5	Very low	71 Å²	71	116 Å²	116	38%	0.38	64%	0.639	S	S	.	*				72.7	151.5	74.2	-63.9	-71.7	0	0	0	117.6	N1149 K1150 E1151	D365-N1149 WeakPolarHBondContact OD2-CB 3.42Å; D365-N1149 PolarHBondContact OD2-ND2 3.47Å; D365-K1150 PolarHBondContact OD2-N 2.9Å; D365-E1151 PolarHBondContact N-OE1 2.93Å
366	E	32.8	Very low	29.5	Very low	169 Å²	169	114.7 Å²	114.7	79%	0.79	63%	0.627	S	S	*	*			trans	82.9	109	168.1	-58.7	-168.8	-165	0	0	121.4
367	D	34	Very low	29.6	Very low	149 Å²	149	113.2 Å²	113.2	80%	0.797	62%	0.622	S	S	*	*				24.7	159.5	122.8	-81.4	-15	0	0	0	124.3
368	N	29.1	Very low	29.4	Very low	137 Å²	137	118.5 Å²	118.5	73%	0.733	63%	0.63	S	S	*	*			trans	70	106.9	164	-73.3	-63.2	0	0	0	116.9
369	S	26.6	Very low	29.4	Very low	87 Å²	87	117.7 Å²	117.7	61%	0.608	63%	0.63	S	S	*	*				84.2	145	64.8	82.5	0	0	0	0	114.9
370	K	28.8	Very low	29.3	Very low	186 Å²	186	115.1 Å²	115.1	81%	0.809	63%	0.627	S	S	*	*			trans	92.7	117.3	168.8	-59.5	171.5	-176.8	169.5	0	119.8
371	V	25.9	Very low	29.2	Very low	126 Å²	126	113.4 Å²	113.4	76%	0.764	63%	0.627	S	S	*	*				66	98.3	125.9	-175.1	0	0	0	0	119.1
372	V	27.5	Very low	29.2	Very low	124 Å²	124	112 Å²	112	75%	0.752	62%	0.62	S	S	*	*				27.2	111.3	121.2	-172.9	0	0	0	0	118
373	T	28.6	Very low	29.3	Very low	109 Å²	109	113 Å²	113	67%	0.669	63%	0.627	S	S	*	*			trans	-146.5	91.3	139.3	41.9	0	0	0	0	112.3
374	S	28.6	Very low	29.4	Very low	73 Å²	73	118.1 Å²	118.1	51%	0.51	65%	0.647	S	S	.	*				29.8	121	112.1	70.7	0	0	0	0	119.4
375	N	27.5	Very low	29.1	Very low	48 Å²	48	120.8 Å²	120.8	26%	0.257	66%	0.66	S	S	.	*				131.5	118.3	128.5	-79.3	24.1	0	0	0	119.6	I1091 S1093	N375-I1091 HydrophobicContact CB-CG2 4.33Å; N375-I1091 WeakPolarHBondContact OD1-CG2 3.49Å; N375-S1093 PolarHBondContact ND2-OG 3.08Å; N375-S1093 WeakPolarHBondContact OD1-CB 3.4Å; N375-S1093 PolarHBondContact OD1-OG 3.41Å
376	T	28.2	Very low	28.9	Very low	78 Å²	78	121 Å²	121	48%	0.479	67%	0.667	S	S	.	*			trans	70.3	166.4	131.4	61.6	0	0	0	0	121.6	I1091	T376-I1091 WeakPolarHBondContact CG2-O 3.45Å
377	S	30.2	Very low	28.8	Very low	108 Å²	108	121.9 Å²	121.9	76%	0.755	67%	0.668	S	S	*	*			trans	65.9	108.4	-168.3	58.2	0	0	0	0	112.7
378	E	26.3	Very low	28.5	Very low	174 Å²	174	117.8 Å²	117.8	81%	0.813	66%	0.661	S	S	*	*			cis	56.2	101	41.4	-61	-164.8	134.9	0	0	114.4
379	I	32.3	Very low	28.7	Very low	165 Å²	165	115.7 Å²	115.7	85%	0.846	66%	0.663	S	S	*	*			trans	-168.8	104.1	156.1	-99.8	153.2	0	0	0	101.6
380	V	28.1	Very low	28.8	Very low	107 Å²	107	118.3 Å²	118.3	65%	0.648	67%	0.67	S	S	*	*			cis	55.2	105.2	39.8	-171.1	0	0	0	0	108.7
381	T	27.3	Very low	28.8	Very low	104 Å²	104	115.6 Å²	115.6	64%	0.638	66%	0.664	S	S	*	*			cis	-146.7	162.3	49.4	-5.9	0	0	0	0	113.9
382	E	28.9	Very low	28.9	Very low	138 Å²	138	115.3 Å²	115.3	65%	0.645	66%	0.655	S	S	*	*			trans	-1.1	145.1	130.4	-55.6	162.6	-153.4	0	0	118	K384	E382-K384 VanDerWaalsContact OE2-CE 3.29Å; E382-K384 WeakPolarHBondContact OE2-CE 3.5Å; E382-K384 IonicContact OE2-NZ 3.77Å; E382-K384 PolarHBondContact OE2-NZ 2.97Å
383	S	29.3	Very low	29	Very low	92 Å²	92	115.5 Å²	115.5	64%	0.643	66%	0.656	S	S	*	*				-169.1	118.6	97.9	-82.2	0	0	0	0	110.6
384	K	30.9	Very low	28.9	Very low	135 Å²	135	115.4 Å²	115.4	59%	0.587	66%	0.66	S	S	*	*				75.8	144.6	95.6	-67.4	171.4	-166.7	103.5	0	111.9	E382	E382-K384 VanDerWaalsContact OE2-CE 3.29Å; E382-K384 WeakPolarHBondContact OE2-CE 3.5Å; E382-K384 IonicContact OE2-NZ 3.77Å; E382-K384 PolarHBondContact OE2-NZ 2.97Å
385	Q	28.9	Very low	28.8	Very low	157 Å²	157	117.5 Å²	117.5	73%	0.734	67%	0.67	S	S	*	*			cis	-142.3	167.9	7.8	-123.8	135.9	-19.4	0	0	112.1
386	S	28.3	Very low	28.7	Very low	76 Å²	76	122.1 Å²	122.1	53%	0.531	70%	0.7	S	S	.	*			trans	-33.4	170	152.1	50.5	0	0	0	0	115.7
387	F	29.7	Very low	28.5	Very low	187 Å²	187	127.4 Å²	127.4	82%	0.82	72%	0.719	S	S	*	*			cis	-140.2	168.2	28	-66.9	-100.1	0	0	0	111.5
388	G	28.2	Very low	28.4	Very low	62 Å²	62	126.6 Å²	126.6	64%	0.639	72%	0.719	S	S	*	*			cis	121.2	67.7	1.2	0	0	0	0	0	114.3
389	A	33.1	Very low	28.5	Very low	94 Å²	94	124.8 Å²	124.8	78%	0.777	72%	0.719	S	S	*	*			trans	-160.7	121.8	158.8	0	0	0	0	0	107.7
390	N	28.5	Very low	28.4	Very low	142 Å²	142	121.1 Å²	121.1	76%	0.759	71%	0.708	S	S	*	*			cis	93.3	140.8	37.9	-68.4	-22.4	0	0	0	113.7
391	N	28.8	Very low	28.5	Very low	128 Å²	128	119.2 Å²	119.2	68%	0.684	70%	0.698	S	S	*	*			trans	67.9	144.5	174	-59.7	-19	0	0	0	116.5	R647	N391-R647 PolarHBondContact OD1-NH2 3.45Å
392	E	28.7	Very low	28.5	Very low	121 Å²	121	120 Å²	120	57%	0.565	70%	0.698	S	S	*	*			cis	-147	131.9	-11.9	-111.6	168.4	152.6	0	0	108.5	R647	E392-R647 IonicContact OE1-CZ 2.83Å; E392-R647 IonicContact OE1-NH1 2.77Å; E392-R647 PolarHBondContact OE1-NH1 2.99Å; E392-R647 IonicContact OE1-NH2 3.91Å; E392-R647 PolarHBondContact OE1-NH2 2.85Å
393	V	28.1	Very low	28.6	Very low	127 Å²	127	117 Å²	117	77%	0.77	69%	0.685	S	S	*	*				49	95.9	97.4	-172.6	0	0	0	0	114.2
394	S	27.1	Very low	28.4	Very low	107 Å²	107	117.6 Å²	117.6	75%	0.748	68%	0.684	S	S	*	*			trans	-170.8	109.1	132.9	-110.6	0	0	0	0	113.6
395	T	25.5	Very low	28.3	Very low	118 Å²	118	117.5 Å²	117.5	72%	0.724	69%	0.686	S	S	*	*			trans	2.3	129.7	140.2	54.9	0	0	0	0	119.1
396	T	26.9	Very low	28.1	Very low	145 Å²	145	114.7 Å²	114.7	89%	0.89	68%	0.683	S	S	*	*				-176.2	165.7	118.1	20.5	0	0	0	0	113.1
397	E	24.4	Very low	28.1	Very low	189 Å²	189	117.8 Å²	117.8	88%	0.883	70%	0.699	S	S	*	*			trans	-70.7	140.1	-174.5	-54.3	159.3	156.8	0	0	114.3
398	A	28.2	Very low	28.1	Very low	90 Å²	90	116.7 Å²	116.7	74%	0.744	70%	0.696	S	S	*	*			trans	-156.3	116.9	146.6	0	0	0	0	0	106.5
399	V	26.6	Very low	28.1	Very low	137 Å²	137	122.4 Å²	122.4	83%	0.83	71%	0.706	S	S	*	*				59	116.1	67.6	-176.5	0	0	0	0	111.9
400	S	30.9	Very low	27.9	Very low	88 Å²	88	120.5 Å²	120.5	62%	0.615	70%	0.695	S	S	*	*			trans	-44.4	152.9	175.6	-161.9	0	0	0	0	113.4	N402	S400-N402 PolarHBondContact OG-N 3.05Å
401	P	30.8	Very low	27.9	Very low	66 Å²	66	120.6 Å²	120.6	43%	0.429	69%	0.692	S	S	.	*				-127.7	158.6	88	38.3	-32.6	0	0	0	114	K1405 S1406	P401-K1405 HydrophobicContact CB-CG 4.49Å; P401-K1405 HydrophobicContact CG-CD 4.38Å; P401-K1405 HydrophobicContact CG-CG 3.81Å; P401-S1406 WeakPolarHBondContact CB-OG 3.21Å
402	N	27.6	Very low	27.8	Very low	120 Å²	120	117.6 Å²	117.6	64%	0.642	69%	0.685	S	S	*	*			trans	-33.6	163.2	143.3	-67.7	10.9	0	0	0	111.1	S400	S400-N402 PolarHBondContact OG-N 3.05Å
403	E	30.1	Very low	27.9	Very low	77 Å²	77	118.3 Å²	118.3	36%	0.36	69%	0.686	S	S	.	*			cis	-156.2	133	49.6	-42.2	177.2	166.5	0	0	110.2	P1404 K1405 S1406	E403-P1404 HydrophobicContact CB-CB 3.93Å; E403-P1404 HydrophobicContact CG-CB 3.93Å; E403-P1404 WeakPolarHBondContact O-CG 3.2Å; E403-P1404 WeakPolarHBondContact OE2-CA 3.36Å; E403-K1405 VanDerWaalsContact OE1-C 3.23Å; E403-K1405 WeakPolarHBondContact OE1-CA 3.13Å; E403-K1405 PolarHBondContact OE1-N 2.73Å; E403-K1405 PolarHBondContact OE2-N 3.27Å; E403-S1406 PolarHBondContact OE1-N 3.08Å
404	T	25.8	Very low	28	Very low	104 Å²	104	118.1 Å²	118.1	64%	0.638	68%	0.68	S	S	*	*			trans	26.9	105.7	137.2	59.6	0	0	0	0	118.8	G1403	T404-G1403 PolarHBondContact O-N 3.23Å
405	E	28.2	Very low	28.1	Very low	133 Å²	133	118.4 Å²	118.4	62%	0.621	67%	0.673	S	S	*	*				-117	121.4	126.9	-59.2	-135.9	138.7	0	0	107.1	P1402	E405-P1402 HydrophobicContact CB-CB 4.49Å; E405-P1402 HydrophobicContact CG-CB 3.96Å; E405-P1402 VanDerWaalsContact OE1-CB 3.28Å; E405-P1402 WeakPolarHBondContact OE1-CB 3.44Å; E405-P1402 VanDerWaalsContact OE1-CG 3.27Å; E405-P1402 WeakPolarHBondContact OE1-CG 3.41Å
406	S	24.6	Very low	28.4	Very low	97 Å²	97	117.9 Å²	117.9	68%	0.678	67%	0.666	S	S	*	*			trans	-95.2	119.3	-174.1	51.6	0	0	0	0	111.3
407	V	29.2	Very low	28.4	Very low	141 Å²	141	116.2 Å²	116.2	86%	0.855	66%	0.656	S	S	*	*			trans	-102.5	103.5	150.6	-179.9	0	0	0	0	105.4	E409	V407-E409 PolarHBondContact O-N 2.9Å
408	E	28.3	Very low	28.7	Very low	164 Å²	164	114.4 Å²	114.4	77%	0.766	64%	0.642	S	S	*	*			trans	-67.8	103.2	178.5	-68.4	175.5	136.2	0	0	108.9	G410	E408-G410 PolarHBondContact O-N 3.17Å
409	E	28.8	Very low	28.7	Very low	183 Å²	183	112.8 Å²	112.8	86%	0.855	63%	0.634	S	S	*	*			trans	-63.6	89.7	154.1	-68.6	-176	132	0	0	106.5	V407 E411	V407-E409 PolarHBondContact O-N 2.9Å; E409-E411 PolarHBondContact O-N 2.91Å
410	G	28.4	Very low	28.8	Very low	53 Å²	53	112.9 Å²	112.9	55%	0.546	63%	0.626	S	S	.	*			trans	-67.8	84.8	179	0	0	0	0	0	109.9	E408 A412	E408-G410 PolarHBondContact O-N 3.17Å; G410-A412 PolarHBondContact O-N 2.8Å; G410-A412 VanDerWaalsContact O-N 3.09Å
411	E	28	Very low	28.5	Very low	145 Å²	145	117 Å²	117	68%	0.678	64%	0.635	S	S	*	*			trans	-44.8	116.4	169	-64.3	-178.2	134.6	0	0	108.8	E409 K413	E409-E411 PolarHBondContact O-N 2.91Å; E411-K413 HydrophobicContact CB-CG 4.07Å; E411-K413 PolarHBondContact O-N 2.66Å; E411-K413 WeakPolarHBondContact OE2-CE 3.23Å; E411-K413 IonicContact OE2-NZ 3.3Å
412	A	28.1	Very low	28.4	Very low	65 Å²	65	119 Å²	119	54%	0.537	65%	0.65	S	S	.	*			trans	-71.5	82.9	161.4	0	0	0	0	0	106.6	G410 D414	G410-A412 PolarHBondContact O-N 2.8Å; G410-A412 VanDerWaalsContact O-N 3.09Å; A412-D414 VanDerWaalsContact C-N 3.31Å; A412-D414 PolarHBondContact O-N 2.79Å
413	K	30.1	Very low	28.4	Very low	136 Å²	136	120 Å²	120	59%	0.591	65%	0.651	S	S	*	*			trans	-65.9	98	167.6	-65.6	-164.2	177.9	-165.4	0	107.4	E411 D415	E411-K413 HydrophobicContact CB-CG 4.07Å; E411-K413 PolarHBondContact O-N 2.66Å; E411-K413 WeakPolarHBondContact OE2-CE 3.23Å; E411-K413 IonicContact OE2-NZ 3.3Å; K413-D415 PolarHBondContact O-N 3Å
414	D	31.3	Very low	28.5	Very low	122 Å²	122	125.2 Å²	125.2	65%	0.652	68%	0.676	S	S	*	*			trans	-67.6	73.3	155.3	-71.8	-45	0	0	0	107.3	A412 D416	A412-D414 VanDerWaalsContact C-N 3.31Å; A412-D414 PolarHBondContact O-N 2.79Å; D414-D416 PolarHBondContact O-N 2.73Å
415	D	29.3	Very low	28.7	Very low	113 Å²	113	127.2 Å²	127.2	60%	0.604	68%	0.683	S	S	*	*			trans	-68.1	76.2	167.6	-85.9	-48.2	0	0	0	108.1	K413 T417	K413-D415 PolarHBondContact O-N 3Å; D415-T417 PolarHBondContact O-N 2.79Å
416	D	31.4	Very low	28.7	Very low	107 Å²	107	129 Å²	129	57%	0.572	69%	0.691	S	S	*	*			trans	-68.6	45.5	157	-95.1	-36.5	0	0	0	110.1	D414 Y418	D414-D416 PolarHBondContact O-N 2.73Å; D416-Y418 PolarHBondContact O-N 3.35Å
417	T	26.7	Very low	28.9	Very low	111 Å²	111	127.6 Å²	127.6	68%	0.681	69%	0.692	S	S	*	*			trans	-75.2	79.5	156.6	-61.2	0	0	0	0	106.6	D415 G419	D415-T417 PolarHBondContact O-N 2.79Å; T417-G419 PolarHBondContact O-N 2.77Å
418	Y	30.2	Very low	28.7	Very low	151 Å²	151	127.1 Å²	127.1	59%	0.592	69%	0.689	S	S	*	*			trans	-63.6	92.5	156.4	-113.7	-91	0	0	0	107.2	D416 I1668	D416-Y418 PolarHBondContact O-N 3.35Å; Y418-I1668 HydrophobicContact CE1-CG1 4.4Å; Y418-I1668 HydrophobicContact CE2-CG1 4.36Å; Y418-I1668 HydrophobicContact CE2-CG2 4.14Å
419	G	28.4	Very low	28.7	Very low	56 Å²	56	126.2 Å²	126.2	58%	0.577	69%	0.689	S	S	*	*			trans	-56.8	141.9	174.5	0	0	0	0	0	110.4	T417	T417-G419 PolarHBondContact O-N 2.77Å
420	E	28.2	Very low	28.5	Very low	139 Å²	139	125 Å²	125	65%	0.65	68%	0.683	S	S	*	*			trans	-59	147.3	-175	-61.1	-176.1	121	0	0	111.9	S422	E420-S422 PolarHBondContact O-N 2.88Å
421	E	25.4	Very low	28.3	Very low	175 Å²	175	130.1 Å²	130.1	82%	0.818	69%	0.693	S	S	*	*			trans	-60.7	98.9	170.6	-65.1	-178.1	132.2	0	0	110	E423	E421-E423 VanDerWaalsContact C-N 3.31Å; E421-E423 PolarHBondContact O-N 2.92Å
422	S	28.8	Very low	28.2	Very low	106 Å²	106	125.3 Å²	125.3	74%	0.741	68%	0.675	S	S	*	*			trans	-74.1	83.1	177.7	60.6	0	0	0	0	110.8	E420 E424	E420-S422 PolarHBondContact O-N 2.88Å; S422-E424 PolarHBondContact O-N 2.89Å
423	E	27.4	Very low	28.1	Very low	141 Å²	141	126.3 Å²	126.3	66%	0.659	68%	0.678	S	S	*	*			trans	-59.4	98.8	165.2	-67.6	-178	96	0	0	109.3	K19 E421 N425	K19-E423 IonicContact NZ-OE2 2.7Å; K19-E423 PolarHBondContact NZ-OE2 2.81Å; E421-E423 VanDerWaalsContact C-N 3.31Å; E421-E423 PolarHBondContact O-N 2.92Å; E423-N425 VanDerWaalsContact C-N 3.33Å; E423-N425 PolarHBondContact O-N 2.97Å
424	E	31.2	Very low	27.8	Very low	188 Å²	188	123.7 Å²	123.7	88%	0.879	68%	0.677	S	S	*	*			trans	-66.9	86.1	175.7	-74.1	-165	144.1	0	0	111.6	S422	S422-E424 PolarHBondContact O-N 2.89Å
425	N	30.9	Very low	27.6	Very low	146 Å²	146	124.3 Å²	124.3	78%	0.781	68%	0.676	S	S	*	*			trans	-149.3	104.2	164.5	-92.9	-52.7	0	0	0	110.3	E423	E423-N425 VanDerWaalsContact C-N 3.33Å; E423-N425 PolarHBondContact O-N 2.97Å
426	E	27.4	Very low	27.5	Very low	169 Å²	169	123.8 Å²	123.8	79%	0.79	67%	0.673	S	S	*	*			trans	174.7	84.1	134.7	-98.9	-63.8	130.1	0	0	113.1
427	G	29.2	Very low	27.4	Very low	69 Å²	69	127 Å²	127	71%	0.711	69%	0.685	S	S	*	*			trans	67.2	-161	138.9	0	0	0	0	0	120.4
428	V	26.2	Very low	27.5	Very low	131 Å²	131	125.8 Å²	125.8	79%	0.794	69%	0.686	S	S	*	*			trans	69.6	121.5	-175.7	-171.5	0	0	0	0	114.9
429	L	26.7	Very low	27.4	Very low	144 Å²	144	125.6 Å²	125.6	75%	0.754	70%	0.695	S	S	*	*			cis	-171.7	-179.3	-26.1	-119.8	165.4	0	0	0	107.6
430	E	25.6	Very low	27.3	Very low	159 Å²	159	127.1 Å²	127.1	74%	0.743	70%	0.697	S	S	*	*			trans	71.6	142.9	163.2	-42	-156.4	164.7	0	0	117.6
431	E	24.9	Very low	27.2	Very low	160 Å²	160	125.4 Å²	125.4	75%	0.748	70%	0.701	S	S	*	*			cis	-157.5	175.6	-17.6	-123.2	-162.5	175.9	0	0	112.5
432	S	24.8	Very low	27.3	Very low	43 Å²	43	127.5 Å²	127.5	30%	0.301	70%	0.701	S	S	.	*			trans	72	99.6	148.1	70.8	0	0	0	0	120.4
433	S	25	Very low	27.3	Very low	86 Å²	86	128.6 Å²	128.6	60%	0.601	69%	0.694	S	S	*	*				56.1	127.3	120	64	0	0	0	0	123.6	L50	L50-S433 WeakPolarHBondContact CD1-O 3.34Å
434	S	25.7	Very low	27.3	Very low	81 Å²	81	127.5 Å²	127.5	57%	0.566	70%	0.697	S	S	*	*			trans	79.7	118	139.6	45.6	0	0	0	0	121.8	L50	L50-S434 WeakPolarHBondContact CD1-O 3.31Å
435	E	26.8	Very low	27.2	Very low	135 Å²	135	124 Å²	124	63%	0.631	69%	0.689	S	S	*	*				85.4	128.5	128.3	-69	-171.8	-156.5	0	0	122.1	R51	R51-E435 PolarHBondContact NH1-O 3.4Å
436	N	26.8	Very low	27	Very low	102 Å²	102	123.3 Å²	123.3	55%	0.545	69%	0.685	S	S	.	*				55.3	142.6	124.4	-49.6	-18.1	0	0	0	122.4
437	E	28.7	Very low	27.1	Very low	174 Å²	174	119.5 Å²	119.5	81%	0.813	68%	0.677	S	S	*	*			trans	62.2	153.6	165.6	-57.4	-53.3	100.7	0	0	117
438	A	28.7	Very low	27	Very low	86 Å²	86	122.9 Å²	122.9	71%	0.711	68%	0.679	S	S	*	*			cis	-152.6	177.9	-22.8	0	0	0	0	0	109.9
439	D	28.1	Very low	27.1	Very low	148 Å²	148	124 Å²	124	79%	0.791	68%	0.675	S	S	*	*			trans	-78.6	151.6	-175.4	-150.4	-18.7	0	0	0	113.9
440	S	27.2	Very low	27.1	Very low	88 Å²	88	124.2 Å²	124.2	62%	0.615	67%	0.672	S	S	*	*			trans	61.5	109.1	151.5	71.1	0	0	0	0	122.2
441	S	26.3	Very low	27.1	Very low	103 Å²	103	120.4 Å²	120.4	72%	0.72	66%	0.663	S	S	*	*				77.5	142.3	123.9	79.5	0	0	0	0	122.3
442	R	27.6	Very low	27.2	Very low	218 Å²	218	119.8 Å²	119.8	82%	0.823	66%	0.66	S	S	*	*			trans	68.6	154.4	154.2	-77.1	-166.1	150.3	117.3	0.2	118.3
443	E	27.2	Very low	27.3	Very low	130 Å²	130	124.8 Å²	124.8	61%	0.607	68%	0.676	S	S	*	*			cis	-175.4	139.7	-30.1	-134	178.4	149.6	0	0	105.3
444	T	27.3	Very low	27.4	Very low	117 Å²	117	129.8 Å²	129.8	72%	0.718	69%	0.687	S	S	*	*			trans	66	158.7	162.9	73.1	0	0	0	0	117.6
445	V	29.8	Very low	27.6	Very low	115 Å²	115	129 Å²	129	70%	0.697	69%	0.686	S	S	*	*			cis	-164.1	165.9	-21.4	131.2	0	0	0	0	107.7
446	D	27.4	Very low	27.8	Very low	132 Å²	132	129.3 Å²	129.3	71%	0.706	69%	0.692	S	S	*	*			trans	71.4	101.5	160.7	-86.2	-41.8	0	0	0	120.9
447	S	28.4	Very low	27.9	Very low	88 Å²	88	129.8 Å²	129.8	62%	0.615	70%	0.695	S	S	*	*				71.7	147.6	101.9	-64	0	0	0	0	122.8
448	N	27.2	Very low	28	Very low	140 Å²	140	127.9 Å²	127.9	75%	0.749	69%	0.689	S	S	*	*			trans	79.9	133.9	145.8	-83	-31.8	0	0	0	119.3
449	Q	28.4	Very low	28	Very low	155 Å²	155	130 Å²	130	72%	0.724	69%	0.688	S	S	*	*			trans	72.1	148.4	157.8	-60.9	171.3	115	0	0	116
450	Q	27.1	Very low	28	Very low	149 Å²	149	129.3 Å²	129.3	70%	0.696	68%	0.68	S	S	*	*			cis	-159.4	147.7	-18.5	-120.8	165.1	20	0	0	109.3
451	S	25.7	Very low	28	Very low	78 Å²	78	128.8 Å²	128.8	55%	0.545	68%	0.676	S	S	.	*			trans	48.9	135.6	138.8	80.9	0	0	0	0	122
452	Q	26.6	Very low	28.2	Very low	147 Å²	147	131.7 Å²	131.7	69%	0.687	68%	0.676	S	S	*	*			trans	72.6	157.5	139.9	-68.1	167.2	46.2	0	0	116.3
453	K	27.4	Very low	28.1	Very low	148 Å²	148	126.3 Å²	126.3	64%	0.643	67%	0.672	S	S	*	*			cis	-160.2	141	1.6	-125.6	158.8	-174	155.6	0	108.8
454	K	27.3	Very low	28	Very low	191 Å²	191	124.6 Å²	124.6	83%	0.83	67%	0.674	S	S	*	*			trans	67	158.4	145.7	-74.4	176.6	179	-169.3	0	117
455	A	30.1	Very low	28	Very low	66 Å²	66	128.3 Å²	128.3	55%	0.545	68%	0.681	S	S	.	*			cis	-162.7	150.4	-2.9	0	0	0	0	0	112.6
456	N	29.9	Very low	27.8	Very low	141 Å²	141	128.4 Å²	128.4	75%	0.754	68%	0.681	S	S	*	*			trans	65.4	152.8	142.5	-57.7	2.4	0	0	0	117.6
457	N	29.9	Very low	27.7	Very low	111 Å²	111	129 Å²	129	59%	0.594	68%	0.68	S	S	*	*			cis	-167.8	175.4	-7.2	-97.9	-8.4	0	0	0	107.3
458	L	30	Very low	27.6	Very low	135 Å²	135	132.4 Å²	132.4	71%	0.707	68%	0.683	S	S	*	*			cis	-148.6	162.5	-0.3	-152.7	75.8	0	0	0	112
459	L	29.7	Very low	27.5	Very low	130 Å²	130	130.3 Å²	130.3	68%	0.681	68%	0.675	S	S	*	*			trans	-32.7	172.2	146.5	-50.7	172.2	0	0	0	117
460	E	26.6	Very low	27.4	Very low	133 Å²	133	125.8 Å²	125.8	62%	0.621	66%	0.661	S	S	*	*			cis	-160.1	136.3	0.3	-132	-179.9	129.3	0	0	115.4	K462	E460-K462 IonicContact OE1-NZ 2.76Å; E460-K462 PolarHBondContact OE1-NZ 3.2Å
461	S	28.1	Very low	27.3	Very low	77 Å²	77	124.9 Å²	124.9	54%	0.538	67%	0.666	S	S	.	*			trans	43.5	155.4	130.2	85.1	0	0	0	0	127.6
462	K	29.7	Very low	27.4	Very low	165 Å²	165	125.6 Å²	125.6	72%	0.717	67%	0.671	S	S	*	*			trans	82.1	107.3	136.1	-80.9	163.2	-140	133.2	0	121.6	E460	E460-K462 IonicContact OE1-NZ 2.76Å; E460-K462 PolarHBondContact OE1-NZ 3.2Å
463	S	25.5	Very low	27.4	Very low	105 Å²	105	123.2 Å²	123.2	73%	0.734	67%	0.67	S	S	*	*				124.7	115.7	102.4	-153.9	0	0	0	0	120.8
464	S	26.5	Very low	27.4	Very low	94 Å²	94	122.4 Å²	122.4	66%	0.657	68%	0.678	S	S	*	*				67.6	114.2	128.6	71.3	0	0	0	0	125
465	K	26.8	Very low	27.4	Very low	195 Å²	195	118.1 Å²	118.1	85%	0.848	67%	0.672	S	S	*	*				86	159	111.2	-165.6	-167.9	179.9	-174.3	0	119.8
466	V	25.7	Very low	27.5	Very low	116 Å²	116	118.8 Å²	118.8	70%	0.703	67%	0.667	S	S	*	*			trans	82.5	93.5	169.9	-170.2	0	0	0	0	113.6
467	Q	25.6	Very low	27.6	Very low	146 Å²	146	124 Å²	124	68%	0.682	68%	0.676	S	S	*	*				87	136.5	81.5	-88.9	-166.2	18.9	0	0	115.7
468	K	26.1	Very low	27.8	Very low	158 Å²	158	123.1 Å²	123.1	69%	0.687	68%	0.675	S	S	*	*			trans	69.5	156	152.5	-69.1	169.4	176.5	155.4	0	116.9
469	T	25.6	Very low	27.9	Very low	96 Å²	96	121 Å²	121	59%	0.589	68%	0.676	S	S	*	*			cis	-159.5	153.5	-9.9	20.8	0	0	0	0	110.3	Y1414	T469-Y1414 WeakPolarHBondContact CB-OH 3.3Å; T469-Y1414 WeakPolarHBondContact CG2-OH 3.22Å
470	S	25.3	Very low	28.1	Very low	61 Å²	61	119.3 Å²	119.3	43%	0.427	68%	0.681	S	S	.	*			trans	54	146.1	145.8	62.5	0	0	0	0	123.7	Y1414	S470-Y1414 PolarHBondContact N-OH 3.21Å
471	T	25.8	Very low	28.4	Very low	129 Å²	129	120.9 Å²	120.9	79%	0.791	69%	0.688	S	S	*	*			trans	65	148.4	147.6	46.8	0	0	0	0	119.6
472	S	26.3	Very low	28.7	Very low	93 Å²	93	120.7 Å²	120.7	65%	0.65	70%	0.699	S	S	*	*			cis	-172.4	163.9	-20.4	49.1	0	0	0	0	110.2
473	S	26.8	Very low	29	Very low	97 Å²	97	120.7 Å²	120.7	68%	0.678	70%	0.699	S	S	*	*			trans	32.4	140.8	142.2	67.4	0	0	0	0	121.2
474	T	27.5	Very low	29.3	Very low	131 Å²	131	124.2 Å²	124.2	80%	0.804	70%	0.696	S	S	*	*			cis	-172.5	164.4	27.9	-13.7	0	0	0	0	113.6
475	S	27.2	Very low	29.4	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	69%	0.693	S	S	*	*			trans	58.7	107.6	143.4	-158.5	0	0	0	0	123.9
476	N	33.5	Very low	29.5	Very low	80 Å²	80	125.4 Å²	125.4	43%	0.428	69%	0.687	S	S	.	*				0.6	145.5	123.8	-75.5	-64.1	0	0	0	121.3	K701	N476-K701 PolarHBondContact ND2-O 3.03Å
477	R	31.4	Very low	29.6	Very low	249 Å²	249	125.9 Å²	125.9	94%	0.94	69%	0.69	S	S	*	*				-151.9	173.5	116.4	-140.6	172.7	177.4	159.5	0.5	112.6
478	V	33.4	Very low	29.5	Very low	94 Å²	94	126.9 Å²	126.9	57%	0.57	69%	0.694	S	S	*	*			trans	-150	144.7	-161.7	175.4	0	0	0	0	113.1	K701	V478-K701 HydrophobicContact CG2-CD 4.2Å
479	A	32.8	Very low	29.5	Very low	89 Å²	89	124 Å²	124	74%	0.736	69%	0.69	S	S	*	*			trans	-147.7	141.8	151.5	0	0	0	0	0	106.9
480	A	33.8	Very low	29.8	Very low	96 Å²	96	125.1 Å²	125.1	79%	0.793	69%	0.692	S	S	*	*			cis	81.3	136.8	43.7	0	0	0	0	0	112.4
481	E	32.8	Very low	30.2	Very low	165 Å²	165	126.6 Å²	126.6	77%	0.771	70%	0.7	S	S	*	*			cis	-128.3	163.7	9.6	-53.3	-171.1	120.5	0	0	112.7	K483	E481-K483 IonicContact OE2-NZ 2.7Å; E481-K483 PolarHBondContact OE2-NZ 3.47Å
482	G	35.1	Very low	30.3	Very low	73 Å²	73	125.6 Å²	125.6	75%	0.753	69%	0.694	S	S	*	*				114.6	157.8	91.2	0	0	0	0	0	111.2
483	K	35.8	Very low	30.4	Very low	166 Å²	166	127.7 Å²	127.7	72%	0.722	70%	0.698	S	S	*	*			cis	-163.1	142.9	-4.2	-102.5	164.1	179.2	141.4	0	110.3	E481	E481-K483 IonicContact OE2-NZ 2.7Å; E481-K483 PolarHBondContact OE2-NZ 3.47Å
484	R	31.5	Very low	30.3	Very low	179 Å²	179	128.8 Å²	128.8	68%	0.675	70%	0.7	S	S	*	*			trans	68.3	152	163.1	-60	176.5	174.8	-179.1	-1.2	117.6	S625	R484-S625 CarbonylContact C-O 3.52Å; R484-S625 VanDerWaalsContact O-CB 3.29Å; R484-S625 WeakPolarHBondContact O-CB 3Å
485	R	29.6	Very low	30.2	Very low	159 Å²	159	129.4 Å²	129.4	60%	0.6	70%	0.698	S	S	*	*			cis	-161.2	176.8	-13.6	-108.1	179.7	177.1	173.5	-3.3	112.9	N624 S625	R485-N624 CarbonylContact O-C 3.57Å; R485-N624 VanDerWaalsContact O-C 3.31Å; R485-S625 PolarHBondContact N-O 3.16Å; R485-S625 PolarHBondContact O-N 2.91Å
486	H	27.7	Very low	30.5	Very low	155 Å²	155	131.6 Å²	131.6	72%	0.718	70%	0.701	S	S	*	*			trans	-26.2	168.9	175.1	-55.8	-100.1	0	0	0	120.2
487	V	27.1	Very low	30.4	Very low	125 Å²	125	132.9 Å²	132.9	76%	0.758	71%	0.713	S	S	*	*			cis	-157.7	175.2	47.4	177.1	0	0	0	0	113.1
488	E	23.6	Very low	30	Very low	167 Å²	167	128.7 Å²	128.7	78%	0.78	71%	0.707	S	S	*	*			trans	-53.9	150.1	180	-64.1	145.9	141.8	0	0	118.6
489	V	27.2	Very low	29.7	Very low	99 Å²	99	128.5 Å²	128.5	60%	0.6	71%	0.71	S	S	*	*				84.3	117.9	87.6	-176.5	0	0	0	0	118	M604	V489-M604 HydrophobicContact CG1-CE 3.93Å; V489-M604 HydrophobicContact CG2-CE 4.47Å
490	L	30.6	Very low	29.3	Very low	119 Å²	119	129.9 Å²	129.9	62%	0.623	71%	0.709	S	S	*	*			trans	51.4	-157.9	159.6	-59.9	170.5	0	0	0	117.9
491	P	35.1	Very low	29	Very low	92 Å²	92	133.2 Å²	133.2	60%	0.597	71%	0.708	S	S	*	*				-129.3	169.4	-99.4	40.9	-25	0	0	0	117.9
492	T	28.1	Very low	28.9	Very low	108 Å²	108	132.8 Å²	132.8	66%	0.663	70%	0.704	S	S	*	*			trans	72	134	159.9	12.4	0	0	0	0	121.4
493	D	28.2	Very low	28.7	Very low	137 Å²	137	135.7 Å²	135.7	73%	0.733	70%	0.702	S	S	*	*			trans	47.5	148.7	148.6	-67.2	-28	0	0	0	124.6
494	T	25.1	Very low	28.6	Very low	119 Å²	119	133 Å²	133	73%	0.73	69%	0.692	S	S	*	*			trans	128.9	94.5	136.7	-48.8	0	0	0	0	117.3
495	L	25.6	Very low	28.6	Very low	144 Å²	144	131.4 Å²	131.4	75%	0.754	69%	0.692	S	S	*	*			trans	65	118.7	142.2	-59.7	173.9	0	0	0	123.7
496	L	32.6	Very low	28.5	Very low	149 Å²	149	131.8 Å²	131.8	78%	0.78	69%	0.694	S	S	*	*			trans	73.1	160.6	130.6	-66.6	177.6	0	0	0	119.5
497	P	30.8	Very low	28.9	Very low	106 Å²	106	127.9 Å²	127.9	69%	0.688	70%	0.695	S	S	*	*			cis	-134.4	157.6	15.1	42.3	-25.5	0	0	0	119.4
498	M	24.3	Very low	29.4	Very low	162 Å²	162	128.4 Å²	128.4	80%	0.798	70%	0.701	S	S	*	*			trans	61.7	149.5	138	-70.9	177.2	65	0	0	123.8
499	S	25.3	Very low	29.6	Very low	90 Å²	90	128.2 Å²	128.2	63%	0.629	70%	0.704	S	S	*	*			trans	78.9	112.2	153.4	-60.1	0	0	0	0	119.7
500	T	25.7	Very low	30.4	Very low	117 Å²	117	131.3 Å²	131.3	72%	0.718	72%	0.717	S	S	*	*			trans	47.1	137.8	131.3	57	0	0	0	0	119.9
501	E	27.4	Very low	30.4	Very low	166 Å²	166	131.6 Å²	131.6	78%	0.776	73%	0.726	S	S	*	*			cis	-154.8	-168.1	27.6	-143	143.9	-131.1	0	0	113.6
502	F	30.2	Very low	30.5	Very low	156 Å²	156	133.4 Å²	133.4	68%	0.684	74%	0.735	S	S	*	*			trans	-49.8	162.7	-176.1	-79.5	-126.6	0	0	0	115.5	H504	F502-H504 AromaticContact CD1-CD2 3.7Å; F502-H504 AromaticContact CE1-CD2 3.97Å; F502-H504 AromaticContact CE1-NE2 3.82Å
503	D	31.8	Very low	30.8	Very low	134 Å²	134	133.7 Å²	133.7	72%	0.717	74%	0.739	S	S	*	*			cis	-151.1	144.7	41.2	-103.6	-50.6	0	0	0	116.6
504	H	33.9	Very low	30.9	Very low	111 Å²	111	133.3 Å²	133.3	51%	0.514	74%	0.741	S	S	.	*				29.8	141.1	120.8	-80.2	-91.5	0	0	0	121.7	F502	F502-H504 AromaticContact CD1-CD2 3.7Å; F502-H504 AromaticContact CE1-CD2 3.97Å; F502-H504 AromaticContact CE1-NE2 3.82Å
505	E	31	Very low	30.9	Very low	145 Å²	145	135.1 Å²	135.1	68%	0.678	75%	0.746	S	S	*	*			cis	-145.6	137.8	12.4	-75.8	-119.8	112	0	0	111.5
506	R	27.4	Very low	31.1	Very low	167 Å²	167	134.2 Å²	134.2	63%	0.63	75%	0.747	S	S	*	*				72	129.4	81.8	-61	-170.9	178.2	-161.7	-0.8	118.3
507	G	36.8	Very low	30.7	Very low	72 Å²	72	131.9 Å²	131.9	74%	0.742	74%	0.735	S	S	*	*			trans	-88.5	-139.5	165.5	0	0	0	0	0	113
508	P	35.9	Very low	30.5	Very low	137 Å²	137	136.6 Å²	136.6	89%	0.89	74%	0.739	S	S	*	*			cis	-149.7	-143.5	37.5	45.1	-22.3	0	0	0	115.6
509	L	28.7	Very low	30.6	Very low	162 Å²	162	137.2 Å²	137.2	85%	0.848	73%	0.732	S	S	*	*			trans	-92.5	175.6	-168.4	-71.1	160.8	0	0	0	116.2
510	L	44.7	Very low	30.6	Very low	164 Å²	164	140.8 Å²	140.8	86%	0.859	74%	0.739	S	S	*	*			trans	-45.1	157	178.8	-61.6	165.6	0	0	0	117.7
511	P	29.9	Very low	30.7	Very low	125 Å²	125	141.8 Å²	141.8	81%	0.812	74%	0.739	S	S	*	*				-140.5	164.7	124.2	40.3	-29.3	0	0	0	116.2
512	T	36.5	Very low	30.7	Very low	131 Å²	131	142.9 Å²	142.9	80%	0.804	74%	0.736	S	S	*	*			trans	-86	-177.8	163.9	56.9	0	0	0	0	111.1
513	P	34.1	Very low	30.5	Very low	114 Å²	114	142.5 Å²	142.5	74%	0.74	74%	0.735	S	S	*	*			cis	-131.9	-158.2	-3.4	43.3	-24.4	0	0	0	113.7
514	V	30.2	Very low	30.2	Very low	128 Å²	128	145.3 Å²	145.3	78%	0.776	74%	0.735	S	S	*	*			trans	-14.3	128.4	160.7	178.1	0	0	0	0	117.5
515	D	25	Very low	29.9	Very low	157 Å²	157	147.3 Å²	147.3	84%	0.84	75%	0.75	S	S	*	*				-161.5	167.8	125.9	-134.7	-30.9	0	0	0	114
516	V	29.8	Very low	29.8	Very low	125 Å²	125	145.2 Å²	145.2	76%	0.758	76%	0.757	S	S	*	*			trans	-117.7	101.1	-176.7	-178.9	0	0	0	0	113
517	D	25	Very low	29.8	Very low	100 Å²	100	140.1 Å²	140.1	54%	0.535	76%	0.757	S	S	.	*			trans	-168.7	141.8	144.5	-121	14.4	0	0	0	107.5	R519	D517-R519 IonicContact OD1-NH2 3.13Å; D517-R519 IonicContact OD2-CZ 3.21Å; D517-R519 VanDerWaalsContact OD2-CZ 3.3Å; D517-R519 IonicContact OD2-NE 3.87Å; D517-R519 PolarHBondContact OD2-NE 3Å; D517-R519 IonicContact OD2-NH2 3.91Å; D517-R519 PolarHBondContact OD2-NH2 2.91Å
518	R	27.2	Very low	29.5	Very low	206 Å²	206	142.8 Å²	142.8	78%	0.777	75%	0.754	S	S	*	*			cis	62.9	82	36.4	-170.7	-153.1	-159.5	-169	8.7	112.7
519	R	25	Very low	29.2	Very low	174 Å²	174	141.8 Å²	141.8	66%	0.657	74%	0.741	S	S	*	*				-178.5	128.2	128.5	-101	162.8	-87.3	-158.9	-3.5	115.1	D517	D517-R519 IonicContact OD1-NH2 3.13Å; D517-R519 IonicContact OD2-CZ 3.21Å; D517-R519 VanDerWaalsContact OD2-CZ 3.3Å; D517-R519 IonicContact OD2-NE 3.87Å; D517-R519 PolarHBondContact OD2-NE 3Å; D517-R519 IonicContact OD2-NH2 3.91Å; D517-R519 PolarHBondContact OD2-NH2 2.91Å
520	H	27.2	Very low	29.2	Very low	165 Å²	165	141.3 Å²	141.3	76%	0.764	74%	0.738	S	S	*	*			trans	70.4	148.8	150.7	-54.7	-27.2	0	0	0	115.5
521	L	27.5	Very low	28.3	Very low	138 Å²	138	138.3 Å²	138.3	72%	0.723	73%	0.731	S	S	*	*			cis	-139.6	131.2	47.5	-77.6	142.3	0	0	0	115.4
522	R	25.8	Very low	28.3	Very low	190 Å²	190	138.6 Å²	138.6	72%	0.717	73%	0.725	S	S	*	*			trans	75.2	132.3	143.2	-62.6	172.3	-175.8	-177.3	4.2	117.7
523	F	27.3	Very low	28	Very low	148 Å²	148	141.2 Å²	141.2	65%	0.649	73%	0.726	S	S	*	*			cis	-151.4	141.2	-2.1	-108.1	-46.4	0	0	0	113.2
524	R	26.1	Very low	27.8	Very low	193 Å²	193	141.9 Å²	141.9	73%	0.728	73%	0.73	S	S	*	*			trans	67.9	110	147.5	-78.1	165.9	172.8	164.4	-3.4	120.5
525	N	26.2	Very low	27.8	Very low	153 Å²	153	139.4 Å²	139.4	82%	0.818	73%	0.73	S	S	*	*				56	142.1	114.5	-56.8	17.2	0	0	0	119.4
526	A	29	Very low	27.8	Very low	101 Å²	101	138 Å²	138	84%	0.835	73%	0.731	S	S	*	*			cis	-170	163.9	-13	0	0	0	0	0	106
527	G	28.5	Very low	27.7	Very low	60 Å²	60	136 Å²	136	62%	0.619	73%	0.728	S	S	*	*			cis	166.9	171.1	0.4	0	0	0	0	0	108.1
528	N	29	Very low	27.8	Very low	128 Å²	128	137.6 Å²	137.6	68%	0.684	74%	0.741	S	S	*	*			trans	66.1	145.7	168.1	-68.2	52.6	0	0	0	116.6
529	D	29.7	Very low	28	Very low	116 Å²	116	132.5 Å²	132.5	62%	0.62	74%	0.744	S	S	*	*			cis	-149.6	166.2	-4.9	-100.8	-33.2	0	0	0	111.8
530	L	28.9	Very low	28.5	Very low	151 Å²	151	129.7 Å²	129.7	79%	0.791	75%	0.748	S	S	*	*			trans	19.3	149.4	145.1	-60.9	160.8	0	0	0	120.3
531	S	27.4	Very low	28.5	Very low	101 Å²	101	130.4 Å²	130.4	71%	0.706	75%	0.751	S	S	*	*			cis	-179.3	177.2	-0.3	51.9	0	0	0	0	107.9
532	L	28.8	Very low	28.6	Very low	132 Å²	132	131.9 Å²	131.9	69%	0.691	76%	0.758	S	S	*	*			cis	-161.1	149.9	-31.8	-104.2	171	0	0	0	109.9
533	F	31.2	Very low	29	Very low	185 Å²	185	127.2 Å²	127.2	81%	0.811	75%	0.752	S	S	*	*			trans	61.9	162.3	163	-66.3	-52.2	0	0	0	121.2
534	P	29.9	Very low	29	Very low	129 Å²	129	127.4 Å²	127.4	84%	0.838	76%	0.76	S	S	*	*			cis	-104.1	157.8	-11.6	37.4	-28.4	0	0	0	113.6
535	G	29.2	Very low	29.1	Very low	75 Å²	75	124.2 Å²	124.2	77%	0.773	76%	0.762	S	S	*	*			trans	-123.4	156.4	-171.9	0	0	0	0	0	115.1
536	C	26.1	Very low	29	Very low	128 Å²	128	124.8 Å²	124.8	87%	0.865	76%	0.764	S	S	*	*			trans	-89.1	155.1	-172.3	-67.2	0	0	0	0	115.3
537	A	27.2	Very low	28.9	Very low	83 Å²	83	128.9 Å²	128.9	69%	0.686	77%	0.766	S	S	*	*			trans	60.6	134.3	138.3	0	0	0	0	0	123.1
538	T	27.4	Very low	28.7	Very low	133 Å²	133	129 Å²	129	82%	0.816	76%	0.761	S	S	*	*			trans	65	90.7	144	51.3	0	0	0	0	121.8
539	A	30.8	Very low	28.5	Very low	100 Å²	100	127.3 Å²	127.3	83%	0.826	77%	0.765	S	S	*	*			trans	63.6	175.9	144.2	0	0	0	0	0	118.5
540	P	35.1	Very low	28.2	Very low	114 Å²	114	126.5 Å²	126.5	74%	0.74	77%	0.774	S	S	*	*			cis	-127	-177.8	-14.9	39.4	-22.6	0	0	0	115
541	H	28.6	Very low	28.1	Very low	180 Å²	180	125.6 Å²	125.6	83%	0.833	77%	0.769	S	S	*	*			trans	28.6	128.5	156.3	-80.9	-78	0	0	0	123.4
542	I	28.1	Very low	28.1	Very low	170 Å²	170	125.9 Å²	125.9	87%	0.872	76%	0.761	S	S	*	*			trans	-164.7	156.3	130.8	-106.4	157.8	0	0	0	110.2
543	P	34.2	Very low	27.9	Very low	92 Å²	92	125.7 Å²	125.7	60%	0.597	77%	0.77	S	S	*	*			trans	-132.6	-172.4	-144.4	45.4	-31.6	0	0	0	118.2
544	N	28	Very low	27.7	Very low	151 Å²	151	119.1 Å²	119.1	81%	0.807	76%	0.755	S	S	*	*			trans	89.7	160	153	-66.4	-14.3	0	0	0	121.3
545	V	27.4	Very low	27.6	Very low	126 Å²	126	120.9 Å²	120.9	76%	0.764	76%	0.757	S	S	*	*			trans	91.2	86.6	162.2	-165.4	0	0	0	0	118.5
546	L	25.6	Very low	27.9	Very low	166 Å²	166	123 Å²	123	87%	0.869	76%	0.758	S	S	*	*			trans	60	165.6	131.5	-87.6	72.4	0	0	0	122.5
547	E	26	Very low	28.5	Very low	186 Å²	186	122.4 Å²	122.4	87%	0.869	75%	0.752	S	S	*	*			trans	68.1	93.4	165.9	-135.3	158.4	-143.5	0	0	115.4
548	A	24.6	Very low	28.5	Very low	63 Å²	63	123.4 Å²	123.4	52%	0.521	76%	0.755	S	S	.	*				89.4	142.7	52.2	0	0	0	0	0	114.4	S767	A548-S767 WeakPolarHBondContact CB-O 3.38Å
549	A	24.2	Very low	28.6	Very low	93 Å²	93	123.7 Å²	123.7	77%	0.769	75%	0.751	S	S	*	*			trans	64.9	145.8	177.4	0	0	0	0	0	119.8
550	A	24.5	Very low	28.8	Very low	98 Å²	98	128.9 Å²	128.9	81%	0.81	76%	0.755	S	S	*	*			trans	65.9	60.8	153.3	0	0	0	0	0	121.1
551	L	25.1	Very low	28.7	Very low	132 Å²	132	128.9 Å²	128.9	69%	0.691	76%	0.755	S	S	*	*	S	Bend	trans	-128.6	114.2	137.7	-90.4	179.2	0	0	0	113
552	M	28.1	Very low	28.6	Very low	108 Å²	108	125 Å²	125	53%	0.532	75%	0.748	S	S	.	*			trans	64	58	155.5	-50.1	-49.7	-65.2	0	0	118.8	G554	M552-G554 PolarHBondContact O-N 3.34Å
553	S	25.7	Very low	28.7	Very low	127 Å²	127	125 Å²	125	89%	0.888	75%	0.746	S	S	*	*				-55.1	94.1	128.3	36.6	0	0	0	0	108.7
554	G	25.8	Very low	28.5	Very low	47 Å²	47	126.5 Å²	126.5	49%	0.485	75%	0.749	S	S	.	*			trans	-128.3	16.7	-148.2	0	0	0	0	0	118.8	M552	M552-G554 PolarHBondContact O-N 3.34Å
555	L	28.3	Very low	28.4	Very low	167 Å²	167	125.2 Å²	125.2	87%	0.874	75%	0.749	S	S	*	*			trans	62.1	104.1	159.6	-57.4	175.4	0	0	0	119.6
556	C	34.7	Very low	28.3	Very low	120 Å²	120	123 Å²	123	81%	0.811	74%	0.74	S	S	*	*				-13.5	164.8	119.9	-109.3	0	0	0	0	117.4
557	P	40.2	Very low	28.6	Very low	114 Å²	114	123 Å²	123	74%	0.74	74%	0.74	S	S	*	*			cis	-147	164	24.5	39.8	-19.8	0	0	0	118.8
558	S	27.1	Very low	28.7	Very low	105 Å²	105	120.7 Å²	120.7	73%	0.734	73%	0.733	S	S	*	*	S	Bend		175.2	139.9	117.3	61.6	0	0	0	0	109.7
559	L	27.7	Very low	28.8	Very low	139 Å²	139	124.9 Å²	124.9	73%	0.728	75%	0.746	S	S	*	*			cis	-133.7	128.3	4.1	-69	168.3	0	0	0	111.8
560	F	35.7	Very low	28.8	Very low	209 Å²	209	127.4 Å²	127.4	92%	0.917	75%	0.746	S	S	*	*			trans	-118.8	144.4	142	-91.5	-79.9	0	0	0	106.8
561	P	32.8	Very low	29.1	Very low	114 Å²	114	129.2 Å²	129.2	74%	0.74	75%	0.748	S	S	*	*				-142.1	166.7	106.6	21.2	0.4	0	0	0	112.5
562	S	26.9	Very low	29.2	Very low	99 Å²	99	130.9 Å²	130.9	69%	0.692	76%	0.757	S	S	*	*			cis	-169.6	-177.4	-8.8	47.4	0	0	0	0	109.2
563	M	29.5	Very low	29.1	Very low	169 Å²	169	137.3 Å²	137.3	83%	0.833	78%	0.775	S	S	*	*			trans	80.8	135.4	167.9	-50.5	-162.2	81	0	0	116.7
564	N	30.1	Very low	29.8	Very low	123 Å²	123	136.8 Å²	136.8	66%	0.658	77%	0.77	S	S	*	*			cis	-159.9	113.9	-14.7	-176.9	22.4	0	0	0	111.3
565	P	26.8	Very low	29.9	Very low	124 Å²	124	140.6 Å²	140.6	81%	0.805	79%	0.786	S	S	*	*			trans	-102.8	91.8	177.1	35.5	-27.8	0	0	0	112.5
566	S	25.8	Very low	30	Very low	81 Å²	81	137.5 Å²	137.5	57%	0.566	78%	0.776	S	S	*	*			trans	-158.8	91	170.8	-77.4	0	0	0	0	111.6
567	N	32.2	Very low	29.6	Very low	164 Å²	164	135.1 Å²	135.1	88%	0.877	76%	0.758	S	S	*	*			trans	165.2	74.7	169.1	-90.8	-16	0	0	0	104.6
568	L	26.3	Very low	28.8	Very low	138 Å²	138	133.5 Å²	133.5	72%	0.723	74%	0.743	S	S	*	*			cis	60.6	97.5	45.6	-92.1	173.2	0	0	0	113.7
569	L	27.2	Very low	28.7	Very low	152 Å²	152	136.2 Å²	136.2	80%	0.796	74%	0.742	S	S	*	*			trans	70.2	158.1	156.6	-61.7	166.2	0	0	0	118.4
570	N	25.1	Very low	28.6	Very low	145 Å²	145	133.7 Å²	133.7	78%	0.775	74%	0.741	S	S	*	*			trans	64.9	110.1	-175.3	-56.8	-20.7	0	0	0	114.6
571	T	30.4	Very low	28.8	Very low	137 Å²	137	129.4 Å²	129.4	84%	0.84	73%	0.734	S	S	*	*			cis	-139.1	116.1	14	32.3	0	0	0	0	113.6
572	L	27.9	Very low	28.6	Very low	167 Å²	167	128.8 Å²	128.8	87%	0.874	73%	0.73	S	S	*	*			trans	-83.6	125.7	144.9	-82.3	168.8	0	0	0	108.1
573	R	24.8	Very low	28.5	Very low	242 Å²	242	133 Å²	133	91%	0.913	74%	0.737	S	S	*	*			trans	162.8	145.5	132.1	-90	165.5	-179.9	-175.3	-0.6	112
574	C	40.1	Very low	28.4	Very low	117 Å²	117	130 Å²	130	79%	0.791	73%	0.731	S	S	*	*			trans	-76.4	174.5	174.8	-40.5	0	0	0	0	111.5
575	P	28.5	Very low	28.2	Very low	126 Å²	126	129.4 Å²	129.4	82%	0.818	73%	0.728	S	S	*	*				-113.4	167.5	123.1	-9.6	28.5	0	0	0	113.1
576	P	30.2	Very low	28.2	Very low	103 Å²	103	126.7 Å²	126.7	67%	0.669	71%	0.706	S	S	*	*			trans	-117.7	-173.3	-171.4	29.2	-7.9	0	0	0	114.5
577	V	25.9	Very low	28.4	Very low	69 Å²	69	127.3 Å²	127.3	42%	0.418	70%	0.698	S	S	.	*			trans	69.4	104.4	157.8	-83.1	0	0	0	0	121.5	Q1842 P1843	V577-Q1842 WeakPolarHBondContact CG2-O 3.29Å; V577-P1843 HydrophobicContact CG2-CB 3.99Å; V577-P1843 VanDerWaalsContact O-CB 3.3Å; V577-P1843 WeakPolarHBondContact O-CB 3.19Å; V577-P1843 VanDerWaalsContact O-CD 3.23Å; V577-P1843 WeakPolarHBondContact O-CD 3.31Å; V577-P1843 WeakPolarHBondContact O-CG 3.33Å
578	D	24	Very low	28.4	Very low	80 Å²	80	126.7 Å²	126.7	43%	0.428	70%	0.695	S	S	.	*				91.3	171.3	103.6	-151.6	7.6	0	0	0	120.7	Q1841 Q1842	D578-Q1841 WeakPolarHBondContact OD2-CA 3.37Å; D578-Q1841 PolarHBondContact OD2-N 2.86Å; D578-Q1842 VanDerWaalsContact C-NE2 3.3Å; D578-Q1842 VanDerWaalsContact CG-CD 3.49Å; D578-Q1842 PolarHBondContact O-NE2 2.81Å; D578-Q1842 PolarHBondContact OD1-OE1 2.92Å; D578-Q1842 PolarHBondContact OD2-N 2.81Å; D578-Q1842 PolarHBondContact OD2-OE1 3.46Å; D578-Q1842 VanDerWaalsContact OD2-OE1 3.1Å
579	F	24.8	Very low	29	Very low	162 Å²	162	127.2 Å²	127.2	71%	0.711	70%	0.698	S	S	*	*			trans	91.1	102	-169.2	-87.3	-42.9	0	0	0	119.2	Q1842	F579-Q1842 VanDerWaalsContact CD2-CD 3.45Å; F579-Q1842 HydrophobicContact CD2-CG 4.33Å; F579-Q1842 HydrophobicContact CE1-CG 4.17Å; F579-Q1842 HydrophobicContact CE2-CG 3.95Å; F579-Q1842 VanDerWaalsContact CG-CD 3.4Å; F579-Q1842 VanDerWaalsContact CG-OE1 3.24Å; F579-Q1842 HydrophobicContact CZ-CG 3.85Å; F579-Q1842 VanDerWaalsContact N-OE1 3.08Å
580	A	25.5	Very low	29.5	Very low	87 Å²	87	122.6 Å²	122.6	72%	0.719	68%	0.677	S	S	*	*			trans	63.8	143.3	135.9	0	0	0	0	0	122.8
581	P	39.7	Very low	30	Very low	119 Å²	119	121 Å²	121	77%	0.773	67%	0.668	S	S	*	*			trans	-92.8	168.1	173.5	42.3	-38.3	0	0	0	112
582	P	30.1	Very low	30.4	Very low	101 Å²	101	118.9 Å²	118.9	66%	0.656	66%	0.657	S	S	*	*				-156	170.7	89.1	43.9	-26.1	0	0	0	117.5
583	F	24.7	Very low	31.1	Very low	188 Å²	188	115.7 Å²	115.7	83%	0.825	64%	0.64	S	S	*	*			trans	57.8	125.1	163	-61.5	-60.8	0	0	0	118.4
584	C	26.5	Very low	32	Very low	105 Å²	105	108.2 Å²	108.2	71%	0.709	62%	0.615	S	S	*	*				66.4	134.9	71.7	-59.9	0	0	0	0	112.7
585	D	26.2	Very low	32.2	Very low	111 Å²	111	106 Å²	106	59%	0.594	60%	0.595	S	S	*	*			cis	-149.2	-159.3	22.8	-123.6	-39.9	0	0	0	113.2	Q994	D585-Q994 PolarHBondContact OD2-NE2 2.7Å
586	L	26.5	Very low	32.8	Very low	67 Å²	67	105.5 Å²	105.5	35%	0.351	58%	0.582	S	S	.	*			trans	86.6	59.1	155.5	-49.3	-179.2	0	0	0	119.9	K992 I993	L586-K992 HydrophobicContact CB-CD 4.42Å; L586-K992 PolarHBondContact O-NZ 2.92Å; L586-I993 HydrophobicContact CD2-CB 3.7Å; L586-I993 HydrophobicContact CD2-CG2 3.41Å; L586-I993 VanDerWaalsContact CD2-CG2 3.41Å
587	F	30.9	Very low	33.4	Very low	93 Å²	93	104.8 Å²	104.8	41%	0.408	57%	0.568	S	S	.	*				166	137.5	98.9	-108	-102	0	0	0	114.5	K992 I993	F587-K992 HydrophobicContact CD2-CB 4.24Å; F587-K992 HydrophobicContact CD2-CD 3.57Å; F587-K992 VanDerWaalsContact CD2-CE 3.48Å; F587-K992 HydrophobicContact CD2-CG 3.67Å; F587-K992 HydrophobicContact CE2-CB 3.56Å; F587-K992 HydrophobicContact CE2-CD 3.82Å; F587-K992 HydrophobicContact CE2-CG 3.39Å; F587-K992 HydrophobicContact CG-CD 4.42Å; F587-K992 HydrophobicContact CZ-CB 4.23Å; F587-K992 HydrophobicContact CZ-CG 4.04Å; F587-I993 HydrophobicContact CD1-CD1 4.44Å; F587-I993 HydrophobicContact CD2-CD1 4.28Å; F587-I993 HydrophobicContact CE1-CD1 3.84Å; F587-I993 HydrophobicContact CE1-CG1 4.28Å; F587-I993 HydrophobicContact CE2-CB 3.63Å; F587-I993 HydrophobicContact CE2-CD1 3.61Å; F587-I993 HydrophobicContact CE2-CG1 3.7Å; F587-I993 HydrophobicContact CZ-CB 3.87Å; F587-I993 HydrophobicContact CZ-CD1 3.38Å; F587-I993 HydrophobicContact CZ-CG1 3.42Å; F587-I993 VanDerWaalsContact CZ-CG1 3.42Å
588	N	31.9	Very low	34	Very low	152 Å²	152	105.8 Å²	105.8	81%	0.813	57%	0.568	S	S	*	*			trans	-114.6	145	167.7	-65.6	-52.8	0	0	0	110.3
589	L	38.7	Very low	35	Very low	148 Å²	148	106.3 Å²	106.3	78%	0.775	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-101.2	150.1	154.7	-79.4	166.6	0	0	0	108.8
590	P	36.4	Very low	35.6	Very low	56 Å²	56	102.9 Å²	102.9	36%	0.364	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-74.1	150.1	-170.9	-16.3	31.9	0	0	0	113.9	E594 I595	P590-E594 HydrophobicContact CB-CB 4.16Å; P590-I595 HydrophobicContact CB-CG1 4.18Å
591	N	36.5	Very low	36.1	Very low	110 Å²	110	103.1 Å²	103.1	59%	0.588	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-61.8	141.7	171.1	-166.5	-10.4	0	0	0	110	I593 E594 I595	N591-I593 PolarHBondContact O-N 2.72Å; N591-I593 VanDerWaalsContact O-N 3.1Å; N591-E594 HydrophobicContact CB-CB 4.41Å; N591-E594 VanDerWaalsContact O-CA 3.3Å; N591-E594 WeakPolarHBondContact O-CA 3.34Å; N591-E594 WeakPolarHBondContact O-CB 3.38Å; N591-E594 PolarHBondContact O-N 3.43Å; N591-I595 PolarHBondContact O-N 2.69Å; N591-I595 VanDerWaalsContact O-N 3.09Å
592	P	38.2	Very low	35.8	Very low	94 Å²	94	104.5 Å²	104.5	61%	0.61	56%	0.555	S	S	*	*	H	α-helix	trans	-57.3	-29.6	-175.5	-31.2	38	0	0	0	115.7	E594 I595 Q596	P592-E594 PolarHBondContact O-N 2.95Å; P592-I595 PolarHBondContact O-N 3.49Å; P592-Q596 PolarHBondContact O-N 2.76Å
593	I	43.3	Very low	35.9	Very low	100 Å²	100	108 Å²	108	51%	0.513	56%	0.56	S	S	.	*	H	α-helix	trans	-65.1	-31.2	172.1	-64.6	173.2	0	0	0	111.4	N591 K597	N591-I593 PolarHBondContact O-N 2.72Å; N591-I593 VanDerWaalsContact O-N 3.1Å; I593-K597 WeakPolarHBondContact O-CG 3.5Å; I593-K597 PolarHBondContact O-N 3.05Å; I593-K597 VanDerWaalsContact O-N 3.08Å
594	E	43.9	Very low	36	Very low	84 Å²	84	104.7 Å²	104.7	39%	0.393	55%	0.548	S	S	.	.	H	α-helix	trans	-78.2	-30.5	175	-146.4	61.3	-155.3	0	0	111.6	P590 N591 P592 K597 Q598	P590-E594 HydrophobicContact CB-CB 4.16Å; N591-E594 HydrophobicContact CB-CB 4.41Å; N591-E594 VanDerWaalsContact O-CA 3.3Å; N591-E594 WeakPolarHBondContact O-CA 3.34Å; N591-E594 WeakPolarHBondContact O-CB 3.38Å; N591-E594 PolarHBondContact O-N 3.43Å; P592-E594 PolarHBondContact O-N 2.95Å; E594-K597 PolarHBondContact O-N 3.49Å; E594-K597 WeakPolarHBondContact OE2-CD 3.08Å; E594-K597 IonicContact OE2-NZ 2.72Å; E594-K597 PolarHBondContact OE2-NZ 3.16Å; E594-Q598 WeakPolarHBondContact O-CB 3.3Å; E594-Q598 WeakPolarHBondContact O-CG 3.31Å; E594-Q598 PolarHBondContact O-N 3.21Å
595	I	43.2	Very low	36.2	Very low	72 Å²	72	106.7 Å²	106.7	37%	0.369	55%	0.552	S	S	.	*	H	α-helix	trans	-65.5	-44.3	169	-60.4	177.4	0	0	0	110.1	P590 N591 P592 K597 Q598 I599	P590-I595 HydrophobicContact CB-CG1 4.18Å; N591-I595 PolarHBondContact O-N 2.69Å; N591-I595 VanDerWaalsContact O-N 3.09Å; P592-I595 PolarHBondContact O-N 3.49Å; I595-K597 VanDerWaalsContact C-N 3.26Å; I595-K597 PolarHBondContact O-N 3.46Å; I595-Q598 PolarHBondContact O-N 2.8Å; I595-I599 HydrophobicContact CG2-CD1 3.98Å; I595-I599 HydrophobicContact CG2-CG1 4.45Å; I595-I599 WeakPolarHBondContact O-CG1 3.32Å; I595-I599 PolarHBondContact O-N 3.46Å
596	Q	41.9	Very low	36.2	Very low	115 Å²	115	107.5 Å²	107.5	54%	0.537	57%	0.565	S	S	.	*	H	α-helix	trans	-65.5	-29.5	176.1	-160.9	64.9	6.6	0	0	112.4	P592 N600	P592-Q596 PolarHBondContact O-N 2.76Å; Q596-N600 PolarHBondContact O-N 3.01Å; Q596-N600 PolarHBondContact O-ND2 2.81Å
597	K	42.6	Very low	36.4	Very low	88 Å²	88	110.3 Å²	110.3	38%	0.383	58%	0.576	S	S	.	*	H	α-helix	trans	-70.5	-43.1	167.2	-72.5	171.9	-168.8	165.3	0	112.2	I593 E594 I595 I599 N600 C601	I593-K597 WeakPolarHBondContact O-CG 3.5Å; I593-K597 PolarHBondContact O-N 3.05Å; I593-K597 VanDerWaalsContact O-N 3.08Å; E594-K597 PolarHBondContact O-N 3.49Å; E594-K597 WeakPolarHBondContact OE2-CD 3.08Å; E594-K597 IonicContact OE2-NZ 2.72Å; E594-K597 PolarHBondContact OE2-NZ 3.16Å; I595-K597 VanDerWaalsContact C-N 3.26Å; I595-K597 PolarHBondContact O-N 3.46Å; K597-I599 PolarHBondContact O-N 2.72Å; K597-N600 CarbonylContact O-C 3.57Å; K597-N600 PolarHBondContact O-N 3.32Å; K597-N600 VanDerWaalsContact O-N 3.14Å; K597-C601 WeakPolarHBondContact O-CB 3.5Å; K597-C601 PolarHBondContact O-N 3.04Å; K597-C601 PolarHBondContact O-SG 2.89Å
598	Q	37.7	Very low	36.3	Very low	89 Å²	89	111.3 Å²	111.3	42%	0.416	59%	0.592	S	S	.	*	H	α-helix	trans	-61.6	-41.3	178.2	-74.8	165	11	0	0	111.9	E594 I595 N600 C601 L602	E594-Q598 WeakPolarHBondContact O-CB 3.3Å; E594-Q598 WeakPolarHBondContact O-CG 3.31Å; E594-Q598 PolarHBondContact O-N 3.21Å; I595-Q598 PolarHBondContact O-N 2.8Å; Q598-N600 VanDerWaalsContact C-N 3.34Å; Q598-N600 PolarHBondContact O-N 3.35Å; Q598-C601 CarbonylContact O-C 3.52Å; Q598-C601 PolarHBondContact O-N 3.04Å; Q598-C601 VanDerWaalsContact O-N 3.15Å; Q598-L602 WeakPolarHBondContact O-CB 3.25Å; Q598-L602 VanDerWaalsContact O-CG 3.28Å; Q598-L602 WeakPolarHBondContact O-CG 3.21Å; Q598-L602 PolarHBondContact O-N 2.77Å
599	I	44.8	Very low	36.1	Very low	92 Å²	92	110.1 Å²	110.1	47%	0.472	59%	0.592	S	S	.	*	H	α-helix	trans	-61.1	-41.5	173	-68.4	168.2	0	0	0	111.2	I595 K597 L602	I595-I599 HydrophobicContact CG2-CD1 3.98Å; I595-I599 HydrophobicContact CG2-CG1 4.45Å; I595-I599 WeakPolarHBondContact O-CG1 3.32Å; I595-I599 PolarHBondContact O-N 3.46Å; K597-I599 PolarHBondContact O-N 2.72Å; I599-L602 PolarHBondContact O-N 2.92Å
600	N	38.3	Very low	35.7	Very low	89 Å²	89	107.8 Å²	107.8	48%	0.476	59%	0.589	S	S	.	*	H	α-helix	trans	-73	-24.7	175.1	-76.7	-62.3	0	0	0	113.6	Q596 K597 Q598	Q596-N600 PolarHBondContact O-N 3.01Å; Q596-N600 PolarHBondContact O-ND2 2.81Å; K597-N600 CarbonylContact O-C 3.57Å; K597-N600 PolarHBondContact O-N 3.32Å; K597-N600 VanDerWaalsContact O-N 3.14Å; Q598-N600 VanDerWaalsContact C-N 3.34Å; Q598-N600 PolarHBondContact O-N 3.35Å
601	C	37	Very low	35.4	Very low	92 Å²	92	114.5 Å²	114.5	62%	0.622	62%	0.615	S	S	*	*	H	α-helix	trans	-81.7	-19.2	172	-70.4	0	0	0	0	113.2	K597 Q598 K603 M604	K597-C601 WeakPolarHBondContact O-CB 3.5Å; K597-C601 PolarHBondContact O-N 3.04Å; K597-C601 PolarHBondContact O-SG 2.89Å; Q598-C601 CarbonylContact O-C 3.52Å; Q598-C601 PolarHBondContact O-N 3.04Å; Q598-C601 VanDerWaalsContact O-N 3.15Å; C601-K603 PolarHBondContact O-N 2.61Å; C601-M604 PolarHBondContact O-N 2.74Å; C601-M604 VanDerWaalsContact O-O 3.14Å
602	L	32.2	Very low	35	Very low	148 Å²	148	114.3 Å²	114.3	78%	0.775	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-0.7	175.7	-76.6	164.8	0	0	0	113.6	Q598 I599	Q598-L602 WeakPolarHBondContact O-CB 3.25Å; Q598-L602 VanDerWaalsContact O-CG 3.28Å; Q598-L602 WeakPolarHBondContact O-CG 3.21Å; Q598-L602 PolarHBondContact O-N 2.77Å; I599-L602 PolarHBondContact O-N 2.92Å
603	K	32	Very low	34.6	Very low	176 Å²	176	114.5 Å²	114.5	77%	0.765	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	26.7	169.2	-79.8	-172.1	174.3	178.9	0	114.2	C601	C601-K603 PolarHBondContact O-N 2.61Å
604	M	28.1	Very low	33.8	Very low	117 Å²	117	118.3 Å²	118.3	58%	0.576	64%	0.642	S	S	*	*	S	Bend	trans	-153.8	140.9	154	-90	-52.3	-176.9	0	0	111.6	V489 C601	V489-M604 HydrophobicContact CG1-CE 3.93Å; V489-M604 HydrophobicContact CG2-CE 4.47Å; C601-M604 PolarHBondContact O-N 2.74Å; C601-M604 VanDerWaalsContact O-O 3.14Å
605	N	29	Very low	32.9	Very low	147 Å²	147	119 Å²	119	79%	0.786	66%	0.656	S	S	*	*			trans	-26.9	134.4	176.9	-55.2	-32.2	0	0	0	117.6
606	C	26.5	Very low	32.2	Very low	129 Å²	129	124.5 Å²	124.5	87%	0.872	68%	0.677	S	S	*	*				-177.7	164.4	107.5	-103.8	0	0	0	0	116
607	H	31.1	Very low	31.5	Very low	125 Å²	125	124.8 Å²	124.8	58%	0.579	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-70.8	163.3	171.5	-75.7	-73.1	0	0	0	113	C683	H607-C683 VanDerWaalsContact CE1-SG 3.51Å; H607-C683 PolarHBondContact ND1-SG 2.78Å
608	P	29.4	Very low	30.8	Very low	115 Å²	115	124 Å²	124	75%	0.747	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-63	153.2	-175.3	24.4	-35.9	0	0	0	114.4
609	P	28.3	Very low	30.3	Very low	127 Å²	127	131.2 Å²	131.2	83%	0.825	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-79.3	157.7	-167.4	32.5	-37.3	0	0	0	114.2
610	S	30.3	Very low	29.6	Very low	99 Å²	99	130.7 Å²	130.7	69%	0.692	74%	0.736	S	S	*	*			trans	-127.3	119.3	159.4	57.5	0	0	0	0	109.4
611	E	28.7	Very low	29.2	Very low	196 Å²	196	133.6 Å²	133.6	92%	0.916	75%	0.745	S	S	*	*			trans	-73.4	134.1	178.9	-57.6	174.4	123.8	0	0	111.8
612	S	29	Very low	28.8	Very low	106 Å²	106	138 Å²	138	74%	0.741	75%	0.75	S	S	*	*				-170.5	133.5	128.2	59.3	0	0	0	0	112.1
613	S	28.4	Very low	28.6	Very low	98 Å²	98	137 Å²	137	69%	0.685	74%	0.741	S	S	*	*			trans	51.4	111	150.2	60.2	0	0	0	0	121
614	E	26.9	Very low	28.4	Very low	181 Å²	181	133.4 Å²	133.4	85%	0.846	73%	0.73	S	S	*	*				74.5	92.6	123.7	-60.7	-167.3	131.4	0	0	121.5
615	S	26.5	Very low	28.5	Very low	99 Å²	99	130.9 Å²	130.9	69%	0.692	72%	0.724	S	S	*	*				113.1	124.6	100.7	76.8	0	0	0	0	120
616	K	27.5	Very low	28.4	Very low	187 Å²	187	132.7 Å²	132.7	81%	0.813	72%	0.724	S	S	*	*			trans	61.7	114.8	139.1	-66.4	173.9	-178.7	173.1	0	120.2
617	S	26.5	Very low	28.5	Very low	121 Å²	121	133.8 Å²	133.8	85%	0.846	72%	0.72	S	S	*	*			trans	53.9	124.4	139	57.5	0	0	0	0	119.8
618	G	28.4	Very low	28.4	Very low	71 Å²	71	138.9 Å²	138.9	73%	0.732	73%	0.734	S	S	*	*			cis	119.5	165.1	2.3	0	0	0	0	0	113.4
619	R	28.3	Very low	28.3	Very low	240 Å²	240	136.5 Å²	136.5	91%	0.906	72%	0.721	S	S	*	*			trans	66.4	150.7	-175.1	-76.4	-163	162.9	172.7	-3	116.3
620	S	29.5	Very low	28.1	Very low	81 Å²	81	135 Å²	135	57%	0.566	71%	0.706	S	S	*	*			cis	-170.7	159.5	-23.6	66.2	0	0	0	0	114.8
621	K	30.4	Very low	28.1	Very low	151 Å²	151	136.4 Å²	136.4	66%	0.657	71%	0.71	S	S	*	*			trans	75.3	160.4	143.7	-76.2	172.8	-178.7	-168.7	0	120.8
622	Y	28.1	Very low	28	Very low	185 Å²	185	137.7 Å²	137.7	73%	0.725	71%	0.706	S	S	*	*			trans	73.5	130.2	162.3	-62.7	-68.9	0	0	0	118.3
623	E	27.9	Very low	27.9	Very low	125 Å²	125	138.1 Å²	138.1	58%	0.584	70%	0.697	S	S	*	*			cis	-168	158.6	-19.3	-135.6	-170.3	-150.4	0	0	113
624	N	28.2	Very low	27.8	Very low	102 Å²	102	140.3 Å²	140.3	55%	0.545	70%	0.699	S	S	.	*			trans	34.4	118.3	144.4	-70.6	-27.8	0	0	0	121.6	R485	R485-N624 CarbonylContact O-C 3.57Å; R485-N624 VanDerWaalsContact O-C 3.31Å
625	S	28.5	Very low	27.8	Very low	63 Å²	63	140.3 Å²	140.3	44%	0.441	69%	0.691	S	S	.	*				156.6	138.7	102.4	-66.9	0	0	0	0	117.7	R484 R485	R484-S625 CarbonylContact C-O 3.52Å; R484-S625 VanDerWaalsContact O-CB 3.29Å; R484-S625 WeakPolarHBondContact O-CB 3Å; R485-S625 PolarHBondContact N-O 3.16Å; R485-S625 PolarHBondContact O-N 2.91Å
626	K	28.9	Very low	27.8	Very low	185 Å²	185	139.4 Å²	139.4	80%	0.804	69%	0.685	S	S	*	*			trans	70.3	122.1	134.4	-80.2	175.7	176.4	166.8	0	124.6
627	I	26.8	Very low	27.8	Very low	153 Å²	153	133.3 Å²	133.3	79%	0.785	66%	0.664	S	S	*	*				104.7	123.3	129.7	-70.6	164.4	0	0	0	120.9
628	R	29.6	Very low	27.8	Very low	231 Å²	231	131.3 Å²	131.3	87%	0.872	64%	0.64	S	S	*	*			trans	-37.8	149.1	164.4	-63.5	165.5	156.7	147.5	-10.8	116.3
629	S	26.7	Very low	27.7	Very low	66 Å²	66	133.1 Å²	133.1	46%	0.462	63%	0.633	S	S	.	*				161.9	143	103.9	57.9	0	0	0	0	115.8	R700	S629-R700 PolarHBondContact OG-NH1 2.8Å; S629-R700 PolarHBondContact OG-NH2 2.95Å
630	D	25	Very low	27.7	Very low	96 Å²	96	131.7 Å²	131.7	51%	0.513	63%	0.633	S	S	.	*			trans	62.1	131.3	157.2	-42.9	-12.2	0	0	0	116.9	R700	D630-R700 IonicContact OD1-NE 3.84Å; D630-R700 IonicContact OD1-NH2 2.95Å; D630-R700 IonicContact OD2-CZ 2.69Å; D630-R700 IonicContact OD2-NE 3.21Å; D630-R700 PolarHBondContact OD2-NE 3.37Å; D630-R700 IonicContact OD2-NH2 3.26Å; D630-R700 PolarHBondContact OD2-NH2 3.35Å
631	V	31	Very low	27.5	Very low	128 Å²	128	135.1 Å²	135.1	78%	0.776	64%	0.64	S	S	*	*			cis	86.8	131.2	32.8	177.6	0	0	0	0	114.2
632	R	25.3	Very low	27.3	Very low	223 Å²	223	137.6 Å²	137.6	84%	0.842	65%	0.647	S	S	*	*			trans	74	151.5	-177	-73.4	-178.3	-156.4	165	5.2	116.4
633	E	26.6	Very low	27.3	Very low	115 Å²	115	135.4 Å²	135.4	54%	0.537	65%	0.647	S	S	.	*			cis	-177	140.6	-17.4	-166.1	-176	155.6	0	0	103.9	R635	E633-R635 IonicContact OE1-CZ 3.81Å; E633-R635 IonicContact OE1-NH1 2.67Å; E633-R635 PolarHBondContact OE1-NH1 2.64Å
634	I	26.6	Very low	27	Very low	143 Å²	143	136.6 Å²	136.6	73%	0.733	65%	0.654	S	S	*	*				175.7	124.8	91.1	-83.1	171.8	0	0	0	104.1
635	R	27.4	Very low	26.9	Very low	181 Å²	181	139.8 Å²	139.8	68%	0.683	66%	0.664	S	S	*	*			cis	92.7	150.2	45	-174.6	-170.9	-160.1	145.8	10.5	112.3	E633 E1464	E633-R635 IonicContact OE1-CZ 3.81Å; E633-R635 IonicContact OE1-NH1 2.67Å; E633-R635 PolarHBondContact OE1-NH1 2.64Å; R635-E1464 VanDerWaalsContact CA-OE1 3.31Å; R635-E1464 WeakPolarHBondContact CA-OE1 3.26Å; R635-E1464 WeakPolarHBondContact CG-OE1 3.3Å
636	S	26.1	Very low	26.7	Very low	81 Å²	81	142.8 Å²	142.8	57%	0.566	68%	0.679	S	S	*	*			trans	100.5	107.7	-178.7	-167.5	0	0	0	0	114.5	E1464	S636-E1464 PolarHBondContact N-OE1 3.17Å
637	T	28.4	Very low	26.5	Very low	59 Å²	59	140.9 Å²	140.9	36%	0.362	67%	0.667	S	S	.	*			cis	-147.7	131	9.8	56.8	0	0	0	0	114.7	S1461 S1462	T637-S1461 WeakPolarHBondContact OG1-CB 3.47Å; T637-S1461 PolarHBondContact OG1-OG 2.88Å; T637-S1462 PolarHBondContact N-O 2.58Å
638	F	27.2	Very low	26.6	Very low	79 Å²	79	141.9 Å²	141.9	35%	0.346	67%	0.668	S	S	.	*			trans	-91.4	-165.7	151.7	-148.4	-110.3	0	0	0	111.6	P1463 E1464 E1466	F638-P1463 HydrophobicContact CD2-CB 4.41Å; F638-P1463 HydrophobicContact CE2-CB 4.49Å; F638-E1464 HydrophobicContact CB-CB 4.03Å; F638-E1464 HydrophobicContact CB-CG 4.24Å; F638-E1464 WeakPolarHBondContact CB-OE2 3.31Å; F638-E1464 HydrophobicContact CD2-CB 4.39Å; F638-E1464 VanDerWaalsContact CD2-O 3.25Å; F638-E1464 WeakPolarHBondContact CD2-O 3.48Å; F638-E1464 WeakPolarHBondContact CE2-O 3.49Å; F638-E1464 PolarHBondContact N-OE2 3.11Å; F638-E1466 HydrophobicContact CE1-CG 3.79Å; F638-E1466 VanDerWaalsContact CE1-OE1 3.3Å; F638-E1466 WeakPolarHBondContact CE1-OE1 3.31Å; F638-E1466 HydrophobicContact CE2-CG 3.87Å; F638-E1466 HydrophobicContact CZ-CG 3.33Å; F638-E1466 WeakPolarHBondContact CZ-OE1 3.46Å
639	N	25.5	Very low	26.5	Very low	108 Å²	108	133.8 Å²	133.8	58%	0.578	66%	0.656	S	S	*	*			trans	74	94.7	160	-84.1	-73.3	0	0	0	118.5
640	K	27.9	Very low	26.6	Very low	210 Å²	210	138.1 Å²	138.1	91%	0.913	67%	0.674	S	S	*	*				-126.6	79.7	124.9	-84.4	-168	177.2	178	0	111.9
641	H	25.6	Very low	27	Very low	154 Å²	154	140.4 Å²	140.4	71%	0.713	69%	0.687	S	S	*	*			trans	-48.8	149.9	137.1	-92.9	-39.6	0	0	0	110.2
642	Y	26.1	Very low	26.9	Very low	203 Å²	203	138.9 Å²	138.9	80%	0.796	68%	0.682	S	S	*	*			trans	158.5	144.1	143.3	-85	-46.8	0	0	0	109.5
643	N	27.7	Very low	27.3	Very low	139 Å²	139	136.4 Å²	136.4	74%	0.743	68%	0.679	S	S	*	*			cis	-156.4	161.6	-16.6	-160.3	5.6	0	0	0	109.1
644	M	22.5	Very low	27.5	Very low	149 Å²	149	134 Å²	134	73%	0.734	68%	0.675	S	S	*	*			trans	-84.3	152.8	160.5	-122.7	-158.9	-170.8	0	0	110.7
645	K	24.8	Very low	27.7	Very low	169 Å²	169	131.6 Å²	131.6	74%	0.735	66%	0.661	S	S	*	*			trans	76	111.7	158.7	-66.1	172.3	-179.8	171.4	0	120.3
646	T	25	Very low	27.9	Very low	126 Å²	126	124.5 Å²	124.5	77%	0.773	64%	0.639	S	S	*	*				78.6	137.6	122.7	60.5	0	0	0	0	123.7
647	R	25	Very low	28.2	Very low	146 Å²	146	126 Å²	126	55%	0.551	64%	0.641	S	S	*	*			trans	90.4	117	143.6	-85	-175.4	174.3	159.5	5.8	120.6	N391 E392	N391-R647 PolarHBondContact OD1-NH2 3.45Å; E392-R647 IonicContact OE1-CZ 2.83Å; E392-R647 IonicContact OE1-NH1 2.77Å; E392-R647 PolarHBondContact OE1-NH1 2.99Å; E392-R647 IonicContact OE1-NH2 3.91Å; E392-R647 PolarHBondContact OE1-NH2 2.85Å
648	H	27.7	Very low	28.2	Very low	174 Å²	174	128 Å²	128	81%	0.806	66%	0.656	S	S	*	*			trans	52.8	143.5	151	-51.1	-68.7	0	0	0	119.8
649	G	28.6	Very low	28.4	Very low	60 Å²	60	129.4 Å²	129.4	62%	0.619	68%	0.676	S	S	*	*			cis	157.1	134.8	-8.4	0	0	0	0	0	112.4
650	N	28.6	Very low	28.8	Very low	157 Å²	157	130.2 Å²	130.2	84%	0.84	69%	0.69	S	S	*	*			trans	62.4	154	175.6	-58.4	11.3	0	0	0	113.9
651	D	33.6	Very low	28.9	Very low	145 Å²	145	124.3 Å²	124.3	78%	0.775	69%	0.688	S	S	*	*			cis	-134.2	171.8	36.6	-65.7	-48.4	0	0	0	115.6
652	S	29.8	Very low	29.2	Very low	96 Å²	96	121.8 Å²	121.8	67%	0.671	69%	0.688	S	S	*	*			trans	2.6	143.2	152.2	58.3	0	0	0	0	119.4
653	E	33.7	Very low	29.4	Very low	170 Å²	170	118.5 Å²	118.5	79%	0.794	68%	0.684	S	S	*	*			cis	-173.4	151.4	18.3	-124.7	163.4	-145.3	0	0	111.5
654	S	29.9	Very low	29.5	Very low	64 Å²	64	122 Å²	122	45%	0.448	69%	0.689	S	S	.	*				61.4	148.7	128.8	118.7	0	0	0	0	121.4
655	E	31	Very low	29.8	Very low	94 Å²	94	122.2 Å²	122.2	44%	0.439	69%	0.688	S	S	.	*			cis	-165.6	49	9.4	-95.8	-108.1	132.7	0	0	116.2	N1070 R1071	E655-N1070 PolarHBondContact OE1-ND2 2.9Å; E655-R1071 VanDerWaalsContact CA-NE 3.34Å; E655-R1071 VanDerWaalsContact CD-NH1 3.3Å; E655-R1071 PolarHBondContact O-NE 3.34Å; E655-R1071 PolarHBondContact O-NH1 2.75Å; E655-R1071 VanDerWaalsContact OE1-CD 3.31Å; E655-R1071 WeakPolarHBondContact OE1-CD 3.39Å; E655-R1071 IonicContact OE1-CZ 3.09Å; E655-R1071 IonicContact OE1-NE 3.41Å; E655-R1071 PolarHBondContact OE1-NE 3.29Å; E655-R1071 IonicContact OE1-NH1 3.79Å; E655-R1071 IonicContact OE1-NH2 2.67Å; E655-R1071 PolarHBondContact OE1-NH2 3.42Å; E655-R1071 IonicContact OE2-CZ 2.95Å; E655-R1071 IonicContact OE2-NE 3.79Å; E655-R1071 IonicContact OE2-NH1 2.8Å; E655-R1071 PolarHBondContact OE2-NH1 3.25Å; E655-R1071 IonicContact OE2-NH2 2.86Å; E655-R1071 PolarHBondContact OE2-NH2 2.97Å
656	S	32.3	Very low	30.2	Very low	31 Å²	31	118.9 Å²	118.9	22%	0.217	69%	0.692	C	S	.	*			trans	52.6	149.9	157.7	77.4	0	0	0	0	125.6	R1071	S656-R1071 VanDerWaalsContact OG-CZ 3.23Å; S656-R1071 PolarHBondContact OG-NE 2.82Å; S656-R1071 PolarHBondContact OG-NH1 3.07Å; S656-R1071 VanDerWaalsContact OG-NH1 3.15Å
657	N	31.1	Very low	30.4	Very low	113 Å²	113	119.1 Å²	119.1	60%	0.604	69%	0.688	S	S	*	*				143.2	148.4	105	-112.7	-5	0	0	0	118.4
658	C	28.1	Very low	30.6	Very low	102 Å²	102	117.5 Å²	117.5	69%	0.689	69%	0.694	S	S	*	*			trans	63	102.2	152.9	-65.6	0	0	0	0	124.6
659	S	31.5	Very low	30.8	Very low	107 Å²	107	115.9 Å²	115.9	75%	0.748	70%	0.696	S	S	*	*				63.7	113.9	116.8	-53.6	0	0	0	0	124.5
660	S	33.8	Very low	30.9	Very low	126 Å²	126	117 Å²	117	88%	0.881	69%	0.691	S	S	*	*			trans	57.9	119.6	133.8	63.7	0	0	0	0	122.5
661	G	30.5	Very low	31	Very low	85 Å²	85	120.2 Å²	120.2	88%	0.876	69%	0.691	S	S	*	*			trans	-161.6	148.9	157.3	0	0	0	0	0	109.9
662	S	31.6	Very low	30.8	Very low	101 Å²	101	122.7 Å²	122.7	71%	0.706	70%	0.696	S	S	*	*			trans	-109.9	164	-173.8	71.5	0	0	0	0	113.9
663	D	31	Very low	30.7	Very low	135 Å²	135	123 Å²	123	72%	0.722	70%	0.698	S	S	*	*			trans	61.2	126.8	162.1	-53.5	-64.5	0	0	0	118.7
664	Y	28.8	Very low	30.4	Very low	213 Å²	213	120.7 Å²	120.7	84%	0.835	70%	0.695	S	S	*	*				-168.5	170.8	107.2	-114.9	-86.8	0	0	0	112.5
665	Q	29.8	Very low	30.4	Very low	152 Å²	152	125.1 Å²	125.1	71%	0.71	71%	0.714	S	S	*	*			trans	-79.7	139.8	-161	-56.9	158.4	-13.2	0	0	115.5
666	A	33	Very low	30.1	Very low	99 Å²	99	131.7 Å²	131.7	82%	0.818	73%	0.734	S	S	*	*			trans	-159.1	78.2	145.9	0	0	0	0	0	110.1
667	N	28.9	Very low	30.6	Very low	131 Å²	131	135.7 Å²	135.7	70%	0.701	76%	0.76	S	S	*	*				54.6	107.6	94	-84.3	-28.3	0	0	0	117.7
668	V	29.1	Very low	30.5	Very low	112 Å²	112	136.4 Å²	136.4	68%	0.679	77%	0.77	S	S	*	*				61.9	117.5	124.3	-179.2	0	0	0	0	119.3	V670	V668-V670 HydrophobicContact CG1-CG2 4.19Å
669	V	32.5	Very low	30.5	Very low	140 Å²	140	136.9 Å²	136.9	85%	0.848	78%	0.775	S	S	*	*				-170.2	153.8	114.2	142.8	0	0	0	0	110
670	V	30.1	Very low	30.3	Very low	85 Å²	85	137.1 Å²	137.1	52%	0.515	78%	0.776	S	S	.	*				-166.1	144.8	-52.6	97.3	0	0	0	0	109.4	V668	V668-V670 HydrophobicContact CG1-CG2 4.19Å
671	R	30.3	Very low	29.9	Very low	223 Å²	223	138.1 Å²	138.1	84%	0.842	77%	0.772	S	S	*	*			trans	63	133.5	172.9	-60.7	156.8	-165.2	154	3.1	115.2
672	K	29.5	Very low	29.7	Very low	198 Å²	198	144.6 Å²	144.6	86%	0.861	77%	0.77	S	S	*	*			cis	75.4	126.7	45.9	-87.6	-166.7	172.8	-178.6	0	116.9
673	S	27.8	Very low	29.5	Very low	102 Å²	102	142.9 Å²	142.9	71%	0.713	76%	0.757	S	S	*	*			trans	81.4	118.5	138.1	59.7	0	0	0	0	122.3
674	V	28	Very low	29.2	Very low	122 Å²	122	142.7 Å²	142.7	74%	0.739	75%	0.754	S	S	*	*			trans	75.6	106.6	132.5	176.6	0	0	0	0	118.1
675	N	29.2	Very low	29	Very low	157 Å²	157	139.4 Å²	139.4	84%	0.84	75%	0.75	S	S	*	*				-161.8	173.6	104.8	-109	-53.4	0	0	0	114.2
676	R	26.4	Very low	28.7	Very low	232 Å²	232	141.2 Å²	141.2	88%	0.875	76%	0.758	S	S	*	*			trans	-80.9	161.5	-173.7	-97.5	180	159.8	175.4	-7.3	114.4
677	P	42.3	Very low	28.7	Very low	115 Å²	115	140.4 Å²	140.4	75%	0.747	75%	0.751	S	S	*	*			trans	-78.5	176	171.9	37.2	-37.9	0	0	0	112.1
678	P	28.5	Very low	28.7	Very low	128 Å²	128	139.4 Å²	139.4	83%	0.831	75%	0.752	S	S	*	*				-140.1	171.5	105.5	40.4	-29.6	0	0	0	115.1
679	S	29	Very low	28.5	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	76%	0.757	S	S	*	*			trans	-85.1	144.7	171.8	51.4	0	0	0	0	113.3
680	S	25.6	Very low	28.2	Very low	112 Å²	112	142 Å²	142	78%	0.783	75%	0.748	S	S	*	*			trans	-174.2	151.7	137	59.1	0	0	0	0	113
681	D	26.1	Very low	28	Very low	148 Å²	148	145.8 Å²	145.8	79%	0.791	76%	0.758	S	S	*	*			trans	-40.6	162.7	171.3	-45.7	-73.4	0	0	0	115.6
682	R	25.6	Very low	27.9	Very low	220 Å²	220	143.1 Å²	143.1	83%	0.83	76%	0.755	S	S	*	*				-174	159.6	59.3	-152.2	169.8	-170.9	168	2.3	113.8
683	C	27.2	Very low	27.8	Very low	65 Å²	65	138.7 Å²	138.7	44%	0.439	75%	0.749	S	S	.	*			trans	-75.2	159.6	174.2	-49.3	0	0	0	0	112.6	H607	H607-C683 VanDerWaalsContact CE1-SG 3.51Å; H607-C683 PolarHBondContact ND1-SG 2.78Å
684	M	25.1	Very low	28	Very low	132 Å²	132	137.4 Å²	137.4	65%	0.65	75%	0.752	S	S	*	*				179.4	168.5	89.4	-89.2	-85.1	77.5	0	0	113.5
685	L	25.6	Very low	28.1	Very low	144 Å²	144	140.5 Å²	140.5	75%	0.754	76%	0.755	S	S	*	*			trans	0.5	147.9	149.5	-63.3	163.3	0	0	0	119
686	E	24	Very low	28.2	Very low	189 Å²	189	141.7 Å²	141.7	88%	0.883	75%	0.753	S	S	*	*			cis	-146.9	172.6	48.5	-80	-159.8	132.6	0	0	115.9
687	A	31.1	Very low	28.4	Very low	82 Å²	82	134.8 Å²	134.8	68%	0.678	74%	0.741	S	S	*	*			trans	-90.9	171.8	169.4	0	0	0	0	0	112.4
688	P	30.2	Very low	28	Very low	110 Å²	110	134.4 Å²	134.4	71%	0.714	74%	0.736	S	S	*	*				-151.5	134.6	102.1	35.6	-17.4	0	0	0	118.1
689	K	24.8	Very low	28.2	Very low	181 Å²	181	132.4 Å²	132.4	79%	0.787	72%	0.722	S	S	*	*				36.4	111.1	121.6	-51.6	156.7	-173.4	161.2	0	118.7
690	N	26.4	Very low	28.4	Very low	125 Å²	125	133.7 Å²	133.7	67%	0.668	71%	0.71	S	S	*	*				167.6	115.6	112.6	-85.8	-41.8	0	0	0	109.6
691	K	25.5	Very low	28.8	Very low	165 Å²	165	133.5 Å²	133.5	72%	0.717	70%	0.695	S	S	*	*				88	149.4	74.7	-81.5	-173.8	-162.7	154.5	0	113.5
692	H	28.7	Very low	29.1	Very low	167 Å²	167	131.6 Å²	131.6	77%	0.773	69%	0.688	S	S	*	*			trans	81.3	137.2	168.2	-61	-74.4	0	0	0	118.1
693	S	27.6	Very low	29.3	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	69%	0.689	S	S	*	*			cis	-171.9	129.5	-43.8	34.4	0	0	0	0	113.2
694	G	30.4	Very low	29.3	Very low	74 Å²	74	134.3 Å²	134.3	76%	0.763	71%	0.705	S	S	*	*			trans	88.5	172.7	156.2	0	0	0	0	0	116.7
695	K	31.8	Very low	29.8	Very low	187 Å²	187	137.9 Å²	137.9	81%	0.813	72%	0.717	S	S	*	*			cis	-174	171.3	-17.1	-124.7	-177.8	-178.9	-177.4	0	109.6
696	F	29.9	Very low	30.1	Very low	182 Å²	182	139.2 Å²	139.2	80%	0.798	72%	0.722	S	S	*	*			trans	76.4	115.4	177.4	-54.6	-81.4	0	0	0	114
697	S	32.2	Very low	30.4	Very low	88 Å²	88	139.6 Å²	139.6	62%	0.615	72%	0.72	S	S	*	*			cis	81.7	152.6	44.7	87.8	0	0	0	0	113.4
698	T	32.9	Very low	30.4	Very low	106 Å²	106	142.9 Å²	142.9	65%	0.65	72%	0.72	S	S	*	*			cis	-166.8	115	38	-21	0	0	0	0	113.1
699	T	33.3	Very low	30.3	Very low	86 Å²	86	143.7 Å²	143.7	53%	0.528	71%	0.714	S	S	.	*			trans	54.7	176.1	132.9	71.6	0	0	0	0	123
700	R	33.4	Very low	30.4	Very low	139 Å²	139	142.2 Å²	142.2	53%	0.525	71%	0.71	S	S	.	*			cis	-170.7	-158	-41.3	-84.9	158	-151.3	158.1	19	104.8	S629 D630	S629-R700 PolarHBondContact OG-NH1 2.8Å; S629-R700 PolarHBondContact OG-NH2 2.95Å; D630-R700 IonicContact OD1-NE 3.84Å; D630-R700 IonicContact OD1-NH2 2.95Å; D630-R700 IonicContact OD2-CZ 2.69Å; D630-R700 IonicContact OD2-NE 3.21Å; D630-R700 PolarHBondContact OD2-NE 3.37Å; D630-R700 IonicContact OD2-NH2 3.26Å; D630-R700 PolarHBondContact OD2-NH2 3.35Å
701	K	32.3	Very low	30.3	Very low	107 Å²	107	144.4 Å²	144.4	47%	0.465	72%	0.716	S	S	.	*			cis	-166.5	131.4	6.1	-135.6	-156.3	-176.4	172.5	0	110.1	N476 V478	N476-K701 PolarHBondContact ND2-O 3.03Å; V478-K701 HydrophobicContact CG2-CD 4.2Å
702	V	33.1	Very low	30.5	Very low	108 Å²	108	141.5 Å²	141.5	66%	0.655	71%	0.714	S	S	*	*				41.3	137	117.3	176.4	0	0	0	0	120.5
703	K	29.8	Very low	30.3	Very low	195 Å²	195	139.7 Å²	139.7	85%	0.848	71%	0.714	S	S	*	*				179.2	136.5	105.6	-144.5	172.1	-175.7	-176.3	0	117.3
704	D	28.3	Very low	30.2	Very low	147 Å²	147	139 Å²	139	79%	0.786	71%	0.71	S	S	*	*			trans	-70.7	169.8	164	-45.9	-86.2	0	0	0	113.6
705	K	33.8	Very low	30	Very low	207 Å²	207	141.5 Å²	141.5	90%	0.9	71%	0.705	S	S	*	*			trans	-138.6	75.5	-174.6	-157.6	177.5	-174.8	-177.4	0	114.3
706	M	32.2	Very low	29.8	Very low	173 Å²	173	140.3 Å²	140.3	85%	0.852	70%	0.7	S	S	*	*			trans	-74.8	137.6	162.7	-78.6	-177.6	165.5	0	0	112.3	M32	M32-M706 HydrophobicContact CE-CE 4.45Å
707	K	31.8	Very low	29.7	Very low	196 Å²	196	138 Å²	138	85%	0.852	69%	0.692	S	S	*	*			trans	-173.4	157.5	156.4	-114.4	176.9	176	-176.5	0	106.1
708	K	30.4	Very low	29.7	Very low	152 Å²	152	140.1 Å²	140.1	66%	0.661	69%	0.692	S	S	*	*			cis	-165.9	128.6	24.2	-146.6	-158.8	169.3	-148.6	0	105.1
709	E	27.8	Very low	29.5	Very low	126 Å²	126	142.9 Å²	142.9	59%	0.589	70%	0.695	S	S	*	*				145.9	154.6	98.1	-75.1	-163.4	129.8	0	0	107.2
710	Q	26.9	Very low	29.9	Very low	151 Å²	151	142.1 Å²	142.1	71%	0.706	69%	0.692	S	S	*	*			cis	-156.7	136.8	-17.3	-108.6	179.6	44.6	0	0	106.4
711	E	23.5	Very low	29.9	Very low	170 Å²	170	145.9 Å²	145.9	79%	0.794	71%	0.706	S	S	*	*			trans	-82.8	145.3	155.3	-75.6	-173.1	150.5	0	0	109.2
712	P	29.8	Very low	29.9	Very low	105 Å²	105	148.8 Å²	148.8	68%	0.682	72%	0.719	S	S	*	*			trans	-118.3	105.7	137.1	32.9	-25.4	0	0	0	110	S714	P712-S714 PolarHBondContact O-N 2.83Å
713	V	24.7	Very low	29.7	Very low	128 Å²	128	147.8 Å²	147.8	78%	0.776	72%	0.717	S	S	*	*			trans	-72.4	105.3	159.8	174.7	0	0	0	0	107.4
714	S	25.3	Very low	29.8	Very low	93 Å²	93	144.9 Å²	144.9	65%	0.65	71%	0.71	S	S	*	*			trans	-147.3	98	172.9	62.1	0	0	0	0	112.3	P712	P712-S714 PolarHBondContact O-N 2.83Å
715	D	26.5	Very low	29.9	Very low	125 Å²	125	145.3 Å²	145.3	67%	0.668	71%	0.705	S	S	*	*			trans	53.5	124.6	141.2	-86.6	14.4	0	0	0	122.5
716	K	29.1	Very low	29.6	Very low	162 Å²	162	144.9 Å²	144.9	70%	0.704	70%	0.699	S	S	*	*			trans	79.2	148.1	150.8	-54.4	150.4	-174.9	133.9	0	116.5
717	Q	27.4	Very low	29.5	Very low	135 Å²	135	145.1 Å²	145.1	63%	0.631	70%	0.7	S	S	*	*			cis	-164.1	162	-15.7	-107.9	171.6	-96.5	0	0	106.4	F719	Q717-F719 HydrophobicContact CG-CD2 4.07Å; Q717-F719 HydrophobicContact CG-CE2 4.45Å
718	E	30.5	Very low	29.5	Very low	132 Å²	132	141.1 Å²	141.1	62%	0.617	70%	0.697	S	S	*	*			cis	-93.9	179.2	-4.7	-79.4	-73	96.3	0	0	111.4
719	F	30.2	Very low	30.1	Very low	163 Å²	163	138.8 Å²	138.8	72%	0.715	70%	0.698	S	S	*	*			cis	84.6	155.2	13.7	-79.9	-29.1	0	0	0	117	Q717	Q717-F719 HydrophobicContact CG-CD2 4.07Å; Q717-F719 HydrophobicContact CG-CE2 4.45Å
720	P	40.4	Very low	30.2	Very low	70 Å²	70	139.7 Å²	139.7	46%	0.455	71%	0.706	S	S	.	*				-133.2	-176.5	-70.9	25.1	-1.1	0	0	0	112.9
721	R	34	Very low	30.4	Very low	219 Å²	219	140 Å²	140	83%	0.826	71%	0.713	S	S	*	*				166.8	162.6	83	-81.3	-179.2	-164.9	-157.1	0.5	109.4
722	K	31.7	Very low	30.9	Very low	167 Å²	167	137 Å²	137	73%	0.726	71%	0.711	S	S	*	*			cis	-170.8	113.7	-32.9	-112.3	-174.7	180	-178.9	0	104.8
723	S	29.8	Very low	31.5	Very low	87 Å²	87	138.2 Å²	138.2	61%	0.608	72%	0.719	S	S	*	*				77.3	131.1	91.4	79.6	0	0	0	0	117.5
724	N	31.6	Very low	31.8	Very low	134 Å²	134	135.4 Å²	135.4	72%	0.717	72%	0.716	S	S	*	*			trans	81.3	121.2	138.9	-79.9	-23	0	0	0	122.7
725	K	29.7	Very low	32.6	Very low	157 Å²	157	137 Å²	137	68%	0.683	72%	0.724	S	S	*	*				105.9	123.5	114.7	-86.5	176.2	173.9	-176	0	121.4
726	Y	28	Very low	33.5	Very low	197 Å²	197	135.9 Å²	135.9	77%	0.773	72%	0.723	S	S	*	*			trans	87.4	130.7	133.7	-83	-50.4	0	0	0	122.9
727	M	29.9	Very low	33.6	Very low	178 Å²	178	134.8 Å²	134.8	88%	0.877	73%	0.725	S	S	*	*			trans	80.8	155.7	154.2	-65.1	180	77.1	0	0	118.9
728	S	32	Very low	33.9	Very low	113 Å²	113	133.8 Å²	133.8	79%	0.79	73%	0.728	S	S	*	*			trans	-120.1	-171.4	-158.8	-23.4	0	0	0	0	109.9
729	P	42.4	Very low	34	Very low	102 Å²	102	134.6 Å²	134.6	66%	0.662	74%	0.737	S	S	*	*			cis	-134	-166.5	-13.2	30.3	-6.4	0	0	0	113.2
730	D	30.4	Very low	34.1	Very low	145 Å²	145	130.9 Å²	130.9	78%	0.775	73%	0.732	S	S	*	*			trans	75.8	149.6	149.1	-58.6	-28.3	0	0	0	123.6
731	D	31.1	Very low	33.8	Very low	159 Å²	159	133.1 Å²	133.1	85%	0.85	74%	0.74	S	S	*	*			trans	65.1	139.8	162.5	-76	-39.5	0	0	0	126.5
732	S	33.8	Very low	33.7	Very low	106 Å²	106	131.3 Å²	131.3	74%	0.741	74%	0.738	S	S	*	*			trans	-90.2	-166.1	-175	-54.1	0	0	0	0	111.4
733	P	42.4	Very low	34	Very low	130 Å²	130	128.4 Å²	128.4	84%	0.844	74%	0.736	S	S	*	*				-127.4	174.5	-60	34.1	-18.5	0	0	0	112.1
734	G	32.5	Very low	34.1	Very low	70 Å²	70	130.5 Å²	130.5	72%	0.722	75%	0.745	S	S	*	*			trans	171.2	159.6	159.4	0	0	0	0	0	117.8
735	P	41.3	Very low	34	Very low	125 Å²	125	129 Å²	129	81%	0.812	74%	0.744	S	S	*	*			trans	-125.7	-153.8	-172	36	-12.8	0	0	0	112
736	P	44.7	Very low	34.1	Very low	102 Å²	102	131.9 Å²	131.9	66%	0.662	75%	0.751	S	S	*	*				-124.6	-162.6	-68.7	36.7	-20.2	0	0	0	113.1
737	D	32.8	Very low	34.5	Very low	140 Å²	140	127.8 Å²	127.8	75%	0.749	75%	0.747	S	S	*	*			trans	103.4	139.9	138	-93.8	-23.5	0	0	0	124.5
738	T	32.8	Very low	34.6	Very low	113 Å²	113	121.7 Å²	121.7	69%	0.693	72%	0.72	S	S	*	*			trans	76.3	124.9	155.1	57.4	0	0	0	0	124.1
739	N	32.2	Very low	34.9	Very low	150 Å²	150	126.3 Å²	126.3	80%	0.802	72%	0.72	S	S	*	*			trans	57.6	141	132.8	-74	-34.3	0	0	0	121.6
740	S	32.7	Very low	34.5	Very low	85 Å²	85	122.3 Å²	122.3	59%	0.594	70%	0.698	S	S	*	*			cis	-178.1	178.7	5.4	52.3	0	0	0	0	113.1
741	N	33.1	Very low	34.6	Very low	117 Å²	117	119.9 Å²	119.9	63%	0.626	69%	0.69	S	S	*	*			trans	77.6	108.2	146.8	-79	-62.7	0	0	0	122.9
742	K	32.5	Very low	34.5	Very low	180 Å²	180	123.1 Å²	123.1	78%	0.783	69%	0.69	S	S	*	*				80.1	162	121.8	-74.8	178.9	-176.8	168.7	0	119.8
743	P	38.2	Very low	34.3	Very low	107 Å²	107	124.9 Å²	124.9	70%	0.695	70%	0.697	S	S	*	*				-139.7	-154.9	-71.2	35.6	-11.8	0	0	0	112.7
744	V	31.1	Very low	34	Very low	131 Å²	131	123.9 Å²	123.9	79%	0.794	69%	0.69	S	S	*	*			trans	76.4	131.4	168.5	-174	0	0	0	0	114.3
745	S	30.4	Very low	33.9	Very low	101 Å²	101	125.5 Å²	125.5	71%	0.706	69%	0.69	S	S	*	*			cis	-169.5	168.3	-16	70.2	0	0	0	0	108.8
746	R	31.5	Very low	33.3	Very low	218 Å²	218	124.8 Å²	124.8	82%	0.823	69%	0.688	S	S	*	*			cis	-158.8	128.6	-4.3	-139.5	-172.9	-178.7	-174.8	1.8	109.9
747	V	37.3	Very low	33	Very low	112 Å²	112	125.8 Å²	125.8	68%	0.679	70%	0.695	S	S	*	*			trans	54.4	157.6	147.1	-65.7	0	0	0	0	122.7
748	P	31.8	Very low	33.3	Very low	50 Å²	50	124.1 Å²	124.1	33%	0.325	69%	0.692	S	S	.	*			cis	-132.2	-162.9	-38.5	29.9	-7.7	0	0	0	114.8	Q1266 R1267	P748-Q1266 WeakPolarHBondContact CD-O 3.19Å; P748-Q1266 WeakPolarHBondContact CG-O 3.4Å; P748-R1267 CarbonylContact C-O 3.59Å; P748-R1267 WeakPolarHBondContact CD-O 3.37Å; P748-R1267 WeakPolarHBondContact CG-O 3.36Å
749	R	37.6	Very low	33.1	Very low	209 Å²	209	126.5 Å²	126.5	79%	0.789	70%	0.699	S	S	*	*			trans	-151.9	154.6	-159.1	-79.7	179.3	162.7	-146.9	1.5	113.8	R1267 E1268	R749-R1267 PolarHBondContact N-O 2.94Å; R749-E1268 WeakPolarHBondContact CA-OE2 3.47Å
750	G	33.5	Very low	32.9	Very low	18 Å²	18	124 Å²	124	19%	0.186	69%	0.693	C	S	.	*			trans	134.6	169.3	159.8	0	0	0	0	0	117.7	E1268 E1269	G750-E1268 VanDerWaalsContact N-CB 3.27Å; G750-E1268 PolarHBondContact N-OE2 3.4Å; G750-E1268 WeakPolarHBondContact O-CB 3.45Å; G750-E1268 WeakPolarHBondContact O-CG 3.48Å; G750-E1269 WeakPolarHBondContact CA-OE1 3.42Å
751	P	34	Very low	32.8	Very low	94 Å²	94	124.2 Å²	124.2	61%	0.61	70%	0.695	S	S	*	*			cis	-105.2	167.2	-20.6	15.1	5.4	0	0	0	114.1	E1269	P751-E1269 VanDerWaalsContact CA-OE1 3.24Å; P751-E1269 WeakPolarHBondContact CA-OE1 3.43Å; P751-E1269 VanDerWaalsContact CB-CD 3.41Å; P751-E1269 HydrophobicContact CB-CG 3.66Å; P751-E1269 HydrophobicContact CG-CG 3.65Å
752	R	27.7	Very low	32.6	Very low	228 Å²	228	126.7 Å²	126.7	86%	0.86	70%	0.703	S	S	*	*			trans	-125.3	150.8	133.3	-68	176	168.4	-151.7	-2.2	106.9
753	T	31.1	Very low	32.5	Very low	143 Å²	143	124.1 Å²	124.1	88%	0.877	70%	0.698	S	S	*	*				162.8	163.5	125.3	39.5	0	0	0	0	113
754	P	35.4	Very low	32.2	Very low	108 Å²	108	128.2 Å²	128.2	70%	0.701	71%	0.707	S	S	*	*			trans	-127.1	-176.3	-167.5	43.6	-29.4	0	0	0	116
755	S	29.5	Very low	32.1	Very low	104 Å²	104	125.5 Å²	125.5	73%	0.727	71%	0.706	S	S	*	*			trans	85.4	146.8	149.5	77.8	0	0	0	0	121.8
756	S	30	Very low	32.3	Very low	110 Å²	110	128.4 Å²	128.4	77%	0.769	71%	0.714	S	S	*	*			trans	92.6	125.1	158.1	-47.8	0	0	0	0	120.4
757	P	38.4	Very low	32.4	Very low	124 Å²	124	121.5 Å²	121.5	81%	0.805	70%	0.699	S	S	*	*			trans	-104.4	-160.9	160.1	44.6	-35.6	0	0	0	110
758	P	39.5	Very low	32.2	Very low	105 Å²	105	119.7 Å²	119.7	68%	0.682	70%	0.703	S	S	*	*			cis	-133.9	-173.1	-8.8	44.8	-28.7	0	0	0	115
759	L	27.9	Very low	32.4	Very low	163 Å²	163	120.9 Å²	120.9	85%	0.853	72%	0.724	S	S	*	*			trans	64.3	143	163.5	-60.3	170	0	0	0	117.4
760	S	27.8	Very low	32	Very low	97 Å²	97	117.8 Å²	117.8	68%	0.678	73%	0.729	S	S	*	*			cis	-167.6	-163.5	-15	61.6	0	0	0	0	107.1
761	S	29.7	Very low	31.8	Very low	90 Å²	90	123.5 Å²	123.5	63%	0.629	76%	0.764	S	S	*	*			cis	-172.3	155.5	0.7	25.5	0	0	0	0	108.9
762	Q	29.1	Very low	31.5	Very low	168 Å²	168	124 Å²	124	79%	0.785	77%	0.77	S	S	*	*			trans	68.8	140.8	169.2	-56.8	-169.1	-98.1	0	0	117.8
763	D	30.2	Very low	31.6	Very low	127 Å²	127	122.3 Å²	122.3	68%	0.679	77%	0.772	S	S	*	*			cis	-167.7	163	-16	-92.8	-25	0	0	0	106.8
764	E	31.7	Very low	31.5	Very low	192 Å²	192	125.6 Å²	125.6	90%	0.897	77%	0.769	S	S	*	*			cis	-105.4	-103	-4.1	-71.5	-175.5	76.4	0	0	111.2
765	G	30.6	Very low	31.2	Very low	74 Å²	74	127.4 Å²	127.4	76%	0.763	77%	0.773	S	S	*	*			cis	135.9	131.5	-3.1	0	0	0	0	0	111.7
766	D	34.3	Very low	31.2	Very low	163 Å²	163	129.4 Å²	129.4	87%	0.872	78%	0.775	S	S	*	*			cis	-120.7	-169.4	-5.4	-158.2	-31.4	0	0	0	110
767	S	32.9	Very low	31.1	Very low	73 Å²	73	129.5 Å²	129.5	51%	0.51	78%	0.775	S	S	.	*			trans	-87.3	162.1	-159.2	51.6	0	0	0	0	116.6	A548	A548-S767 WeakPolarHBondContact CB-O 3.38Å
768	G	34.1	Very low	30.7	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	78%	0.778	S	S	*	*			cis	163.7	170.8	-7.9	0	0	0	0	0	114.5
769	G	34.2	Very low	30	Very low	75 Å²	75	137 Å²	137	77%	0.773	78%	0.781	S	S	*	*			trans	84.4	149.5	170.1	0	0	0	0	0	116.8
770	T	29.7	Very low	30.1	Very low	144 Å²	144	135 Å²	135	88%	0.883	78%	0.78	S	S	*	*			cis	-154.9	134.8	-9.4	50.6	0	0	0	0	110.7
771	C	29.1	Very low	29.9	Very low	138 Å²	138	136 Å²	136	93%	0.932	79%	0.786	S	S	*	*			trans	-160.3	150	152	-160.1	0	0	0	0	109.8
772	S	27.9	Very low	29.8	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	79%	0.79	S	S	*	*			trans	-126.2	115.6	-171.7	57.9	0	0	0	0	112.8
773	H	29.6	Very low	29.7	Very low	192 Å²	192	139.1 Å²	139.1	89%	0.889	79%	0.792	S	S	*	*			trans	-139	127.2	158.5	-124.9	-88.2	0	0	0	106.7
774	Y	30.6	Very low	29.5	Very low	212 Å²	212	138.1 Å²	138.1	83%	0.831	80%	0.795	S	S	*	*			trans	-138.3	125.7	173.6	-105.2	-79.5	0	0	0	109.1
775	D	27.9	Very low	29.2	Very low	146 Å²	146	133.6 Å²	133.6	78%	0.781	79%	0.785	S	S	*	*			trans	-121.7	121.2	162.7	173.8	19.4	0	0	0	105.7
776	L	30.7	Very low	29.2	Very low	146 Å²	146	137.6 Å²	137.6	76%	0.764	79%	0.788	S	S	*	*			trans	-160.7	103.7	169	-87.4	-167.1	0	0	0	109.3
777	S	26.4	Very low	28.9	Very low	111 Å²	111	136.6 Å²	136.6	78%	0.776	78%	0.783	S	S	*	*			trans	-66.5	135.3	151.7	50.6	0	0	0	0	109.8
778	R	29.6	Very low	28.8	Very low	228 Å²	228	136.7 Å²	136.7	86%	0.86	78%	0.778	S	S	*	*			trans	-157.4	139.8	156.5	-146	170.8	-173.5	173.4	3.1	112.7
779	E	26.3	Very low	28.6	Very low	160 Å²	160	137.9 Å²	137.9	75%	0.748	76%	0.762	S	S	*	*			trans	-74.1	157.3	179.5	-38.1	97.2	127.9	0	0	111.9
780	S	29.3	Very low	28.4	Very low	119 Å²	119	138.1 Å²	138.1	83%	0.832	75%	0.748	S	S	*	*				-168.7	134.8	118	26.3	0	0	0	0	112.3
781	C	24.6	Very low	28.2	Very low	119 Å²	119	137.7 Å²	137.7	80%	0.804	73%	0.73	S	S	*	*			trans	-65.6	147.5	173.1	-56.7	0	0	0	0	111.7
782	S	26.8	Very low	28.2	Very low	101 Å²	101	138 Å²	138	71%	0.706	71%	0.712	S	S	*	*				179.9	126.4	122.3	-86.8	0	0	0	0	114.2
783	R	26.5	Very low	28.3	Very low	222 Å²	222	140 Å²	140	84%	0.838	71%	0.709	S	S	*	*			trans	62.1	119.3	145.4	-66	175.8	166.8	149.4	-2.6	116.5
784	S	25.7	Very low	28.2	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	70%	0.699	S	S	*	*				50.4	135	71.2	84.9	0	0	0	0	113.4
785	S	27	Very low	28	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	69%	0.692	S	S	*	*			cis	-157	159.1	23.7	-162.4	0	0	0	0	113.3
786	L	29.2	Very low	28	Very low	159 Å²	159	133.2 Å²	133.2	83%	0.832	69%	0.688	S	S	*	*			trans	31.7	116.9	153	-68.7	169.3	0	0	0	120.8
787	N	29.2	Very low	28	Very low	142 Å²	142	132 Å²	132	76%	0.759	69%	0.687	S	S	*	*			trans	-18.5	146	141	-90.5	-30.9	0	0	0	118.3
788	N	30	Very low	28.1	Very low	75 Å²	75	131.2 Å²	131.2	40%	0.401	68%	0.682	S	S	.	*			trans	83	77.5	139.2	-65.4	-23.2	0	0	0	121.8	S970	N788-S970 VanDerWaalsContact CB-O 3.31Å; N788-S970 WeakPolarHBondContact CB-O 3.36Å; N788-S970 PolarHBondContact ND2-O 2.81Å
789	K	30.1	Very low	27.9	Very low	98 Å²	98	125.2 Å²	125.2	43%	0.426	68%	0.675	S	S	.	*				83.9	144.5	118.2	-67.3	139.2	173.7	159.8	0	122.3	T968 S969	K789-T968 WeakPolarHBondContact CD-OG1 3.4Å; K789-T968 VanDerWaalsContact CE-OG1 3.25Å; K789-T968 WeakPolarHBondContact CE-OG1 3.5Å; K789-T968 WeakPolarHBondContact CG-OG1 3.47Å; K789-S969 WeakPolarHBondContact CD-O 3.2Å; K789-S969 WeakPolarHBondContact CE-O 3.46Å; K789-S969 PolarHBondContact NZ-O 3.03Å
790	T	29.5	Very low	28	Very low	80 Å²	80	123.6 Å²	123.6	49%	0.491	68%	0.675	S	S	.	*			trans	8.8	138.1	148.5	75.8	0	0	0	0	118.1	T968	T790-T968 PolarHBondContact OG1-N 3.19Å
791	R	27.1	Very low	27.9	Very low	135 Å²	135	123.4 Å²	123.4	51%	0.509	67%	0.674	S	S	.	*			cis	-173.7	133.9	49.4	172.5	176.7	157.6	-121.1	-4.7	113.1	S964 S965	R791-S964 PolarHBondContact NH2-O 3.21Å; R791-S965 PolarHBondContact NE-O 3.22Å; R791-S965 PolarHBondContact NH2-O 2.97Å
792	R	27.8	Very low	28.2	Very low	146 Å²	146	121.1 Å²	121.1	55%	0.551	67%	0.67	S	S	*	*			trans	62.2	163.1	162.7	-74.2	-169.1	-172.8	-173.6	1.8	116.7	S964 S965	R792-S964 VanDerWaalsContact CZ-O 3.26Å; R792-S964 PolarHBondContact NH2-O 2.92Å; R792-S965 PolarHBondContact NE-O 3.32Å; R792-S965 VanDerWaalsContact NE-O 3.11Å; R792-S965 PolarHBondContact NH2-O 2.82Å; R792-S965 PolarHBondContact NH2-OG 3.25Å
793	Q	30.3	Very low	28.2	Very low	145 Å²	145	127.2 Å²	127.2	68%	0.678	68%	0.678	S	S	*	*			cis	-172.8	160.6	-34.8	-161.2	164.3	-3.3	0	0	105.7
794	N	28.1	Very low	28.2	Very low	125 Å²	125	121.9 Å²	121.9	67%	0.668	67%	0.673	S	S	*	*			trans	70.1	146	-175.3	-62.1	28.4	0	0	0	112
795	E	26.9	Very low	28.3	Very low	146 Å²	146	124 Å²	124	68%	0.682	68%	0.676	S	S	*	*			cis	-154.4	144.8	5.8	-125.2	153	-126	0	0	111.3
796	I	27.6	Very low	28.2	Very low	138 Å²	138	126 Å²	126	71%	0.708	68%	0.679	S	S	*	*			trans	64.4	159.8	148.7	-63.6	160.2	0	0	0	118.1
797	T	31.1	Very low	28	Very low	121 Å²	121	123.1 Å²	123.1	74%	0.742	67%	0.672	S	S	*	*			trans	65.1	118.3	-171.3	64.7	0	0	0	0	114.9
798	S	27.7	Very low	28	Very low	94 Å²	94	121 Å²	121	66%	0.657	67%	0.668	S	S	*	*			cis	68.5	94	47.8	84.2	0	0	0	0	111.5
799	S	25.8	Very low	27.8	Very low	102 Å²	102	124.9 Å²	124.9	71%	0.713	69%	0.689	S	S	*	*				71.7	157.7	77.5	73.2	0	0	0	0	113.7
800	V	28.5	Very low	27.6	Very low	126 Å²	126	124.3 Å²	124.3	76%	0.764	70%	0.697	S	S	*	*			trans	71.2	106.5	179.4	-177.1	0	0	0	0	110.9
801	S	27	Very low	27.4	Very low	115 Å²	115	126.6 Å²	126.6	80%	0.804	71%	0.706	S	S	*	*				77.3	138.2	51	85.7	0	0	0	0	114.6
802	G	30	Very low	27.4	Very low	70 Å²	70	127.3 Å²	127.3	72%	0.722	72%	0.716	S	S	*	*			trans	129.4	96.4	-165.9	0	0	0	0	0	107.7
803	R	26.8	Very low	27.3	Very low	229 Å²	229	126.7 Å²	126.7	86%	0.864	72%	0.723	S	S	*	*			cis	56.8	115.8	49.1	-85.2	-163.2	-179.1	-153.8	0.5	113.6
804	C	26.5	Very low	27.2	Very low	110 Å²	110	127.5 Å²	127.5	74%	0.743	73%	0.731	S	S	*	*			trans	58.4	136.5	150	-46.1	0	0	0	0	116.4
805	L	27.6	Very low	27.1	Very low	152 Å²	152	125.7 Å²	125.7	80%	0.796	73%	0.728	S	S	*	*				-157.2	143.5	50.1	-74.4	160.8	0	0	0	106.8
806	D	25.1	Very low	27.1	Very low	138 Å²	138	123.7 Å²	123.7	74%	0.738	73%	0.726	S	S	*	*				77.9	154.5	52.6	-164.3	23.5	0	0	0	113.4
807	S	25.8	Very low	27.1	Very low	98 Å²	98	127.6 Å²	127.6	69%	0.685	73%	0.732	S	S	*	*			trans	70.2	93.1	-176.5	-60.4	0	0	0	0	117.4
808	S	27.8	Very low	27.2	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	74%	0.736	S	S	*	*				30.1	159.1	100.7	-47.6	0	0	0	0	120.7
809	N	25.8	Very low	27.5	Very low	155 Å²	155	131.8 Å²	131.8	83%	0.829	74%	0.739	S	S	*	*			trans	73.3	146.5	164.1	-67.9	-3	0	0	0	115.2
810	S	25.9	Very low	27.6	Very low	86 Å²	86	132.7 Å²	132.7	60%	0.601	74%	0.741	S	S	*	*			cis	-170.1	159.4	-7.4	42	0	0	0	0	109.2
811	N	26.2	Very low	27.6	Very low	128 Å²	128	132.6 Å²	132.6	68%	0.684	74%	0.74	S	S	*	*			trans	67.1	157.2	151.1	-69.7	20.4	0	0	0	116
812	E	26.6	Very low	27.6	Very low	151 Å²	151	132 Å²	132	71%	0.706	73%	0.734	S	S	*	*			cis	-148.1	175.9	-12.6	-127.9	162.6	143.1	0	0	111.4	L814	E812-L814 PolarHBondContact O-N 2.99Å
813	N	25.9	Very low	27.5	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	73%	0.732	S	S	*	*			trans	-43.3	133.3	152.5	-53.3	-77.4	0	0	0	110.9
814	L	27.7	Very low	27.4	Very low	161 Å²	161	129.6 Å²	129.6	84%	0.843	73%	0.727	S	S	*	*				174.4	136.1	118.3	-108.9	75.6	0	0	0	106.6	E812	E812-L814 PolarHBondContact O-N 2.99Å
815	S	26.2	Very low	27.4	Very low	87 Å²	87	128.3 Å²	128.3	61%	0.608	72%	0.719	S	S	*	*			cis	164.6	-156.3	-4.6	51.4	0	0	0	0	104.3
816	V	28.2	Very low	27.3	Very low	105 Å²	105	129 Å²	129	64%	0.636	72%	0.718	S	S	*	*			trans	64.2	90.7	147.6	171.3	0	0	0	0	116.8
817	R	27.7	Very low	27.3	Very low	219 Å²	219	127 Å²	127	83%	0.826	72%	0.715	S	S	*	*				70.1	113.4	128.6	-63.3	179.2	-174	157.2	0.7	118.9	P819	R817-P819 WeakPolarHBondContact O-CD 3.44Å
818	K	33.2	Very low	27.4	Very low	189 Å²	189	126.3 Å²	126.3	82%	0.822	71%	0.71	S	S	*	*			trans	-39.5	136.8	135	-57.7	171.5	-178.7	174.3	0	109.9
819	P	33.4	Very low	27.4	Very low	114 Å²	114	128.2 Å²	128.2	74%	0.74	71%	0.712	S	S	*	*				-98.3	153.3	110.9	-22.8	37.1	0	0	0	112	R817	R817-P819 WeakPolarHBondContact O-CD 3.44Å
820	V	28.7	Very low	27.5	Very low	122 Å²	122	126.5 Å²	126.5	74%	0.739	70%	0.703	S	S	*	*			cis	69.1	117.6	29.9	179.1	0	0	0	0	110
821	V	28.3	Very low	27.7	Very low	123 Å²	123	132.5 Å²	132.5	75%	0.745	71%	0.713	S	S	*	*			cis	-165.9	-165.3	-1.8	70.9	0	0	0	0	107.6
822	C	25.9	Very low	27.6	Very low	102 Å²	102	130 Å²	130	69%	0.689	71%	0.705	S	S	*	*			trans	71.5	147.6	162.2	-91.2	0	0	0	0	116.8
823	T	27.4	Very low	28	Very low	108 Å²	108	129 Å²	129	66%	0.663	71%	0.711	S	S	*	*			cis	-155.6	174.7	-21.8	-6.4	0	0	0	0	110.2
824	N	25	Very low	28.1	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	71%	0.713	S	S	*	*			trans	-5.4	144.8	130.1	-66.5	-6.1	0	0	0	116.3
825	S	26.4	Very low	28.2	Very low	82 Å²	82	129.1 Å²	129.1	57%	0.573	71%	0.71	S	S	*	*			cis	-179	-167.5	-1.6	52.4	0	0	0	0	108.7
826	Q	26.3	Very low	28.3	Very low	166 Å²	166	136 Å²	136	78%	0.776	72%	0.722	S	S	*	*			trans	73.5	131.9	160.9	-68.8	169.1	33.2	0	0	113.5
827	S	25.6	Very low	28.4	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	73%	0.725	S	S	*	*				62.7	132.2	83	128.4	0	0	0	0	111.6
828	S	26.4	Very low	28.4	Very low	82 Å²	82	130 Å²	130	57%	0.573	72%	0.718	S	S	*	*			cis	-175.3	-176.3	9.3	43.5	0	0	0	0	109.9
829	N	27.7	Very low	28.2	Very low	139 Å²	139	129.2 Å²	129.2	74%	0.743	72%	0.715	S	S	*	*			trans	71.3	162.9	147.2	-64.7	-24	0	0	0	119.7
830	N	28.1	Very low	28.1	Very low	119 Å²	119	130.9 Å²	130.9	64%	0.636	71%	0.713	S	S	*	*			trans	72.9	108	150.6	-71.7	-40.5	0	0	0	120.7
831	R	30.2	Very low	28.2	Very low	213 Å²	213	131 Å²	131	80%	0.804	71%	0.709	S	S	*	*			trans	77.3	125.9	131.9	-60.5	168.3	-169.4	-155.8	-3.5	114.5
832	S	24.9	Very low	28.2	Very low	75 Å²	75	129.7 Å²	129.7	52%	0.524	70%	0.701	S	S	.	*				57	120	67.6	-57.2	0	0	0	0	111
833	P	35.5	Very low	28.3	Very low	129 Å²	129	132 Å²	132	84%	0.838	70%	0.699	S	S	*	*				-84.6	147.1	61.4	26.5	-36.4	0	0	0	114.8
834	K	28.2	Very low	28.3	Very low	173 Å²	173	132.3 Å²	132.3	75%	0.752	70%	0.696	S	S	*	*			cis	49.4	101.9	7.9	-69.7	-169.9	175.9	-172.4	0	113.9
835	T	29.5	Very low	28.4	Very low	125 Å²	125	128.7 Å²	128.7	77%	0.767	68%	0.676	S	S	*	*			cis	-143.3	160	32.6	34.6	0	0	0	0	110.5
836	R	28.6	Very low	28.6	Very low	232 Å²	232	133.9 Å²	133.9	88%	0.875	68%	0.682	S	S	*	*				53.1	136.8	68.8	-98.1	-170.5	174.7	-171.3	-2.3	111.8
837	S	29.3	Very low	28.6	Very low	100 Å²	100	129 Å²	129	70%	0.699	68%	0.677	S	S	*	*			cis	-169	168.2	7.7	50.6	0	0	0	0	114
838	S	28.7	Very low	28.8	Very low	97 Å²	97	135 Å²	135	68%	0.678	69%	0.685	S	S	*	*			trans	72.6	123.8	160.5	-143.3	0	0	0	0	115.5
839	K	29.2	Very low	29	Very low	173 Å²	173	136.7 Å²	136.7	75%	0.752	69%	0.687	S	S	*	*			cis	68.6	140.2	41.9	-60.8	-171.9	172.4	-174.1	0	114.9
840	H	30.9	Very low	29.1	Very low	149 Å²	149	136.6 Å²	136.6	69%	0.69	68%	0.682	S	S	*	*			trans	77.8	143.7	158.4	-64.5	-51.4	0	0	0	118.1
841	N	29.4	Very low	29.1	Very low	123 Å²	123	138.1 Å²	138.1	66%	0.658	69%	0.685	S	S	*	*			cis	-172	166.7	-30.2	-136.4	-2.4	0	0	0	111.3
842	T	28.8	Very low	28.9	Very low	96 Å²	96	132.4 Å²	132.4	59%	0.589	68%	0.678	S	S	*	*			trans	63	139.3	145.5	51.1	0	0	0	0	122.4
843	K	28.1	Very low	29	Very low	150 Å²	150	132.9 Å²	132.9	65%	0.652	68%	0.681	S	S	*	*			trans	78.1	152.2	144.1	-73.2	164.4	179.4	179.3	0	116.5
844	I	28.6	Very low	28.6	Very low	115 Å²	115	133.4 Å²	133.4	59%	0.59	68%	0.677	S	S	*	*			cis	-143.1	126.1	10.6	-132.8	150.3	0	0	0	114.2	S1107	I844-S1107 VanDerWaalsContact C-CB 3.41Å; I844-S1107 WeakPolarHBondContact CA-OG 3.11Å
845	M	26.8	Very low	28.5	Very low	67 Å²	67	130 Å²	130	33%	0.33	67%	0.673	S	S	.	*			trans	21.9	112.3	144	-36.6	-170.9	163.4	0	0	118.1	R1106 S1107	M845-R1106 HydrophobicContact CB-CB 4.12Å; M845-R1106 HydrophobicContact CB-CG 3.87Å; M845-R1106 HydrophobicContact CG-CB 3.86Å; M845-R1106 HydrophobicContact CG-CG 3.94Å; M845-S1107 PolarHBondContact N-OG 3.37Å
846	R	29.2	Very low	28.4	Very low	190 Å²	190	127.5 Å²	127.5	72%	0.717	66%	0.661	S	S	*	*				170.4	148.4	86.6	-79.6	132.7	-158.8	-158.7	2.9	107.2
847	G	27.7	Very low	28.3	Very low	64 Å²	64	122.5 Å²	122.5	66%	0.66	65%	0.651	S	S	*	*			cis	98.7	136.6	16	0	0	0	0	0	111.2
848	R	29.8	Very low	28.3	Very low	225 Å²	225	122.3 Å²	122.3	85%	0.849	65%	0.65	S	S	*	*			trans	69.6	153.6	-166.2	-87.5	176.8	-161	156.4	3	112.6
849	D	30.3	Very low	28.3	Very low	116 Å²	116	121.8 Å²	121.8	62%	0.62	65%	0.647	S	S	*	*			cis	-143.3	149.9	24.9	-109.9	-22.1	0	0	0	111.4
850	H	29	Very low	28.3	Very low	138 Å²	138	120 Å²	120	64%	0.639	65%	0.65	S	S	*	*				57.9	140	102.3	-66.8	-22.3	0	0	0	115.7
851	H	28.4	Very low	28.3	Very low	151 Å²	151	117.9 Å²	117.9	70%	0.699	65%	0.652	S	S	*	*			cis	-161.9	-169.8	4.1	-127.1	-32.3	0	0	0	112.6
852	S	26.5	Very low	28.4	Very low	93 Å²	93	116.6 Å²	116.6	65%	0.65	66%	0.659	S	S	*	*			trans	-0.9	149.8	149.6	68.7	0	0	0	0	119.3
853	S	27.3	Very low	28.5	Very low	85 Å²	85	116.5 Å²	116.5	59%	0.594	66%	0.662	S	S	*	*			cis	171.6	-167.2	-0	54	0	0	0	0	108
854	N	25.8	Very low	28.7	Very low	140 Å²	140	115.7 Å²	115.7	75%	0.749	67%	0.67	S	S	*	*			trans	38.1	103	141.8	-56.4	-12.5	0	0	0	119
855	C	26.8	Very low	28.8	Very low	100 Å²	100	114.8 Å²	114.8	68%	0.676	67%	0.674	S	S	*	*				-164.8	133	100.5	-93.3	0	0	0	0	110.1	R1142	C855-R1142 PolarHBondContact O-NH2 3.02Å
856	S	27.3	Very low	29.2	Very low	73 Å²	73	122.9 Å²	122.9	51%	0.51	70%	0.701	S	S	.	*				71.4	143.3	65	-52.1	0	0	0	0	113.7	R1142	S856-R1142 PolarHBondContact O-NH2 2.82Å
857	N	27.1	Very low	29.3	Very low	127 Å²	127	117 Å²	117	68%	0.679	69%	0.689	S	S	*	*			trans	68.7	117.9	166.3	-58.6	-4.4	0	0	0	115.1	R1142	N857-R1142 PolarHBondContact O-NH1 3.47Å; N857-R1142 PolarHBondContact O-NH2 3.28Å
858	S	28.5	Very low	29.4	Very low	97 Å²	97	120 Å²	120	68%	0.678	69%	0.69	S	S	*	*				78.4	151.5	74.1	97.3	0	0	0	0	111.6
859	S	29.4	Very low	29.5	Very low	86 Å²	86	112.6 Å²	112.6	60%	0.601	67%	0.672	S	S	*	*			cis	-167	158.8	4	16.9	0	0	0	0	109.7
860	T	28	Very low	29.6	Very low	135 Å²	135	117.4 Å²	117.4	83%	0.828	68%	0.683	S	S	*	*			trans	62.2	150.9	152.7	44.8	0	0	0	0	118.3
861	S	31.3	Very low	29.7	Very low	104 Å²	104	119.6 Å²	119.6	73%	0.727	69%	0.694	S	S	*	*			cis	-171.1	157.1	-4.3	40.9	0	0	0	0	110.5
862	A	32	Very low	29.8	Very low	96 Å²	96	116.2 Å²	116.2	79%	0.793	69%	0.692	S	S	*	*			trans	66.6	148.2	158.8	0	0	0	0	0	118
863	S	31.3	Very low	30.3	Very low	94 Å²	94	116.8 Å²	116.8	66%	0.657	69%	0.693	S	S	*	*			cis	-168.4	148.1	-12.2	44.2	0	0	0	0	111.7
864	T	31.3	Very low	30.3	Very low	133 Å²	133	119.7 Å²	119.7	82%	0.816	70%	0.702	S	S	*	*			trans	60.8	144.2	156.8	50	0	0	0	0	119.7
865	S	31.3	Very low	30.5	Very low	97 Å²	97	119 Å²	119	68%	0.678	70%	0.703	S	S	*	*			cis	-174.1	150.5	-9.5	51.7	0	0	0	0	112
866	R	34.1	Very low	30.4	Very low	236 Å²	236	119.4 Å²	119.4	89%	0.891	71%	0.706	S	S	*	*			trans	67.2	149.6	164.4	-67.3	174.3	172.3	169	-3.9	117
867	S	31.3	Very low	30.4	Very low	68 Å²	68	122.8 Å²	122.8	48%	0.476	72%	0.718	S	S	.	*			cis	-167.4	144.5	-18.3	45.4	0	0	0	0	112.9	T1321	S867-T1321 PolarHBondContact O-OG1 3.49Å
868	N	31.5	Very low	30.5	Very low	127 Å²	127	122.4 Å²	122.4	68%	0.679	72%	0.72	S	S	*	*			trans	63.3	141.2	157.5	-58.3	5.5	0	0	0	119	T1321 H1322	N868-T1321 PolarHBondContact O-OG1 2.96Å; N868-H1322 PolarHBondContact O-CD2 3.21Å
869	S	32	Very low	30.7	Very low	68 Å²	68	122.5 Å²	122.5	48%	0.476	72%	0.721	S	S	.	*			cis	-167.7	135.9	-9.5	45.4	0	0	0	0	113.1
870	Y	31.6	Very low	30.8	Very low	218 Å²	218	125.4 Å²	125.4	86%	0.855	73%	0.73	S	S	*	*			trans	35.6	127.9	140	-67.4	-70.5	0	0	0	120.8
871	E	30.2	Very low	31.2	Very low	184 Å²	184	128.1 Å²	128.1	86%	0.86	73%	0.73	S	S	*	*			cis	66.3	147.9	20.8	-115.2	177.9	-146	0	0	114.4
872	A	31.3	Very low	31.5	Very low	80 Å²	80	131.9 Å²	131.9	66%	0.661	73%	0.733	S	S	*	*			cis	-156.5	-178.5	8.5	0	0	0	0	0	110.4
873	P	37.7	Very low	31.6	Very low	104 Å²	104	136.6 Å²	136.6	68%	0.675	74%	0.736	S	S	*	*			trans	-101.6	-173.2	179.2	40.1	-34.4	0	0	0	114.5
874	N	26.7	Very low	31.7	Very low	147 Å²	147	143.3 Å²	143.3	79%	0.786	75%	0.747	S	S	*	*			trans	76.5	129.2	152.7	-74.1	-19	0	0	0	122.6
875	V	28.7	Very low	31.7	Very low	126 Å²	126	140.8 Å²	140.8	76%	0.764	74%	0.735	S	S	*	*			trans	82.2	113.9	134.7	174.1	0	0	0	0	122.3
876	C	26.1	Very low	31.7	Very low	108 Å²	108	141.7 Å²	141.7	73%	0.73	74%	0.736	S	S	*	*			trans	44.6	126.4	139.1	-56.6	0	0	0	0	126
877	N	27.4	Very low	31.5	Very low	143 Å²	143	136.4 Å²	136.4	77%	0.765	73%	0.726	S	S	*	*				87.3	134.1	127.4	-84.4	-15	0	0	0	125.6
878	T	29.4	Very low	31.5	Very low	119 Å²	119	142.7 Å²	142.7	73%	0.73	74%	0.739	S	S	*	*			trans	82.7	105	141.5	48.1	0	0	0	0	124.9
879	S	31.3	Very low	31.3	Very low	99 Å²	99	144.1 Å²	144.1	69%	0.692	74%	0.741	S	S	*	*				111	114	111	77.4	0	0	0	0	124.4
880	N	32.4	Very low	31.1	Very low	147 Å²	147	147.4 Å²	147.4	79%	0.786	75%	0.752	S	S	*	*				76.9	143.8	124.8	-78.1	-36	0	0	0	125.6
881	K	37.1	Very low	30.9	Very low	193 Å²	193	141.8 Å²	141.8	84%	0.839	74%	0.74	S	S	*	*			trans	91.3	145.7	165.8	-60.1	147.2	-176.8	166.5	0	115
882	K	36.6	Very low	30.8	Very low	182 Å²	182	141 Å²	141	79%	0.791	74%	0.737	S	S	*	*			cis	-160.4	154.8	11.1	-138.7	170.3	-174.5	175.5	0	112.5
883	K	35	Very low	30.6	Very low	196 Å²	196	142.1 Å²	142.1	85%	0.852	74%	0.739	S	S	*	*			trans	67.3	146	174.6	-56.6	172.6	-178.4	175	0	113.2
884	R	33	Very low	30.1	Very low	235 Å²	235	144 Å²	144	89%	0.887	74%	0.744	S	S	*	*			cis	-156.6	169.5	0.5	-117.9	-164.9	164.5	172.4	-4.7	105.2
885	S	31.1	Very low	30.2	Very low	79 Å²	79	143.6 Å²	143.6	55%	0.552	75%	0.746	S	S	*	*			cis	172.2	141.8	-29.6	52.8	0	0	0	0	107.1
886	T	32	Very low	30.2	Very low	117 Å²	117	140.3 Å²	140.3	72%	0.718	74%	0.738	S	S	*	*			cis	-172.8	174.9	-0.4	17.8	0	0	0	0	107.6
887	N	29	Very low	30.2	Very low	124 Å²	124	143.9 Å²	143.9	66%	0.663	75%	0.746	S	S	*	*			trans	75	149.6	166.7	-62.5	-30	0	0	0	116.6
888	R	30.8	Very low	30.2	Very low	200 Å²	200	140.4 Å²	140.4	76%	0.755	73%	0.733	S	S	*	*			cis	-157.1	130.6	-7.8	-113.3	167	-170	174.1	-0.8	107.8
889	H	28.5	Very low	30.2	Very low	157 Å²	157	143.5 Å²	143.5	73%	0.727	73%	0.733	S	S	*	*				76.1	152.8	94.6	-97.8	-15.4	0	0	0	117.1
890	I	28.1	Very low	30	Very low	138 Å²	138	143 Å²	143	71%	0.708	72%	0.72	S	S	*	*			trans	72.9	139.1	143.5	-73.9	166.2	0	0	0	117.2
891	T	27.2	Very low	29.9	Very low	99 Å²	99	142 Å²	142	61%	0.607	71%	0.714	S	S	*	*			cis	-166.3	148.5	-17.7	34.4	0	0	0	0	109.7
892	H	27	Very low	29.6	Very low	169 Å²	169	139.2 Å²	139.2	78%	0.782	71%	0.708	S	S	*	*			trans	53.2	164.5	135.6	-67.2	-133.6	0	0	0	122.6
893	S	28.7	Very low	29.3	Very low	102 Å²	102	134.4 Å²	134.4	71%	0.713	70%	0.697	S	S	*	*			trans	87.1	147.7	146.2	81.7	0	0	0	0	119.3
894	N	27.1	Very low	29.1	Very low	144 Å²	144	128.2 Å²	128.2	77%	0.77	68%	0.677	S	S	*	*			cis	-170.2	168.1	-32	-103.2	-8	0	0	0	107.9
895	V	27.8	Very low	28.8	Very low	138 Å²	138	121.1 Å²	121.1	84%	0.836	66%	0.657	S	S	*	*			trans	67.2	135.2	167.5	-157.7	0	0	0	0	115.4
896	G	28	Very low	28.7	Very low	58 Å²	58	123.5 Å²	123.5	60%	0.598	66%	0.659	S	S	*	*			cis	141.5	155.4	-4.2	0	0	0	0	0	111.9
897	M	27.2	Very low	28.5	Very low	183 Å²	183	120.9 Å²	120.9	90%	0.901	65%	0.646	S	S	*	*			trans	67.3	147.9	169.8	-52.9	-174.7	84.5	0	0	115.4
898	S	26.9	Very low	28.4	Very low	69 Å²	69	119.1 Å²	119.1	48%	0.483	64%	0.643	S	S	.	*			cis	-170.9	134.6	-6.6	43.7	0	0	0	0	109.2
899	Y	28.8	Very low	28.3	Very low	185 Å²	185	117.9 Å²	117.9	73%	0.725	65%	0.646	S	S	*	*			trans	62.2	163.8	172.8	-34.4	-66.1	0	0	0	117
900	E	28.4	Very low	28.1	Very low	89 Å²	89	119.2 Å²	119.2	42%	0.416	65%	0.65	S	S	.	*			cis	-136.1	160.9	2.6	-40.6	80	-128	0	0	108.7	R347	R347-E900 IonicContact CZ-OE1 2.64Å; R347-E900 IonicContact CZ-OE2 3.98Å; R347-E900 IonicContact NH1-OE1 2.81Å; R347-E900 IonicContact NH1-OE2 3.71Å; R347-E900 PolarHBondContact NH1-OE2 3.38Å; R347-E900 IonicContact NH2-OE1 3.83Å; R347-E900 PolarHBondContact NH2-OE1 2.96Å; R347-E900 IonicContact NH2-OE2 3.18Å; R347-E900 PolarHBondContact NH2-OE2 2.67Å
901	D	30.9	Very low	28.1	Very low	125 Å²	125	117.1 Å²	117.1	67%	0.668	65%	0.653	S	S	*	*			cis	-163.6	-170.6	-16.6	-127.2	-87.7	0	0	0	115.6
902	N	29.4	Very low	28	Very low	135 Å²	135	119.1 Å²	119.1	72%	0.722	66%	0.655	S	S	*	*			trans	-60.5	145.2	177.2	-75.9	-72.8	0	0	0	117.5
903	S	29.7	Very low	28	Very low	80 Å²	80	118.2 Å²	118.2	56%	0.559	65%	0.65	S	S	*	*				85.2	167.6	75.4	-129.2	0	0	0	0	113	N905	S903-N905 PolarHBondContact OG-N 3.36Å
904	P	30.9	Very low	27.8	Very low	67 Å²	67	123.2 Å²	123.2	44%	0.435	65%	0.653	S	S	.	*			cis	-79	171.2	15.4	34.4	-38.2	0	0	0	115.4	V218 L219	V218-P904 VanDerWaalsContact CG1-O 3.24Å; V218-P904 WeakPolarHBondContact CG1-O 3.16Å; V218-P904 WeakPolarHBondContact O-CD 3.44Å; V218-P904 VanDerWaalsContact O-CG 3.28Å; V218-P904 WeakPolarHBondContact O-CG 3.45Å; L219-P904 HydrophobicContact CB-CG 4.48Å
905	N	28.5	Very low	27.8	Very low	86 Å²	86	120.3 Å²	120.3	46%	0.46	64%	0.644	S	S	.	*			trans	-137.9	172.7	150	-179.4	8.6	0	0	0	104.8	L219 S903	L219-N905 HydrophobicContact CD1-CB 3.72Å; S903-N905 PolarHBondContact OG-N 3.36Å
906	Q	28.7	Very low	27.8	Very low	128 Å²	128	119.7 Å²	119.7	60%	0.598	64%	0.636	S	S	*	*			trans	69.6	157.6	176.5	-49.2	124.9	37	0	0	112.5	S220	S220-Q906 WeakPolarHBondContact CB-O 3.39Å; S220-Q906 PolarHBondContact OG-O 2.96Å
907	S	27.3	Very low	27.9	Very low	63 Å²	63	123.5 Å²	123.5	44%	0.441	64%	0.642	S	S	.	*			cis	-138.3	145.4	26.4	-63	0	0	0	0	111.2	S220 S221	S220-S907 PolarHBondContact OG-N 2.8Å; S221-S907 WeakPolarHBondContact CB-O 3.41Å; S221-S907 PolarHBondContact OG-N 3.25Å; S221-S907 PolarHBondContact OG-O 2.67Å
908	S	27.3	Very low	28	Very low	86 Å²	86	121.1 Å²	121.1	60%	0.601	64%	0.638	S	S	*	*				54.3	135.7	72.3	111.4	0	0	0	0	111.9
909	Q	27.7	Very low	28.1	Very low	175 Å²	175	121 Å²	121	82%	0.818	65%	0.648	S	S	*	*			cis	-134.9	151.6	48.9	-73.6	177.9	-4.8	0	0	112.6
910	F	24.9	Very low	28.1	Very low	185 Å²	185	119.4 Å²	119.4	81%	0.811	65%	0.652	S	S	*	*				71.7	61.7	61.1	-107.2	-77.1	0	0	0	114.5
911	A	27.6	Very low	28.1	Very low	93 Å²	93	119 Å²	119	77%	0.769	66%	0.659	S	S	*	*			trans	-141.2	123.1	146.5	0	0	0	0	0	105.2
912	H	26.1	Very low	28	Very low	142 Å²	142	117.8 Å²	117.8	66%	0.657	66%	0.661	S	S	*	*			cis	69.6	128.1	27.9	-130.2	-60.5	0	0	0	112.3
913	F	25.5	Very low	28	Very low	150 Å²	150	118 Å²	118	66%	0.658	66%	0.661	S	S	*	*			trans	71.1	111.6	-169.6	-60.2	-84.7	0	0	0	112.3
914	R	25.5	Very low	28	Very low	207 Å²	207	118.4 Å²	118.4	78%	0.781	67%	0.665	S	S	*	*				81.5	143.6	60.6	-87.9	-154	-160.4	154.9	-1.3	110.9
915	S	27	Very low	27.9	Very low	83 Å²	83	120 Å²	120	58%	0.58	68%	0.677	S	S	*	*			trans	71.2	141.1	144.5	-63.3	0	0	0	0	118
916	D	28.1	Very low	27.9	Very low	125 Å²	125	121.8 Å²	121.8	67%	0.668	69%	0.687	S	S	*	*			cis	-157.7	-155.4	-21.3	-100.5	-32.6	0	0	0	104.7
917	D	30.1	Very low	28	Very low	137 Å²	137	122.8 Å²	122.8	73%	0.733	69%	0.692	S	S	*	*				30.2	125.2	128.6	-64.4	-11.4	0	0	0	117.9
918	T	29.7	Very low	28.1	Very low	134 Å²	134	126.9 Å²	126.9	82%	0.822	70%	0.704	S	S	*	*			cis	-166.9	162.9	23	2	0	0	0	0	111
919	G	28.8	Very low	28.2	Very low	67 Å²	67	128 Å²	128	69%	0.691	70%	0.703	S	S	*	*			trans	93.7	140.6	133.6	0	0	0	0	0	116.3
920	D	28.3	Very low	28.3	Very low	151 Å²	151	130.1 Å²	130.1	81%	0.807	70%	0.703	S	S	*	*			cis	-156.7	175.1	-14.1	-152.3	-11.2	0	0	0	110
921	S	28.6	Very low	28.6	Very low	80 Å²	80	125.6 Å²	125.6	56%	0.559	70%	0.7	S	S	*	*			trans	31.2	108.9	142.8	69.7	0	0	0	0	115.8
922	S	28.8	Very low	28.8	Very low	100 Å²	100	128.3 Å²	128.3	70%	0.699	70%	0.701	S	S	*	*				105.5	152.9	99.3	74.7	0	0	0	0	111
923	D	28.7	Very low	29.2	Very low	138 Å²	138	127.5 Å²	127.5	74%	0.738	71%	0.708	S	S	*	*			cis	-147.4	-174.1	-7.2	-137.1	-38.3	0	0	0	111.7
924	S	29.2	Very low	29.3	Very low	90 Å²	90	124 Å²	124	63%	0.629	71%	0.706	S	S	*	*			trans	-21.7	165.6	132.5	79.3	0	0	0	0	116.3
925	S	28.6	Very low	29.4	Very low	100 Å²	100	117.8 Å²	117.8	70%	0.699	70%	0.7	S	S	*	*			cis	-152.2	134.3	16	50.1	0	0	0	0	108.5
926	D	30.3	Very low	29.3	Very low	124 Å²	124	124.9 Å²	124.9	66%	0.663	72%	0.716	S	S	*	*				77.5	136.2	59	-162.4	25.8	0	0	0	113
927	Q	30.4	Very low	29.4	Very low	149 Å²	149	122.9 Å²	122.9	70%	0.696	72%	0.716	S	S	*	*			trans	66.1	161.5	171.9	-56.3	159.5	44.9	0	0	115.7
928	Q	29.5	Very low	29.3	Very low	149 Å²	149	123.6 Å²	123.6	70%	0.696	72%	0.72	S	S	*	*			cis	-150.8	148.7	30.3	-84	-172.1	18.5	0	0	114.8
929	N	28.9	Very low	29.4	Very low	108 Å²	108	122 Å²	122	58%	0.578	71%	0.712	S	S	*	*			trans	62.3	143.5	144.6	-67	-42.4	0	0	0	118.3
930	R	29	Very low	29.5	Very low	221 Å²	221	126 Å²	126	83%	0.834	71%	0.712	S	S	*	*			cis	-164	157.1	0.7	-110.9	162.6	-164.8	172.2	-0.5	106.6
931	A	32.1	Very low	29.5	Very low	90 Å²	90	126 Å²	126	74%	0.744	71%	0.708	S	S	*	*			cis	-151.5	162.4	6.6	0	0	0	0	0	112.6
932	L	32	Very low	29.6	Very low	150 Å²	150	126.6 Å²	126.6	79%	0.785	71%	0.712	S	S	*	*			trans	-73.2	162.5	158.6	-54.5	167.4	0	0	0	109.1	A934	L932-A934 HydrophobicContact CB-CB 4.22Å
933	P	34	Very low	29.6	Very low	125 Å²	125	126.8 Å²	126.8	81%	0.812	71%	0.705	S	S	*	*				-119	152.6	59.3	1.1	22.8	0	0	0	113.1
934	A	27.8	Very low	29.7	Very low	75 Å²	75	129.3 Å²	129.3	62%	0.62	70%	0.704	S	S	*	*			cis	77.1	146.6	25.7	0	0	0	0	0	116.7	L932	L932-A934 HydrophobicContact CB-CB 4.22Å
935	A	27	Very low	29.9	Very low	78 Å²	78	131.2 Å²	131.2	65%	0.645	70%	0.703	S	S	*	*			trans	76.7	137.1	166	0	0	0	0	0	119.6
936	Y	26.1	Very low	30	Very low	232 Å²	232	134.1 Å²	134.1	91%	0.91	71%	0.705	S	S	*	*			trans	62.3	149.5	169.1	-53.8	-79.2	0	0	0	117.9
937	A	29.2	Very low	30	Very low	83 Å²	83	132.3 Å²	132.3	69%	0.686	70%	0.702	S	S	*	*			cis	-168.2	-179.2	-25.3	0	0	0	0	0	109.3
938	N	28.5	Very low	30.2	Very low	151 Å²	151	132.7 Å²	132.7	81%	0.807	70%	0.704	S	S	*	*			trans	-48.7	148	143.1	-88.5	-34.4	0	0	0	109.4
939	P	32.5	Very low	30.3	Very low	100 Å²	100	128.5 Å²	128.5	65%	0.649	69%	0.691	S	S	*	*				-151.8	-179.4	52.8	44.4	-24.6	0	0	0	116.2
940	H	29.3	Very low	30.5	Very low	151 Å²	151	127.3 Å²	127.3	70%	0.699	69%	0.691	S	S	*	*				42.7	153.9	128.3	-65.9	-151.9	0	0	0	120
941	Q	30	Very low	30.6	Very low	153 Å²	153	119 Å²	119	72%	0.715	67%	0.674	S	S	*	*			cis	-156.4	145.8	7.2	-129.5	148.6	-9	0	0	109
942	S	29.7	Very low	30.6	Very low	92 Å²	92	122 Å²	122	64%	0.643	68%	0.678	S	S	*	*			trans	55	166.4	132.4	84.2	0	0	0	0	120.6
943	D	29.5	Very low	30.6	Very low	104 Å²	104	121.9 Å²	121.9	56%	0.556	68%	0.683	S	S	*	*			cis	-148.5	141.8	13.1	-111.4	-59.3	0	0	0	111.4
944	R	30.6	Very low	30.3	Very low	191 Å²	191	124.3 Å²	124.3	72%	0.721	68%	0.683	S	S	*	*			trans	69.9	147.9	143.3	-59.7	173.9	-157.7	-159.1	2.8	119.6
945	H	33.2	Very low	31	Very low	130 Å²	130	125.2 Å²	125.2	60%	0.602	68%	0.683	S	S	*	*			cis	-156.3	135.7	-12.5	-102.5	-42.4	0	0	0	106.2
946	Q	30.2	Very low	31.2	Very low	161 Å²	161	127.2 Å²	127.2	75%	0.752	69%	0.69	S	S	*	*				58.9	138.4	105.4	-74.2	172.1	-15.1	0	0	116.2
947	S	30.4	Very low	31.5	Very low	85 Å²	85	121.8 Å²	121.8	59%	0.594	68%	0.683	S	S	*	*			cis	179.8	157.7	4.6	46.2	0	0	0	0	115
948	H	34.9	Very low	31.7	Very low	157 Å²	157	122 Å²	122	73%	0.727	69%	0.685	S	S	*	*			trans	67.5	111.8	150.5	-61.2	-40.4	0	0	0	119.1
949	S	31.5	Very low	31.8	Very low	61 Å²	61	120.9 Å²	120.9	43%	0.427	69%	0.686	S	S	.	*				67.7	146.6	83.6	84	0	0	0	0	115.3	D1112	S949-D1112 PolarHBondContact N-O 3.06Å
950	S	32.5	Very low	31.8	Very low	83 Å²	83	121.2 Å²	121.2	58%	0.58	69%	0.69	S	S	*	*			cis	-174.2	156.1	16.4	48.3	0	0	0	0	111.9	D1112	S950-D1112 WeakPolarHBondContact CA-OD2 3.45Å
951	G	32.7	Very low	32.3	Very low	47 Å²	47	118.8 Å²	118.8	49%	0.485	69%	0.688	S	S	.	*				139.4	128.6	127.8	0	0	0	0	0	121.1	D1112	G951-D1112 PolarHBondContact N-OD2 2.99Å
952	D	30.8	Very low	32.4	Very low	152 Å²	152	122.6 Å²	122.6	81%	0.813	70%	0.696	S	S	*	*			trans	-13.7	124.2	157.7	-63.9	-70.8	0	0	0	120.1
953	V	33.2	Very low	32.6	Very low	149 Å²	149	123 Å²	123	90%	0.903	70%	0.699	S	S	*	*			trans	-146.8	109.7	143.5	-177	0	0	0	0	111.5
954	E	27.7	Very low	32.8	Very low	175 Å²	175	121.1 Å²	121.1	82%	0.818	69%	0.693	S	S	*	*			trans	-91.5	-171.7	168	-130.4	-137.8	125.6	0	0	111.2
955	P	42.2	Very low	33	Very low	94 Å²	94	115.4 Å²	115.4	61%	0.61	68%	0.683	S	S	*	*			trans	-80.9	169.7	-153.2	40	-43	0	0	0	113.8
956	P	31.4	Very low	32.9	Very low	121 Å²	121	112.9 Å²	112.9	79%	0.786	68%	0.68	S	S	*	*				-147	-137.3	95	34.5	-10.3	0	0	0	114.3
957	P	31.4	Very low	33.1	Very low	117 Å²	117	108.9 Å²	108.9	76%	0.76	67%	0.67	S	S	*	*				-126.1	-177	-108.4	41.1	-22.6	0	0	0	116.2
958	A	32.9	Very low	33.1	Very low	88 Å²	88	109.4 Å²	109.4	73%	0.727	67%	0.67	S	S	*	*			trans	-68	161.7	177.9	0	0	0	0	0	114.4
959	P	30.6	Very low	33	Very low	128 Å²	128	105.2 Å²	105.2	83%	0.831	66%	0.658	S	S	*	*				-147.2	167.3	98.1	39.4	-24.3	0	0	0	116.8
960	S	33.8	Very low	32.9	Very low	106 Å²	106	105.7 Å²	105.7	74%	0.741	66%	0.661	S	S	*	*			trans	-98.2	-162.6	171.2	-34.1	0	0	0	0	110.8
961	P	39.7	Very low	32.9	Very low	101 Å²	101	106.7 Å²	106.7	66%	0.656	67%	0.668	S	S	*	*			cis	-138.4	-166.5	-16	39.2	-19.4	0	0	0	114.6
962	R	30.9	Very low	32.8	Very low	232 Å²	232	109.3 Å²	109.3	88%	0.875	68%	0.679	S	S	*	*			trans	71.7	156.5	157.7	-67.5	166.5	-173.9	-107.4	-0.5	117.7
963	S	35.1	Very low	32.9	Very low	102 Å²	102	107.7 Å²	107.7	71%	0.713	68%	0.679	S	S	*	*			cis	-172.4	148.6	-27.2	56.1	0	0	0	0	107.5
964	S	33.5	Very low	32.9	Very low	63 Å²	63	106.6 Å²	106.6	44%	0.441	68%	0.679	S	S	.	*				-178	149.4	77.7	53.5	0	0	0	0	111.8	R791 R792	R791-S964 PolarHBondContact NH2-O 3.21Å; R792-S964 VanDerWaalsContact CZ-O 3.26Å; R792-S964 PolarHBondContact NH2-O 2.92Å
965	S	33.5	Very low	33.1	Very low	71 Å²	71	108 Å²	108	50%	0.497	68%	0.676	S	S	.	*			trans	42.1	139.7	160.7	59.8	0	0	0	0	121.1	R791 R792	R791-S965 PolarHBondContact NE-O 3.22Å; R791-S965 PolarHBondContact NH2-O 2.97Å; R792-S965 PolarHBondContact NE-O 3.32Å; R792-S965 VanDerWaalsContact NE-O 3.11Å; R792-S965 PolarHBondContact NH2-O 2.82Å; R792-S965 PolarHBondContact NH2-OG 3.25Å
966	S	32.9	Very low	32.5	Very low	77 Å²	77	109 Å²	109	54%	0.538	69%	0.686	S	S	.	*			cis	-174.9	164.2	-5.8	40.5	0	0	0	0	106.4
967	S	32.7	Very low	32.4	Very low	77 Å²	77	111.9 Å²	111.9	54%	0.538	68%	0.682	S	S	.	*			cis	-172.7	120.8	-21.9	48.1	0	0	0	0	110.5
968	T	31.7	Very low	32.3	Very low	97 Å²	97	109.8 Å²	109.8	60%	0.595	67%	0.669	S	S	*	*				167.2	-174.6	121.8	40.4	0	0	0	0	110.5	K789 T790	K789-T968 WeakPolarHBondContact CD-OG1 3.4Å; K789-T968 VanDerWaalsContact CE-OG1 3.25Å; K789-T968 WeakPolarHBondContact CE-OG1 3.5Å; K789-T968 WeakPolarHBondContact CG-OG1 3.47Å; T790-T968 PolarHBondContact OG1-N 3.19Å
969	S	31.2	Very low	32	Very low	68 Å²	68	108.8 Å²	108.8	48%	0.476	65%	0.65	S	S	.	*			trans	-98.7	156.1	-153.9	62.5	0	0	0	0	120.3	K789	K789-S969 WeakPolarHBondContact CD-O 3.2Å; K789-S969 WeakPolarHBondContact CE-O 3.46Å; K789-S969 PolarHBondContact NZ-O 3.03Å
970	S	30.9	Very low	32	Very low	72 Å²	72	108.6 Å²	108.6	50%	0.503	64%	0.64	S	S	.	*			trans	63	139.3	135	60	0	0	0	0	120.9	N788	N788-S970 VanDerWaalsContact CB-O 3.31Å; N788-S970 WeakPolarHBondContact CB-O 3.36Å; N788-S970 PolarHBondContact ND2-O 2.81Å
971	S	31.3	Very low	31.7	Very low	103 Å²	103	113.9 Å²	113.9	72%	0.72	64%	0.644	S	S	*	*			cis	-167.8	152.2	-2.6	37.3	0	0	0	0	111.9
972	S	31.8	Very low	31.1	Very low	103 Å²	103	114.3 Å²	114.3	72%	0.72	65%	0.65	S	S	*	*			trans	-11.8	133.8	159.3	49.7	0	0	0	0	117.6
973	S	31.9	Very low	31.1	Very low	117 Å²	117	108.8 Å²	108.8	82%	0.818	65%	0.647	S	S	*	*			cis	62.6	100.7	12.4	-153.1	0	0	0	0	116
974	S	33	Very low	30.7	Very low	127 Å²	127	109.3 Å²	109.3	89%	0.888	65%	0.65	S	S	*	*			trans	-107.1	139.9	167.6	-68.4	0	0	0	0	109.5
975	R	32.2	Very low	30.6	Very low	204 Å²	204	111.7 Å²	111.7	77%	0.77	67%	0.667	S	S	*	*			trans	-144.5	119.6	-167.4	-175.4	-176.3	-173.8	-174	1.9	111.8
976	S	30.8	Very low	30.5	Very low	115 Å²	115	115.4 Å²	115.4	80%	0.804	68%	0.681	S	S	*	*			trans	-158.1	124.2	163.7	-72.7	0	0	0	0	107.2
977	Y	28.6	Very low	30.7	Very low	181 Å²	181	117.4 Å²	117.4	71%	0.71	69%	0.692	S	S	*	*				62.8	125.8	62.3	-78.4	-108.7	0	0	0	112.7
978	C	28.4	Very low	30.7	Very low	73 Å²	73	118.7 Å²	118.7	49%	0.493	70%	0.699	S	S	.	*			cis	-158.3	-165.8	-4.7	-135.1	0	0	0	0	114.1
979	H	28.4	Very low	30.7	Very low	68 Å²	68	122.6 Å²	122.6	32%	0.315	71%	0.71	S	S	.	*			trans	-28.7	157.7	174.2	-47.6	-68.7	0	0	0	117.7
980	I	29.6	Very low	30.6	Very low	124 Å²	124	126.2 Å²	126.2	64%	0.636	72%	0.724	S	S	*	*				-166.3	142.8	70.9	-86.3	-176.6	0	0	0	112
981	R	26.9	Very low	30.5	Very low	216 Å²	216	130 Å²	130	82%	0.815	74%	0.739	S	S	*	*			trans	45.9	124.5	156.2	-73.9	172.9	172.7	163.1	-5.5	119.8
982	S	27.7	Very low	30.5	Very low	111 Å²	111	130.9 Å²	130.9	78%	0.776	73%	0.73	S	S	*	*				73.5	137.1	86.3	-49.1	0	0	0	0	113.6
983	S	30.8	Very low	30.4	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	72%	0.72	S	S	*	*			cis	-151.4	155.1	9.1	27.5	0	0	0	0	112.4
984	S	26.9	Very low	30.2	Very low	112 Å²	112	131 Å²	131	78%	0.783	71%	0.708	S	S	*	*			trans	-73.4	144.4	179	52	0	0	0	0	114.3
985	S	31.2	Very low	30	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	70%	0.702	S	S	*	*			trans	-154.3	104.6	151.4	57.9	0	0	0	0	111
986	N	32.1	Very low	29.9	Very low	150 Å²	150	127.3 Å²	127.3	80%	0.802	71%	0.705	S	S	*	*			trans	-69.6	165.2	164.6	-58.8	-2.3	0	0	0	109.7
987	P	37.6	Very low	29.9	Very low	118 Å²	118	126.8 Å²	126.8	77%	0.766	70%	0.701	S	S	*	*				-109.9	162.4	122	-15.7	33	0	0	0	114.3
988	P	31.8	Very low	30.1	Very low	105 Å²	105	123.9 Å²	123.9	68%	0.682	71%	0.708	S	S	*	*			trans	-80.5	-172.2	168.5	31.5	-21.9	0	0	0	110.3
989	E	30.8	Very low	30.3	Very low	178 Å²	178	124 Å²	124	83%	0.832	72%	0.721	S	S	*	*			cis	-156.4	148.8	47.2	-68.1	162.1	165.6	0	0	108.9
990	N	29.8	Very low	30.6	Very low	145 Å²	145	126.3 Å²	126.3	78%	0.775	74%	0.744	S	S	*	*			cis	76.4	51.5	17.5	-123.7	17	0	0	0	116.8	K992	N990-K992 PolarHBondContact O-N 3.22Å
991	N	28.5	Very low	30.7	Very low	152 Å²	152	125.2 Å²	125.2	81%	0.813	75%	0.748	S	S	*	*			trans	-53.1	112	163.5	-82.6	-41.2	0	0	0	112.5
992	K	32.5	Very low	31	Very low	120 Å²	120	125.3 Å²	125.3	52%	0.522	75%	0.748	S	S	.	*			trans	-143.1	92.5	163.8	-73.6	-148	164.4	-167.7	0	117.6	L586 F587 N990	L586-K992 HydrophobicContact CB-CD 4.42Å; L586-K992 PolarHBondContact O-NZ 2.92Å; F587-K992 HydrophobicContact CD2-CB 4.24Å; F587-K992 HydrophobicContact CD2-CD 3.57Å; F587-K992 VanDerWaalsContact CD2-CE 3.48Å; F587-K992 HydrophobicContact CD2-CG 3.67Å; F587-K992 HydrophobicContact CE2-CB 3.56Å; F587-K992 HydrophobicContact CE2-CD 3.82Å; F587-K992 HydrophobicContact CE2-CG 3.39Å; F587-K992 HydrophobicContact CG-CD 4.42Å; F587-K992 HydrophobicContact CZ-CB 4.23Å; F587-K992 HydrophobicContact CZ-CG 4.04Å; N990-K992 PolarHBondContact O-N 3.22Å
993	I	28.2	Very low	31.4	Very low	103 Å²	103	127.8 Å²	127.8	53%	0.528	75%	0.747	S	S	.	*			trans	30.1	154.5	149.6	-80.6	170.3	0	0	0	123.1	L586 F587	L586-I993 HydrophobicContact CD2-CB 3.7Å; L586-I993 HydrophobicContact CD2-CG2 3.41Å; L586-I993 VanDerWaalsContact CD2-CG2 3.41Å; F587-I993 HydrophobicContact CD1-CD1 4.44Å; F587-I993 HydrophobicContact CD2-CD1 4.28Å; F587-I993 HydrophobicContact CE1-CD1 3.84Å; F587-I993 HydrophobicContact CE1-CG1 4.28Å; F587-I993 HydrophobicContact CE2-CB 3.63Å; F587-I993 HydrophobicContact CE2-CD1 3.61Å; F587-I993 HydrophobicContact CE2-CG1 3.7Å; F587-I993 HydrophobicContact CZ-CB 3.87Å; F587-I993 HydrophobicContact CZ-CD1 3.38Å; F587-I993 HydrophobicContact CZ-CG1 3.42Å; F587-I993 VanDerWaalsContact CZ-CG1 3.42Å
994	Q	29.2	Very low	31.5	Very low	121 Å²	121	127.4 Å²	127.4	57%	0.565	74%	0.744	S	S	*	*			trans	92.2	85.9	156.8	-94.6	157.5	-1.4	0	0	121.3	D585	D585-Q994 PolarHBondContact OD2-NE2 2.7Å
995	A	28.9	Very low	31.7	Very low	92 Å²	92	126.3 Å²	126.3	76%	0.76	74%	0.737	S	S	*	*				63.6	156.8	106.8	0	0	0	0	0	124.5
996	I	29.5	Very low	31.7	Very low	161 Å²	161	127 Å²	127	83%	0.826	74%	0.737	S	S	*	*			trans	100.3	116.4	157.3	-57.2	-178.9	0	0	0	120.3
997	S	30.4	Very low	31.4	Very low	103 Å²	103	124 Å²	124	72%	0.72	73%	0.727	S	S	*	*			trans	68.2	103.3	151.1	-78	0	0	0	0	125.6
998	S	32	Very low	31.1	Very low	121 Å²	121	127 Å²	127	85%	0.846	73%	0.731	S	S	*	*				54.4	143.9	105.1	72.8	0	0	0	0	123.7
999	G	33.2	Very low	30.9	Very low	75 Å²	75	126 Å²	126	77%	0.773	73%	0.727	S	S	*	*			trans	166.7	74.9	169.2	0	0	0	0	0	120.1
1000	S	34.8	Very low	30.8	Very low	116 Å²	116	125.8 Å²	125.8	81%	0.811	73%	0.726	S	S	*	*			trans	49.1	107	148.2	-58.5	0	0	0	0	124.8
1001	S	32.2	Very low	30.7	Very low	101 Å²	101	124 Å²	124	71%	0.706	72%	0.716	S	S	*	*				33.9	144.3	121.5	64.5	0	0	0	0	122.8
1002	R	33.6	Very low	30.8	Very low	219 Å²	219	126.7 Å²	126.7	83%	0.826	72%	0.715	S	S	*	*				-169	154.6	79.5	-87.5	-178.6	167.9	171.6	-2.1	114.7
1003	H	35.4	Very low	30.7	Very low	163 Å²	163	126.2 Å²	126.2	76%	0.755	72%	0.721	S	S	*	*			trans	11.4	153.7	143.4	-48.3	-60.3	0	0	0	120
1004	S	32.5	Very low	30.9	Very low	107 Å²	107	131.9 Å²	131.9	75%	0.748	74%	0.736	S	S	*	*			cis	171.2	170.2	9.1	37.4	0	0	0	0	106.5
1005	S	32.1	Very low	31.2	Very low	90 Å²	90	134.1 Å²	134.1	63%	0.629	75%	0.746	S	S	*	*			cis	-173.1	171.2	-14.1	49.6	0	0	0	0	107.4
1006	T	30	Very low	31.4	Very low	128 Å²	128	136.8 Å²	136.8	79%	0.785	75%	0.753	S	S	*	*			trans	61.6	159	156.4	39.5	0	0	0	0	118.6
1007	S	27.3	Very low	31.6	Very low	85 Å²	85	136.9 Å²	136.9	59%	0.594	75%	0.75	S	S	*	*			cis	-173.6	167.6	-37.7	52.2	0	0	0	0	107.7
1008	Q	30.9	Very low	31.6	Very low	182 Å²	182	136 Å²	136	85%	0.85	74%	0.744	S	S	*	*			trans	65.1	166.3	168.3	-61.9	174.9	6.2	0	0	115.4
1009	S	26.8	Very low	31.7	Very low	85 Å²	85	139.8 Å²	139.8	59%	0.594	75%	0.745	S	S	*	*			cis	-167	148.6	-37.4	56.8	0	0	0	0	110.8
1010	Q	28.8	Very low	31.8	Very low	173 Å²	173	141.2 Å²	141.2	81%	0.808	74%	0.743	S	S	*	*			trans	68.3	156.7	152.3	-73.8	177.8	-34.9	0	0	121.3
1011	D	28.4	Very low	31.8	Very low	106 Å²	106	145.9 Å²	145.9	57%	0.567	74%	0.743	S	S	*	*			trans	77	103	143.4	-78.7	10.6	0	0	0	124.4
1012	R	29.7	Very low	31.8	Very low	210 Å²	210	150.7 Å²	150.7	79%	0.792	75%	0.746	S	S	*	*				102.7	111.3	105.9	-80.6	-179.3	-166.6	-159.7	4	123
1013	V	31.5	Very low	31.7	Very low	109 Å²	109	148 Å²	148	66%	0.661	74%	0.743	S	S	*	*				91.8	148.1	110.9	163.4	0	0	0	0	122.5
1014	R	32.3	Very low	31.4	Very low	223 Å²	223	143.1 Å²	143.1	84%	0.842	74%	0.737	S	S	*	*			trans	79.9	124.6	172.4	-74.8	144.3	-162.8	-165.4	2.7	115.9
1015	H	34.5	Very low	31.4	Very low	167 Å²	167	146.1 Å²	146.1	77%	0.773	74%	0.743	S	S	*	*			cis	94.9	118.4	32.9	-83.2	-44	0	0	0	114.7
1016	T	33.6	Very low	31.3	Very low	148 Å²	148	151 Å²	151	91%	0.908	75%	0.753	S	S	*	*				-171.9	177.9	126.8	19.5	0	0	0	0	110.4
1017	Q	33.1	Very low	31.6	Very low	163 Å²	163	150.1 Å²	150.1	76%	0.762	75%	0.749	S	S	*	*				-148.6	153.4	-114.6	-130.7	-162.8	41.4	0	0	116.3
1018	S	31.3	Very low	31.9	Very low	85 Å²	85	156.1 Å²	156.1	59%	0.594	77%	0.765	S	S	*	*			trans	67.3	122	141.4	-59.8	0	0	0	0	122.1
1019	K	34.2	Very low	31.8	Very low	200 Å²	200	152.1 Å²	152.1	87%	0.87	76%	0.757	S	S	*	*				171.2	127.2	108.5	-93.3	163	-175.8	173.5	0	116.5
1020	S	34.6	Very low	31.8	Very low	105 Å²	105	156.4 Å²	156.4	73%	0.734	77%	0.765	S	S	*	*				68	137.4	127.8	-152.7	0	0	0	0	120.3
1021	R	34	Very low	31.8	Very low	215 Å²	215	151.7 Å²	151.7	81%	0.811	74%	0.741	S	S	*	*			cis	-160.3	151.9	7.1	-137.3	173.6	177.5	179.5	-3.1	113
1022	R	34.1	Very low	31.7	Very low	202 Å²	202	150.6 Å²	150.6	76%	0.762	74%	0.735	S	S	*	*			trans	1.3	154.6	143.8	-60.3	175.6	171.1	-160.8	-1.2	119.4
1023	Q	31.6	Very low	31.6	Very low	161 Å²	161	144.8 Å²	144.8	75%	0.752	72%	0.72	S	S	*	*			cis	-170.4	-179.4	-2.9	-109.3	171.4	-93.7	0	0	107.3
1024	G	27.5	Very low	31.4	Very low	62 Å²	62	144.8 Å²	144.8	64%	0.639	72%	0.716	S	S	*	*			cis	159.4	-157.9	1.9	0	0	0	0	0	112
1025	I	33	Very low	31.2	Very low	169 Å²	169	138 Å²	138	87%	0.867	70%	0.703	S	S	*	*			trans	72.8	115.6	171	-54.7	-179.5	0	0	0	117.9
1026	K	29.1	Very low	30.9	Very low	193 Å²	193	136.9 Å²	136.9	84%	0.839	70%	0.702	S	S	*	*			trans	-101	-170.3	164.6	-60.5	177.5	179.8	175.7	0	109.2
1027	P	38.3	Very low	30.8	Very low	109 Å²	109	135.8 Å²	135.8	71%	0.708	69%	0.691	S	S	*	*				-124.5	-176.9	-66.3	38	-23.7	0	0	0	110.7
1028	K	32.5	Very low	30.9	Very low	212 Å²	212	134.5 Å²	134.5	92%	0.922	69%	0.685	S	S	*	*			trans	-164.2	162.6	136.1	-109.6	150	-170.4	172.4	0	112.4
1029	S	28.3	Very low	30.8	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	68%	0.68	S	S	*	*			trans	-114.2	178	176.9	56.9	0	0	0	0	110.3
1030	K	28.2	Very low	30.7	Very low	175 Å²	175	132.4 Å²	132.4	76%	0.761	67%	0.672	S	S	*	*			trans	79.8	112.6	157	-69.9	-172.6	173.9	-179.9	0	120.7
1031	K	28.1	Very low	30.5	Very low	74 Å²	74	134.3 Å²	134.3	32%	0.322	67%	0.669	S	S	.	*				86.5	89.7	111.8	-64.3	-165.9	127.2	-159.1	0	122.8	T1431 S1432 R1433	K1031-T1431 WeakPolarHBondContact CE-O 3.38Å; K1031-T1431 WeakPolarHBondContact CG-O 3.45Å; K1031-S1432 VanDerWaalsContact CE-CA 3.43Å; K1031-S1432 WeakPolarHBondContact CE-O 3.14Å; K1031-S1432 PolarHBondContact NZ-O 2.98Å; K1031-R1433 HydrophobicContact CB-CG 4.27Å; K1031-R1433 VanDerWaalsContact CD-O 3.22Å; K1031-R1433 WeakPolarHBondContact CD-O 3.32Å; K1031-R1433 WeakPolarHBondContact CE-O 3.5Å; K1031-R1433 PolarHBondContact NZ-O 3.45Å; K1031-R1433 PolarHBondContact O-NE 2.96Å
1032	L	26.6	Very low	30.1	Very low	82 Å²	82	128.7 Å²	128.7	43%	0.429	66%	0.658	S	S	.	*				-139.5	149	125.5	-150.6	87.7	0	0	0	113.6	T1431 R1433	L1032-T1431 VanDerWaalsContact C-CB 3.44Å; L1032-T1431 VanDerWaalsContact C-OG1 3.22Å; L1032-T1431 VanDerWaalsContact N-CG2 3.31Å; L1032-T1431 WeakPolarHBondContact O-CB 3.32Å; L1032-T1431 WeakPolarHBondContact O-CG2 3.35Å; L1032-T1431 PolarHBondContact O-OG1 3.1Å; L1032-R1433 HydrophobicContact CD1-CG 4.39Å; L1032-R1433 VanDerWaalsContact CD1-NE 3.32Å
1033	N	26.7	Very low	29.9	Very low	88 Å²	88	130.1 Å²	130.1	47%	0.471	66%	0.664	S	S	.	*			trans	-64.7	-170.5	169.9	-41.9	-29.3	0	0	0	110.6	S1432	N1033-S1432 PolarHBondContact ND2-OG 3.38Å; N1033-S1432 WeakPolarHBondContact OD1-CB 3.33Å; N1033-S1432 PolarHBondContact OD1-N 2.68Å; N1033-S1432 PolarHBondContact OD1-OG 2.98Å
1034	D	27.8	Very low	29.7	Very low	109 Å²	109	127.2 Å²	127.2	58%	0.583	66%	0.662	S	S	*	*				-162.8	144	53.6	-91.7	-58.2	0	0	0	108.4
1035	S	28.2	Very low	29.8	Very low	81 Å²	81	130.5 Å²	130.5	57%	0.566	66%	0.664	S	S	*	*				79.6	154	71.8	-47.7	0	0	0	0	112.8
1036	D	29	Very low	29.6	Very low	143 Å²	143	130.7 Å²	130.7	77%	0.765	66%	0.658	S	S	*	*			trans	68.1	146.5	172.4	-40.9	-26.8	0	0	0	114.7
1037	D	30.2	Very low	29.6	Very low	125 Å²	125	127.2 Å²	127.2	67%	0.668	65%	0.645	S	S	*	*			cis	-158.1	170.4	-20.9	-118.1	-28.9	0	0	0	107.3
1038	H	35.3	Very low	29.3	Very low	137 Å²	137	128.3 Å²	128.3	63%	0.634	64%	0.638	S	S	*	*			cis	-152.6	170.4	14.5	-143	23.9	0	0	0	111.2
1039	N	29	Very low	29.2	Very low	91 Å²	91	127.5 Å²	127.5	49%	0.487	64%	0.635	S	S	.	*			trans	7.2	147	139.7	-77.3	-53	0	0	0	120.5
1040	Q	32.8	Very low	29.3	Very low	149 Å²	149	131 Å²	131	70%	0.696	64%	0.638	S	S	*	*			cis	-159.2	140	25.2	-131.8	150.3	64.9	0	0	113.6
1041	Q	29.1	Very low	29.2	Very low	146 Å²	146	129.5 Å²	129.5	68%	0.682	64%	0.635	S	S	*	*				25.7	154.1	127.3	-50.4	179.2	27.9	0	0	121.8
1042	T	26.6	Very low	29	Very low	96 Å²	96	130.2 Å²	130.2	59%	0.589	65%	0.65	S	S	*	*			cis	-172	171.7	-28.2	48.5	0	0	0	0	107.1
1043	R	30	Very low	29	Very low	233 Å²	233	130.4 Å²	130.4	88%	0.879	65%	0.654	S	S	*	*			trans	71.1	156.3	158.9	-64.4	158.5	-174.8	-171.1	2.4	116.3
1044	S	27.2	Very low	28.9	Very low	100 Å²	100	131.5 Å²	131.5	70%	0.699	67%	0.669	S	S	*	*			cis	-168.2	162.5	-34.8	-150.8	0	0	0	0	111.4
1045	L	29.1	Very low	28.9	Very low	131 Å²	131	134.1 Å²	134.1	69%	0.686	68%	0.682	S	S	*	*			trans	72.3	110.4	155.6	-60	165.8	0	0	0	122.1
1046	K	30.3	Very low	28.7	Very low	172 Å²	172	135.5 Å²	135.5	75%	0.748	69%	0.69	S	S	*	*				83.2	118.2	121.2	-73.6	177.1	179.4	159.6	0	123.2
1047	E	28.7	Very low	28.6	Very low	120 Å²	120	136.6 Å²	136.6	56%	0.561	69%	0.69	S	S	*	*			trans	82.2	104.4	130.2	-68.9	-155.6	149.9	0	0	122.3
1048	K	31.6	Very low	28.4	Very low	132 Å²	132	139.4 Å²	139.4	57%	0.574	69%	0.692	S	S	*	*				83.7	128.9	127.3	-65.7	168.2	-173.5	149.9	0	120.9
1049	K	30.9	Very low	28	Very low	195 Å²	195	136.8 Å²	136.8	85%	0.848	69%	0.689	S	S	*	*			trans	37.1	120.9	132.6	-60	-170.7	175.3	-165.7	0	116
1050	K	28.9	Very low	27.9	Very low	171 Å²	171	136.1 Å²	136.1	74%	0.743	69%	0.692	S	S	*	*				-175.4	156	58.7	-136.5	-176.6	177.5	-155.1	0	111
1051	M	26.3	Very low	27.7	Very low	145 Å²	145	135.1 Å²	135.1	71%	0.714	69%	0.691	S	S	*	*			trans	50.7	111.8	145.5	-78.2	159.5	158.7	0	0	120.9
1052	S	25.1	Very low	27.7	Very low	89 Å²	89	133.1 Å²	133.1	62%	0.622	69%	0.693	S	S	*	*				85.7	150.4	129.1	-51.3	0	0	0	0	121.6
1053	T	25.4	Very low	27.7	Very low	85 Å²	85	134.3 Å²	134.3	52%	0.521	70%	0.7	S	S	.	*			trans	78.1	151.6	161.4	71.2	0	0	0	0	120.8	D211	D211-T1053 HydrophobicContact CB-CG2 4.08Å
1054	S	25.3	Very low	27.7	Very low	111 Å²	111	130 Å²	130	78%	0.776	70%	0.695	S	S	*	*			trans	83.2	137.4	155.2	73.5	0	0	0	0	120.7
1055	L	27.5	Very low	27.9	Very low	164 Å²	164	131.5 Å²	131.5	86%	0.859	69%	0.694	S	S	*	*			trans	-71.9	144.7	159.5	-68.6	69.6	0	0	0	109.6
1056	C	24.7	Very low	27.9	Very low	110 Å²	110	131.6 Å²	131.6	74%	0.743	70%	0.695	S	S	*	*			trans	-169.3	125.5	136.9	-97.6	0	0	0	0	107.2
1057	H	26.7	Very low	27.9	Very low	166 Å²	166	130.1 Å²	130.1	77%	0.769	70%	0.695	S	S	*	*				63.5	141.6	83.9	-77.9	-13.6	0	0	0	114.3
1058	R	25.9	Very low	27.9	Very low	184 Å²	184	130 Å²	130	69%	0.694	70%	0.698	S	S	*	*			cis	-173.7	165.8	-21.4	-157.9	-179.1	-175.6	-163.3	0.2	105.9
1059	S	26.4	Very low	27.8	Very low	82 Å²	82	129.6 Å²	129.6	57%	0.573	70%	0.702	S	S	*	*			trans	77.6	160.6	168.7	-24.9	0	0	0	0	113.8
1060	S	27.4	Very low	27.7	Very low	78 Å²	78	125.6 Å²	125.6	55%	0.545	69%	0.69	S	S	.	*			cis	-149.2	152.2	14.1	-28.8	0	0	0	0	112.8
1061	D	28.8	Very low	27.8	Very low	127 Å²	127	122.4 Å²	122.4	68%	0.679	67%	0.673	S	S	*	*			trans	63.5	145.4	148.7	-41.1	-27.1	0	0	0	116.3	K229	K229-D1061 IonicContact NZ-OD1 2.87Å; K229-D1061 PolarHBondContact NZ-OD1 2.74Å; K229-D1061 VanDerWaalsContact NZ-OD1 3.14Å; K229-D1061 IonicContact NZ-OD2 3.92Å; K229-D1061 PolarHBondContact NZ-OD2 3.27Å
1062	S	28	Very low	28.1	Very low	104 Å²	104	124 Å²	124	73%	0.727	67%	0.671	S	S	*	*			cis	-157.1	137	-2	39.9	0	0	0	0	107.5
1063	V	27.9	Very low	28.2	Very low	122 Å²	122	127 Å²	127	74%	0.739	68%	0.675	S	S	*	*				68.4	108.4	68	168.2	0	0	0	0	112.4
1064	D	29.1	Very low	28.5	Very low	143 Å²	143	130 Å²	130	77%	0.765	69%	0.687	S	S	*	*			cis	-129.7	-94	-19.7	-89.9	-54.2	0	0	0	113.4
1065	D	32.2	Very low	28.7	Very low	130 Å²	130	129.7 Å²	129.7	70%	0.695	68%	0.684	S	S	*	*			cis	-163	105.4	-6.2	-166.8	35.8	0	0	0	114.1
1066	I	28.6	Very low	28.8	Very low	134 Å²	134	129.2 Å²	129.2	69%	0.687	68%	0.683	S	S	*	*			trans	55.3	134.7	137.1	-62.3	-177.4	0	0	0	124.1
1067	N	29.9	Very low	29.4	Very low	141 Å²	141	128.8 Å²	128.8	75%	0.754	68%	0.679	S	S	*	*			trans	66.6	155.2	157.4	-79.9	17.1	0	0	0	120.9
1068	D	29.3	Very low	29.4	Very low	118 Å²	118	126.8 Å²	126.8	63%	0.631	68%	0.678	S	S	*	*			cis	-163.7	159.9	-30.9	-149.8	-5.9	0	0	0	111.2
1069	N	29.4	Very low	29.6	Very low	123 Å²	123	127.9 Å²	127.9	66%	0.658	68%	0.683	S	S	*	*			trans	57.1	157.8	157.1	-70.6	-54.4	0	0	0	123.1
1070	N	30	Very low	29.6	Very low	110 Å²	110	127.8 Å²	127.8	59%	0.588	68%	0.683	S	S	*	*			trans	66.2	141.9	157.3	-66.2	-6.9	0	0	0	120	E655	E655-N1070 PolarHBondContact OE1-ND2 2.9Å
1071	R	30.8	Very low	29.7	Very low	105 Å²	105	133.6 Å²	133.6	40%	0.396	69%	0.694	S	S	.	*			cis	-153.3	172.6	-17.7	-123.2	146.4	101.6	174.7	164.9	108.8	E655 S656	E655-R1071 VanDerWaalsContact CA-NE 3.34Å; E655-R1071 VanDerWaalsContact CD-NH1 3.3Å; E655-R1071 PolarHBondContact O-NE 3.34Å; E655-R1071 PolarHBondContact O-NH1 2.75Å; E655-R1071 VanDerWaalsContact OE1-CD 3.31Å; E655-R1071 WeakPolarHBondContact OE1-CD 3.39Å; E655-R1071 IonicContact OE1-CZ 3.09Å; E655-R1071 IonicContact OE1-NE 3.41Å; E655-R1071 PolarHBondContact OE1-NE 3.29Å; E655-R1071 IonicContact OE1-NH1 3.79Å; E655-R1071 IonicContact OE1-NH2 2.67Å; E655-R1071 PolarHBondContact OE1-NH2 3.42Å; E655-R1071 IonicContact OE2-CZ 2.95Å; E655-R1071 IonicContact OE2-NE 3.79Å; E655-R1071 IonicContact OE2-NH1 2.8Å; E655-R1071 PolarHBondContact OE2-NH1 3.25Å; E655-R1071 IonicContact OE2-NH2 2.86Å; E655-R1071 PolarHBondContact OE2-NH2 2.97Å; S656-R1071 VanDerWaalsContact OG-CZ 3.23Å; S656-R1071 PolarHBondContact OG-NE 2.82Å; S656-R1071 PolarHBondContact OG-NH1 3.07Å; S656-R1071 VanDerWaalsContact OG-NH1 3.15Å
1072	R	31	Very low	29.6	Very low	177 Å²	177	138 Å²	138	67%	0.668	70%	0.702	S	S	*	*			trans	-73.1	148.7	-177.2	-57.3	170.5	178.1	146	-2.1	112.5
1073	E	27.8	Very low	29.8	Very low	152 Å²	152	139.6 Å²	139.6	71%	0.71	70%	0.702	S	S	*	*				-178.3	174	112.1	-101.7	179.2	-145.8	0	0	116.3
1074	I	31.1	Very low	29.9	Very low	149 Å²	149	137.9 Å²	137.9	76%	0.764	70%	0.695	S	S	*	*			trans	78.7	128.2	164.9	-35.4	-169.9	0	0	0	120.8
1075	S	29.8	Very low	29.8	Very low	104 Å²	104	136.1 Å²	136.1	73%	0.727	69%	0.694	S	S	*	*			trans	63.8	91.6	157.7	53.5	0	0	0	0	122.7
1076	N	29.5	Very low	29.7	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	70%	0.696	S	S	*	*				12.3	157.2	105.7	-82	-10.5	0	0	0	120.4
1077	P	37.4	Very low	29.8	Very low	101 Å²	101	135 Å²	135	66%	0.656	70%	0.698	S	S	*	*			cis	-148.1	178.8	-22.6	41.6	-22.9	0	0	0	116.7
1078	V	28.2	Very low	29.9	Very low	124 Å²	124	134.4 Å²	134.4	75%	0.752	69%	0.694	S	S	*	*			trans	67.4	133.9	142.8	162.8	0	0	0	0	119.6
1079	Y	28.5	Very low	30.1	Very low	206 Å²	206	137.2 Å²	137.2	81%	0.808	70%	0.7	S	S	*	*			cis	-155.5	179	-4.4	-130.2	-135.5	0	0	0	111.6
1080	S	27.1	Very low	30.1	Very low	80 Å²	80	137.9 Å²	137.9	56%	0.559	70%	0.704	S	S	*	*			trans	-29.9	158.2	167.6	61.2	0	0	0	0	119
1081	Y	30.1	Very low	30.1	Very low	201 Å²	201	136.3 Å²	136.3	79%	0.788	70%	0.695	S	S	*	*			cis	-146.6	152.4	34.3	-115.5	-85.2	0	0	0	112.9
1082	R	26.7	Very low	30.1	Very low	220 Å²	220	136 Å²	136	83%	0.83	71%	0.709	S	S	*	*			trans	-162.3	86.3	178.5	-164.4	-168.6	-164.2	-156.4	5.8	115.3	S1084	R1082-S1084 PolarHBondContact O-OG 3.19Å
1083	D	31.7	Very low	30.1	Very low	136 Å²	136	130 Å²	130	73%	0.727	69%	0.694	S	S	*	*			trans	-102.8	122.3	169.6	-55.8	-42.1	0	0	0	108.3
1084	S	29.1	Very low	30.2	Very low	87 Å²	87	131.3 Å²	131.3	61%	0.608	70%	0.697	S	S	*	*			cis	67.6	102.8	28.1	-38.8	0	0	0	0	110.8	R1082	R1082-S1084 PolarHBondContact O-OG 3.19Å
1085	S	27.6	Very low	30.3	Very low	105 Å²	105	133 Å²	133	73%	0.734	70%	0.702	S	S	*	*				64.4	130.5	55.2	-163.7	0	0	0	0	112.8
1086	S	29.4	Very low	30.4	Very low	105 Å²	105	132.1 Å²	132.1	73%	0.734	70%	0.696	S	S	*	*			trans	60	166.8	175.3	62	0	0	0	0	114.3
1087	D	31.6	Very low	30.5	Very low	137 Å²	137	128.8 Å²	128.8	73%	0.733	69%	0.685	S	S	*	*			cis	-156.5	175.6	-29.4	-115.8	-47.6	0	0	0	109.4
1088	L	32	Very low	30.2	Very low	128 Å²	128	131.6 Å²	131.6	67%	0.67	69%	0.693	S	S	*	*			trans	33.7	120.4	145.4	-63.3	164.8	0	0	0	121.7
1089	K	33.1	Very low	30.2	Very low	176 Å²	176	131.3 Å²	131.3	77%	0.765	69%	0.686	S	S	*	*				62.1	110.2	129.4	-65.2	-179.3	-179.2	176.2	0	121.3
1090	D	30.5	Very low	30.2	Very low	137 Å²	137	130.2 Å²	130.2	73%	0.733	68%	0.68	S	S	*	*				63.2	99	118.6	-86.4	-32.3	0	0	0	122.5
1091	I	30.3	Very low	30.4	Very low	78 Å²	78	135.2 Å²	135.2	40%	0.4	69%	0.687	S	S	.	*			trans	94.3	101.4	131.3	-41.5	144.3	0	0	0	120.2	N375 T376	N375-I1091 HydrophobicContact CB-CG2 4.33Å; N375-I1091 WeakPolarHBondContact OD1-CG2 3.49Å; T376-I1091 WeakPolarHBondContact CG2-O 3.45Å
1092	S	29.2	Very low	30.2	Very low	98 Å²	98	130 Å²	130	69%	0.685	69%	0.694	S	S	*	*				-154.6	142.6	124.9	-167.8	0	0	0	0	109.6
1093	S	31.7	Very low	30.2	Very low	52 Å²	52	126 Å²	126	36%	0.364	69%	0.685	S	S	.	*			cis	111.1	141.7	0.2	91.9	0	0	0	0	116.8	N375	N375-S1093 PolarHBondContact ND2-OG 3.08Å; N375-S1093 WeakPolarHBondContact OD1-CB 3.4Å; N375-S1093 PolarHBondContact OD1-OG 3.41Å
1094	K	30.8	Very low	30.1	Very low	179 Å²	179	126.4 Å²	126.4	78%	0.778	69%	0.687	S	S	*	*			trans	54.2	97.3	174	-57.3	174.3	-172.5	169.3	0	114
1095	E	32.3	Very low	30.1	Very low	184 Å²	184	127 Å²	127	86%	0.86	69%	0.688	S	S	*	*				-127.7	159.8	73.7	-71.3	-143.8	87.9	0	0	114.9
1096	S	32.4	Very low	30.2	Very low	86 Å²	86	128.3 Å²	128.3	60%	0.601	68%	0.676	S	S	*	*			cis	-154.8	152.2	-21.9	-102.3	0	0	0	0	110.3
1097	S	30.2	Very low	30.2	Very low	85 Å²	85	125.4 Å²	125.4	59%	0.594	66%	0.656	S	S	*	*			trans	-33.8	145.3	174	47.6	0	0	0	0	116.1
1098	I	30.9	Very low	30.1	Very low	160 Å²	160	124.1 Å²	124.1	82%	0.821	65%	0.649	S	S	*	*				-138.2	108.2	69.3	-79.2	148.5	0	0	0	109.6
1099	L	30.1	Very low	30	Very low	117 Å²	117	124.1 Å²	124.1	61%	0.613	65%	0.654	S	S	*	*				64.3	105.7	87.5	-64.5	169.2	0	0	0	112.4
1100	R	28.1	Very low	29.8	Very low	183 Å²	183	119.3 Å²	119.3	69%	0.691	64%	0.643	S	S	*	*				86.2	145.4	62.5	-84	-167.5	177.5	172.1	-4.4	113.5
1101	R	30.5	Very low	30	Very low	185 Å²	185	118.7 Å²	118.7	70%	0.698	64%	0.635	S	S	*	*			trans	64.8	91.5	161.3	-70.4	171.9	167.3	154.4	4.1	117.1	E1103	R1101-E1103 HydrophobicContact CB-CB 4.46Å; R1101-E1103 WeakPolarHBondContact CD-OE2 3.23Å; R1101-E1103 HydrophobicContact CG-CG 4.42Å; R1101-E1103 WeakPolarHBondContact CG-OE2 3.18Å; R1101-E1103 IonicContact CZ-OE2 2.79Å; R1101-E1103 IonicContact NE-OE2 3.25Å; R1101-E1103 PolarHBondContact NE-OE2 2.92Å; R1101-E1103 PolarHBondContact O-N 2.78Å
1102	G	25.2	Very low	30.1	Very low	91 Å²	91	118.6 Å²	118.6	94%	0.938	64%	0.636	S	S	*	*			trans	-75.9	78	135.7	0	0	0	0	0	109.4
1103	E	28.3	Very low	30.3	Very low	137 Å²	137	119.7 Å²	119.7	64%	0.64	63%	0.63	S	S	*	*			trans	-110.8	110.5	160.9	-80	178.7	120.5	0	0	107.6	R1101	R1101-E1103 HydrophobicContact CB-CB 4.46Å; R1101-E1103 WeakPolarHBondContact CD-OE2 3.23Å; R1101-E1103 HydrophobicContact CG-CG 4.42Å; R1101-E1103 WeakPolarHBondContact CG-OE2 3.18Å; R1101-E1103 IonicContact CZ-OE2 2.79Å; R1101-E1103 IonicContact NE-OE2 3.25Å; R1101-E1103 PolarHBondContact NE-OE2 2.92Å; R1101-E1103 PolarHBondContact O-N 2.78Å
1104	D	29.6	Very low	30.4	Very low	145 Å²	145	121 Å²	121	78%	0.775	64%	0.639	S	S	*	*	S	Bend	trans	48.9	105.5	153.8	-69.6	-20.9	0	0	0	122.1
1105	T	28.7	Very low	30.5	Very low	100 Å²	100	117.4 Å²	117.4	61%	0.613	64%	0.637	S	S	*	*				82.6	95.1	127.8	72.1	0	0	0	0	119.3
1106	R	29.3	Very low	30.6	Very low	132 Å²	132	114 Å²	114	50%	0.498	63%	0.629	S	S	.	*				142.4	140.4	106.2	-79.8	132.9	154.5	179.1	-7.7	113.7	M845	M845-R1106 HydrophobicContact CB-CB 4.12Å; M845-R1106 HydrophobicContact CB-CG 3.87Å; M845-R1106 HydrophobicContact CG-CB 3.86Å; M845-R1106 HydrophobicContact CG-CG 3.94Å
1107	S	28.8	Very low	30.7	Very low	44 Å²	44	115.7 Å²	115.7	31%	0.308	64%	0.64	S	S	.	*			trans	61.9	142.2	147.9	60.2	0	0	0	0	121.6	I844 M845	I844-S1107 VanDerWaalsContact C-CB 3.41Å; I844-S1107 WeakPolarHBondContact CA-OG 3.11Å; M845-S1107 PolarHBondContact N-OG 3.37Å
1108	D	30.5	Very low	31	Very low	110 Å²	110	115.4 Å²	115.4	59%	0.588	65%	0.651	S	S	*	*			cis	-164.7	159.1	-16.3	-96.4	-34.6	0	0	0	108.9
1109	V	29.8	Very low	31.2	Very low	127 Å²	127	111.2 Å²	111.2	77%	0.77	65%	0.647	S	S	*	*			trans	19.7	134.7	135.2	-175.1	0	0	0	0	118.9
1110	S	30	Very low	31.4	Very low	75 Å²	75	117.5 Å²	117.5	52%	0.524	66%	0.662	S	S	.	*			cis	-171.5	177	-15.1	59.3	0	0	0	0	112.1
1111	E	32.7	Very low	31.8	Very low	124 Å²	124	115.1 Å²	115.1	58%	0.579	66%	0.663	S	S	*	*			trans	54.2	117.9	133.8	-74.3	141.9	-159.1	0	0	123.1
1112	D	32.9	Very low	31.9	Very low	76 Å²	76	112.8 Å²	112.8	41%	0.406	66%	0.662	S	S	.	*				125.6	144.3	91.9	-94.7	-2.1	0	0	0	122.8	S949 S950 G951	S949-D1112 PolarHBondContact N-O 3.06Å; S950-D1112 WeakPolarHBondContact CA-OD2 3.45Å; G951-D1112 PolarHBondContact N-OD2 2.99Å
1113	E	33.1	Very low	32.2	Very low	122 Å²	122	112.5 Å²	112.5	57%	0.57	64%	0.644	S	S	*	*			trans	67.6	153.8	142.1	-68.6	-87.2	103.5	0	0	121
1114	S	34.9	Very low	32.4	Very low	78 Å²	78	115.7 Å²	115.7	55%	0.545	65%	0.651	S	S	.	*			cis	-173.7	-156.3	-28.9	65.4	0	0	0	0	114.2
1115	S	32.8	Very low	32.5	Very low	105 Å²	105	116.9 Å²	116.9	73%	0.734	65%	0.652	S	S	*	*			trans	83.3	143.9	164.2	92.6	0	0	0	0	115.4
1116	T	33.3	Very low	32.6	Very low	113 Å²	113	117.5 Å²	117.5	69%	0.693	66%	0.66	S	S	*	*			cis	-143.7	123.6	3.4	-62	0	0	0	0	108.3
1117	S	35.1	Very low	32.8	Very low	120 Å²	120	116 Å²	116	84%	0.839	67%	0.669	S	S	*	*				52	141.8	95.9	133.1	0	0	0	0	116.2
1118	G	36.3	Very low	33.2	Very low	80 Å²	80	124.8 Å²	124.8	83%	0.825	70%	0.696	S	S	*	*			cis	-179.4	-172.8	2.1	0	0	0	0	0	108.7
1119	G	35.9	Very low	33.3	Very low	71 Å²	71	124.9 Å²	124.9	73%	0.732	71%	0.705	S	S	*	*			cis	162.9	174.1	-7.2	0	0	0	0	0	112.6
1120	R	34.9	Very low	33.5	Very low	250 Å²	250	129.9 Å²	129.9	94%	0.943	71%	0.71	S	S	*	*			trans	83.1	155.4	158.1	-58.8	177.5	-175.6	176.7	2.9	121.6
1121	N	34.8	Very low	33.6	Very low	133 Å²	133	131.8 Å²	131.8	71%	0.711	72%	0.724	S	S	*	*			cis	-175.1	174.2	-37.2	-141.1	-20.7	0	0	0	115.5
1122	M	34.1	Very low	33.6	Very low	136 Å²	136	131.1 Å²	131.1	67%	0.67	73%	0.733	S	S	*	*			trans	79.3	158.3	156.5	-64.4	-64.4	96	0	0	123.2
1123	C	31.1	Very low	33.6	Very low	84 Å²	84	131.2 Å²	131.2	57%	0.568	74%	0.74	S	S	*	*			cis	-176.5	158.7	-42	-132.1	0	0	0	0	116.9
1124	R	31.9	Very low	33.5	Very low	205 Å²	205	135 Å²	135	77%	0.774	75%	0.75	S	S	*	*			trans	69.6	156.8	146.5	-76.2	162.5	-166.1	-163	1	122.6
1125	Q	31.9	Very low	33.3	Very low	170 Å²	170	136.9 Å²	136.9	79%	0.794	76%	0.758	S	S	*	*			cis	-172.3	172.2	-29.5	-123.8	179.4	3.5	0	0	115.3
1126	S	31.5	Very low	33.3	Very low	113 Å²	113	136.5 Å²	136.5	79%	0.79	76%	0.756	S	S	*	*			trans	86.3	165.9	161.9	95.9	0	0	0	0	119.1
1127	S	31.9	Very low	33.1	Very low	99 Å²	99	135.9 Å²	135.9	69%	0.692	76%	0.756	S	S	*	*			cis	-171.9	-177.9	-29.4	58.4	0	0	0	0	114.7
1128	R	37.5	Very low	32.9	Very low	229 Å²	229	141.7 Å²	141.7	86%	0.864	76%	0.759	S	S	*	*			trans	76.5	113.9	161.3	-71.1	-174	173.4	-173.9	-1.6	124.6
1129	S	32.5	Very low	32.5	Very low	112 Å²	112	141.9 Å²	141.9	78%	0.783	75%	0.748	S	S	*	*			trans	41.1	156	137.4	62.5	0	0	0	0	123.5
1130	R	34.2	Very low	32.2	Very low	232 Å²	232	143.8 Å²	143.8	88%	0.875	75%	0.746	S	S	*	*			cis	-157.6	159.4	15.4	-148.1	175.5	-170.8	176	2	110.4
1131	S	33.3	Very low	31.9	Very low	116 Å²	116	138.9 Å²	138.9	81%	0.811	74%	0.738	S	S	*	*			trans	49.7	130.3	169.3	51.4	0	0	0	0	118.6
1132	S	32.8	Very low	31.6	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	74%	0.735	S	S	*	*			cis	-163.1	-162.4	-3.3	71.7	0	0	0	0	105.8
1133	S	31.8	Very low	31.3	Very low	79 Å²	79	141.7 Å²	141.7	55%	0.552	74%	0.743	S	S	*	*			cis	-166.1	151.1	-21.2	33.5	0	0	0	0	106.2
1134	Y	31.3	Very low	31.3	Very low	201 Å²	201	144.2 Å²	144.2	79%	0.788	76%	0.756	S	S	*	*			cis	-163.9	124.7	-25.2	-148.4	-112.5	0	0	0	107.8
1135	T	31.3	Very low	31.1	Very low	117 Å²	117	139 Å²	139	72%	0.718	75%	0.751	S	S	*	*			trans	55.4	159.8	150.8	59.9	0	0	0	0	120.9
1136	S	32.1	Very low	31	Very low	98 Å²	98	138 Å²	138	69%	0.685	75%	0.751	S	S	*	*			cis	-160.4	157.3	-15.3	-133	0	0	0	0	106.1
1137	S	30.1	Very low	31	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	75%	0.754	S	S	*	*			cis	85.7	131.8	7.7	85.8	0	0	0	0	119.7
1138	R	30.9	Very low	31	Very low	241 Å²	241	148.1 Å²	148.1	91%	0.909	76%	0.757	S	S	*	*			trans	77.1	155.1	174.5	-73.9	-175.3	167.3	173.4	-6.8	118.1
1139	S	27.6	Very low	30.7	Very low	85 Å²	85	141 Å²	141	59%	0.594	74%	0.736	S	S	*	*			cis	-172.7	-174.3	-18.3	54.4	0	0	0	0	110.9
1140	T	28.8	Very low	30.7	Very low	110 Å²	110	140.7 Å²	140.7	68%	0.675	72%	0.72	S	S	*	*			trans	65.7	114.4	156.1	43.5	0	0	0	0	117.5
1141	D	28.1	Very low	30.4	Very low	147 Å²	147	133.5 Å²	133.5	79%	0.786	70%	0.697	S	S	*	*				73.5	112.4	73.2	-72.5	-58.7	0	0	0	114.8
1142	R	29.4	Very low	30.2	Very low	170 Å²	170	135.9 Å²	135.9	64%	0.642	69%	0.688	S	S	*	*			trans	-164.5	149.8	131.2	-111.2	161.8	175.9	165.9	-5.4	113.1	C855 S856 N857	C855-R1142 PolarHBondContact O-NH2 3.02Å; S856-R1142 PolarHBondContact O-NH2 2.82Å; N857-R1142 PolarHBondContact O-NH1 3.47Å; N857-R1142 PolarHBondContact O-NH2 3.28Å
1143	N	28.1	Very low	29.9	Very low	158 Å²	158	136.5 Å²	136.5	85%	0.845	69%	0.687	S	S	*	*			trans	-79.3	-165.7	-177.3	-71	-57.1	0	0	0	112.9
1144	V	30.3	Very low	29.8	Very low	137 Å²	137	140.9 Å²	140.9	83%	0.83	70%	0.702	S	S	*	*			trans	92.7	113.4	169.1	-173.3	0	0	0	0	113.9
1145	S	28.8	Very low	29.6	Very low	96 Å²	96	138.5 Å²	138.5	67%	0.671	70%	0.699	S	S	*	*			cis	164.8	155.6	-27.8	50	0	0	0	0	106.5
1146	N	28.3	Very low	29.4	Very low	150 Å²	150	139 Å²	139	80%	0.802	70%	0.697	S	S	*	*			trans	9.1	122.2	156.8	-57.2	-0.6	0	0	0	118.7
1147	R	32.6	Very low	29.2	Very low	222 Å²	222	143.7 Å²	143.7	84%	0.838	71%	0.705	S	S	*	*				-163	118.3	117.8	-108.3	160.9	-168.2	-166.3	3.8	114.3
1148	R	31.7	Very low	29.1	Very low	202 Å²	202	148.1 Å²	148.1	76%	0.762	71%	0.708	S	S	*	*			trans	56.2	101.1	134.1	-65.2	178.5	-179.8	173.5	-2.2	116.7
1149	N	29.9	Very low	29	Very low	79 Å²	79	143.9 Å²	143.9	42%	0.422	70%	0.696	S	S	.	*				82.4	164.7	70.6	-74.2	40.1	0	0	0	111.6	H364 D365	H364-N1149 PolarHBondContact CE1-ND2 2.95Å; H364-N1149 VanDerWaalsContact CE1-ND2 3.32Å; H364-N1149 PolarHBondContact ND1-ND2 3.33Å; D365-N1149 WeakPolarHBondContact OD2-CB 3.42Å; D365-N1149 PolarHBondContact OD2-ND2 3.47Å
1150	K	33.4	Very low	29.1	Very low	105 Å²	105	147.7 Å²	147.7	46%	0.457	70%	0.704	S	S	.	*			trans	88.8	74.9	161.8	-44.5	-138.7	90.6	167.5	0	116.9	V363 H364 D365	V363-K1150 HydrophobicContact CB-CB 3.58Å; V363-K1150 HydrophobicContact CB-CD 4.07Å; V363-K1150 VanDerWaalsContact CB-CE 3.41Å; V363-K1150 HydrophobicContact CB-CG 4.12Å; V363-K1150 HydrophobicContact CG1-CB 3.63Å; V363-K1150 HydrophobicContact CG2-CB 3.91Å; V363-K1150 HydrophobicContact CG2-CD 3.68Å; V363-K1150 HydrophobicContact CG2-CG 4.23Å; V363-K1150 WeakPolarHBondContact O-CE 3.35Å; V363-K1150 PolarHBondContact O-NZ 3.09Å; H364-K1150 WeakPolarHBondContact CD2-CE 3.49Å; H364-K1150 PolarHBondContact CD2-NZ 2.78Å; H364-K1150 WeakPolarHBondContact CE1-CE 3.41Å; H364-K1150 VanDerWaalsContact ND1-CE 3.31Å; H364-K1150 WeakPolarHBondContact ND1-CE 3.35Å; H364-K1150 WeakPolarHBondContact NE2-CE 3.35Å; H364-K1150 PolarHBondContact NE2-NZ 2.79Å; H364-K1150 VanDerWaalsContact NE2-NZ 3.12Å; D365-K1150 PolarHBondContact OD2-N 2.9Å
1151	E	28	Very low	29	Very low	81 Å²	81	147.5 Å²	147.5	38%	0.379	71%	0.707	S	S	.	*			trans	-7.2	175.8	149.6	-29.5	169.2	160.8	0	0	125.7	V363 H364 D365	V363-E1151 WeakPolarHBondContact CA-OE2 3.38Å; V363-E1151 HydrophobicContact CB-CB 4.42Å; V363-E1151 HydrophobicContact CB-CG 4.39Å; V363-E1151 HydrophobicContact CG1-CB 3.68Å; V363-E1151 HydrophobicContact CG1-CG 4.16Å; V363-E1151 WeakPolarHBondContact CG1-O 3.42Å; V363-E1151 PolarHBondContact N-OE2 3.1Å; H364-E1151 PolarHBondContact N-OE1 2.96Å; H364-E1151 VanDerWaalsContact N-OE1 3.1Å; D365-E1151 PolarHBondContact N-OE1 2.93Å
1152	R	28	Very low	29.1	Very low	166 Å²	166	145.7 Å²	145.7	63%	0.626	69%	0.692	S	S	*	*				108.8	99	130	-136.9	173.9	-82.4	-136	-7.3	119.4	V363	V363-R1152 HydrophobicContact CG1-CB 4.43Å
1153	V	28.3	Very low	29.1	Very low	123 Å²	123	143.3 Å²	143.3	75%	0.745	68%	0.683	S	S	*	*			trans	58.6	119.8	137.1	177.7	0	0	0	0	119.8
1154	I	28.6	Very low	29.1	Very low	170 Å²	170	144.3 Å²	144.3	87%	0.872	68%	0.68	S	S	*	*				-155.9	155.4	124.4	-104.8	157	0	0	0	109.5
1155	E	26.8	Very low	29.1	Very low	152 Å²	152	140.7 Å²	140.7	71%	0.71	66%	0.659	S	S	*	*			trans	-80	165.1	-169.6	-51.9	175.3	66.1	0	0	116.5
1156	N	27.1	Very low	28.9	Very low	127 Å²	127	140.4 Å²	140.4	68%	0.679	66%	0.656	S	S	*	*			trans	39.6	100.1	133.6	-71.1	-43.8	0	0	0	119
1157	K	29.1	Very low	29	Very low	197 Å²	197	137.2 Å²	137.2	86%	0.857	64%	0.642	S	S	*	*			trans	-163.6	124	131.8	-105	135.7	-160.2	158	0	116.8
1158	Y	27.6	Very low	28.9	Very low	193 Å²	193	131.5 Å²	131.5	76%	0.757	63%	0.634	S	S	*	*				53.1	114	126.3	-83.2	-118.6	0	0	0	121.5
1159	K	28.9	Very low	28.7	Very low	152 Å²	152	127.2 Å²	127.2	66%	0.661	63%	0.626	S	S	*	*				58.8	133.4	121.8	-65.8	-167	-179.3	-172	0	122.2
1160	H	28.7	Very low	28.7	Very low	164 Å²	164	128.6 Å²	128.6	76%	0.759	64%	0.642	S	S	*	*			trans	84.9	157.6	139.7	-67.6	-24	0	0	0	119.9
1161	S	27.8	Very low	28.5	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	66%	0.655	S	S	*	*			trans	65	114.3	-177.8	-71.4	0	0	0	0	115.1
1162	K	29.5	Very low	28.7	Very low	108 Å²	108	131.6 Å²	131.6	47%	0.47	67%	0.673	S	S	.	*				96.4	141.8	51.3	-93.8	-165.9	163.4	-162.7	0	110.2	D331 D332	D331-K1162 IonicContact OD1-NZ 3.4Å; D332-K1162 VanDerWaalsContact C-NZ 3.32Å; D332-K1162 PolarHBondContact O-NZ 3.42Å
1163	R	29.4	Very low	28.9	Very low	121 Å²	121	128 Å²	128	46%	0.457	67%	0.673	S	S	.	*			trans	103.7	125.1	158.1	-46.5	-115.8	120.6	129	8.7	118.1	D330 D331	D330-R1163 VanDerWaalsContact CG-NE 3.28Å; D330-R1163 PolarHBondContact O-NE 3Å; D330-R1163 PolarHBondContact O-NH1 3.39Å; D330-R1163 PolarHBondContact O-NH2 2.91Å; D330-R1163 IonicContact OD1-CZ 3.23Å; D330-R1163 IonicContact OD1-NE 3.39Å; D330-R1163 PolarHBondContact OD1-NE 2.87Å; D330-R1163 IonicContact OD1-NH2 3.89Å; D330-R1163 PolarHBondContact OD1-NH2 2.95Å; D330-R1163 VanDerWaalsContact OD2-CA 3.3Å; D330-R1163 WeakPolarHBondContact OD2-CA 3.42Å; D331-R1163 IonicContact OD1-CZ 3.59Å; D331-R1163 VanDerWaalsContact OD1-CZ 3.3Å; D331-R1163 IonicContact OD1-NH1 3.61Å; D331-R1163 PolarHBondContact OD1-NH1 3.11Å; D331-R1163 VanDerWaalsContact OD1-NH1 3.1Å; D331-R1163 IonicContact OD1-NH2 2.79Å; D331-R1163 PolarHBondContact OD1-NH2 3.24Å; D331-R1163 IonicContact OD2-CZ 2.74Å; D331-R1163 IonicContact OD2-NH1 2.93Å; D331-R1163 PolarHBondContact OD2-NH1 3.25Å; D331-R1163 IonicContact OD2-NH2 3.84Å
1164	K	29.1	Very low	29	Very low	178 Å²	178	128.9 Å²	128.9	77%	0.774	67%	0.674	S	S	*	*			trans	-92.5	-166.2	157.5	-49.6	179.8	176.7	-179.6	0	108.2	D330	D330-K1164 PolarHBondContact OD2-N 2.8Å
1165	P	29.1	Very low	29.2	Very low	61 Å²	61	125.5 Å²	125.5	40%	0.396	66%	0.661	S	S	.	*			cis	-132.5	176.7	-11.9	33.3	-11.4	0	0	0	115.4	A329	A329-P1165 HydrophobicContact CB-CG 4.37Å
1166	C	25.9	Very low	29.4	Very low	90 Å²	90	129.3 Å²	129.3	61%	0.608	67%	0.669	S	S	*	*			trans	26.2	134.9	140.3	-56	0	0	0	0	123.5	N327	N327-C1166 WeakPolarHBondContact OD1-CB 3.27Å; N327-C1166 PolarHBondContact OD1-O 2.86Å
1167	T	30.1	Very low	29.6	Very low	83 Å²	83	130.2 Å²	130.2	51%	0.509	67%	0.667	S	S	.	*			trans	65.9	171.6	141.4	76.1	0	0	0	0	117.7	E326 N327	E326-T1167 VanDerWaalsContact CD-CB 3.43Å; E326-T1167 HydrophobicContact CG-CG2 4.13Å; E326-T1167 WeakPolarHBondContact OE1-CB 3.25Å; E326-T1167 WeakPolarHBondContact OE1-CG2 3.42Å; E326-T1167 PolarHBondContact OE1-OG1 2.98Å; E326-T1167 VanDerWaalsContact OE1-OG1 3.11Å; E326-T1167 WeakPolarHBondContact OE2-CB 3.44Å; E326-T1167 PolarHBondContact OE2-OG1 3.3Å; N327-T1167 PolarHBondContact ND2-OG1 3.36Å; N327-T1167 PolarHBondContact OD1-OG1 3.14Å
1168	P	29.9	Very low	29.7	Very low	102 Å²	102	129.5 Å²	129.5	66%	0.662	66%	0.66	S	S	*	*				-141.2	156.2	67.8	44.4	-28.1	0	0	0	117.3
1169	D	27.7	Very low	29.9	Very low	113 Å²	113	123.4 Å²	123.4	60%	0.604	66%	0.656	S	S	*	*			trans	58.1	149.5	131.2	-84	-59.7	0	0	0	125.6
1170	S	29.1	Very low	30	Very low	108 Å²	108	124 Å²	124	76%	0.755	66%	0.661	S	S	*	*			trans	78.9	138.1	144.7	79.7	0	0	0	0	117.7
1171	S	30	Very low	30	Very low	103 Å²	103	120.8 Å²	120.8	72%	0.72	65%	0.653	S	S	*	*			cis	-156.6	163.5	23.7	46.3	0	0	0	0	110.2
1172	L	32.1	Very low	30.1	Very low	145 Å²	145	123.8 Å²	123.8	76%	0.759	65%	0.653	S	S	*	*			cis	-163.8	150.8	15.2	-136.3	163.2	0	0	0	110
1173	S	31.2	Very low	30	Very low	90 Å²	90	123.7 Å²	123.7	63%	0.629	66%	0.658	S	S	*	*			trans	63	150.5	155.9	56.8	0	0	0	0	118.6
1174	N	31	Very low	29.9	Very low	142 Å²	142	125.7 Å²	125.7	76%	0.759	67%	0.665	S	S	*	*			cis	-163.6	158.6	-3.6	-104.4	-14	0	0	0	105.9
1175	T	32.5	Very low	29.8	Very low	100 Å²	100	118.7 Å²	118.7	61%	0.613	64%	0.636	S	S	*	*			cis	-165.2	154.4	8	1.7	0	0	0	0	109.9
1176	R	32.2	Very low	29.7	Very low	231 Å²	231	119.6 Å²	119.6	87%	0.872	64%	0.635	S	S	*	*			trans	66.3	156.1	147.4	-70.3	173.3	178.3	-170.1	-0.4	119.3
1177	K	31.1	Very low	29.7	Very low	147 Å²	147	121.7 Å²	121.7	64%	0.639	64%	0.636	S	S	*	*			cis	-172.6	138	-35.8	-147.9	176.4	175.2	-167.6	0	108.5
1178	Y	30.5	Very low	29.6	Very low	181 Å²	181	122.3 Å²	122.3	71%	0.71	64%	0.636	S	S	*	*			trans	62.2	131.3	177.5	-52.1	-78	0	0	0	115
1179	G	31.4	Very low	29.5	Very low	65 Å²	65	122.4 Å²	122.4	67%	0.67	63%	0.63	S	S	*	*			cis	108.7	160	-6.7	0	0	0	0	0	114.6
1180	Q	31	Very low	29.5	Very low	165 Å²	165	123 Å²	123	77%	0.771	63%	0.629	S	S	*	*			trans	72.1	149.7	-178.1	-50.5	-168.2	11.6	0	0	115.8
1181	T	28.5	Very low	29.4	Very low	97 Å²	97	122.4 Å²	122.4	60%	0.595	61%	0.614	S	S	*	*			cis	-166.4	166.9	-32.7	39.5	0	0	0	0	108
1182	K	30.2	Very low	29.4	Very low	170 Å²	170	121.2 Å²	121.2	74%	0.739	60%	0.596	S	S	*	*			trans	71.2	145.5	146.5	-77.9	159.8	-173.8	167.9	0	118.6
1183	N	27.7	Very low	29.4	Very low	106 Å²	106	118.6 Å²	118.6	57%	0.567	58%	0.58	S	S	*	*			trans	74.3	158.6	137.9	-72.3	5.8	0	0	0	119.2	L118	L118-N1183 VanDerWaalsContact CD1-CA 3.48Å
1184	R	27.9	Very low	29.3	Very low	162 Å²	162	121.1 Å²	121.1	61%	0.611	58%	0.58	S	S	*	*			cis	-171.8	155.5	-20.9	172.7	172.9	175.6	-152.4	0.2	111.8	N116	N116-R1184 VanDerWaalsContact C-C 3.44Å; N116-R1184 PolarHBondContact N-O 3.18Å; N116-R1184 CarbonylContact O-C 2.93Å; N116-R1184 WeakPolarHBondContact O-CA 3.49Å; N116-R1184 PolarHBondContact O-N 2.93Å
1185	N	26.3	Very low	29.3	Very low	32 Å²	32	117.1 Å²	117.1	17%	0.171	56%	0.558	C	S	.	*			trans	42.3	121.4	166.7	-80.2	57.7	0	0	0	119.8	R115 N116	R115-N1185 CarbonylContact C-O 3.55Å; R115-N1185 VanDerWaalsContact C-O 3.23Å; R115-N1185 WeakPolarHBondContact CA-O 3.47Å; R115-N1185 WeakPolarHBondContact CB-O 3.45Å; R115-N1185 WeakPolarHBondContact CG-O 3.37Å; N116-N1185 VanDerWaalsContact C-N 3.32Å; N116-N1185 PolarHBondContact N-O 3.48Å; N116-N1185 PolarHBondContact O-N 2.98Å
1186	E	26.4	Very low	29.3	Very low	79 Å²	79	117.4 Å²	117.4	37%	0.369	57%	0.565	S	S	.	*			trans	85.6	-175.9	141.6	-64.3	152.6	-149.4	0	0	122.5	R115 N116	R115-E1186 CarbonylContact C-O 3.22Å; R115-E1186 HydrophobicContact CB-CB 4.09Å; R115-E1186 WeakPolarHBondContact CB-O 3.29Å; R115-E1186 HydrophobicContact CG-CB 4.35Å; R115-E1186 IonicContact CZ-OE2 2.72Å; R115-E1186 IonicContact NH1-OE2 3.3Å; R115-E1186 PolarHBondContact NH1-OE2 3.07Å; N116-E1186 PolarHBondContact N-O 3.12Å
1187	H	27.6	Very low	29.2	Very low	134 Å²	134	111.5 Å²	111.5	62%	0.62	55%	0.55	S	S	*	*			trans	-34.5	156.2	171.4	-86.3	-85.4	0	0	0	123.5	R115	R115-H1187 WeakPolarHBondContact CB-O 3.17Å
1188	N	26.9	Very low	29.3	Very low	97 Å²	97	116 Å²	116	52%	0.519	56%	0.563	S	S	.	*			trans	74.4	124.8	132.5	-71.6	9.9	0	0	0	122.6	L113	L113-N1188 VanDerWaalsContact O-O 3.08Å
1189	I	27.5	Very low	29.3	Very low	103 Å²	103	116.2 Å²	116.2	53%	0.528	57%	0.568	S	S	.	*				77.7	116.8	125.1	-65.7	171.4	0	0	0	118.2	L113	L113-I1189 PolarHBondContact N-O 3.43Å
1190	E	27.7	Very low	29.3	Very low	126 Å²	126	124.6 Å²	124.6	59%	0.589	58%	0.579	S	S	*	*			trans	63.6	162.6	150.6	-76.2	169.5	-162.4	0	0	117	T111 S112 L113	T111-E1190 WeakPolarHBondContact O-CB 3.34Å; S112-E1190 VanDerWaalsContact CA-O 3.25Å; S112-E1190 WeakPolarHBondContact CA-O 3.35Å; S112-E1190 PolarHBondContact N-O 3.13Å; L113-E1190 PolarHBondContact N-O 2.92Å
1191	E	28.3	Very low	29.3	Very low	95 Å²	95	120.7 Å²	120.7	44%	0.444	58%	0.575	S	S	.	*			cis	177.4	163	-31.2	-118.9	-163.3	122.1	0	0	108.9	S112	S112-E1191 PolarHBondContact N-O 3.45Å
1192	K	30.1	Very low	29.4	Very low	78 Å²	78	123.5 Å²	123.5	34%	0.339	59%	0.586	S	S	.	*			trans	64	125.1	143.5	-73.3	166	-177.4	140.3	0	122.5	K109	K109-K1192 WeakPolarHBondContact O-CD 3.41Å; K109-K1192 WeakPolarHBondContact O-CE 3.12Å; K109-K1192 PolarHBondContact O-NZ 2.65Å
1193	H	31.2	Very low	29.5	Very low	91 Å²	91	123 Å²	123	42%	0.421	59%	0.59	S	S	.	*			trans	78.5	152.5	142.2	-53.8	-25.5	0	0	0	117.2	R108 V110	R108-H1193 VanDerWaalsContact CA-NE2 3.27Å; R108-H1193 WeakPolarHBondContact CA-NE2 3.3Å; R108-H1193 VanDerWaalsContact CB-NE2 3.26Å; R108-H1193 WeakPolarHBondContact CB-NE2 3.4Å; R108-H1193 WeakPolarHBondContact CG-NE2 3.15Å; V110-H1193 HydrophobicContact CG2-CB 4.2Å
1194	F	28.4	Very low	29.6	Very low	142 Å²	142	122.6 Å²	122.6	62%	0.623	59%	0.593	S	S	*	*			cis	-130.9	125.6	32.4	-132	-97.9	0	0	0	118.3
1195	N	32	Very low	29.9	Very low	58 Å²	58	120.9 Å²	120.9	31%	0.31	60%	0.603	S	S	.	*			trans	2.5	134.3	144.2	-46.1	-109.1	0	0	0	119	R108	R108-N1195 PolarHBondContact NE-ND2 3.49Å; R108-N1195 PolarHBondContact NE-OD1 2.83Å; R108-N1195 VanDerWaalsContact NE-OD1 3.13Å; R108-N1195 VanDerWaalsContact NH2-CG 3.3Å; R108-N1195 PolarHBondContact NH2-OD1 3.14Å
1196	S	31.6	Very low	30.1	Very low	107 Å²	107	124.8 Å²	124.8	75%	0.748	63%	0.631	S	S	*	*				-173.7	116.6	107.2	-86.9	0	0	0	0	112
1197	N	30.2	Very low	30.3	Very low	106 Å²	106	126.8 Å²	126.8	57%	0.567	65%	0.648	S	S	*	*				95.8	93.2	69.3	-83.2	-50.2	0	0	0	113.5
1198	R	33.2	Very low	30.3	Very low	241 Å²	241	124.9 Å²	124.9	91%	0.909	65%	0.65	S	S	*	*				-178.4	115.6	118.8	-94.7	158	-177.1	-164.9	0.3	108.1
1199	K	31.1	Very low	30.3	Very low	186 Å²	186	126.8 Å²	126.8	81%	0.809	67%	0.665	S	S	*	*				68.8	84.9	65.6	-73.5	-164.9	172.3	-171.1	0	114.4
1200	R	32.6	Very low	30.4	Very low	241 Å²	241	131.4 Å²	131.4	91%	0.909	68%	0.681	S	S	*	*				-179.3	130.9	111.7	-95.2	-179.8	159.5	149.3	-6.3	107.6
1201	A	30.4	Very low	30.4	Very low	83 Å²	83	131.3 Å²	131.3	69%	0.686	69%	0.692	S	S	*	*				69.8	125	66.9	0	0	0	0	0	111.1
1202	L	30.2	Very low	30.2	Very low	157 Å²	157	131.4 Å²	131.4	82%	0.822	69%	0.692	S	S	*	*			cis	-157.9	179.1	11.6	-106.7	153.1	0	0	0	110.9
1203	L	31.5	Very low	30	Very low	158 Å²	158	134.3 Å²	134.3	83%	0.827	72%	0.717	S	S	*	*			trans	86.8	143.1	165.3	-50.1	-177.3	0	0	0	118.4
1204	P	30.8	Very low	29.7	Very low	98 Å²	98	135.3 Å²	135.3	64%	0.636	72%	0.72	S	S	*	*			trans	-101.1	164	-176.6	40.2	-36	0	0	0	114
1205	P	34.6	Very low	29.6	Very low	127 Å²	127	135.2 Å²	135.2	83%	0.825	73%	0.725	S	S	*	*			trans	-73	136	156.4	32	-31.4	0	0	0	109.9
1206	P	30.8	Very low	29.2	Very low	114 Å²	114	141.9 Å²	141.9	74%	0.74	75%	0.745	S	S	*	*			trans	-110	178.8	-160.7	8.3	16.1	0	0	0	115.1
1207	T	29.4	Very low	28.9	Very low	120 Å²	120	145 Å²	145	74%	0.736	74%	0.741	S	S	*	*			trans	-46.9	151.9	165.5	50.6	0	0	0	0	115.5
1208	S	27	Very low	28.8	Very low	95 Å²	95	143.8 Å²	143.8	66%	0.664	74%	0.741	S	S	*	*			trans	68.6	144.6	138.6	66.6	0	0	0	0	121.9
1209	T	27.9	Very low	28.6	Very low	136 Å²	136	138.1 Å²	138.1	83%	0.834	72%	0.719	S	S	*	*			trans	70.4	152.1	154.3	48.5	0	0	0	0	120.4
1210	K	28.7	Very low	28.6	Very low	200 Å²	200	137.2 Å²	137.2	87%	0.87	72%	0.715	S	S	*	*			trans	-62.3	157.1	171	-52.8	170.7	-176.5	174.9	0	110.3
1211	P	27.9	Very low	28.6	Very low	125 Å²	125	127.4 Å²	127.4	81%	0.812	69%	0.689	S	S	*	*				-136.4	173.1	116.1	38.3	-29.7	0	0	0	114.5
1212	E	24	Very low	28.6	Very low	97 Å²	97	133.4 Å²	133.4	45%	0.453	70%	0.696	S	S	.	*			trans	-72.9	166.6	175	-55.8	172.3	96	0	0	113	K1214	E1212-K1214 VanDerWaalsContact C-N 3.3Å; E1212-K1214 HydrophobicContact CB-CD 4.39Å; E1212-K1214 HydrophobicContact CB-CG 4.3Å; E1212-K1214 PolarHBondContact O-N 3.39Å; E1212-K1214 VanDerWaalsContact OE1-CE 3.29Å; E1212-K1214 WeakPolarHBondContact OE1-CE 3.1Å; E1212-K1214 IonicContact OE1-NZ 2.66Å; E1212-K1214 PolarHBondContact OE1-NZ 2.93Å; E1212-K1214 WeakPolarHBondContact OE2-CD 3.4Å; E1212-K1214 VanDerWaalsContact OE2-CE 3.32Å; E1212-K1214 WeakPolarHBondContact OE2-CE 3.48Å; E1212-K1214 IonicContact OE2-NZ 3.12Å; E1212-K1214 PolarHBondContact OE2-NZ 2.9Å
1213	T	27.4	Very low	28.6	Very low	138 Å²	138	129.4 Å²	129.4	85%	0.847	68%	0.678	S	S	*	*	S	Bend	trans	-70.7	78	165.7	49.9	0	0	0	0	112.1
1214	K	25	Very low	28.5	Very low	112 Å²	112	128.6 Å²	128.6	49%	0.487	67%	0.674	S	S	.	*			trans	-146	139.2	177.2	-70.3	-178.4	-169.2	159.3	0	110.5	E1212	E1212-K1214 VanDerWaalsContact C-N 3.3Å; E1212-K1214 HydrophobicContact CB-CD 4.39Å; E1212-K1214 HydrophobicContact CB-CG 4.3Å; E1212-K1214 PolarHBondContact O-N 3.39Å; E1212-K1214 VanDerWaalsContact OE1-CE 3.29Å; E1212-K1214 WeakPolarHBondContact OE1-CE 3.1Å; E1212-K1214 IonicContact OE1-NZ 2.66Å; E1212-K1214 PolarHBondContact OE1-NZ 2.93Å; E1212-K1214 WeakPolarHBondContact OE2-CD 3.4Å; E1212-K1214 VanDerWaalsContact OE2-CE 3.32Å; E1212-K1214 WeakPolarHBondContact OE2-CE 3.48Å; E1212-K1214 IonicContact OE2-NZ 3.12Å; E1212-K1214 PolarHBondContact OE2-NZ 2.9Å
1215	I	24.7	Very low	28.4	Very low	141 Å²	141	131.5 Å²	131.5	72%	0.723	68%	0.679	S	S	*	*			cis	-167.5	163	-15.2	-136.8	172.5	0	0	0	110.5
1216	W	23.7	Very low	28.2	Very low	197 Å²	197	131 Å²	131	75%	0.746	67%	0.673	S	S	*	*			trans	79.2	111.1	158.7	-80.9	32.3	0	0	0	125.1
1217	R	26.6	Very low	28.4	Very low	174 Å²	174	130.3 Å²	130.3	66%	0.657	67%	0.669	S	S	*	*				80.3	148.6	116.6	-71.1	-170.5	-177.8	-101.3	2.5	125.5
1218	S	28.5	Very low	28.4	Very low	80 Å²	80	128.7 Å²	128.7	56%	0.559	67%	0.668	S	S	*	*			trans	83.9	144	152.8	-70.6	0	0	0	0	119	T1301 D1302	S1218-T1301 PolarHBondContact OG-O 3.15Å; S1218-D1302 PolarHBondContact OG-N 2.99Å
1219	R	28.7	Very low	28.5	Very low	121 Å²	121	129.2 Å²	129.2	46%	0.457	67%	0.672	S	S	.	*			cis	-157.2	155	3.4	-139.8	-176.2	163.6	129.8	-3.2	115.1	M1300 T1301 D1302 S1303	R1219-M1300 PolarHBondContact NH1-O 2.77Å; R1219-T1301 VanDerWaalsContact CZ-C 3.48Å; R1219-T1301 PolarHBondContact NH1-O 3.3Å; R1219-T1301 PolarHBondContact NH2-OG1 3Å; R1219-D1302 WeakPolarHBondContact CA-O 3.41Å; R1219-D1302 HydrophobicContact CG-CB 4.07Å; R1219-D1302 WeakPolarHBondContact CG-O 3.44Å; R1219-S1303 CarbonylContact C-O 3.27Å
1220	K	31.2	Very low	28.5	Very low	167 Å²	167	127 Å²	127	73%	0.726	66%	0.662	S	S	*	*			trans	71.7	144.3	163.4	-60.4	177.4	178.4	177.1	0	117.1	S1303	K1220-S1303 WeakPolarHBondContact CA-OG 3.35Å; K1220-S1303 PolarHBondContact N-O 3.44Å
1221	G	32.4	Very low	28.4	Very low	36 Å²	36	123.6 Å²	123.6	37%	0.371	65%	0.652	S	S	.	*			cis	-178	167.4	-2.7	0	0	0	0	0	114.5	S1304	G1221-S1304 VanDerWaalsContact CA-OG 3.23Å; G1221-S1304 WeakPolarHBondContact CA-OG 3.43Å
1222	Y	30.5	Very low	28.3	Very low	208 Å²	208	128.2 Å²	128.2	82%	0.816	65%	0.653	S	S	*	*			trans	58.1	112.7	177.7	-67.2	-81.9	0	0	0	117	S1304 S1305	Y1222-S1304 PolarHBondContact N-OG 3.39Å; Y1222-S1304 VanDerWaalsContact N-OG 3.14Å; Y1222-S1305 PolarHBondContact O-OG 3.32Å
1223	V	29.3	Very low	28.7	Very low	73 Å²	73	131.4 Å²	131.4	44%	0.442	67%	0.668	S	S	.	*			cis	81.9	98.3	26.4	-167.1	0	0	0	0	114.6	E1225 S1305	V1223-E1225 HydrophobicContact CG1-CG 4.28Å; V1223-S1305 PolarHBondContact N-OG 3.27Å
1224	N	29.3	Very low	28.9	Very low	141 Å²	141	130.5 Å²	130.5	75%	0.754	67%	0.665	S	S	*	*				-162.4	139	113.8	-85.8	-39	0	0	0	107.4
1225	E	28.2	Very low	28.9	Very low	159 Å²	159	133.4 Å²	133.4	74%	0.743	68%	0.68	S	S	*	*			cis	70.4	138.3	48.9	-61.1	-134.1	170.2	0	0	110.4	V1223	V1223-E1225 HydrophobicContact CG1-CG 4.28Å
1226	V	31.5	Very low	29.3	Very low	116 Å²	116	133.3 Å²	133.3	70%	0.703	68%	0.68	S	S	*	*			cis	-172.5	-178.5	10.4	90.5	0	0	0	0	107.7
1227	P	33.9	Very low	29.6	Very low	101 Å²	101	129.3 Å²	129.3	66%	0.656	68%	0.68	S	S	*	*			cis	-130	-163.3	-22.4	36.8	-17.6	0	0	0	112.4
1228	A	29.7	Very low	29.8	Very low	85 Å²	85	128 Å²	128	70%	0.702	69%	0.685	S	S	*	*			trans	72.5	149.7	133.7	0	0	0	0	0	120.6
1229	S	28.6	Very low	29.6	Very low	107 Å²	107	128.7 Å²	128.7	75%	0.748	69%	0.691	S	S	*	*			cis	-169.2	175.6	-22.6	66.5	0	0	0	0	106.3
1230	S	27.8	Very low	29.7	Very low	89 Å²	89	131.2 Å²	131.2	62%	0.622	71%	0.707	S	S	*	*			cis	-167.2	169.8	3.4	-144.3	0	0	0	0	108.1
1231	L	28.1	Very low	29.5	Very low	129 Å²	129	131.8 Å²	131.8	68%	0.675	71%	0.712	S	S	*	*			trans	64.7	145.6	154.4	-57.9	160.6	0	0	0	117.5
1232	R	26.1	Very low	29.2	Very low	221 Å²	221	134.6 Å²	134.6	83%	0.834	73%	0.726	S	S	*	*			cis	-162	164.1	-27.7	-130.7	179.2	-149.9	162.5	8.3	108.3
1233	H	31.2	Very low	29	Very low	164 Å²	164	130 Å²	130	76%	0.759	72%	0.72	S	S	*	*			trans	-57.8	149.8	160.4	-70	-82.5	0	0	0	110.8	Q1235	H1233-Q1235 HydrophobicContact CB-CG 4.39Å
1234	P	31	Very low	28.7	Very low	120 Å²	120	133.6 Å²	133.6	78%	0.779	74%	0.736	S	S	*	*				-107.3	146.3	81.6	-9.1	28.4	0	0	0	112.2
1235	Q	25.7	Very low	28.8	Very low	173 Å²	173	136 Å²	136	81%	0.808	74%	0.74	S	S	*	*			cis	95	147.2	45.5	-64.3	-116.6	2.4	0	0	113.1	H1233	H1233-Q1235 HydrophobicContact CB-CG 4.39Å
1236	L	34.4	Very low	28.5	Very low	138 Å²	138	137.5 Å²	137.5	72%	0.723	74%	0.744	S	S	*	*			trans	-74.4	159.6	-174.8	-64.6	157.7	0	0	0	111.7	N1238	L1236-N1238 HydrophobicContact CB-CB 4.4Å
1237	P	28.8	Very low	28.3	Very low	113 Å²	113	137.1 Å²	137.1	73%	0.734	74%	0.742	S	S	*	*				-119.1	163.3	80.1	-0.6	22.4	0	0	0	112.2
1238	N	30.7	Very low	27.9	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	75%	0.754	S	S	*	*			cis	63.5	57	6.3	-102.1	29.1	0	0	0	118.6	L1236	L1236-N1238 HydrophobicContact CB-CB 4.4Å
1239	S	24.3	Very low	27.7	Very low	96 Å²	96	145.7 Å²	145.7	67%	0.671	76%	0.755	S	S	*	*			trans	-149.4	127.6	144.1	48.1	0	0	0	0	108
1240	H	30.8	Very low	27.7	Very low	174 Å²	174	144 Å²	144	81%	0.806	76%	0.755	S	S	*	*				56.3	95	57.6	-81.8	-86.8	0	0	0	114.2
1241	H	26.8	Very low	27.7	Very low	179 Å²	179	148.8 Å²	148.8	83%	0.829	77%	0.767	S	S	*	*			trans	180	146.1	141	-90.2	-58	0	0	0	108.1
1242	S	26.6	Very low	27.8	Very low	94 Å²	94	147.7 Å²	147.7	66%	0.657	77%	0.766	S	S	*	*			cis	-142.5	130.2	-10.5	-99.8	0	0	0	0	107.8
1243	V	25.5	Very low	27.8	Very low	113 Å²	113	142.1 Å²	142.1	69%	0.685	76%	0.756	S	S	*	*				70.1	97.7	76.5	176.9	0	0	0	0	113.4
1244	N	24.6	Very low	27.7	Very low	147 Å²	147	138.8 Å²	138.8	79%	0.786	75%	0.752	S	S	*	*			trans	166.3	119.4	138.1	-84.8	-29.6	0	0	0	106.8
1245	K	30.1	Very low	27.6	Very low	191 Å²	191	141.3 Å²	141.3	83%	0.83	75%	0.75	S	S	*	*			cis	65.3	128	19.3	-141.5	176.4	-171.3	177.8	0	113.2
1246	K	22.9	Very low	27.7	Very low	191 Å²	191	139 Å²	139	83%	0.83	75%	0.748	S	S	*	*			trans	72.1	118.3	-158.4	-54.3	176.8	-178.5	178.3	0	110.8
1247	V	27.3	Very low	27.3	Very low	109 Å²	109	136.4 Å²	136.4	66%	0.661	74%	0.742	S	S	*	*				70.4	96.6	53	-177.3	0	0	0	0	112	H1249	V1247-H1249 WeakPolarHBondContact CG1-ND1 3.12Å
1248	F	24.6	Very low	27.3	Very low	208 Å²	208	141.3 Å²	141.3	91%	0.912	75%	0.745	S	S	*	*			trans	-149.7	104.8	134.6	-112.1	-88.5	0	0	0	105.9
1249	H	25.6	Very low	27.1	Very low	158 Å²	158	144.7 Å²	144.7	73%	0.731	75%	0.747	S	S	*	*				87.8	112.6	68.8	-99.3	53.4	0	0	0	114.2	V1247	V1247-H1249 WeakPolarHBondContact CG1-ND1 3.12Å
1250	G	28.4	Very low	27.3	Very low	71 Å²	71	144.4 Å²	144.4	73%	0.732	75%	0.745	S	S	*	*			trans	78.5	167.7	162.8	0	0	0	0	0	116.2
1251	Q	29.3	Very low	27.1	Very low	190 Å²	190	141.2 Å²	141.2	89%	0.888	74%	0.743	S	S	*	*			cis	-167	157.4	-11.3	-116.9	-176.7	15.8	0	0	105.9
1252	V	28.9	Very low	27.2	Very low	106 Å²	106	137.1 Å²	137.1	64%	0.642	74%	0.74	S	S	*	*			cis	-159.9	153.3	8.1	77.8	0	0	0	0	110
1253	T	27.5	Very low	27.3	Very low	103 Å²	103	140.4 Å²	140.4	63%	0.632	75%	0.746	S	S	*	*			trans	48.1	130	164.6	54.1	0	0	0	0	120.5
1254	S	28.3	Very low	27.5	Very low	95 Å²	95	143.1 Å²	143.1	66%	0.664	75%	0.749	S	S	*	*			cis	71.1	119.2	34.6	93.2	0	0	0	0	117
1255	K	28.9	Very low	27.7	Very low	173 Å²	173	142.4 Å²	142.4	75%	0.752	75%	0.746	S	S	*	*				173.9	119	129.7	-93.6	154.6	-170.9	174.4	0	110.3
1256	T	27.3	Very low	27.6	Very low	124 Å²	124	140.9 Å²	140.9	76%	0.761	74%	0.741	S	S	*	*				56	141.7	95.9	72.1	0	0	0	0	114.3
1257	S	26.8	Very low	27.7	Very low	84 Å²	84	136.5 Å²	136.5	59%	0.587	72%	0.72	S	S	*	*			cis	-166.8	169.5	22	-138.8	0	0	0	0	112
1258	R	27.5	Very low	27.6	Very low	215 Å²	215	135.8 Å²	135.8	81%	0.811	71%	0.709	S	S	*	*			trans	32.5	142	137.6	-64.6	166.9	-177.8	172	-0.6	119.4
1259	R	27.2	Very low	27.6	Very low	217 Å²	217	131 Å²	131	82%	0.819	69%	0.689	S	S	*	*			cis	-166.3	162.4	18	-132.1	174.2	179.2	170.2	-4.1	110.8
1260	S	28	Very low	27.6	Very low	90 Å²	90	127.6 Å²	127.6	63%	0.629	68%	0.684	S	S	*	*			trans	-1.3	134.6	148.5	61.5	0	0	0	0	118
1261	S	27.4	Very low	27.4	Very low	108 Å²	108	128.7 Å²	128.7	76%	0.755	68%	0.68	S	S	*	*				-177.8	144.9	66.6	-77.4	0	0	0	0	114.5
1262	A	29	Very low	27.2	Very low	93 Å²	93	130.6 Å²	130.6	77%	0.769	68%	0.679	S	S	*	*			trans	64.2	138.3	139.2	0	0	0	0	0	123.7
1263	M	29.1	Very low	27	Very low	162 Å²	162	129.8 Å²	129.8	80%	0.798	68%	0.678	S	S	*	*			trans	81.1	107.9	150.4	-67.8	-84.1	171	0	0	121.4
1264	K	29.5	Very low	27.2	Very low	170 Å²	170	131.2 Å²	131.2	74%	0.739	69%	0.687	S	S	*	*			trans	78.1	108.4	135	-71.6	-177.6	176	179.3	0	122.1
1265	N	29.1	Very low	27	Very low	133 Å²	133	135.4 Å²	135.4	71%	0.711	70%	0.698	S	S	*	*				84.6	136	126	-70.7	18.2	0	0	0	120.9
1266	Q	27.1	Very low	26.8	Very low	159 Å²	159	130.9 Å²	130.9	74%	0.743	69%	0.693	S	S	*	*			trans	65.3	150.7	169	-69.6	-173.2	17.8	0	0	113.6	P748	P748-Q1266 WeakPolarHBondContact CD-O 3.19Å; P748-Q1266 WeakPolarHBondContact CG-O 3.4Å
1267	R	26.1	Very low	26.7	Very low	99 Å²	99	132.6 Å²	132.6	37%	0.374	69%	0.692	S	S	.	*			cis	-176.2	121.5	-4.2	156.8	-178.3	-169.5	-69.1	-19.4	105.6	P748 R749	P748-R1267 CarbonylContact C-O 3.59Å; P748-R1267 WeakPolarHBondContact CD-O 3.37Å; P748-R1267 WeakPolarHBondContact CG-O 3.36Å; R749-R1267 PolarHBondContact N-O 2.94Å
1268	E	24.2	Very low	26.6	Very low	94 Å²	94	134.4 Å²	134.4	44%	0.439	69%	0.691	S	S	.	*			trans	79.3	151.3	169	-59.3	165.3	165.7	0	0	120.5	R749 G750	R749-E1268 WeakPolarHBondContact CA-OE2 3.47Å; G750-E1268 VanDerWaalsContact N-CB 3.27Å; G750-E1268 PolarHBondContact N-OE2 3.4Å; G750-E1268 WeakPolarHBondContact O-CB 3.45Å; G750-E1268 WeakPolarHBondContact O-CG 3.48Å
1269	E	24.9	Very low	26.5	Very low	106 Å²	106	133.7 Å²	133.7	50%	0.495	69%	0.689	S	S	.	*			trans	74.3	118.6	162.2	-102.6	-163.6	-77.2	0	0	127.7	G750 P751	G750-E1269 WeakPolarHBondContact CA-OE1 3.42Å; P751-E1269 VanDerWaalsContact CA-OE1 3.24Å; P751-E1269 WeakPolarHBondContact CA-OE1 3.43Å; P751-E1269 VanDerWaalsContact CB-CD 3.41Å; P751-E1269 HydrophobicContact CB-CG 3.66Å; P751-E1269 HydrophobicContact CG-CG 3.65Å
1270	S	25.2	Very low	26.5	Very low	88 Å²	88	131.2 Å²	131.2	62%	0.615	69%	0.686	S	S	*	*			trans	68.4	101.6	130	72.1	0	0	0	0	123.6
1271	S	25.1	Very low	26.4	Very low	94 Å²	94	132.2 Å²	132.2	66%	0.657	69%	0.689	S	S	*	*				81.9	151.8	121.3	-158.7	0	0	0	0	121.4
1272	W	23.5	Very low	26.3	Very low	230 Å²	230	134.9 Å²	134.9	87%	0.871	68%	0.682	S	S	*	*			trans	67.3	154.4	172.9	-48	89.3	0	0	0	116.9
1273	S	26	Very low	26.3	Very low	88 Å²	88	136.3 Å²	136.3	62%	0.615	68%	0.677	S	S	*	*			cis	-175.3	141.3	-37.8	-95.7	0	0	0	0	109.2
1274	T	31.1	Very low	26.2	Very low	134 Å²	134	132.9 Å²	132.9	82%	0.822	66%	0.662	S	S	*	*			trans	71.4	155.9	155.8	-45.8	0	0	0	0	118.9
1275	M	23.2	Very low	26.2	Very low	183 Å²	183	131.3 Å²	131.3	90%	0.901	66%	0.657	S	S	*	*			trans	73.6	156.5	175.9	-65	-166.5	169.1	0	0	118
1276	A	26	Very low	26.1	Very low	78 Å²	78	134.7 Å²	134.7	65%	0.645	66%	0.661	S	S	*	*			cis	-177.7	165.9	-34	0	0	0	0	0	109.1
1277	H	24.7	Very low	26.1	Very low	159 Å²	159	130 Å²	130	74%	0.736	66%	0.656	S	S	*	*			trans	63.6	102.5	163.8	-86.2	-94.9	0	0	0	120.6
1278	E	24.1	Very low	26.2	Very low	123 Å²	123	131.6 Å²	131.6	58%	0.575	68%	0.681	S	S	*	*				75	125.3	117.8	-73.9	-167.5	123	0	0	123.8
1279	R	25.5	Very low	26.3	Very low	199 Å²	199	130.5 Å²	130.5	75%	0.751	70%	0.696	S	S	*	*			trans	61	119.6	139.6	-59.7	176.1	-156.3	-128	3.6	118.2
1280	H	27.2	Very low	26.4	Very low	165 Å²	165	130.4 Å²	130.4	76%	0.764	71%	0.707	S	S	*	*				-158.2	143.4	92.4	-119.1	-90	0	0	0	113
1281	T	26	Very low	26.4	Very low	112 Å²	112	134.6 Å²	134.6	69%	0.687	71%	0.714	S	S	*	*			trans	17.1	121.6	150.3	48	0	0	0	0	117.4
1282	R	25.4	Very low	26.5	Very low	164 Å²	164	138.8 Å²	138.8	62%	0.619	72%	0.721	S	S	*	*			cis	-150.3	-174	25.8	-113.8	175.5	79.7	84.3	3.3	109.4	D1284	R1282-D1284 IonicContact CZ-OD2 2.68Å; R1282-D1284 IonicContact NH1-OD1 2.77Å; R1282-D1284 IonicContact NH1-OD2 2.67Å; R1282-D1284 PolarHBondContact NH1-OD2 3.49Å; R1282-D1284 IonicContact NH2-OD2 2.81Å; R1282-D1284 PolarHBondContact NH2-OD2 3.35Å
1283	D	29	Very low	26.6	Very low	122 Å²	122	133.6 Å²	133.6	65%	0.652	72%	0.719	S	S	*	*			cis	-141.7	-167.6	25.6	-144.1	-80.4	0	0	0	113.2
1284	D	28.2	Very low	26.8	Very low	90 Å²	90	133.1 Å²	133.1	48%	0.481	73%	0.728	S	S	.	*			trans	-98.2	163.3	-172.3	-77.7	-29	0	0	0	112.5	R1282	R1282-D1284 IonicContact CZ-OD2 2.68Å; R1282-D1284 IonicContact NH1-OD1 2.77Å; R1282-D1284 IonicContact NH1-OD2 2.67Å; R1282-D1284 PolarHBondContact NH1-OD2 3.49Å; R1282-D1284 IonicContact NH2-OD2 2.81Å; R1282-D1284 PolarHBondContact NH2-OD2 3.35Å
1285	H	28.9	Very low	26.8	Very low	138 Å²	138	132.5 Å²	132.5	64%	0.639	72%	0.724	S	S	*	*			cis	-159.7	161.5	5.7	-119.6	23.1	0	0	0	110.6
1286	Y	26.9	Very low	27	Very low	204 Å²	204	131.6 Å²	131.6	80%	0.8	72%	0.72	S	S	*	*			trans	10.5	145.8	152.2	-60	-116	0	0	0	121.1
1287	G	27.4	Very low	27.1	Very low	61 Å²	61	135.2 Å²	135.2	63%	0.629	72%	0.723	S	S	*	*			cis	126.2	147.9	-0.5	0	0	0	0	0	115
1288	S	27	Very low	27.3	Very low	131 Å²	131	135.4 Å²	135.4	92%	0.916	73%	0.728	S	S	*	*			trans	71.1	165.5	167.4	81.3	0	0	0	0	119.4
1289	G	26.8	Very low	27.4	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	73%	0.728	S	S	*	*			trans	89.8	86.6	176.1	0	0	0	0	0	114.6
1290	S	27.2	Very low	27.5	Very low	103 Å²	103	130.9 Å²	130.9	72%	0.72	72%	0.72	S	S	*	*			cis	87.7	144.5	33.6	-159.2	0	0	0	0	115.9
1291	F	25.5	Very low	27.6	Very low	177 Å²	177	126.1 Å²	126.1	78%	0.776	70%	0.703	S	S	*	*			trans	80.4	134	164.8	-76.6	-65.4	0	0	0	123
1292	K	26.1	Very low	27.7	Very low	182 Å²	182	124.6 Å²	124.6	79%	0.791	69%	0.69	S	S	*	*			trans	74.5	123.1	155.2	-63.9	154	-172.3	176.5	0	115.5
1293	S	27.2	Very low	27.8	Very low	120 Å²	120	118.7 Å²	118.7	84%	0.839	67%	0.674	S	S	*	*			cis	74.6	120.6	46.4	-166.8	0	0	0	0	112.6
1294	G	30.3	Very low	27.8	Very low	78 Å²	78	115.4 Å²	115.4	80%	0.804	66%	0.661	S	S	*	*			trans	-176.4	53.2	-168.8	0	0	0	0	0	113.2
1295	T	30	Very low	27.8	Very low	121 Å²	121	114.3 Å²	114.3	74%	0.742	66%	0.661	S	S	*	*			trans	-67.8	136.9	176.5	-53.8	0	0	0	0	112.3
1296	M	27.1	Very low	27.8	Very low	165 Å²	165	119.6 Å²	119.6	81%	0.813	68%	0.675	S	S	*	*			trans	-170.5	132.2	135.9	-102.2	-174.8	-81	0	0	108.8
1297	H	28.1	Very low	28.1	Very low	154 Å²	154	115 Å²	115	71%	0.713	67%	0.67	S	S	*	*				55.7	130	90.7	-81	-83.6	0	0	0	112.3
1298	I	28.5	Very low	28.2	Very low	162 Å²	162	122 Å²	122	83%	0.831	68%	0.677	S	S	*	*			cis	-151.3	157.9	30.8	-67.3	-176.5	0	0	0	108.7
1299	D	27.3	Very low	28.4	Very low	109 Å²	109	121.6 Å²	121.6	58%	0.583	67%	0.672	S	S	*	*			cis	179.7	-174.7	-28.1	-164.4	-1.3	0	0	0	107.9
1300	M	27.8	Very low	28.6	Very low	118 Å²	118	123.2 Å²	123.2	58%	0.581	67%	0.669	S	S	*	*			trans	69.4	75.6	151.3	-69	-67.2	158.6	0	0	119.8	R1219	R1219-M1300 PolarHBondContact NH1-O 2.77Å
1301	T	28.9	Very low	28.5	Very low	66 Å²	66	129 Å²	129	41%	0.405	68%	0.675	S	S	.	*				59.6	172.5	119.3	60.2	0	0	0	0	118.4	S1218 R1219	S1218-T1301 PolarHBondContact OG-O 3.15Å; R1219-T1301 VanDerWaalsContact CZ-C 3.48Å; R1219-T1301 PolarHBondContact NH1-O 3.3Å; R1219-T1301 PolarHBondContact NH2-OG1 3Å
1302	D	27	Very low	28.5	Very low	79 Å²	79	129.5 Å²	129.5	42%	0.422	68%	0.677	S	S	.	*			cis	-168.7	168.6	20	-171.1	25.2	0	0	0	111.5	S1218 R1219	S1218-D1302 PolarHBondContact OG-N 2.99Å; R1219-D1302 WeakPolarHBondContact CA-O 3.41Å; R1219-D1302 HydrophobicContact CG-CB 4.07Å; R1219-D1302 WeakPolarHBondContact CG-O 3.44Å
1303	S	28.5	Very low	28.6	Very low	40 Å²	40	123.7 Å²	123.7	28%	0.28	67%	0.669	S	S	.	*			trans	44.9	149.6	147.5	52.4	0	0	0	0	122.9	R1219 K1220	R1219-S1303 CarbonylContact C-O 3.27Å; K1220-S1303 WeakPolarHBondContact CA-OG 3.35Å; K1220-S1303 PolarHBondContact N-O 3.44Å
1304	S	28.2	Very low	28.7	Very low	53 Å²	53	126.2 Å²	126.2	37%	0.371	67%	0.667	S	S	.	*			cis	-170.1	-179.8	-16.7	55.5	0	0	0	0	111.6	G1221 Y1222	G1221-S1304 VanDerWaalsContact CA-OG 3.23Å; G1221-S1304 WeakPolarHBondContact CA-OG 3.43Å; Y1222-S1304 PolarHBondContact N-OG 3.39Å; Y1222-S1304 VanDerWaalsContact N-OG 3.14Å
1305	S	29.3	Very low	28.6	Very low	68 Å²	68	127.5 Å²	127.5	48%	0.476	66%	0.659	S	S	.	*			trans	56.1	111.7	155.2	12	0	0	0	0	118.8	Y1222 V1223	Y1222-S1305 PolarHBondContact O-OG 3.32Å; V1223-S1305 PolarHBondContact N-OG 3.27Å
1306	R	28.4	Very low	28.6	Very low	249 Å²	249	127.1 Å²	127.1	94%	0.94	66%	0.657	S	S	*	*			cis	88.2	147.3	45.2	-74.5	-165.2	165	-151.9	-0.7	115.8
1307	P	32.5	Very low	28.7	Very low	106 Å²	106	124.2 Å²	124.2	69%	0.688	65%	0.645	S	S	*	*			trans	-130.1	-178.8	-158	43	-26.1	0	0	0	116.2
1308	R	29.6	Very low	28.9	Very low	209 Å²	209	122.7 Å²	122.7	79%	0.789	64%	0.642	S	S	*	*			trans	72.2	153.6	171.1	-66.7	-177.6	-176.1	-119.8	-0.2	113.2
1309	P	31.3	Very low	29	Very low	123 Å²	123	122.6 Å²	122.6	80%	0.799	64%	0.635	S	S	*	*			cis	-127	174.6	36.7	30.6	-8.8	0	0	0	117
1310	P	31.2	Very low	29.3	Very low	105 Å²	105	122.9 Å²	122.9	68%	0.682	64%	0.637	S	S	*	*			trans	-95.9	151.7	175.6	36.6	-33.5	0	0	0	113.6
1311	R	25	Very low	29.4	Very low	226 Å²	226	121.2 Å²	121.2	85%	0.853	63%	0.634	S	S	*	*			trans	172.4	144.6	141	-102.2	167.1	-175.2	-154.2	1.8	115.4
1312	F	26.5	Very low	29.4	Very low	186 Å²	186	125.3 Å²	125.3	82%	0.816	65%	0.648	S	S	*	*			trans	59.4	158.8	153.2	-68.7	-63.3	0	0	0	121.5
1313	G	27.5	Very low	29.4	Very low	60 Å²	60	125.2 Å²	125.2	62%	0.619	67%	0.665	S	S	*	*			trans	96.5	117.3	-173.5	0	0	0	0	0	111.6
1314	H	28.9	Very low	29.5	Very low	173 Å²	173	129.7 Å²	129.7	80%	0.801	69%	0.691	S	S	*	*			cis	59.3	126.3	45.1	-62.3	-87.3	0	0	0	112.6
1315	T	28.3	Very low	29.3	Very low	105 Å²	105	138.2 Å²	138.2	64%	0.644	72%	0.715	S	S	*	*			cis	-167.2	156.6	3.8	2.6	0	0	0	0	112.2
1316	T	30.2	Very low	29.4	Very low	113 Å²	113	142.9 Å²	142.9	69%	0.693	73%	0.729	S	S	*	*			trans	61.8	153.8	149.6	55.8	0	0	0	0	119.3
1317	N	29.7	Very low	29.4	Very low	104 Å²	104	136.5 Å²	136.5	56%	0.556	71%	0.714	S	S	*	*			cis	-166.5	148.4	-14.9	-110.4	-5.1	0	0	0	109.6
1318	N	31.8	Very low	29.1	Very low	123 Å²	123	143.1 Å²	143.1	66%	0.658	73%	0.727	S	S	*	*			trans	65.5	152.4	143.5	-65.1	-15.3	0	0	0	118.5
1319	K	31.3	Very low	29.1	Very low	159 Å²	159	138.6 Å²	138.6	69%	0.691	72%	0.723	S	S	*	*			cis	-162.5	168.5	1.7	-128.6	179.2	-178.8	-166.2	0	111.5
1320	D	32.2	Very low	28.9	Very low	116 Å²	116	138.5 Å²	138.5	62%	0.62	73%	0.725	S	S	*	*			trans	64.5	145	157.5	-48.4	-28.1	0	0	0	117.5
1321	T	31	Very low	28.9	Very low	82 Å²	82	144.5 Å²	144.5	50%	0.503	73%	0.734	S	S	.	*			cis	-152.7	156.8	-14.4	6.7	0	0	0	0	110.4	S867 N868	S867-T1321 PolarHBondContact O-OG1 3.49Å; N868-T1321 PolarHBondContact O-OG1 2.96Å
1322	H	29	Very low	29.1	Very low	152 Å²	152	141.2 Å²	141.2	70%	0.704	73%	0.733	S	S	*	*			trans	46.7	136.1	159.1	-68.6	-82.2	0	0	0	123.5	N868	N868-H1322 PolarHBondContact O-CD2 3.21Å
1323	G	26.2	Very low	29.2	Very low	77 Å²	77	143 Å²	143	79%	0.794	74%	0.736	S	S	*	*			trans	112	30.3	133.1	0	0	0	0	0	122
1324	V	30.2	Very low	29.4	Very low	134 Å²	134	145.7 Å²	145.7	81%	0.812	74%	0.742	S	S	*	*			trans	-137.2	125.4	-176.8	174.5	0	0	0	0	108.3
1325	R	25.5	Very low	29.4	Very low	233 Å²	233	144 Å²	144	88%	0.879	74%	0.744	S	S	*	*			cis	67.7	129	9.3	-155.9	179.3	-170.2	-145	0.5	116.5
1326	Q	30.4	Very low	29.5	Very low	165 Å²	165	148.2 Å²	148.2	77%	0.771	75%	0.754	S	S	*	*			trans	85.2	152.5	-157.7	-62.5	-175	25.1	0	0	112.4
1327	N	28.6	Very low	29.5	Very low	115 Å²	115	151 Å²	151	62%	0.615	76%	0.758	S	S	*	*			cis	-157	142.1	-18.9	-104.9	-16.3	0	0	0	108
1328	Y	27	Very low	29.5	Very low	245 Å²	245	152.2 Å²	152.2	96%	0.961	76%	0.764	S	S	*	*			trans	-130.3	116.4	155.5	-102.8	-78.7	0	0	0	109.2
1329	T	29.3	Very low	29.4	Very low	115 Å²	115	154.6 Å²	154.6	71%	0.706	77%	0.771	S	S	*	*			trans	-100.5	129.7	-166.3	50.9	0	0	0	0	111.9
1330	S	27.9	Very low	29.4	Very low	120 Å²	120	152.8 Å²	152.8	84%	0.839	77%	0.768	S	S	*	*			trans	-141.5	95.1	158.4	-97.3	0	0	0	0	111.8
1331	R	30.6	Very low	29.2	Very low	232 Å²	232	155.6 Å²	155.6	88%	0.875	77%	0.774	S	S	*	*			trans	53.3	75.6	148.4	-64.6	-178.6	172.6	165.2	-2.3	118.7
1332	N	28.6	Very low	29	Very low	156 Å²	156	158.3 Å²	158.3	83%	0.834	79%	0.791	S	S	*	*			trans	3.4	121.3	136.4	-52.8	-5.3	0	0	0	118.1
1333	Y	29.1	Very low	29	Very low	223 Å²	223	157.6 Å²	157.6	88%	0.875	79%	0.793	S	S	*	*			trans	-117.6	137.6	133.2	-89.1	-97.3	0	0	0	108.3	V1335	Y1333-V1335 PolarHBondContact O-N 2.87Å
1334	P	31.2	Very low	29.2	Very low	117 Å²	117	159.6 Å²	159.6	76%	0.76	79%	0.789	S	S	*	*			trans	-86.6	98.5	-168.2	32.4	-34.7	0	0	0	113.2	K1336	P1334-K1336 PolarHBondContact O-N 3.31Å
1335	V	30	Very low	29.2	Very low	138 Å²	138	162 Å²	162	84%	0.836	79%	0.791	S	S	*	*			trans	-69.1	112.2	166.3	179.8	0	0	0	0	109.3	Y1333 H1337	Y1333-V1335 PolarHBondContact O-N 2.87Å; V1335-H1337 PolarHBondContact O-N 2.87Å
1336	K	29.6	Very low	29.4	Very low	194 Å²	194	155.1 Å²	155.1	84%	0.843	77%	0.771	S	S	*	*			trans	-70	113.6	175.8	-70	-177.2	178.2	179.8	0	110.2	P1334 L1338	P1334-K1336 PolarHBondContact O-N 3.31Å; K1336-L1338 PolarHBondContact O-N 3.35Å
1337	H	30.4	Very low	29.4	Very low	170 Å²	170	152.7 Å²	152.7	79%	0.787	77%	0.773	S	S	*	*			trans	-65.4	96.3	174.5	-125.7	-78.2	0	0	0	110.4	V1335 H1339	V1335-H1337 PolarHBondContact O-N 2.87Å; H1337-H1339 PolarHBondContact O-N 2.9Å; H1337-H1339 VanDerWaalsContact O-N 3.09Å
1338	L	30.4	Very low	29.4	Very low	131 Å²	131	154.3 Å²	154.3	69%	0.686	77%	0.774	S	S	*	*			trans	-85.1	83.9	-178.4	-162	75.1	0	0	0	110.9	K1336 I1340	K1336-L1338 PolarHBondContact O-N 3.35Å; L1338-I1340 HydrophobicContact CD2-CD1 3.81Å; L1338-I1340 HydrophobicContact CD2-CG1 3.8Å; L1338-I1340 HydrophobicContact CG-CD1 4.49Å; L1338-I1340 HydrophobicContact CG-CG1 3.92Å; L1338-I1340 PolarHBondContact O-N 3.2Å
1339	H	29	Very low	29.5	Very low	172 Å²	172	150.5 Å²	150.5	80%	0.796	77%	0.77	S	S	*	*			trans	-65	81.5	165.3	-90.4	119.4	0	0	0	110.5	H1337 K1341	H1337-H1339 PolarHBondContact O-N 2.9Å; H1337-H1339 VanDerWaalsContact O-N 3.09Å; H1339-K1341 PolarHBondContact O-N 3.48Å; H1339-K1341 VanDerWaalsContact O-N 3.16Å
1340	I	30.6	Very low	29.4	Very low	122 Å²	122	151.6 Å²	151.6	63%	0.626	77%	0.767	S	S	*	*			trans	-71	106.5	163	-61.9	-175.8	0	0	0	107.1	L1338 T1342	L1338-I1340 HydrophobicContact CD2-CD1 3.81Å; L1338-I1340 HydrophobicContact CD2-CG1 3.8Å; L1338-I1340 HydrophobicContact CG-CD1 4.49Å; L1338-I1340 HydrophobicContact CG-CG1 3.92Å; L1338-I1340 PolarHBondContact O-N 3.2Å; I1340-T1342 PolarHBondContact O-N 3.27Å
1341	K	28.1	Very low	29.3	Very low	174 Å²	174	157.8 Å²	157.8	76%	0.757	77%	0.772	S	S	*	*			trans	-59.9	134.8	164.5	-71.8	179.6	177.7	176.7	0	108.9	H1339 D1343	H1339-K1341 PolarHBondContact O-N 3.48Å; H1339-K1341 VanDerWaalsContact O-N 3.16Å; K1341-D1343 PolarHBondContact O-N 3.15Å
1342	T	27.3	Very low	29.1	Very low	139 Å²	139	150.2 Å²	150.2	85%	0.853	75%	0.754	S	S	*	*			trans	-72.5	89.6	170.9	50	0	0	0	0	109.7	I1340	I1340-T1342 PolarHBondContact O-N 3.27Å
1343	D	30	Very low	28.9	Very low	138 Å²	138	151.6 Å²	151.6	74%	0.738	75%	0.753	S	S	*	*			trans	-110.6	121.2	168.5	-87.2	-57.5	0	0	0	111.6	K1341	K1341-D1343 PolarHBondContact O-N 3.15Å
1344	V	29.4	Very low	28.8	Very low	118 Å²	118	146.2 Å²	146.2	72%	0.715	75%	0.748	S	S	*	*			trans	-37.1	130.1	-178.9	179.5	0	0	0	0	115.1	D1346	V1344-D1346 HydrophobicContact CG1-CB 4.22Å
1345	H	30.6	Very low	28.5	Very low	185 Å²	185	144.1 Å²	144.1	86%	0.856	75%	0.747	S	S	*	*				-134.1	110.2	128.7	-131.3	-73.8	0	0	0	111.8
1346	D	29.2	Very low	28.4	Very low	88 Å²	88	144 Å²	144	47%	0.471	74%	0.742	S	S	.	*			trans	-81.6	150.4	-179.7	-167.9	7.7	0	0	0	110	V1344 K1348	V1344-D1346 HydrophobicContact CG1-CB 4.22Å; D1346-K1348 VanDerWaalsContact CG-NZ 3.32Å; D1346-K1348 PolarHBondContact OD1-N 3.49Å; D1346-K1348 IonicContact OD1-NZ 3.1Å; D1346-K1348 PolarHBondContact OD1-NZ 2.6Å; D1346-K1348 IonicContact OD2-NZ 2.68Å; D1346-K1348 PolarHBondContact OD2-NZ 3.37Å
1347	S	31	Very low	28.3	Very low	115 Å²	115	140.4 Å²	140.4	80%	0.804	74%	0.736	S	S	*	*			trans	-148.8	49.8	175.9	-76	0	0	0	0	111.8	L1349	S1347-L1349 PolarHBondContact O-N 2.87Å; S1347-L1349 VanDerWaalsContact O-N 3.1Å
1348	K	27.7	Very low	28.2	Very low	148 Å²	148	142 Å²	142	64%	0.643	74%	0.736	S	S	*	*			trans	-52.1	108.8	163	-75.7	173.8	-177.7	63.6	0	111.7	D1346 H1350	D1346-K1348 VanDerWaalsContact CG-NZ 3.32Å; D1346-K1348 PolarHBondContact OD1-N 3.49Å; D1346-K1348 IonicContact OD1-NZ 3.1Å; D1346-K1348 PolarHBondContact OD1-NZ 2.6Å; D1346-K1348 IonicContact OD2-NZ 2.68Å; D1346-K1348 PolarHBondContact OD2-NZ 3.37Å; K1348-H1350 HydrophobicContact CB-CB 4.27Å; K1348-H1350 PolarHBondContact O-N 3.49Å
1349	L	28.6	Very low	28	Very low	165 Å²	165	141.3 Å²	141.3	86%	0.864	73%	0.732	S	S	*	*			trans	-90.5	77.8	154.1	-93.8	169.2	0	0	0	109.9	S1347	S1347-L1349 PolarHBondContact O-N 2.87Å; S1347-L1349 VanDerWaalsContact O-N 3.1Å
1350	H	27.8	Very low	27.8	Very low	138 Å²	138	140.9 Å²	140.9	64%	0.639	73%	0.729	S	S	*	*			trans	-101.3	81	-174.5	-163.3	-69.8	0	0	0	111.3	K1348 S1352	K1348-H1350 HydrophobicContact CB-CB 4.27Å; K1348-H1350 PolarHBondContact O-N 3.49Å; H1350-S1352 VanDerWaalsContact C-N 3.34Å; H1350-S1352 PolarHBondContact CE1-OG 2.74Å; H1350-S1352 VanDerWaalsContact CE1-OG 3.23Å; H1350-S1352 PolarHBondContact ND1-OG 3.03Å; H1350-S1352 PolarHBondContact O-N 3.38Å
1351	W	25.6	Very low	27.8	Very low	251 Å²	251	138.8 Å²	138.8	95%	0.951	71%	0.713	S	S	*	*			trans	-82.8	81	171	-88.6	-25.8	0	0	0	112.9
1352	S	26	Very low	28	Very low	72 Å²	72	133.4 Å²	133.4	50%	0.503	70%	0.695	S	S	.	*			trans	-57.7	135.1	163.6	-44.7	0	0	0	0	111.6	H1350	H1350-S1352 VanDerWaalsContact C-N 3.34Å; H1350-S1352 PolarHBondContact CE1-OG 2.74Å; H1350-S1352 VanDerWaalsContact CE1-OG 3.23Å; H1350-S1352 PolarHBondContact ND1-OG 3.03Å; H1350-S1352 PolarHBondContact O-N 3.38Å
1353	K	26	Very low	28.2	Very low	186 Å²	186	132 Å²	132	81%	0.809	69%	0.688	S	S	*	*				177.9	134.3	109.6	-97.4	161.3	-175.6	172.6	0	114.9
1354	S	25.3	Very low	28.2	Very low	110 Å²	110	131 Å²	131	77%	0.769	69%	0.688	S	S	*	*			trans	35.9	128.8	144.9	61.2	0	0	0	0	121.4
1355	G	26.7	Very low	28	Very low	72 Å²	72	128.7 Å²	128.7	74%	0.742	67%	0.674	S	S	*	*			cis	158.8	151.8	-8.1	0	0	0	0	0	116.7
1356	N	27.5	Very low	27.8	Very low	135 Å²	135	123.6 Å²	123.6	72%	0.722	66%	0.659	S	S	*	*			trans	34.8	98.5	139.8	-168.4	32.8	0	0	0	120.2
1357	T	27.7	Very low	27.7	Very low	119 Å²	119	123.5 Å²	123.5	73%	0.73	67%	0.665	S	S	*	*				-165.4	112.8	125.2	21.1	0	0	0	0	107
1358	R	27	Very low	27.4	Very low	205 Å²	205	123 Å²	123	77%	0.774	66%	0.662	S	S	*	*				43.5	97.8	68.1	-72.4	-168.1	175.6	-171.1	0.1	113.5
1359	N	26.2	Very low	27.5	Very low	116 Å²	116	127.1 Å²	127.1	62%	0.62	67%	0.673	S	S	*	*				-174.7	91.6	107.4	-87.3	-14.9	0	0	0	113.7	R346 R347	R346-N1359 CarbonylContact C-O 3.44Å; R346-N1359 VanDerWaalsContact C-O 3.27Å; R347-N1359 PolarHBondContact N-O 2.67Å
1360	F	26.3	Very low	27.5	Very low	163 Å²	163	124.3 Å²	124.3	72%	0.715	67%	0.667	S	S	*	*			trans	25.8	132.5	146.2	-91.3	-70.7	0	0	0	122.8	R347 S348	R347-F1360 CarbonylContact C-O 3.5Å; R347-F1360 WeakPolarHBondContact CA-O 3.43Å; R347-F1360 PolarHBondContact N-O 2.95Å; S348-F1360 PolarHBondContact N-O 3.1Å
1361	R	28.6	Very low	27.8	Very low	78 Å²	78	122.8 Å²	122.8	29%	0.294	67%	0.67	S	S	.	*			trans	76.3	169.4	130.4	-149.9	158.9	73.6	-170.4	-169.9	114	R347 S348 V350 E351	R347-R1361 CarbonylContact C-O 3.13Å; S348-R1361 VanDerWaalsContact N-C 3.34Å; S348-R1361 PolarHBondContact N-O 2.72Å; S348-R1361 CarbonylContact O-C 3.51Å; S348-R1361 WeakPolarHBondContact O-CB 3.22Å; S348-R1361 WeakPolarHBondContact O-CG 3.47Å; V350-R1361 HydrophobicContact CB-CG 3.85Å; V350-R1361 HydrophobicContact CG1-CG 4.32Å; V350-R1361 HydrophobicContact CG2-CG 4.21Å; V350-R1361 PolarHBondContact O-NH1 2.95Å; E351-R1361 IonicContact OE1-CZ 2.7Å; E351-R1361 IonicContact OE1-NH1 2.84Å; E351-R1361 PolarHBondContact OE1-NH1 3.12Å; E351-R1361 VanDerWaalsContact OE1-NH1 3.1Å; E351-R1361 IonicContact OE1-NH2 3.79Å; E351-R1361 PolarHBondContact OE1-NH2 3.11Å; E351-R1361 IonicContact OE2-CZ 3.24Å; E351-R1361 IonicContact OE2-NH1 3.88Å; E351-R1361 PolarHBondContact OE2-NH1 2.94Å; E351-R1361 IonicContact OE2-NH2 3.35Å
1362	P	32.6	Very low	27.9	Very low	60 Å²	60	117.7 Å²	117.7	39%	0.39	66%	0.66	S	S	.	*			cis	-111	-143.5	-17.3	40.5	-18.7	0	0	0	108.9	S348 V350	S348-P1362 VanDerWaalsContact O-CB 3.25Å; S348-P1362 WeakPolarHBondContact O-CB 3.48Å; S348-P1362 WeakPolarHBondContact O-CD 3.43Å; S348-P1362 VanDerWaalsContact O-CG 3.3Å; S348-P1362 WeakPolarHBondContact O-CG 3.49Å; V350-P1362 HydrophobicContact CG2-CB 4.04Å
1363	P	33	Very low	28	Very low	109 Å²	109	117.4 Å²	117.4	71%	0.708	67%	0.668	S	S	*	*			trans	-127	152	156.3	38.3	-26.6	0	0	0	114.5
1364	V	28.3	Very low	28.2	Very low	119 Å²	119	117.9 Å²	117.9	72%	0.721	67%	0.67	S	S	*	*			trans	-155.2	113.6	144.5	-103.4	0	0	0	0	110.9
1365	T	26.7	Very low	28.4	Very low	69 Å²	69	118.7 Å²	118.7	42%	0.423	67%	0.67	S	S	.	*			trans	24.7	151.7	131.5	57	0	0	0	0	122.8
1366	S	26.3	Very low	28.5	Very low	78 Å²	78	118.5 Å²	118.5	55%	0.545	67%	0.668	S	S	.	*			trans	98.3	141.9	157.4	81.2	0	0	0	0	119.5
1367	S	26.2	Very low	28.6	Very low	85 Å²	85	121 Å²	121	59%	0.594	67%	0.673	S	S	*	*			trans	41.9	100.7	164.6	51.6	0	0	0	0	117.8
1368	S	25.3	Very low	28.7	Very low	106 Å²	106	122.5 Å²	122.5	74%	0.741	67%	0.671	S	S	*	*				78.6	159.6	71.1	79	0	0	0	0	115.2
1369	R	29.1	Very low	28.8	Very low	234 Å²	234	120.6 Å²	120.6	88%	0.883	68%	0.675	S	S	*	*			trans	69.6	87.3	168.2	-69.1	-175	173.6	-170.3	-1.5	117.6
1370	S	29.1	Very low	29	Very low	105 Å²	105	118.4 Å²	118.4	73%	0.734	68%	0.68	S	S	*	*				-34.8	164.8	118.1	-15.4	0	0	0	0	113.1
1371	P	33.3	Very low	29.3	Very low	107 Å²	107	115.3 Å²	115.3	70%	0.695	68%	0.684	S	S	*	*			cis	-142.3	-152.1	23.6	31.3	-4.6	0	0	0	112.9
1372	I	28.1	Very low	29.4	Very low	144 Å²	144	116.6 Å²	116.6	74%	0.738	71%	0.705	S	S	*	*			trans	69.7	109.6	164.2	-51.4	154.3	0	0	0	113.6
1373	G	29	Very low	29.4	Very low	66 Å²	66	118.2 Å²	118.2	68%	0.68	71%	0.714	S	S	*	*			cis	104.6	171.6	12.6	0	0	0	0	0	112.2
1374	K	29.8	Very low	29.5	Very low	196 Å²	196	118.7 Å²	118.7	85%	0.852	71%	0.711	S	S	*	*			trans	70.5	155.3	-177.4	-54.4	179.7	179.6	176.4	0	114.3
1375	V	28.9	Very low	29.8	Very low	126 Å²	126	115.5 Å²	115.5	76%	0.764	69%	0.687	S	S	*	*			cis	-155.8	144	-18.9	125.6	0	0	0	0	109
1376	G	30	Very low	30.2	Very low	69 Å²	69	116.2 Å²	116.2	71%	0.711	69%	0.686	S	S	*	*			trans	70.1	-172.6	161.7	0	0	0	0	0	115.7
1377	K	29.9	Very low	30.5	Very low	188 Å²	188	118.5 Å²	118.5	82%	0.817	69%	0.688	S	S	*	*			cis	-172.3	151.2	-11.2	-112.3	-176.3	175.3	-175.6	0	104.9
1378	H	29.5	Very low	30.9	Very low	150 Å²	150	120.2 Å²	120.2	69%	0.694	69%	0.686	S	S	*	*			cis	-173.5	169.5	-10.8	-144.4	-118.2	0	0	0	106.7
1379	I	29.5	Very low	31.4	Very low	165 Å²	165	121.5 Å²	121.5	85%	0.846	68%	0.68	S	S	*	*			trans	69.8	144.3	166.6	-51.7	143.2	0	0	0	113.3
1380	G	28.7	Very low	31.4	Very low	70 Å²	70	116.3 Å²	116.3	72%	0.722	67%	0.67	S	S	*	*			cis	160	163.6	0.3	0	0	0	0	0	107.7
1381	A	33.5	Very low	31.8	Very low	98 Å²	98	116.5 Å²	116.5	81%	0.81	68%	0.678	S	S	*	*			cis	-152.2	147.9	3.2	0	0	0	0	0	107.8
1382	S	30.3	Very low	31.7	Very low	105 Å²	105	122.2 Å²	122.2	73%	0.734	69%	0.685	S	S	*	*				68.8	135.1	88	-143.4	0	0	0	0	115.4
1383	T	33.4	Very low	31.8	Very low	94 Å²	94	124.7 Å²	124.7	58%	0.577	69%	0.691	S	S	*	*			cis	-135.8	-120.3	-15.5	0.9	0	0	0	0	110.3
1384	D	33.9	Very low	31.9	Very low	119 Å²	119	130.5 Å²	130.5	64%	0.636	70%	0.698	S	S	*	*			cis	-157.3	131.2	-4.5	-99	-74.2	0	0	0	106.8
1385	H	35.4	Very low	31.8	Very low	51 Å²	51	129.3 Å²	129.3	24%	0.236	70%	0.695	C	S	.	*				87.6	150.9	70.3	-69.4	18.1	0	0	0	117	V252 S253 S254	V252-H1385 WeakPolarHBondContact CG1-NE2 3.48Å; S253-H1385 WeakPolarHBondContact CB-CE1 3.4Å; S253-H1385 VanDerWaalsContact CB-NE2 3.35Å; S253-H1385 WeakPolarHBondContact CB-NE2 3.38Å; S253-H1385 PolarHBondContact O-CE1 2.68Å; S253-H1385 PolarHBondContact OG-CD2 3.44Å; S253-H1385 PolarHBondContact OG-CE1 3.1Å; S253-H1385 VanDerWaalsContact OG-CG 3.25Å; S253-H1385 PolarHBondContact OG-ND1 3.25Å; S253-H1385 VanDerWaalsContact OG-ND1 3.09Å; S253-H1385 PolarHBondContact OG-NE2 2.81Å; S254-H1385 PolarHBondContact OG-N 3.24Å; S254-H1385 PolarHBondContact OG-ND1 3.35Å
1386	H	34.8	Very low	31.7	Very low	85 Å²	85	128.7 Å²	128.7	39%	0.394	69%	0.691	S	S	.	*			cis	-99.7	-117.5	-6.5	-152.7	0.3	0	0	0	109.8	S253 S254	S253-H1386 PolarHBondContact OG-ND1 2.99Å; S254-H1386 WeakPolarHBondContact CB-O 3.13Å
1387	H	33.4	Very low	31.5	Very low	126 Å²	126	131.8 Å²	131.8	58%	0.583	69%	0.692	S	S	*	*			cis	-175.6	165.5	-20.3	-132.1	32	0	0	0	104.4
1388	H	34.6	Very low	31.3	Very low	120 Å²	120	129.7 Å²	129.7	56%	0.556	69%	0.688	S	S	*	*			cis	-174.9	157.9	-31.6	-116.8	31.9	0	0	0	107.1
1389	Q	34.6	Very low	31.1	Very low	134 Å²	134	128 Å²	128	63%	0.626	69%	0.688	S	S	*	*			cis	-156	139.8	-17.2	-146.3	-155.2	97.3	0	0	111.7
1390	N	29.5	Very low	30.9	Very low	125 Å²	125	131.5 Å²	131.5	67%	0.668	69%	0.691	S	S	*	*			trans	38.1	114.5	149.6	-67.5	-25.6	0	0	0	124.1
1391	A	37.1	Very low	31	Very low	108 Å²	108	135.8 Å²	135.8	89%	0.893	69%	0.692	S	S	*	*				-134.8	137.6	129.1	0	0	0	0	0	109.5
1392	R	30.9	Very low	30.9	Very low	227 Å²	227	135.3 Å²	135.3	86%	0.857	68%	0.681	S	S	*	*			trans	-105.9	133.4	-172.5	-77.4	175.2	166	167.9	-5.4	112.9
1393	K	30.9	Very low	30.9	Very low	197 Å²	197	131.7 Å²	131.7	86%	0.857	66%	0.66	S	S	*	*				-176.4	121.6	119.4	-100.4	158	-175.3	173.7	0	113.3
1394	K	30.6	Very low	30.9	Very low	188 Å²	188	130.7 Å²	130.7	82%	0.817	66%	0.655	S	S	*	*			trans	36.2	118.7	145.6	-57	-171.6	175.1	-166.4	0	118.9
1395	Q	28.9	Very low	30.6	Very low	171 Å²	171	131.8 Å²	131.8	80%	0.799	65%	0.654	S	S	*	*			cis	65.9	102.8	41.4	-164	-172	8.2	0	0	114.2
1396	T	26.6	Very low	30.2	Very low	112 Å²	112	131.9 Å²	131.9	69%	0.687	66%	0.661	S	S	*	*				-168.3	126.9	110.8	34.4	0	0	0	0	109.8
1397	D	24.9	Very low	29.9	Very low	134 Å²	134	134.1 Å²	134.1	72%	0.717	67%	0.674	S	S	*	*			trans	36.2	118.3	135.3	-35.8	-37.9	0	0	0	119.4
1398	I	25.9	Very low	29.6	Very low	144 Å²	144	137.6 Å²	137.6	74%	0.738	69%	0.687	S	S	*	*			trans	-121.3	101.6	157.6	-59.8	179.4	0	0	0	107.8
1399	V	25.8	Very low	29.3	Very low	116 Å²	116	140 Å²	140	70%	0.703	70%	0.696	S	S	*	*			trans	-96.3	133.7	158.2	176.4	0	0	0	0	105.9	E1401	V1399-E1401 HydrophobicContact CG1-CG 4.07Å
1400	W	25.9	Very low	29.1	Very low	238 Å²	238	140.5 Å²	140.5	90%	0.902	71%	0.708	S	S	*	*			trans	-96.6	90.3	166.7	-78.7	99.9	0	0	0	108.7
1401	E	29	Very low	28.9	Very low	160 Å²	160	140 Å²	140	75%	0.748	71%	0.706	S	S	*	*			trans	-100.3	155.1	152.2	-75.9	179.3	179.4	0	0	107.6	V1399	V1399-E1401 HydrophobicContact CG1-CG 4.07Å
1402	P	33.3	Very low	28.5	Very low	88 Å²	88	141.1 Å²	141.1	57%	0.571	70%	0.697	S	S	*	*			trans	-94.3	-180	-175.1	8.5	14.1	0	0	0	112.2	E405	E405-P1402 HydrophobicContact CB-CB 4.49Å; E405-P1402 HydrophobicContact CG-CB 3.96Å; E405-P1402 VanDerWaalsContact OE1-CB 3.28Å; E405-P1402 WeakPolarHBondContact OE1-CB 3.44Å; E405-P1402 VanDerWaalsContact OE1-CG 3.27Å; E405-P1402 WeakPolarHBondContact OE1-CG 3.41Å
1403	G	29.1	Very low	28.3	Very low	29 Å²	29	135.6 Å²	135.6	30%	0.299	68%	0.684	S	S	.	*			trans	98.2	173.5	173	0	0	0	0	0	118	T404	T404-G1403 PolarHBondContact O-N 3.23Å
1404	P	34.1	Very low	28.1	Very low	72 Å²	72	133.8 Å²	133.8	47%	0.468	67%	0.673	S	S	.	*			trans	-105	136.9	-139.9	-8.8	29.9	0	0	0	119.4	E403	E403-P1404 HydrophobicContact CB-CB 3.93Å; E403-P1404 HydrophobicContact CG-CB 3.93Å; E403-P1404 WeakPolarHBondContact O-CG 3.2Å; E403-P1404 WeakPolarHBondContact OE2-CA 3.36Å
1405	K	27.8	Very low	27.9	Very low	142 Å²	142	129.7 Å²	129.7	62%	0.617	67%	0.668	S	S	*	*				156.9	120	112.5	-88	143	-171.8	153.9	0	118.9	P401 E403	P401-K1405 HydrophobicContact CB-CG 4.49Å; P401-K1405 HydrophobicContact CG-CD 4.38Å; P401-K1405 HydrophobicContact CG-CG 3.81Å; E403-K1405 VanDerWaalsContact OE1-C 3.23Å; E403-K1405 WeakPolarHBondContact OE1-CA 3.13Å; E403-K1405 PolarHBondContact OE1-N 2.73Å; E403-K1405 PolarHBondContact OE2-N 3.27Å
1406	S	27	Very low	27.8	Very low	54 Å²	54	127.4 Å²	127.4	38%	0.378	67%	0.666	S	S	.	*				69.3	131.9	116	-60.5	0	0	0	0	124.5	P401 E403	P401-S1406 WeakPolarHBondContact CB-OG 3.21Å; E403-S1406 PolarHBondContact OE1-N 3.08Å
1407	I	27.6	Very low	28	Very low	132 Å²	132	131 Å²	131	68%	0.677	67%	0.672	S	S	*	*			trans	57.2	115.2	137	-55.1	166.3	0	0	0	120.6	K1409	I1407-K1409 HydrophobicContact CG2-CG 4.09Å
1408	K	28.5	Very low	28	Very low	198 Å²	198	131 Å²	131	86%	0.861	68%	0.676	S	S	*	*			trans	-147.4	109.9	136	-66.2	-166.9	-177.6	70.1	0	110
1409	K	27.3	Very low	28.1	Very low	170 Å²	170	129.8 Å²	129.8	74%	0.739	68%	0.681	S	S	*	*				69	90.8	76.8	-74.4	-169	174.3	-178.9	0	116.3	I1407	I1407-K1409 HydrophobicContact CG2-CG 4.09Å
1410	V	30.4	Very low	28.3	Very low	145 Å²	145	129.4 Å²	129.4	88%	0.879	68%	0.684	S	S	*	*			trans	-125.3	82.6	146.5	-179.3	0	0	0	0	106.6
1411	N	25.5	Very low	28.4	Very low	115 Å²	115	122.9 Å²	122.9	62%	0.615	67%	0.674	S	S	*	*				52.5	78.4	88.4	-81.7	14.7	0	0	0	115.9
1412	N	29.4	Very low	28.4	Very low	131 Å²	131	125.3 Å²	125.3	70%	0.701	68%	0.682	S	S	*	*				-157.9	112	122.5	-86.8	-41.7	0	0	0	108.1
1413	N	25.8	Very low	28.1	Very low	112 Å²	112	125.9 Å²	125.9	60%	0.599	69%	0.694	S	S	*	*				74	75	68.7	-68.3	-32.2	0	0	0	114.4
1414	Y	27.2	Very low	28	Very low	159 Å²	159	131.8 Å²	131.8	62%	0.624	72%	0.718	S	S	*	*			trans	-171.4	100.7	140.9	-60.4	-61.2	0	0	0	105.8	T469 S470	T469-Y1414 WeakPolarHBondContact CB-OH 3.3Å; T469-Y1414 WeakPolarHBondContact CG2-OH 3.22Å; S470-Y1414 PolarHBondContact N-OH 3.21Å
1415	S	25.9	Very low	27.5	Very low	101 Å²	101	137 Å²	137	71%	0.706	74%	0.741	S	S	*	*			cis	82.2	107.9	35	-161	0	0	0	0	114.7
1416	T	26.4	Very low	27.5	Very low	124 Å²	124	138.8 Å²	138.8	76%	0.761	75%	0.749	S	S	*	*			trans	67.3	146.4	176.3	78	0	0	0	0	115.1
1417	K	30.4	Very low	27.5	Very low	187 Å²	187	142 Å²	142	81%	0.813	77%	0.766	S	S	*	*			cis	-132.2	145.2	6.3	-56.3	168.9	-176.9	177.5	0	107.2
1418	V	26.5	Very low	27.4	Very low	133 Å²	133	141.4 Å²	141.4	81%	0.806	77%	0.771	S	S	*	*				58.1	98.2	55.6	-175.2	0	0	0	0	113.4
1419	S	28.1	Very low	27.2	Very low	120 Å²	120	139.7 Å²	139.7	84%	0.839	77%	0.766	S	S	*	*			trans	-170.6	153.1	138.9	-82.3	0	0	0	0	112.6
1420	S	28.4	Very low	27.3	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	77%	0.767	S	S	*	*			trans	-45.1	163.2	171.7	-43.5	0	0	0	0	114.6
1421	S	28	Very low	27.3	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	74%	0.741	S	S	*	*			cis	-155.8	162.3	32.2	-39.4	0	0	0	0	109.9
1422	K	29.5	Very low	27.5	Very low	211 Å²	211	129.3 Å²	129.3	92%	0.917	72%	0.723	S	S	*	*			cis	55.1	47.7	28.4	-95	-164.6	177.1	-173	0	115.3	L1424	K1422-L1424 VanDerWaalsContact C-N 3.34Å; K1422-L1424 PolarHBondContact O-N 2.73Å
1423	A	26.9	Very low	27.7	Very low	99 Å²	99	129.6 Å²	129.6	82%	0.818	71%	0.714	S	S	*	*			trans	-71.6	86.8	165.9	0	0	0	0	0	110.7
1424	L	27.2	Very low	28.1	Very low	154 Å²	154	133.7 Å²	133.7	81%	0.806	72%	0.721	S	S	*	*			trans	-150	112.5	162.9	-148.5	76.1	0	0	0	110.7	K1422	K1422-L1424 VanDerWaalsContact C-N 3.34Å; K1422-L1424 PolarHBondContact O-N 2.73Å
1425	L	24.9	Very low	28.5	Very low	180 Å²	180	130.2 Å²	130.2	94%	0.942	73%	0.725	S	S	*	*			trans	-122.6	80.8	174.4	-109.9	171.6	0	0	0	109.2
1426	K	26.3	Very low	29	Very low	181 Å²	181	130.8 Å²	130.8	79%	0.787	72%	0.72	S	S	*	*			trans	-146	110	164.8	-108.9	-171.2	176	-175.1	0	108.5
1427	T	27.6	Very low	29.7	Very low	121 Å²	121	132.4 Å²	132.4	74%	0.742	72%	0.719	S	S	*	*			trans	59.3	148.2	-179.5	45.7	0	0	0	0	113.9	E1429	T1427-E1429 HydrophobicContact CG2-CG 4.28Å
1428	P	24.6	Very low	29.9	Very low	120 Å²	120	129.6 Å²	129.6	78%	0.779	71%	0.709	S	S	*	*			cis	-82.3	159.7	39.7	33.1	-39.2	0	0	0	114.3
1429	E	25.9	Very low	30.3	Very low	162 Å²	162	131.4 Å²	131.4	76%	0.757	70%	0.702	S	S	*	*			trans	-64.4	151.5	156.4	-52.7	178.1	123.4	0	0	107.5	T1427	T1427-E1429 HydrophobicContact CG2-CG 4.28Å
1430	T	28.5	Very low	30.7	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	70%	0.699	S	S	*	*			trans	80.3	158.2	171	80.3	0	0	0	0	121.2
1431	T	30.2	Very low	31	Very low	56 Å²	56	131.6 Å²	131.6	34%	0.344	69%	0.685	S	S	.	*			cis	-151.8	-118.7	-33.3	44.1	0	0	0	0	115.3	K1031 L1032	K1031-T1431 WeakPolarHBondContact CE-O 3.38Å; K1031-T1431 WeakPolarHBondContact CG-O 3.45Å; L1032-T1431 VanDerWaalsContact C-CB 3.44Å; L1032-T1431 VanDerWaalsContact C-OG1 3.22Å; L1032-T1431 VanDerWaalsContact N-CG2 3.31Å; L1032-T1431 WeakPolarHBondContact O-CB 3.32Å; L1032-T1431 WeakPolarHBondContact O-CG2 3.35Å; L1032-T1431 PolarHBondContact O-OG1 3.1Å
1432	S	30.5	Very low	31.3	Very low	33 Å²	33	134.3 Å²	134.3	23%	0.231	69%	0.686	C	S	.	*				-99.9	178.8	-116.5	106.2	0	0	0	0	123.3	K1031 N1033	K1031-S1432 VanDerWaalsContact CE-CA 3.43Å; K1031-S1432 WeakPolarHBondContact CE-O 3.14Å; K1031-S1432 PolarHBondContact NZ-O 2.98Å; N1033-S1432 PolarHBondContact ND2-OG 3.38Å; N1033-S1432 WeakPolarHBondContact OD1-CB 3.33Å; N1033-S1432 PolarHBondContact OD1-N 2.68Å; N1033-S1432 PolarHBondContact OD1-OG 2.98Å
1433	R	33.1	Very low	31.7	Very low	137 Å²	137	131.1 Å²	131.1	52%	0.517	67%	0.674	S	S	.	*			cis	-124.5	-133.3	-25.5	-145.9	179.6	-159.6	173	5.3	111.4	K1031 L1032	K1031-R1433 HydrophobicContact CB-CG 4.27Å; K1031-R1433 VanDerWaalsContact CD-O 3.22Å; K1031-R1433 WeakPolarHBondContact CD-O 3.32Å; K1031-R1433 WeakPolarHBondContact CE-O 3.5Å; K1031-R1433 PolarHBondContact NZ-O 3.45Å; K1031-R1433 PolarHBondContact O-NE 2.96Å; L1032-R1433 HydrophobicContact CD1-CG 4.39Å; L1032-R1433 VanDerWaalsContact CD1-NE 3.32Å
1434	R	34.2	Very low	32.1	Very low	199 Å²	199	133.2 Å²	133.2	75%	0.751	67%	0.667	S	S	*	*			trans	-65.8	-176.8	178	-56.4	170.9	175.3	124	-3.9	111.2
1435	A	36.1	Very low	32.6	Very low	85 Å²	85	130.6 Å²	130.6	70%	0.702	66%	0.662	S	S	*	*			cis	-161.7	177	15.3	0	0	0	0	0	108
1436	D	36.7	Very low	33.2	Very low	113 Å²	113	126.5 Å²	126.5	60%	0.604	65%	0.648	S	S	*	*			cis	-166.1	174.7	-37.3	-84.8	-35.6	0	0	0	107.5
1437	H	39.4	Very low	33.8	Very low	158 Å²	158	129.1 Å²	129.1	73%	0.731	65%	0.653	S	S	*	*			trans	69.5	148.7	166.7	-52.2	-66.9	0	0	0	118.2
1438	H	35.5	Very low	34.3	Very low	129 Å²	129	130 Å²	130	60%	0.597	65%	0.654	S	S	*	*			cis	-162.4	164.5	-13.1	-122	-46.8	0	0	0	113
1439	Y	34.3	Very low	34.9	Very low	171 Å²	171	129 Å²	129	67%	0.671	65%	0.649	S	S	*	*			trans	62.5	112.6	150.3	-76.9	-57.9	0	0	0	119.6
1440	H	36.5	Very low	35.3	Very low	165 Å²	165	129.6 Å²	129.6	76%	0.764	65%	0.652	S	S	*	*				88.5	150.1	93.2	-103.8	16.4	0	0	0	113.8
1441	S	34.6	Very low	35.6	Very low	66 Å²	66	128.2 Å²	128.2	46%	0.462	65%	0.647	S	S	.	*			cis	-158.9	142.7	-4.6	-157.2	0	0	0	0	111.2
1442	Q	34.9	Very low	36	Very low	158 Å²	158	132.8 Å²	132.8	74%	0.738	66%	0.664	S	S	*	*			trans	58	169.6	146.3	-67.9	168.3	-37.3	0	0	118
1443	H	37.6	Very low	36.2	Very low	144 Å²	144	137.2 Å²	137.2	67%	0.667	69%	0.685	S	S	*	*			cis	-159.6	169.3	-17.6	-118.7	-151.8	0	0	0	107.9
1444	E	36.2	Very low	36.2	Very low	144 Å²	144	135.4 Å²	135.4	67%	0.673	69%	0.693	S	S	*	*			cis	-157.6	160.7	-4.4	-156	179.4	119.6	0	0	109.7
1445	S	37.4	Very low	36.3	Very low	99 Å²	99	133.5 Å²	133.5	69%	0.692	70%	0.698	S	S	*	*			trans	68.4	158.9	152	87.6	0	0	0	0	118.2
1446	S	36.8	Very low	36.2	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	70%	0.697	S	S	*	*			cis	-162.3	139.6	-31.4	49.3	0	0	0	0	109.6
1447	R	40	Very low	35.9	Very low	236 Å²	236	134.7 Å²	134.7	89%	0.891	71%	0.711	S	S	*	*				170.9	139.3	124	-92.2	162.8	-171.7	-177.3	1.5	111.2
1448	D	37.6	Very low	35.6	Very low	141 Å²	141	132.7 Å²	132.7	75%	0.754	71%	0.714	S	S	*	*			trans	-65.1	145.2	-174.2	-74.5	-81.1	0	0	0	113.6
1449	S	35.8	Very low	35.4	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	72%	0.722	S	S	*	*				63.1	132.8	78	-33	0	0	0	0	110.9
1450	E	35.2	Very low	35.3	Very low	175 Å²	175	129.6 Å²	129.6	82%	0.818	73%	0.732	S	S	*	*			cis	-133.2	149.3	21.7	-68	-179.7	124.7	0	0	110.6
1451	S	35.1	Very low	35	Very low	92 Å²	92	125.1 Å²	125.1	64%	0.643	72%	0.719	S	S	*	*				58.3	138.3	86.1	124.6	0	0	0	0	114.6
1452	H	37.5	Very low	35.1	Very low	153 Å²	153	126 Å²	126	71%	0.708	73%	0.725	S	S	*	*			cis	-159.8	158.7	8.5	-123.8	-58.4	0	0	0	110.8
1453	N	36.7	Very low	35.4	Very low	125 Å²	125	123.4 Å²	123.4	67%	0.668	72%	0.722	S	S	*	*			trans	56.4	104.2	148.9	-62.3	-10.8	0	0	0	118.7
1454	S	33.1	Very low	35.4	Very low	99 Å²	99	119.8 Å²	119.8	69%	0.692	71%	0.706	S	S	*	*				87.4	124.2	65.6	70.3	0	0	0	0	114.2
1455	D	34.7	Very low	35.5	Very low	159 Å²	159	122.1 Å²	122.1	85%	0.85	72%	0.717	S	S	*	*			trans	-157	160	140.9	-119.6	-31.9	0	0	0	113
1456	S	35	Very low	35.7	Very low	98 Å²	98	124.7 Å²	124.7	69%	0.685	72%	0.718	S	S	*	*			trans	24.3	108.7	167.3	61.8	0	0	0	0	119.5	S1458	S1456-S1458 PolarHBondContact O-N 2.7Å
1457	S	30.3	Very low	35.9	Very low	126 Å²	126	127.6 Å²	127.6	88%	0.881	73%	0.726	S	S	*	*			trans	-69.9	114.8	164.4	36.4	0	0	0	0	112.1
1458	S	32.9	Very low	36.1	Very low	116 Å²	116	124.3 Å²	124.3	81%	0.811	73%	0.726	S	S	*	*			trans	-131.3	69.3	174.9	66.1	0	0	0	0	111.5	S1456	S1456-S1458 PolarHBondContact O-N 2.7Å
1459	S	32.1	Very low	37	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	73%	0.728	S	S	*	*			trans	-111.7	105	173.8	56.7	0	0	0	0	109.9	S1461	S1459-S1461 PolarHBondContact O-N 3.01Å
1460	S	31.3	Very low	38.4	Very low	126 Å²	126	128.8 Å²	128.8	88%	0.881	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-57.8	123.5	173.5	50	0	0	0	0	111.4
1461	S	30.2	Very low	40.3	Very low	71 Å²	71	122.5 Å²	122.5	50%	0.497	71%	0.71	S	S	.	*	P	Polyproline II helix	trans	-96	125.8	163.4	51.8	0	0	0	0	110.1	T637 S1459	T637-S1461 WeakPolarHBondContact OG1-CB 3.47Å; T637-S1461 PolarHBondContact OG1-OG 2.88Å; S1459-S1461 PolarHBondContact O-N 3.01Å
1462	S	36.6	Very low	42.6	Very low	84 Å²	84	122.3 Å²	122.3	59%	0.587	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-74.1	151.3	168.7	46.7	0	0	0	0	110.3	T637	T637-S1462 PolarHBondContact N-O 2.58Å
1463	P	41.8	Very low	45.1	Very low	104 Å²	104	117.5 Å²	117.5	68%	0.675	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-62	142.6	168.5	29	-34.3	0	0	0	109.8	F638	F638-P1463 HydrophobicContact CD2-CB 4.41Å; F638-P1463 HydrophobicContact CE2-CB 4.49Å
1464	E	37.7	Very low	47.6	Very low	69 Å²	69	113.7 Å²	113.7	32%	0.322	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-79.5	163.4	166.1	-49.9	173.4	115.1	0	0	109.2	R635 S636 F638	R635-E1464 VanDerWaalsContact CA-OE1 3.31Å; R635-E1464 WeakPolarHBondContact CA-OE1 3.26Å; R635-E1464 WeakPolarHBondContact CG-OE1 3.3Å; S636-E1464 PolarHBondContact N-OE1 3.17Å; F638-E1464 HydrophobicContact CB-CB 4.03Å; F638-E1464 HydrophobicContact CB-CG 4.24Å; F638-E1464 WeakPolarHBondContact CB-OE2 3.31Å; F638-E1464 HydrophobicContact CD2-CB 4.39Å; F638-E1464 VanDerWaalsContact CD2-O 3.25Å; F638-E1464 WeakPolarHBondContact CD2-O 3.48Å; F638-E1464 WeakPolarHBondContact CE2-O 3.49Å; F638-E1464 PolarHBondContact N-OE2 3.11Å
1465	E	38.4	Very low	50.3	Low	193 Å²	193	115.9 Å²	115.9	90%	0.902	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-78.4	133.4	-178.7	-65.5	155.8	160	0	0	109.6
1466	E	41.9	Very low	52.8	Low	153 Å²	153	113.3 Å²	113.3	72%	0.715	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-78.7	146.5	169.1	-70.1	-175.4	127.8	0	0	109.4	F638	F638-E1466 HydrophobicContact CE1-CG 3.79Å; F638-E1466 VanDerWaalsContact CE1-OE1 3.3Å; F638-E1466 WeakPolarHBondContact CE1-OE1 3.31Å; F638-E1466 HydrophobicContact CE2-CG 3.87Å; F638-E1466 HydrophobicContact CZ-CG 3.33Å; F638-E1466 WeakPolarHBondContact CZ-OE1 3.46Å
1467	D	39.5	Very low	55.5	Low	154 Å²	154	109.1 Å²	109.1	82%	0.824	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-62.6	137.4	-171.7	-60.7	-88.1	0	0	0	112.5	D1469	D1467-D1469 PolarHBondContact O-N 3.27Å
1468	D	44.1	Very low	58.5	Low	166 Å²	166	103.8 Å²	103.8	89%	0.888	59%	0.592	S	S	*	*			trans	-64.9	100.1	160.9	-76.6	-54.6	0	0	0	108	E1470	D1468-E1470 PolarHBondContact O-N 3.44Å; D1468-E1470 VanDerWaalsContact O-N 3.09Å
1469	D	57	Low	61.5	Low	151 Å²	151	98.5 Å²	98.5	81%	0.807	56%	0.555	S	S	*	*			trans	-54.9	115.7	166.6	-86.4	-47.2	0	0	0	108.4	D1467 V1471	D1467-D1469 PolarHBondContact O-N 3.27Å; D1469-V1471 PolarHBondContact O-N 2.84Å
1470	E	65.1	Low	64.4	Low	182 Å²	182	97.9 Å²	97.9	85%	0.85	54%	0.542	S	S	*	.			trans	-60.2	105	177.8	-74.3	-171.7	146.1	0	0	108.7	D1468 V1472	D1468-E1470 PolarHBondContact O-N 3.44Å; D1468-E1470 VanDerWaalsContact O-N 3.09Å; E1470-V1472 WeakPolarHBondContact O-CG2 3.4Å; E1470-V1472 PolarHBondContact O-N 3.29Å
1471	V	76.3	Confident	67.4	Low	43 Å²	43	93.8 Å²	93.8	26%	0.261	51%	0.508	S	S	.	.			trans	-57.1	122.3	177.7	175	0	0	0	0	109.1	D1469 L1479 Y1562 H1563	D1469-V1471 PolarHBondContact O-N 2.84Å; V1471-L1479 HydrophobicContact CG1-CD1 3.44Å; V1471-L1479 VanDerWaalsContact CG1-CD1 3.44Å; V1471-Y1562 HydrophobicContact CG1-CE1 4.15Å; V1471-Y1562 HydrophobicContact CG2-CE1 4.3Å; V1471-H1563 HydrophobicContact CB-CB 4.3Å; V1471-H1563 HydrophobicContact CG1-CB 4.07Å
1472	V	83.4	Confident	70.4	Confident	88 Å²	88	94 Å²	94	53%	0.533	51%	0.509	S	S	.	.			trans	-107.7	124.6	-173	-166.6	0	0	0	0	110.6	E1470 I1480	E1470-V1472 WeakPolarHBondContact O-CG2 3.4Å; E1470-V1472 PolarHBondContact O-N 3.29Å; V1472-I1480 HydrophobicContact CB-CD1 4.2Å; V1472-I1480 HydrophobicContact CG1-CD1 3.9Å; V1472-I1480 VanDerWaalsContact O-CB 3.27Å; V1472-I1480 WeakPolarHBondContact O-CB 3.2Å; V1472-I1480 VanDerWaalsContact O-CG1 3.31Å; V1472-I1480 WeakPolarHBondContact O-CG1 3.37Å; V1472-I1480 PolarHBondContact O-N 3.39Å; V1472-I1480 VanDerWaalsContact O-N 3.09Å
1473	D	89.3	Confident	73.2	Confident	53 Å²	53	95.8 Å²	95.8	28%	0.283	51%	0.511	S	S	.	.	B	Isolated β-bridge	trans	-87.6	146.9	169.8	-56.4	19.7	0	0	0	109.5	H1478 N1524 H1565	D1473-H1478 CarbonylContact C-O 3.36Å; D1473-H1478 WeakPolarHBondContact CA-O 3.23Å; D1473-N1524 WeakPolarHBondContact OD2-CB 3.43Å; D1473-N1524 PolarHBondContact OD2-ND2 2.92Å; D1473-H1565 IonicContact OD1-NE2 2.95Å; D1473-H1565 PolarHBondContact OD1-NE2 3.42Å; D1473-H1565 IonicContact OD2-CE1 2.67Å; D1473-H1565 IonicContact OD2-NE2 3.16Å
1474	D	89.8	Confident	75.7	Confident	44 Å²	44	92.9 Å²	92.9	24%	0.235	50%	0.5	C	S	.	.			trans	-75.6	172	166.8	69	29.5	0	0	0	112.1	D1476 G1477 H1478 I1480 K1504	D1474-D1476 PolarHBondContact O-N 2.85Å; D1474-D1476 VanDerWaalsContact O-N 3.11Å; D1474-D1476 PolarHBondContact OD1-N 2.86Å; D1474-G1477 PolarHBondContact O-N 3.4Å; D1474-G1477 PolarHBondContact OD1-N 2.65Å; D1474-G1477 VanDerWaalsContact OD1-N 3.12Å; D1474-H1478 PolarHBondContact N-O 2.88Å; D1474-H1478 IonicContact OD1-CD2 2.69Å; D1474-H1478 PolarHBondContact OD1-CD2 3.24Å; D1474-H1478 IonicContact OD1-CG 3.83Å; D1474-H1478 PolarHBondContact OD1-N 3.11Å; D1474-H1478 WeakPolarHBondContact OD2-CB 3.39Å; D1474-H1478 IonicContact OD2-CD2 3.48Å; D1474-H1478 PolarHBondContact OD2-CD2 2.67Å; D1474-H1478 IonicContact OD2-CG 3.49Å; D1474-I1480 HydrophobicContact CB-CD1 4.21Å; D1474-I1480 HydrophobicContact CB-CG1 4.08Å; D1474-K1504 IonicContact OD2-NZ 3.73Å; D1474-K1504 PolarHBondContact OD2-NZ 3.45Å; D1474-K1504 VanDerWaalsContact OD2-NZ 3.17Å
1475	V	88.7	Confident	78.4	Confident	145 Å²	145	92.7 Å²	92.7	88%	0.879	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-18.7	-175	-65.4	0	0	0	0	114
1476	D	88.3	Confident	81.1	Confident	106 Å²	106	89.1 Å²	89.1	57%	0.567	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	9.4	176.7	-60.1	-65.2	0	0	0	111.8	D1474 K1523	D1474-D1476 PolarHBondContact O-N 2.85Å; D1474-D1476 VanDerWaalsContact O-N 3.11Å; D1474-D1476 PolarHBondContact OD1-N 2.86Å; D1476-K1523 WeakPolarHBondContact O-CD 3.34Å; D1476-K1523 PolarHBondContact O-NZ 3Å
1477	G	91.6	Very high	83.6	Confident	9 Å²	9	82.1 Å²	82.1	9%	0.093	45%	0.447	C	S	.	.	S	Bend	trans	78.8	18	173.3	0	0	0	0	0	115.6	D1474 K1523 N1524 H1565	D1474-G1477 PolarHBondContact O-N 3.4Å; D1474-G1477 PolarHBondContact OD1-N 2.65Å; D1474-G1477 VanDerWaalsContact OD1-N 3.12Å; G1477-K1523 CarbonylContact O-C 3.58Å; G1477-K1523 WeakPolarHBondContact O-CA 3.36Å; G1477-K1523 WeakPolarHBondContact O-CB 3.48Å; G1477-N1524 PolarHBondContact O-N 2.81Å; G1477-H1565 PolarHBondContact O-CE1 2.7Å
1478	H	93.2	Very high	86.1	Confident	14 Å²	14	79.5 Å²	79.5	7%	0.065	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-80.6	150	168.2	-52.6	-107.9	0	0	0	111	D1473 D1474 I1480 E1499 K1504 K1523	D1473-H1478 CarbonylContact C-O 3.36Å; D1473-H1478 WeakPolarHBondContact CA-O 3.23Å; D1474-H1478 PolarHBondContact N-O 2.88Å; D1474-H1478 IonicContact OD1-CD2 2.69Å; D1474-H1478 PolarHBondContact OD1-CD2 3.24Å; D1474-H1478 IonicContact OD1-CG 3.83Å; D1474-H1478 PolarHBondContact OD1-N 3.11Å; D1474-H1478 WeakPolarHBondContact OD2-CB 3.39Å; D1474-H1478 IonicContact OD2-CD2 3.48Å; D1474-H1478 PolarHBondContact OD2-CD2 2.67Å; D1474-H1478 IonicContact OD2-CG 3.49Å; H1478-I1480 PolarHBondContact O-N 3.09Å; H1478-E1499 IonicContact CE1-OE1 3.61Å; H1478-E1499 PolarHBondContact CE1-OE1 2.66Å; H1478-E1499 VanDerWaalsContact CE1-OE1 3.24Å; H1478-E1499 IonicContact ND1-OE1 3.8Å; H1478-E1499 IonicContact NE2-OE1 2.74Å; H1478-K1504 HydrophobicContact CB-CD 4Å; H1478-K1504 WeakPolarHBondContact ND1-CE 3.41Å; H1478-K1523 PolarHBondContact CD2-NZ 2.82Å; H1478-K1523 WeakPolarHBondContact NE2-CE 3.44Å; H1478-K1523 PolarHBondContact NE2-NZ 3.17Å
1479	L	94.4	Very high	88.4	Confident	6 Å²	6	77.5 Å²	77.5	3%	0.031	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-60.9	128.5	166	-179.2	60.4	0	0	0	110	V1471 Y1481 L1487 I1521 Y1562 H1565	V1471-L1479 HydrophobicContact CG1-CD1 3.44Å; V1471-L1479 VanDerWaalsContact CG1-CD1 3.44Å; L1479-Y1481 WeakPolarHBondContact O-CD1 3.3Å; L1479-L1487 HydrophobicContact CD2-CD1 4.29Å; L1479-L1487 HydrophobicContact CD2-CD2 3.9Å; L1479-I1521 HydrophobicContact CB-CG2 4Å; L1479-I1521 HydrophobicContact CD2-CD1 4.45Å; L1479-I1521 HydrophobicContact CD2-CG2 4.1Å; L1479-Y1562 HydrophobicContact CD1-CD1 4.4Å; L1479-Y1562 HydrophobicContact CD1-CE1 4.04Å; L1479-Y1562 HydrophobicContact CD2-CD1 3.92Å; L1479-Y1562 HydrophobicContact CD2-CE1 3.93Å; L1479-H1565 PolarHBondContact N-CE1 2.97Å
1480	I	93.8	Very high	90.2	Very high	95 Å²	95	72.5 Å²	72.5	49%	0.487	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-81.2	125	167.4	-58.5	177.7	0	0	0	108.3	V1472 D1474 H1478	V1472-I1480 HydrophobicContact CB-CD1 4.2Å; V1472-I1480 HydrophobicContact CG1-CD1 3.9Å; V1472-I1480 VanDerWaalsContact O-CB 3.27Å; V1472-I1480 WeakPolarHBondContact O-CB 3.2Å; V1472-I1480 VanDerWaalsContact O-CG1 3.31Å; V1472-I1480 WeakPolarHBondContact O-CG1 3.37Å; V1472-I1480 PolarHBondContact O-N 3.39Å; V1472-I1480 VanDerWaalsContact O-N 3.09Å; D1474-I1480 HydrophobicContact CB-CD1 4.21Å; D1474-I1480 HydrophobicContact CB-CG1 4.08Å; H1478-I1480 PolarHBondContact O-N 3.09Å
1481	Y	93.8	Very high	91.8	Very high	40 Å²	40	63.9 Å²	63.9	16%	0.157	35%	0.351	C	S	.	.			trans	-144.3	160.7	177.9	65.7	-96.6	0	0	0	111.3	L1479 D1485 I1493 T1496 K1504 V1506	L1479-Y1481 WeakPolarHBondContact O-CD1 3.3Å; Y1481-D1485 WeakPolarHBondContact CA-OD2 3.29Å; Y1481-I1493 HydrophobicContact CD1-CD1 4.42Å; Y1481-I1493 HydrophobicContact CD2-CD1 3.64Å; Y1481-I1493 HydrophobicContact CD2-CG2 3.92Å; Y1481-I1493 HydrophobicContact CE2-CD1 4.4Å; Y1481-I1493 HydrophobicContact CE2-CG2 3.98Å; Y1481-I1493 HydrophobicContact CG-CD1 3.68Å; Y1481-T1496 WeakPolarHBondContact OH-CG2 3.28Å; Y1481-T1496 PolarHBondContact OH-OG1 3.09Å; Y1481-K1504 HydrophobicContact CE1-CB 4.16Å; Y1481-K1504 HydrophobicContact CE1-CD 3.82Å; Y1481-V1506 HydrophobicContact CE1-CG1 4.06Å; Y1481-V1506 HydrophobicContact CE2-CG1 3.72Å; Y1481-V1506 VanDerWaalsContact OH-CG1 3.22Å; Y1481-V1506 WeakPolarHBondContact OH-CG1 3.3Å
1482	S	93.4	Very high	92.8	Very high	76 Å²	76	64 Å²	64	53%	0.531	35%	0.349	S	S	.	.			trans	-115.5	163.7	171	-61.9	0	0	0	0	111.6	G1484 D1485	S1482-G1484 PolarHBondContact O-N 2.86Å; S1482-D1485 WeakPolarHBondContact CB-OD1 3.44Å; S1482-D1485 PolarHBondContact N-OD2 2.6Å; S1482-D1485 WeakPolarHBondContact O-CB 3.47Å; S1482-D1485 VanDerWaalsContact O-CG 3.31Å; S1482-D1485 PolarHBondContact O-N 3.2Å
1483	I	95.4	Very high	93.5	Very high	121 Å²	121	59.9 Å²	59.9	62%	0.621	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	125.1	170.6	-66.8	172.8	0	0	0	108.7	V1494	I1483-V1494 VanDerWaalsContact CG2-O 3.27Å; I1483-V1494 WeakPolarHBondContact CG2-O 3.28Å
1484	G	94.6	Very high	93.8	Very high	43 Å²	43	59.6 Å²	59.6	44%	0.443	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.9	-16.3	-172.6	0	0	0	0	0	114.3	S1482 I1493	S1482-G1484 PolarHBondContact O-N 2.86Å; G1484-I1493 PolarHBondContact N-O 3.29Å
1485	D	95	Very high	94.1	Very high	65 Å²	65	61.9 Å²	61.9	35%	0.348	33%	0.331	S	S	.	.			trans	-66.8	149.4	-178	-65.8	5	0	0	0	111.7	Y1481 S1482 E1492 I1493	Y1481-D1485 WeakPolarHBondContact CA-OD2 3.29Å; S1482-D1485 WeakPolarHBondContact CB-OD1 3.44Å; S1482-D1485 PolarHBondContact N-OD2 2.6Å; S1482-D1485 WeakPolarHBondContact O-CB 3.47Å; S1482-D1485 VanDerWaalsContact O-CG 3.31Å; S1482-D1485 PolarHBondContact O-N 3.2Å; D1485-E1492 CarbonylContact O-C 3.38Å; D1485-E1492 WeakPolarHBondContact O-CA 3.44Å; D1485-I1493 HydrophobicContact CB-CD1 4.39Å; D1485-I1493 PolarHBondContact O-N 3.48Å
1486	R	94.5	Very high	94.4	Very high	117 Å²	117	58 Å²	58	44%	0.442	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	94.2	-171.9	-71.7	-173.3	170.4	-171.3	1.6	113.6	L1488 N1489 Y1491 E1492 H1511	R1486-L1488 PolarHBondContact O-N 3.3Å; R1486-N1489 PolarHBondContact O-N 3.29Å; R1486-Y1491 WeakPolarHBondContact CA-O 3.46Å; R1486-E1492 HydrophobicContact CG-CB 3.95Å; R1486-E1492 HydrophobicContact CG-CG 4.17Å; R1486-E1492 IonicContact CZ-OE2 3.49Å; R1486-E1492 IonicContact NE-OE2 3.54Å; R1486-E1492 PolarHBondContact NE-OE2 3.16Å; R1486-E1492 IonicContact NH2-OE2 3.87Å; R1486-E1492 PolarHBondContact NH2-OE2 3.04Å; R1486-H1511 PolarHBondContact NH2-CE1 2.9Å; R1486-H1511 PolarHBondContact NH2-NE2 3.12Å
1487	L	94.2	Very high	94.7	Very high	7 Å²	7	56.4 Å²	56.4	4%	0.037	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	130.7	175.1	-51.1	-178.7	0	0	0	110.1	L1479 N1489 R1490 Y1491 I1493 L1519 I1521 Y1562	L1479-L1487 HydrophobicContact CD2-CD1 4.29Å; L1479-L1487 HydrophobicContact CD2-CD2 3.9Å; L1487-N1489 PolarHBondContact O-N 3.1Å; L1487-R1490 PolarHBondContact O-N 2.72Å; L1487-Y1491 PolarHBondContact N-O 2.87Å; L1487-Y1491 PolarHBondContact O-N 3.2Å; L1487-I1493 HydrophobicContact CD1-CD1 4.27Å; L1487-I1493 HydrophobicContact CG-CD1 4.28Å; L1487-L1519 HydrophobicContact CD1-CD2 3.76Å; L1487-I1521 HydrophobicContact CD1-CD1 3.78Å; L1487-I1521 HydrophobicContact CD1-CG1 4.44Å; L1487-Y1562 HydrophobicContact CD2-CD1 4.16Å; L1487-Y1562 HydrophobicContact CD2-CE1 3.68Å; L1487-Y1562 HydrophobicContact CD2-CE2 4.44Å
1488	L	93	Very high	94.6	Very high	98 Å²	98	57.5 Å²	57.5	51%	0.513	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	24.9	-173.5	-58.1	178.7	0	0	0	114.7	R1486 R1490 F1560 Y1562	R1486-L1488 PolarHBondContact O-N 3.3Å; L1488-R1490 PolarHBondContact O-N 3.37Å; L1488-F1560 HydrophobicContact CD1-CB 4.13Å; L1488-F1560 HydrophobicContact CD1-CD1 4.26Å; L1488-F1560 HydrophobicContact CD1-CD2 3.48Å; L1488-F1560 VanDerWaalsContact CD1-CD2 3.48Å; L1488-F1560 HydrophobicContact CD1-CE2 3.85Å; L1488-F1560 HydrophobicContact CD1-CG 3.7Å; L1488-F1560 HydrophobicContact CD1-CZ 4.39Å; L1488-F1560 HydrophobicContact CG-CD2 4.17Å; L1488-F1560 HydrophobicContact CG-CE2 4.19Å; L1488-Y1562 HydrophobicContact CD2-CD2 3.94Å; L1488-Y1562 HydrophobicContact CD2-CE2 4.39Å; L1488-Y1562 HydrophobicContact CG-CD2 4.27Å
1489	N	91.1	Very high	94.5	Very high	124 Å²	124	62.5 Å²	62.5	66%	0.663	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	23.5	-170.3	-161.9	15.5	0	0	0	114.3	R1486 L1487	R1486-N1489 PolarHBondContact O-N 3.29Å; L1487-N1489 PolarHBondContact O-N 3.1Å
1490	R	96.1	Very high	94.1	Very high	46 Å²	46	63.6 Å²	63.6	17%	0.174	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	-41.9	-176.9	173.3	173.3	174.8	-154.9	-13	112.6	L1487 L1488 D1510 H1511 V1512 D1558	L1487-R1490 PolarHBondContact O-N 2.72Å; L1488-R1490 PolarHBondContact O-N 3.37Å; R1490-D1510 WeakPolarHBondContact CG-OD1 3.45Å; R1490-D1510 IonicContact CZ-OD1 3.07Å; R1490-D1510 IonicContact CZ-OD2 2.67Å; R1490-D1510 IonicContact NE-OD1 3.97Å; R1490-D1510 PolarHBondContact NE-OD1 2.79Å; R1490-D1510 IonicContact NE-OD2 2.86Å; R1490-D1510 PolarHBondContact NE-OD2 2.87Å; R1490-D1510 IonicContact NH2-OD1 2.74Å; R1490-D1510 IonicContact NH2-OD2 3.99Å; R1490-D1510 PolarHBondContact NH2-OD2 3.2Å; R1490-H1511 PolarHBondContact O-CD2 3.35Å; R1490-H1511 PolarHBondContact O-N 2.85Å; R1490-V1512 HydrophobicContact CG-CB 4.26Å; R1490-V1512 HydrophobicContact CG-CG2 3.83Å; R1490-D1558 IonicContact CZ-OD2 3.84Å; R1490-D1558 IonicContact NH1-OD2 3.34Å; R1490-D1558 PolarHBondContact NH1-OD2 3.29Å; R1490-D1558 IonicContact NH2-OD2 2.79Å; R1490-D1558 PolarHBondContact NH2-OD2 3.14Å
1491	Y	97.3	Very high	93.8	Very high	1 Å²	1	63.6 Å²	63.6	0%	0.004	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	98.5	-171.5	-61.7	-65.5	0	0	0	110.1	R1486 L1487 D1510 I1517 D1558 F1560	R1486-Y1491 WeakPolarHBondContact CA-O 3.46Å; L1487-Y1491 PolarHBondContact N-O 2.87Å; L1487-Y1491 PolarHBondContact O-N 3.2Å; Y1491-D1510 HydrophobicContact CD1-CB 3.97Å; Y1491-D1510 HydrophobicContact CE1-CB 3.87Å; Y1491-I1517 HydrophobicContact CD1-CD1 3.56Å; Y1491-I1517 HydrophobicContact CD1-CG1 4.45Å; Y1491-I1517 HydrophobicContact CE1-CD1 3.48Å; Y1491-I1517 VanDerWaalsContact CE1-CD1 3.48Å; Y1491-D1558 WeakPolarHBondContact OH-CB 3.49Å; Y1491-D1558 PolarHBondContact OH-OD2 2.78Å; Y1491-F1560 AromaticContact CD2-CE1 3.69Å; Y1491-F1560 HydrophobicContact CD2-CE1 3.69Å; Y1491-F1560 AromaticContact CD2-CZ 3.65Å; Y1491-F1560 HydrophobicContact CD2-CZ 3.65Å; Y1491-F1560 HydrophobicContact CE2-CD1 4.02Å; Y1491-F1560 AromaticContact CE2-CE1 3.26Å; Y1491-F1560 HydrophobicContact CE2-CE1 3.26Å; Y1491-F1560 AromaticContact CE2-CZ 3.74Å; Y1491-F1560 HydrophobicContact CE2-CZ 3.74Å
1492	E	97.5	Very high	93.6	Very high	47 Å²	47	64 Å²	64	22%	0.22	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	117.3	-180	-178.8	177	106.8	0	0	110.8	D1485 R1486 V1494 C1508 K1509 H1511	D1485-E1492 CarbonylContact O-C 3.38Å; D1485-E1492 WeakPolarHBondContact O-CA 3.44Å; R1486-E1492 HydrophobicContact CG-CB 3.95Å; R1486-E1492 HydrophobicContact CG-CG 4.17Å; R1486-E1492 IonicContact CZ-OE2 3.49Å; R1486-E1492 IonicContact NE-OE2 3.54Å; R1486-E1492 PolarHBondContact NE-OE2 3.16Å; R1486-E1492 IonicContact NH2-OE2 3.87Å; R1486-E1492 PolarHBondContact NH2-OE2 3.04Å; E1492-V1494 PolarHBondContact O-N 2.93Å; E1492-C1508 CarbonylContact O-C 3.58Å; E1492-C1508 VanDerWaalsContact O-CA 3.23Å; E1492-C1508 WeakPolarHBondContact O-CA 3.34Å; E1492-K1509 HydrophobicContact CB-CB 4.39Å; E1492-K1509 PolarHBondContact N-O 2.68Å; E1492-K1509 PolarHBondContact O-N 3.05Å; E1492-H1511 VanDerWaalsContact CB-NE2 3.34Å; E1492-H1511 WeakPolarHBondContact CB-NE2 3.31Å; E1492-H1511 VanDerWaalsContact CD-NE2 3.33Å; E1492-H1511 IonicContact OE1-NE2 3.57Å; E1492-H1511 IonicContact OE2-CD2 3.05Å; E1492-H1511 IonicContact OE2-CE1 2.71Å; E1492-H1511 PolarHBondContact OE2-CE1 2.77Å; E1492-H1511 IonicContact OE2-NE2 2.73Å; E1492-H1511 PolarHBondContact OE2-NE2 2.78Å
1493	I	97.7	Very high	93.5	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	117.1	-176.3	-61.4	178.5	0	0	0	110	Y1481 G1484 D1485 L1487 V1506	Y1481-I1493 HydrophobicContact CD1-CD1 4.42Å; Y1481-I1493 HydrophobicContact CD2-CD1 3.64Å; Y1481-I1493 HydrophobicContact CD2-CG2 3.92Å; Y1481-I1493 HydrophobicContact CE2-CD1 4.4Å; Y1481-I1493 HydrophobicContact CE2-CG2 3.98Å; Y1481-I1493 HydrophobicContact CG-CD1 3.68Å; G1484-I1493 PolarHBondContact N-O 3.29Å; D1485-I1493 HydrophobicContact CB-CD1 4.39Å; D1485-I1493 PolarHBondContact O-N 3.48Å; L1487-I1493 HydrophobicContact CD1-CD1 4.27Å; L1487-I1493 HydrophobicContact CG-CD1 4.28Å; I1493-V1506 HydrophobicContact CG1-CG2 4.32Å; I1493-V1506 HydrophobicContact CG2-CB 4.15Å; I1493-V1506 HydrophobicContact CG2-CG1 4.16Å
1494	V	97.2	Very high	93.5	Very high	47 Å²	47	56 Å²	56	29%	0.285	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-43.2	-177	-174.9	0	0	0	0	111.9	I1483 E1492 E1507 K1509	I1483-V1494 VanDerWaalsContact CG2-O 3.27Å; I1483-V1494 WeakPolarHBondContact CG2-O 3.28Å; E1492-V1494 PolarHBondContact O-N 2.93Å; V1494-E1507 HydrophobicContact CB-CB 4.48Å; V1494-E1507 HydrophobicContact CB-CG 4.16Å; V1494-E1507 HydrophobicContact CG2-CG 4.49Å; V1494-E1507 PolarHBondContact N-O 2.81Å; V1494-K1509 HydrophobicContact CG2-CB 4.29Å
1495	K	96.2	Very high	93.6	Very high	91 Å²	91	55.4 Å²	55.4	40%	0.396	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	158.3	173.1	66.6	171.9	-159.9	-79.5	0	111	V1506 E1507	K1495-V1506 CarbonylContact O-C 3.13Å; K1495-V1506 WeakPolarHBondContact O-CA 3.14Å; K1495-E1507 HydrophobicContact CG-CB 3.96Å; K1495-E1507 IonicContact NZ-OE2 3.36Å; K1495-E1507 PolarHBondContact NZ-OE2 3.02Å; K1495-E1507 PolarHBondContact O-N 3.36Å
1496	T	95.3	Very high	93.7	Very high	63 Å²	63	52.3 Å²	52.3	39%	0.387	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	135.7	163	-45.1	0	0	0	0	109.5	Y1481	Y1481-T1496 WeakPolarHBondContact OH-CG2 3.28Å; Y1481-T1496 PolarHBondContact OH-OG1 3.09Å
1497	L	93.8	Very high	93.8	Very high	74 Å²	74	47.3 Å²	47.3	39%	0.387	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-34.3	174.7	-73.3	168.8	0	0	0	111.6	V1505 E1507 A1518 I1572	L1497-V1505 HydrophobicContact CB-CB 4.44Å; L1497-V1505 HydrophobicContact CB-CG1 4.2Å; L1497-V1505 HydrophobicContact CD1-CG1 4.25Å; L1497-V1505 PolarHBondContact N-O 3.34Å; L1497-E1507 HydrophobicContact CD1-CB 3.98Å; L1497-E1507 HydrophobicContact CD2-CB 4.28Å; L1497-E1507 HydrophobicContact CG-CB 4Å; L1497-A1518 HydrophobicContact CD1-CB 3.82Å; L1497-I1572 HydrophobicContact CD1-CD1 4.45Å
1498	G	89.9	Confident	94	Very high	31 Å²	31	47 Å²	47	32%	0.32	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.3	171.9	177.9	0	0	0	0	0	112.3	V1505	G1498-V1505 PolarHBondContact N-O 2.86Å; G1498-V1505 PolarHBondContact O-N 3.35Å
1499	E	91	Very high	94.2	Very high	119 Å²	119	45.7 Å²	45.7	56%	0.556	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-144.5	147.6	-179.5	-177.3	159	176.4	0	0	109.3	H1478 K1504	H1478-E1499 IonicContact CE1-OE1 3.61Å; H1478-E1499 PolarHBondContact CE1-OE1 2.66Å; H1478-E1499 VanDerWaalsContact CE1-OE1 3.24Å; H1478-E1499 IonicContact ND1-OE1 3.8Å; H1478-E1499 IonicContact NE2-OE1 2.74Å; E1499-K1504 HydrophobicContact CB-CG 4.26Å; E1499-K1504 HydrophobicContact CG-CG 3.77Å; E1499-K1504 WeakPolarHBondContact OE1-CE 3.45Å; E1499-K1504 IonicContact OE1-NZ 2.67Å; E1499-K1504 WeakPolarHBondContact OE2-CE 3.48Å
1500	G	86.5	Confident	94.5	Very high	29 Å²	29	39.9 Å²	39.9	30%	0.299	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	-178.6	-177.3	0	0	0	0	0	112.3	F1502 G1503	G1500-F1502 PolarHBondContact O-N 2.93Å; G1500-F1502 VanDerWaalsContact O-N 3.12Å; G1500-G1503 PolarHBondContact N-O 2.76Å; G1500-G1503 PolarHBondContact O-N 3.26Å
1501	T	86.6	Confident	94.4	Very high	95 Å²	95	40.8 Å²	40.8	58%	0.583	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.7	-174.3	53.6	0	0	0	0	113.5	K1523 Y1528	T1501-K1523 VanDerWaalsContact O-CD 3.29Å; T1501-K1523 WeakPolarHBondContact O-CD 3.35Å; T1501-K1523 WeakPolarHBondContact O-CE 3.46Å; T1501-Y1528 WeakPolarHBondContact O-CE1 3.03Å; T1501-Y1528 WeakPolarHBondContact O-CE2 3.17Å; T1501-Y1528 PolarHBondContact O-OH 3.2Å
1502	F	88.6	Confident	94.3	Very high	49 Å²	49	46 Å²	46	22%	0.215	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-22.6	177.3	60.7	-103.3	0	0	0	114.6	G1500 V1505 K1520 I1522 K1523 Y1528	G1500-F1502 PolarHBondContact O-N 2.93Å; G1500-F1502 VanDerWaalsContact O-N 3.12Å; F1502-V1505 HydrophobicContact CE2-CG2 3.89Å; F1502-V1505 HydrophobicContact CZ-CG2 3.91Å; F1502-K1520 HydrophobicContact CD2-CD 4.45Å; F1502-K1520 HydrophobicContact CD2-CG 4.05Å; F1502-K1520 HydrophobicContact CE2-CD 4.2Å; F1502-K1520 HydrophobicContact CE2-CG 3.64Å; F1502-K1520 HydrophobicContact CZ-CG 4.35Å; F1502-I1522 HydrophobicContact CB-CD1 4.21Å; F1502-I1522 HydrophobicContact CD2-CD1 3.91Å; F1502-I1522 HydrophobicContact CG-CD1 4.38Å; F1502-I1522 CarbonylContact O-C 3.31Å; F1502-I1522 WeakPolarHBondContact O-CA 3.29Å; F1502-K1523 PolarHBondContact O-N 3.07Å; F1502-Y1528 HydrophobicContact CB-CD1 4.36Å
1503	G	92.8	Very high	94	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.1	-154.2	-166.4	0	0	0	0	0	114.9	G1500 I1521	G1500-G1503 PolarHBondContact N-O 2.76Å; G1500-G1503 PolarHBondContact O-N 3.26Å; G1503-I1521 CarbonylContact C-O 3.56Å; G1503-I1521 WeakPolarHBondContact CA-O 3.35Å
1504	K	94.9	Very high	93.8	Very high	28 Å²	28	53.9 Å²	53.9	12%	0.122	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	139.6	-174.2	-74.9	160.1	-175.6	162	0	110	D1474 H1478 Y1481 E1499 I1521	D1474-K1504 IonicContact OD2-NZ 3.73Å; D1474-K1504 PolarHBondContact OD2-NZ 3.45Å; D1474-K1504 VanDerWaalsContact OD2-NZ 3.17Å; H1478-K1504 HydrophobicContact CB-CD 4Å; H1478-K1504 WeakPolarHBondContact ND1-CE 3.41Å; Y1481-K1504 HydrophobicContact CE1-CB 4.16Å; Y1481-K1504 HydrophobicContact CE1-CD 3.82Å; E1499-K1504 HydrophobicContact CB-CG 4.26Å; E1499-K1504 HydrophobicContact CG-CG 3.77Å; E1499-K1504 WeakPolarHBondContact OE1-CE 3.45Å; E1499-K1504 IonicContact OE1-NZ 2.67Å; E1499-K1504 WeakPolarHBondContact OE2-CE 3.48Å; K1504-I1521 PolarHBondContact N-O 3.5Å; K1504-I1521 PolarHBondContact O-N 2.81Å
1505	V	96.1	Very high	93.7	Very high	32 Å²	32	55.3 Å²	55.3	19%	0.194	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127.3	172.6	-172.2	0	0	0	0	108.5	L1497 G1498 F1502 A1518 L1519 K1520	L1497-V1505 HydrophobicContact CB-CB 4.44Å; L1497-V1505 HydrophobicContact CB-CG1 4.2Å; L1497-V1505 HydrophobicContact CD1-CG1 4.25Å; L1497-V1505 PolarHBondContact N-O 3.34Å; G1498-V1505 PolarHBondContact N-O 2.86Å; G1498-V1505 PolarHBondContact O-N 3.35Å; F1502-V1505 HydrophobicContact CE2-CG2 3.89Å; F1502-V1505 HydrophobicContact CZ-CG2 3.91Å; V1505-A1518 HydrophobicContact CG1-CB 4.34Å; V1505-L1519 WeakPolarHBondContact CA-O 3.23Å; V1505-K1520 HydrophobicContact CG2-CB 4.45Å; V1505-K1520 HydrophobicContact CG2-CG 4.22Å
1506	V	97.2	Very high	93.7	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.6	-179.7	-62.7	0	0	0	0	111.6	Y1481 I1493 K1495 C1508 A1518 L1519 I1521	Y1481-V1506 HydrophobicContact CE1-CG1 4.06Å; Y1481-V1506 HydrophobicContact CE2-CG1 3.72Å; Y1481-V1506 VanDerWaalsContact OH-CG1 3.22Å; Y1481-V1506 WeakPolarHBondContact OH-CG1 3.3Å; I1493-V1506 HydrophobicContact CG1-CG2 4.32Å; I1493-V1506 HydrophobicContact CG2-CB 4.15Å; I1493-V1506 HydrophobicContact CG2-CG1 4.16Å; K1495-V1506 CarbonylContact O-C 3.13Å; K1495-V1506 WeakPolarHBondContact O-CA 3.14Å; V1506-C1508 VanDerWaalsContact CG2-SG 3.56Å; V1506-A1518 CarbonylContact O-C 3.57Å; V1506-A1518 WeakPolarHBondContact O-CA 3.32Å; V1506-L1519 HydrophobicContact CG2-CB 3.89Å; V1506-L1519 HydrophobicContact CG2-CD2 4.33Å; V1506-L1519 PolarHBondContact N-O 3.38Å; V1506-L1519 PolarHBondContact O-N 3.04Å; V1506-I1521 HydrophobicContact CG1-CD1 4.39Å; V1506-I1521 HydrophobicContact CG2-CD1 3.79Å; V1506-I1521 HydrophobicContact CG2-CG1 4.42Å
1507	E	97.7	Very high	93.8	Very high	12 Å²	12	54.8 Å²	54.8	6%	0.056	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	121.8	162	175.8	175.2	-167.6	0	0	108.3	V1494 K1495 L1497 R1516 I1517 I1572	V1494-E1507 HydrophobicContact CB-CB 4.48Å; V1494-E1507 HydrophobicContact CB-CG 4.16Å; V1494-E1507 HydrophobicContact CG2-CG 4.49Å; V1494-E1507 PolarHBondContact N-O 2.81Å; K1495-E1507 HydrophobicContact CG-CB 3.96Å; K1495-E1507 IonicContact NZ-OE2 3.36Å; K1495-E1507 PolarHBondContact NZ-OE2 3.02Å; K1495-E1507 PolarHBondContact O-N 3.36Å; L1497-E1507 HydrophobicContact CD1-CB 3.98Å; L1497-E1507 HydrophobicContact CD2-CB 4.28Å; L1497-E1507 HydrophobicContact CG-CB 4Å; E1507-R1516 VanDerWaalsContact OE1-CD 3.25Å; E1507-R1516 WeakPolarHBondContact OE1-CD 3.34Å; E1507-R1516 IonicContact OE1-CZ 3.14Å; E1507-R1516 IonicContact OE1-NE 3.18Å; E1507-R1516 IonicContact OE1-NH1 3.63Å; E1507-R1516 PolarHBondContact OE1-NH1 2.99Å; E1507-R1516 IonicContact OE2-NH1 2.6Å; E1507-I1517 WeakPolarHBondContact CA-O 3.1Å; E1507-I1572 HydrophobicContact CB-CD1 4.25Å; E1507-I1572 HydrophobicContact CG-CD1 3.79Å
1508	C	97.9	Very high	94	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	146.7	173.5	-75.9	0	0	0	0	111.5	E1492 V1506 R1516 I1517	E1492-C1508 CarbonylContact O-C 3.58Å; E1492-C1508 VanDerWaalsContact O-CA 3.23Å; E1492-C1508 WeakPolarHBondContact O-CA 3.34Å; V1506-C1508 VanDerWaalsContact CG2-SG 3.56Å; C1508-R1516 CarbonylContact O-C 3.6Å; C1508-R1516 WeakPolarHBondContact O-CA 3.43Å; C1508-I1517 HydrophobicContact CB-CD1 4.17Å; C1508-I1517 HydrophobicContact CB-CG1 3.82Å; C1508-I1517 PolarHBondContact N-O 3.28Å; C1508-I1517 WeakPolarHBondContact O-CG1 3.33Å; C1508-I1517 PolarHBondContact O-N 2.99Å
1509	K	97.4	Very high	94.4	Very high	71 Å²	71	50.3 Å²	50.3	31%	0.309	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.2	159.5	179	179.7	173.5	-178.1	0	108.5	E1492 V1494 H1511	E1492-K1509 HydrophobicContact CB-CB 4.39Å; E1492-K1509 PolarHBondContact N-O 2.68Å; E1492-K1509 PolarHBondContact O-N 3.05Å; V1494-K1509 HydrophobicContact CG2-CB 4.29Å; K1509-H1511 PolarHBondContact O-N 2.81Å
1510	D	97.1	Very high	94.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.011	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	109.8	168.2	-178.6	-12	0	0	0	108.7	R1490 Y1491 V1512 Q1513 N1514 R1515	R1490-D1510 WeakPolarHBondContact CG-OD1 3.45Å; R1490-D1510 IonicContact CZ-OD1 3.07Å; R1490-D1510 IonicContact CZ-OD2 2.67Å; R1490-D1510 IonicContact NE-OD1 3.97Å; R1490-D1510 PolarHBondContact NE-OD1 2.79Å; R1490-D1510 IonicContact NE-OD2 2.86Å; R1490-D1510 PolarHBondContact NE-OD2 2.87Å; R1490-D1510 IonicContact NH2-OD1 2.74Å; R1490-D1510 IonicContact NH2-OD2 3.99Å; R1490-D1510 PolarHBondContact NH2-OD2 3.2Å; Y1491-D1510 HydrophobicContact CD1-CB 3.97Å; Y1491-D1510 HydrophobicContact CE1-CB 3.87Å; D1510-V1512 VanDerWaalsContact C-N 3.34Å; D1510-V1512 WeakPolarHBondContact OD1-CA 3.4Å; D1510-V1512 WeakPolarHBondContact OD1-CB 3.5Å; D1510-V1512 PolarHBondContact OD1-N 3.24Å; D1510-Q1513 HydrophobicContact CB-CB 4.48Å; D1510-Q1513 PolarHBondContact OD1-N 2.74Å; D1510-Q1513 VanDerWaalsContact OD1-N 3.15Å; D1510-Q1513 WeakPolarHBondContact OD2-CB 3.13Å; D1510-Q1513 WeakPolarHBondContact OD2-CG 2.83Å; D1510-N1514 WeakPolarHBondContact O-CA 3.38Å; D1510-N1514 PolarHBondContact O-N 3.2Å; D1510-R1515 PolarHBondContact N-O 3.25Å; D1510-R1515 PolarHBondContact O-N 3.05Å
1511	H	94.4	Very high	95.2	Very high	64 Å²	64	44.2 Å²	44.2	30%	0.296	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.4	179.5	-72	-89.1	0	0	0	114.2	R1486 R1490 E1492 K1509	R1486-H1511 PolarHBondContact NH2-CE1 2.9Å; R1486-H1511 PolarHBondContact NH2-NE2 3.12Å; R1490-H1511 PolarHBondContact O-CD2 3.35Å; R1490-H1511 PolarHBondContact O-N 2.85Å; E1492-H1511 VanDerWaalsContact CB-NE2 3.34Å; E1492-H1511 WeakPolarHBondContact CB-NE2 3.31Å; E1492-H1511 VanDerWaalsContact CD-NE2 3.33Å; E1492-H1511 IonicContact OE1-NE2 3.57Å; E1492-H1511 IonicContact OE2-CD2 3.05Å; E1492-H1511 IonicContact OE2-CE1 2.71Å; E1492-H1511 PolarHBondContact OE2-CE1 2.77Å; E1492-H1511 IonicContact OE2-NE2 2.73Å; E1492-H1511 PolarHBondContact OE2-NE2 2.78Å; K1509-H1511 PolarHBondContact O-N 2.81Å
1512	V	93.9	Very high	95.7	Very high	111 Å²	111	39.8 Å²	39.8	67%	0.673	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-39.4	175	171.9	0	0	0	0	110.8	R1490 D1510	R1490-V1512 HydrophobicContact CG-CB 4.26Å; R1490-V1512 HydrophobicContact CG-CG2 3.83Å; D1510-V1512 VanDerWaalsContact C-N 3.34Å; D1510-V1512 WeakPolarHBondContact OD1-CA 3.4Å; D1510-V1512 WeakPolarHBondContact OD1-CB 3.5Å; D1510-V1512 PolarHBondContact OD1-N 3.24Å
1513	Q	92.2	Very high	96.1	Very high	91 Å²	91	38.4 Å²	38.4	43%	0.425	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-6.3	-179.9	-59.4	-176.7	-1.2	0	0	113.6	D1510 R1515	D1510-Q1513 HydrophobicContact CB-CB 4.48Å; D1510-Q1513 PolarHBondContact OD1-N 2.74Å; D1510-Q1513 VanDerWaalsContact OD1-N 3.15Å; D1510-Q1513 WeakPolarHBondContact OD2-CB 3.13Å; D1510-Q1513 WeakPolarHBondContact OD2-CG 2.83Å; Q1513-R1515 VanDerWaalsContact C-N 3.29Å; Q1513-R1515 HydrophobicContact CB-CG 4.09Å; Q1513-R1515 PolarHBondContact O-N 3.17Å; Q1513-R1515 VanDerWaalsContact OE1-CZ 3.26Å
1514	N	92.9	Very high	96.2	Very high	122 Å²	122	41.1 Å²	41.1	65%	0.652	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	42	-176.9	-166.6	47.9	0	0	0	114	D1510	D1510-N1514 WeakPolarHBondContact O-CA 3.38Å; D1510-N1514 PolarHBondContact O-N 3.2Å
1515	R	95.3	Very high	96.1	Very high	78 Å²	78	42.6 Å²	42.6	29%	0.294	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	162.1	174.6	60.6	164.3	163.3	177.2	-8	112.4	D1510 Q1513 I1517 L1557 D1571	D1510-R1515 PolarHBondContact N-O 3.25Å; D1510-R1515 PolarHBondContact O-N 3.05Å; Q1513-R1515 VanDerWaalsContact C-N 3.29Å; Q1513-R1515 HydrophobicContact CB-CG 4.09Å; Q1513-R1515 PolarHBondContact O-N 3.17Å; Q1513-R1515 VanDerWaalsContact OE1-CZ 3.26Å; R1515-I1517 HydrophobicContact CG-CG2 4.07Å; R1515-L1557 VanDerWaalsContact CZ-CD1 3.43Å; R1515-L1557 VanDerWaalsContact NH1-CD1 3.34Å; R1515-D1571 IonicContact CZ-OD1 3.93Å; R1515-D1571 IonicContact NH1-OD1 3.62Å; R1515-D1571 PolarHBondContact NH1-OD1 2.8Å; R1515-D1571 IonicContact NH1-OD2 3.91Å; R1515-D1571 PolarHBondContact NH1-OD2 2.86Å
1516	R	96.7	Very high	96	Very high	141 Å²	141	46.1 Å²	46.1	53%	0.532	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	138.8	165.7	-71.6	166.2	179.4	-89.1	-1.5	108.6	E1507 C1508 I1572	E1507-R1516 VanDerWaalsContact OE1-CD 3.25Å; E1507-R1516 WeakPolarHBondContact OE1-CD 3.34Å; E1507-R1516 IonicContact OE1-CZ 3.14Å; E1507-R1516 IonicContact OE1-NE 3.18Å; E1507-R1516 IonicContact OE1-NH1 3.63Å; E1507-R1516 PolarHBondContact OE1-NH1 2.99Å; E1507-R1516 IonicContact OE2-NH1 2.6Å; C1508-R1516 CarbonylContact O-C 3.6Å; C1508-R1516 WeakPolarHBondContact O-CA 3.43Å; R1516-I1572 HydrophobicContact CB-CG2 4.22Å
1517	I	97.5	Very high	95.7	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	160.6	178.4	60.7	155.3	0	0	0	109.8	Y1491 E1507 C1508 R1515 L1519 L1557 A1569 F1570	Y1491-I1517 HydrophobicContact CD1-CD1 3.56Å; Y1491-I1517 HydrophobicContact CD1-CG1 4.45Å; Y1491-I1517 HydrophobicContact CE1-CD1 3.48Å; Y1491-I1517 VanDerWaalsContact CE1-CD1 3.48Å; E1507-I1517 WeakPolarHBondContact CA-O 3.1Å; C1508-I1517 HydrophobicContact CB-CD1 4.17Å; C1508-I1517 HydrophobicContact CB-CG1 3.82Å; C1508-I1517 PolarHBondContact N-O 3.28Å; C1508-I1517 WeakPolarHBondContact O-CG1 3.33Å; C1508-I1517 PolarHBondContact O-N 2.99Å; R1515-I1517 HydrophobicContact CG-CG2 4.07Å; I1517-L1519 HydrophobicContact CD1-CB 4.4Å; I1517-L1519 HydrophobicContact CD1-CD1 4.37Å; I1517-L1557 HydrophobicContact CB-CD1 4.47Å; I1517-L1557 HydrophobicContact CG2-CD1 3.72Å; I1517-A1569 HydrophobicContact CD1-CB 3.77Å; I1517-F1570 CarbonylContact C-O 3.56Å; I1517-F1570 WeakPolarHBondContact CA-O 3.31Å; I1517-F1570 VanDerWaalsContact CB-O 3.29Å; I1517-F1570 WeakPolarHBondContact CB-O 3.27Å
1518	A	97.9	Very high	95.4	Very high	12 Å²	12	55.7 Å²	55.7	10%	0.099	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	138.9	158.1	0	0	0	0	0	109.2	L1497 V1505 V1506 F1570	L1497-A1518 HydrophobicContact CD1-CB 3.82Å; V1505-A1518 HydrophobicContact CG1-CB 4.34Å; V1506-A1518 CarbonylContact O-C 3.57Å; V1506-A1518 WeakPolarHBondContact O-CA 3.32Å; A1518-F1570 HydrophobicContact CB-CB 4.43Å; A1518-F1570 PolarHBondContact N-O 3.38Å; A1518-F1570 PolarHBondContact O-N 2.92Å
1519	L	97.6	Very high	95.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	113.3	178.6	-172.6	74.9	0	0	0	109.1	L1487 V1505 V1506 I1517 I1521 F1560 C1567 L1568 A1569	L1487-L1519 HydrophobicContact CD1-CD2 3.76Å; V1505-L1519 WeakPolarHBondContact CA-O 3.23Å; V1506-L1519 HydrophobicContact CG2-CB 3.89Å; V1506-L1519 HydrophobicContact CG2-CD2 4.33Å; V1506-L1519 PolarHBondContact N-O 3.38Å; V1506-L1519 PolarHBondContact O-N 3.04Å; I1517-L1519 HydrophobicContact CD1-CB 4.4Å; I1517-L1519 HydrophobicContact CD1-CD1 4.37Å; L1519-I1521 HydrophobicContact CD2-CD1 4.27Å; L1519-I1521 HydrophobicContact CD2-CG1 4.06Å; L1519-I1521 HydrophobicContact CG-CG1 4.15Å; L1519-I1521 PolarHBondContact O-N 3.03Å; L1519-F1560 HydrophobicContact CD1-CE1 3.84Å; L1519-F1560 HydrophobicContact CD1-CZ 3.96Å; L1519-F1560 HydrophobicContact CD2-CZ 4.13Å; L1519-C1567 HydrophobicContact CD1-CB 4.26Å; L1519-L1568 CarbonylContact C-O 2.9Å; L1519-L1568 WeakPolarHBondContact CA-O 3.41Å; L1519-A1569 HydrophobicContact CD1-CB 3.96Å
1520	K	97.4	Very high	95	Very high	15 Å²	15	60.8 Å²	60.8	7%	0.065	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	102.9	176.6	-168.3	-175.8	-165.6	-177.9	0	107.6	F1502 V1505 I1522 E1535 C1567 L1568 F1570 D1654	F1502-K1520 HydrophobicContact CD2-CD 4.45Å; F1502-K1520 HydrophobicContact CD2-CG 4.05Å; F1502-K1520 HydrophobicContact CE2-CD 4.2Å; F1502-K1520 HydrophobicContact CE2-CG 3.64Å; F1502-K1520 HydrophobicContact CZ-CG 4.35Å; V1505-K1520 HydrophobicContact CG2-CB 4.45Å; V1505-K1520 HydrophobicContact CG2-CG 4.22Å; K1520-I1522 HydrophobicContact CD-CD1 4.09Å; K1520-I1522 HydrophobicContact CG-CD1 3.95Å; K1520-E1535 IonicContact NZ-OE1 2.72Å; K1520-E1535 PolarHBondContact NZ-OE1 3.41Å; K1520-E1535 IonicContact NZ-OE2 3.36Å; K1520-E1535 PolarHBondContact NZ-OE2 2.83Å; K1520-C1567 WeakPolarHBondContact O-CA 3.32Å; K1520-L1568 HydrophobicContact CB-CB 4.26Å; K1520-L1568 PolarHBondContact N-O 3.36Å; K1520-L1568 PolarHBondContact O-N 3.35Å; K1520-F1570 HydrophobicContact CB-CD2 4.49Å; K1520-F1570 HydrophobicContact CB-CE2 4.02Å; K1520-F1570 HydrophobicContact CD-CE2 4.33Å; K1520-D1654 IonicContact NZ-OD1 3.1Å; K1520-D1654 PolarHBondContact NZ-OD1 3.01Å
1521	I	97.5	Very high	94.7	Very high	4 Å²	4	62.4 Å²	62.4	2%	0.021	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	109.2	179.4	-55.5	171.5	0	0	0	107.9	L1479 L1487 G1503 K1504 V1506 L1519 H1565	L1479-I1521 HydrophobicContact CB-CG2 4Å; L1479-I1521 HydrophobicContact CD2-CD1 4.45Å; L1479-I1521 HydrophobicContact CD2-CG2 4.1Å; L1487-I1521 HydrophobicContact CD1-CD1 3.78Å; L1487-I1521 HydrophobicContact CD1-CG1 4.44Å; G1503-I1521 CarbonylContact C-O 3.56Å; G1503-I1521 WeakPolarHBondContact CA-O 3.35Å; K1504-I1521 PolarHBondContact N-O 3.5Å; K1504-I1521 PolarHBondContact O-N 2.81Å; V1506-I1521 HydrophobicContact CG1-CD1 4.39Å; V1506-I1521 HydrophobicContact CG2-CD1 3.79Å; V1506-I1521 HydrophobicContact CG2-CG1 4.42Å; L1519-I1521 HydrophobicContact CD2-CD1 4.27Å; L1519-I1521 HydrophobicContact CD2-CG1 4.06Å; L1519-I1521 HydrophobicContact CG-CG1 4.15Å; L1519-I1521 PolarHBondContact O-N 3.03Å; I1521-H1565 HydrophobicContact CG2-CB 4.06Å
1522	I	97.2	Very high	94.7	Very high	3 Å²	3	59.5 Å²	59.5	2%	0.015	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	147.7	-174.9	-55.3	-69.3	0	0	0	110.4	F1502 K1520 Y1528 A1532 H1565 I1566 L1568	F1502-I1522 HydrophobicContact CB-CD1 4.21Å; F1502-I1522 HydrophobicContact CD2-CD1 3.91Å; F1502-I1522 HydrophobicContact CG-CD1 4.38Å; F1502-I1522 CarbonylContact O-C 3.31Å; F1502-I1522 WeakPolarHBondContact O-CA 3.29Å; K1520-I1522 HydrophobicContact CD-CD1 4.09Å; K1520-I1522 HydrophobicContact CG-CD1 3.95Å; I1522-Y1528 WeakPolarHBondContact CG2-O 3.27Å; I1522-A1532 HydrophobicContact CB-CB 4.42Å; I1522-A1532 HydrophobicContact CD1-CB 4.05Å; I1522-A1532 HydrophobicContact CG1-CB 3.72Å; I1522-A1532 HydrophobicContact CG2-CB 4.12Å; I1522-H1565 WeakPolarHBondContact O-CB 3.43Å; I1522-H1565 PolarHBondContact O-ND1 3.18Å; I1522-I1566 HydrophobicContact CB-CB 4.17Å; I1522-I1566 WeakPolarHBondContact CB-O 3.3Å; I1522-I1566 HydrophobicContact CG1-CB 4.22Å; I1522-I1566 WeakPolarHBondContact CG1-O 3.46Å; I1522-I1566 PolarHBondContact N-O 3.45Å; I1522-L1568 HydrophobicContact CD1-CD1 4.29Å; I1522-L1568 HydrophobicContact CG1-CD1 3.87Å
1523	K	96.2	Very high	94.8	Very high	20 Å²	20	57.4 Å²	57.4	9%	0.087	27%	0.274	C	S	.	.			trans	-59.1	146.7	173.6	-73.4	168.5	177.3	-78.4	0	112.1	D1476 G1477 H1478 T1501 F1502 V1525 Y1528 R1529	D1476-K1523 WeakPolarHBondContact O-CD 3.34Å; D1476-K1523 PolarHBondContact O-NZ 3Å; G1477-K1523 CarbonylContact O-C 3.58Å; G1477-K1523 WeakPolarHBondContact O-CA 3.36Å; G1477-K1523 WeakPolarHBondContact O-CB 3.48Å; H1478-K1523 PolarHBondContact CD2-NZ 2.82Å; H1478-K1523 WeakPolarHBondContact NE2-CE 3.44Å; H1478-K1523 PolarHBondContact NE2-NZ 3.17Å; T1501-K1523 VanDerWaalsContact O-CD 3.29Å; T1501-K1523 WeakPolarHBondContact O-CD 3.35Å; T1501-K1523 WeakPolarHBondContact O-CE 3.46Å; F1502-K1523 PolarHBondContact O-N 3.07Å; K1523-V1525 HydrophobicContact CB-CB 4.39Å; K1523-V1525 HydrophobicContact CB-CG2 4.26Å; K1523-V1525 PolarHBondContact O-N 3.32Å; K1523-Y1528 HydrophobicContact CB-CD2 4.01Å; K1523-Y1528 HydrophobicContact CD-CD2 3.66Å; K1523-Y1528 HydrophobicContact CD-CE2 3.67Å; K1523-Y1528 HydrophobicContact CG-CD2 4.47Å; K1523-R1529 WeakPolarHBondContact O-CG 3.28Å
1524	N	94.6	Very high	94.8	Very high	56 Å²	56	57.9 Å²	57.9	30%	0.299	28%	0.278	S	S	.	.	S	Bend	trans	-77.7	52.9	174.7	-158.2	3	0	0	0	111.9	D1473 G1477 H1563 G1564	D1473-N1524 WeakPolarHBondContact OD2-CB 3.43Å; D1473-N1524 PolarHBondContact OD2-ND2 2.92Å; G1477-N1524 PolarHBondContact O-N 2.81Å; N1524-H1563 PolarHBondContact ND2-O 2.88Å; N1524-G1564 VanDerWaalsContact OD1-CA 3.3Å; N1524-G1564 WeakPolarHBondContact OD1-CA 3.22Å
1525	V	93.9	Very high	94.9	Very high	59 Å²	59	52.3 Å²	52.3	36%	0.358	25%	0.248	S	C	.	.	S	Bend	trans	-135.5	121.7	-174.3	174.5	0	0	0	0	107.7	K1523 K1527 Y1528 R1529	K1523-V1525 HydrophobicContact CB-CB 4.39Å; K1523-V1525 HydrophobicContact CB-CG2 4.26Å; K1523-V1525 PolarHBondContact O-N 3.32Å; V1525-K1527 VanDerWaalsContact C-N 3.31Å; V1525-K1527 PolarHBondContact O-N 3.16Å; V1525-K1527 VanDerWaalsContact O-N 3.1Å; V1525-Y1528 HydrophobicContact CB-CD2 4.04Å; V1525-Y1528 HydrophobicContact CG1-CD2 4.18Å; V1525-Y1528 PolarHBondContact O-N 2.97Å; V1525-R1529 PolarHBondContact O-N 3.43Å; V1525-R1529 VanDerWaalsContact O-N 3.1Å
1526	D	92.6	Very high	94.9	Very high	106 Å²	106	48.6 Å²	48.6	57%	0.567	24%	0.235	S	C	*	.	H	α-helix	trans	-55.6	-38.4	-163.1	-71.1	-46.1	0	0	0	114.3	Y1528 R1529 E1530	D1526-Y1528 VanDerWaalsContact C-N 3.3Å; D1526-Y1528 PolarHBondContact O-N 3.47Å; D1526-R1529 PolarHBondContact O-N 3Å; D1526-R1529 VanDerWaalsContact O-N 3.11Å; D1526-R1529 IonicContact OD1-NH1 2.68Å; D1526-R1529 PolarHBondContact OD1-NH1 3.39Å; D1526-E1530 WeakPolarHBondContact O-CB 3.34Å; D1526-E1530 WeakPolarHBondContact O-CG 3.5Å; D1526-E1530 PolarHBondContact O-N 3.36Å
1527	K	91.2	Very high	94.9	Very high	148 Å²	148	46.3 Å²	46.3	64%	0.643	23%	0.233	S	C	*	.	H	α-helix	trans	-53.5	-43.4	174	-179.4	-178.7	176.8	-177.7	0	112.9	V1525 A1531	V1525-K1527 VanDerWaalsContact C-N 3.31Å; V1525-K1527 PolarHBondContact O-N 3.16Å; V1525-K1527 VanDerWaalsContact O-N 3.1Å; K1527-A1531 WeakPolarHBondContact O-CB 3.36Å; K1527-A1531 PolarHBondContact O-N 3.08Å
1528	Y	92.2	Very high	94.8	Very high	66 Å²	66	46.6 Å²	46.6	26%	0.259	24%	0.235	S	C	.	.	H	α-helix	trans	-78.8	-31.7	179.5	-62.1	-58.3	0	0	0	111.8	T1501 F1502 I1522 K1523 V1525 D1526 A1532	T1501-Y1528 WeakPolarHBondContact O-CE1 3.03Å; T1501-Y1528 WeakPolarHBondContact O-CE2 3.17Å; T1501-Y1528 PolarHBondContact O-OH 3.2Å; F1502-Y1528 HydrophobicContact CB-CD1 4.36Å; I1522-Y1528 WeakPolarHBondContact CG2-O 3.27Å; K1523-Y1528 HydrophobicContact CB-CD2 4.01Å; K1523-Y1528 HydrophobicContact CD-CD2 3.66Å; K1523-Y1528 HydrophobicContact CD-CE2 3.67Å; K1523-Y1528 HydrophobicContact CG-CD2 4.47Å; V1525-Y1528 HydrophobicContact CB-CD2 4.04Å; V1525-Y1528 HydrophobicContact CG1-CD2 4.18Å; V1525-Y1528 PolarHBondContact O-N 2.97Å; D1526-Y1528 VanDerWaalsContact C-N 3.3Å; D1526-Y1528 PolarHBondContact O-N 3.47Å; Y1528-A1532 VanDerWaalsContact O-CB 3.28Å; Y1528-A1532 WeakPolarHBondContact O-CB 3.39Å; Y1528-A1532 PolarHBondContact O-N 3.49Å
1529	R	94.8	Very high	94.7	Very high	61 Å²	61	46 Å²	46	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-66.7	-41.8	174	-59.3	176.2	69.8	-107.8	-6.5	111.5	K1523 V1525 D1526 A1532 M1533 D1561 G1564 I1566	K1523-R1529 WeakPolarHBondContact O-CG 3.28Å; V1525-R1529 PolarHBondContact O-N 3.43Å; V1525-R1529 VanDerWaalsContact O-N 3.1Å; D1526-R1529 PolarHBondContact O-N 3Å; D1526-R1529 VanDerWaalsContact O-N 3.11Å; D1526-R1529 IonicContact OD1-NH1 2.68Å; D1526-R1529 PolarHBondContact OD1-NH1 3.39Å; R1529-A1532 PolarHBondContact O-N 3.16Å; R1529-M1533 WeakPolarHBondContact O-CG 3.32Å; R1529-M1533 PolarHBondContact O-N 3.04Å; R1529-D1561 IonicContact CZ-OD2 2.85Å; R1529-D1561 IonicContact NH2-OD2 2.81Å; R1529-D1561 PolarHBondContact NH2-OD2 3.48Å; R1529-G1564 WeakPolarHBondContact CD-O 3.43Å; R1529-G1564 PolarHBondContact NE-O 3Å; R1529-I1566 HydrophobicContact CB-CG1 4.09Å; R1529-I1566 HydrophobicContact CG-CG1 4.23Å
1530	E	91.6	Very high	94.6	Very high	117 Å²	117	48.7 Å²	48.7	55%	0.547	24%	0.244	S	C	.	.	H	α-helix	trans	-63.6	-47.1	174.1	-72.8	-178.2	150.1	0	0	111.4	D1526 A1532 M1533 L1534	D1526-E1530 WeakPolarHBondContact O-CB 3.34Å; D1526-E1530 WeakPolarHBondContact O-CG 3.5Å; D1526-E1530 PolarHBondContact O-N 3.36Å; E1530-A1532 VanDerWaalsContact C-N 3.32Å; E1530-A1532 PolarHBondContact O-N 3.03Å; E1530-M1533 PolarHBondContact O-N 2.95Å; E1530-M1533 VanDerWaalsContact O-N 3.15Å; E1530-L1534 PolarHBondContact O-N 3.41Å
1531	A	90.9	Very high	94.4	Very high	36 Å²	36	49.9 Å²	49.9	30%	0.298	25%	0.25	S	C	.	.	H	α-helix	trans	-59.9	-40	174.7	0	0	0	0	0	112.6	K1527 L1534 E1535	K1527-A1531 WeakPolarHBondContact O-CB 3.36Å; K1527-A1531 PolarHBondContact O-N 3.08Å; A1531-L1534 PolarHBondContact O-N 3.47Å; A1531-E1535 PolarHBondContact O-N 2.87Å
1532	A	95.4	Very high	94.2	Very high	2 Å²	2	49.8 Å²	49.8	2%	0.017	25%	0.249	C	C	.	.	H	α-helix	trans	-66	-35.5	175	0	0	0	0	0	112.9	I1522 Y1528 R1529 E1530 E1535 I1536 I1566 L1568	I1522-A1532 HydrophobicContact CB-CB 4.42Å; I1522-A1532 HydrophobicContact CD1-CB 4.05Å; I1522-A1532 HydrophobicContact CG1-CB 3.72Å; I1522-A1532 HydrophobicContact CG2-CB 4.12Å; Y1528-A1532 VanDerWaalsContact O-CB 3.28Å; Y1528-A1532 WeakPolarHBondContact O-CB 3.39Å; Y1528-A1532 PolarHBondContact O-N 3.49Å; R1529-A1532 PolarHBondContact O-N 3.16Å; E1530-A1532 VanDerWaalsContact C-N 3.32Å; E1530-A1532 PolarHBondContact O-N 3.03Å; A1532-E1535 PolarHBondContact O-N 2.92Å; A1532-I1536 WeakPolarHBondContact O-CB 3.46Å; A1532-I1536 WeakPolarHBondContact O-CD1 3.29Å; A1532-I1536 WeakPolarHBondContact O-CG1 3.44Å; A1532-I1536 PolarHBondContact O-N 2.73Å; A1532-I1566 HydrophobicContact CB-CB 4.1Å; A1532-I1566 HydrophobicContact CB-CG2 3.88Å; A1532-L1568 HydrophobicContact CB-CD1 4.34Å
1533	M	94.7	Very high	93.9	Very high	67 Å²	67	51.1 Å²	51.1	33%	0.33	26%	0.256	S	S	.	.	H	α-helix	trans	-68.1	-35.2	173.5	-71.4	-58.2	-55.5	0	0	112.3	R1529 E1530 I1536 N1537 W1559 I1566	R1529-M1533 WeakPolarHBondContact O-CG 3.32Å; R1529-M1533 PolarHBondContact O-N 3.04Å; E1530-M1533 PolarHBondContact O-N 2.95Å; E1530-M1533 VanDerWaalsContact O-N 3.15Å; M1533-I1536 HydrophobicContact SD-CD1 4.11Å; M1533-N1537 PolarHBondContact O-N 3.38Å; M1533-N1537 PolarHBondContact O-ND2 2.89Å; M1533-W1559 HydrophobicContact CE-CH2 4.23Å; M1533-W1559 HydrophobicContact SD-CH2 4.5Å; M1533-W1559 HydrophobicContact SD-CZ3 4.22Å; M1533-I1566 HydrophobicContact SD-CD1 4.35Å
1534	L	91.9	Very high	93.7	Very high	101 Å²	101	57.5 Å²	57.5	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-46.6	170.2	-66.6	173.7	0	0	0	111.2	E1530 A1531 I1536 N1537 V1538	E1530-L1534 PolarHBondContact O-N 3.41Å; A1531-L1534 PolarHBondContact O-N 3.47Å; L1534-I1536 VanDerWaalsContact C-N 3.34Å; L1534-I1536 PolarHBondContact O-N 2.94Å; L1534-N1537 PolarHBondContact O-N 2.86Å; L1534-N1537 VanDerWaalsContact O-N 3.16Å; L1534-V1538 WeakPolarHBondContact O-CG2 3.17Å; L1534-V1538 PolarHBondContact O-N 3.4Å
1535	E	95.7	Very high	93.3	Very high	5 Å²	5	58.9 Å²	58.9	2%	0.023	29%	0.287	C	S	.	.	H	α-helix	trans	-57.2	-45.2	175.8	-168	179	-165.6	0	0	111.6	K1520 A1531 A1532 N1537 V1538 L1539 L1568 F1655	K1520-E1535 IonicContact NZ-OE1 2.72Å; K1520-E1535 PolarHBondContact NZ-OE1 3.41Å; K1520-E1535 IonicContact NZ-OE2 3.36Å; K1520-E1535 PolarHBondContact NZ-OE2 2.83Å; A1531-E1535 PolarHBondContact O-N 2.87Å; A1532-E1535 PolarHBondContact O-N 2.92Å; E1535-N1537 PolarHBondContact O-N 3.11Å; E1535-V1538 PolarHBondContact O-N 3.37Å; E1535-L1539 HydrophobicContact CG-CD1 3.75Å; E1535-L1539 HydrophobicContact CG-CG 4.41Å; E1535-L1539 VanDerWaalsContact O-CB 3.3Å; E1535-L1539 WeakPolarHBondContact O-CB 3.41Å; E1535-L1539 WeakPolarHBondContact O-CD1 3.31Å; E1535-L1539 VanDerWaalsContact O-CG 3.22Å; E1535-L1539 WeakPolarHBondContact O-CG 3.43Å; E1535-L1539 PolarHBondContact O-N 2.77Å; E1535-L1568 HydrophobicContact CG-CD2 4.21Å; E1535-F1655 HydrophobicContact CG-CB 4.08Å; E1535-F1655 PolarHBondContact OE1-N 2.64Å
1536	I	96.4	Very high	92.4	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-60.3	-43.9	175.3	-73.8	163.1	0	0	0	111.5	A1532 M1533 L1534 L1539 N1540 L1556 W1559 I1566 L1568	A1532-I1536 WeakPolarHBondContact O-CB 3.46Å; A1532-I1536 WeakPolarHBondContact O-CD1 3.29Å; A1532-I1536 WeakPolarHBondContact O-CG1 3.44Å; A1532-I1536 PolarHBondContact O-N 2.73Å; M1533-I1536 HydrophobicContact SD-CD1 4.11Å; L1534-I1536 VanDerWaalsContact C-N 3.34Å; L1534-I1536 PolarHBondContact O-N 2.94Å; I1536-L1539 PolarHBondContact O-N 2.85Å; I1536-N1540 VanDerWaalsContact CG2-ND2 3.3Å; I1536-N1540 WeakPolarHBondContact CG2-ND2 3.15Å; I1536-N1540 WeakPolarHBondContact O-CB 3.35Å; I1536-N1540 PolarHBondContact O-N 2.96Å; I1536-N1540 PolarHBondContact O-ND2 3.28Å; I1536-L1556 HydrophobicContact CG1-CD2 4.42Å; I1536-L1556 HydrophobicContact CG2-CD2 4.41Å; I1536-W1559 HydrophobicContact CD1-CB 4.08Å; I1536-W1559 HydrophobicContact CD1-CD2 3.84Å; I1536-W1559 HydrophobicContact CD1-CE3 3.78Å; I1536-W1559 HydrophobicContact CD1-CG 3.98Å; I1536-W1559 HydrophobicContact CG1-CB 4.33Å; I1536-W1559 HydrophobicContact CG1-CD2 4.49Å; I1536-W1559 HydrophobicContact CG1-CG 4.24Å; I1536-W1559 HydrophobicContact CG2-CD2 4.01Å; I1536-W1559 HydrophobicContact CG2-CG 4.02Å; I1536-W1559 HydrophobicContact CG2-CZ2 4.45Å; I1536-I1566 HydrophobicContact CD1-CG2 3.53Å; I1536-L1568 HydrophobicContact CD1-CD1 4.34Å; I1536-L1568 HydrophobicContact CD1-CD2 4.43Å; I1536-L1568 HydrophobicContact CD1-CG 4.1Å; I1536-L1568 HydrophobicContact CG1-CD2 3.73Å; I1536-L1568 HydrophobicContact CG1-CG 3.86Å
1537	N	95.5	Very high	91.1	Very high	93 Å²	93	56.1 Å²	56.1	50%	0.497	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-46.5	178.7	-70.9	-25.3	0	0	0	111.6	M1533 L1534 E1535 F1541	M1533-N1537 PolarHBondContact O-N 3.38Å; M1533-N1537 PolarHBondContact O-ND2 2.89Å; L1534-N1537 PolarHBondContact O-N 2.86Å; L1534-N1537 VanDerWaalsContact O-N 3.16Å; E1535-N1537 PolarHBondContact O-N 3.11Å; N1537-F1541 WeakPolarHBondContact O-CB 3.3Å; N1537-F1541 PolarHBondContact O-N 3.43Å; N1537-F1541 VanDerWaalsContact O-N 3.15Å
1538	V	95.6	Very high	89.7	Confident	6 Å²	6	56.4 Å²	56.4	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-62.8	-47.3	176.7	173.1	0	0	0	0	110.9	L1534 E1535 N1540 F1541 L1542 L1613 F1655 A1658 F1660	L1534-V1538 WeakPolarHBondContact O-CG2 3.17Å; L1534-V1538 PolarHBondContact O-N 3.4Å; E1535-V1538 PolarHBondContact O-N 3.37Å; V1538-N1540 PolarHBondContact O-N 3.19Å; V1538-F1541 WeakPolarHBondContact O-CB 3.2Å; V1538-F1541 PolarHBondContact O-N 3.22Å; V1538-L1542 HydrophobicContact CG1-CD1 3.85Å; V1538-L1542 HydrophobicContact CG1-CG 4.27Å; V1538-L1542 VanDerWaalsContact O-CG 3.3Å; V1538-L1542 WeakPolarHBondContact O-CG 3.49Å; V1538-L1542 PolarHBondContact O-N 3.33Å; V1538-L1613 HydrophobicContact CG1-CD1 4.15Å; V1538-L1613 HydrophobicContact CG1-CD2 3.7Å; V1538-L1613 HydrophobicContact CG2-CD1 4.13Å; V1538-F1655 HydrophobicContact CB-CB 4.43Å; V1538-F1655 HydrophobicContact CG1-CB 3.97Å; V1538-F1655 HydrophobicContact CG1-CD1 3.93Å; V1538-F1655 HydrophobicContact CG1-CG 4.24Å; V1538-A1658 HydrophobicContact CG1-CB 4.2Å; V1538-F1660 HydrophobicContact CG2-CE2 4.06Å; V1538-F1660 HydrophobicContact CG2-CZ 4.47Å
1539	L	95.9	Very high	88.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.8	-42.1	-179.1	-75.4	165.7	0	0	0	113	E1535 I1536 F1541 L1542 N1543 V1554 L1556 L1568 F1570 F1655	E1535-L1539 HydrophobicContact CG-CD1 3.75Å; E1535-L1539 HydrophobicContact CG-CG 4.41Å; E1535-L1539 VanDerWaalsContact O-CB 3.3Å; E1535-L1539 WeakPolarHBondContact O-CB 3.41Å; E1535-L1539 WeakPolarHBondContact O-CD1 3.31Å; E1535-L1539 VanDerWaalsContact O-CG 3.22Å; E1535-L1539 WeakPolarHBondContact O-CG 3.43Å; E1535-L1539 PolarHBondContact O-N 2.77Å; I1536-L1539 PolarHBondContact O-N 2.85Å; L1539-F1541 VanDerWaalsContact C-N 3.33Å; L1539-F1541 PolarHBondContact O-N 2.97Å; L1539-L1542 PolarHBondContact O-N 3.35Å; L1539-N1543 WeakPolarHBondContact O-CB 3.39Å; L1539-N1543 VanDerWaalsContact O-CG 3.27Å; L1539-N1543 PolarHBondContact O-N 3.49Å; L1539-V1554 HydrophobicContact CD2-CG1 4.08Å; L1539-L1556 HydrophobicContact CB-CB 3.83Å; L1539-L1556 HydrophobicContact CB-CD2 3.98Å; L1539-L1556 HydrophobicContact CD1-CB 4.19Å; L1539-L1556 HydrophobicContact CD1-CD1 4.34Å; L1539-L1556 HydrophobicContact CD1-CD2 4.38Å; L1539-L1556 HydrophobicContact CG-CB 4.47Å; L1539-L1568 HydrophobicContact CD1-CD2 4.09Å; L1539-F1570 HydrophobicContact CD1-CE1 3.63Å; L1539-F1570 HydrophobicContact CD1-CZ 3.69Å; L1539-F1570 HydrophobicContact CD2-CE1 4.32Å; L1539-F1655 HydrophobicContact CD2-CD2 3.73Å; L1539-F1655 HydrophobicContact CD2-CE2 4.26Å; L1539-F1655 HydrophobicContact CD2-CG 4.34Å; L1539-F1655 HydrophobicContact CG-CD2 4.44Å
1540	N	95	Very high	88.1	Confident	57 Å²	57	56 Å²	56	31%	0.305	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-43.2	175.1	-76.4	-46.1	0	0	0	111.3	I1536 V1538 N1543 E1544	I1536-N1540 VanDerWaalsContact CG2-ND2 3.3Å; I1536-N1540 WeakPolarHBondContact CG2-ND2 3.15Å; I1536-N1540 WeakPolarHBondContact O-CB 3.35Å; I1536-N1540 PolarHBondContact O-N 2.96Å; I1536-N1540 PolarHBondContact O-ND2 3.28Å; V1538-N1540 PolarHBondContact O-N 3.19Å; N1540-N1543 WeakPolarHBondContact O-CB 3.43Å; N1540-N1543 PolarHBondContact O-N 3.1Å; N1540-E1544 WeakPolarHBondContact O-CG 3.35Å; N1540-E1544 PolarHBondContact O-N 3.15Å
1541	F	93.4	Very high	88	Confident	40 Å²	40	51 Å²	51	18%	0.175	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-40.2	176.4	171.1	-81	0	0	0	112.9	N1537 V1538 L1539 E1544 R1545 N1611 F1660	N1537-F1541 WeakPolarHBondContact O-CB 3.3Å; N1537-F1541 PolarHBondContact O-N 3.43Å; N1537-F1541 VanDerWaalsContact O-N 3.15Å; V1538-F1541 WeakPolarHBondContact O-CB 3.2Å; V1538-F1541 PolarHBondContact O-N 3.22Å; L1539-F1541 VanDerWaalsContact C-N 3.33Å; L1539-F1541 PolarHBondContact O-N 2.97Å; F1541-E1544 PolarHBondContact O-N 2.78Å; F1541-R1545 WeakPolarHBondContact O-CG 3.38Å; F1541-R1545 PolarHBondContact O-N 2.99Å; F1541-N1611 HydrophobicContact CE1-CB 4.43Å; F1541-F1660 HydrophobicContact CD1-CE1 4.06Å; F1541-F1660 AromaticContact CD1-CZ 3.85Å; F1541-F1660 HydrophobicContact CD1-CZ 3.85Å; F1541-F1660 HydrophobicContact CD2-CE1 4.47Å; F1541-F1660 HydrophobicContact CD2-CZ 4.07Å; F1541-F1660 AromaticContact CE1-CE1 3.43Å; F1541-F1660 HydrophobicContact CE1-CE1 3.43Å; F1541-F1660 VanDerWaalsContact CE1-CE1 3.43Å; F1541-F1660 AromaticContact CE1-CZ 3.72Å; F1541-F1660 HydrophobicContact CE1-CZ 3.72Å; F1541-F1660 AromaticContact CE2-CE1 3.86Å; F1541-F1660 HydrophobicContact CE2-CE1 3.86Å; F1541-F1660 AromaticContact CE2-CZ 3.9Å; F1541-F1660 HydrophobicContact CE2-CZ 3.9Å; F1541-F1660 HydrophobicContact CG-CZ 4.01Å; F1541-F1660 HydrophobicContact CZ-CD1 4.33Å; F1541-F1660 AromaticContact CZ-CE1 3.26Å; F1541-F1660 HydrophobicContact CZ-CE1 3.26Å; F1541-F1660 AromaticContact CZ-CZ 3.69Å; F1541-F1660 HydrophobicContact CZ-CZ 3.69Å
1542	L	93.1	Very high	88.2	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-67.1	-41.8	174.2	-65.4	173	0	0	0	111.1	V1538 L1539 R1545 S1546 F1607 L1608 L1613 F1655	V1538-L1542 HydrophobicContact CG1-CD1 3.85Å; V1538-L1542 HydrophobicContact CG1-CG 4.27Å; V1538-L1542 VanDerWaalsContact O-CG 3.3Å; V1538-L1542 WeakPolarHBondContact O-CG 3.49Å; V1538-L1542 PolarHBondContact O-N 3.33Å; L1539-L1542 PolarHBondContact O-N 3.35Å; L1542-R1545 PolarHBondContact O-N 2.73Å; L1542-S1546 WeakPolarHBondContact O-CB 3.21Å; L1542-S1546 PolarHBondContact O-N 3.29Å; L1542-F1607 HydrophobicContact CD2-CD1 4.21Å; L1542-F1607 HydrophobicContact CD2-CE1 3.68Å; L1542-L1608 HydrophobicContact CD1-CD2 3.94Å; L1542-L1608 HydrophobicContact CD2-CD2 3.66Å; L1542-L1608 HydrophobicContact CG-CD2 4.5Å; L1542-L1613 HydrophobicContact CD2-CD2 4.47Å; L1542-F1655 HydrophobicContact CD1-CD1 3.82Å; L1542-F1655 HydrophobicContact CD1-CE1 3.62Å; L1542-F1655 HydrophobicContact CD1-CG 4.42Å; L1542-F1655 HydrophobicContact CD1-CZ 4.07Å
1543	N	92.2	Very high	88.3	Confident	31 Å²	31	49.5 Å²	49.5	17%	0.166	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-45.6	173.3	-78.9	-5.3	0	0	0	112	L1539 N1540 R1545 S1546 T1555 L1556	L1539-N1543 WeakPolarHBondContact O-CB 3.39Å; L1539-N1543 VanDerWaalsContact O-CG 3.27Å; L1539-N1543 PolarHBondContact O-N 3.49Å; N1540-N1543 WeakPolarHBondContact O-CB 3.43Å; N1540-N1543 PolarHBondContact O-N 3.1Å; N1543-R1545 VanDerWaalsContact C-N 3.29Å; N1543-R1545 PolarHBondContact O-N 2.76Å; N1543-S1546 WeakPolarHBondContact O-CB 3.12Å; N1543-S1546 PolarHBondContact O-N 3.46Å; N1543-S1546 VanDerWaalsContact O-N 3.16Å; N1543-S1546 PolarHBondContact O-OG 3.45Å; N1543-T1555 WeakPolarHBondContact OD1-CG2 3.34Å; N1543-L1556 PolarHBondContact ND2-O 3.26Å
1544	E	90.3	Very high	88.3	Confident	154 Å²	154	46.8 Å²	46.8	72%	0.72	25%	0.247	S	C	*	.	H	α-helix	trans	-59	-40.7	176.8	-77.7	-179.3	-174.1	0	0	112	N1540 F1541	N1540-E1544 WeakPolarHBondContact O-CG 3.35Å; N1540-E1544 PolarHBondContact O-N 3.15Å; F1541-E1544 PolarHBondContact O-N 2.78Å
1545	R	86.2	Confident	88.3	Confident	85 Å²	85	44.7 Å²	44.7	32%	0.321	24%	0.239	S	C	.	.	H	α-helix	trans	-74.8	-26.3	177.6	-65.1	-173.6	-178	-170.3	2.1	112.7	F1541 L1542 N1543 A1547 F1607 N1611 Y1819	F1541-R1545 WeakPolarHBondContact O-CG 3.38Å; F1541-R1545 PolarHBondContact O-N 2.99Å; L1542-R1545 PolarHBondContact O-N 2.73Å; N1543-R1545 VanDerWaalsContact C-N 3.29Å; N1543-R1545 PolarHBondContact O-N 2.76Å; R1545-A1547 PolarHBondContact O-N 2.85Å; R1545-F1607 HydrophobicContact CB-CZ 3.99Å; R1545-N1611 WeakPolarHBondContact CD-OD1 3.35Å; R1545-N1611 VanDerWaalsContact NH1-CG 3.34Å; R1545-N1611 PolarHBondContact NH1-O 3.05Å; R1545-N1611 PolarHBondContact NH1-OD1 2.99Å; R1545-Y1819 PolarHBondContact O-OH 3.21Å
1546	S	76.3	Confident	88.4	Confident	30 Å²	30	44.9 Å²	44.9	21%	0.21	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-21.7	-177	78.5	0	0	0	0	115.6	L1542 N1543 N1548 V1549 H1551	L1542-S1546 WeakPolarHBondContact O-CB 3.21Å; L1542-S1546 PolarHBondContact O-N 3.29Å; N1543-S1546 WeakPolarHBondContact O-CB 3.12Å; N1543-S1546 PolarHBondContact O-N 3.46Å; N1543-S1546 VanDerWaalsContact O-N 3.16Å; N1543-S1546 PolarHBondContact O-OG 3.45Å; S1546-N1548 PolarHBondContact O-N 3.14Å; S1546-V1549 PolarHBondContact O-N 3.33Å; S1546-V1549 VanDerWaalsContact O-O 3.07Å; S1546-H1551 WeakPolarHBondContact CB-CD2 3.01Å; S1546-H1551 WeakPolarHBondContact CB-NE2 3.34Å
1547	A	65.9	Low	88.3	Confident	77 Å²	77	46.8 Å²	46.8	64%	0.636	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-8.1	-159.1	0	0	0	0	0	117.4	R1545	R1545-A1547 PolarHBondContact O-N 2.85Å
1548	N	60.5	Low	88.3	Confident	154 Å²	154	44.8 Å²	44.8	82%	0.824	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-133.1	-0.1	174.9	-63	-88	0	0	0	114.3	S1546	S1546-N1548 PolarHBondContact O-N 3.14Å
1549	V	70.1	Confident	88.4	Confident	20 Å²	20	49.3 Å²	49.3	12%	0.121	26%	0.255	C	S	.	.	S	Bend	trans	-145.3	125.8	-171.8	-171.7	0	0	0	0	110.6	S1546 H1551 Y1819	S1546-V1549 PolarHBondContact O-N 3.33Å; S1546-V1549 VanDerWaalsContact O-O 3.07Å; V1549-H1551 PolarHBondContact O-N 3.06Å; V1549-Y1819 HydrophobicContact CB-CE2 4.39Å; V1549-Y1819 WeakPolarHBondContact CB-OH 3.36Å; V1549-Y1819 HydrophobicContact CG2-CE1 4.5Å; V1549-Y1819 HydrophobicContact CG2-CE2 3.99Å; V1549-Y1819 WeakPolarHBondContact CG2-OH 3.34Å
1550	E	84	Confident	88.4	Confident	100 Å²	100	50.3 Å²	50.3	47%	0.467	26%	0.26	S	S	.	.			trans	-66.4	124.4	168	-178.6	174.1	-161.9	0	0	109.7	L1552 Y1603 R1651	E1550-L1552 HydrophobicContact CG-CD2 3.87Å; E1550-Y1603 WeakPolarHBondContact O-CE1 3.26Å; E1550-Y1603 PolarHBondContact O-OH 3.38Å; E1550-R1651 IonicContact OE1-CZ 2.63Å; E1550-R1651 IonicContact OE1-NH1 3.33Å; E1550-R1651 PolarHBondContact OE1-NH1 3.06Å; E1550-R1651 IonicContact OE1-NH2 3.87Å; E1550-R1651 PolarHBondContact OE1-NH2 3.06Å
1551	H	89.4	Confident	88.5	Confident	10 Å²	10	51 Å²	51	5%	0.046	26%	0.264	C	S	.	.			trans	-119.6	0.2	-173.7	60	94.3	0	0	0	113.8	S1546 V1549 C1553 F1607	S1546-H1551 WeakPolarHBondContact CB-CD2 3.01Å; S1546-H1551 WeakPolarHBondContact CB-NE2 3.34Å; V1549-H1551 PolarHBondContact O-N 3.06Å; H1551-C1553 VanDerWaalsContact ND1-CB 3.3Å; H1551-C1553 WeakPolarHBondContact ND1-CB 3.44Å; H1551-C1553 PolarHBondContact ND1-N 3.09Å; H1551-C1553 PolarHBondContact ND1-SG 3.36Å; H1551-C1553 VanDerWaalsContact ND1-SG 3.44Å; H1551-C1553 PolarHBondContact O-N 3.22Å; H1551-F1607 HydrophobicContact CB-CB 4.32Å; H1551-F1607 HydrophobicContact CB-CD1 3.48Å; H1551-F1607 VanDerWaalsContact CB-CD1 3.48Å; H1551-F1607 HydrophobicContact CB-CD2 3.9Å; H1551-F1607 HydrophobicContact CB-CE1 3.52Å; H1551-F1607 HydrophobicContact CB-CE2 3.96Å; H1551-F1607 HydrophobicContact CB-CG 3.65Å; H1551-F1607 HydrophobicContact CB-CZ 3.77Å; H1551-F1607 AromaticContact CG-CE1 3.67Å; H1551-F1607 AromaticContact CG-CZ 3.99Å; H1551-F1607 AromaticContact ND1-CE1 3.81Å
1552	L	95.3	Very high	88.6	Confident	5 Å²	5	51 Å²	51	3%	0.026	26%	0.263	C	S	.	.			trans	57.4	10	177.3	-41.9	175	0	0	0	116.7	E1550 Q1600 Y1603 A1604 R1651 L1652 L1814	E1550-L1552 HydrophobicContact CG-CD2 3.87Å; L1552-Q1600 HydrophobicContact CD1-CB 3.66Å; L1552-Q1600 HydrophobicContact CD1-CG 3.86Å; L1552-Q1600 WeakPolarHBondContact CD1-O 3.03Å; L1552-Y1603 HydrophobicContact CD1-CD1 3.7Å; L1552-Y1603 HydrophobicContact CD1-CE1 4.4Å; L1552-Y1603 HydrophobicContact CD1-CG 4.47Å; L1552-Y1603 HydrophobicContact CG-CD1 3.96Å; L1552-Y1603 HydrophobicContact CG-CE1 4.21Å; L1552-A1604 HydrophobicContact CB-CB 3.98Å; L1552-A1604 HydrophobicContact CD1-CB 4.4Å; L1552-R1651 VanDerWaalsContact CD2-NH1 3.27Å; L1552-R1651 CarbonylContact O-C 3.5Å; L1552-R1651 VanDerWaalsContact O-CA 3.23Å; L1552-R1651 WeakPolarHBondContact O-CA 3.43Å; L1552-R1651 WeakPolarHBondContact O-CD 2.85Å; L1552-L1652 PolarHBondContact O-N 3.35Å; L1552-L1814 HydrophobicContact CD1-CD1 3.63Å; L1552-L1814 HydrophobicContact CD2-CD1 3.96Å; L1552-L1814 HydrophobicContact CG-CD1 4.1Å
1553	C	96.1	Very high	88.7	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.014	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-82.5	156.7	168.2	-47.2	0	0	0	0	109.1	H1551 F1655	H1551-C1553 VanDerWaalsContact ND1-CB 3.3Å; H1551-C1553 WeakPolarHBondContact ND1-CB 3.44Å; H1551-C1553 PolarHBondContact ND1-N 3.09Å; H1551-C1553 PolarHBondContact ND1-SG 3.36Å; H1551-C1553 VanDerWaalsContact ND1-SG 3.44Å; H1551-C1553 PolarHBondContact O-N 3.22Å; C1553-F1655 HydrophobicContact CB-CE2 4.09Å; C1553-F1655 HydrophobicContact CB-CZ 3.66Å
1554	V	95.6	Very high	88.7	Confident	11 Å²	11	55.7 Å²	55.7	7%	0.067	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-64.8	137.4	172.9	71.6	0	0	0	0	111.1	L1539 F1570 L1573 L1652 I1653 F1655	L1539-V1554 HydrophobicContact CD2-CG1 4.08Å; V1554-F1570 HydrophobicContact CB-CD1 4.44Å; V1554-F1570 HydrophobicContact CG1-CD1 4Å; V1554-F1570 HydrophobicContact CG1-CE1 3.89Å; V1554-F1570 HydrophobicContact CG2-CB 4.05Å; V1554-F1570 HydrophobicContact CG2-CD1 3.64Å; V1554-F1570 HydrophobicContact CG2-CE1 4.38Å; V1554-F1570 HydrophobicContact CG2-CG 4.11Å; V1554-L1573 HydrophobicContact CG2-CD1 4.35Å; V1554-L1652 PolarHBondContact N-O 3.25Å; V1554-I1653 HydrophobicContact CB-CG2 4.13Å; V1554-I1653 HydrophobicContact CG1-CB 4.42Å; V1554-I1653 HydrophobicContact CG1-CG2 4.25Å; V1554-F1655 HydrophobicContact CG1-CE2 4.31Å
1555	T	93	Very high	89	Confident	57 Å²	57	48.3 Å²	48.3	35%	0.35	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-90.5	120.4	179.1	-56.6	0	0	0	0	109.7	N1543 L1557	N1543-T1555 WeakPolarHBondContact OD1-CG2 3.34Å; T1555-L1557 HydrophobicContact CG2-CD2 4.32Å; T1555-L1557 PolarHBondContact O-N 2.82Å
1556	L	95.9	Very high	89.6	Confident	8 Å²	8	44.5 Å²	44.5	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	125.5	169.2	-177.6	67.3	0	0	0	109	I1536 L1539 N1543 D1558 L1568 F1570	I1536-L1556 HydrophobicContact CG1-CD2 4.42Å; I1536-L1556 HydrophobicContact CG2-CD2 4.41Å; L1539-L1556 HydrophobicContact CB-CB 3.83Å; L1539-L1556 HydrophobicContact CB-CD2 3.98Å; L1539-L1556 HydrophobicContact CD1-CB 4.19Å; L1539-L1556 HydrophobicContact CD1-CD1 4.34Å; L1539-L1556 HydrophobicContact CD1-CD2 4.38Å; L1539-L1556 HydrophobicContact CG-CB 4.47Å; N1543-L1556 PolarHBondContact ND2-O 3.26Å; L1556-D1558 WeakPolarHBondContact CD1-O 3.38Å; L1556-L1568 HydrophobicContact CD1-CB 3.81Å; L1556-L1568 HydrophobicContact CD1-CD2 4.29Å; L1556-L1568 HydrophobicContact CD1-CG 4.3Å; L1556-F1570 HydrophobicContact CB-CE1 4.23Å; L1556-F1570 HydrophobicContact CD1-CD1 4.39Å; L1556-F1570 HydrophobicContact CD1-CE1 3.85Å; L1556-F1570 HydrophobicContact CD1-CZ 4.04Å
1557	L	95.1	Very high	90.6	Very high	42 Å²	42	43 Å²	43	22%	0.22	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-37.8	-174.8	-56.3	179.5	0	0	0	112.8	R1515 I1517 T1555 A1569	R1515-L1557 VanDerWaalsContact CZ-CD1 3.43Å; R1515-L1557 VanDerWaalsContact NH1-CD1 3.34Å; I1517-L1557 HydrophobicContact CB-CD1 4.47Å; I1517-L1557 HydrophobicContact CG2-CD1 3.72Å; T1555-L1557 HydrophobicContact CG2-CD2 4.32Å; T1555-L1557 PolarHBondContact O-N 2.82Å; L1557-A1569 HydrophobicContact CB-CB 4.26Å; L1557-A1569 WeakPolarHBondContact CB-O 3.22Å; L1557-A1569 PolarHBondContact N-O 2.91Å
1558	D	95.8	Very high	92.1	Very high	51 Å²	51	39.4 Å²	39.4	27%	0.273	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	157.9	-174.2	-160	-2.4	0	0	0	108.2	R1490 Y1491 L1556 A1569	R1490-D1558 IonicContact CZ-OD2 3.84Å; R1490-D1558 IonicContact NH1-OD2 3.34Å; R1490-D1558 PolarHBondContact NH1-OD2 3.29Å; R1490-D1558 IonicContact NH2-OD2 2.79Å; R1490-D1558 PolarHBondContact NH2-OD2 3.14Å; Y1491-D1558 WeakPolarHBondContact OH-CB 3.49Å; Y1491-D1558 PolarHBondContact OH-OD2 2.78Å; L1556-D1558 WeakPolarHBondContact CD1-O 3.38Å; D1558-A1569 HydrophobicContact CB-CB 4.04Å; D1558-A1569 PolarHBondContact O-N 3.3Å
1559	W	97.2	Very high	93.9	Very high	100 Å²	100	32.1 Å²	32.1	38%	0.379	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	149.6	170.5	72.9	-89	0	0	0	111.3	M1533 I1536 C1567	M1533-W1559 HydrophobicContact CE-CH2 4.23Å; M1533-W1559 HydrophobicContact SD-CH2 4.5Å; M1533-W1559 HydrophobicContact SD-CZ3 4.22Å; I1536-W1559 HydrophobicContact CD1-CB 4.08Å; I1536-W1559 HydrophobicContact CD1-CD2 3.84Å; I1536-W1559 HydrophobicContact CD1-CE3 3.78Å; I1536-W1559 HydrophobicContact CD1-CG 3.98Å; I1536-W1559 HydrophobicContact CG1-CB 4.33Å; I1536-W1559 HydrophobicContact CG1-CD2 4.49Å; I1536-W1559 HydrophobicContact CG1-CG 4.24Å; I1536-W1559 HydrophobicContact CG2-CD2 4.01Å; I1536-W1559 HydrophobicContact CG2-CG 4.02Å; I1536-W1559 HydrophobicContact CG2-CZ2 4.45Å; W1559-C1567 CarbonylContact C-O 3.4Å; W1559-C1567 WeakPolarHBondContact CA-O 3.37Å
1560	F	97.1	Very high	95.2	Very high	21 Å²	21	32 Å²	32	9%	0.092	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	155.8	-177.8	53.9	-84.1	0	0	0	111.7	L1488 Y1491 L1519 C1567	L1488-F1560 HydrophobicContact CD1-CB 4.13Å; L1488-F1560 HydrophobicContact CD1-CD1 4.26Å; L1488-F1560 HydrophobicContact CD1-CD2 3.48Å; L1488-F1560 VanDerWaalsContact CD1-CD2 3.48Å; L1488-F1560 HydrophobicContact CD1-CE2 3.85Å; L1488-F1560 HydrophobicContact CD1-CG 3.7Å; L1488-F1560 HydrophobicContact CD1-CZ 4.39Å; L1488-F1560 HydrophobicContact CG-CD2 4.17Å; L1488-F1560 HydrophobicContact CG-CE2 4.19Å; Y1491-F1560 AromaticContact CD2-CE1 3.69Å; Y1491-F1560 HydrophobicContact CD2-CE1 3.69Å; Y1491-F1560 AromaticContact CD2-CZ 3.65Å; Y1491-F1560 HydrophobicContact CD2-CZ 3.65Å; Y1491-F1560 HydrophobicContact CE2-CD1 4.02Å; Y1491-F1560 AromaticContact CE2-CE1 3.26Å; Y1491-F1560 HydrophobicContact CE2-CE1 3.26Å; Y1491-F1560 AromaticContact CE2-CZ 3.74Å; Y1491-F1560 HydrophobicContact CE2-CZ 3.74Å; L1519-F1560 HydrophobicContact CD1-CE1 3.84Å; L1519-F1560 HydrophobicContact CD1-CZ 3.96Å; L1519-F1560 HydrophobicContact CD2-CZ 4.13Å; F1560-C1567 HydrophobicContact CD1-CB 4.12Å; F1560-C1567 HydrophobicContact CD2-CB 3.73Å; F1560-C1567 HydrophobicContact CE1-CB 3.8Å; F1560-C1567 HydrophobicContact CE2-CB 3.4Å; F1560-C1567 VanDerWaalsContact CE2-CB 3.4Å; F1560-C1567 HydrophobicContact CG-CB 4.09Å; F1560-C1567 HydrophobicContact CZ-CB 3.44Å; F1560-C1567 VanDerWaalsContact CZ-CB 3.44Å; F1560-C1567 PolarHBondContact N-O 3.47Å; F1560-C1567 PolarHBondContact O-N 3.13Å
1561	D	96.8	Very high	95.7	Very high	72 Å²	72	30.5 Å²	30.5	39%	0.385	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.5	165.7	-172.6	-49.6	0	0	0	108.1	R1529 G1564 I1566	R1529-D1561 IonicContact CZ-OD2 2.85Å; R1529-D1561 IonicContact NH2-OD2 2.81Å; R1529-D1561 PolarHBondContact NH2-OD2 3.48Å; D1561-G1564 WeakPolarHBondContact OD1-CA 3.39Å; D1561-G1564 PolarHBondContact OD1-N 2.73Å; D1561-I1566 HydrophobicContact CB-CD1 3.96Å; D1561-I1566 WeakPolarHBondContact OD2-CD1 3.1Å
1562	Y	95.5	Very high	96	Very high	39 Å²	39	32.8 Å²	32.8	15%	0.153	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	98.2	177	-176.9	-100.5	0	0	0	109.2	V1471 L1479 L1487 L1488 G1564 H1565	V1471-Y1562 HydrophobicContact CG1-CE1 4.15Å; V1471-Y1562 HydrophobicContact CG2-CE1 4.3Å; L1479-Y1562 HydrophobicContact CD1-CD1 4.4Å; L1479-Y1562 HydrophobicContact CD1-CE1 4.04Å; L1479-Y1562 HydrophobicContact CD2-CD1 3.92Å; L1479-Y1562 HydrophobicContact CD2-CE1 3.93Å; L1487-Y1562 HydrophobicContact CD2-CD1 4.16Å; L1487-Y1562 HydrophobicContact CD2-CE1 3.68Å; L1487-Y1562 HydrophobicContact CD2-CE2 4.44Å; L1488-Y1562 HydrophobicContact CD2-CD2 3.94Å; L1488-Y1562 HydrophobicContact CD2-CE2 4.39Å; L1488-Y1562 HydrophobicContact CG-CD2 4.27Å; Y1562-G1564 PolarHBondContact O-N 3.48Å; Y1562-G1564 VanDerWaalsContact O-N 3.12Å; Y1562-H1565 PolarHBondContact N-O 2.83Å; Y1562-H1565 VanDerWaalsContact O-CB 3.31Å; Y1562-H1565 WeakPolarHBondContact O-CB 3.22Å; Y1562-H1565 PolarHBondContact O-CD2 2.72Å; Y1562-H1565 PolarHBondContact O-N 3.08Å
1563	H	94	Very high	96.1	Very high	121 Å²	121	34.5 Å²	34.5	56%	0.56	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	22.2	179.1	-60.3	-109.1	0	0	0	114.8	V1471 N1524	V1471-H1563 HydrophobicContact CB-CB 4.3Å; V1471-H1563 HydrophobicContact CG1-CB 4.07Å; N1524-H1563 PolarHBondContact ND2-O 2.88Å
1564	G	93.4	Very high	96	Very high	10 Å²	10	35.3 Å²	35.3	10%	0.103	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.5	-22.8	-173.8	0	0	0	0	0	113.2	N1524 R1529 D1561 Y1562 I1566	N1524-G1564 VanDerWaalsContact OD1-CA 3.3Å; N1524-G1564 WeakPolarHBondContact OD1-CA 3.22Å; R1529-G1564 WeakPolarHBondContact CD-O 3.43Å; R1529-G1564 PolarHBondContact NE-O 3Å; D1561-G1564 WeakPolarHBondContact OD1-CA 3.39Å; D1561-G1564 PolarHBondContact OD1-N 2.73Å; Y1562-G1564 PolarHBondContact O-N 3.48Å; Y1562-G1564 VanDerWaalsContact O-N 3.12Å; G1564-I1566 PolarHBondContact O-N 2.85Å
1565	H	96.7	Very high	96.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	106.8	173.6	-58.5	-73	0	0	0	110.8	D1473 G1477 L1479 I1521 I1522 Y1562 C1567	D1473-H1565 IonicContact OD1-NE2 2.95Å; D1473-H1565 PolarHBondContact OD1-NE2 3.42Å; D1473-H1565 IonicContact OD2-CE1 2.67Å; D1473-H1565 IonicContact OD2-NE2 3.16Å; G1477-H1565 PolarHBondContact O-CE1 2.7Å; L1479-H1565 PolarHBondContact N-CE1 2.97Å; I1521-H1565 HydrophobicContact CG2-CB 4.06Å; I1522-H1565 WeakPolarHBondContact O-CB 3.43Å; I1522-H1565 PolarHBondContact O-ND1 3.18Å; Y1562-H1565 PolarHBondContact N-O 2.83Å; Y1562-H1565 VanDerWaalsContact O-CB 3.31Å; Y1562-H1565 WeakPolarHBondContact O-CB 3.22Å; Y1562-H1565 PolarHBondContact O-CD2 2.72Å; Y1562-H1565 PolarHBondContact O-N 3.08Å; H1565-C1567 PolarHBondContact O-N 3.39Å; H1565-C1567 PolarHBondContact O-SG 3.02Å
1566	I	97.4	Very high	96.3	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	127.9	166.6	-53.5	-59.9	0	0	0	108	I1522 R1529 A1532 M1533 I1536 D1561 G1564 L1568	I1522-I1566 HydrophobicContact CB-CB 4.17Å; I1522-I1566 WeakPolarHBondContact CB-O 3.3Å; I1522-I1566 HydrophobicContact CG1-CB 4.22Å; I1522-I1566 WeakPolarHBondContact CG1-O 3.46Å; I1522-I1566 PolarHBondContact N-O 3.45Å; R1529-I1566 HydrophobicContact CB-CG1 4.09Å; R1529-I1566 HydrophobicContact CG-CG1 4.23Å; A1532-I1566 HydrophobicContact CB-CB 4.1Å; A1532-I1566 HydrophobicContact CB-CG2 3.88Å; M1533-I1566 HydrophobicContact SD-CD1 4.35Å; I1536-I1566 HydrophobicContact CD1-CG2 3.53Å; D1561-I1566 HydrophobicContact CB-CD1 3.96Å; D1561-I1566 WeakPolarHBondContact OD2-CD1 3.1Å; G1564-I1566 PolarHBondContact O-N 2.85Å; I1566-L1568 HydrophobicContact CG2-CD1 3.96Å
1567	C	97.9	Very high	96.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	122.1	-175.9	-66.5	0	0	0	0	109.5	L1519 K1520 W1559 F1560 H1565	L1519-C1567 HydrophobicContact CD1-CB 4.26Å; K1520-C1567 WeakPolarHBondContact O-CA 3.32Å; W1559-C1567 CarbonylContact C-O 3.4Å; W1559-C1567 WeakPolarHBondContact CA-O 3.37Å; F1560-C1567 HydrophobicContact CD1-CB 4.12Å; F1560-C1567 HydrophobicContact CD2-CB 3.73Å; F1560-C1567 HydrophobicContact CE1-CB 3.8Å; F1560-C1567 HydrophobicContact CE2-CB 3.4Å; F1560-C1567 VanDerWaalsContact CE2-CB 3.4Å; F1560-C1567 HydrophobicContact CG-CB 4.09Å; F1560-C1567 HydrophobicContact CZ-CB 3.44Å; F1560-C1567 VanDerWaalsContact CZ-CB 3.44Å; F1560-C1567 PolarHBondContact N-O 3.47Å; F1560-C1567 PolarHBondContact O-N 3.13Å; H1565-C1567 PolarHBondContact O-N 3.39Å; H1565-C1567 PolarHBondContact O-SG 3.02Å
1568	L	98	Very high	96.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125	-179.7	-60.5	78.3	0	0	0	109.8	L1519 K1520 I1522 A1532 E1535 I1536 L1539 L1556 I1566 F1570	L1519-L1568 CarbonylContact C-O 2.9Å; L1519-L1568 WeakPolarHBondContact CA-O 3.41Å; K1520-L1568 HydrophobicContact CB-CB 4.26Å; K1520-L1568 PolarHBondContact N-O 3.36Å; K1520-L1568 PolarHBondContact O-N 3.35Å; I1522-L1568 HydrophobicContact CD1-CD1 4.29Å; I1522-L1568 HydrophobicContact CG1-CD1 3.87Å; A1532-L1568 HydrophobicContact CB-CD1 4.34Å; E1535-L1568 HydrophobicContact CG-CD2 4.21Å; I1536-L1568 HydrophobicContact CD1-CD1 4.34Å; I1536-L1568 HydrophobicContact CD1-CD2 4.43Å; I1536-L1568 HydrophobicContact CD1-CG 4.1Å; I1536-L1568 HydrophobicContact CG1-CD2 3.73Å; I1536-L1568 HydrophobicContact CG1-CG 3.86Å; L1539-L1568 HydrophobicContact CD1-CD2 4.09Å; L1556-L1568 HydrophobicContact CD1-CB 3.81Å; L1556-L1568 HydrophobicContact CD1-CD2 4.29Å; L1556-L1568 HydrophobicContact CD1-CG 4.3Å; I1566-L1568 HydrophobicContact CG2-CD1 3.96Å; L1568-F1570 HydrophobicContact CB-CD2 4.37Å; L1568-F1570 HydrophobicContact CB-CE2 3.53Å; L1568-F1570 HydrophobicContact CB-CZ 3.79Å; L1568-F1570 HydrophobicContact CD2-CE2 4.24Å; L1568-F1570 HydrophobicContact CD2-CZ 3.83Å
1569	A	97.6	Very high	96.6	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.008	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.8	179.2	0	0	0	0	0	111.8	I1517 L1519 L1557 D1558	I1517-A1569 HydrophobicContact CD1-CB 3.77Å; L1519-A1569 HydrophobicContact CD1-CB 3.96Å; L1557-A1569 HydrophobicContact CB-CB 4.26Å; L1557-A1569 WeakPolarHBondContact CB-O 3.22Å; L1557-A1569 PolarHBondContact N-O 2.91Å; D1558-A1569 HydrophobicContact CB-CB 4.04Å; D1558-A1569 PolarHBondContact O-N 3.3Å
1570	F	97.3	Very high	96.6	Very high	18 Å²	18	30 Å²	30	8%	0.079	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	156	-176.6	-61.4	-73.2	0	0	0	110.9	I1517 A1518 K1520 L1539 V1554 L1556 L1568	I1517-F1570 CarbonylContact C-O 3.56Å; I1517-F1570 WeakPolarHBondContact CA-O 3.31Å; I1517-F1570 VanDerWaalsContact CB-O 3.29Å; I1517-F1570 WeakPolarHBondContact CB-O 3.27Å; A1518-F1570 HydrophobicContact CB-CB 4.43Å; A1518-F1570 PolarHBondContact N-O 3.38Å; A1518-F1570 PolarHBondContact O-N 2.92Å; K1520-F1570 HydrophobicContact CB-CD2 4.49Å; K1520-F1570 HydrophobicContact CB-CE2 4.02Å; K1520-F1570 HydrophobicContact CD-CE2 4.33Å; L1539-F1570 HydrophobicContact CD1-CE1 3.63Å; L1539-F1570 HydrophobicContact CD1-CZ 3.69Å; L1539-F1570 HydrophobicContact CD2-CE1 4.32Å; V1554-F1570 HydrophobicContact CB-CD1 4.44Å; V1554-F1570 HydrophobicContact CG1-CD1 4Å; V1554-F1570 HydrophobicContact CG1-CE1 3.89Å; V1554-F1570 HydrophobicContact CG2-CB 4.05Å; V1554-F1570 HydrophobicContact CG2-CD1 3.64Å; V1554-F1570 HydrophobicContact CG2-CE1 4.38Å; V1554-F1570 HydrophobicContact CG2-CG 4.11Å; L1556-F1570 HydrophobicContact CB-CE1 4.23Å; L1556-F1570 HydrophobicContact CD1-CD1 4.39Å; L1556-F1570 HydrophobicContact CD1-CE1 3.85Å; L1556-F1570 HydrophobicContact CD1-CZ 4.04Å; L1568-F1570 HydrophobicContact CB-CD2 4.37Å; L1568-F1570 HydrophobicContact CB-CE2 3.53Å; L1568-F1570 HydrophobicContact CB-CZ 3.79Å; L1568-F1570 HydrophobicContact CD2-CE2 4.24Å; L1568-F1570 HydrophobicContact CD2-CZ 3.83Å
1571	D	95.1	Very high	96.6	Very high	68 Å²	68	29.2 Å²	29.2	36%	0.364	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	142.3	166.8	-80.6	-51.3	0	0	0	110.1	R1515	R1515-D1571 IonicContact CZ-OD1 3.93Å; R1515-D1571 IonicContact NH1-OD1 3.62Å; R1515-D1571 PolarHBondContact NH1-OD1 2.8Å; R1515-D1571 IonicContact NH1-OD2 3.91Å; R1515-D1571 PolarHBondContact NH1-OD2 2.86Å
1572	I	95.5	Very high	96.6	Very high	59 Å²	59	30.4 Å²	30.4	30%	0.303	16%	0.155	S	C	.	.			trans	-73.7	134.7	179.7	-172	165.3	0	0	0	110.6	L1497 E1507 R1516	L1497-I1572 HydrophobicContact CD1-CD1 4.45Å; E1507-I1572 HydrophobicContact CB-CD1 4.25Å; E1507-I1572 HydrophobicContact CG-CD1 3.79Å; R1516-I1572 HydrophobicContact CB-CG2 4.22Å
1573	L	96.3	Very high	96.6	Very high	41 Å²	41	32.4 Å²	32.4	22%	0.215	17%	0.166	C	C	.	.			trans	-121.6	173.5	-177.2	-63.6	173.1	0	0	0	110.7	V1554 L1624 R1651 I1653	V1554-L1573 HydrophobicContact CG2-CD1 4.35Å; L1573-L1624 HydrophobicContact CB-CB 4.26Å; L1573-L1624 HydrophobicContact CB-CD2 3.99Å; L1573-L1624 HydrophobicContact CD1-CB 4.07Å; L1573-L1624 HydrophobicContact CD1-CD2 4.11Å; L1573-R1651 HydrophobicContact CD1-CB 3.88Å; L1573-R1651 HydrophobicContact CD1-CG 4.26Å; L1573-R1651 HydrophobicContact CD2-CB 4.45Å; L1573-R1651 HydrophobicContact CD2-CG 3.96Å; L1573-I1653 HydrophobicContact CD1-CG2 4.34Å
1574	G	95.7	Very high	96.6	Very high	18 Å²	18	27.2 Å²	27.2	19%	0.186	14%	0.142	C	C	.	.			trans	-78.5	-168.5	172.1	0	0	0	0	0	113.8	F1625	G1574-F1625 WeakPolarHBondContact CA-O 3.46Å; G1574-F1625 PolarHBondContact N-O 3.1Å
1575	L	96.1	Very high	96.7	Very high	59 Å²	59	32.8 Å²	32.8	31%	0.309	17%	0.169	S	C	.	.			trans	-59.1	155.8	174.4	-64.8	173.9	0	0	0	112.6	D1579 E1583 F1625 S1628	L1575-D1579 HydrophobicContact CB-CB 4.46Å; L1575-D1579 HydrophobicContact CD2-CB 4.44Å; L1575-E1583 WeakPolarHBondContact CD1-OE1 3.28Å; L1575-F1625 PolarHBondContact O-N 3.25Å; L1575-S1628 PolarHBondContact N-OG 2.79Å
1576	S	97.5	Very high	96.6	Very high	7 Å²	7	37.2 Å²	37.2	5%	0.049	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-64.1	156	166.3	77.1	0	0	0	0	111.5	F1578 D1579 F1580 E1621 I1623	S1576-F1578 PolarHBondContact O-N 2.82Å; S1576-F1578 PolarHBondContact OG-N 3.22Å; S1576-D1579 PolarHBondContact O-N 2.95Å; S1576-D1579 WeakPolarHBondContact OG-CB 3.46Å; S1576-D1579 PolarHBondContact OG-N 3.24Å; S1576-D1579 PolarHBondContact OG-OD2 2.8Å; S1576-F1580 PolarHBondContact O-N 3.19Å; S1576-E1621 WeakPolarHBondContact CB-O 3.33Å; S1576-I1623 CarbonylContact C-O 3.54Å; S1576-I1623 WeakPolarHBondContact CA-O 3.37Å
1577	V	98.3	Very high	96.5	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-30.8	173.1	167.4	0	0	0	0	110.8	L1581 Y1589 I1597 P1620 I1623 F1625 I1650 L1701	V1577-L1581 VanDerWaalsContact O-CB 3.31Å; V1577-L1581 WeakPolarHBondContact O-CB 3.43Å; V1577-L1581 PolarHBondContact O-N 3.36Å; V1577-Y1589 HydrophobicContact CG1-CE2 4.07Å; V1577-Y1589 PolarHBondContact O-OH 3.33Å; V1577-I1597 HydrophobicContact CG2-CG2 4.49Å; V1577-P1620 HydrophobicContact CB-CB 4.49Å; V1577-P1620 WeakPolarHBondContact CB-O 3.48Å; V1577-P1620 HydrophobicContact CG1-CB 4.24Å; V1577-P1620 PolarHBondContact N-O 3Å; V1577-I1623 HydrophobicContact CB-CB 4.41Å; V1577-I1623 HydrophobicContact CG2-CB 4.11Å; V1577-I1623 HydrophobicContact CG2-CG2 3.71Å; V1577-I1623 WeakPolarHBondContact CG2-O 3.3Å; V1577-I1623 PolarHBondContact N-O 3.39Å; V1577-F1625 HydrophobicContact CB-CE2 4.44Å; V1577-F1625 HydrophobicContact CG2-CD2 4.32Å; V1577-F1625 HydrophobicContact CG2-CE1 4.3Å; V1577-F1625 HydrophobicContact CG2-CE2 3.84Å; V1577-F1625 HydrophobicContact CG2-CZ 3.82Å; V1577-I1650 HydrophobicContact CG2-CG2 4.33Å; V1577-L1701 HydrophobicContact CG1-CD2 3.52Å
1578	F	97.6	Very high	96.4	Very high	39 Å²	39	38.4 Å²	38.4	17%	0.171	20%	0.197	C	C	.	.	H	α-helix	trans	-66.6	-53.3	170.3	-176.7	-102.9	0	0	0	112.8	S1576 F1580 L1581 K1582 Y1586 P1620 E1621	S1576-F1578 PolarHBondContact O-N 2.82Å; S1576-F1578 PolarHBondContact OG-N 3.22Å; F1578-F1580 VanDerWaalsContact C-N 3.34Å; F1578-F1580 PolarHBondContact O-N 3.35Å; F1578-L1581 WeakPolarHBondContact O-CA 3.41Å; F1578-L1581 WeakPolarHBondContact O-CB 3.21Å; F1578-L1581 PolarHBondContact O-N 3.18Å; F1578-K1582 HydrophobicContact CD1-CD 4.21Å; F1578-K1582 HydrophobicContact CE1-CD 3.69Å; F1578-K1582 HydrophobicContact CZ-CD 4.4Å; F1578-K1582 WeakPolarHBondContact O-CB 3.43Å; F1578-K1582 PolarHBondContact O-N 2.87Å; F1578-Y1586 HydrophobicContact CE2-CE1 4.35Å; F1578-P1620 HydrophobicContact CB-CB 4.06Å; F1578-P1620 PolarHBondContact N-O 2.95Å; F1578-E1621 HydrophobicContact CB-CB 4.45Å; F1578-E1621 HydrophobicContact CB-CG 3.81Å; F1578-E1621 HydrophobicContact CD1-CG 4Å; F1578-E1621 HydrophobicContact CD2-CG 4.48Å; F1578-E1621 HydrophobicContact CG-CG 3.86Å
1579	D	96.9	Very high	96.3	Very high	52 Å²	52	39 Å²	39	28%	0.278	20%	0.199	S	C	.	.	H	α-helix	trans	-67.3	-36	-175	-70.8	-61.5	0	0	0	111.9	L1575 S1576 K1582 E1583	L1575-D1579 HydrophobicContact CB-CB 4.46Å; L1575-D1579 HydrophobicContact CD2-CB 4.44Å; S1576-D1579 PolarHBondContact O-N 2.95Å; S1576-D1579 WeakPolarHBondContact OG-CB 3.46Å; S1576-D1579 PolarHBondContact OG-N 3.24Å; S1576-D1579 PolarHBondContact OG-OD2 2.8Å; D1579-K1582 PolarHBondContact O-N 3.12Å; D1579-K1582 IonicContact OD1-NZ 3.63Å; D1579-K1582 PolarHBondContact OD1-NZ 3.11Å; D1579-E1583 WeakPolarHBondContact O-CB 3.27Å; D1579-E1583 PolarHBondContact O-N 2.92Å
1580	F	97.6	Very high	96.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-40.9	170.5	-169.7	-79.1	0	0	0	111.9	S1576 F1578 N1584 Y1589 F1625 S1628 Y1630 R1643 V1645	S1576-F1580 PolarHBondContact O-N 3.19Å; F1578-F1580 VanDerWaalsContact C-N 3.34Å; F1578-F1580 PolarHBondContact O-N 3.35Å; F1580-N1584 WeakPolarHBondContact O-CB 3.47Å; F1580-N1584 PolarHBondContact O-N 3.26Å; F1580-Y1589 AromaticContact CD1-CE1 3.7Å; F1580-Y1589 HydrophobicContact CD1-CE1 3.7Å; F1580-Y1589 AromaticContact CD1-CZ 3.96Å; F1580-Y1589 WeakPolarHBondContact CD1-OH 3.43Å; F1580-Y1589 HydrophobicContact CE1-CE1 4.09Å; F1580-F1625 HydrophobicContact CB-CD2 4.32Å; F1580-F1625 HydrophobicContact CB-CE2 3.81Å; F1580-F1625 HydrophobicContact CD2-CE2 4.45Å; F1580-F1625 HydrophobicContact CG-CE2 4Å; F1580-S1628 WeakPolarHBondContact CE2-O 3.34Å; F1580-Y1630 HydrophobicContact CE2-CD1 4.4Å; F1580-Y1630 HydrophobicContact CE2-CG 4.43Å; F1580-R1643 HydrophobicContact CE1-CB 4.38Å; F1580-R1643 HydrophobicContact CZ-CB 4.04Å; F1580-V1645 HydrophobicContact CE1-CB 4.28Å; F1580-V1645 HydrophobicContact CE2-CB 3.85Å; F1580-V1645 HydrophobicContact CE2-CG2 4.11Å; F1580-V1645 HydrophobicContact CZ-CB 3.72Å; F1580-V1645 HydrophobicContact CZ-CG2 4.47Å
1581	L	97	Very high	96.1	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-42.5	177.1	177.2	60.5	0	0	0	111.6	V1577 F1578 N1584 N1585 Y1586 V1587 Y1589 E1700	V1577-L1581 VanDerWaalsContact O-CB 3.31Å; V1577-L1581 WeakPolarHBondContact O-CB 3.43Å; V1577-L1581 PolarHBondContact O-N 3.36Å; F1578-L1581 WeakPolarHBondContact O-CA 3.41Å; F1578-L1581 WeakPolarHBondContact O-CB 3.21Å; F1578-L1581 PolarHBondContact O-N 3.18Å; L1581-N1584 CarbonylContact O-C 3.43Å; L1581-N1584 PolarHBondContact O-N 3.1Å; L1581-N1585 PolarHBondContact O-N 3.12Å; L1581-Y1586 HydrophobicContact CG-CD1 4.3Å; L1581-Y1586 WeakPolarHBondContact O-CA 3.29Å; L1581-Y1586 PolarHBondContact O-N 2.81Å; L1581-V1587 VanDerWaalsContact CD1-C 3.46Å; L1581-V1587 WeakPolarHBondContact CD1-O 3.41Å; L1581-Y1589 HydrophobicContact CB-CE2 4.02Å; L1581-Y1589 HydrophobicContact CD1-CE2 4.21Å; L1581-Y1589 HydrophobicContact CG-CE2 4.49Å; L1581-E1700 HydrophobicContact CD2-CG 4.21Å
1582	K	96.4	Very high	96.1	Very high	97 Å²	97	44.1 Å²	44.1	42%	0.422	23%	0.227	S	C	.	.	H	α-helix	trans	-62.9	-49.4	175.2	169.8	176.2	154.7	-155.1	0	112	F1578 D1579 N1584 N1585 Y1586	F1578-K1582 HydrophobicContact CD1-CD 4.21Å; F1578-K1582 HydrophobicContact CE1-CD 3.69Å; F1578-K1582 HydrophobicContact CZ-CD 4.4Å; F1578-K1582 WeakPolarHBondContact O-CB 3.43Å; F1578-K1582 PolarHBondContact O-N 2.87Å; D1579-K1582 PolarHBondContact O-N 3.12Å; D1579-K1582 IonicContact OD1-NZ 3.63Å; D1579-K1582 PolarHBondContact OD1-NZ 3.11Å; K1582-N1584 PolarHBondContact O-N 2.97Å; K1582-N1585 WeakPolarHBondContact O-CA 3.44Å; K1582-N1585 PolarHBondContact O-N 3.43Å; K1582-Y1586 HydrophobicContact CB-CE1 4.29Å; K1582-Y1586 HydrophobicContact CB-CE2 4.34Å; K1582-Y1586 HydrophobicContact CG-CE2 4.37Å
1583	E	95.6	Very high	96.2	Very high	82 Å²	82	42.3 Å²	42.3	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-30.9	172	-82	-154.8	-123.5	0	0	112.9	L1575 D1579 N1585 R1643	L1575-E1583 WeakPolarHBondContact CD1-OE1 3.28Å; D1579-E1583 WeakPolarHBondContact O-CB 3.27Å; D1579-E1583 PolarHBondContact O-N 2.92Å; E1583-N1585 PolarHBondContact O-N 3.37Å; E1583-N1585 PolarHBondContact O-ND2 2.76Å; E1583-R1643 IonicContact OE2-CZ 3.88Å; E1583-R1643 IonicContact OE2-NH1 3.86Å; E1583-R1643 PolarHBondContact OE2-NH1 3.14Å; E1583-R1643 IonicContact OE2-NH2 2.79Å; E1583-R1643 PolarHBondContact OE2-NH2 3.37Å
1584	N	95.2	Very high	96.3	Very high	11 Å²	11	40.3 Å²	40.3	6%	0.059	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	13	171.6	-157	18.6	0	0	0	113.3	F1580 L1581 K1582 V1587 R1643	F1580-N1584 WeakPolarHBondContact O-CB 3.47Å; F1580-N1584 PolarHBondContact O-N 3.26Å; L1581-N1584 CarbonylContact O-C 3.43Å; L1581-N1584 PolarHBondContact O-N 3.1Å; K1582-N1584 PolarHBondContact O-N 2.97Å; N1584-V1587 WeakPolarHBondContact O-CB 3.22Å; N1584-V1587 WeakPolarHBondContact O-CG2 3.37Å; N1584-R1643 HydrophobicContact CB-CB 4.44Å; N1584-R1643 PolarHBondContact ND2-O 3.48Å; N1584-R1643 WeakPolarHBondContact OD1-CB 3.18Å; N1584-R1643 PolarHBondContact OD1-N 3.03Å
1585	N	94.7	Very high	96.4	Very high	127 Å²	127	40.1 Å²	40.1	68%	0.679	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	44.2	178.6	-62.8	-111.4	0	0	0	113.3	L1581 K1582 E1583 V1587	L1581-N1585 PolarHBondContact O-N 3.12Å; K1582-N1585 WeakPolarHBondContact O-CA 3.44Å; K1582-N1585 PolarHBondContact O-N 3.43Å; E1583-N1585 PolarHBondContact O-N 3.37Å; E1583-N1585 PolarHBondContact O-ND2 2.76Å; N1585-V1587 PolarHBondContact O-N 2.71Å
1586	Y	95.3	Very high	96.5	Very high	94 Å²	94	37.6 Å²	37.6	37%	0.369	19%	0.187	S	C	.	.	S	Bend	trans	55.9	37.8	178.3	-64.1	-81.1	0	0	0	113.3	F1578 L1581 K1582 G1588	F1578-Y1586 HydrophobicContact CE2-CE1 4.35Å; L1581-Y1586 HydrophobicContact CG-CD1 4.3Å; L1581-Y1586 WeakPolarHBondContact O-CA 3.29Å; L1581-Y1586 PolarHBondContact O-N 2.81Å; K1582-Y1586 HydrophobicContact CB-CE1 4.29Å; K1582-Y1586 HydrophobicContact CB-CE2 4.34Å; K1582-Y1586 HydrophobicContact CG-CE2 4.37Å; Y1586-G1588 PolarHBondContact O-N 2.79Å
1587	V	94.6	Very high	96.5	Very high	12 Å²	12	37.3 Å²	37.3	7%	0.073	18%	0.184	C	C	.	.			trans	-91.6	99.2	176	179.8	0	0	0	0	109.5	L1581 N1584 N1585 E1642	L1581-V1587 VanDerWaalsContact CD1-C 3.46Å; L1581-V1587 WeakPolarHBondContact CD1-O 3.41Å; N1584-V1587 WeakPolarHBondContact O-CB 3.22Å; N1584-V1587 WeakPolarHBondContact O-CG2 3.37Å; N1585-V1587 PolarHBondContact O-N 2.71Å; V1587-E1642 HydrophobicContact CG1-CG 4.45Å; V1587-E1642 WeakPolarHBondContact CG1-OE1 3.3Å
1588	G	95.4	Very high	96.5	Very high	16 Å²	16	37.2 Å²	37.2	17%	0.165	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-47.6	139.5	175	0	0	0	0	0	112.6	Y1586 L1701	Y1586-G1588 PolarHBondContact O-N 2.79Å; G1588-L1701 CarbonylContact C-O 3.58Å; G1588-L1701 WeakPolarHBondContact CA-O 3.32Å
1589	Y	96.8	Very high	96.5	Very high	12 Å²	12	36.3 Å²	36.3	5%	0.047	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-65.9	157.5	-164.8	-70.9	-91.4	0	0	0	113.3	V1577 F1580 L1581 H1593 F1625 L1701	V1577-Y1589 HydrophobicContact CG1-CE2 4.07Å; V1577-Y1589 PolarHBondContact O-OH 3.33Å; F1580-Y1589 AromaticContact CD1-CE1 3.7Å; F1580-Y1589 HydrophobicContact CD1-CE1 3.7Å; F1580-Y1589 AromaticContact CD1-CZ 3.96Å; F1580-Y1589 WeakPolarHBondContact CD1-OH 3.43Å; F1580-Y1589 HydrophobicContact CE1-CE1 4.09Å; L1581-Y1589 HydrophobicContact CB-CE2 4.02Å; L1581-Y1589 HydrophobicContact CD1-CE2 4.21Å; L1581-Y1589 HydrophobicContact CG-CE2 4.49Å; Y1589-H1593 HydrophobicContact CD1-CB 4.47Å; Y1589-F1625 AromaticContact CE1-CZ 3.99Å; Y1589-F1625 HydrophobicContact CE1-CZ 3.99Å; Y1589-L1701 HydrophobicContact CD2-CD2 3.55Å; Y1589-L1701 HydrophobicContact CE2-CD2 3.66Å; Y1589-L1701 HydrophobicContact CG-CD2 4.4Å; Y1589-L1701 PolarHBondContact N-O 3.34Å
1590	P	95.1	Very high	96.6	Very high	54 Å²	54	34.1 Å²	34.1	35%	0.351	17%	0.168	S	C	.	.	P	Polyproline II helix	trans	-57	142.9	167.8	-21	32.5	0	0	0	111.3	E1592 H1593 V1594 M1644	P1590-E1592 PolarHBondContact O-N 2.87Å; P1590-H1593 WeakPolarHBondContact O-CA 3.44Å; P1590-H1593 WeakPolarHBondContact O-CB 3.49Å; P1590-H1593 PolarHBondContact O-N 3.31Å; P1590-V1594 PolarHBondContact O-N 3.05Å; P1590-M1644 HydrophobicContact CG-CG 4.12Å; P1590-M1644 HydrophobicContact CG-SD 3.88Å
1591	M	95.8	Very high	96.6	Very high	38 Å²	38	34.2 Å²	34.2	19%	0.187	17%	0.168	C	C	.	.	H	α-helix	trans	-52.5	-35	-177.1	-177	61.9	85.9	0	0	113.8	V1594 R1595 Y1702 D1774 T1775 L1778 F1804	M1591-V1594 PolarHBondContact O-N 3.37Å; M1591-R1595 WeakPolarHBondContact O-CB 3.4Å; M1591-R1595 PolarHBondContact O-N 3.35Å; M1591-Y1702 HydrophobicContact CE-CD2 4.05Å; M1591-Y1702 HydrophobicContact CE-CE2 3.59Å; M1591-D1774 HydrophobicContact CE-CB 4.19Å; M1591-D1774 HydrophobicContact CG-CB 3.97Å; M1591-D1774 HydrophobicContact SD-CB 4.47Å; M1591-T1775 VanDerWaalsContact CE-OG1 3.29Å; M1591-T1775 WeakPolarHBondContact CE-OG1 3.47Å; M1591-L1778 HydrophobicContact CE-CD2 3.86Å; M1591-L1778 HydrophobicContact SD-CD2 3.89Å; M1591-F1804 HydrophobicContact SD-CE2 3.74Å; M1591-F1804 HydrophobicContact SD-CZ 4.06Å
1592	E	95.2	Very high	96.6	Very high	104 Å²	104	34 Å²	34	49%	0.486	17%	0.167	S	C	.	.	H	α-helix	trans	-62.3	-42.5	175.4	-172.9	166.5	-166.9	0	0	112.5	P1590 R1595 H1596	P1590-E1592 PolarHBondContact O-N 2.87Å; E1592-R1595 PolarHBondContact O-N 3.38Å; E1592-H1596 WeakPolarHBondContact O-CB 3.38Å; E1592-H1596 PolarHBondContact O-N 2.96Å
1593	H	97.1	Very high	96.6	Very high	20 Å²	20	29.8 Å²	29.8	9%	0.093	15%	0.148	C	C	.	.	H	α-helix	trans	-73.2	-40.2	177.4	-66.3	-157.3	0	0	0	111.2	Y1589 P1590 R1595 H1596 I1597 V1645	Y1589-H1593 HydrophobicContact CD1-CB 4.47Å; P1590-H1593 WeakPolarHBondContact O-CA 3.44Å; P1590-H1593 WeakPolarHBondContact O-CB 3.49Å; P1590-H1593 PolarHBondContact O-N 3.31Å; H1593-R1595 VanDerWaalsContact C-N 3.3Å; H1593-R1595 PolarHBondContact O-N 2.82Å; H1593-H1596 PolarHBondContact O-N 3.14Å; H1593-I1597 HydrophobicContact CB-CD1 4.37Å; H1593-I1597 WeakPolarHBondContact O-CB 3.43Å; H1593-I1597 WeakPolarHBondContact O-CG1 3.34Å; H1593-I1597 PolarHBondContact O-N 2.67Å; H1593-V1645 PolarHBondContact CE1-O 3.38Å; H1593-V1645 VanDerWaalsContact CE1-O 3.29Å
1594	V	98	Very high	96.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-53.8	-51.7	171.9	-179.8	0	0	0	0	109.3	P1590 M1591 H1596 S1598 L1701 L1778 F1804	P1590-V1594 PolarHBondContact O-N 3.05Å; M1591-V1594 PolarHBondContact O-N 3.37Å; V1594-H1596 PolarHBondContact O-N 2.92Å; V1594-S1598 VanDerWaalsContact O-CB 3.3Å; V1594-S1598 WeakPolarHBondContact O-CB 3.21Å; V1594-S1598 PolarHBondContact O-N 3.2Å; V1594-S1598 PolarHBondContact O-OG 3.24Å; V1594-L1701 HydrophobicContact CG1-CB 4.18Å; V1594-L1701 HydrophobicContact CG2-CB 4.25Å; V1594-L1778 HydrophobicContact CG1-CD1 4.27Å; V1594-L1778 HydrophobicContact CG1-CD2 4.36Å; V1594-F1804 HydrophobicContact CG1-CZ 4.48Å
1595	R	97.7	Very high	96.8	Very high	13 Å²	13	25.5 Å²	25.5	5%	0.049	13%	0.128	C	C	.	.	H	α-helix	trans	-58.7	-44.2	178.8	-168.1	-169.8	-69.7	107.8	-10.3	112.8	M1591 E1592 H1593 Y1599 D1774 F1804 F1805 L1808	M1591-R1595 WeakPolarHBondContact O-CB 3.4Å; M1591-R1595 PolarHBondContact O-N 3.35Å; E1592-R1595 PolarHBondContact O-N 3.38Å; H1593-R1595 VanDerWaalsContact C-N 3.3Å; H1593-R1595 PolarHBondContact O-N 2.82Å; R1595-Y1599 VanDerWaalsContact O-CB 3.26Å; R1595-Y1599 WeakPolarHBondContact O-CB 3.47Å; R1595-Y1599 PolarHBondContact O-N 3.47Å; R1595-Y1599 VanDerWaalsContact O-N 3.07Å; R1595-D1774 IonicContact CZ-OD2 3.36Å; R1595-D1774 IonicContact NH2-OD1 3.32Å; R1595-D1774 PolarHBondContact NH2-OD1 2.84Å; R1595-D1774 IonicContact NH2-OD2 2.58Å; R1595-D1774 PolarHBondContact NH2-OD2 3.25Å; R1595-F1804 HydrophobicContact CB-CE1 3.9Å; R1595-F1804 HydrophobicContact CB-CE2 4.13Å; R1595-F1804 HydrophobicContact CB-CZ 3.54Å; R1595-F1804 WeakPolarHBondContact CD-O 3.38Å; R1595-F1804 HydrophobicContact CG-CD1 4.2Å; R1595-F1804 HydrophobicContact CG-CE1 3.83Å; R1595-F1804 HydrophobicContact CG-CE2 4.15Å; R1595-F1804 HydrophobicContact CG-CZ 3.8Å; R1595-F1804 PolarHBondContact NE-O 3.34Å; R1595-F1805 HydrophobicContact CG-CD1 3.96Å; R1595-F1805 WeakPolarHBondContact O-CE1 2.94Å; R1595-L1808 HydrophobicContact CB-CD2 4.25Å; R1595-L1808 HydrophobicContact CG-CD1 4.48Å; R1595-L1808 HydrophobicContact CG-CD2 3.73Å; R1595-L1808 HydrophobicContact CG-CG 3.84Å
1596	H	97.8	Very high	96.9	Very high	7 Å²	7	21.4 Å²	21.4	3%	0.032	10%	0.104	C	C	.	.	H	α-helix	trans	-75.1	-41.9	-175.4	-169.8	-134.5	0	0	0	113.4	E1592 H1593 V1594 Y1599 Q1600 S1648 D1649 L1808 Q1812	E1592-H1596 WeakPolarHBondContact O-CB 3.38Å; E1592-H1596 PolarHBondContact O-N 2.96Å; H1593-H1596 PolarHBondContact O-N 3.14Å; V1594-H1596 PolarHBondContact O-N 2.92Å; H1596-Y1599 PolarHBondContact O-N 2.85Å; H1596-Q1600 PolarHBondContact CE1-NE2 3.47Å; H1596-Q1600 PolarHBondContact ND1-NE2 3.42Å; H1596-Q1600 PolarHBondContact NE2-NE2 3.03Å; H1596-Q1600 PolarHBondContact O-N 3.16Å; H1596-Q1600 VanDerWaalsContact O-N 3.13Å; H1596-Q1600 PolarHBondContact O-NE2 3.03Å; H1596-Q1600 VanDerWaalsContact O-NE2 3.16Å; H1596-S1648 PolarHBondContact ND1-OG 3.1Å; H1596-D1649 IonicContact CE1-OD1 3.67Å; H1596-D1649 PolarHBondContact CE1-OD1 3.24Å; H1596-L1808 HydrophobicContact CB-CD2 4.09Å; H1596-Q1812 WeakPolarHBondContact NE2-CB 3.46Å
1597	I	98.4	Very high	96.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.2	-48.1	175.4	-65.8	166.9	0	0	0	109.7	V1577 H1593 Y1599 Q1600 L1601 F1625 I1650 L1701	V1577-I1597 HydrophobicContact CG2-CG2 4.49Å; H1593-I1597 HydrophobicContact CB-CD1 4.37Å; H1593-I1597 WeakPolarHBondContact O-CB 3.43Å; H1593-I1597 WeakPolarHBondContact O-CG1 3.34Å; H1593-I1597 PolarHBondContact O-N 2.67Å; I1597-Y1599 PolarHBondContact O-N 2.87Å; I1597-Q1600 PolarHBondContact O-N 3.24Å; I1597-L1601 WeakPolarHBondContact O-CB 3.16Å; I1597-L1601 PolarHBondContact O-N 3.04Å; I1597-F1625 HydrophobicContact CD1-CE1 3.84Å; I1597-F1625 HydrophobicContact CD1-CZ 3.9Å; I1597-F1625 HydrophobicContact CG1-CE1 4.27Å; I1597-I1650 HydrophobicContact CG1-CG2 4.36Å; I1597-I1650 HydrophobicContact CG2-CD1 4.26Å; I1597-I1650 HydrophobicContact CG2-CG2 4.39Å; I1597-L1701 HydrophobicContact CB-CD1 4.32Å; I1597-L1701 HydrophobicContact CD1-CD2 4.18Å; I1597-L1701 HydrophobicContact CG2-CD1 3.84Å; I1597-L1701 HydrophobicContact CG2-CD2 4.25Å
1598	S	98.5	Very high	97	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66.9	-33.6	-179.6	-55.2	0	0	0	0	113.3	V1594 L1601 C1602 M1698	V1594-S1598 VanDerWaalsContact O-CB 3.3Å; V1594-S1598 WeakPolarHBondContact O-CB 3.21Å; V1594-S1598 PolarHBondContact O-N 3.2Å; V1594-S1598 PolarHBondContact O-OG 3.24Å; S1598-L1601 PolarHBondContact O-N 3.37Å; S1598-C1602 WeakPolarHBondContact O-CB 3.2Å; S1598-C1602 PolarHBondContact O-N 3.38Å; S1598-C1602 PolarHBondContact O-SG 3.43Å; S1598-M1698 WeakPolarHBondContact OG-CG 3.22Å
1599	Y	98	Very high	97.1	Very high	20 Å²	20	16.8 Å²	16.8	8%	0.078	8%	0.08	C	C	.	.	H	α-helix	trans	-65.1	-47.3	174.8	172.9	-103.4	0	0	0	112.2	R1595 H1596 I1597 L1601 C1602 Y1603 L1800 F1805 L1808 Q1812 L1814	R1595-Y1599 VanDerWaalsContact O-CB 3.26Å; R1595-Y1599 WeakPolarHBondContact O-CB 3.47Å; R1595-Y1599 PolarHBondContact O-N 3.47Å; R1595-Y1599 VanDerWaalsContact O-N 3.07Å; H1596-Y1599 PolarHBondContact O-N 2.85Å; I1597-Y1599 PolarHBondContact O-N 2.87Å; Y1599-L1601 VanDerWaalsContact C-N 3.34Å; Y1599-L1601 PolarHBondContact O-N 3.01Å; Y1599-C1602 PolarHBondContact O-N 2.91Å; Y1599-Y1603 WeakPolarHBondContact O-CB 3.38Å; Y1599-Y1603 PolarHBondContact O-N 2.86Å; Y1599-L1800 HydrophobicContact CD2-CD2 3.64Å; Y1599-L1800 HydrophobicContact CE2-CD2 3.66Å; Y1599-L1800 HydrophobicContact CG-CD2 4.49Å; Y1599-F1805 HydrophobicContact CD2-CB 4.04Å; Y1599-F1805 HydrophobicContact CD2-CD1 4.13Å; Y1599-F1805 HydrophobicContact CD2-CD2 4.19Å; Y1599-F1805 AromaticContact CD2-CG 3.88Å; Y1599-F1805 HydrophobicContact CD2-CG 3.88Å; Y1599-F1805 HydrophobicContact CG-CD1 4.36Å; Y1599-L1808 HydrophobicContact CD1-CD1 3.59Å; Y1599-L1808 HydrophobicContact CD2-CD1 3.73Å; Y1599-L1808 HydrophobicContact CE1-CD1 4.21Å; Y1599-L1808 HydrophobicContact CE2-CD1 4.34Å; Y1599-L1808 HydrophobicContact CG-CD1 3.31Å; Y1599-Q1812 WeakPolarHBondContact CE1-O 3.13Å; Y1599-L1814 HydrophobicContact CE1-CB 4.41Å; Y1599-L1814 HydrophobicContact CE1-CG 4.34Å; Y1599-L1814 PolarHBondContact OH-N 2.84Å; Y1599-L1814 PolarHBondContact OH-O 3.41Å
1600	Q	97.6	Very high	97	Very high	6 Å²	6	19.2 Å²	19.2	3%	0.028	9%	0.094	C	C	.	.	H	α-helix	trans	-60.9	-42.2	174.4	-78.5	174.9	86.8	0	0	111.7	L1552 H1596 I1597 Y1603 A1604 S1648 I1650 L1814	L1552-Q1600 HydrophobicContact CD1-CB 3.66Å; L1552-Q1600 HydrophobicContact CD1-CG 3.86Å; L1552-Q1600 WeakPolarHBondContact CD1-O 3.03Å; H1596-Q1600 PolarHBondContact CE1-NE2 3.47Å; H1596-Q1600 PolarHBondContact ND1-NE2 3.42Å; H1596-Q1600 PolarHBondContact NE2-NE2 3.03Å; H1596-Q1600 PolarHBondContact O-N 3.16Å; H1596-Q1600 VanDerWaalsContact O-N 3.13Å; H1596-Q1600 PolarHBondContact O-NE2 3.03Å; H1596-Q1600 VanDerWaalsContact O-NE2 3.16Å; I1597-Q1600 PolarHBondContact O-N 3.24Å; Q1600-Y1603 WeakPolarHBondContact O-CB 3.29Å; Q1600-Y1603 PolarHBondContact O-N 2.88Å; Q1600-Y1603 VanDerWaalsContact O-N 3.14Å; Q1600-A1604 WeakPolarHBondContact O-CB 3.48Å; Q1600-A1604 PolarHBondContact O-N 3.46Å; Q1600-S1648 PolarHBondContact NE2-O 2.89Å; Q1600-I1650 HydrophobicContact CB-CD1 3.73Å; Q1600-I1650 HydrophobicContact CB-CG1 3.57Å; Q1600-I1650 HydrophobicContact CG-CG1 4.3Å; Q1600-L1814 HydrophobicContact CG-CD1 4.44Å
1601	L	98.4	Very high	96.9	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-62	-47.5	176.7	-177	62.6	0	0	0	111.6	I1597 S1598 Y1599 Y1603 A1604 V1605 I1623 I1650 I1694 I1697	I1597-L1601 WeakPolarHBondContact O-CB 3.16Å; I1597-L1601 PolarHBondContact O-N 3.04Å; S1598-L1601 PolarHBondContact O-N 3.37Å; Y1599-L1601 VanDerWaalsContact C-N 3.34Å; Y1599-L1601 PolarHBondContact O-N 3.01Å; L1601-Y1603 PolarHBondContact O-N 3.45Å; L1601-A1604 PolarHBondContact O-N 3.45Å; L1601-V1605 HydrophobicContact CD1-CG2 3.96Å; L1601-V1605 HydrophobicContact CG-CG2 4.48Å; L1601-V1605 WeakPolarHBondContact O-CB 3.43Å; L1601-V1605 WeakPolarHBondContact O-CG2 3.12Å; L1601-V1605 PolarHBondContact O-N 3.06Å; L1601-I1623 HydrophobicContact CD1-CD1 3.66Å; L1601-I1623 HydrophobicContact CD1-CG1 4.05Å; L1601-I1623 HydrophobicContact CD2-CD1 3.66Å; L1601-I1623 HydrophobicContact CG-CD1 4.25Å; L1601-I1650 HydrophobicContact CB-CD1 4.25Å; L1601-I1694 HydrophobicContact CD2-CB 4.47Å; L1601-I1694 HydrophobicContact CD2-CG1 3.87Å; L1601-I1694 HydrophobicContact CD2-CG2 4.25Å; L1601-I1694 HydrophobicContact CG-CD1 4.37Å; L1601-I1694 HydrophobicContact CG-CG1 4.02Å; L1601-I1697 HydrophobicContact CD2-CD1 4.2Å; L1601-I1697 HydrophobicContact CD2-CG2 4.08Å
1602	C	98.1	Very high	96.9	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.8	-31.3	173.6	-71.2	0	0	0	0	112.9	S1598 Y1599 R1606 M1785 L1796 L1800	S1598-C1602 WeakPolarHBondContact O-CB 3.2Å; S1598-C1602 PolarHBondContact O-N 3.38Å; S1598-C1602 PolarHBondContact O-SG 3.43Å; Y1599-C1602 PolarHBondContact O-N 2.91Å; C1602-R1606 WeakPolarHBondContact O-CB 3.09Å; C1602-R1606 PolarHBondContact O-N 2.92Å; C1602-R1606 VanDerWaalsContact O-N 3.16Å; C1602-M1785 VanDerWaalsContact SG-CE 3.57Å; C1602-L1796 HydrophobicContact CB-CD2 4.32Å; C1602-L1800 HydrophobicContact CB-CD2 3.67Å; C1602-L1800 HydrophobicContact CB-CG 4.04Å
1603	Y	96.3	Very high	97	Very high	8 Å²	8	14.9 Å²	14.9	3%	0.031	7%	0.069	C	C	.	.	H	α-helix	trans	-74.8	-45.3	177.3	177.5	-80.4	0	0	0	111.7	E1550 L1552 Y1599 Q1600 L1601 R1606 F1607 L1814 Y1816	E1550-Y1603 WeakPolarHBondContact O-CE1 3.26Å; E1550-Y1603 PolarHBondContact O-OH 3.38Å; L1552-Y1603 HydrophobicContact CD1-CD1 3.7Å; L1552-Y1603 HydrophobicContact CD1-CE1 4.4Å; L1552-Y1603 HydrophobicContact CD1-CG 4.47Å; L1552-Y1603 HydrophobicContact CG-CD1 3.96Å; L1552-Y1603 HydrophobicContact CG-CE1 4.21Å; Y1599-Y1603 WeakPolarHBondContact O-CB 3.38Å; Y1599-Y1603 PolarHBondContact O-N 2.86Å; Q1600-Y1603 WeakPolarHBondContact O-CB 3.29Å; Q1600-Y1603 PolarHBondContact O-N 2.88Å; Q1600-Y1603 VanDerWaalsContact O-N 3.14Å; L1601-Y1603 PolarHBondContact O-N 3.45Å; Y1603-R1606 PolarHBondContact O-N 3.3Å; Y1603-F1607 PolarHBondContact O-N 3.49Å; Y1603-F1607 VanDerWaalsContact O-N 3.15Å; Y1603-L1814 HydrophobicContact CD1-CD1 3.75Å; Y1603-L1814 HydrophobicContact CD2-CB 3.77Å; Y1603-L1814 HydrophobicContact CD2-CD1 4.2Å; Y1603-L1814 HydrophobicContact CE1-CB 4.36Å; Y1603-L1814 HydrophobicContact CE1-CD1 3.9Å; Y1603-L1814 HydrophobicContact CE2-CB 3.45Å; Y1603-L1814 VanDerWaalsContact CE2-CB 3.45Å; Y1603-L1814 HydrophobicContact CE2-CD1 4.32Å; Y1603-L1814 HydrophobicContact CG-CB 4.35Å; Y1603-L1814 HydrophobicContact CG-CD1 3.91Å; Y1603-Y1816 HydrophobicContact CE2-CD2 4.12Å; Y1603-Y1816 HydrophobicContact CE2-CG 4.49Å
1604	A	97.1	Very high	97.1	Very high	3 Å²	3	14 Å²	14	3%	0.025	7%	0.065	C	C	.	.	H	α-helix	trans	-63	-51.9	178.5	0	0	0	0	0	111.6	L1552 Q1600 L1601 R1606 F1607 L1608 L1652	L1552-A1604 HydrophobicContact CB-CB 3.98Å; L1552-A1604 HydrophobicContact CD1-CB 4.4Å; Q1600-A1604 WeakPolarHBondContact O-CB 3.48Å; Q1600-A1604 PolarHBondContact O-N 3.46Å; L1601-A1604 PolarHBondContact O-N 3.45Å; A1604-R1606 VanDerWaalsContact C-N 3.31Å; A1604-R1606 PolarHBondContact O-N 3.4Å; A1604-F1607 WeakPolarHBondContact O-CB 3.34Å; A1604-F1607 PolarHBondContact O-N 2.99Å; A1604-F1607 VanDerWaalsContact O-N 3.08Å; A1604-L1608 PolarHBondContact O-N 3.18Å; A1604-L1652 HydrophobicContact CB-CB 4.41Å; A1604-L1652 HydrophobicContact CB-CD2 4.3Å
1605	V	98	Very high	97.1	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-68.5	-33.1	-178.8	179.1	0	0	0	0	110.9	L1601 F1607 L1608 H1609 L1618 L1652 D1690 I1694 L1796	L1601-V1605 HydrophobicContact CD1-CG2 3.96Å; L1601-V1605 HydrophobicContact CG-CG2 4.48Å; L1601-V1605 WeakPolarHBondContact O-CB 3.43Å; L1601-V1605 WeakPolarHBondContact O-CG2 3.12Å; L1601-V1605 PolarHBondContact O-N 3.06Å; V1605-F1607 VanDerWaalsContact C-N 3.3Å; V1605-F1607 PolarHBondContact O-N 3.48Å; V1605-L1608 WeakPolarHBondContact O-CA 3.41Å; V1605-L1608 WeakPolarHBondContact O-CB 3.3Å; V1605-L1608 PolarHBondContact O-N 2.94Å; V1605-H1609 WeakPolarHBondContact CG1-NE2 3.46Å; V1605-H1609 PolarHBondContact O-CD2 3.39Å; V1605-H1609 PolarHBondContact O-N 3.29Å; V1605-L1618 HydrophobicContact CB-CD1 4.44Å; V1605-L1618 HydrophobicContact CG1-CD1 3.93Å; V1605-L1618 HydrophobicContact CG2-CD1 3.65Å; V1605-L1618 HydrophobicContact CG2-CD2 3.82Å; V1605-L1618 HydrophobicContact CG2-CG 4.41Å; V1605-L1652 HydrophobicContact CG2-CD2 3.86Å; V1605-D1690 HydrophobicContact CG1-CB 3.86Å; V1605-I1694 HydrophobicContact CB-CD1 4.11Å; V1605-I1694 HydrophobicContact CG1-CD1 4.15Å; V1605-I1694 HydrophobicContact CG2-CD1 4.18Å; V1605-L1796 HydrophobicContact CB-CD1 3.73Å; V1605-L1796 HydrophobicContact CG1-CD1 3.58Å
1606	R	96.6	Very high	97.1	Very high	42 Å²	42	13.4 Å²	13.4	16%	0.158	6%	0.063	C	C	.	.	H	α-helix	trans	-58.1	-41.9	170	170.8	173.1	179.1	-178.4	2.5	112	C1602 Y1603 A1604 L1608 H1609 D1610 L1796 L1800 Y1816	C1602-R1606 WeakPolarHBondContact O-CB 3.09Å; C1602-R1606 PolarHBondContact O-N 2.92Å; C1602-R1606 VanDerWaalsContact O-N 3.16Å; Y1603-R1606 PolarHBondContact O-N 3.3Å; A1604-R1606 VanDerWaalsContact C-N 3.31Å; A1604-R1606 PolarHBondContact O-N 3.4Å; R1606-L1608 PolarHBondContact O-N 3.11Å; R1606-H1609 PolarHBondContact O-N 3.06Å; R1606-D1610 WeakPolarHBondContact CG-OD2 3.48Å; R1606-D1610 IonicContact CZ-OD2 2.77Å; R1606-D1610 IonicContact NE-OD1 2.66Å; R1606-D1610 IonicContact NE-OD2 3.15Å; R1606-D1610 PolarHBondContact NE-OD2 3.19Å; R1606-D1610 IonicContact NH2-OD1 3.23Å; R1606-D1610 IonicContact NH2-OD2 3.33Å; R1606-D1610 PolarHBondContact NH2-OD2 3.39Å; R1606-D1610 WeakPolarHBondContact O-CB 3.29Å; R1606-D1610 PolarHBondContact O-N 3.48Å; R1606-L1796 HydrophobicContact CB-CB 3.91Å; R1606-L1796 HydrophobicContact CB-CD1 4.25Å; R1606-L1800 HydrophobicContact CB-CD1 4.24Å; R1606-L1800 VanDerWaalsContact CD-CD1 3.49Å; R1606-L1800 HydrophobicContact CG-CD1 4.44Å; R1606-Y1816 HydrophobicContact CG-CE2 4.26Å; R1606-Y1816 VanDerWaalsContact NH2-CE1 3.26Å
1607	F	95.1	Very high	97.1	Very high	4 Å²	4	14 Å²	14	2%	0.018	7%	0.066	C	C	.	.	H	α-helix	trans	-61.2	-31.9	176.2	171.5	-98.2	0	0	0	111.6	L1542 R1545 H1551 Y1603 A1604 V1605 N1611 Y1819	L1542-F1607 HydrophobicContact CD2-CD1 4.21Å; L1542-F1607 HydrophobicContact CD2-CE1 3.68Å; R1545-F1607 HydrophobicContact CB-CZ 3.99Å; H1551-F1607 HydrophobicContact CB-CB 4.32Å; H1551-F1607 HydrophobicContact CB-CD1 3.48Å; H1551-F1607 VanDerWaalsContact CB-CD1 3.48Å; H1551-F1607 HydrophobicContact CB-CD2 3.9Å; H1551-F1607 HydrophobicContact CB-CE1 3.52Å; H1551-F1607 HydrophobicContact CB-CE2 3.96Å; H1551-F1607 HydrophobicContact CB-CG 3.65Å; H1551-F1607 HydrophobicContact CB-CZ 3.77Å; H1551-F1607 AromaticContact CG-CE1 3.67Å; H1551-F1607 AromaticContact CG-CZ 3.99Å; H1551-F1607 AromaticContact ND1-CE1 3.81Å; Y1603-F1607 PolarHBondContact O-N 3.49Å; Y1603-F1607 VanDerWaalsContact O-N 3.15Å; A1604-F1607 WeakPolarHBondContact O-CB 3.34Å; A1604-F1607 PolarHBondContact O-N 2.99Å; A1604-F1607 VanDerWaalsContact O-N 3.08Å; V1605-F1607 VanDerWaalsContact C-N 3.3Å; V1605-F1607 PolarHBondContact O-N 3.48Å; F1607-N1611 WeakPolarHBondContact CD2-ND2 3.34Å; F1607-N1611 WeakPolarHBondContact CE1-ND2 3.47Å; F1607-N1611 VanDerWaalsContact CE2-ND2 3.28Å; F1607-N1611 WeakPolarHBondContact CE2-ND2 3.49Å; F1607-N1611 VanDerWaalsContact CZ-ND2 3.29Å; F1607-N1611 WeakPolarHBondContact CZ-ND2 3.11Å; F1607-N1611 VanDerWaalsContact O-CB 3.22Å; F1607-N1611 WeakPolarHBondContact O-CB 3.37Å; F1607-N1611 PolarHBondContact O-N 2.79Å; F1607-N1611 PolarHBondContact O-ND2 2.98Å; F1607-Y1819 HydrophobicContact CD2-CE2 4.2Å; F1607-Y1819 AromaticContact CE2-CE2 3.81Å; F1607-Y1819 HydrophobicContact CE2-CE2 3.81Å
1608	L	96.5	Very high	97.1	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-68.1	-48	172.2	-48.4	-178.9	0	0	0	111.2	L1542 A1604 V1605 R1606 N1611 Q1612 L1613 H1615 L1652 F1655	L1542-L1608 HydrophobicContact CD1-CD2 3.94Å; L1542-L1608 HydrophobicContact CD2-CD2 3.66Å; L1542-L1608 HydrophobicContact CG-CD2 4.5Å; A1604-L1608 PolarHBondContact O-N 3.18Å; V1605-L1608 WeakPolarHBondContact O-CA 3.41Å; V1605-L1608 WeakPolarHBondContact O-CB 3.3Å; V1605-L1608 PolarHBondContact O-N 2.94Å; R1606-L1608 PolarHBondContact O-N 3.11Å; L1608-N1611 CarbonylContact O-C 3.46Å; L1608-N1611 WeakPolarHBondContact O-CA 3.32Å; L1608-N1611 WeakPolarHBondContact O-CB 3.41Å; L1608-N1611 PolarHBondContact O-N 3.07Å; L1608-Q1612 PolarHBondContact O-N 2.74Å; L1608-L1613 CarbonylContact C-O 3.55Å; L1608-L1613 HydrophobicContact CB-CB 4.29Å; L1608-L1613 HydrophobicContact CB-CD2 4.22Å; L1608-L1613 WeakPolarHBondContact CB-O 3.32Å; L1608-L1613 HydrophobicContact CD1-CD2 4.5Å; L1608-L1613 HydrophobicContact CD2-CD2 3.96Å; L1608-L1613 HydrophobicContact CG-CD2 4.43Å; L1608-L1613 PolarHBondContact O-N 2.64Å; L1608-L1613 VanDerWaalsContact O-O 3.14Å; L1608-H1615 HydrophobicContact CD1-CB 3.88Å; L1608-L1652 HydrophobicContact CD1-CD2 3.87Å; L1608-F1655 HydrophobicContact CD1-CE1 3.83Å; L1608-F1655 HydrophobicContact CD2-CE1 3.85Å
1609	H	97	Very high	97.1	Very high	20 Å²	20	15.7 Å²	15.7	9%	0.093	7%	0.074	C	C	.	.	H	α-helix	trans	-62.3	-47.3	-179.3	-66.1	179.9	0	0	0	112.7	V1605 R1606 N1611 Q1612 L1613 Q1687 D1690	V1605-H1609 WeakPolarHBondContact CG1-NE2 3.46Å; V1605-H1609 PolarHBondContact O-CD2 3.39Å; V1605-H1609 PolarHBondContact O-N 3.29Å; R1606-H1609 PolarHBondContact O-N 3.06Å; H1609-N1611 PolarHBondContact O-N 2.87Å; H1609-N1611 VanDerWaalsContact O-N 3.1Å; H1609-Q1612 PolarHBondContact O-N 3.03Å; H1609-L1613 PolarHBondContact CD2-O 3.15Å; H1609-L1613 PolarHBondContact N-O 2.81Å; H1609-Q1687 HydrophobicContact CB-CB 4.45Å; H1609-Q1687 HydrophobicContact CB-CG 4.23Å; H1609-Q1687 PolarHBondContact CE1-O 2.88Å; H1609-Q1687 PolarHBondContact NE2-O 2.84Å; H1609-Q1687 PolarHBondContact O-NE2 2.88Å; H1609-D1690 IonicContact CD2-OD2 3.19Å; H1609-D1690 IonicContact CE1-OD2 3.96Å; H1609-D1690 IonicContact NE2-OD2 3.25Å; H1609-D1690 PolarHBondContact NE2-OD2 3.25Å
1610	D	94.4	Very high	97.1	Very high	64 Å²	64	15 Å²	15	34%	0.342	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.5	173.7	-70.6	-48.1	0	0	0	112.2	R1606 Y1816	R1606-D1610 WeakPolarHBondContact CG-OD2 3.48Å; R1606-D1610 IonicContact CZ-OD2 2.77Å; R1606-D1610 IonicContact NE-OD1 2.66Å; R1606-D1610 IonicContact NE-OD2 3.15Å; R1606-D1610 PolarHBondContact NE-OD2 3.19Å; R1606-D1610 IonicContact NH2-OD1 3.23Å; R1606-D1610 IonicContact NH2-OD2 3.33Å; R1606-D1610 PolarHBondContact NH2-OD2 3.39Å; R1606-D1610 WeakPolarHBondContact O-CB 3.29Å; R1606-D1610 PolarHBondContact O-N 3.48Å; D1610-Y1816 WeakPolarHBondContact OD2-CE2 3.19Å; D1610-Y1816 PolarHBondContact OD2-OH 3.22Å
1611	N	94.3	Very high	97	Very high	11 Å²	11	17.3 Å²	17.3	6%	0.059	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	5.1	176.9	-79.7	-43.1	0	0	0	114.6	F1541 R1545 F1607 L1608 H1609	F1541-N1611 HydrophobicContact CE1-CB 4.43Å; R1545-N1611 WeakPolarHBondContact CD-OD1 3.35Å; R1545-N1611 VanDerWaalsContact NH1-CG 3.34Å; R1545-N1611 PolarHBondContact NH1-O 3.05Å; R1545-N1611 PolarHBondContact NH1-OD1 2.99Å; F1607-N1611 WeakPolarHBondContact CD2-ND2 3.34Å; F1607-N1611 WeakPolarHBondContact CE1-ND2 3.47Å; F1607-N1611 VanDerWaalsContact CE2-ND2 3.28Å; F1607-N1611 WeakPolarHBondContact CE2-ND2 3.49Å; F1607-N1611 VanDerWaalsContact CZ-ND2 3.29Å; F1607-N1611 WeakPolarHBondContact CZ-ND2 3.11Å; F1607-N1611 VanDerWaalsContact O-CB 3.22Å; F1607-N1611 WeakPolarHBondContact O-CB 3.37Å; F1607-N1611 PolarHBondContact O-N 2.79Å; F1607-N1611 PolarHBondContact O-ND2 2.98Å; L1608-N1611 CarbonylContact O-C 3.46Å; L1608-N1611 WeakPolarHBondContact O-CA 3.32Å; L1608-N1611 WeakPolarHBondContact O-CB 3.41Å; L1608-N1611 PolarHBondContact O-N 3.07Å; H1609-N1611 PolarHBondContact O-N 2.87Å; H1609-N1611 VanDerWaalsContact O-N 3.1Å
1612	Q	96	Very high	97	Very high	94 Å²	94	17.8 Å²	17.8	44%	0.439	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	32.9	-177.5	-59.7	167	14.2	0	0	114.3	L1608 H1609 F1660 D1661	L1608-Q1612 PolarHBondContact O-N 2.74Å; H1609-Q1612 PolarHBondContact O-N 3.03Å; Q1612-F1660 CarbonylContact O-C 3.32Å; Q1612-F1660 WeakPolarHBondContact O-CA 3.34Å; Q1612-F1660 WeakPolarHBondContact O-CD1 3.23Å; Q1612-D1661 WeakPolarHBondContact CA-OD2 3.26Å; Q1612-D1661 HydrophobicContact CB-CB 4.22Å; Q1612-D1661 VanDerWaalsContact CB-OD2 3.3Å; Q1612-D1661 WeakPolarHBondContact CB-OD2 3.46Å; Q1612-D1661 WeakPolarHBondContact CG-OD2 3.47Å; Q1612-D1661 PolarHBondContact O-N 3.19Å
1613	L	96.7	Very high	97	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.5	179.1	-170.2	89.8	0	0	0	110.4	V1538 L1542 L1608 H1609 F1655 A1658 F1660	V1538-L1613 HydrophobicContact CG1-CD1 4.15Å; V1538-L1613 HydrophobicContact CG1-CD2 3.7Å; V1538-L1613 HydrophobicContact CG2-CD1 4.13Å; L1542-L1613 HydrophobicContact CD2-CD2 4.47Å; L1608-L1613 CarbonylContact C-O 3.55Å; L1608-L1613 HydrophobicContact CB-CB 4.29Å; L1608-L1613 HydrophobicContact CB-CD2 4.22Å; L1608-L1613 WeakPolarHBondContact CB-O 3.32Å; L1608-L1613 HydrophobicContact CD1-CD2 4.5Å; L1608-L1613 HydrophobicContact CD2-CD2 3.96Å; L1608-L1613 HydrophobicContact CG-CD2 4.43Å; L1608-L1613 PolarHBondContact O-N 2.64Å; L1608-L1613 VanDerWaalsContact O-O 3.14Å; H1609-L1613 PolarHBondContact CD2-O 3.15Å; H1609-L1613 PolarHBondContact N-O 2.81Å; L1613-F1655 HydrophobicContact CD2-CD1 4.5Å; L1613-A1658 HydrophobicContact CD1-CB 4.19Å; L1613-A1658 HydrophobicContact CD2-CB 3.95Å; L1613-A1658 HydrophobicContact CG-CB 4.17Å; L1613-F1660 HydrophobicContact CB-CD1 4.25Å; L1613-F1660 HydrophobicContact CB-CE1 4.21Å; L1613-F1660 HydrophobicContact CD1-CD1 3.62Å; L1613-F1660 HydrophobicContact CD1-CD2 4Å; L1613-F1660 HydrophobicContact CD1-CE1 3.51Å; L1613-F1660 HydrophobicContact CD1-CE2 3.94Å; L1613-F1660 HydrophobicContact CD1-CG 3.85Å; L1613-F1660 HydrophobicContact CD1-CZ 3.7Å; L1613-F1660 HydrophobicContact CG-CE1 4.45Å
1614	T	98.1	Very high	97.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.8	170.2	-53.2	0	0	0	0	108.8	T1616 A1658 T1659 W1685 Q1687 D1690	T1614-T1616 HydrophobicContact CG2-CG2 3.89Å; T1614-A1658 CarbonylContact O-C 3.58Å; T1614-A1658 VanDerWaalsContact O-CA 3.27Å; T1614-A1658 WeakPolarHBondContact O-CA 3.28Å; T1614-T1659 PolarHBondContact N-O 3.46Å; T1614-T1659 PolarHBondContact O-N 2.87Å; T1614-W1685 HydrophobicContact CG2-CE3 4.28Å; T1614-W1685 HydrophobicContact CG2-CZ3 4.05Å; T1614-Q1687 WeakPolarHBondContact OG1-CG 3.5Å; T1614-Q1687 PolarHBondContact OG1-N 3.02Å; T1614-D1690 WeakPolarHBondContact CG2-OD2 3.43Å
1615	H	98.1	Very high	97.2	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	9%	0.09	C	C	.	.			trans	-77	-37.4	-177.7	-172.4	-73.6	0	0	0	112.2	L1608 D1617 L1618 I1653 D1654 F1655 S1657 D1690	L1608-H1615 HydrophobicContact CD1-CB 3.88Å; H1615-D1617 PolarHBondContact CE1-O 3.08Å; H1615-D1617 PolarHBondContact ND1-N 2.92Å; H1615-D1617 PolarHBondContact O-N 3.41Å; H1615-L1618 HydrophobicContact CB-CD2 3.84Å; H1615-L1618 HydrophobicContact CB-CG 3.97Å; H1615-L1618 VanDerWaalsContact CG-CD2 3.47Å; H1615-I1653 PolarHBondContact NE2-O 3.22Å; H1615-D1654 PolarHBondContact CE1-O 3.07Å; H1615-D1654 PolarHBondContact NE2-O 2.91Å; H1615-F1655 AromaticContact CD2-CE1 3.76Å; H1615-S1657 CarbonylContact O-C 3.57Å; H1615-D1690 PolarHBondContact N-OD1 2.81Å; H1615-D1690 PolarHBondContact N-OD2 2.84Å
1616	T	97.5	Very high	97.1	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	11%	0.107	C	C	.	.			trans	69.1	-34.9	177.2	89.3	0	0	0	0	116.2	T1614 S1657 V1669 S1670 W1685 D1690	T1614-T1616 HydrophobicContact CG2-CG2 3.89Å; T1616-S1657 WeakPolarHBondContact CG2-O 3.36Å; T1616-S1657 WeakPolarHBondContact OG1-CB 3.38Å; T1616-S1657 PolarHBondContact OG1-O 2.93Å; T1616-V1669 HydrophobicContact CG2-CG1 4.5Å; T1616-S1670 WeakPolarHBondContact O-CA 3.33Å; T1616-S1670 VanDerWaalsContact O-CB 3.22Å; T1616-S1670 WeakPolarHBondContact O-CB 3.14Å; T1616-S1670 PolarHBondContact O-N 2.78Å; T1616-S1670 PolarHBondContact O-OG 3.46Å; T1616-W1685 HydrophobicContact CG2-CE3 4.32Å; T1616-W1685 HydrophobicContact CG2-CH2 3.58Å; T1616-W1685 HydrophobicContact CG2-CZ2 4.46Å; T1616-W1685 HydrophobicContact CG2-CZ3 3.49Å; T1616-W1685 VanDerWaalsContact CG2-CZ3 3.49Å; T1616-D1690 PolarHBondContact N-OD1 3.34Å
1617	D	97.7	Very high	97.1	Very high	18 Å²	18	23.6 Å²	23.6	10%	0.096	12%	0.121	C	C	.	.			trans	-117.8	55.1	178.5	-162.5	41.4	0	0	0	113.6	H1615 K1619 N1622 T1671	H1615-D1617 PolarHBondContact CE1-O 3.08Å; H1615-D1617 PolarHBondContact ND1-N 2.92Å; H1615-D1617 PolarHBondContact O-N 3.41Å; D1617-K1619 PolarHBondContact O-N 3.41Å; D1617-K1619 IonicContact OD1-NZ 2.92Å; D1617-K1619 WeakPolarHBondContact OD2-CE 3.37Å; D1617-K1619 IonicContact OD2-NZ 2.81Å; D1617-K1619 PolarHBondContact OD2-NZ 2.76Å; D1617-N1622 PolarHBondContact O-ND2 2.81Å; D1617-T1671 VanDerWaalsContact OD1-CB 3.28Å; D1617-T1671 WeakPolarHBondContact OD1-CB 3.3Å; D1617-T1671 PolarHBondContact OD1-N 3.06Å; D1617-T1671 PolarHBondContact OD1-OG1 3.23Å; D1617-T1671 PolarHBondContact OD2-OG1 3.1Å
1618	L	98.6	Very high	97.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.127	C	C	.	.			trans	-73.9	120.4	169.7	-65	179	0	0	0	111.2	V1605 H1615 L1652 D1690 I1694 I1697	V1605-L1618 HydrophobicContact CB-CD1 4.44Å; V1605-L1618 HydrophobicContact CG1-CD1 3.93Å; V1605-L1618 HydrophobicContact CG2-CD1 3.65Å; V1605-L1618 HydrophobicContact CG2-CD2 3.82Å; V1605-L1618 HydrophobicContact CG2-CG 4.41Å; H1615-L1618 HydrophobicContact CB-CD2 3.84Å; H1615-L1618 HydrophobicContact CB-CG 3.97Å; H1615-L1618 VanDerWaalsContact CG-CD2 3.47Å; L1618-L1652 HydrophobicContact CD2-CD1 3.59Å; L1618-L1652 HydrophobicContact CD2-CD2 4.18Å; L1618-D1690 HydrophobicContact CD1-CB 3.56Å; L1618-I1694 HydrophobicContact CD1-CD1 4.16Å; L1618-I1694 HydrophobicContact CD1-CG1 3.96Å; L1618-I1697 HydrophobicContact CB-CD1 4.17Å
1619	K	98.3	Very high	97.2	Very high	37 Å²	37	27.8 Å²	27.8	16%	0.161	15%	0.145	C	C	.	.			trans	-154.7	158.7	179	62.6	-168.5	-174.3	-154.4	0	111.2	D1617 E1621 N1622 T1671 Y1674	D1617-K1619 PolarHBondContact O-N 3.41Å; D1617-K1619 IonicContact OD1-NZ 2.92Å; D1617-K1619 WeakPolarHBondContact OD2-CE 3.37Å; D1617-K1619 IonicContact OD2-NZ 2.81Å; D1617-K1619 PolarHBondContact OD2-NZ 2.76Å; K1619-E1621 VanDerWaalsContact CB-OE2 3.22Å; K1619-E1621 WeakPolarHBondContact CB-OE2 3.49Å; K1619-E1621 HydrophobicContact CG-CB 4.2Å; K1619-E1621 WeakPolarHBondContact CG-OE2 3.47Å; K1619-E1621 PolarHBondContact O-N 2.93Å; K1619-E1621 VanDerWaalsContact O-N 3.16Å; K1619-N1622 WeakPolarHBondContact CE-ND2 3.43Å; K1619-N1622 HydrophobicContact CG-CB 4Å; K1619-N1622 PolarHBondContact O-N 2.86Å; K1619-T1671 HydrophobicContact CD-CG2 4.3Å; K1619-T1671 WeakPolarHBondContact CD-OG1 3.33Å; K1619-T1671 PolarHBondContact NZ-OG1 2.93Å; K1619-Y1674 HydrophobicContact CB-CD2 3.67Å; K1619-Y1674 HydrophobicContact CB-CE2 3.4Å; K1619-Y1674 HydrophobicContact CB-CG 4.47Å
1620	P	98.2	Very high	97.1	Very high	4 Å²	4	31.3 Å²	31.3	3%	0.026	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-63.5	-18	-176.3	-19.8	33.1	0	0	0	114.9	V1577 F1578 Y1674 I1697	V1577-P1620 HydrophobicContact CB-CB 4.49Å; V1577-P1620 WeakPolarHBondContact CB-O 3.48Å; V1577-P1620 HydrophobicContact CG1-CB 4.24Å; V1577-P1620 PolarHBondContact N-O 3Å; F1578-P1620 HydrophobicContact CB-CB 4.06Å; F1578-P1620 PolarHBondContact N-O 2.95Å; P1620-Y1674 WeakPolarHBondContact CD-OH 3.41Å; P1620-Y1674 HydrophobicContact CG-CE1 4.28Å; P1620-I1697 HydrophobicContact CG-CG1 4.18Å; P1620-I1697 HydrophobicContact CG-CG2 4.39Å
1621	E	97	Very high	97.2	Very high	55 Å²	55	32.4 Å²	32.4	26%	0.257	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-71	-37.7	171.3	-57.8	81	173.2	0	0	111.4	S1576 F1578 K1619 I1623 L1624	S1576-E1621 WeakPolarHBondContact CB-O 3.33Å; F1578-E1621 HydrophobicContact CB-CB 4.45Å; F1578-E1621 HydrophobicContact CB-CG 3.81Å; F1578-E1621 HydrophobicContact CD1-CG 4Å; F1578-E1621 HydrophobicContact CD2-CG 4.48Å; F1578-E1621 HydrophobicContact CG-CG 3.86Å; K1619-E1621 VanDerWaalsContact CB-OE2 3.22Å; K1619-E1621 WeakPolarHBondContact CB-OE2 3.49Å; K1619-E1621 HydrophobicContact CG-CB 4.2Å; K1619-E1621 WeakPolarHBondContact CG-OE2 3.47Å; K1619-E1621 PolarHBondContact O-N 2.93Å; K1619-E1621 VanDerWaalsContact O-N 3.16Å; E1621-I1623 PolarHBondContact O-N 3.1Å; E1621-L1624 WeakPolarHBondContact O-CD1 3.27Å
1622	N	97.7	Very high	97.1	Very high	11 Å²	11	35.3 Å²	35.3	6%	0.059	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-85	12.2	-178.8	-72.1	-1.4	0	0	0	113.1	D1617 K1619 I1653	D1617-N1622 PolarHBondContact O-ND2 2.81Å; K1619-N1622 WeakPolarHBondContact CE-ND2 3.43Å; K1619-N1622 HydrophobicContact CG-CB 4Å; K1619-N1622 PolarHBondContact O-N 2.86Å; N1622-I1653 HydrophobicContact CB-CG1 4.18Å; N1622-I1653 WeakPolarHBondContact O-CG1 3.38Å; N1622-I1653 PolarHBondContact O-N 3.29Å
1623	I	98.5	Very high	96.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	109.9	175.5	-56.5	166.7	0	0	0	107.5	S1576 V1577 L1601 E1621 I1650 I1697	S1576-I1623 CarbonylContact C-O 3.54Å; S1576-I1623 WeakPolarHBondContact CA-O 3.37Å; V1577-I1623 HydrophobicContact CB-CB 4.41Å; V1577-I1623 HydrophobicContact CG2-CB 4.11Å; V1577-I1623 HydrophobicContact CG2-CG2 3.71Å; V1577-I1623 WeakPolarHBondContact CG2-O 3.3Å; V1577-I1623 PolarHBondContact N-O 3.39Å; L1601-I1623 HydrophobicContact CD1-CD1 3.66Å; L1601-I1623 HydrophobicContact CD1-CG1 4.05Å; L1601-I1623 HydrophobicContact CD2-CD1 3.66Å; L1601-I1623 HydrophobicContact CG-CD1 4.25Å; E1621-I1623 PolarHBondContact O-N 3.1Å; I1623-I1650 HydrophobicContact CG2-CB 3.92Å; I1623-I1650 HydrophobicContact CG2-CD1 3.59Å; I1623-I1650 HydrophobicContact CG2-CG1 4.36Å; I1623-I1650 HydrophobicContact CG2-CG2 3.95Å; I1623-I1697 HydrophobicContact CD1-CD1 4.24Å; I1623-I1697 HydrophobicContact CD1-CG2 4.21Å
1624	L	98.1	Very high	96.6	Very high	32 Å²	32	38.3 Å²	38.3	17%	0.168	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	144.2	-179.6	-85.8	60.8	0	0	0	110.7	L1573 E1621 I1650 R1651 I1653	L1573-L1624 HydrophobicContact CB-CB 4.26Å; L1573-L1624 HydrophobicContact CB-CD2 3.99Å; L1573-L1624 HydrophobicContact CD1-CB 4.07Å; L1573-L1624 HydrophobicContact CD1-CD2 4.11Å; E1621-L1624 WeakPolarHBondContact O-CD1 3.27Å; L1624-I1650 CarbonylContact O-C 3.58Å; L1624-I1650 WeakPolarHBondContact O-CA 3.4Å; L1624-I1650 WeakPolarHBondContact O-CB 3.37Å; L1624-R1651 PolarHBondContact N-O 3.49Å; L1624-R1651 PolarHBondContact O-N 3.46Å; L1624-I1653 HydrophobicContact CD1-CD1 3.54Å; L1624-I1653 HydrophobicContact CD1-CG1 3.9Å; L1624-I1653 HydrophobicContact CD1-CG2 4.27Å; L1624-I1653 HydrophobicContact CD2-CD1 4.41Å; L1624-I1653 HydrophobicContact CD2-CG2 4.42Å
1625	F	98.2	Very high	96	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	143.5	165.7	-70.4	-71.3	0	0	0	110.1	G1574 L1575 V1577 F1580 Y1589 I1597 D1627 V1645 D1649 I1650	G1574-F1625 WeakPolarHBondContact CA-O 3.46Å; G1574-F1625 PolarHBondContact N-O 3.1Å; L1575-F1625 PolarHBondContact O-N 3.25Å; V1577-F1625 HydrophobicContact CB-CE2 4.44Å; V1577-F1625 HydrophobicContact CG2-CD2 4.32Å; V1577-F1625 HydrophobicContact CG2-CE1 4.3Å; V1577-F1625 HydrophobicContact CG2-CE2 3.84Å; V1577-F1625 HydrophobicContact CG2-CZ 3.82Å; F1580-F1625 HydrophobicContact CB-CD2 4.32Å; F1580-F1625 HydrophobicContact CB-CE2 3.81Å; F1580-F1625 HydrophobicContact CD2-CE2 4.45Å; F1580-F1625 HydrophobicContact CG-CE2 4Å; Y1589-F1625 AromaticContact CE1-CZ 3.99Å; Y1589-F1625 HydrophobicContact CE1-CZ 3.99Å; I1597-F1625 HydrophobicContact CD1-CE1 3.84Å; I1597-F1625 HydrophobicContact CD1-CZ 3.9Å; I1597-F1625 HydrophobicContact CG1-CE1 4.27Å; F1625-D1627 VanDerWaalsContact C-N 3.26Å; F1625-V1645 HydrophobicContact CD1-CG2 4.46Å; F1625-V1645 HydrophobicContact CE1-CG1 4.05Å; F1625-V1645 HydrophobicContact CZ-CG1 4.17Å; F1625-D1649 WeakPolarHBondContact CA-O 3.46Å; F1625-I1650 HydrophobicContact CD1-CG2 3.94Å; F1625-I1650 HydrophobicContact CE1-CG2 4.16Å
1626	V	96.9	Very high	95.4	Very high	61 Å²	61	50.5 Å²	50.5	37%	0.37	25%	0.251	S	S	.	.	S	Bend	trans	-61.5	-42.1	168.9	177	0	0	0	0	109.9	D1649 R1651	V1626-D1649 HydrophobicContact CB-CB 4.22Å; V1626-D1649 HydrophobicContact CG2-CB 3.96Å; V1626-D1649 PolarHBondContact N-O 3.1Å; V1626-R1651 HydrophobicContact CG2-CG 4.02Å
1627	D	95.8	Very high	94.8	Very high	82 Å²	82	60.1 Å²	60.1	44%	0.439	29%	0.293	S	S	.	.			trans	-139.8	124.8	169	-179.6	11.1	0	0	0	109.4	F1625 D1629	F1625-D1627 VanDerWaalsContact C-N 3.26Å; D1627-D1629 WeakPolarHBondContact OD1-CB 3.5Å; D1627-D1629 PolarHBondContact OD1-N 3.42Å; D1627-D1629 WeakPolarHBondContact OD2-CB 3.46Å
1628	S	96.5	Very high	94.1	Very high	20 Å²	20	64.3 Å²	64.3	14%	0.14	31%	0.31	C	S	.	.			trans	-94.2	9.5	-179.8	56	0	0	0	0	113.9	L1575 F1580	L1575-S1628 PolarHBondContact N-OG 2.79Å; F1580-S1628 WeakPolarHBondContact CE2-O 3.34Å
1629	D	96.7	Very high	93.4	Very high	73 Å²	73	73.9 Å²	73.9	39%	0.39	35%	0.346	S	S	.	.			trans	-59	141	176.8	-160.3	4.5	0	0	0	111.7	D1627 V1645 K1646	D1627-D1629 WeakPolarHBondContact OD1-CB 3.5Å; D1627-D1629 PolarHBondContact OD1-N 3.42Å; D1627-D1629 WeakPolarHBondContact OD2-CB 3.46Å; D1629-V1645 WeakPolarHBondContact O-CG2 3.3Å; D1629-K1646 HydrophobicContact CB-CD 4.18Å; D1629-K1646 WeakPolarHBondContact O-CG 3.46Å; D1629-K1646 PolarHBondContact O-N 2.66Å; D1629-K1646 WeakPolarHBondContact OD1-CE 3.23Å; D1629-K1646 IonicContact OD1-NZ 2.65Å; D1629-K1646 PolarHBondContact OD1-NZ 2.75Å; D1629-K1646 WeakPolarHBondContact OD2-CE 3.35Å; D1629-K1646 IonicContact OD2-NZ 2.98Å; D1629-K1646 PolarHBondContact OD2-NZ 3.26Å
1630	Y	96.4	Very high	92.8	Very high	94 Å²	94	77 Å²	77	37%	0.369	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	166.3	-165.9	69.4	-90.6	0	0	0	115.1	F1580 R1643 M1644 K1646	F1580-Y1630 HydrophobicContact CE2-CD1 4.4Å; F1580-Y1630 HydrophobicContact CE2-CG 4.43Å; Y1630-R1643 HydrophobicContact CD2-CB 3.82Å; Y1630-R1643 HydrophobicContact CD2-CG 3.76Å; Y1630-R1643 VanDerWaalsContact CE1-NH1 3.34Å; Y1630-R1643 HydrophobicContact CE2-CB 4.3Å; Y1630-R1643 HydrophobicContact CE2-CG 3.7Å; Y1630-R1643 HydrophobicContact CG-CB 4.22Å; Y1630-R1643 HydrophobicContact CG-CG 4.41Å; Y1630-M1644 CarbonylContact C-O 3.59Å; Y1630-M1644 WeakPolarHBondContact CA-O 3.1Å; Y1630-M1644 WeakPolarHBondContact CB-O 3.3Å; Y1630-K1646 WeakPolarHBondContact O-CE 3.49Å
1631	I	95.4	Very high	92.3	Very high	86 Å²	86	82 Å²	82	44%	0.441	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.8	166.2	56.1	172.9	0	0	0	110.8	V1633 M1644 K1646	I1631-V1633 HydrophobicContact CD1-CG2 4.39Å; I1631-V1633 HydrophobicContact CG1-CG2 4.26Å; I1631-M1644 HydrophobicContact CD1-CE 3.88Å; I1631-M1644 HydrophobicContact CG1-CB 4.36Å; I1631-M1644 HydrophobicContact CG1-CE 4.3Å; I1631-M1644 PolarHBondContact N-O 3.03Å; I1631-M1644 PolarHBondContact O-N 2.93Å; I1631-K1646 HydrophobicContact CG2-CG 4.19Å
1632	S	93.4	Very high	92.1	Very high	73 Å²	73	80.5 Å²	80.5	51%	0.51	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	108.5	179.3	180	0	0	0	0	110.3	H1641	S1632-H1641 PolarHBondContact OG-ND1 2.95Å
1633	V	91.6	Very high	91.9	Very high	64 Å²	64	83 Å²	83	39%	0.388	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.1	-176.5	-175.6	0	0	0	0	109.8	I1631 N1635 E1642 M1644	I1631-V1633 HydrophobicContact CD1-CG2 4.39Å; I1631-V1633 HydrophobicContact CG1-CG2 4.26Å; V1633-N1635 PolarHBondContact O-N 2.85Å; V1633-N1635 VanDerWaalsContact O-N 3.17Å; V1633-E1642 PolarHBondContact N-O 3.06Å; V1633-E1642 PolarHBondContact O-N 3Å; V1633-M1644 HydrophobicContact CG2-CB 4.04Å; V1633-M1644 HydrophobicContact CG2-CE 4.15Å; V1633-M1644 HydrophobicContact CG2-SD 4.48Å
1634	H	89.6	Confident	91.7	Very high	92 Å²	92	85.8 Å²	85.8	43%	0.426	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	103.6	178.1	-174.2	90.6	0	0	0	111.5	R1636 H1641	H1634-R1636 PolarHBondContact O-N 2.89Å; H1634-H1641 AromaticContact CE1-NE2 3.99Å; H1634-H1641 AromaticContact CG-NE2 3.84Å; H1634-H1641 AromaticContact ND1-CD2 3.45Å; H1634-H1641 PolarHBondContact ND1-CD2 3.2Å; H1634-H1641 AromaticContact ND1-CE1 3.68Å; H1634-H1641 AromaticContact ND1-NE2 2.97Å; H1634-H1641 PolarHBondContact ND1-NE2 3.01Å
1635	N	86.5	Confident	91.7	Very high	35 Å²	35	84.4 Å²	84.4	19%	0.187	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	91.8	176.2	-170	-34.9	0	0	0	111	V1633 K1637 K1638 R1639 R1640 E1642	V1633-N1635 PolarHBondContact O-N 2.85Å; V1633-N1635 VanDerWaalsContact O-N 3.17Å; N1635-K1637 PolarHBondContact O-N 3.04Å; N1635-K1637 VanDerWaalsContact O-N 3.08Å; N1635-K1637 WeakPolarHBondContact OD1-CB 3.34Å; N1635-K1637 PolarHBondContact OD1-N 2.73Å; N1635-K1638 HydrophobicContact CB-CB 4.33Å; N1635-K1638 WeakPolarHBondContact ND2-CE 3.21Å; N1635-K1638 CarbonylContact O-C 3.56Å; N1635-K1638 PolarHBondContact O-N 3.32Å; N1635-K1638 PolarHBondContact OD1-N 2.81Å; N1635-R1639 PolarHBondContact O-N 3.09Å; N1635-R1640 PolarHBondContact N-O 2.9Å; N1635-E1642 HydrophobicContact CB-CG 4.01Å; N1635-E1642 WeakPolarHBondContact CB-OE2 3.3Å; N1635-E1642 PolarHBondContact ND2-OE2 2.81Å
1636	R	84.7	Confident	91.6	Very high	222 Å²	222	89.9 Å²	89.9	84%	0.838	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-29	178.3	-67.6	-175	178.9	-174.2	0.2	114.4	H1634	H1634-R1636 PolarHBondContact O-N 2.89Å
1637	K	84.6	Confident	91.4	Very high	203 Å²	203	89.2 Å²	89.2	88%	0.883	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-38.9	178.7	-63	-178.5	179.8	177.3	0	111.7	N1635	N1635-K1637 PolarHBondContact O-N 3.04Å; N1635-K1637 VanDerWaalsContact O-N 3.08Å; N1635-K1637 WeakPolarHBondContact OD1-CB 3.34Å; N1635-K1637 PolarHBondContact OD1-N 2.73Å
1638	K	84	Confident	91.5	Very high	106 Å²	106	85.7 Å²	85.7	46%	0.461	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.5	-179.2	-58.6	176.3	-165	161.3	0	113.6	N1635 R1640 E1642	N1635-K1638 HydrophobicContact CB-CB 4.33Å; N1635-K1638 WeakPolarHBondContact ND2-CE 3.21Å; N1635-K1638 CarbonylContact O-C 3.56Å; N1635-K1638 PolarHBondContact O-N 3.32Å; N1635-K1638 PolarHBondContact OD1-N 2.81Å; K1638-R1640 VanDerWaalsContact C-N 3.25Å; K1638-R1640 HydrophobicContact CB-CG 3.98Å; K1638-R1640 PolarHBondContact O-N 2.86Å; K1638-E1642 WeakPolarHBondContact CD-OE1 3.39Å; K1638-E1642 WeakPolarHBondContact CE-OE1 3.46Å; K1638-E1642 IonicContact NZ-OE1 3.55Å; K1638-E1642 PolarHBondContact NZ-OE1 2.98Å; K1638-E1642 IonicContact NZ-OE2 2.93Å; K1638-E1642 PolarHBondContact NZ-OE2 3.11Å
1639	R	83.1	Confident	91.5	Very high	202 Å²	202	88 Å²	88	76%	0.762	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	31.7	-176.9	-57	-173.7	64.6	-163.7	-4	114.5	N1635	N1635-R1639 PolarHBondContact O-N 3.09Å
1640	R	86.6	Confident	91.6	Very high	102 Å²	102	84.7 Å²	84.7	39%	0.385	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	161.3	177.8	69.7	-179.2	-178	-173.7	0.5	111.2	N1635 K1638 E1642	N1635-R1640 PolarHBondContact N-O 2.9Å; K1638-R1640 VanDerWaalsContact C-N 3.25Å; K1638-R1640 HydrophobicContact CB-CG 3.98Å; K1638-R1640 PolarHBondContact O-N 2.86Å; R1640-E1642 HydrophobicContact CG-CG 4.06Å; R1640-E1642 IonicContact CZ-OE1 2.67Å; R1640-E1642 IonicContact NE-OE1 3.39Å; R1640-E1642 PolarHBondContact NE-OE1 2.82Å; R1640-E1642 IonicContact NH2-OE1 3.38Å; R1640-E1642 PolarHBondContact NH2-OE1 2.76Å
1641	H	87.9	Confident	91.6	Very high	109 Å²	109	82.8 Å²	82.8	51%	0.505	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	142	166.4	-72.5	-104.7	0	0	0	109.6	S1632 H1634	S1632-H1641 PolarHBondContact OG-ND1 2.95Å; H1634-H1641 AromaticContact CE1-NE2 3.99Å; H1634-H1641 AromaticContact CG-NE2 3.84Å; H1634-H1641 AromaticContact ND1-CD2 3.45Å; H1634-H1641 PolarHBondContact ND1-CD2 3.2Å; H1634-H1641 AromaticContact ND1-CE1 3.68Å; H1634-H1641 AromaticContact ND1-NE2 2.97Å; H1634-H1641 PolarHBondContact ND1-NE2 3.01Å
1642	E	91.9	Very high	91.8	Very high	24 Å²	24	78.9 Å²	78.9	11%	0.112	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.8	175	-53.3	-166.1	129.5	0	0	106.9	V1587 V1633 N1635 K1638 R1640	V1587-E1642 HydrophobicContact CG1-CG 4.45Å; V1587-E1642 WeakPolarHBondContact CG1-OE1 3.3Å; V1633-E1642 PolarHBondContact N-O 3.06Å; V1633-E1642 PolarHBondContact O-N 3Å; N1635-E1642 HydrophobicContact CB-CG 4.01Å; N1635-E1642 WeakPolarHBondContact CB-OE2 3.3Å; N1635-E1642 PolarHBondContact ND2-OE2 2.81Å; K1638-E1642 WeakPolarHBondContact CD-OE1 3.39Å; K1638-E1642 WeakPolarHBondContact CE-OE1 3.46Å; K1638-E1642 IonicContact NZ-OE1 3.55Å; K1638-E1642 PolarHBondContact NZ-OE1 2.98Å; K1638-E1642 IonicContact NZ-OE2 2.93Å; K1638-E1642 PolarHBondContact NZ-OE2 3.11Å; R1640-E1642 HydrophobicContact CG-CG 4.06Å; R1640-E1642 IonicContact CZ-OE1 2.67Å; R1640-E1642 IonicContact NE-OE1 3.39Å; R1640-E1642 PolarHBondContact NE-OE1 2.82Å; R1640-E1642 IonicContact NH2-OE1 3.38Å; R1640-E1642 PolarHBondContact NH2-OE1 2.76Å
1643	R	94.5	Very high	91.9	Very high	63 Å²	63	77.3 Å²	77.3	24%	0.238	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	143	175.8	-56.1	-172.6	-174.4	-174.5	13.2	109.2	F1580 E1583 N1584 Y1630	F1580-R1643 HydrophobicContact CE1-CB 4.38Å; F1580-R1643 HydrophobicContact CZ-CB 4.04Å; E1583-R1643 IonicContact OE2-CZ 3.88Å; E1583-R1643 IonicContact OE2-NH1 3.86Å; E1583-R1643 PolarHBondContact OE2-NH1 3.14Å; E1583-R1643 IonicContact OE2-NH2 2.79Å; E1583-R1643 PolarHBondContact OE2-NH2 3.37Å; N1584-R1643 HydrophobicContact CB-CB 4.44Å; N1584-R1643 PolarHBondContact ND2-O 3.48Å; N1584-R1643 WeakPolarHBondContact OD1-CB 3.18Å; N1584-R1643 PolarHBondContact OD1-N 3.03Å; Y1630-R1643 HydrophobicContact CD2-CB 3.82Å; Y1630-R1643 HydrophobicContact CD2-CG 3.76Å; Y1630-R1643 VanDerWaalsContact CE1-NH1 3.34Å; Y1630-R1643 HydrophobicContact CE2-CB 4.3Å; Y1630-R1643 HydrophobicContact CE2-CG 3.7Å; Y1630-R1643 HydrophobicContact CG-CB 4.22Å; Y1630-R1643 HydrophobicContact CG-CG 4.41Å
1644	M	94.2	Very high	92.1	Very high	59 Å²	59	75.8 Å²	75.8	29%	0.291	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	118.1	173.5	-169.9	170.9	79.1	0	0	107.9	P1590 Y1630 I1631 V1633	P1590-M1644 HydrophobicContact CG-CG 4.12Å; P1590-M1644 HydrophobicContact CG-SD 3.88Å; Y1630-M1644 CarbonylContact C-O 3.59Å; Y1630-M1644 WeakPolarHBondContact CA-O 3.1Å; Y1630-M1644 WeakPolarHBondContact CB-O 3.3Å; I1631-M1644 HydrophobicContact CD1-CE 3.88Å; I1631-M1644 HydrophobicContact CG1-CB 4.36Å; I1631-M1644 HydrophobicContact CG1-CE 4.3Å; I1631-M1644 PolarHBondContact N-O 3.03Å; I1631-M1644 PolarHBondContact O-N 2.93Å; V1633-M1644 HydrophobicContact CG2-CB 4.04Å; V1633-M1644 HydrophobicContact CG2-CE 4.15Å; V1633-M1644 HydrophobicContact CG2-SD 4.48Å
1645	V	96.6	Very high	92.3	Very high	2 Å²	2	71.4 Å²	71.4	1%	0.012	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	143.8	-179.8	68.4	0	0	0	0	110.3	F1580 H1593 F1625 D1629 C1647	F1580-V1645 HydrophobicContact CE1-CB 4.28Å; F1580-V1645 HydrophobicContact CE2-CB 3.85Å; F1580-V1645 HydrophobicContact CE2-CG2 4.11Å; F1580-V1645 HydrophobicContact CZ-CB 3.72Å; F1580-V1645 HydrophobicContact CZ-CG2 4.47Å; H1593-V1645 PolarHBondContact CE1-O 3.38Å; H1593-V1645 VanDerWaalsContact CE1-O 3.29Å; F1625-V1645 HydrophobicContact CD1-CG2 4.46Å; F1625-V1645 HydrophobicContact CE1-CG1 4.05Å; F1625-V1645 HydrophobicContact CZ-CG1 4.17Å; D1629-V1645 WeakPolarHBondContact O-CG2 3.3Å; V1645-C1647 WeakPolarHBondContact CG1-O 3.19Å; V1645-C1647 WeakPolarHBondContact CG2-O 3.21Å
1646	K	96	Very high	92.6	Very high	116 Å²	116	70.8 Å²	70.8	50%	0.504	31%	0.313	S	S	.	.	S	Bend	trans	-74.3	-39.2	-176	-67.3	174.6	-162.6	174.4	0	111.9	D1629 Y1630 I1631	D1629-K1646 HydrophobicContact CB-CD 4.18Å; D1629-K1646 WeakPolarHBondContact O-CG 3.46Å; D1629-K1646 PolarHBondContact O-N 2.66Å; D1629-K1646 WeakPolarHBondContact OD1-CE 3.23Å; D1629-K1646 IonicContact OD1-NZ 2.65Å; D1629-K1646 PolarHBondContact OD1-NZ 2.75Å; D1629-K1646 WeakPolarHBondContact OD2-CE 3.35Å; D1629-K1646 IonicContact OD2-NZ 2.98Å; D1629-K1646 PolarHBondContact OD2-NZ 3.26Å; Y1630-K1646 WeakPolarHBondContact O-CE 3.49Å; I1631-K1646 HydrophobicContact CG2-CG 4.19Å
1647	C	94	Very high	93	Very high	47 Å²	47	63.1 Å²	63.1	32%	0.318	29%	0.293	S	S	.	.			trans	-119.7	149.7	173.4	-162.5	0	0	0	0	109.3	V1645 D1649	V1645-C1647 WeakPolarHBondContact CG1-O 3.19Å; V1645-C1647 WeakPolarHBondContact CG2-O 3.21Å; C1647-D1649 PolarHBondContact SG-OD1 3.28Å; C1647-D1649 VanDerWaalsContact SG-OD1 3.39Å; C1647-D1649 PolarHBondContact SG-OD2 2.86Å; C1647-D1649 VanDerWaalsContact SG-OD2 3.36Å
1648	S	96.8	Very high	93.5	Very high	8 Å²	8	54.1 Å²	54.1	6%	0.056	26%	0.257	C	S	.	.			trans	-116.3	22.2	176.4	45.5	0	0	0	0	112.1	H1596 Q1600	H1596-S1648 PolarHBondContact ND1-OG 3.1Å; Q1600-S1648 PolarHBondContact NE2-O 2.89Å
1649	D	97.1	Very high	94	Very high	68 Å²	68	50 Å²	50	36%	0.364	24%	0.24	S	C	.	.			trans	-70.5	134	173.5	-63.8	-1.9	0	0	0	109.8	H1596 F1625 V1626 C1647	H1596-D1649 IonicContact CE1-OD1 3.67Å; H1596-D1649 PolarHBondContact CE1-OD1 3.24Å; F1625-D1649 WeakPolarHBondContact CA-O 3.46Å; V1626-D1649 HydrophobicContact CB-CB 4.22Å; V1626-D1649 HydrophobicContact CG2-CB 3.96Å; V1626-D1649 PolarHBondContact N-O 3.1Å; C1647-D1649 PolarHBondContact SG-OD1 3.28Å; C1647-D1649 VanDerWaalsContact SG-OD1 3.39Å; C1647-D1649 PolarHBondContact SG-OD2 2.86Å; C1647-D1649 VanDerWaalsContact SG-OD2 3.36Å
1650	I	98.2	Very high	94.6	Very high	3 Å²	3	41 Å²	41	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	164.4	-174.6	57.3	157.8	0	0	0	113.5	V1577 I1597 Q1600 L1601 I1623 L1624 F1625	V1577-I1650 HydrophobicContact CG2-CG2 4.33Å; I1597-I1650 HydrophobicContact CG1-CG2 4.36Å; I1597-I1650 HydrophobicContact CG2-CD1 4.26Å; I1597-I1650 HydrophobicContact CG2-CG2 4.39Å; Q1600-I1650 HydrophobicContact CB-CD1 3.73Å; Q1600-I1650 HydrophobicContact CB-CG1 3.57Å; Q1600-I1650 HydrophobicContact CG-CG1 4.3Å; L1601-I1650 HydrophobicContact CB-CD1 4.25Å; I1623-I1650 HydrophobicContact CG2-CB 3.92Å; I1623-I1650 HydrophobicContact CG2-CD1 3.59Å; I1623-I1650 HydrophobicContact CG2-CG1 4.36Å; I1623-I1650 HydrophobicContact CG2-CG2 3.95Å; L1624-I1650 CarbonylContact O-C 3.58Å; L1624-I1650 WeakPolarHBondContact O-CA 3.4Å; L1624-I1650 WeakPolarHBondContact O-CB 3.37Å; F1625-I1650 HydrophobicContact CD1-CG2 3.94Å; F1625-I1650 HydrophobicContact CE1-CG2 4.16Å
1651	R	98	Very high	95	Very high	55 Å²	55	39.2 Å²	39.2	21%	0.208	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.8	165	-64.1	-63.9	-178.8	-109.9	15.4	111	E1550 L1552 L1573 L1624 V1626	E1550-R1651 IonicContact OE1-CZ 2.63Å; E1550-R1651 IonicContact OE1-NH1 3.33Å; E1550-R1651 PolarHBondContact OE1-NH1 3.06Å; E1550-R1651 IonicContact OE1-NH2 3.87Å; E1550-R1651 PolarHBondContact OE1-NH2 3.06Å; L1552-R1651 VanDerWaalsContact CD2-NH1 3.27Å; L1552-R1651 CarbonylContact O-C 3.5Å; L1552-R1651 VanDerWaalsContact O-CA 3.23Å; L1552-R1651 WeakPolarHBondContact O-CA 3.43Å; L1552-R1651 WeakPolarHBondContact O-CD 2.85Å; L1573-R1651 HydrophobicContact CD1-CB 3.88Å; L1573-R1651 HydrophobicContact CD1-CG 4.26Å; L1573-R1651 HydrophobicContact CD2-CB 4.45Å; L1573-R1651 HydrophobicContact CD2-CG 3.96Å; L1624-R1651 PolarHBondContact N-O 3.49Å; L1624-R1651 PolarHBondContact O-N 3.46Å; V1626-R1651 HydrophobicContact CG2-CG 4.02Å
1652	L	98.2	Very high	95.2	Very high	4 Å²	4	41 Å²	41	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132.3	173	-179.5	60.7	0	0	0	109.9	L1552 V1554 A1604 V1605 L1608 L1618 F1655	L1552-L1652 PolarHBondContact O-N 3.35Å; V1554-L1652 PolarHBondContact N-O 3.25Å; A1604-L1652 HydrophobicContact CB-CB 4.41Å; A1604-L1652 HydrophobicContact CB-CD2 4.3Å; V1605-L1652 HydrophobicContact CG2-CD2 3.86Å; L1608-L1652 HydrophobicContact CD1-CD2 3.87Å; L1618-L1652 HydrophobicContact CD2-CD1 3.59Å; L1618-L1652 HydrophobicContact CD2-CD2 4.18Å; L1652-F1655 HydrophobicContact CD2-CZ 4.17Å; L1652-F1655 HydrophobicContact CG-CZ 4Å
1653	I	96.7	Very high	95.2	Very high	39 Å²	39	43.5 Å²	43.5	20%	0.2	22%	0.222	C	C	.	.			trans	-123	-178.8	-177.1	71.4	155.7	0	0	0	112.5	V1554 L1573 H1615 N1622 L1624	V1554-I1653 HydrophobicContact CB-CG2 4.13Å; V1554-I1653 HydrophobicContact CG1-CB 4.42Å; V1554-I1653 HydrophobicContact CG1-CG2 4.25Å; L1573-I1653 HydrophobicContact CD1-CG2 4.34Å; H1615-I1653 PolarHBondContact NE2-O 3.22Å; N1622-I1653 HydrophobicContact CB-CG1 4.18Å; N1622-I1653 WeakPolarHBondContact O-CG1 3.38Å; N1622-I1653 PolarHBondContact O-N 3.29Å; L1624-I1653 HydrophobicContact CD1-CD1 3.54Å; L1624-I1653 HydrophobicContact CD1-CG1 3.9Å; L1624-I1653 HydrophobicContact CD1-CG2 4.27Å; L1624-I1653 HydrophobicContact CD2-CD1 4.41Å; L1624-I1653 HydrophobicContact CD2-CG2 4.42Å
1654	D	94.5	Very high	94.9	Very high	33 Å²	33	47 Å²	47	18%	0.176	24%	0.241	C	C	.	.			trans	58.4	75.4	168.9	-158.5	41.3	0	0	0	114.4	K1520 H1615 G1656	K1520-D1654 IonicContact NZ-OD1 3.1Å; K1520-D1654 PolarHBondContact NZ-OD1 3.01Å; H1615-D1654 PolarHBondContact CE1-O 3.07Å; H1615-D1654 PolarHBondContact NE2-O 2.91Å; D1654-G1656 VanDerWaalsContact C-N 3.3Å; D1654-G1656 PolarHBondContact O-N 3.3Å
1655	F	95.3	Very high	94.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.239	C	C	.	.			trans	-90.1	10.9	-177	-69.9	-92.2	0	0	0	113.1	E1535 V1538 L1539 L1542 C1553 V1554 L1608 L1613 H1615 L1652 S1657 A1658	E1535-F1655 HydrophobicContact CG-CB 4.08Å; E1535-F1655 PolarHBondContact OE1-N 2.64Å; V1538-F1655 HydrophobicContact CB-CB 4.43Å; V1538-F1655 HydrophobicContact CG1-CB 3.97Å; V1538-F1655 HydrophobicContact CG1-CD1 3.93Å; V1538-F1655 HydrophobicContact CG1-CG 4.24Å; L1539-F1655 HydrophobicContact CD2-CD2 3.73Å; L1539-F1655 HydrophobicContact CD2-CE2 4.26Å; L1539-F1655 HydrophobicContact CD2-CG 4.34Å; L1539-F1655 HydrophobicContact CG-CD2 4.44Å; L1542-F1655 HydrophobicContact CD1-CD1 3.82Å; L1542-F1655 HydrophobicContact CD1-CE1 3.62Å; L1542-F1655 HydrophobicContact CD1-CG 4.42Å; L1542-F1655 HydrophobicContact CD1-CZ 4.07Å; C1553-F1655 HydrophobicContact CB-CE2 4.09Å; C1553-F1655 HydrophobicContact CB-CZ 3.66Å; V1554-F1655 HydrophobicContact CG1-CE2 4.31Å; L1608-F1655 HydrophobicContact CD1-CE1 3.83Å; L1608-F1655 HydrophobicContact CD2-CE1 3.85Å; L1613-F1655 HydrophobicContact CD2-CD1 4.5Å; H1615-F1655 AromaticContact CD2-CE1 3.76Å; L1652-F1655 HydrophobicContact CD2-CZ 4.17Å; L1652-F1655 HydrophobicContact CG-CZ 4Å; F1655-S1657 PolarHBondContact O-N 2.89Å; F1655-A1658 HydrophobicContact CB-CB 4.21Å; F1655-A1658 HydrophobicContact CD1-CB 4.05Å; F1655-A1658 WeakPolarHBondContact O-CB 3.48Å; F1655-A1658 PolarHBondContact O-N 3.36Å
1656	G	91.6	Very high	94.5	Very high	21 Å²	21	49.4 Å²	49.4	22%	0.216	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.5	-177	0	0	0	0	0	115.5	D1654	D1654-G1656 VanDerWaalsContact C-N 3.3Å; D1654-G1656 PolarHBondContact O-N 3.3Å
1657	S	92.8	Very high	94.4	Very high	62 Å²	62	47.9 Å²	47.9	43%	0.434	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	8.9	171.2	-55.3	0	0	0	0	113.2	H1615 T1616 F1655 T1659	H1615-S1657 CarbonylContact O-C 3.57Å; T1616-S1657 WeakPolarHBondContact CG2-O 3.36Å; T1616-S1657 WeakPolarHBondContact OG1-CB 3.38Å; T1616-S1657 PolarHBondContact OG1-O 2.93Å; F1655-S1657 PolarHBondContact O-N 2.89Å; S1657-T1659 PolarHBondContact O-N 3.08Å; S1657-T1659 PolarHBondContact O-OG1 3.25Å
1658	A	95.3	Very high	94.3	Very high	14 Å²	14	47.7 Å²	47.7	12%	0.116	25%	0.254	C	S	.	.			trans	-74.9	126.8	-179.6	0	0	0	0	0	110.5	V1538 L1613 T1614 F1655	V1538-A1658 HydrophobicContact CG1-CB 4.2Å; L1613-A1658 HydrophobicContact CD1-CB 4.19Å; L1613-A1658 HydrophobicContact CD2-CB 3.95Å; L1613-A1658 HydrophobicContact CG-CB 4.17Å; T1614-A1658 CarbonylContact O-C 3.58Å; T1614-A1658 VanDerWaalsContact O-CA 3.27Å; T1614-A1658 WeakPolarHBondContact O-CA 3.28Å; F1655-A1658 HydrophobicContact CB-CB 4.21Å; F1655-A1658 HydrophobicContact CD1-CB 4.05Å; F1655-A1658 WeakPolarHBondContact O-CB 3.48Å; F1655-A1658 PolarHBondContact O-N 3.36Å
1659	T	95.2	Very high	94.2	Very high	18 Å²	18	48.1 Å²	48.1	11%	0.11	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.9	-169.9	-54	0	0	0	0	110.2	T1614 S1657 D1663 W1685	T1614-T1659 PolarHBondContact N-O 3.46Å; T1614-T1659 PolarHBondContact O-N 2.87Å; S1657-T1659 PolarHBondContact O-N 3.08Å; S1657-T1659 PolarHBondContact O-OG1 3.25Å; T1659-D1663 HydrophobicContact CG2-CB 4.18Å; T1659-W1685 HydrophobicContact CG2-CH2 4.06Å
1660	F	95.5	Very high	94.1	Very high	14 Å²	14	45.2 Å²	45.2	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	148.5	171.8	-73	-72.6	0	0	0	111.7	V1538 F1541 Q1612 L1613 Y1662 D1663 H1665	V1538-F1660 HydrophobicContact CG2-CE2 4.06Å; V1538-F1660 HydrophobicContact CG2-CZ 4.47Å; F1541-F1660 HydrophobicContact CD1-CE1 4.06Å; F1541-F1660 AromaticContact CD1-CZ 3.85Å; F1541-F1660 HydrophobicContact CD1-CZ 3.85Å; F1541-F1660 HydrophobicContact CD2-CE1 4.47Å; F1541-F1660 HydrophobicContact CD2-CZ 4.07Å; F1541-F1660 AromaticContact CE1-CE1 3.43Å; F1541-F1660 HydrophobicContact CE1-CE1 3.43Å; F1541-F1660 VanDerWaalsContact CE1-CE1 3.43Å; F1541-F1660 AromaticContact CE1-CZ 3.72Å; F1541-F1660 HydrophobicContact CE1-CZ 3.72Å; F1541-F1660 AromaticContact CE2-CE1 3.86Å; F1541-F1660 HydrophobicContact CE2-CE1 3.86Å; F1541-F1660 AromaticContact CE2-CZ 3.9Å; F1541-F1660 HydrophobicContact CE2-CZ 3.9Å; F1541-F1660 HydrophobicContact CG-CZ 4.01Å; F1541-F1660 HydrophobicContact CZ-CD1 4.33Å; F1541-F1660 AromaticContact CZ-CE1 3.26Å; F1541-F1660 HydrophobicContact CZ-CE1 3.26Å; F1541-F1660 AromaticContact CZ-CZ 3.69Å; F1541-F1660 HydrophobicContact CZ-CZ 3.69Å; Q1612-F1660 CarbonylContact O-C 3.32Å; Q1612-F1660 WeakPolarHBondContact O-CA 3.34Å; Q1612-F1660 WeakPolarHBondContact O-CD1 3.23Å; L1613-F1660 HydrophobicContact CB-CD1 4.25Å; L1613-F1660 HydrophobicContact CB-CE1 4.21Å; L1613-F1660 HydrophobicContact CD1-CD1 3.62Å; L1613-F1660 HydrophobicContact CD1-CD2 4Å; L1613-F1660 HydrophobicContact CD1-CE1 3.51Å; L1613-F1660 HydrophobicContact CD1-CE2 3.94Å; L1613-F1660 HydrophobicContact CD1-CG 3.85Å; L1613-F1660 HydrophobicContact CD1-CZ 3.7Å; L1613-F1660 HydrophobicContact CG-CE1 4.45Å; F1660-Y1662 HydrophobicContact CB-CD1 4.17Å; F1660-Y1662 HydrophobicContact CB-CD2 3.89Å; F1660-Y1662 HydrophobicContact CB-CE1 3.84Å; F1660-Y1662 HydrophobicContact CB-CE2 3.5Å; F1660-Y1662 HydrophobicContact CB-CG 4.2Å; F1660-Y1662 VanDerWaalsContact CB-CZ 3.48Å; F1660-Y1662 HydrophobicContact CD1-CE1 4.12Å; F1660-Y1662 AromaticContact CD1-CZ 3.87Å; F1660-Y1662 WeakPolarHBondContact CD1-OH 3.28Å; F1660-Y1662 HydrophobicContact CD2-CE2 4.07Å; F1660-Y1662 AromaticContact CD2-CZ 3.93Å; F1660-Y1662 WeakPolarHBondContact CD2-OH 3.16Å; F1660-Y1662 HydrophobicContact CG-CE1 4.06Å; F1660-Y1662 AromaticContact CG-CE2 3.85Å; F1660-Y1662 HydrophobicContact CG-CE2 3.85Å; F1660-Y1662 AromaticContact CG-CZ 3.49Å; F1660-Y1662 VanDerWaalsContact CG-CZ 3.49Å; F1660-Y1662 VanDerWaalsContact CG-OH 3.3Å; F1660-Y1662 WeakPolarHBondContact CG-OH 3.35Å; F1660-Y1662 PolarHBondContact O-N 3.35Å; F1660-D1663 HydrophobicContact CB-CB 4.31Å; F1660-D1663 WeakPolarHBondContact CD2-OD2 3.32Å; F1660-D1663 PolarHBondContact O-N 3.21Å; F1660-H1665 PolarHBondContact O-CE1 2.87Å; F1660-H1665 VanDerWaalsContact O-CE1 3.23Å
1661	D	94.8	Very high	94	Very high	64 Å²	64	46.6 Å²	46.6	34%	0.342	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-17.2	178.6	-65.4	-16.3	0	0	0	113.6	Q1612 Q1687	Q1612-D1661 WeakPolarHBondContact CA-OD2 3.26Å; Q1612-D1661 HydrophobicContact CB-CB 4.22Å; Q1612-D1661 VanDerWaalsContact CB-OD2 3.3Å; Q1612-D1661 WeakPolarHBondContact CB-OD2 3.46Å; Q1612-D1661 WeakPolarHBondContact CG-OD2 3.47Å; Q1612-D1661 PolarHBondContact O-N 3.19Å; D1661-Q1687 PolarHBondContact OD1-NE2 2.79Å; D1661-Q1687 PolarHBondContact OD2-NE2 3.28Å
1662	Y	91.9	Very high	93.9	Very high	147 Å²	147	46.5 Å²	46.5	58%	0.576	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-7.5	177.8	53.4	-109.7	0	0	0	115.3	F1660	F1660-Y1662 HydrophobicContact CB-CD1 4.17Å; F1660-Y1662 HydrophobicContact CB-CD2 3.89Å; F1660-Y1662 HydrophobicContact CB-CE1 3.84Å; F1660-Y1662 HydrophobicContact CB-CE2 3.5Å; F1660-Y1662 HydrophobicContact CB-CG 4.2Å; F1660-Y1662 VanDerWaalsContact CB-CZ 3.48Å; F1660-Y1662 HydrophobicContact CD1-CE1 4.12Å; F1660-Y1662 AromaticContact CD1-CZ 3.87Å; F1660-Y1662 WeakPolarHBondContact CD1-OH 3.28Å; F1660-Y1662 HydrophobicContact CD2-CE2 4.07Å; F1660-Y1662 AromaticContact CD2-CZ 3.93Å; F1660-Y1662 WeakPolarHBondContact CD2-OH 3.16Å; F1660-Y1662 HydrophobicContact CG-CE1 4.06Å; F1660-Y1662 AromaticContact CG-CE2 3.85Å; F1660-Y1662 HydrophobicContact CG-CE2 3.85Å; F1660-Y1662 AromaticContact CG-CZ 3.49Å; F1660-Y1662 VanDerWaalsContact CG-CZ 3.49Å; F1660-Y1662 VanDerWaalsContact CG-OH 3.3Å; F1660-Y1662 WeakPolarHBondContact CG-OH 3.35Å; F1660-Y1662 PolarHBondContact O-N 3.35Å
1663	D	91.7	Very high	93.9	Very high	77 Å²	77	47.6 Å²	47.6	41%	0.412	25%	0.254	S	S	.	.	S	Bend	trans	-88.8	175.2	-177.3	-78.9	-23.4	0	0	0	112.6	T1659 F1660 H1665	T1659-D1663 HydrophobicContact CG2-CB 4.18Å; F1660-D1663 HydrophobicContact CB-CB 4.31Å; F1660-D1663 WeakPolarHBondContact CD2-OD2 3.32Å; F1660-D1663 PolarHBondContact O-N 3.21Å; D1663-H1665 PolarHBondContact O-N 3.16Å; D1663-H1665 PolarHBondContact O-ND1 3.46Å
1664	H	89.2	Confident	94	Very high	136 Å²	136	46 Å²	46	63%	0.63	25%	0.246	S	C	*	.			trans	-66.9	117.3	173.6	175.7	64.2	0	0	0	111.2
1665	H	90.5	Very high	94.2	Very high	53 Å²	53	44.8 Å²	44.8	25%	0.245	24%	0.239	C	C	.	.			trans	-88.3	108.5	174.3	-68.5	51	0	0	0	110.1	F1660 D1663 W1685	F1660-H1665 PolarHBondContact O-CE1 2.87Å; F1660-H1665 VanDerWaalsContact O-CE1 3.23Å; D1663-H1665 PolarHBondContact O-N 3.16Å; D1663-H1665 PolarHBondContact O-ND1 3.46Å; H1665-W1685 HydrophobicContact CB-CH2 3.96Å; H1665-W1685 HydrophobicContact CB-CZ2 3.65Å; H1665-W1685 AromaticContact CD2-CE3 3.85Å; H1665-W1685 AromaticContact CD2-CH2 3.6Å; H1665-W1685 AromaticContact CD2-CZ3 3.5Å; H1665-W1685 VanDerWaalsContact CD2-CZ3 3.5Å; H1665-W1685 WeakPolarHBondContact CD2-CZ3 3.47Å; H1665-W1685 PolarHBondContact CD2-O 2.84Å; H1665-W1685 AromaticContact CG-CH2 3.9Å
1666	S	92.2	Very high	94.3	Very high	58 Å²	58	44.8 Å²	44.8	41%	0.406	24%	0.239	S	C	.	.			trans	-61.5	139.3	176.5	-53.1	0	0	0	0	112.1	I1668 W1685	S1666-I1668 VanDerWaalsContact C-N 3.29Å; S1666-I1668 PolarHBondContact O-N 3.32Å; S1666-W1685 WeakPolarHBondContact O-CZ2 3.39Å; S1666-W1685 PolarHBondContact O-NE1 3.45Å
1667	T	92.8	Very high	94.7	Very high	85 Å²	85	43.8 Å²	43.8	52%	0.521	23%	0.228	S	C	.	.	S	Bend	trans	-57.4	-39.7	-174.6	-50.8	0	0	0	0	113.5	E1682	T1667-E1682 HydrophobicContact CG2-CG 3.97Å
1668	I	92.4	Very high	94.9	Very high	43 Å²	43	40.9 Å²	40.9	22%	0.221	21%	0.208	C	C	.	.	S	Bend	trans	-114.9	124	-178.6	-57.5	-64	0	0	0	109	Y418 S1666 R1675	Y418-I1668 HydrophobicContact CE1-CG1 4.4Å; Y418-I1668 HydrophobicContact CE2-CG1 4.36Å; Y418-I1668 HydrophobicContact CE2-CG2 4.14Å; S1666-I1668 VanDerWaalsContact C-N 3.29Å; S1666-I1668 PolarHBondContact O-N 3.32Å; I1668-R1675 VanDerWaalsContact CG2-CZ 3.49Å; I1668-R1675 VanDerWaalsContact CG2-NH1 3.34Å
1669	V	94	Very high	95	Very high	17 Å²	17	40.2 Å²	40.2	10%	0.103	20%	0.203	C	C	.	.			trans	-138.9	174.6	175.5	-64.4	0	0	0	0	110.5	T1616 R1675 V1679 W1685	T1616-V1669 HydrophobicContact CG2-CG1 4.5Å; V1669-R1675 WeakPolarHBondContact O-CD 3.43Å; V1669-R1675 WeakPolarHBondContact O-CG 3.22Å; V1669-R1675 PolarHBondContact O-NE 3.05Å; V1669-V1679 HydrophobicContact CG2-CG1 4.02Å; V1669-V1679 HydrophobicContact CG2-CG2 4.03Å; V1669-W1685 HydrophobicContact CB-CZ2 4.4Å; V1669-W1685 HydrophobicContact CG1-CH2 4.15Å; V1669-W1685 HydrophobicContact CG1-CZ2 3.44Å; V1669-W1685 VanDerWaalsContact CG1-CZ2 3.44Å; V1669-W1685 HydrophobicContact CG2-CD2 3.89Å; V1669-W1685 HydrophobicContact CG2-CE3 4.47Å; V1669-W1685 HydrophobicContact CG2-CG 4.17Å; V1669-W1685 HydrophobicContact CG2-CZ2 4.09Å
1670	S	96	Very high	95.1	Very high	7 Å²	7	39.5 Å²	39.5	5%	0.049	20%	0.198	C	C	.	.	S	Bend	trans	64.4	134.1	-177.3	-39.6	0	0	0	0	115.3	T1616 R1675	T1616-S1670 WeakPolarHBondContact O-CA 3.33Å; T1616-S1670 VanDerWaalsContact O-CB 3.22Å; T1616-S1670 WeakPolarHBondContact O-CB 3.14Å; T1616-S1670 PolarHBondContact O-N 2.78Å; T1616-S1670 PolarHBondContact O-OG 3.46Å; S1670-R1675 VanDerWaalsContact O-CZ 3.27Å; S1670-R1675 PolarHBondContact O-NE 3Å; S1670-R1675 PolarHBondContact O-NH2 2.58Å
1671	T	94.8	Very high	95.2	Very high	32 Å²	32	38.9 Å²	38.9	20%	0.196	20%	0.195	C	C	.	.			trans	-53.8	138.8	167.1	-63.4	0	0	0	0	110.5	D1617 K1619 H1673 Y1674 R1675	D1617-T1671 VanDerWaalsContact OD1-CB 3.28Å; D1617-T1671 WeakPolarHBondContact OD1-CB 3.3Å; D1617-T1671 PolarHBondContact OD1-N 3.06Å; D1617-T1671 PolarHBondContact OD1-OG1 3.23Å; D1617-T1671 PolarHBondContact OD2-OG1 3.1Å; K1619-T1671 HydrophobicContact CD-CG2 4.3Å; K1619-T1671 WeakPolarHBondContact CD-OG1 3.33Å; K1619-T1671 PolarHBondContact NZ-OG1 2.93Å; T1671-H1673 VanDerWaalsContact C-N 3.34Å; T1671-H1673 PolarHBondContact O-N 2.92Å; T1671-Y1674 HydrophobicContact CG2-CD2 4.14Å; T1671-Y1674 HydrophobicContact CG2-CE2 3.98Å; T1671-Y1674 PolarHBondContact O-N 2.94Å; T1671-R1675 PolarHBondContact O-N 3.02Å
1672	R	97	Very high	95.3	Very high	52 Å²	52	40.3 Å²	40.3	20%	0.196	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-43	-48	-163	172.8	64.1	80.2	-161.5	13.3	115.5	Y1674 T1710 H1711 N1713 H1716	R1672-Y1674 VanDerWaalsContact C-N 3.28Å; R1672-Y1674 PolarHBondContact O-N 2.83Å; R1672-T1710 WeakPolarHBondContact CG-O 3.42Å; R1672-H1711 VanDerWaalsContact CZ-O 3.28Å; R1672-H1711 PolarHBondContact NE-O 3.18Å; R1672-H1711 PolarHBondContact NH2-O 2.94Å; R1672-N1713 PolarHBondContact NH1-OD1 3.11Å; R1672-H1716 PolarHBondContact O-CE1 3.08Å; R1672-H1716 VanDerWaalsContact O-CE1 3.32Å
1673	H	97.6	Very high	95.5	Very high	27 Å²	27	35.9 Å²	35.9	13%	0.125	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-71.8	-18.3	-172.7	-49.5	91	0	0	0	114.4	T1671 T1706 F1708 Q1709	T1671-H1673 VanDerWaalsContact C-N 3.34Å; T1671-H1673 PolarHBondContact O-N 2.92Å; H1673-T1706 HydrophobicContact CB-CG2 4.25Å; H1673-F1708 PolarHBondContact CD2-O 3.38Å; H1673-Q1709 PolarHBondContact NE2-NE2 3.16Å
1674	Y	98.5	Very high	95.7	Very high	5 Å²	5	34.6 Å²	34.6	2%	0.02	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-109.9	-3.5	-176	-39	-74.3	0	0	0	112.1	K1619 P1620 T1671 R1672 A1676 W1692 S1693 C1696 I1697	K1619-Y1674 HydrophobicContact CB-CD2 3.67Å; K1619-Y1674 HydrophobicContact CB-CE2 3.4Å; K1619-Y1674 HydrophobicContact CB-CG 4.47Å; P1620-Y1674 WeakPolarHBondContact CD-OH 3.41Å; P1620-Y1674 HydrophobicContact CG-CE1 4.28Å; T1671-Y1674 HydrophobicContact CG2-CD2 4.14Å; T1671-Y1674 HydrophobicContact CG2-CE2 3.98Å; T1671-Y1674 PolarHBondContact O-N 2.94Å; R1672-Y1674 VanDerWaalsContact C-N 3.28Å; R1672-Y1674 PolarHBondContact O-N 2.83Å; Y1674-A1676 PolarHBondContact O-N 3.23Å; Y1674-W1692 VanDerWaalsContact O-CD1 3.29Å; Y1674-S1693 PolarHBondContact O-OG 2.88Å; Y1674-S1693 VanDerWaalsContact O-OG 3.14Å; Y1674-C1696 HydrophobicContact CD1-CB 3.91Å; Y1674-I1697 HydrophobicContact CD1-CG1 4.05Å; Y1674-I1697 HydrophobicContact CE1-CG1 4.23Å
1675	R	98.6	Very high	96.1	Very high	9 Å²	9	29.2 Å²	29.2	3%	0.034	17%	0.165	C	C	.	.			trans	-66.9	127.8	-174.6	-168.8	176.2	-64.5	169.9	2.4	112.8	I1668 V1669 S1670 T1671 V1679 I1680 W1692	I1668-R1675 VanDerWaalsContact CG2-CZ 3.49Å; I1668-R1675 VanDerWaalsContact CG2-NH1 3.34Å; V1669-R1675 WeakPolarHBondContact O-CD 3.43Å; V1669-R1675 WeakPolarHBondContact O-CG 3.22Å; V1669-R1675 PolarHBondContact O-NE 3.05Å; S1670-R1675 VanDerWaalsContact O-CZ 3.27Å; S1670-R1675 PolarHBondContact O-NE 3Å; S1670-R1675 PolarHBondContact O-NH2 2.58Å; T1671-R1675 PolarHBondContact O-N 3.02Å; R1675-V1679 HydrophobicContact CG-CB 3.92Å; R1675-V1679 HydrophobicContact CG-CG1 3.9Å; R1675-I1680 HydrophobicContact CG-CG1 3.97Å; R1675-W1692 PolarHBondContact O-NE1 2.95Å
1676	A	98.6	Very high	96.4	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.17	C	C	.	.			trans	-73.9	152.2	-177.6	0	0	0	0	0	113.6	Y1674 E1678 V1679 I1680 C1689 W1692	Y1674-A1676 PolarHBondContact O-N 3.23Å; A1676-E1678 VanDerWaalsContact C-N 3.33Å; A1676-E1678 VanDerWaalsContact CB-OE1 3.28Å; A1676-E1678 WeakPolarHBondContact CB-OE1 3.45Å; A1676-E1678 PolarHBondContact O-N 3.32Å; A1676-V1679 HydrophobicContact CB-CG2 4.27Å; A1676-V1679 WeakPolarHBondContact O-CB 3.4Å; A1676-V1679 PolarHBondContact O-N 2.74Å; A1676-V1679 VanDerWaalsContact O-N 3.11Å; A1676-I1680 PolarHBondContact O-N 3.01Å; A1676-C1689 HydrophobicContact CB-CB 3.92Å; A1676-W1692 HydrophobicContact CB-CB 3.82Å; A1676-W1692 HydrophobicContact CB-CD2 4.37Å; A1676-W1692 HydrophobicContact CB-CG 3.78Å
1677	P	98.4	Very high	96.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.3	-34.6	-175.8	24.1	-33.9	0	0	0	113	V1679 I1680 L1681 W1692 M1720 M1731 Y1788	P1677-V1679 VanDerWaalsContact C-N 3.25Å; P1677-V1679 PolarHBondContact O-N 3.31Å; P1677-I1680 PolarHBondContact O-N 2.98Å; P1677-L1681 WeakPolarHBondContact O-CB 3.36Å; P1677-L1681 WeakPolarHBondContact O-CG 3.35Å; P1677-L1681 PolarHBondContact O-N 3.25Å; P1677-W1692 VanDerWaalsContact CD-CD2 3.49Å; P1677-W1692 VanDerWaalsContact CD-CE3 3.48Å; P1677-W1692 HydrophobicContact CG-CD2 4.49Å; P1677-W1692 HydrophobicContact CG-CE3 4.02Å; P1677-W1692 HydrophobicContact CG-CH2 3.9Å; P1677-W1692 HydrophobicContact CG-CZ2 4.4Å; P1677-W1692 HydrophobicContact CG-CZ3 3.7Å; P1677-M1720 HydrophobicContact CB-CE 4.41Å; P1677-M1720 HydrophobicContact CB-SD 3.94Å; P1677-M1731 HydrophobicContact CB-CE 4.34Å; P1677-M1731 HydrophobicContact CG-CE 4.42Å; P1677-Y1788 HydrophobicContact CB-CD1 4.16Å; P1677-Y1788 HydrophobicContact CG-CD1 4.01Å
1678	E	98.4	Very high	97	Very high	1 Å²	1	26 Å²	26	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-64.7	-27.3	176.2	65.1	-82.4	-171.8	0	0	113.7	A1676 E1682 L1683 W1685 P1790 R1793	A1676-E1678 VanDerWaalsContact C-N 3.33Å; A1676-E1678 VanDerWaalsContact CB-OE1 3.28Å; A1676-E1678 WeakPolarHBondContact CB-OE1 3.45Å; A1676-E1678 PolarHBondContact O-N 3.32Å; E1678-E1682 PolarHBondContact O-N 2.99Å; E1678-L1683 HydrophobicContact CB-CB 4.15Å; E1678-L1683 HydrophobicContact CB-CD1 4.5Å; E1678-L1683 PolarHBondContact O-N 2.84Å; E1678-W1685 HydrophobicContact CG-CB 4.27Å; E1678-P1790 HydrophobicContact CB-CG 4.14Å; E1678-P1790 HydrophobicContact CG-CB 4.34Å; E1678-P1790 HydrophobicContact CG-CG 4.05Å; E1678-R1793 IonicContact OE1-CZ 3.49Å; E1678-R1793 IonicContact OE1-NH1 2.73Å; E1678-R1793 PolarHBondContact OE1-NH1 2.84Å; E1678-R1793 IonicContact OE1-NH2 3.59Å; E1678-R1793 IonicContact OE2-CZ 3.56Å; E1678-R1793 IonicContact OE2-NH1 3.23Å; E1678-R1793 PolarHBondContact OE2-NH1 2.71Å; E1678-R1793 IonicContact OE2-NH2 3.42Å; E1678-R1793 PolarHBondContact OE2-NH2 2.81Å
1679	V	97.8	Very high	97.3	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-73.8	-49.6	172.4	-174.3	0	0	0	0	109.9	V1669 R1675 A1676 P1677 L1681 E1682 W1685 C1689	V1669-V1679 HydrophobicContact CG2-CG1 4.02Å; V1669-V1679 HydrophobicContact CG2-CG2 4.03Å; R1675-V1679 HydrophobicContact CG-CB 3.92Å; R1675-V1679 HydrophobicContact CG-CG1 3.9Å; A1676-V1679 HydrophobicContact CB-CG2 4.27Å; A1676-V1679 WeakPolarHBondContact O-CB 3.4Å; A1676-V1679 PolarHBondContact O-N 2.74Å; A1676-V1679 VanDerWaalsContact O-N 3.11Å; P1677-V1679 VanDerWaalsContact C-N 3.25Å; P1677-V1679 PolarHBondContact O-N 3.31Å; V1679-L1681 PolarHBondContact O-N 3.49Å; V1679-E1682 PolarHBondContact O-N 3.41Å; V1679-E1682 VanDerWaalsContact O-N 3.15Å; V1679-W1685 HydrophobicContact CG2-CB 3.82Å; V1679-W1685 HydrophobicContact CG2-CG 3.97Å; V1679-C1689 HydrophobicContact CG2-CB 4.37Å
1680	I	97.6	Very high	97.5	Very high	3 Å²	3	23.2 Å²	23.2	2%	0.015	13%	0.131	C	C	.	.	H	α-helix	trans	-60.8	-27.8	178.6	-60	167.4	0	0	0	111.8	R1675 A1676 P1677 N1713 H1716 L1717 M1720	R1675-I1680 HydrophobicContact CG-CG1 3.97Å; A1676-I1680 PolarHBondContact O-N 3.01Å; P1677-I1680 PolarHBondContact O-N 2.98Å; I1680-N1713 HydrophobicContact CG2-CB 4.03Å; I1680-H1716 HydrophobicContact CD1-CB 4.46Å; I1680-H1716 WeakPolarHBondContact CD1-ND1 3.49Å; I1680-L1717 HydrophobicContact CG2-CD1 4.1Å; I1680-L1717 HydrophobicContact CG2-CD2 4.08Å; I1680-L1717 HydrophobicContact CG2-CG 4Å; I1680-M1720 HydrophobicContact CD1-CE 3.51Å
1681	L	97	Very high	97.7	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	3.7	-178.3	-64.6	-178.4	0	0	0	114.5	P1677 V1679 L1683 L1717 I1727 M1731 S1735 F1739 F1740	P1677-L1681 WeakPolarHBondContact O-CB 3.36Å; P1677-L1681 WeakPolarHBondContact O-CG 3.35Å; P1677-L1681 PolarHBondContact O-N 3.25Å; V1679-L1681 PolarHBondContact O-N 3.49Å; L1681-L1683 VanDerWaalsContact C-N 3.27Å; L1681-L1683 HydrophobicContact CB-CD1 3.93Å; L1681-L1683 HydrophobicContact CB-CG 3.8Å; L1681-L1683 HydrophobicContact CD1-CD1 4.27Å; L1681-L1683 PolarHBondContact O-N 3.16Å; L1681-L1717 HydrophobicContact CD2-CD1 3.76Å; L1681-L1717 HydrophobicContact CD2-CD2 4.14Å; L1681-L1717 HydrophobicContact CG-CD2 4.28Å; L1681-I1727 HydrophobicContact CD1-CG2 4.3Å; L1681-M1731 HydrophobicContact CD1-CB 4.31Å; L1681-M1731 HydrophobicContact CD1-CE 4.31Å; L1681-S1735 WeakPolarHBondContact O-CB 3.49Å; L1681-S1735 PolarHBondContact O-OG 3.31Å; L1681-F1739 HydrophobicContact CD2-CD2 4.46Å; L1681-F1740 HydrophobicContact CD1-CZ 4.48Å; L1681-F1740 HydrophobicContact CD2-CE2 3.47Å; L1681-F1740 VanDerWaalsContact CD2-CE2 3.47Å; L1681-F1740 HydrophobicContact CD2-CZ 3.72Å
1682	E	96.5	Very high	97.9	Very high	95 Å²	95	21.5 Å²	21.5	44%	0.444	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	40.9	179.4	-58.7	173.8	-170.4	0	0	113.2	T1667 E1678 V1679 G1684 T1737	T1667-E1682 HydrophobicContact CG2-CG 3.97Å; E1678-E1682 PolarHBondContact O-N 2.99Å; V1679-E1682 PolarHBondContact O-N 3.41Å; V1679-E1682 VanDerWaalsContact O-N 3.15Å; E1682-G1684 VanDerWaalsContact C-N 3.34Å; E1682-T1737 HydrophobicContact CG-CG2 4.37Å
1683	L	96.3	Very high	98	Very high	54 Å²	54	19 Å²	19	28%	0.283	11%	0.111	S	C	.	.	S	Bend	trans	-90.1	-1	-177.8	-62.2	178.9	0	0	0	113.5	E1678 L1681 M1731 K1734	E1678-L1683 HydrophobicContact CB-CB 4.15Å; E1678-L1683 HydrophobicContact CB-CD1 4.5Å; E1678-L1683 PolarHBondContact O-N 2.84Å; L1681-L1683 VanDerWaalsContact C-N 3.27Å; L1681-L1683 HydrophobicContact CB-CD1 3.93Å; L1681-L1683 HydrophobicContact CB-CG 3.8Å; L1681-L1683 HydrophobicContact CD1-CD1 4.27Å; L1681-L1683 PolarHBondContact O-N 3.16Å; L1683-M1731 HydrophobicContact CD1-CB 3.8Å; L1683-M1731 HydrophobicContact CD1-CE 3.75Å; L1683-M1731 HydrophobicContact CD1-CG 3.93Å; L1683-K1734 HydrophobicContact CD2-CB 3.55Å
1684	G	94.9	Very high	98	Very high	50 Å²	50	17.8 Å²	17.8	52%	0.515	11%	0.105	S	C	.	.			trans	82.6	151.4	-161.4	0	0	0	0	0	111.3	E1682	E1682-G1684 VanDerWaalsContact C-N 3.34Å
1685	W	98	Very high	98	Very high	23 Å²	23	17.5 Å²	17.5	9%	0.087	10%	0.104	C	C	.	.			trans	-139.1	163.9	178.2	58.4	-98.7	0	0	0	110	T1614 T1616 T1659 H1665 S1666 V1669 E1678 V1679 C1689	T1614-W1685 HydrophobicContact CG2-CE3 4.28Å; T1614-W1685 HydrophobicContact CG2-CZ3 4.05Å; T1616-W1685 HydrophobicContact CG2-CE3 4.32Å; T1616-W1685 HydrophobicContact CG2-CH2 3.58Å; T1616-W1685 HydrophobicContact CG2-CZ2 4.46Å; T1616-W1685 HydrophobicContact CG2-CZ3 3.49Å; T1616-W1685 VanDerWaalsContact CG2-CZ3 3.49Å; T1659-W1685 HydrophobicContact CG2-CH2 4.06Å; H1665-W1685 HydrophobicContact CB-CH2 3.96Å; H1665-W1685 HydrophobicContact CB-CZ2 3.65Å; H1665-W1685 AromaticContact CD2-CE3 3.85Å; H1665-W1685 AromaticContact CD2-CH2 3.6Å; H1665-W1685 AromaticContact CD2-CZ3 3.5Å; H1665-W1685 VanDerWaalsContact CD2-CZ3 3.5Å; H1665-W1685 WeakPolarHBondContact CD2-CZ3 3.47Å; H1665-W1685 PolarHBondContact CD2-O 2.84Å; H1665-W1685 AromaticContact CG-CH2 3.9Å; S1666-W1685 WeakPolarHBondContact O-CZ2 3.39Å; S1666-W1685 PolarHBondContact O-NE1 3.45Å; V1669-W1685 HydrophobicContact CB-CZ2 4.4Å; V1669-W1685 HydrophobicContact CG1-CH2 4.15Å; V1669-W1685 HydrophobicContact CG1-CZ2 3.44Å; V1669-W1685 VanDerWaalsContact CG1-CZ2 3.44Å; V1669-W1685 HydrophobicContact CG2-CD2 3.89Å; V1669-W1685 HydrophobicContact CG2-CE3 4.47Å; V1669-W1685 HydrophobicContact CG2-CG 4.17Å; V1669-W1685 HydrophobicContact CG2-CZ2 4.09Å; E1678-W1685 HydrophobicContact CG-CB 4.27Å; V1679-W1685 HydrophobicContact CG2-CB 3.82Å; V1679-W1685 HydrophobicContact CG2-CG 3.97Å; W1685-C1689 HydrophobicContact CB-CB 4.34Å
1686	S	97.9	Very high	98	Very high	49 Å²	49	17.1 Å²	17.1	34%	0.343	10%	0.103	S	C	.	.			trans	-163.2	-162.4	170.4	61.7	0	0	0	0	107.1	P1688 C1689	S1686-P1688 WeakPolarHBondContact O-CD 3.18Å; S1686-P1688 WeakPolarHBondContact OG-CD 3.34Å; S1686-C1689 PolarHBondContact O-N 3.09Å; S1686-C1689 PolarHBondContact O-SG 2.71Å
1687	Q	98.3	Very high	98	Very high	47 Å²	47	17.2 Å²	17.2	22%	0.22	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-29.9	-39.7	177.6	-58.3	172.1	20	0	0	117.4	H1609 T1614 D1661 C1689 D1690	H1609-Q1687 HydrophobicContact CB-CB 4.45Å; H1609-Q1687 HydrophobicContact CB-CG 4.23Å; H1609-Q1687 PolarHBondContact CE1-O 2.88Å; H1609-Q1687 PolarHBondContact NE2-O 2.84Å; H1609-Q1687 PolarHBondContact O-NE2 2.88Å; T1614-Q1687 WeakPolarHBondContact OG1-CG 3.5Å; T1614-Q1687 PolarHBondContact OG1-N 3.02Å; D1661-Q1687 PolarHBondContact OD1-NE2 2.79Å; D1661-Q1687 PolarHBondContact OD2-NE2 3.28Å; Q1687-C1689 PolarHBondContact O-N 2.95Å; Q1687-D1690 PolarHBondContact O-N 3.45Å
1688	P	98.6	Very high	98.1	Very high	33 Å²	33	17.2 Å²	17.2	21%	0.214	10%	0.103	C	C	.	.	H	α-helix	trans	-60.4	-21.9	174.5	-26.3	37.4	0	0	0	116.1	S1686 V1691 W1692 P1790 R1793	S1686-P1688 WeakPolarHBondContact O-CD 3.18Å; S1686-P1688 WeakPolarHBondContact OG-CD 3.34Å; P1688-V1691 WeakPolarHBondContact O-CB 3.32Å; P1688-V1691 PolarHBondContact O-N 3.32Å; P1688-W1692 PolarHBondContact O-N 3.35Å; P1688-P1790 HydrophobicContact CB-CB 3.64Å; P1688-P1790 WeakPolarHBondContact CB-O 3.44Å; P1688-P1790 HydrophobicContact CG-CB 4.09Å; P1688-P1790 WeakPolarHBondContact CG-O 3.29Å; P1688-R1793 WeakPolarHBondContact O-CD 3.47Å; P1688-R1793 PolarHBondContact O-NH1 2.84Å
1689	C	98.5	Very high	98.1	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.1	-40.4	178.6	69.1	0	0	0	0	111.3	A1676 V1679 W1685 S1686 Q1687 V1691 W1692 S1693	A1676-C1689 HydrophobicContact CB-CB 3.92Å; V1679-C1689 HydrophobicContact CG2-CB 4.37Å; W1685-C1689 HydrophobicContact CB-CB 4.34Å; S1686-C1689 PolarHBondContact O-N 3.09Å; S1686-C1689 PolarHBondContact O-SG 2.71Å; Q1687-C1689 PolarHBondContact O-N 2.95Å; C1689-V1691 PolarHBondContact O-N 2.89Å; C1689-W1692 WeakPolarHBondContact O-CB 3.13Å; C1689-W1692 PolarHBondContact O-N 2.82Å; C1689-S1693 PolarHBondContact O-N 2.76Å; C1689-S1693 PolarHBondContact O-OG 3.5Å
1690	D	98.8	Very high	98.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-56.6	-36.7	172.6	-73.3	-20.8	0	0	0	111.9	V1605 H1609 T1614 H1615 T1616 L1618 Q1687 W1692 S1693 I1694	V1605-D1690 HydrophobicContact CG1-CB 3.86Å; H1609-D1690 IonicContact CD2-OD2 3.19Å; H1609-D1690 IonicContact CE1-OD2 3.96Å; H1609-D1690 IonicContact NE2-OD2 3.25Å; H1609-D1690 PolarHBondContact NE2-OD2 3.25Å; T1614-D1690 WeakPolarHBondContact CG2-OD2 3.43Å; H1615-D1690 PolarHBondContact N-OD1 2.81Å; H1615-D1690 PolarHBondContact N-OD2 2.84Å; T1616-D1690 PolarHBondContact N-OD1 3.34Å; L1618-D1690 HydrophobicContact CD1-CB 3.56Å; Q1687-D1690 PolarHBondContact O-N 3.45Å; D1690-W1692 VanDerWaalsContact C-N 3.34Å; D1690-W1692 PolarHBondContact O-N 3.06Å; D1690-S1693 WeakPolarHBondContact O-CB 3.37Å; D1690-S1693 PolarHBondContact O-N 2.84Å; D1690-I1694 VanDerWaalsContact O-CG1 3.26Å; D1690-I1694 WeakPolarHBondContact O-CG1 3.49Å; D1690-I1694 PolarHBondContact O-N 3.33Å
1691	V	98.9	Very high	98.1	Very high	4 Å²	4	17.5 Å²	17.5	2%	0.024	11%	0.105	C	C	.	.	H	α-helix	trans	-64.7	-39	177.9	-176.1	0	0	0	0	111.5	P1688 C1689 I1694 G1695 M1785 R1793 I1794 L1796	P1688-V1691 WeakPolarHBondContact O-CB 3.32Å; P1688-V1691 PolarHBondContact O-N 3.32Å; C1689-V1691 PolarHBondContact O-N 2.89Å; V1691-I1694 PolarHBondContact O-N 3.22Å; V1691-G1695 PolarHBondContact O-N 2.79Å; V1691-M1785 HydrophobicContact CG1-CB 4.06Å; V1691-M1785 HydrophobicContact CG1-CG 3.81Å; V1691-R1793 HydrophobicContact CB-CG 4.38Å; V1691-R1793 HydrophobicContact CG1-CG 4.01Å; V1691-I1794 HydrophobicContact CG1-CG2 4.29Å; V1691-I1794 WeakPolarHBondContact CG1-O 3.35Å; V1691-L1796 HydrophobicContact CG1-CD2 4.39Å; V1691-L1796 HydrophobicContact CG2-CD2 3.97Å; V1691-L1796 HydrophobicContact CG2-CG 3.98Å
1692	W	98.9	Very high	98.2	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.3	-43.2	174.8	177.2	-75.7	0	0	0	111.1	Y1674 R1675 A1676 P1677 P1688 C1689 D1690 I1694 G1695 C1696 F1708 M1720 L1724 L1786 Y1788	Y1674-W1692 VanDerWaalsContact O-CD1 3.29Å; R1675-W1692 PolarHBondContact O-NE1 2.95Å; A1676-W1692 HydrophobicContact CB-CB 3.82Å; A1676-W1692 HydrophobicContact CB-CD2 4.37Å; A1676-W1692 HydrophobicContact CB-CG 3.78Å; P1677-W1692 VanDerWaalsContact CD-CD2 3.49Å; P1677-W1692 VanDerWaalsContact CD-CE3 3.48Å; P1677-W1692 HydrophobicContact CG-CD2 4.49Å; P1677-W1692 HydrophobicContact CG-CE3 4.02Å; P1677-W1692 HydrophobicContact CG-CH2 3.9Å; P1677-W1692 HydrophobicContact CG-CZ2 4.4Å; P1677-W1692 HydrophobicContact CG-CZ3 3.7Å; P1688-W1692 PolarHBondContact O-N 3.35Å; C1689-W1692 WeakPolarHBondContact O-CB 3.13Å; C1689-W1692 PolarHBondContact O-N 2.82Å; D1690-W1692 VanDerWaalsContact C-N 3.34Å; D1690-W1692 PolarHBondContact O-N 3.06Å; W1692-I1694 VanDerWaalsContact C-N 3.33Å; W1692-I1694 PolarHBondContact O-N 3.11Å; W1692-G1695 WeakPolarHBondContact O-CA 3.17Å; W1692-G1695 PolarHBondContact O-N 2.9Å; W1692-C1696 PolarHBondContact O-N 2.96Å; W1692-F1708 AromaticContact CZ2-CE2 3.81Å; W1692-F1708 HydrophobicContact CZ2-CE2 3.81Å; W1692-F1708 HydrophobicContact CZ2-CZ 4.29Å; W1692-M1720 HydrophobicContact CH2-CE 4.29Å; W1692-M1720 HydrophobicContact CH2-CG 4.37Å; W1692-M1720 HydrophobicContact CH2-SD 3.87Å; W1692-M1720 HydrophobicContact CZ2-CE 3.54Å; W1692-M1720 HydrophobicContact CZ2-CG 4.14Å; W1692-M1720 HydrophobicContact CZ2-SD 3.71Å; W1692-L1724 HydrophobicContact CH2-CD1 3.42Å; W1692-L1724 VanDerWaalsContact CH2-CD1 3.42Å; W1692-L1724 HydrophobicContact CZ2-CD1 4.21Å; W1692-L1724 HydrophobicContact CZ3-CD1 4.08Å; W1692-L1786 HydrophobicContact CD2-CD2 3.72Å; W1692-L1786 HydrophobicContact CE3-CB 4.36Å; W1692-L1786 HydrophobicContact CE3-CD2 4.03Å; W1692-L1786 HydrophobicContact CG-CD2 4.09Å; W1692-L1786 HydrophobicContact CH2-CD2 4.49Å; W1692-L1786 HydrophobicContact CZ2-CD2 4.18Å; W1692-L1786 HydrophobicContact CZ3-CB 4.23Å; W1692-L1786 HydrophobicContact CZ3-CD2 4.41Å; W1692-L1786 WeakPolarHBondContact CZ3-O 3.38Å; W1692-Y1788 HydrophobicContact CH2-CE1 4.45Å
1693	S	98.8	Very high	98.2	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.4	-45.5	174.5	-52.3	0	0	0	0	111.4	Y1674 C1689 D1690 G1695 C1696 I1697	Y1674-S1693 PolarHBondContact O-OG 2.88Å; Y1674-S1693 VanDerWaalsContact O-OG 3.14Å; C1689-S1693 PolarHBondContact O-N 2.76Å; C1689-S1693 PolarHBondContact O-OG 3.5Å; D1690-S1693 WeakPolarHBondContact O-CB 3.37Å; D1690-S1693 PolarHBondContact O-N 2.84Å; S1693-G1695 VanDerWaalsContact C-N 3.33Å; S1693-G1695 PolarHBondContact O-N 3.05Å; S1693-C1696 PolarHBondContact O-N 3.26Å; S1693-C1696 VanDerWaalsContact O-N 3.16Å; S1693-I1697 VanDerWaalsContact O-CG1 3.29Å; S1693-I1697 WeakPolarHBondContact O-CG1 3.37Å; S1693-I1697 PolarHBondContact O-N 3.06Å
1694	I	98.9	Very high	98.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-58.1	-44.4	173.2	-67.6	165	0	0	0	110.9	L1601 V1605 L1618 D1690 V1691 W1692 C1696 I1697 M1698 M1785 L1796	L1601-I1694 HydrophobicContact CD2-CB 4.47Å; L1601-I1694 HydrophobicContact CD2-CG1 3.87Å; L1601-I1694 HydrophobicContact CD2-CG2 4.25Å; L1601-I1694 HydrophobicContact CG-CD1 4.37Å; L1601-I1694 HydrophobicContact CG-CG1 4.02Å; V1605-I1694 HydrophobicContact CB-CD1 4.11Å; V1605-I1694 HydrophobicContact CG1-CD1 4.15Å; V1605-I1694 HydrophobicContact CG2-CD1 4.18Å; L1618-I1694 HydrophobicContact CD1-CD1 4.16Å; L1618-I1694 HydrophobicContact CD1-CG1 3.96Å; D1690-I1694 VanDerWaalsContact O-CG1 3.26Å; D1690-I1694 WeakPolarHBondContact O-CG1 3.49Å; D1690-I1694 PolarHBondContact O-N 3.33Å; V1691-I1694 PolarHBondContact O-N 3.22Å; W1692-I1694 VanDerWaalsContact C-N 3.33Å; W1692-I1694 PolarHBondContact O-N 3.11Å; I1694-C1696 VanDerWaalsContact C-N 3.29Å; I1694-C1696 PolarHBondContact O-N 2.97Å; I1694-I1697 PolarHBondContact O-N 3.47Å; I1694-I1697 VanDerWaalsContact O-N 3.14Å; I1694-M1698 HydrophobicContact CG2-CG 4.2Å; I1694-M1698 HydrophobicContact CG2-SD 4.47Å; I1694-M1698 VanDerWaalsContact O-CG 3.3Å; I1694-M1698 WeakPolarHBondContact O-CG 3.48Å; I1694-M1698 PolarHBondContact O-N 3.05Å; I1694-M1785 HydrophobicContact CG2-CE 3.74Å; I1694-M1785 HydrophobicContact CG2-SD 3.88Å; I1694-L1796 HydrophobicContact CD1-CD1 4.08Å; I1694-L1796 HydrophobicContact CD1-CD2 3.91Å
1695	G	98.8	Very high	98.3	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-57.4	-38.9	175.9	0	0	0	0	0	113.6	V1691 W1692 S1693 F1699	V1691-G1695 PolarHBondContact O-N 2.79Å; W1692-G1695 WeakPolarHBondContact O-CA 3.17Å; W1692-G1695 PolarHBondContact O-N 2.9Å; S1693-G1695 VanDerWaalsContact C-N 3.33Å; S1693-G1695 PolarHBondContact O-N 3.05Å; G1695-F1699 PolarHBondContact O-N 3.4Å
1696	C	98.8	Very high	98.3	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.007	7%	0.071	C	C	.	.	H	α-helix	trans	-69.8	-42	173.7	-65.7	0	0	0	0	112.2	Y1674 W1692 S1693 I1694 F1699 E1700	Y1674-C1696 HydrophobicContact CD1-CB 3.91Å; W1692-C1696 PolarHBondContact O-N 2.96Å; S1693-C1696 PolarHBondContact O-N 3.26Å; S1693-C1696 VanDerWaalsContact O-N 3.16Å; I1694-C1696 VanDerWaalsContact C-N 3.29Å; I1694-C1696 PolarHBondContact O-N 2.97Å; C1696-F1699 WeakPolarHBondContact O-CB 3.42Å; C1696-F1699 PolarHBondContact O-N 2.69Å; C1696-E1700 PolarHBondContact O-N 3.41Å; C1696-E1700 VanDerWaalsContact O-N 3.1Å
1697	I	98.8	Very high	98.3	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-63.3	-41.4	176.8	-66.6	162.9	0	0	0	111.3	L1601 L1618 P1620 I1623 Y1674 S1693 I1694 F1699 E1700 L1701	L1601-I1697 HydrophobicContact CD2-CD1 4.2Å; L1601-I1697 HydrophobicContact CD2-CG2 4.08Å; L1618-I1697 HydrophobicContact CB-CD1 4.17Å; P1620-I1697 HydrophobicContact CG-CG1 4.18Å; P1620-I1697 HydrophobicContact CG-CG2 4.39Å; I1623-I1697 HydrophobicContact CD1-CD1 4.24Å; I1623-I1697 HydrophobicContact CD1-CG2 4.21Å; Y1674-I1697 HydrophobicContact CD1-CG1 4.05Å; Y1674-I1697 HydrophobicContact CE1-CG1 4.23Å; S1693-I1697 VanDerWaalsContact O-CG1 3.29Å; S1693-I1697 WeakPolarHBondContact O-CG1 3.37Å; S1693-I1697 PolarHBondContact O-N 3.06Å; I1694-I1697 PolarHBondContact O-N 3.47Å; I1694-I1697 VanDerWaalsContact O-N 3.14Å; I1697-F1699 VanDerWaalsContact C-N 3.27Å; I1697-F1699 PolarHBondContact O-N 2.79Å; I1697-E1700 PolarHBondContact O-N 2.86Å; I1697-L1701 HydrophobicContact CG2-CD1 3.97Å; I1697-L1701 HydrophobicContact CG2-CG 4.21Å; I1697-L1701 WeakPolarHBondContact O-CB 3.32Å; I1697-L1701 VanDerWaalsContact O-CG 3.28Å; I1697-L1701 WeakPolarHBondContact O-CG 3.3Å; I1697-L1701 PolarHBondContact O-N 3.04Å
1698	M	98.8	Very high	98.3	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-58.6	-39.7	175.2	-71.8	-164.3	81.1	0	0	112.1	S1598 I1694 Y1702 L1778 L1781 M1782 M1785 F1804	S1598-M1698 WeakPolarHBondContact OG-CG 3.22Å; I1694-M1698 HydrophobicContact CG2-CG 4.2Å; I1694-M1698 HydrophobicContact CG2-SD 4.47Å; I1694-M1698 VanDerWaalsContact O-CG 3.3Å; I1694-M1698 WeakPolarHBondContact O-CG 3.48Å; I1694-M1698 PolarHBondContact O-N 3.05Å; M1698-Y1702 WeakPolarHBondContact O-CB 3.21Å; M1698-Y1702 PolarHBondContact O-N 3.05Å; M1698-L1778 HydrophobicContact CB-CD1 4.49Å; M1698-L1778 HydrophobicContact CE-CD1 3.37Å; M1698-L1781 HydrophobicContact CE-CD2 3.94Å; M1698-L1781 HydrophobicContact SD-CD2 4.1Å; M1698-L1781 HydrophobicContact SD-CG 4.28Å; M1698-M1782 HydrophobicContact CB-CG 3.77Å; M1698-M1782 HydrophobicContact CB-SD 3.75Å; M1698-M1782 HydrophobicContact SD-CG 4.29Å; M1698-M1785 HydrophobicContact SD-CE 4.01Å; M1698-M1785 HydrophobicContact SD-SD 3.55Å; M1698-F1804 HydrophobicContact CE-CD1 3.93Å; M1698-F1804 HydrophobicContact CE-CE1 3.54Å; M1698-F1804 HydrophobicContact CE-CZ 4.49Å
1699	F	98.6	Very high	98.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-64.4	-49.4	176.1	177.5	-89.9	0	0	0	111.2	G1695 C1696 I1697 Y1702 T1703 Y1705 L1707 L1764 Y1767 M1782	G1695-F1699 PolarHBondContact O-N 3.4Å; C1696-F1699 WeakPolarHBondContact O-CB 3.42Å; C1696-F1699 PolarHBondContact O-N 2.69Å; I1697-F1699 VanDerWaalsContact C-N 3.27Å; I1697-F1699 PolarHBondContact O-N 2.79Å; F1699-Y1702 PolarHBondContact O-N 3.43Å; F1699-Y1702 VanDerWaalsContact O-N 3.14Å; F1699-T1703 HydrophobicContact CD1-CG2 4Å; F1699-T1703 HydrophobicContact CD2-CG2 4.09Å; F1699-T1703 HydrophobicContact CE1-CG2 3.66Å; F1699-T1703 HydrophobicContact CE2-CG2 3.76Å; F1699-T1703 HydrophobicContact CG-CG2 4.23Å; F1699-T1703 HydrophobicContact CZ-CG2 3.55Å; F1699-T1703 WeakPolarHBondContact O-CG2 3.37Å; F1699-T1703 PolarHBondContact O-N 3.48Å; F1699-T1703 PolarHBondContact O-OG1 3.1Å; F1699-Y1705 WeakPolarHBondContact CD1-O 3.13Å; F1699-Y1705 HydrophobicContact CE1-CD2 4.12Å; F1699-Y1705 AromaticContact CE1-CE2 3.76Å; F1699-Y1705 HydrophobicContact CE1-CE2 3.76Å; F1699-Y1705 WeakPolarHBondContact CE1-O 3.31Å; F1699-Y1705 AromaticContact CZ-CE2 3.96Å; F1699-Y1705 HydrophobicContact CZ-CE2 3.96Å; F1699-L1707 HydrophobicContact CB-CB 4.39Å; F1699-L1707 HydrophobicContact CD1-CB 3.66Å; F1699-L1707 HydrophobicContact CD1-CD1 3.97Å; F1699-L1707 HydrophobicContact CD1-CG 4.35Å; F1699-L1707 HydrophobicContact CD2-CD1 3.78Å; F1699-L1707 HydrophobicContact CE1-CB 4.03Å; F1699-L1707 HydrophobicContact CE1-CD1 3.83Å; F1699-L1707 HydrophobicContact CE2-CD1 3.62Å; F1699-L1707 HydrophobicContact CG-CB 4.04Å; F1699-L1707 HydrophobicContact CG-CD1 3.92Å; F1699-L1707 HydrophobicContact CG-CG 4.39Å; F1699-L1707 HydrophobicContact CZ-CD1 3.63Å; F1699-L1764 HydrophobicContact CD2-CD1 4.12Å; F1699-L1764 HydrophobicContact CE2-CD1 4.32Å; F1699-Y1767 AromaticContact CE2-CD1 3.87Å; F1699-Y1767 HydrophobicContact CE2-CD1 3.87Å; F1699-Y1767 AromaticContact CE2-CD2 3.57Å; F1699-Y1767 HydrophobicContact CE2-CD2 3.57Å; F1699-Y1767 HydrophobicContact CE2-CE1 4.38Å; F1699-Y1767 HydrophobicContact CE2-CE2 4.08Å; F1699-Y1767 AromaticContact CE2-CG 3.44Å; F1699-Y1767 HydrophobicContact CE2-CG 3.44Å; F1699-Y1767 VanDerWaalsContact CE2-CG 3.44Å; F1699-Y1767 AromaticContact CZ-CD1 3.62Å; F1699-Y1767 HydrophobicContact CZ-CD1 3.62Å; F1699-Y1767 AromaticContact CZ-CD2 3.99Å; F1699-Y1767 HydrophobicContact CZ-CD2 3.99Å; F1699-Y1767 AromaticContact CZ-CE1 3.83Å; F1699-Y1767 HydrophobicContact CZ-CE1 3.83Å; F1699-Y1767 HydrophobicContact CZ-CE2 4.15Å; F1699-Y1767 AromaticContact CZ-CG 3.72Å; F1699-Y1767 HydrophobicContact CZ-CG 3.72Å; F1699-M1782 VanDerWaalsContact CA-SD 3.58Å; F1699-M1782 HydrophobicContact CB-SD 3.86Å; F1699-M1782 PolarHBondContact N-SD 2.72Å; F1699-M1782 VanDerWaalsContact N-SD 3.38Å
1700	E	98.4	Very high	98	Very high	7 Å²	7	10.7 Å²	10.7	3%	0.033	5%	0.049	C	C	.	.	H	α-helix	trans	-66.6	-41.2	-177.8	178.8	149.8	-148.9	0	0	112.9	L1581 C1696 I1697 Y1702 T1703 G1704 T1706	L1581-E1700 HydrophobicContact CD2-CG 4.21Å; C1696-E1700 PolarHBondContact O-N 3.41Å; C1696-E1700 VanDerWaalsContact O-N 3.1Å; I1697-E1700 PolarHBondContact O-N 2.86Å; E1700-Y1702 PolarHBondContact O-N 2.83Å; E1700-T1703 PolarHBondContact O-N 3.36Å; E1700-G1704 WeakPolarHBondContact O-CA 3.3Å; E1700-G1704 PolarHBondContact O-N 3.46Å; E1700-T1706 PolarHBondContact OE1-N 3.22Å; E1700-T1706 WeakPolarHBondContact OE2-CG2 3.26Å
1701	L	98.4	Very high	97.7	Very high	4 Å²	4	15.4 Å²	15.4	2%	0.021	7%	0.071	C	C	.	.	H	α-helix	trans	-51.3	-44.9	169.2	-79.6	172.6	0	0	0	111.4	V1577 G1588 Y1589 V1594 I1597 I1697	V1577-L1701 HydrophobicContact CG1-CD2 3.52Å; G1588-L1701 CarbonylContact C-O 3.58Å; G1588-L1701 WeakPolarHBondContact CA-O 3.32Å; Y1589-L1701 HydrophobicContact CD2-CD2 3.55Å; Y1589-L1701 HydrophobicContact CE2-CD2 3.66Å; Y1589-L1701 HydrophobicContact CG-CD2 4.4Å; Y1589-L1701 PolarHBondContact N-O 3.34Å; V1594-L1701 HydrophobicContact CG1-CB 4.18Å; V1594-L1701 HydrophobicContact CG2-CB 4.25Å; I1597-L1701 HydrophobicContact CB-CD1 4.32Å; I1597-L1701 HydrophobicContact CD1-CD2 4.18Å; I1597-L1701 HydrophobicContact CG2-CD1 3.84Å; I1597-L1701 HydrophobicContact CG2-CD2 4.25Å; I1697-L1701 HydrophobicContact CG2-CD1 3.97Å; I1697-L1701 HydrophobicContact CG2-CG 4.21Å; I1697-L1701 WeakPolarHBondContact O-CB 3.32Å; I1697-L1701 VanDerWaalsContact O-CG 3.28Å; I1697-L1701 WeakPolarHBondContact O-CG 3.3Å; I1697-L1701 PolarHBondContact O-N 3.04Å
1702	Y	98	Very high	97.5	Very high	10 Å²	10	18.8 Å²	18.8	4%	0.039	9%	0.089	C	C	.	.	H	α-helix	trans	-75.5	-45.3	-179.8	177.2	-103.4	0	0	0	113.2	M1591 M1698 F1699 E1700 K1769 T1775 L1778 F1779	M1591-Y1702 HydrophobicContact CE-CD2 4.05Å; M1591-Y1702 HydrophobicContact CE-CE2 3.59Å; M1698-Y1702 WeakPolarHBondContact O-CB 3.21Å; M1698-Y1702 PolarHBondContact O-N 3.05Å; F1699-Y1702 PolarHBondContact O-N 3.43Å; F1699-Y1702 VanDerWaalsContact O-N 3.14Å; E1700-Y1702 PolarHBondContact O-N 2.83Å; Y1702-K1769 HydrophobicContact CE1-CB 4.46Å; Y1702-K1769 HydrophobicContact CE1-CD 3.87Å; Y1702-K1769 HydrophobicContact CE1-CG 3.8Å; Y1702-K1769 HydrophobicContact CE2-CD 4.45Å; Y1702-K1769 PolarHBondContact O-NZ 2.81Å; Y1702-K1769 WeakPolarHBondContact OH-CB 3.35Å; Y1702-K1769 PolarHBondContact OH-N 3.19Å; Y1702-T1775 VanDerWaalsContact OH-CG2 3.27Å; Y1702-T1775 WeakPolarHBondContact OH-CG2 3.44Å; Y1702-T1775 PolarHBondContact OH-OG1 3.13Å; Y1702-L1778 HydrophobicContact CD2-CD2 3.49Å; Y1702-L1778 VanDerWaalsContact CD2-CD2 3.49Å; Y1702-L1778 HydrophobicContact CE2-CD2 4.01Å; Y1702-L1778 HydrophobicContact CG-CD2 3.76Å; Y1702-F1779 AromaticContact CD1-CE2 3.84Å; Y1702-F1779 HydrophobicContact CD1-CE2 3.84Å; Y1702-F1779 HydrophobicContact CD1-CZ 4.07Å; Y1702-F1779 AromaticContact CE1-CE2 3.57Å; Y1702-F1779 HydrophobicContact CE1-CE2 3.57Å; Y1702-F1779 AromaticContact CE1-CZ 3.91Å; Y1702-F1779 HydrophobicContact CE1-CZ 3.91Å
1703	T	97	Very high	97.4	Very high	10 Å²	10	20 Å²	20	6%	0.061	10%	0.096	C	C	.	.	H	α-helix	trans	-81	-46.9	-172.8	58.1	0	0	0	0	112.5	F1699 E1700 Y1705 K1769	F1699-T1703 HydrophobicContact CD1-CG2 4Å; F1699-T1703 HydrophobicContact CD2-CG2 4.09Å; F1699-T1703 HydrophobicContact CE1-CG2 3.66Å; F1699-T1703 HydrophobicContact CE2-CG2 3.76Å; F1699-T1703 HydrophobicContact CG-CG2 4.23Å; F1699-T1703 HydrophobicContact CZ-CG2 3.55Å; F1699-T1703 WeakPolarHBondContact O-CG2 3.37Å; F1699-T1703 PolarHBondContact O-N 3.48Å; F1699-T1703 PolarHBondContact O-OG1 3.1Å; E1700-T1703 PolarHBondContact O-N 3.36Å; T1703-Y1705 HydrophobicContact CG2-CE1 4.32Å; T1703-Y1705 PolarHBondContact OG1-N 3Å; T1703-Y1705 VanDerWaalsContact OG1-N 3.1Å; T1703-Y1705 PolarHBondContact OG1-O 3.47Å; T1703-K1769 PolarHBondContact O-NZ 3.26Å; T1703-K1769 VanDerWaalsContact O-NZ 3.11Å
1704	G	96.7	Very high	97.3	Very high	2 Å²	2	23.3 Å²	23.3	2%	0.021	11%	0.108	C	C	.	.	S	Bend	trans	102.5	7.3	-164.4	0	0	0	0	0	114.7	E1700	E1700-G1704 WeakPolarHBondContact O-CA 3.3Å; E1700-G1704 PolarHBondContact O-N 3.46Å
1705	Y	96.4	Very high	97.2	Very high	104 Å²	104	24.6 Å²	24.6	41%	0.408	11%	0.114	S	C	.	.	S	Bend	trans	-156.2	153.8	-178.6	60	-96.5	0	0	0	112.7	F1699 T1703 Y1767	F1699-Y1705 WeakPolarHBondContact CD1-O 3.13Å; F1699-Y1705 HydrophobicContact CE1-CD2 4.12Å; F1699-Y1705 AromaticContact CE1-CE2 3.76Å; F1699-Y1705 HydrophobicContact CE1-CE2 3.76Å; F1699-Y1705 WeakPolarHBondContact CE1-O 3.31Å; F1699-Y1705 AromaticContact CZ-CE2 3.96Å; F1699-Y1705 HydrophobicContact CZ-CE2 3.96Å; T1703-Y1705 HydrophobicContact CG2-CE1 4.32Å; T1703-Y1705 PolarHBondContact OG1-N 3Å; T1703-Y1705 VanDerWaalsContact OG1-N 3.1Å; T1703-Y1705 PolarHBondContact OG1-O 3.47Å; Y1705-Y1767 HydrophobicContact CE2-CE1 4.47Å; Y1705-Y1767 WeakPolarHBondContact OH-CD1 3.5Å
1706	T	97.7	Very high	97.1	Very high	16 Å²	16	24.6 Å²	24.6	10%	0.098	11%	0.114	C	C	.	.			trans	-55.3	151.1	-177.9	76.2	0	0	0	0	114	H1673 E1700 Q1709	H1673-T1706 HydrophobicContact CB-CG2 4.25Å; E1700-T1706 PolarHBondContact OE1-N 3.22Å; E1700-T1706 WeakPolarHBondContact OE2-CG2 3.26Å; T1706-Q1709 PolarHBondContact OG1-OE1 3.11Å
1707	L	98.1	Very high	97.1	Very high	5 Å²	5	24.6 Å²	24.6	3%	0.026	11%	0.114	C	C	.	.	S	Bend	trans	-74.7	-36.6	176.8	-178	56.8	0	0	0	112.9	F1699 T1723 L1764 Y1767 L1786	F1699-L1707 HydrophobicContact CB-CB 4.39Å; F1699-L1707 HydrophobicContact CD1-CB 3.66Å; F1699-L1707 HydrophobicContact CD1-CD1 3.97Å; F1699-L1707 HydrophobicContact CD1-CG 4.35Å; F1699-L1707 HydrophobicContact CD2-CD1 3.78Å; F1699-L1707 HydrophobicContact CE1-CB 4.03Å; F1699-L1707 HydrophobicContact CE1-CD1 3.83Å; F1699-L1707 HydrophobicContact CE2-CD1 3.62Å; F1699-L1707 HydrophobicContact CG-CB 4.04Å; F1699-L1707 HydrophobicContact CG-CD1 3.92Å; F1699-L1707 HydrophobicContact CG-CG 4.39Å; F1699-L1707 HydrophobicContact CZ-CD1 3.63Å; L1707-T1723 HydrophobicContact CD1-CG2 4.17Å; L1707-L1764 HydrophobicContact CD1-CD1 4.2Å; L1707-Y1767 HydrophobicContact CD1-CE2 4.37Å; L1707-L1786 HydrophobicContact CD2-CD1 3.53Å
1708	F	98.1	Very high	97	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	11%	0.114	C	C	.	.			trans	-128.8	68.5	-171.4	-59.5	-57.5	0	0	0	111.7	H1673 W1692 T1710 H1716 M1719 M1720 T1723 L1724	H1673-F1708 PolarHBondContact CD2-O 3.38Å; W1692-F1708 AromaticContact CZ2-CE2 3.81Å; W1692-F1708 HydrophobicContact CZ2-CE2 3.81Å; W1692-F1708 HydrophobicContact CZ2-CZ 4.29Å; F1708-T1710 VanDerWaalsContact C-N 3.34Å; F1708-T1710 PolarHBondContact O-N 3Å; F1708-H1716 VanDerWaalsContact CB-NE2 3.3Å; F1708-H1716 WeakPolarHBondContact CB-NE2 3.43Å; F1708-H1716 AromaticContact CD2-NE2 3.31Å; F1708-H1716 VanDerWaalsContact CD2-NE2 3.31Å; F1708-H1716 WeakPolarHBondContact CD2-NE2 3.34Å; F1708-H1716 AromaticContact CG-CD2 3.7Å; F1708-H1716 AromaticContact CG-NE2 3.37Å; F1708-H1716 WeakPolarHBondContact CG-NE2 3.44Å; F1708-M1719 HydrophobicContact CD1-CB 3.88Å; F1708-M1719 HydrophobicContact CE1-CB 4.45Å; F1708-M1720 HydrophobicContact CE1-CB 4.47Å; F1708-M1720 HydrophobicContact CE1-CG 4Å; F1708-M1720 HydrophobicContact CE2-CG 4.25Å; F1708-M1720 HydrophobicContact CZ-CG 3.84Å; F1708-T1723 HydrophobicContact CE1-CG2 4.4Å; F1708-L1724 HydrophobicContact CZ-CD1 4.24Å
1709	Q	95.7	Very high	97	Very high	57 Å²	57	24.8 Å²	24.8	27%	0.266	12%	0.115	S	C	.	.			trans	-69.9	82.8	178.3	-164.3	68.1	52.1	0	0	112.9	H1673 T1706 Y1756	H1673-Q1709 PolarHBondContact NE2-NE2 3.16Å; T1706-Q1709 PolarHBondContact OG1-OE1 3.11Å; Q1709-Y1756 PolarHBondContact O-OH 3.49Å
1710	T	94.9	Very high	97	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.018	12%	0.115	C	C	.	.			trans	-151.2	164.6	175.5	179.1	0	0	0	0	110.9	R1672 F1708 D1712 E1715 H1716 M1719	R1672-T1710 WeakPolarHBondContact CG-O 3.42Å; F1708-T1710 VanDerWaalsContact C-N 3.34Å; F1708-T1710 PolarHBondContact O-N 3Å; T1710-D1712 PolarHBondContact OG1-N 3.39Å; T1710-E1715 WeakPolarHBondContact CB-OE2 3.13Å; T1710-E1715 PolarHBondContact OG1-OE2 2.89Å; T1710-H1716 HydrophobicContact CG2-CB 3.61Å; T1710-M1719 VanDerWaalsContact CB-SD 3.55Å; T1710-M1719 HydrophobicContact CG2-SD 3.52Å; T1710-M1719 VanDerWaalsContact CG2-SD 3.52Å
1711	H	92.9	Very high	96.9	Very high	99 Å²	99	26 Å²	26	46%	0.458	12%	0.121	S	C	.	.	S	Bend	trans	-122.7	3	175.4	-58.6	-99.5	0	0	0	113.2	R1672	R1672-H1711 VanDerWaalsContact CZ-O 3.28Å; R1672-H1711 PolarHBondContact NE-O 3.18Å; R1672-H1711 PolarHBondContact NH2-O 2.94Å
1712	D	95.3	Very high	96.8	Very high	75 Å²	75	29.5 Å²	29.5	40%	0.401	13%	0.134	S	C	.	.			trans	-110.2	147.8	177.4	169.6	52.1	0	0	0	112.5	T1710 R1714 E1715 H1716	T1710-D1712 PolarHBondContact OG1-N 3.39Å; D1712-R1714 PolarHBondContact OD1-N 3.04Å; D1712-R1714 WeakPolarHBondContact OD2-CA 3.28Å; D1712-R1714 WeakPolarHBondContact OD2-CB 3.24Å; D1712-R1714 PolarHBondContact OD2-N 3.33Å; D1712-E1715 HydrophobicContact CB-CB 4.15Å; D1712-E1715 PolarHBondContact OD2-N 2.98Å; D1712-H1716 VanDerWaalsContact O-CB 3.23Å; D1712-H1716 WeakPolarHBondContact O-CB 3.36Å; D1712-H1716 PolarHBondContact O-N 3.37Å
1713	N	96.4	Very high	96.8	Very high	27 Å²	27	29.2 Å²	29.2	14%	0.144	13%	0.133	C	C	.	.	H	α-helix	trans	-68.3	-42	178.2	-75.7	-10.2	0	0	0	112.8	R1672 I1680 H1716 L1717 F1739	R1672-N1713 PolarHBondContact NH1-OD1 3.11Å; I1680-N1713 HydrophobicContact CG2-CB 4.03Å; N1713-H1716 PolarHBondContact O-N 2.85Å; N1713-L1717 WeakPolarHBondContact O-CG 3.44Å; N1713-L1717 PolarHBondContact O-N 2.9Å; N1713-L1717 VanDerWaalsContact O-N 3.11Å; N1713-F1739 HydrophobicContact CB-CE1 4.29Å; N1713-F1739 HydrophobicContact CB-CE2 3.76Å; N1713-F1739 HydrophobicContact CB-CZ 3.51Å
1714	R	95.7	Very high	96.8	Very high	68 Å²	68	31.1 Å²	31.1	26%	0.257	14%	0.143	S	C	.	.	H	α-helix	trans	-75.4	-39.9	-175.7	-169.4	-173.9	-96.6	-152.8	-2.6	110.9	D1712 L1717 A1718 G1738 F1739 L1745 D1746 W1747	D1712-R1714 PolarHBondContact OD1-N 3.04Å; D1712-R1714 WeakPolarHBondContact OD2-CA 3.28Å; D1712-R1714 WeakPolarHBondContact OD2-CB 3.24Å; D1712-R1714 PolarHBondContact OD2-N 3.33Å; R1714-L1717 PolarHBondContact O-N 3.28Å; R1714-A1718 PolarHBondContact O-N 3.32Å; R1714-G1738 PolarHBondContact NH2-O 3.15Å; R1714-G1738 VanDerWaalsContact NH2-O 3.14Å; R1714-F1739 HydrophobicContact CB-CD1 4.13Å; R1714-F1739 HydrophobicContact CB-CE1 4.49Å; R1714-F1739 HydrophobicContact CG-CD1 4.43Å; R1714-L1745 HydrophobicContact CG-CD1 4.46Å; R1714-D1746 WeakPolarHBondContact CD-O 3.48Å; R1714-D1746 IonicContact CZ-OD2 3.77Å; R1714-D1746 PolarHBondContact NE-O 2.81Å; R1714-D1746 VanDerWaalsContact NH1-CG 3.33Å; R1714-D1746 PolarHBondContact NH1-O 3.33Å; R1714-D1746 IonicContact NH1-OD2 3.36Å; R1714-D1746 PolarHBondContact NH1-OD2 3.26Å; R1714-D1746 IonicContact NH2-OD2 2.63Å; R1714-D1746 PolarHBondContact NH2-OD2 2.74Å; R1714-W1747 HydrophobicContact CB-CZ3 4.49Å; R1714-W1747 HydrophobicContact CG-CE3 3.89Å; R1714-W1747 HydrophobicContact CG-CZ3 4.16Å
1715	E	96.8	Very high	96.8	Very high	28 Å²	28	32.5 Å²	32.5	13%	0.131	16%	0.157	C	C	.	.	H	α-helix	trans	-61.8	-42.5	170.4	-173.8	172.2	-115.6	0	0	111.6	T1710 D1712 L1717 A1718 M1719 W1747 Y1756 V1757	T1710-E1715 WeakPolarHBondContact CB-OE2 3.13Å; T1710-E1715 PolarHBondContact OG1-OE2 2.89Å; D1712-E1715 HydrophobicContact CB-CB 4.15Å; D1712-E1715 PolarHBondContact OD2-N 2.98Å; E1715-L1717 PolarHBondContact O-N 3.47Å; E1715-A1718 CarbonylContact O-C 3.48Å; E1715-A1718 WeakPolarHBondContact O-CA 3.44Å; E1715-A1718 WeakPolarHBondContact O-CB 3.43Å; E1715-A1718 PolarHBondContact O-N 2.96Å; E1715-A1718 VanDerWaalsContact O-N 3.08Å; E1715-M1719 HydrophobicContact CG-CG 4.34Å; E1715-M1719 HydrophobicContact CG-SD 4.2Å; E1715-M1719 WeakPolarHBondContact O-CG 3.45Å; E1715-M1719 PolarHBondContact O-N 2.56Å; E1715-W1747 HydrophobicContact CB-CH2 3.68Å; E1715-W1747 HydrophobicContact CB-CZ3 4.14Å; E1715-W1747 HydrophobicContact CG-CH2 3.85Å; E1715-W1747 HydrophobicContact CG-CZ2 4.37Å; E1715-Y1756 VanDerWaalsContact OE1-CD1 3.25Å; E1715-Y1756 WeakPolarHBondContact OE1-CD1 3.29Å; E1715-V1757 HydrophobicContact CG-CG2 3.73Å
1716	H	97.7	Very high	96.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.4	-46.9	176.4	-163.7	172.7	0	0	0	111.6	R1672 I1680 F1708 T1710 D1712 N1713 A1718 M1719 M1720	R1672-H1716 PolarHBondContact O-CE1 3.08Å; R1672-H1716 VanDerWaalsContact O-CE1 3.32Å; I1680-H1716 HydrophobicContact CD1-CB 4.46Å; I1680-H1716 WeakPolarHBondContact CD1-ND1 3.49Å; F1708-H1716 VanDerWaalsContact CB-NE2 3.3Å; F1708-H1716 WeakPolarHBondContact CB-NE2 3.43Å; F1708-H1716 AromaticContact CD2-NE2 3.31Å; F1708-H1716 VanDerWaalsContact CD2-NE2 3.31Å; F1708-H1716 WeakPolarHBondContact CD2-NE2 3.34Å; F1708-H1716 AromaticContact CG-CD2 3.7Å; F1708-H1716 AromaticContact CG-NE2 3.37Å; F1708-H1716 WeakPolarHBondContact CG-NE2 3.44Å; T1710-H1716 HydrophobicContact CG2-CB 3.61Å; D1712-H1716 VanDerWaalsContact O-CB 3.23Å; D1712-H1716 WeakPolarHBondContact O-CB 3.36Å; D1712-H1716 PolarHBondContact O-N 3.37Å; N1713-H1716 PolarHBondContact O-N 2.85Å; H1716-A1718 VanDerWaalsContact C-N 3.27Å; H1716-A1718 PolarHBondContact O-N 3.42Å; H1716-M1719 PolarHBondContact O-N 3.23Å; H1716-M1719 VanDerWaalsContact O-N 3.16Å; H1716-M1720 VanDerWaalsContact CD2-CE 3.48Å; H1716-M1720 WeakPolarHBondContact CD2-CE 3.45Å; H1716-M1720 VanDerWaalsContact NE2-CE 3.26Å; H1716-M1720 WeakPolarHBondContact NE2-CE 3.42Å; H1716-M1720 WeakPolarHBondContact O-CG 3.39Å; H1716-M1720 PolarHBondContact O-N 3Å
1717	L	97.9	Very high	96.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-34.9	174.7	-66.5	170.2	0	0	0	112.4	I1680 L1681 N1713 R1714 E1715 M1720 E1721 I1727 F1739 F1740 L1745	I1680-L1717 HydrophobicContact CG2-CD1 4.1Å; I1680-L1717 HydrophobicContact CG2-CD2 4.08Å; I1680-L1717 HydrophobicContact CG2-CG 4Å; L1681-L1717 HydrophobicContact CD2-CD1 3.76Å; L1681-L1717 HydrophobicContact CD2-CD2 4.14Å; L1681-L1717 HydrophobicContact CG-CD2 4.28Å; N1713-L1717 WeakPolarHBondContact O-CG 3.44Å; N1713-L1717 PolarHBondContact O-N 2.9Å; N1713-L1717 VanDerWaalsContact O-N 3.11Å; R1714-L1717 PolarHBondContact O-N 3.28Å; E1715-L1717 PolarHBondContact O-N 3.47Å; L1717-M1720 HydrophobicContact CD2-SD 4.28Å; L1717-M1720 PolarHBondContact O-N 3.36Å; L1717-E1721 PolarHBondContact O-N 2.94Å; L1717-I1727 HydrophobicContact CB-CD1 4.07Å; L1717-I1727 HydrophobicContact CD2-CD1 3.9Å; L1717-I1727 HydrophobicContact CG-CD1 4.48Å; L1717-F1739 HydrophobicContact CD1-CB 4.13Å; L1717-F1739 HydrophobicContact CD1-CD2 3.54Å; L1717-F1739 HydrophobicContact CD1-CE2 4.3Å; L1717-F1739 HydrophobicContact CD1-CG 4.11Å; L1717-F1740 HydrophobicContact CD1-CE2 4.48Å; L1717-F1740 HydrophobicContact CD1-CZ 4.14Å; L1717-L1745 HydrophobicContact CB-CD1 3.73Å; L1717-L1745 HydrophobicContact CB-CD2 3.98Å; L1717-L1745 HydrophobicContact CD1-CD1 3.96Å
1718	A	97.7	Very high	96.7	Very high	2 Å²	2	35.8 Å²	35.8	2%	0.017	18%	0.177	C	C	.	.	H	α-helix	trans	-70.2	-38	174.7	0	0	0	0	0	112.8	R1714 E1715 H1716 E1721 R1722 L1745 W1747 V1757	R1714-A1718 PolarHBondContact O-N 3.32Å; E1715-A1718 CarbonylContact O-C 3.48Å; E1715-A1718 WeakPolarHBondContact O-CA 3.44Å; E1715-A1718 WeakPolarHBondContact O-CB 3.43Å; E1715-A1718 PolarHBondContact O-N 2.96Å; E1715-A1718 VanDerWaalsContact O-N 3.08Å; H1716-A1718 VanDerWaalsContact C-N 3.27Å; H1716-A1718 PolarHBondContact O-N 3.42Å; A1718-E1721 PolarHBondContact O-N 2.86Å; A1718-R1722 WeakPolarHBondContact O-CB 3.41Å; A1718-R1722 PolarHBondContact O-N 3.16Å; A1718-L1745 HydrophobicContact CB-CD2 3.71Å; A1718-W1747 HydrophobicContact CB-CD2 3.53Å; A1718-W1747 VanDerWaalsContact CB-CE2 3.42Å; A1718-W1747 HydrophobicContact CB-CE3 4.04Å; A1718-W1747 HydrophobicContact CB-CG 3.84Å; A1718-W1747 HydrophobicContact CB-CH2 4.29Å; A1718-W1747 HydrophobicContact CB-CZ2 3.83Å; A1718-W1747 HydrophobicContact CB-CZ3 4.39Å; A1718-V1757 HydrophobicContact CB-CG1 4.36Å
1719	M	98.1	Very high	96.5	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.02	20%	0.204	C	C	.	.	H	α-helix	trans	-66.3	-37.7	173.2	-66.6	175.1	85.9	0	0	111.6	F1708 T1710 E1715 H1716 T1723 V1757 C1761	F1708-M1719 HydrophobicContact CD1-CB 3.88Å; F1708-M1719 HydrophobicContact CE1-CB 4.45Å; T1710-M1719 VanDerWaalsContact CB-SD 3.55Å; T1710-M1719 HydrophobicContact CG2-SD 3.52Å; T1710-M1719 VanDerWaalsContact CG2-SD 3.52Å; E1715-M1719 HydrophobicContact CG-CG 4.34Å; E1715-M1719 HydrophobicContact CG-SD 4.2Å; E1715-M1719 WeakPolarHBondContact O-CG 3.45Å; E1715-M1719 PolarHBondContact O-N 2.56Å; H1716-M1719 PolarHBondContact O-N 3.23Å; H1716-M1719 VanDerWaalsContact O-N 3.16Å; M1719-T1723 WeakPolarHBondContact O-CB 3.46Å; M1719-T1723 PolarHBondContact O-N 2.82Å; M1719-T1723 PolarHBondContact O-OG1 2.87Å; M1719-V1757 HydrophobicContact CG-CB 4.44Å; M1719-V1757 HydrophobicContact CG-CG1 4.07Å; M1719-V1757 HydrophobicContact CG-CG2 3.73Å; M1719-C1761 WeakPolarHBondContact CE-SG 3.4Å
1720	M	98.3	Very high	96.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.2	-55.5	170.3	-66.6	-177.1	-171.8	0	0	110.5	P1677 I1680 W1692 F1708 H1716 L1717 R1722 T1723 L1724 Y1788	P1677-M1720 HydrophobicContact CB-CE 4.41Å; P1677-M1720 HydrophobicContact CB-SD 3.94Å; I1680-M1720 HydrophobicContact CD1-CE 3.51Å; W1692-M1720 HydrophobicContact CH2-CE 4.29Å; W1692-M1720 HydrophobicContact CH2-CG 4.37Å; W1692-M1720 HydrophobicContact CH2-SD 3.87Å; W1692-M1720 HydrophobicContact CZ2-CE 3.54Å; W1692-M1720 HydrophobicContact CZ2-CG 4.14Å; W1692-M1720 HydrophobicContact CZ2-SD 3.71Å; F1708-M1720 HydrophobicContact CE1-CB 4.47Å; F1708-M1720 HydrophobicContact CE1-CG 4Å; F1708-M1720 HydrophobicContact CE2-CG 4.25Å; F1708-M1720 HydrophobicContact CZ-CG 3.84Å; H1716-M1720 VanDerWaalsContact CD2-CE 3.48Å; H1716-M1720 WeakPolarHBondContact CD2-CE 3.45Å; H1716-M1720 VanDerWaalsContact NE2-CE 3.26Å; H1716-M1720 WeakPolarHBondContact NE2-CE 3.42Å; H1716-M1720 WeakPolarHBondContact O-CG 3.39Å; H1716-M1720 PolarHBondContact O-N 3Å; L1717-M1720 HydrophobicContact CD2-SD 4.28Å; L1717-M1720 PolarHBondContact O-N 3.36Å; M1720-R1722 PolarHBondContact O-N 2.96Å; M1720-R1722 VanDerWaalsContact O-N 3.16Å; M1720-T1723 PolarHBondContact O-N 3.45Å; M1720-L1724 PolarHBondContact O-N 3.08Å; M1720-Y1788 HydrophobicContact CB-CE1 4.09Å; M1720-Y1788 WeakPolarHBondContact CB-OH 3.32Å; M1720-Y1788 PolarHBondContact O-OH 3.38Å; M1720-Y1788 HydrophobicContact SD-CE1 4.2Å
1721	E	97.4	Very high	96.5	Very high	31 Å²	31	44 Å²	44	15%	0.145	21%	0.207	C	C	.	.	H	α-helix	trans	-55.8	-38.5	-179.8	-77.4	-135.7	146.1	0	0	112.4	L1717 A1718 T1723 G1725 H1726 I1727 Y1788	L1717-E1721 PolarHBondContact O-N 2.94Å; A1718-E1721 PolarHBondContact O-N 2.86Å; E1721-T1723 VanDerWaalsContact C-N 3.26Å; E1721-T1723 PolarHBondContact O-N 3.32Å; E1721-G1725 WeakPolarHBondContact CA-O 3.27Å; E1721-G1725 WeakPolarHBondContact O-CA 3.36Å; E1721-G1725 PolarHBondContact O-N 3.44Å; E1721-H1726 VanDerWaalsContact CD-ND1 3.33Å; E1721-H1726 VanDerWaalsContact OE1-CA 3.25Å; E1721-H1726 WeakPolarHBondContact OE1-CA 3.14Å; E1721-H1726 IonicContact OE1-CG 2.86Å; E1721-H1726 IonicContact OE1-ND1 3.17Å; E1721-H1726 PolarHBondContact OE1-ND1 3.48Å; E1721-H1726 IonicContact OE2-CE1 3.17Å; E1721-H1726 IonicContact OE2-ND1 3.68Å; E1721-H1726 PolarHBondContact OE2-ND1 3.06Å; E1721-I1727 HydrophobicContact CG-CD1 3.85Å; E1721-I1727 HydrophobicContact CG-CG1 3.92Å; E1721-I1727 PolarHBondContact OE1-N 3.22Å; E1721-Y1788 PolarHBondContact N-OH 2.97Å
1722	R	96.4	Very high	96.6	Very high	78 Å²	78	39.9 Å²	39.9	29%	0.294	19%	0.189	S	C	.	.	H	α-helix	trans	-67.2	-23.6	179	178.4	62.5	-166.2	115.4	-2.5	114	A1718 M1720 V1757 C1761	A1718-R1722 WeakPolarHBondContact O-CB 3.41Å; A1718-R1722 PolarHBondContact O-N 3.16Å; M1720-R1722 PolarHBondContact O-N 2.96Å; M1720-R1722 VanDerWaalsContact O-N 3.16Å; R1722-V1757 HydrophobicContact CB-CG1 3.88Å; R1722-V1757 HydrophobicContact CG-CG1 3.98Å; R1722-C1761 HydrophobicContact CB-CB 4.18Å; R1722-C1761 HydrophobicContact CG-CB 3.48Å; R1722-C1761 VanDerWaalsContact CG-CB 3.48Å; R1722-C1761 VanDerWaalsContact CZ-O 3.23Å; R1722-C1761 PolarHBondContact NE-O 3.43Å; R1722-C1761 PolarHBondContact NH2-O 3.16Å; R1722-C1761 VanDerWaalsContact NH2-O 3.08Å
1723	T	97.8	Very high	96.5	Very high	5 Å²	5	44.8 Å²	44.8	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-109.7	-38.3	-169.2	-58.6	0	0	0	0	113	L1707 F1708 M1719 M1720 E1721 P1763 L1764 Y1767	L1707-T1723 HydrophobicContact CD1-CG2 4.17Å; F1708-T1723 HydrophobicContact CE1-CG2 4.4Å; M1719-T1723 WeakPolarHBondContact O-CB 3.46Å; M1719-T1723 PolarHBondContact O-N 2.82Å; M1719-T1723 PolarHBondContact O-OG1 2.87Å; M1720-T1723 PolarHBondContact O-N 3.45Å; E1721-T1723 VanDerWaalsContact C-N 3.26Å; E1721-T1723 PolarHBondContact O-N 3.32Å; T1723-P1763 CarbonylContact O-C 2.79Å; T1723-P1763 VanDerWaalsContact O-CA 3.3Å; T1723-P1763 WeakPolarHBondContact O-CA 3.25Å; T1723-L1764 HydrophobicContact CG2-CB 4.24Å; T1723-L1764 HydrophobicContact CG2-CD1 4.41Å; T1723-L1764 PolarHBondContact O-N 2.93Å; T1723-Y1767 HydrophobicContact CG2-CE2 4.34Å
1724	L	98	Very high	96.3	Very high	50 Å²	50	50.3 Å²	50.3	26%	0.262	22%	0.224	S	C	.	.	H	α-helix	trans	-109.6	-27.5	-173.1	-57.8	171.9	0	0	0	112.7	W1692 F1708 M1720 L1764 L1786 Y1788	W1692-L1724 HydrophobicContact CH2-CD1 3.42Å; W1692-L1724 VanDerWaalsContact CH2-CD1 3.42Å; W1692-L1724 HydrophobicContact CZ2-CD1 4.21Å; W1692-L1724 HydrophobicContact CZ3-CD1 4.08Å; F1708-L1724 HydrophobicContact CZ-CD1 4.24Å; M1720-L1724 PolarHBondContact O-N 3.08Å; L1724-L1764 HydrophobicContact CD2-CB 4.5Å; L1724-L1764 HydrophobicContact CD2-CD2 4.12Å; L1724-L1786 HydrophobicContact CD1-CB 4.2Å; L1724-L1786 HydrophobicContact CD2-CB 3.93Å; L1724-L1786 HydrophobicContact CD2-CD1 4.33Å; L1724-Y1788 HydrophobicContact CB-CE2 3.82Å; L1724-Y1788 HydrophobicContact CD1-CE2 4.46Å
1725	G	96.4	Very high	96.1	Very high	31 Å²	31	48 Å²	48	32%	0.32	22%	0.218	S	C	.	.			trans	113.3	179.2	-171.5	0	0	0	0	0	111.6	E1721 Y1788	E1721-G1725 WeakPolarHBondContact CA-O 3.27Å; E1721-G1725 WeakPolarHBondContact O-CA 3.36Å; E1721-G1725 PolarHBondContact O-N 3.44Å; G1725-Y1788 VanDerWaalsContact O-CE2 3.3Å; G1725-Y1788 WeakPolarHBondContact O-CE2 3.25Å; G1725-Y1788 PolarHBondContact O-OH 2.89Å
1726	H	95.9	Very high	95.7	Very high	151 Å²	151	57.4 Å²	57.4	70%	0.699	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-64.6	142.3	-172.3	-68.5	-61.2	0	0	0	114.1	E1721	E1721-H1726 VanDerWaalsContact CD-ND1 3.33Å; E1721-H1726 VanDerWaalsContact OE1-CA 3.25Å; E1721-H1726 WeakPolarHBondContact OE1-CA 3.14Å; E1721-H1726 IonicContact OE1-CG 2.86Å; E1721-H1726 IonicContact OE1-ND1 3.17Å; E1721-H1726 PolarHBondContact OE1-ND1 3.48Å; E1721-H1726 IonicContact OE2-CE1 3.17Å; E1721-H1726 IonicContact OE2-ND1 3.68Å; E1721-H1726 PolarHBondContact OE2-ND1 3.06Å
1727	I	97.5	Very high	95.3	Very high	9 Å²	9	58.4 Å²	58.4	5%	0.046	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-64.5	132.1	175.9	-64	154.6	0	0	0	109	L1681 L1717 E1721 Y1729 M1731 T1732 F1740 Y1788	L1681-I1727 HydrophobicContact CD1-CG2 4.3Å; L1717-I1727 HydrophobicContact CB-CD1 4.07Å; L1717-I1727 HydrophobicContact CD2-CD1 3.9Å; L1717-I1727 HydrophobicContact CG-CD1 4.48Å; E1721-I1727 HydrophobicContact CG-CD1 3.85Å; E1721-I1727 HydrophobicContact CG-CG1 3.92Å; E1721-I1727 PolarHBondContact OE1-N 3.22Å; I1727-Y1729 PolarHBondContact O-N 2.78Å; I1727-M1731 HydrophobicContact CG2-CB 4.31Å; I1727-T1732 HydrophobicContact CB-CG2 4.03Å; I1727-T1732 HydrophobicContact CG2-CG2 3.61Å; I1727-F1740 HydrophobicContact CD1-CE1 4.07Å; I1727-F1740 HydrophobicContact CD1-CZ 4.17Å; I1727-Y1788 HydrophobicContact CB-CE1 4.46Å; I1727-Y1788 HydrophobicContact CG1-CD1 4.22Å; I1727-Y1788 HydrophobicContact CG1-CE1 3.59Å
1728	P	96.4	Very high	94.9	Very high	33 Å²	33	61.5 Å²	61.5	21%	0.214	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-55.8	126	-179.5	-28.4	35.5	0	0	0	112.9	R1730 M1731 T1732 Y1788	P1728-R1730 HydrophobicContact CB-CG 4.07Å; P1728-R1730 PolarHBondContact O-N 3.21Å; P1728-M1731 HydrophobicContact CB-CG 4.41Å; P1728-M1731 HydrophobicContact CB-SD 4.27Å; P1728-M1731 HydrophobicContact CG-SD 4.09Å; P1728-M1731 WeakPolarHBondContact O-CA 3.34Å; P1728-M1731 WeakPolarHBondContact O-CB 3.35Å; P1728-M1731 PolarHBondContact O-N 2.9Å; P1728-T1732 PolarHBondContact O-N 3.47Å; P1728-Y1788 VanDerWaalsContact CD-CB 3.41Å; P1728-Y1788 HydrophobicContact CG-CG 4.34Å
1729	Y	94.4	Very high	94.8	Very high	142 Å²	142	63.1 Å²	63.1	56%	0.557	30%	0.298	S	S	*	.	H	α-helix	trans	-54.7	-27.9	-178	176.8	-107.4	0	0	0	114.2	I1727 M1731 T1732 R1733	I1727-Y1729 PolarHBondContact O-N 2.78Å; Y1729-M1731 VanDerWaalsContact C-N 3.26Å; Y1729-M1731 PolarHBondContact O-N 3.28Å; Y1729-T1732 PolarHBondContact O-N 3.11Å; Y1729-T1732 PolarHBondContact O-OG1 2.72Å; Y1729-R1733 VanDerWaalsContact O-CB 3.24Å; Y1729-R1733 WeakPolarHBondContact O-CB 3.43Å; Y1729-R1733 PolarHBondContact O-N 2.93Å
1730	R	94.2	Very high	94.6	Very high	90 Å²	90	64.7 Å²	64.7	34%	0.34	30%	0.304	S	S	.	.	H	α-helix	trans	-64.6	-26	173.6	66.4	178.4	-176.6	62.7	40.4	113.6	P1728 K1734 D1789	P1728-R1730 HydrophobicContact CB-CG 4.07Å; P1728-R1730 PolarHBondContact O-N 3.21Å; R1730-K1734 WeakPolarHBondContact O-CB 3.21Å; R1730-K1734 VanDerWaalsContact O-CG 3.23Å; R1730-K1734 WeakPolarHBondContact O-CG 3.13Å; R1730-D1789 IonicContact CZ-OD1 2.83Å; R1730-D1789 VanDerWaalsContact CZ-OD1 3.23Å; R1730-D1789 IonicContact CZ-OD2 2.81Å; R1730-D1789 IonicContact NE-OD2 2.66Å; R1730-D1789 PolarHBondContact NE-OD2 3Å; R1730-D1789 IonicContact NH1-OD1 2.69Å; R1730-D1789 PolarHBondContact NH1-OD1 2.91Å; R1730-D1789 IonicContact NH1-OD2 3.67Å; R1730-D1789 PolarHBondContact NH1-OD2 2.77Å; R1730-D1789 IonicContact NH2-OD1 2.7Å; R1730-D1789 PolarHBondContact NH2-OD1 2.88Å; R1730-D1789 IonicContact NH2-OD2 2.73Å; R1730-D1789 PolarHBondContact NH2-OD2 3.22Å
1731	M	96.4	Very high	94.2	Very high	2 Å²	2	72 Å²	72	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-84.1	-47.9	174.3	-65	173.2	77.7	0	0	110.2	P1677 L1681 L1683 I1727 P1728 Y1729 R1733 K1734 S1735 Y1788	P1677-M1731 HydrophobicContact CB-CE 4.34Å; P1677-M1731 HydrophobicContact CG-CE 4.42Å; L1681-M1731 HydrophobicContact CD1-CB 4.31Å; L1681-M1731 HydrophobicContact CD1-CE 4.31Å; L1683-M1731 HydrophobicContact CD1-CB 3.8Å; L1683-M1731 HydrophobicContact CD1-CE 3.75Å; L1683-M1731 HydrophobicContact CD1-CG 3.93Å; I1727-M1731 HydrophobicContact CG2-CB 4.31Å; P1728-M1731 HydrophobicContact CB-CG 4.41Å; P1728-M1731 HydrophobicContact CB-SD 4.27Å; P1728-M1731 HydrophobicContact CG-SD 4.09Å; P1728-M1731 WeakPolarHBondContact O-CA 3.34Å; P1728-M1731 WeakPolarHBondContact O-CB 3.35Å; P1728-M1731 PolarHBondContact O-N 2.9Å; Y1729-M1731 VanDerWaalsContact C-N 3.26Å; Y1729-M1731 PolarHBondContact O-N 3.28Å; M1731-R1733 PolarHBondContact O-N 3.25Å; M1731-K1734 PolarHBondContact O-N 3.22Å; M1731-S1735 PolarHBondContact O-N 2.93Å; M1731-Y1788 WeakPolarHBondContact CE-O 3.34Å; M1731-Y1788 VanDerWaalsContact SD-O 3.35Å
1732	T	94.8	Very high	93.7	Very high	12 Å²	12	78 Å²	78	7%	0.074	36%	0.36	C	S	.	.	H	α-helix	trans	-61.2	-32.2	179.8	74.3	0	0	0	0	112.4	I1727 P1728 Y1729 F1740 G1743	I1727-T1732 HydrophobicContact CB-CG2 4.03Å; I1727-T1732 HydrophobicContact CG2-CG2 3.61Å; P1728-T1732 PolarHBondContact O-N 3.47Å; Y1729-T1732 PolarHBondContact O-N 3.11Å; Y1729-T1732 PolarHBondContact O-OG1 2.72Å; T1732-F1740 HydrophobicContact CG2-CD1 3.53Å; T1732-F1740 HydrophobicContact CG2-CE1 3.28Å; T1732-F1740 HydrophobicContact CG2-CG 4.27Å; T1732-F1740 HydrophobicContact CG2-CZ 3.84Å; T1732-G1743 PolarHBondContact OG1-O 3.21Å
1733	R	92.5	Very high	93.3	Very high	177 Å²	177	75.2 Å²	75.2	67%	0.668	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.9	174.2	-155.4	-154.5	73.2	-169.1	2	114.8	Y1729 M1731	Y1729-R1733 VanDerWaalsContact O-CB 3.24Å; Y1729-R1733 WeakPolarHBondContact O-CB 3.43Å; Y1729-R1733 PolarHBondContact O-N 2.93Å; M1731-R1733 PolarHBondContact O-N 3.25Å
1734	K	92.2	Very high	93	Very high	144 Å²	144	84.4 Å²	84.4	63%	0.626	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-30.3	173.3	-86.2	-177.6	174	-171.1	0	112.3	L1683 R1730 M1731	L1683-K1734 HydrophobicContact CD2-CB 3.55Å; R1730-K1734 WeakPolarHBondContact O-CB 3.21Å; R1730-K1734 VanDerWaalsContact O-CG 3.23Å; R1730-K1734 WeakPolarHBondContact O-CG 3.13Å; M1731-K1734 PolarHBondContact O-N 3.22Å
1735	S	91.3	Very high	92.9	Very high	19 Å²	19	82.9 Å²	82.9	13%	0.133	38%	0.383	C	S	.	.			trans	-62.4	145.2	-178.2	-171.5	0	0	0	0	111.3	L1681 M1731 T1737	L1681-S1735 WeakPolarHBondContact O-CB 3.49Å; L1681-S1735 PolarHBondContact O-OG 3.31Å; M1731-S1735 PolarHBondContact O-N 2.93Å; S1735-T1737 WeakPolarHBondContact OG-CB 3.23Å; S1735-T1737 WeakPolarHBondContact OG-CG2 3.48Å; S1735-T1737 PolarHBondContact OG-N 3.35Å; S1735-T1737 PolarHBondContact OG-OG1 3.18Å
1736	R	88.9	Confident	92.8	Very high	225 Å²	225	84.9 Å²	84.9	85%	0.849	39%	0.386	S	S	*	.			trans	-89.2	-8	172	-63	177.7	-179	173.2	1.5	112.4
1737	T	88.3	Confident	92.7	Very high	21 Å²	21	79 Å²	79	13%	0.129	36%	0.358	C	S	.	.	S	Bend	trans	-72.2	139.1	-175.5	65	0	0	0	0	112.5	E1682 S1735 F1739	E1682-T1737 HydrophobicContact CG-CG2 4.37Å; S1735-T1737 WeakPolarHBondContact OG-CB 3.23Å; S1735-T1737 WeakPolarHBondContact OG-CG2 3.48Å; S1735-T1737 PolarHBondContact OG-N 3.35Å; S1735-T1737 PolarHBondContact OG-OG1 3.18Å; T1737-F1739 HydrophobicContact CG2-CD2 4.05Å; T1737-F1739 HydrophobicContact CG2-CE2 3.73Å; T1737-F1739 PolarHBondContact O-N 3.23Å; T1737-F1739 WeakPolarHBondContact OG1-CD2 3.4Å
1738	G	90.7	Very high	92.4	Very high	65 Å²	65	82.5 Å²	82.5	67%	0.67	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	23	178.5	0	0	0	0	0	115.2	R1714	R1714-G1738 PolarHBondContact NH2-O 3.15Å; R1714-G1738 VanDerWaalsContact NH2-O 3.14Å
1739	F	94.3	Very high	91.9	Very high	37 Å²	37	85.2 Å²	85.2	16%	0.162	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-9.4	-173.2	-53.9	-39.9	0	0	0	114.1	L1681 N1713 R1714 L1717 T1737 L1745 D1746	L1681-F1739 HydrophobicContact CD2-CD2 4.46Å; N1713-F1739 HydrophobicContact CB-CE1 4.29Å; N1713-F1739 HydrophobicContact CB-CE2 3.76Å; N1713-F1739 HydrophobicContact CB-CZ 3.51Å; R1714-F1739 HydrophobicContact CB-CD1 4.13Å; R1714-F1739 HydrophobicContact CB-CE1 4.49Å; R1714-F1739 HydrophobicContact CG-CD1 4.43Å; L1717-F1739 HydrophobicContact CD1-CB 4.13Å; L1717-F1739 HydrophobicContact CD1-CD2 3.54Å; L1717-F1739 HydrophobicContact CD1-CE2 4.3Å; L1717-F1739 HydrophobicContact CD1-CG 4.11Å; T1737-F1739 HydrophobicContact CG2-CD2 4.05Å; T1737-F1739 HydrophobicContact CG2-CE2 3.73Å; T1737-F1739 PolarHBondContact O-N 3.23Å; T1737-F1739 WeakPolarHBondContact OG1-CD2 3.4Å; F1739-L1745 HydrophobicContact CB-CD1 4.04Å; F1739-D1746 PolarHBondContact O-N 2.8Å
1740	F	94.5	Very high	91.6	Very high	36 Å²	36	87.4 Å²	87.4	16%	0.158	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.1	-171.4	-57.6	-87.4	0	0	0	113.8	L1681 L1717 I1727 T1732 R1744 L1745	L1681-F1740 HydrophobicContact CD1-CZ 4.48Å; L1681-F1740 HydrophobicContact CD2-CE2 3.47Å; L1681-F1740 VanDerWaalsContact CD2-CE2 3.47Å; L1681-F1740 HydrophobicContact CD2-CZ 3.72Å; L1717-F1740 HydrophobicContact CD1-CE2 4.48Å; L1717-F1740 HydrophobicContact CD1-CZ 4.14Å; I1727-F1740 HydrophobicContact CD1-CE1 4.07Å; I1727-F1740 HydrophobicContact CD1-CZ 4.17Å; T1732-F1740 HydrophobicContact CG2-CD1 3.53Å; T1732-F1740 HydrophobicContact CG2-CE1 3.28Å; T1732-F1740 HydrophobicContact CG2-CG 4.27Å; T1732-F1740 HydrophobicContact CG2-CZ 3.84Å; F1740-R1744 CarbonylContact C-O 3.5Å; F1740-R1744 WeakPolarHBondContact CA-O 3.33Å; F1740-R1744 WeakPolarHBondContact CB-O 3.3Å; F1740-L1745 HydrophobicContact CD1-CB 4.43Å; F1740-L1745 HydrophobicContact CD1-CD1 4.37Å; F1740-L1745 HydrophobicContact CE1-CB 4.27Å; F1740-L1745 HydrophobicContact CE1-CD1 3.87Å; F1740-L1745 HydrophobicContact CZ-CD1 4.08Å
1741	Y	90.3	Very high	91.5	Very high	155 Å²	155	85.4 Å²	85.4	61%	0.608	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	126	172.1	-172.1	-114.8	0	0	0	109.7	G1743 R1744	Y1741-G1743 PolarHBondContact O-N 3.26Å; Y1741-G1743 VanDerWaalsContact O-N 3.12Å; Y1741-R1744 PolarHBondContact N-O 3.24Å; Y1741-R1744 PolarHBondContact O-N 2.92Å; Y1741-R1744 VanDerWaalsContact O-N 3.08Å
1742	H	87.3	Confident	91.2	Very high	155 Å²	155	92.2 Å²	92.2	72%	0.718	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	36.8	-170.7	-62.1	-53.3	0	0	0	114.4	R1744	H1742-R1744 VanDerWaalsContact C-N 3.29Å; H1742-R1744 PolarHBondContact O-N 3.31Å
1743	G	87.1	Confident	91.1	Very high	21 Å²	21	95.9 Å²	95.9	22%	0.216	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	-2	177.5	0	0	0	0	0	116.2	T1732 Y1741	T1732-G1743 PolarHBondContact OG1-O 3.21Å; Y1741-G1743 PolarHBondContact O-N 3.26Å; Y1741-G1743 VanDerWaalsContact O-N 3.12Å
1744	R	91.4	Very high	91.1	Very high	197 Å²	197	87.5 Å²	87.5	74%	0.743	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	156.6	171.4	-63.2	-175.9	178.7	-169	-1.6	110.2	F1740 Y1741 H1742 D1746	F1740-R1744 CarbonylContact C-O 3.5Å; F1740-R1744 WeakPolarHBondContact CA-O 3.33Å; F1740-R1744 WeakPolarHBondContact CB-O 3.3Å; Y1741-R1744 PolarHBondContact N-O 3.24Å; Y1741-R1744 PolarHBondContact O-N 2.92Å; Y1741-R1744 VanDerWaalsContact O-N 3.08Å; H1742-R1744 VanDerWaalsContact C-N 3.29Å; H1742-R1744 PolarHBondContact O-N 3.31Å; R1744-D1746 PolarHBondContact O-N 3.47Å
1745	L	95	Very high	91.1	Very high	19 Å²	19	87.1 Å²	87.1	10%	0.099	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	129.8	172.9	-167.8	72.9	0	0	0	109.6	R1714 L1717 A1718 F1739 F1740 W1747	R1714-L1745 HydrophobicContact CG-CD1 4.46Å; L1717-L1745 HydrophobicContact CB-CD1 3.73Å; L1717-L1745 HydrophobicContact CB-CD2 3.98Å; L1717-L1745 HydrophobicContact CD1-CD1 3.96Å; A1718-L1745 HydrophobicContact CB-CD2 3.71Å; F1739-L1745 HydrophobicContact CB-CD1 4.04Å; F1740-L1745 HydrophobicContact CD1-CB 4.43Å; F1740-L1745 HydrophobicContact CD1-CD1 4.37Å; F1740-L1745 HydrophobicContact CE1-CB 4.27Å; F1740-L1745 HydrophobicContact CE1-CD1 3.87Å; F1740-L1745 HydrophobicContact CZ-CD1 4.08Å; L1745-W1747 HydrophobicContact CD2-CB 4.07Å; L1745-W1747 HydrophobicContact CD2-CG 4.49Å; L1745-W1747 HydrophobicContact CG-CB 4.2Å; L1745-W1747 PolarHBondContact O-N 3.08Å; L1745-W1747 VanDerWaalsContact O-N 3.07Å
1746	D	94.3	Very high	91.3	Very high	73 Å²	73	90.1 Å²	90.1	39%	0.39	41%	0.41	S	S	.	.			trans	-79.3	86.1	176.4	177.1	39.5	0	0	0	109.1	R1714 F1739 R1744	R1714-D1746 WeakPolarHBondContact CD-O 3.48Å; R1714-D1746 IonicContact CZ-OD2 3.77Å; R1714-D1746 PolarHBondContact NE-O 2.81Å; R1714-D1746 VanDerWaalsContact NH1-CG 3.33Å; R1714-D1746 PolarHBondContact NH1-O 3.33Å; R1714-D1746 IonicContact NH1-OD2 3.36Å; R1714-D1746 PolarHBondContact NH1-OD2 3.26Å; R1714-D1746 IonicContact NH2-OD2 2.63Å; R1714-D1746 PolarHBondContact NH2-OD2 2.74Å; F1739-D1746 PolarHBondContact O-N 2.8Å; R1744-D1746 PolarHBondContact O-N 3.47Å
1747	W	93.7	Very high	91.6	Very high	27 Å²	27	79.4 Å²	79.4	10%	0.102	37%	0.37	C	S	.	.			trans	-138.5	118.3	-171.1	-173.7	-104.2	0	0	0	112	R1714 E1715 A1718 L1745 F1749 E1753 V1757	R1714-W1747 HydrophobicContact CB-CZ3 4.49Å; R1714-W1747 HydrophobicContact CG-CE3 3.89Å; R1714-W1747 HydrophobicContact CG-CZ3 4.16Å; E1715-W1747 HydrophobicContact CB-CH2 3.68Å; E1715-W1747 HydrophobicContact CB-CZ3 4.14Å; E1715-W1747 HydrophobicContact CG-CH2 3.85Å; E1715-W1747 HydrophobicContact CG-CZ2 4.37Å; A1718-W1747 HydrophobicContact CB-CD2 3.53Å; A1718-W1747 VanDerWaalsContact CB-CE2 3.42Å; A1718-W1747 HydrophobicContact CB-CE3 4.04Å; A1718-W1747 HydrophobicContact CB-CG 3.84Å; A1718-W1747 HydrophobicContact CB-CH2 4.29Å; A1718-W1747 HydrophobicContact CB-CZ2 3.83Å; A1718-W1747 HydrophobicContact CB-CZ3 4.39Å; L1745-W1747 HydrophobicContact CD2-CB 4.07Å; L1745-W1747 HydrophobicContact CD2-CG 4.49Å; L1745-W1747 HydrophobicContact CG-CB 4.2Å; L1745-W1747 PolarHBondContact O-N 3.08Å; L1745-W1747 VanDerWaalsContact O-N 3.07Å; W1747-F1749 AromaticContact CD1-CD1 3.83Å; W1747-F1749 AromaticContact CD1-CE1 3.73Å; W1747-F1749 AromaticContact CD1-CZ 3.86Å; W1747-F1749 PolarHBondContact O-N 3.14Å; W1747-E1753 HydrophobicContact CH2-CB 3.45Å; W1747-E1753 VanDerWaalsContact CH2-CB 3.45Å; W1747-E1753 HydrophobicContact CH2-CG 4.38Å; W1747-E1753 HydrophobicContact CZ2-CB 3.7Å; W1747-E1753 HydrophobicContact CZ3-CB 4.43Å; W1747-V1757 HydrophobicContact CH2-CG2 4.42Å; W1747-V1757 HydrophobicContact CZ2-CB 4.36Å; W1747-V1757 HydrophobicContact CZ2-CG2 3.66Å
1748	D	91.6	Very high	91.8	Very high	82 Å²	82	84 Å²	84	44%	0.439	38%	0.384	S	S	.	.			trans	-84.2	98.8	174.8	-178.6	14.6	0	0	0	111.2	Y1750 N1751	D1748-Y1750 PolarHBondContact O-N 3.24Å; D1748-Y1750 WeakPolarHBondContact OD1-CB 3.41Å; D1748-Y1750 WeakPolarHBondContact OD1-CD2 3.16Å; D1748-Y1750 PolarHBondContact OD1-N 2.96Å; D1748-N1751 HydrophobicContact CB-CB 4.33Å; D1748-N1751 PolarHBondContact O-N 2.91Å; D1748-N1751 PolarHBondContact O-OD1 3.18Å
1749	F	87.1	Confident	91.9	Very high	91 Å²	91	87.5 Å²	87.5	40%	0.399	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-18	174.3	-68.6	-81.6	0	0	0	114.6	W1747 G1754 R1758	W1747-F1749 AromaticContact CD1-CD1 3.83Å; W1747-F1749 AromaticContact CD1-CE1 3.73Å; W1747-F1749 AromaticContact CD1-CZ 3.86Å; W1747-F1749 PolarHBondContact O-N 3.14Å; F1749-G1754 CarbonylContact O-C 3.23Å; F1749-G1754 VanDerWaalsContact O-C 3.32Å; F1749-R1758 PolarHBondContact O-NH2 3.01Å
1750	Y	88.6	Confident	91.9	Very high	187 Å²	187	89.7 Å²	89.7	73%	0.733	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-13.5	-176.3	-58.5	-79.4	0	0	0	114.4	D1748	D1748-Y1750 PolarHBondContact O-N 3.24Å; D1748-Y1750 WeakPolarHBondContact OD1-CB 3.41Å; D1748-Y1750 WeakPolarHBondContact OD1-CD2 3.16Å; D1748-Y1750 PolarHBondContact OD1-N 2.96Å
1751	N	91.2	Very high	91.9	Very high	49 Å²	49	88.2 Å²	88.2	26%	0.262	39%	0.391	S	S	.	.	S	Bend	trans	-73.9	-168.3	176.5	85.1	4.4	0	0	0	111.9	D1748 E1753 G1754 R1755	D1748-N1751 HydrophobicContact CB-CB 4.33Å; D1748-N1751 PolarHBondContact O-N 2.91Å; D1748-N1751 PolarHBondContact O-OD1 3.18Å; N1751-E1753 PolarHBondContact ND2-OE2 3.18Å; N1751-E1753 PolarHBondContact OD1-N 3.42Å; N1751-G1754 PolarHBondContact OD1-N 3.09Å; N1751-R1755 WeakPolarHBondContact O-CB 3.21Å; N1751-R1755 PolarHBondContact O-N 3.43Å
1752	Q	90.7	Very high	92.1	Very high	145 Å²	145	85.2 Å²	85.2	68%	0.678	38%	0.378	S	S	*	.	H	α-helix	trans	-75.9	-44	-178.4	-169.4	169.7	-60.3	0	0	112.7	R1755 Y1756	Q1752-R1755 PolarHBondContact O-N 3Å; Q1752-Y1756 PolarHBondContact O-N 3.16Å
1753	E	91.4	Very high	92.6	Very high	89 Å²	89	80.1 Å²	80.1	42%	0.416	36%	0.359	S	S	.	.	H	α-helix	trans	-64.1	-47.4	175.7	-49.3	90.4	-115.2	0	0	111.5	W1747 N1751 R1755 Y1756 V1757	W1747-E1753 HydrophobicContact CH2-CB 3.45Å; W1747-E1753 VanDerWaalsContact CH2-CB 3.45Å; W1747-E1753 HydrophobicContact CH2-CG 4.38Å; W1747-E1753 HydrophobicContact CZ2-CB 3.7Å; W1747-E1753 HydrophobicContact CZ3-CB 4.43Å; N1751-E1753 PolarHBondContact ND2-OE2 3.18Å; N1751-E1753 PolarHBondContact OD1-N 3.42Å; E1753-R1755 PolarHBondContact O-N 2.97Å; E1753-R1755 VanDerWaalsContact O-N 3.16Å; E1753-Y1756 WeakPolarHBondContact O-CA 3.23Å; E1753-Y1756 WeakPolarHBondContact O-CB 3.22Å; E1753-Y1756 PolarHBondContact O-N 3.01Å; E1753-V1757 PolarHBondContact O-N 2.83Å
1754	G	92.9	Very high	93.1	Very high	0 Å²	0	79.4 Å²	79.4	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-61.9	-23.7	176.9	0	0	0	0	0	114	F1749 N1751 R1758	F1749-G1754 CarbonylContact O-C 3.23Å; F1749-G1754 VanDerWaalsContact O-C 3.32Å; N1751-G1754 PolarHBondContact OD1-N 3.09Å; G1754-R1758 VanDerWaalsContact O-CB 3.24Å; G1754-R1758 WeakPolarHBondContact O-CB 3.16Å; G1754-R1758 PolarHBondContact O-N 3.17Å
1755	R	93.3	Very high	93.3	Very high	136 Å²	136	75.5 Å²	75.5	51%	0.513	34%	0.344	S	S	.	.	H	α-helix	trans	-76.9	-47	166.8	-171.2	-174.6	-49	-170.4	4.7	112.1	N1751 Q1752 E1753 V1757 R1758 E1759	N1751-R1755 WeakPolarHBondContact O-CB 3.21Å; N1751-R1755 PolarHBondContact O-N 3.43Å; Q1752-R1755 PolarHBondContact O-N 3Å; E1753-R1755 PolarHBondContact O-N 2.97Å; E1753-R1755 VanDerWaalsContact O-N 3.16Å; R1755-V1757 VanDerWaalsContact C-N 3.35Å; R1755-V1757 PolarHBondContact O-N 3.34Å; R1755-R1758 WeakPolarHBondContact O-CB 3.14Å; R1755-R1758 PolarHBondContact O-N 3.26Å; R1755-R1758 VanDerWaalsContact O-N 3.09Å; R1755-E1759 VanDerWaalsContact CD-OE1 3.29Å; R1755-E1759 WeakPolarHBondContact CD-OE1 3.37Å; R1755-E1759 HydrophobicContact CG-CG 4.18Å; R1755-E1759 WeakPolarHBondContact CG-OE1 3.39Å; R1755-E1759 WeakPolarHBondContact O-CB 3.39Å; R1755-E1759 WeakPolarHBondContact O-CG 3.45Å; R1755-E1759 PolarHBondContact O-N 3.34Å
1756	Y	94.4	Very high	93.3	Very high	83 Å²	83	82 Å²	82	33%	0.325	37%	0.367	S	S	.	.	H	α-helix	trans	-54.9	-48.6	176.6	168.7	-100.7	0	0	0	111.6	Q1709 E1715 Q1752 E1753 R1758 E1759 N1760	Q1709-Y1756 PolarHBondContact O-OH 3.49Å; E1715-Y1756 VanDerWaalsContact OE1-CD1 3.25Å; E1715-Y1756 WeakPolarHBondContact OE1-CD1 3.29Å; Q1752-Y1756 PolarHBondContact O-N 3.16Å; E1753-Y1756 WeakPolarHBondContact O-CA 3.23Å; E1753-Y1756 WeakPolarHBondContact O-CB 3.22Å; E1753-Y1756 PolarHBondContact O-N 3.01Å; Y1756-R1758 VanDerWaalsContact C-N 3.34Å; Y1756-R1758 PolarHBondContact O-N 3.08Å; Y1756-E1759 PolarHBondContact O-N 2.77Å; Y1756-N1760 WeakPolarHBondContact CD2-ND2 3.28Å; Y1756-N1760 WeakPolarHBondContact CE2-ND2 3.24Å; Y1756-N1760 WeakPolarHBondContact O-CB 3.37Å; Y1756-N1760 PolarHBondContact O-N 3.25Å; Y1756-N1760 PolarHBondContact O-ND2 3.03Å
1757	V	94.7	Very high	93.4	Very high	0 Å²	0	79 Å²	79	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-61	-40.8	174.9	174.3	0	0	0	0	111.7	E1715 A1718 M1719 R1722 W1747 E1753 R1755 C1761	E1715-V1757 HydrophobicContact CG-CG2 3.73Å; A1718-V1757 HydrophobicContact CB-CG1 4.36Å; M1719-V1757 HydrophobicContact CG-CB 4.44Å; M1719-V1757 HydrophobicContact CG-CG1 4.07Å; M1719-V1757 HydrophobicContact CG-CG2 3.73Å; R1722-V1757 HydrophobicContact CB-CG1 3.88Å; R1722-V1757 HydrophobicContact CG-CG1 3.98Å; W1747-V1757 HydrophobicContact CH2-CG2 4.42Å; W1747-V1757 HydrophobicContact CZ2-CB 4.36Å; W1747-V1757 HydrophobicContact CZ2-CG2 3.66Å; E1753-V1757 PolarHBondContact O-N 2.83Å; R1755-V1757 VanDerWaalsContact C-N 3.35Å; R1755-V1757 PolarHBondContact O-N 3.34Å; V1757-C1761 VanDerWaalsContact O-CB 3.27Å; V1757-C1761 WeakPolarHBondContact O-CB 3.38Å; V1757-C1761 PolarHBondContact O-N 2.8Å
1758	R	93.4	Very high	93.4	Very high	117 Å²	117	79.5 Å²	79.5	44%	0.442	36%	0.357	S	S	.	.	H	α-helix	trans	-66.7	-38.9	179.6	-171.5	-161.1	-55.6	-150.7	2.3	113.1	F1749 G1754 R1755 Y1756	F1749-R1758 PolarHBondContact O-NH2 3.01Å; G1754-R1758 VanDerWaalsContact O-CB 3.24Å; G1754-R1758 WeakPolarHBondContact O-CB 3.16Å; G1754-R1758 PolarHBondContact O-N 3.17Å; R1755-R1758 WeakPolarHBondContact O-CB 3.14Å; R1755-R1758 PolarHBondContact O-N 3.26Å; R1755-R1758 VanDerWaalsContact O-N 3.09Å; Y1756-R1758 VanDerWaalsContact C-N 3.34Å; Y1756-R1758 PolarHBondContact O-N 3.08Å
1759	E	93.2	Very high	93.3	Very high	139 Å²	139	81.5 Å²	81.5	65%	0.65	36%	0.362	S	S	*	.	H	α-helix	trans	-82	-37.7	-175.6	-72.4	176	-176.8	0	0	112.5	R1755 Y1756	R1755-E1759 VanDerWaalsContact CD-OE1 3.29Å; R1755-E1759 WeakPolarHBondContact CD-OE1 3.37Å; R1755-E1759 HydrophobicContact CG-CG 4.18Å; R1755-E1759 WeakPolarHBondContact CG-OE1 3.39Å; R1755-E1759 WeakPolarHBondContact O-CB 3.39Å; R1755-E1759 WeakPolarHBondContact O-CG 3.45Å; R1755-E1759 PolarHBondContact O-N 3.34Å; Y1756-E1759 PolarHBondContact O-N 2.77Å
1760	N	93.9	Very high	93.5	Very high	83 Å²	83	80.7 Å²	80.7	44%	0.444	36%	0.362	S	S	.	.	H	α-helix	trans	-91.7	-40	-176.7	-63.5	-80.4	0	0	0	112.9	Y1756	Y1756-N1760 WeakPolarHBondContact CD2-ND2 3.28Å; Y1756-N1760 WeakPolarHBondContact CE2-ND2 3.24Å; Y1756-N1760 WeakPolarHBondContact O-CB 3.37Å; Y1756-N1760 PolarHBondContact O-N 3.25Å; Y1756-N1760 PolarHBondContact O-ND2 3.03Å
1761	C	94.3	Very high	93.7	Very high	5 Å²	5	80.6 Å²	80.6	3%	0.034	37%	0.368	C	S	.	.			trans	-90.8	143.3	-179.3	-66	0	0	0	0	113	M1719 R1722 V1757	M1719-C1761 WeakPolarHBondContact CE-SG 3.4Å; R1722-C1761 HydrophobicContact CB-CB 4.18Å; R1722-C1761 HydrophobicContact CG-CB 3.48Å; R1722-C1761 VanDerWaalsContact CG-CB 3.48Å; R1722-C1761 VanDerWaalsContact CZ-O 3.23Å; R1722-C1761 PolarHBondContact NE-O 3.43Å; R1722-C1761 PolarHBondContact NH2-O 3.16Å; R1722-C1761 VanDerWaalsContact NH2-O 3.08Å; V1757-C1761 VanDerWaalsContact O-CB 3.27Å; V1757-C1761 WeakPolarHBondContact O-CB 3.38Å; V1757-C1761 PolarHBondContact O-N 2.8Å
1762	R	95.5	Very high	93.9	Very high	91 Å²	91	80.6 Å²	80.6	34%	0.343	37%	0.372	S	S	.	.			trans	-144	158.4	179.2	58.6	-172.1	-172.6	-94.7	9.5	110.4	L1764 R1766 Y1767	R1762-L1764 PolarHBondContact O-N 3.5Å; R1762-R1766 HydrophobicContact CB-CB 4.35Å; R1762-R1766 HydrophobicContact CG-CB 4.03Å; R1762-R1766 PolarHBondContact NE-O 2.88Å; R1762-Y1767 HydrophobicContact CG-CD1 4.31Å; R1762-Y1767 HydrophobicContact CG-CD2 4.18Å; R1762-Y1767 HydrophobicContact CG-CE1 3.85Å; R1762-Y1767 HydrophobicContact CG-CE2 3.75Å; R1762-Y1767 HydrophobicContact CG-CG 4.46Å; R1762-Y1767 PolarHBondContact N-OH 3.26Å; R1762-Y1767 VanDerWaalsContact NH1-CE1 3.26Å; R1762-Y1767 VanDerWaalsContact O-CE2 3.23Å; R1762-Y1767 WeakPolarHBondContact O-CE2 3.45Å
1763	P	97.3	Very high	94.1	Very high	48 Å²	48	79.2 Å²	79.2	31%	0.312	37%	0.366	S	S	.	.			trans	-56.7	140.8	-179.3	-24.7	35.7	0	0	0	111.3	T1723 L1765 R1766	T1723-P1763 CarbonylContact O-C 2.79Å; T1723-P1763 VanDerWaalsContact O-CA 3.3Å; T1723-P1763 WeakPolarHBondContact O-CA 3.25Å; P1763-L1765 VanDerWaalsContact C-N 3.32Å; P1763-L1765 PolarHBondContact O-N 2.93Å; P1763-L1765 VanDerWaalsContact O-N 3.11Å; P1763-R1766 WeakPolarHBondContact O-CB 3.33Å; P1763-R1766 PolarHBondContact O-N 3.25Å
1764	L	97.5	Very high	94.2	Very high	7 Å²	7	77.3 Å²	77.3	4%	0.037	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-49.2	-46.5	-164.8	-172.6	61.2	0	0	0	113.7	F1699 L1707 T1723 L1724 R1762 R1766 Y1767 F1779 M1782 L1786	F1699-L1764 HydrophobicContact CD2-CD1 4.12Å; F1699-L1764 HydrophobicContact CE2-CD1 4.32Å; L1707-L1764 HydrophobicContact CD1-CD1 4.2Å; T1723-L1764 HydrophobicContact CG2-CB 4.24Å; T1723-L1764 HydrophobicContact CG2-CD1 4.41Å; T1723-L1764 PolarHBondContact O-N 2.93Å; L1724-L1764 HydrophobicContact CD2-CB 4.5Å; L1724-L1764 HydrophobicContact CD2-CD2 4.12Å; R1762-L1764 PolarHBondContact O-N 3.5Å; L1764-R1766 PolarHBondContact O-N 2.92Å; L1764-Y1767 HydrophobicContact CD1-CD2 4.43Å; L1764-Y1767 WeakPolarHBondContact O-CD2 3.22Å; L1764-Y1767 PolarHBondContact O-N 2.85Å; L1764-F1779 HydrophobicContact CD1-CD1 4.48Å; L1764-F1779 HydrophobicContact CD1-CE1 4.21Å; L1764-F1779 HydrophobicContact CG-CD1 4.03Å; L1764-F1779 HydrophobicContact CG-CE1 4.21Å; L1764-F1779 WeakPolarHBondContact O-CE1 3.37Å; L1764-M1782 HydrophobicContact CD2-CB 4.41Å; L1764-L1786 HydrophobicContact CD2-CD1 4.12Å
1765	L	95.4	Very high	94.4	Very high	115 Å²	115	77.3 Å²	77.3	60%	0.602	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-61.9	-10.3	178.1	-61.8	176.8	0	0	0	115.1	P1763 Y1767 C1768 F1779	P1763-L1765 VanDerWaalsContact C-N 3.32Å; P1763-L1765 PolarHBondContact O-N 2.93Å; P1763-L1765 VanDerWaalsContact O-N 3.11Å; L1765-Y1767 VanDerWaalsContact C-N 3.31Å; L1765-C1768 PolarHBondContact O-SG 2.77Å; L1765-C1768 VanDerWaalsContact O-SG 3.37Å; L1765-F1779 HydrophobicContact CD2-CB 3.95Å; L1765-F1779 HydrophobicContact CD2-CD1 4.41Å
1766	R	95.6	Very high	94.5	Very high	154 Å²	154	74.5 Å²	74.5	58%	0.581	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-87	5.5	172.9	-59.2	-163.1	-176.4	-174.9	-0.9	113.6	R1762 P1763 L1764	R1762-R1766 HydrophobicContact CB-CB 4.35Å; R1762-R1766 HydrophobicContact CG-CB 4.03Å; R1762-R1766 PolarHBondContact NE-O 2.88Å; P1763-R1766 WeakPolarHBondContact O-CB 3.33Å; P1763-R1766 PolarHBondContact O-N 3.25Å; L1764-R1766 PolarHBondContact O-N 2.92Å
1767	Y	95.7	Very high	94.7	Very high	12 Å²	12	71.4 Å²	71.4	5%	0.047	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-97.1	-8.5	170.4	-64.4	-82.1	0	0	0	113.6	F1699 Y1705 L1707 T1723 R1762 L1764 L1765 K1769	F1699-Y1767 AromaticContact CE2-CD1 3.87Å; F1699-Y1767 HydrophobicContact CE2-CD1 3.87Å; F1699-Y1767 AromaticContact CE2-CD2 3.57Å; F1699-Y1767 HydrophobicContact CE2-CD2 3.57Å; F1699-Y1767 HydrophobicContact CE2-CE1 4.38Å; F1699-Y1767 HydrophobicContact CE2-CE2 4.08Å; F1699-Y1767 AromaticContact CE2-CG 3.44Å; F1699-Y1767 HydrophobicContact CE2-CG 3.44Å; F1699-Y1767 VanDerWaalsContact CE2-CG 3.44Å; F1699-Y1767 AromaticContact CZ-CD1 3.62Å; F1699-Y1767 HydrophobicContact CZ-CD1 3.62Å; F1699-Y1767 AromaticContact CZ-CD2 3.99Å; F1699-Y1767 HydrophobicContact CZ-CD2 3.99Å; F1699-Y1767 AromaticContact CZ-CE1 3.83Å; F1699-Y1767 HydrophobicContact CZ-CE1 3.83Å; F1699-Y1767 HydrophobicContact CZ-CE2 4.15Å; F1699-Y1767 AromaticContact CZ-CG 3.72Å; F1699-Y1767 HydrophobicContact CZ-CG 3.72Å; Y1705-Y1767 HydrophobicContact CE2-CE1 4.47Å; Y1705-Y1767 WeakPolarHBondContact OH-CD1 3.5Å; L1707-Y1767 HydrophobicContact CD1-CE2 4.37Å; T1723-Y1767 HydrophobicContact CG2-CE2 4.34Å; R1762-Y1767 HydrophobicContact CG-CD1 4.31Å; R1762-Y1767 HydrophobicContact CG-CD2 4.18Å; R1762-Y1767 HydrophobicContact CG-CE1 3.85Å; R1762-Y1767 HydrophobicContact CG-CE2 3.75Å; R1762-Y1767 HydrophobicContact CG-CG 4.46Å; R1762-Y1767 PolarHBondContact N-OH 3.26Å; R1762-Y1767 VanDerWaalsContact NH1-CE1 3.26Å; R1762-Y1767 VanDerWaalsContact O-CE2 3.23Å; R1762-Y1767 WeakPolarHBondContact O-CE2 3.45Å; L1764-Y1767 HydrophobicContact CD1-CD2 4.43Å; L1764-Y1767 WeakPolarHBondContact O-CD2 3.22Å; L1764-Y1767 PolarHBondContact O-N 2.85Å; L1765-Y1767 VanDerWaalsContact C-N 3.31Å; Y1767-K1769 PolarHBondContact O-N 2.64Å
1768	C	94.1	Very high	94.8	Very high	37 Å²	37	71.4 Å²	71.4	25%	0.25	34%	0.342	C	S	.	.			trans	-53.6	128.4	171.5	-58.4	0	0	0	0	111.1	L1765 T1775 F1779	L1765-C1768 PolarHBondContact O-SG 2.77Å; L1765-C1768 VanDerWaalsContact O-SG 3.37Å; C1768-T1775 HydrophobicContact CB-CG2 3.71Å; C1768-F1779 VanDerWaalsContact SG-CG 3.55Å
1769	K	89.8	Confident	95.1	Very high	124 Å²	124	65.8 Å²	65.8	54%	0.539	32%	0.321	S	S	.	.	S	Bend	trans	-85.4	-18.5	178.8	-61.8	171.9	176.5	179.1	0	112.4	Y1702 T1703 Y1767	Y1702-K1769 HydrophobicContact CE1-CB 4.46Å; Y1702-K1769 HydrophobicContact CE1-CD 3.87Å; Y1702-K1769 HydrophobicContact CE1-CG 3.8Å; Y1702-K1769 HydrophobicContact CE2-CD 4.45Å; Y1702-K1769 PolarHBondContact O-NZ 2.81Å; Y1702-K1769 WeakPolarHBondContact OH-CB 3.35Å; Y1702-K1769 PolarHBondContact OH-N 3.19Å; T1703-K1769 PolarHBondContact O-NZ 3.26Å; T1703-K1769 VanDerWaalsContact O-NZ 3.11Å; Y1767-K1769 PolarHBondContact O-N 2.64Å
1770	D	91.6	Very high	95.3	Very high	74 Å²	74	62.1 Å²	62.1	40%	0.396	31%	0.306	S	S	.	.	S	Bend	trans	-155.9	170.7	178.4	55.4	73.6	0	0	0	110.4	S1772 T1775	D1770-S1772 VanDerWaalsContact OD1-CB 3.23Å; D1770-S1772 WeakPolarHBondContact OD1-CB 3.35Å; D1770-S1772 PolarHBondContact OD1-N 3.46Å; D1770-S1772 VanDerWaalsContact OD1-N 3.1Å; D1770-S1772 PolarHBondContact OD1-OG 3.37Å; D1770-T1775 WeakPolarHBondContact O-CG2 3.14Å; D1770-T1775 WeakPolarHBondContact OD1-CB 3.47Å; D1770-T1775 PolarHBondContact OD1-OG1 3.29Å
1771	E	91.6	Very high	95.5	Very high	185 Å²	185	58.2 Å²	58.2	86%	0.864	29%	0.285	S	S	*	.			trans	-102.1	28.6	178.8	-59.4	-179.6	159.1	0	0	111.9
1772	S	94.4	Very high	95.7	Very high	49 Å²	49	58 Å²	58	34%	0.343	28%	0.283	S	S	.	.			trans	-71.1	151.3	175.9	68.3	0	0	0	0	111.6	D1770 D1774 T1775 L1776	D1770-S1772 VanDerWaalsContact OD1-CB 3.23Å; D1770-S1772 WeakPolarHBondContact OD1-CB 3.35Å; D1770-S1772 PolarHBondContact OD1-N 3.46Å; D1770-S1772 VanDerWaalsContact OD1-N 3.1Å; D1770-S1772 PolarHBondContact OD1-OG 3.37Å; S1772-D1774 PolarHBondContact O-N 2.96Å; S1772-T1775 PolarHBondContact O-N 2.8Å; S1772-T1775 PolarHBondContact OG-N 3Å; S1772-T1775 PolarHBondContact OG-OG1 2.92Å; S1772-L1776 WeakPolarHBondContact O-CG 3.23Å; S1772-L1776 PolarHBondContact O-N 2.91Å
1773	Q	95	Very high	95.9	Very high	116 Å²	116	56 Å²	56	54%	0.542	28%	0.283	S	S	.	.	H	α-helix	trans	-57.6	-37	177.1	-168.1	66.3	52.2	0	0	111.6	T1775 L1776 D1777	Q1773-T1775 PolarHBondContact O-N 2.95Å; Q1773-L1776 PolarHBondContact O-N 3.02Å; Q1773-D1777 PolarHBondContact NE2-OD1 3.27Å; Q1773-D1777 WeakPolarHBondContact O-CB 3.43Å; Q1773-D1777 PolarHBondContact O-N 3.23Å
1774	D	94.2	Very high	95.9	Very high	49 Å²	49	57.7 Å²	57.7	26%	0.262	29%	0.286	S	S	.	.	H	α-helix	trans	-57.5	-45.5	173.7	-79.1	-8.2	0	0	0	112.6	M1591 R1595 S1772 L1778 H1807	M1591-D1774 HydrophobicContact CE-CB 4.19Å; M1591-D1774 HydrophobicContact CG-CB 3.97Å; M1591-D1774 HydrophobicContact SD-CB 4.47Å; R1595-D1774 IonicContact CZ-OD2 3.36Å; R1595-D1774 IonicContact NH2-OD1 3.32Å; R1595-D1774 PolarHBondContact NH2-OD1 2.84Å; R1595-D1774 IonicContact NH2-OD2 2.58Å; R1595-D1774 PolarHBondContact NH2-OD2 3.25Å; S1772-D1774 PolarHBondContact O-N 2.96Å; D1774-L1778 VanDerWaalsContact O-CB 3.29Å; D1774-L1778 WeakPolarHBondContact O-CB 3.4Å; D1774-L1778 PolarHBondContact O-N 3.16Å; D1774-H1807 IonicContact OD1-CG 3.55Å
1775	T	96.6	Very high	96	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-68.1	-39.3	175.8	-66.1	0	0	0	0	111.1	M1591 Y1702 C1768 D1770 S1772 Q1773 F1779	M1591-T1775 VanDerWaalsContact CE-OG1 3.29Å; M1591-T1775 WeakPolarHBondContact CE-OG1 3.47Å; Y1702-T1775 VanDerWaalsContact OH-CG2 3.27Å; Y1702-T1775 WeakPolarHBondContact OH-CG2 3.44Å; Y1702-T1775 PolarHBondContact OH-OG1 3.13Å; C1768-T1775 HydrophobicContact CB-CG2 3.71Å; D1770-T1775 WeakPolarHBondContact O-CG2 3.14Å; D1770-T1775 WeakPolarHBondContact OD1-CB 3.47Å; D1770-T1775 PolarHBondContact OD1-OG1 3.29Å; S1772-T1775 PolarHBondContact O-N 2.8Å; S1772-T1775 PolarHBondContact OG-N 3Å; S1772-T1775 PolarHBondContact OG-OG1 2.92Å; Q1773-T1775 PolarHBondContact O-N 2.95Å; T1775-F1779 HydrophobicContact CG2-CD2 3.98Å; T1775-F1779 HydrophobicContact CG2-CE2 4.15Å; T1775-F1779 VanDerWaalsContact O-CD2 3.26Å; T1775-F1779 WeakPolarHBondContact O-CD2 3.48Å; T1775-F1779 PolarHBondContact O-N 3.38Å
1776	L	96.9	Very high	96.1	Very high	77 Å²	77	52 Å²	52	40%	0.403	26%	0.256	S	S	.	.	H	α-helix	trans	-66.4	-42.8	178.3	-65.3	175.5	0	0	0	112.1	S1772 Q1773 F1779 D1780	S1772-L1776 WeakPolarHBondContact O-CG 3.23Å; S1772-L1776 PolarHBondContact O-N 2.91Å; Q1773-L1776 PolarHBondContact O-N 3.02Å; L1776-F1779 PolarHBondContact O-N 3.31Å; L1776-D1780 WeakPolarHBondContact O-CB 3.16Å; L1776-D1780 PolarHBondContact O-N 3.46Å
1777	D	97.3	Very high	96.3	Very high	17 Å²	17	48.1 Å²	48.1	9%	0.091	24%	0.244	C	C	.	.	H	α-helix	trans	-69.1	-37.3	178.3	-71.5	0.3	0	0	0	111.6	Q1773 L1781 H1802 P1803 F1804	Q1773-D1777 PolarHBondContact NE2-OD1 3.27Å; Q1773-D1777 WeakPolarHBondContact O-CB 3.43Å; Q1773-D1777 PolarHBondContact O-N 3.23Å; D1777-L1781 WeakPolarHBondContact O-CB 3.4Å; D1777-L1781 PolarHBondContact O-N 3.33Å; D1777-H1802 PolarHBondContact O-CE1 3.33Å; D1777-P1803 WeakPolarHBondContact OD2-CB 3.47Å; D1777-F1804 HydrophobicContact CB-CB 3.94Å; D1777-F1804 HydrophobicContact CB-CD2 4.34Å
1778	L	98.1	Very high	96.4	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-49.7	170.3	170.1	59.9	0	0	0	111.2	M1591 V1594 M1698 Y1702 D1774 L1781 M1782 F1804	M1591-L1778 HydrophobicContact CE-CD2 3.86Å; M1591-L1778 HydrophobicContact SD-CD2 3.89Å; V1594-L1778 HydrophobicContact CG1-CD1 4.27Å; V1594-L1778 HydrophobicContact CG1-CD2 4.36Å; M1698-L1778 HydrophobicContact CB-CD1 4.49Å; M1698-L1778 HydrophobicContact CE-CD1 3.37Å; Y1702-L1778 HydrophobicContact CD2-CD2 3.49Å; Y1702-L1778 VanDerWaalsContact CD2-CD2 3.49Å; Y1702-L1778 HydrophobicContact CE2-CD2 4.01Å; Y1702-L1778 HydrophobicContact CG-CD2 3.76Å; D1774-L1778 VanDerWaalsContact O-CB 3.29Å; D1774-L1778 WeakPolarHBondContact O-CB 3.4Å; D1774-L1778 PolarHBondContact O-N 3.16Å; L1778-L1781 PolarHBondContact O-N 2.81Å; L1778-M1782 HydrophobicContact CD1-CE 4.42Å; L1778-M1782 HydrophobicContact CD1-CG 4.26Å; L1778-M1782 HydrophobicContact CD1-SD 4.23Å; L1778-M1782 HydrophobicContact CG-CE 4.07Å; L1778-M1782 WeakPolarHBondContact O-CG 3.08Å; L1778-M1782 PolarHBondContact O-N 2.87Å; L1778-F1804 HydrophobicContact CB-CD2 3.91Å; L1778-F1804 HydrophobicContact CB-CE2 3.68Å; L1778-F1804 HydrophobicContact CB-CZ 4.06Å; L1778-F1804 HydrophobicContact CD1-CE1 3.95Å; L1778-F1804 HydrophobicContact CD1-CE2 4.36Å; L1778-F1804 HydrophobicContact CD1-CZ 3.84Å; L1778-F1804 HydrophobicContact CG-CE2 4.47Å; L1778-F1804 HydrophobicContact CG-CZ 4.39Å
1779	F	98.2	Very high	96.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-72.1	-32.5	-177.8	-86.5	-101.7	0	0	0	112.9	Y1702 L1764 L1765 C1768 T1775 L1776 M1782 S1783	Y1702-F1779 AromaticContact CD1-CE2 3.84Å; Y1702-F1779 HydrophobicContact CD1-CE2 3.84Å; Y1702-F1779 HydrophobicContact CD1-CZ 4.07Å; Y1702-F1779 AromaticContact CE1-CE2 3.57Å; Y1702-F1779 HydrophobicContact CE1-CE2 3.57Å; Y1702-F1779 AromaticContact CE1-CZ 3.91Å; Y1702-F1779 HydrophobicContact CE1-CZ 3.91Å; L1764-F1779 HydrophobicContact CD1-CD1 4.48Å; L1764-F1779 HydrophobicContact CD1-CE1 4.21Å; L1764-F1779 HydrophobicContact CG-CD1 4.03Å; L1764-F1779 HydrophobicContact CG-CE1 4.21Å; L1764-F1779 WeakPolarHBondContact O-CE1 3.37Å; L1765-F1779 HydrophobicContact CD2-CB 3.95Å; L1765-F1779 HydrophobicContact CD2-CD1 4.41Å; C1768-F1779 VanDerWaalsContact SG-CG 3.55Å; T1775-F1779 HydrophobicContact CG2-CD2 3.98Å; T1775-F1779 HydrophobicContact CG2-CE2 4.15Å; T1775-F1779 VanDerWaalsContact O-CD2 3.26Å; T1775-F1779 WeakPolarHBondContact O-CD2 3.48Å; T1775-F1779 PolarHBondContact O-N 3.38Å; L1776-F1779 PolarHBondContact O-N 3.31Å; F1779-M1782 HydrophobicContact CB-CE 4.29Å; F1779-M1782 HydrophobicContact CD1-CE 3.53Å; F1779-M1782 HydrophobicContact CD2-CE 3.53Å; F1779-M1782 HydrophobicContact CE1-CE 3.53Å; F1779-M1782 HydrophobicContact CE2-CE 3.57Å; F1779-M1782 HydrophobicContact CG-CE 3.53Å; F1779-M1782 HydrophobicContact CZ-CE 3.57Å; F1779-M1782 PolarHBondContact O-N 2.7Å; F1779-S1783 WeakPolarHBondContact O-CB 3.34Å; F1779-S1783 PolarHBondContact O-N 2.86Å; F1779-S1783 PolarHBondContact O-OG 3.03Å
1780	D	98.1	Very high	97	Very high	62 Å²	62	43.1 Å²	43.1	33%	0.332	22%	0.223	S	C	.	.	H	α-helix	trans	-65.3	-35.8	170.5	174.9	64	0	0	0	112.2	L1776 K1784 H1802	L1776-D1780 WeakPolarHBondContact O-CB 3.16Å; L1776-D1780 PolarHBondContact O-N 3.46Å; D1780-K1784 VanDerWaalsContact O-CD 3.32Å; D1780-K1784 WeakPolarHBondContact O-CD 3.18Å; D1780-K1784 VanDerWaalsContact O-CG 3.32Å; D1780-K1784 WeakPolarHBondContact O-CG 3.45Å; D1780-K1784 PolarHBondContact O-N 3.28Å; D1780-K1784 WeakPolarHBondContact OD1-CE 3.24Å; D1780-K1784 IonicContact OD1-NZ 2.93Å; D1780-K1784 PolarHBondContact OD1-NZ 3.17Å; D1780-K1784 IonicContact OD2-NZ 2.79Å; D1780-K1784 PolarHBondContact OD2-NZ 2.84Å; D1780-H1802 IonicContact OD2-CD2 2.78Å; D1780-H1802 IonicContact OD2-CE1 2.8Å; D1780-H1802 PolarHBondContact OD2-CE1 3.35Å; D1780-H1802 VanDerWaalsContact OD2-CE1 3.25Å; D1780-H1802 IonicContact OD2-NE2 3.94Å; D1780-H1802 PolarHBondContact OD2-NE2 3.21Å
1781	L	98.5	Very high	97.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-68.3	-48.7	171.9	-177	53.2	0	0	0	111.6	M1698 D1777 L1778 S1783 K1784 M1785 I1794 A1799 H1802 F1804 F1805	M1698-L1781 HydrophobicContact CE-CD2 3.94Å; M1698-L1781 HydrophobicContact SD-CD2 4.1Å; M1698-L1781 HydrophobicContact SD-CG 4.28Å; D1777-L1781 WeakPolarHBondContact O-CB 3.4Å; D1777-L1781 PolarHBondContact O-N 3.33Å; L1778-L1781 PolarHBondContact O-N 2.81Å; L1781-S1783 VanDerWaalsContact C-N 3.31Å; L1781-S1783 PolarHBondContact O-N 2.72Å; L1781-K1784 PolarHBondContact O-N 3.07Å; L1781-M1785 HydrophobicContact CD1-CE 3.95Å; L1781-M1785 HydrophobicContact CD1-CG 4.41Å; L1781-M1785 HydrophobicContact CD1-SD 4.38Å; L1781-M1785 HydrophobicContact CD2-CE 4.26Å; L1781-M1785 HydrophobicContact CG-CE 4.01Å; L1781-M1785 HydrophobicContact CG-SD 4.11Å; L1781-M1785 PolarHBondContact O-N 2.75Å; L1781-I1794 HydrophobicContact CD1-CD1 4.27Å; L1781-A1799 HydrophobicContact CD1-CB 4.18Å; L1781-H1802 HydrophobicContact CD1-CB 4.04Å; L1781-H1802 HydrophobicContact CD2-CB 4.34Å; L1781-F1804 HydrophobicContact CD2-CB 4.41Å; L1781-F1804 HydrophobicContact CD2-CD1 4.01Å; L1781-F1805 HydrophobicContact CD2-CD2 4.33Å; L1781-F1805 HydrophobicContact CD2-CE1 4.48Å; L1781-F1805 HydrophobicContact CD2-CE2 3.6Å; L1781-F1805 HydrophobicContact CD2-CZ 3.69Å
1782	M	98.6	Very high	97.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-40.1	177	-69.6	-171.7	-55.9	0	0	112.1	M1698 F1699 L1764 L1778 F1779 K1784 M1785 L1786	M1698-M1782 HydrophobicContact CB-CG 3.77Å; M1698-M1782 HydrophobicContact CB-SD 3.75Å; M1698-M1782 HydrophobicContact SD-CG 4.29Å; F1699-M1782 VanDerWaalsContact CA-SD 3.58Å; F1699-M1782 HydrophobicContact CB-SD 3.86Å; F1699-M1782 PolarHBondContact N-SD 2.72Å; F1699-M1782 VanDerWaalsContact N-SD 3.38Å; L1764-M1782 HydrophobicContact CD2-CB 4.41Å; L1778-M1782 HydrophobicContact CD1-CE 4.42Å; L1778-M1782 HydrophobicContact CD1-CG 4.26Å; L1778-M1782 HydrophobicContact CD1-SD 4.23Å; L1778-M1782 HydrophobicContact CG-CE 4.07Å; L1778-M1782 WeakPolarHBondContact O-CG 3.08Å; L1778-M1782 PolarHBondContact O-N 2.87Å; F1779-M1782 HydrophobicContact CB-CE 4.29Å; F1779-M1782 HydrophobicContact CD1-CE 3.53Å; F1779-M1782 HydrophobicContact CD2-CE 3.53Å; F1779-M1782 HydrophobicContact CE1-CE 3.53Å; F1779-M1782 HydrophobicContact CE2-CE 3.57Å; F1779-M1782 HydrophobicContact CG-CE 3.53Å; F1779-M1782 HydrophobicContact CZ-CE 3.57Å; F1779-M1782 PolarHBondContact O-N 2.7Å; M1782-K1784 PolarHBondContact O-N 3.37Å; M1782-M1785 PolarHBondContact O-N 2.96Å; M1782-L1786 WeakPolarHBondContact O-CB 3.19Å; M1782-L1786 VanDerWaalsContact O-CG 3.32Å; M1782-L1786 WeakPolarHBondContact O-CG 2.92Å; M1782-L1786 PolarHBondContact O-N 3.45Å
1783	S	98.4	Very high	97.7	Very high	49 Å²	49	38.6 Å²	38.6	34%	0.343	21%	0.212	S	C	.	.	H	α-helix	trans	-59.3	-31.9	174.3	-79.3	0	0	0	0	113.6	F1779 L1781	F1779-S1783 WeakPolarHBondContact O-CB 3.34Å; F1779-S1783 PolarHBondContact O-N 2.86Å; F1779-S1783 PolarHBondContact O-OG 3.03Å; L1781-S1783 VanDerWaalsContact C-N 3.31Å; L1781-S1783 PolarHBondContact O-N 2.72Å
1784	K	98.6	Very high	97.9	Very high	84 Å²	84	34.2 Å²	34.2	37%	0.365	19%	0.192	S	C	.	.	H	α-helix	trans	-84.7	-25.1	179.1	-67.5	163.9	-174.3	168.1	0	113.1	D1780 L1781 M1782 I1794	D1780-K1784 VanDerWaalsContact O-CD 3.32Å; D1780-K1784 WeakPolarHBondContact O-CD 3.18Å; D1780-K1784 VanDerWaalsContact O-CG 3.32Å; D1780-K1784 WeakPolarHBondContact O-CG 3.45Å; D1780-K1784 PolarHBondContact O-N 3.28Å; D1780-K1784 WeakPolarHBondContact OD1-CE 3.24Å; D1780-K1784 IonicContact OD1-NZ 2.93Å; D1780-K1784 PolarHBondContact OD1-NZ 3.17Å; D1780-K1784 IonicContact OD2-NZ 2.79Å; D1780-K1784 PolarHBondContact OD2-NZ 2.84Å; L1781-K1784 PolarHBondContact O-N 3.07Å; M1782-K1784 PolarHBondContact O-N 3.37Å; K1784-I1794 HydrophobicContact CB-CB 3.98Å; K1784-I1794 HydrophobicContact CB-CD1 4.39Å; K1784-I1794 HydrophobicContact CB-CG2 3.82Å; K1784-I1794 HydrophobicContact CD-CD1 4.44Å; K1784-I1794 WeakPolarHBondContact O-CG2 3.36Å; K1784-I1794 PolarHBondContact O-N 2.88Å; K1784-I1794 VanDerWaalsContact O-N 3.08Å
1785	M	98.8	Very high	98.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-77.9	-32.5	171.2	-70.9	175.3	161.8	0	0	112.2	C1602 V1691 I1694 M1698 L1781 M1782 E1787 R1793 I1794 A1799	C1602-M1785 VanDerWaalsContact SG-CE 3.57Å; V1691-M1785 HydrophobicContact CG1-CB 4.06Å; V1691-M1785 HydrophobicContact CG1-CG 3.81Å; I1694-M1785 HydrophobicContact CG2-CE 3.74Å; I1694-M1785 HydrophobicContact CG2-SD 3.88Å; M1698-M1785 HydrophobicContact SD-CE 4.01Å; M1698-M1785 HydrophobicContact SD-SD 3.55Å; L1781-M1785 HydrophobicContact CD1-CE 3.95Å; L1781-M1785 HydrophobicContact CD1-CG 4.41Å; L1781-M1785 HydrophobicContact CD1-SD 4.38Å; L1781-M1785 HydrophobicContact CD2-CE 4.26Å; L1781-M1785 HydrophobicContact CG-CE 4.01Å; L1781-M1785 HydrophobicContact CG-SD 4.11Å; L1781-M1785 PolarHBondContact O-N 2.75Å; M1782-M1785 PolarHBondContact O-N 2.96Å; M1785-E1787 VanDerWaalsContact C-N 3.31Å; M1785-E1787 PolarHBondContact O-N 3.14Å; M1785-R1793 WeakPolarHBondContact O-CD 3.42Å; M1785-R1793 VanDerWaalsContact O-CG 3.3Å; M1785-R1793 WeakPolarHBondContact O-CG 3.22Å; M1785-R1793 PolarHBondContact O-NE 3.08Å; M1785-I1794 HydrophobicContact CG-CG2 3.77Å; M1785-A1799 HydrophobicContact CE-CB 4.04Å
1786	L	98.8	Very high	98.1	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	20%	0.204	C	C	.	.	S	Bend	trans	-95.5	27.4	178.4	-59.8	171.7	0	0	0	112.5	W1692 L1707 L1724 L1764 M1782	W1692-L1786 HydrophobicContact CD2-CD2 3.72Å; W1692-L1786 HydrophobicContact CE3-CB 4.36Å; W1692-L1786 HydrophobicContact CE3-CD2 4.03Å; W1692-L1786 HydrophobicContact CG-CD2 4.09Å; W1692-L1786 HydrophobicContact CH2-CD2 4.49Å; W1692-L1786 HydrophobicContact CZ2-CD2 4.18Å; W1692-L1786 HydrophobicContact CZ3-CB 4.23Å; W1692-L1786 HydrophobicContact CZ3-CD2 4.41Å; W1692-L1786 WeakPolarHBondContact CZ3-O 3.38Å; L1707-L1786 HydrophobicContact CD2-CD1 3.53Å; L1724-L1786 HydrophobicContact CD1-CB 4.2Å; L1724-L1786 HydrophobicContact CD2-CB 3.93Å; L1724-L1786 HydrophobicContact CD2-CD1 4.33Å; L1764-L1786 HydrophobicContact CD2-CD1 4.12Å; M1782-L1786 WeakPolarHBondContact O-CB 3.19Å; M1782-L1786 VanDerWaalsContact O-CG 3.32Å; M1782-L1786 WeakPolarHBondContact O-CG 2.92Å; M1782-L1786 PolarHBondContact O-N 3.45Å
1787	E	98.6	Very high	98.1	Very high	72 Å²	72	34.7 Å²	34.7	34%	0.336	20%	0.203	S	C	.	.			trans	-70.8	138.8	169.4	-179.1	51.5	-103.8	0	0	109.8	M1785 D1792 R1793	M1785-E1787 VanDerWaalsContact C-N 3.31Å; M1785-E1787 PolarHBondContact O-N 3.14Å; E1787-D1792 HydrophobicContact CG-CB 3.89Å; E1787-R1793 HydrophobicContact CB-CB 4.24Å; E1787-R1793 HydrophobicContact CB-CG 4.48Å; E1787-R1793 PolarHBondContact O-NE 3.36Å; E1787-R1793 PolarHBondContact O-NH2 2.98Å
1788	Y	98.5	Very high	98.1	Very high	9 Å²	9	35.6 Å²	35.6	4%	0.035	21%	0.213	C	C	.	.	S	Bend	trans	-70.1	-38	-175	-79.9	-70.9	0	0	0	112.7	P1677 W1692 M1720 E1721 L1724 G1725 I1727 P1728 M1731 P1790 R1793	P1677-Y1788 HydrophobicContact CB-CD1 4.16Å; P1677-Y1788 HydrophobicContact CG-CD1 4.01Å; W1692-Y1788 HydrophobicContact CH2-CE1 4.45Å; M1720-Y1788 HydrophobicContact CB-CE1 4.09Å; M1720-Y1788 WeakPolarHBondContact CB-OH 3.32Å; M1720-Y1788 PolarHBondContact O-OH 3.38Å; M1720-Y1788 HydrophobicContact SD-CE1 4.2Å; E1721-Y1788 PolarHBondContact N-OH 2.97Å; L1724-Y1788 HydrophobicContact CB-CE2 3.82Å; L1724-Y1788 HydrophobicContact CD1-CE2 4.46Å; G1725-Y1788 VanDerWaalsContact O-CE2 3.3Å; G1725-Y1788 WeakPolarHBondContact O-CE2 3.25Å; G1725-Y1788 PolarHBondContact O-OH 2.89Å; I1727-Y1788 HydrophobicContact CB-CE1 4.46Å; I1727-Y1788 HydrophobicContact CG1-CD1 4.22Å; I1727-Y1788 HydrophobicContact CG1-CE1 3.59Å; P1728-Y1788 VanDerWaalsContact CD-CB 3.41Å; P1728-Y1788 HydrophobicContact CG-CG 4.34Å; M1731-Y1788 WeakPolarHBondContact CE-O 3.34Å; M1731-Y1788 VanDerWaalsContact SD-O 3.35Å; Y1788-P1790 VanDerWaalsContact O-CD 3.24Å; Y1788-P1790 WeakPolarHBondContact O-CD 3.29Å; Y1788-R1793 PolarHBondContact O-NH2 2.66Å
1789	D	97.6	Very high	98	Very high	23 Å²	23	35.6 Å²	35.6	12%	0.123	21%	0.213	C	C	.	.			trans	-76.7	118.3	174.4	-152.8	2.9	0	0	0	110.7	R1730 A1791 D1792 R1793	R1730-D1789 IonicContact CZ-OD1 2.83Å; R1730-D1789 VanDerWaalsContact CZ-OD1 3.23Å; R1730-D1789 IonicContact CZ-OD2 2.81Å; R1730-D1789 IonicContact NE-OD2 2.66Å; R1730-D1789 PolarHBondContact NE-OD2 3Å; R1730-D1789 IonicContact NH1-OD1 2.69Å; R1730-D1789 PolarHBondContact NH1-OD1 2.91Å; R1730-D1789 IonicContact NH1-OD2 3.67Å; R1730-D1789 PolarHBondContact NH1-OD2 2.77Å; R1730-D1789 IonicContact NH2-OD1 2.7Å; R1730-D1789 PolarHBondContact NH2-OD1 2.88Å; R1730-D1789 IonicContact NH2-OD2 2.73Å; R1730-D1789 PolarHBondContact NH2-OD2 3.22Å; D1789-A1791 PolarHBondContact O-N 2.97Å; D1789-D1792 HydrophobicContact CB-CB 3.89Å; D1789-D1792 WeakPolarHBondContact CB-OD2 3.44Å; D1789-D1792 PolarHBondContact O-N 3.27Å; D1789-R1793 WeakPolarHBondContact O-CB 3.42Å; D1789-R1793 PolarHBondContact O-N 2.7Å
1790	P	98.2	Very high	97.9	Very high	37 Å²	37	36.8 Å²	36.8	24%	0.24	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-18.8	167.7	23.5	-35.1	0	0	0	113.1	E1678 P1688 Y1788	E1678-P1790 HydrophobicContact CB-CG 4.14Å; E1678-P1790 HydrophobicContact CG-CB 4.34Å; E1678-P1790 HydrophobicContact CG-CG 4.05Å; P1688-P1790 HydrophobicContact CB-CB 3.64Å; P1688-P1790 WeakPolarHBondContact CB-O 3.44Å; P1688-P1790 HydrophobicContact CG-CB 4.09Å; P1688-P1790 WeakPolarHBondContact CG-O 3.29Å; Y1788-P1790 VanDerWaalsContact O-CD 3.24Å; Y1788-P1790 WeakPolarHBondContact O-CD 3.29Å
1791	A	97.2	Very high	97.8	Very high	83 Å²	83	38.4 Å²	38.4	69%	0.686	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-26	174.5	0	0	0	0	0	115.3	D1789	D1789-A1791 PolarHBondContact O-N 2.97Å
1792	D	97.7	Very high	97.7	Very high	118 Å²	118	38.9 Å²	38.9	63%	0.631	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-17	176.5	-65.2	-46.6	0	0	0	112	E1787 D1789	E1787-D1792 HydrophobicContact CG-CB 3.89Å; D1789-D1792 HydrophobicContact CB-CB 3.89Å; D1789-D1792 WeakPolarHBondContact CB-OD2 3.44Å; D1789-D1792 PolarHBondContact O-N 3.27Å
1793	R	98.6	Very high	97.7	Very high	11 Å²	11	41.6 Å²	41.6	4%	0.042	25%	0.251	C	S	.	.	S	Bend	trans	-60.5	141.3	178.5	-166.4	179	-62.3	151.4	8.1	112.1	E1678 P1688 V1691 M1785 E1787 Y1788 D1789 P1795	E1678-R1793 IonicContact OE1-CZ 3.49Å; E1678-R1793 IonicContact OE1-NH1 2.73Å; E1678-R1793 PolarHBondContact OE1-NH1 2.84Å; E1678-R1793 IonicContact OE1-NH2 3.59Å; E1678-R1793 IonicContact OE2-CZ 3.56Å; E1678-R1793 IonicContact OE2-NH1 3.23Å; E1678-R1793 PolarHBondContact OE2-NH1 2.71Å; E1678-R1793 IonicContact OE2-NH2 3.42Å; E1678-R1793 PolarHBondContact OE2-NH2 2.81Å; P1688-R1793 WeakPolarHBondContact O-CD 3.47Å; P1688-R1793 PolarHBondContact O-NH1 2.84Å; V1691-R1793 HydrophobicContact CB-CG 4.38Å; V1691-R1793 HydrophobicContact CG1-CG 4.01Å; M1785-R1793 WeakPolarHBondContact O-CD 3.42Å; M1785-R1793 VanDerWaalsContact O-CG 3.3Å; M1785-R1793 WeakPolarHBondContact O-CG 3.22Å; M1785-R1793 PolarHBondContact O-NE 3.08Å; E1787-R1793 HydrophobicContact CB-CB 4.24Å; E1787-R1793 HydrophobicContact CB-CG 4.48Å; E1787-R1793 PolarHBondContact O-NE 3.36Å; E1787-R1793 PolarHBondContact O-NH2 2.98Å; Y1788-R1793 PolarHBondContact O-NH2 2.66Å; D1789-R1793 WeakPolarHBondContact O-CB 3.42Å; D1789-R1793 PolarHBondContact O-N 2.7Å; R1793-P1795 WeakPolarHBondContact O-CD 3.17Å
1794	I	98.6	Very high	97.6	Very high	24 Å²	24	39.2 Å²	39.2	12%	0.123	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-65.8	121	-172.5	-169.5	171.2	0	0	0	112.7	V1691 L1781 K1784 M1785 A1798 A1799	V1691-I1794 HydrophobicContact CG1-CG2 4.29Å; V1691-I1794 WeakPolarHBondContact CG1-O 3.35Å; L1781-I1794 HydrophobicContact CD1-CD1 4.27Å; K1784-I1794 HydrophobicContact CB-CB 3.98Å; K1784-I1794 HydrophobicContact CB-CD1 4.39Å; K1784-I1794 HydrophobicContact CB-CG2 3.82Å; K1784-I1794 HydrophobicContact CD-CD1 4.44Å; K1784-I1794 WeakPolarHBondContact O-CG2 3.36Å; K1784-I1794 PolarHBondContact O-N 2.88Å; K1784-I1794 VanDerWaalsContact O-N 3.08Å; M1785-I1794 HydrophobicContact CG-CG2 3.77Å; I1794-A1798 HydrophobicContact CD1-CB 4.23Å; I1794-A1798 HydrophobicContact CG1-CB 3.85Å; I1794-A1799 HydrophobicContact CD1-CB 4.23Å; I1794-A1799 HydrophobicContact CG1-CB 4.37Å; I1794-A1799 HydrophobicContact CG2-CB 4.48Å
1795	P	98	Very high	97.5	Very high	75 Å²	75	35.4 Å²	35.4	49%	0.487	22%	0.218	S	C	.	.	P	Polyproline II helix	trans	-68.6	147	174.3	28.4	-34.4	0	0	0	110.5	R1793 S1797 A1798 A1799	R1793-P1795 WeakPolarHBondContact O-CD 3.17Å; P1795-S1797 PolarHBondContact O-N 2.86Å; P1795-S1797 VanDerWaalsContact O-N 3.11Å; P1795-A1798 HydrophobicContact CG-CB 4.06Å; P1795-A1798 WeakPolarHBondContact O-CA 3.25Å; P1795-A1798 WeakPolarHBondContact O-CB 3.19Å; P1795-A1798 PolarHBondContact O-N 2.92Å; P1795-A1799 PolarHBondContact O-N 3.12Å
1796	L	97.9	Very high	97.1	Very high	5 Å²	5	40 Å²	40	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-60.6	-27.8	-175.2	-64.1	-177.5	0	0	0	113.6	C1602 V1605 R1606 V1691 I1694 A1798 A1799 L1800	C1602-L1796 HydrophobicContact CB-CD2 4.32Å; V1605-L1796 HydrophobicContact CB-CD1 3.73Å; V1605-L1796 HydrophobicContact CG1-CD1 3.58Å; R1606-L1796 HydrophobicContact CB-CB 3.91Å; R1606-L1796 HydrophobicContact CB-CD1 4.25Å; V1691-L1796 HydrophobicContact CG1-CD2 4.39Å; V1691-L1796 HydrophobicContact CG2-CD2 3.97Å; V1691-L1796 HydrophobicContact CG2-CG 3.98Å; I1694-L1796 HydrophobicContact CD1-CD1 4.08Å; I1694-L1796 HydrophobicContact CD1-CD2 3.91Å; L1796-A1798 VanDerWaalsContact C-N 3.27Å; L1796-A1798 PolarHBondContact O-N 3.03Å; L1796-A1799 HydrophobicContact CD2-CB 4.32Å; L1796-A1799 PolarHBondContact O-N 3.44Å; L1796-L1800 WeakPolarHBondContact O-CG 3.24Å; L1796-L1800 PolarHBondContact O-N 2.83Å
1797	S	95.4	Very high	96.6	Very high	56 Å²	56	44.8 Å²	44.8	39%	0.392	27%	0.265	S	S	.	.	H	α-helix	trans	-59.8	-33.5	171.4	57.8	0	0	0	0	113.5	P1795	P1795-S1797 PolarHBondContact O-N 2.86Å; P1795-S1797 VanDerWaalsContact O-N 3.11Å
1798	A	96.9	Very high	96.2	Very high	36 Å²	36	41.6 Å²	41.6	30%	0.298	25%	0.25	S	C	.	.	H	α-helix	trans	-85.3	-39.2	171.8	0	0	0	0	0	111.8	I1794 P1795 L1796 L1800 T1801 H1802	I1794-A1798 HydrophobicContact CD1-CB 4.23Å; I1794-A1798 HydrophobicContact CG1-CB 3.85Å; P1795-A1798 HydrophobicContact CG-CB 4.06Å; P1795-A1798 WeakPolarHBondContact O-CA 3.25Å; P1795-A1798 WeakPolarHBondContact O-CB 3.19Å; P1795-A1798 PolarHBondContact O-N 2.92Å; L1796-A1798 VanDerWaalsContact C-N 3.27Å; L1796-A1798 PolarHBondContact O-N 3.03Å; A1798-L1800 VanDerWaalsContact C-N 3.31Å; A1798-L1800 PolarHBondContact O-N 2.98Å; A1798-T1801 PolarHBondContact O-N 3.12Å; A1798-T1801 PolarHBondContact O-OG1 2.83Å; A1798-H1802 PolarHBondContact O-N 2.69Å
1799	A	97.7	Very high	95.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-55.7	-43.2	178.5	0	0	0	0	0	112.2	L1781 M1785 I1794 P1795 L1796 T1801 H1802 F1805	L1781-A1799 HydrophobicContact CD1-CB 4.18Å; M1785-A1799 HydrophobicContact CE-CB 4.04Å; I1794-A1799 HydrophobicContact CD1-CB 4.23Å; I1794-A1799 HydrophobicContact CG1-CB 4.37Å; I1794-A1799 HydrophobicContact CG2-CB 4.48Å; P1795-A1799 PolarHBondContact O-N 3.12Å; L1796-A1799 HydrophobicContact CD2-CB 4.32Å; L1796-A1799 PolarHBondContact O-N 3.44Å; A1799-T1801 PolarHBondContact O-N 2.7Å; A1799-H1802 WeakPolarHBondContact O-CB 2.95Å; A1799-H1802 PolarHBondContact O-N 2.7Å; A1799-F1805 WeakPolarHBondContact O-CD2 3.45Å; A1799-F1805 WeakPolarHBondContact O-CE2 3.27Å
1800	L	95.6	Very high	95.2	Very high	25 Å²	25	47 Å²	47	13%	0.131	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-11.7	176.1	-72.3	166.4	0	0	0	114.6	Y1599 C1602 R1606 L1796 A1798	Y1599-L1800 HydrophobicContact CD2-CD2 3.64Å; Y1599-L1800 HydrophobicContact CE2-CD2 3.66Å; Y1599-L1800 HydrophobicContact CG-CD2 4.49Å; C1602-L1800 HydrophobicContact CB-CD2 3.67Å; C1602-L1800 HydrophobicContact CB-CG 4.04Å; R1606-L1800 HydrophobicContact CB-CD1 4.24Å; R1606-L1800 VanDerWaalsContact CD-CD1 3.49Å; R1606-L1800 HydrophobicContact CG-CD1 4.44Å; L1796-L1800 WeakPolarHBondContact O-CG 3.24Å; L1796-L1800 PolarHBondContact O-N 2.83Å; A1798-L1800 VanDerWaalsContact C-N 3.31Å; A1798-L1800 PolarHBondContact O-N 2.98Å
1801	T	95.2	Very high	94.6	Very high	97 Å²	97	52.6 Å²	52.6	60%	0.595	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	2.1	175.3	68.7	0	0	0	0	113.7	A1798 A1799	A1798-T1801 PolarHBondContact O-N 3.12Å; A1798-T1801 PolarHBondContact O-OG1 2.83Å; A1799-T1801 PolarHBondContact O-N 2.7Å
1802	H	97.5	Very high	94.2	Very high	10 Å²	10	50.1 Å²	50.1	5%	0.046	29%	0.287	C	S	.	.	S	Bend	trans	-65.6	143.7	-176.3	-168.1	-82.7	0	0	0	112.3	D1777 D1780 L1781 A1798 A1799 F1804 F1805 L1806	D1777-H1802 PolarHBondContact O-CE1 3.33Å; D1780-H1802 IonicContact OD2-CD2 2.78Å; D1780-H1802 IonicContact OD2-CE1 2.8Å; D1780-H1802 PolarHBondContact OD2-CE1 3.35Å; D1780-H1802 VanDerWaalsContact OD2-CE1 3.25Å; D1780-H1802 IonicContact OD2-NE2 3.94Å; D1780-H1802 PolarHBondContact OD2-NE2 3.21Å; L1781-H1802 HydrophobicContact CD1-CB 4.04Å; L1781-H1802 HydrophobicContact CD2-CB 4.34Å; A1798-H1802 PolarHBondContact O-N 2.69Å; A1799-H1802 WeakPolarHBondContact O-CB 2.95Å; A1799-H1802 PolarHBondContact O-N 2.7Å; H1802-F1804 PolarHBondContact ND1-N 3.25Å; H1802-F1804 PolarHBondContact O-N 2.83Å; H1802-F1805 PolarHBondContact O-N 2.84Å; H1802-L1806 PolarHBondContact O-N 3.34Å
1803	P	97	Very high	93.6	Very high	56 Å²	56	49.4 Å²	49.4	36%	0.364	28%	0.275	S	S	.	.	H	α-helix	trans	-42.8	-40.5	176.7	-34.6	37.5	0	0	0	115.2	D1777 F1805 L1806 H1807	D1777-P1803 WeakPolarHBondContact OD2-CB 3.47Å; P1803-F1805 VanDerWaalsContact C-N 3.27Å; P1803-F1805 PolarHBondContact O-N 2.94Å; P1803-L1806 WeakPolarHBondContact O-CA 3.09Å; P1803-L1806 VanDerWaalsContact O-CB 3.32Å; P1803-L1806 WeakPolarHBondContact O-CB 2.97Å; P1803-L1806 PolarHBondContact O-N 3.42Å; P1803-H1807 PolarHBondContact O-CD2 3.13Å
1804	F	97.3	Very high	93	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-51.6	-42.6	178.1	-177.7	-122.5	0	0	0	113.4	M1591 V1594 R1595 M1698 D1777 L1778 L1781 H1802	M1591-F1804 HydrophobicContact SD-CE2 3.74Å; M1591-F1804 HydrophobicContact SD-CZ 4.06Å; V1594-F1804 HydrophobicContact CG1-CZ 4.48Å; R1595-F1804 HydrophobicContact CB-CE1 3.9Å; R1595-F1804 HydrophobicContact CB-CE2 4.13Å; R1595-F1804 HydrophobicContact CB-CZ 3.54Å; R1595-F1804 WeakPolarHBondContact CD-O 3.38Å; R1595-F1804 HydrophobicContact CG-CD1 4.2Å; R1595-F1804 HydrophobicContact CG-CE1 3.83Å; R1595-F1804 HydrophobicContact CG-CE2 4.15Å; R1595-F1804 HydrophobicContact CG-CZ 3.8Å; R1595-F1804 PolarHBondContact NE-O 3.34Å; M1698-F1804 HydrophobicContact CE-CD1 3.93Å; M1698-F1804 HydrophobicContact CE-CE1 3.54Å; M1698-F1804 HydrophobicContact CE-CZ 4.49Å; D1777-F1804 HydrophobicContact CB-CB 3.94Å; D1777-F1804 HydrophobicContact CB-CD2 4.34Å; L1778-F1804 HydrophobicContact CB-CD2 3.91Å; L1778-F1804 HydrophobicContact CB-CE2 3.68Å; L1778-F1804 HydrophobicContact CB-CZ 4.06Å; L1778-F1804 HydrophobicContact CD1-CE1 3.95Å; L1778-F1804 HydrophobicContact CD1-CE2 4.36Å; L1778-F1804 HydrophobicContact CD1-CZ 3.84Å; L1778-F1804 HydrophobicContact CG-CE2 4.47Å; L1778-F1804 HydrophobicContact CG-CZ 4.39Å; L1781-F1804 HydrophobicContact CD2-CB 4.41Å; L1781-F1804 HydrophobicContact CD2-CD1 4.01Å; H1802-F1804 PolarHBondContact ND1-N 3.25Å; H1802-F1804 PolarHBondContact O-N 2.83Å
1805	F	96.5	Very high	91.6	Very high	3 Å²	3	55.6 Å²	55.6	1%	0.013	31%	0.314	C	S	.	.	H	α-helix	trans	-84.7	-15.6	178.6	-58.3	-47.2	0	0	0	113.5	R1595 Y1599 L1781 A1799 H1802 P1803 H1807 L1808	R1595-F1805 HydrophobicContact CG-CD1 3.96Å; R1595-F1805 WeakPolarHBondContact O-CE1 2.94Å; Y1599-F1805 HydrophobicContact CD2-CB 4.04Å; Y1599-F1805 HydrophobicContact CD2-CD1 4.13Å; Y1599-F1805 HydrophobicContact CD2-CD2 4.19Å; Y1599-F1805 AromaticContact CD2-CG 3.88Å; Y1599-F1805 HydrophobicContact CD2-CG 3.88Å; Y1599-F1805 HydrophobicContact CG-CD1 4.36Å; L1781-F1805 HydrophobicContact CD2-CD2 4.33Å; L1781-F1805 HydrophobicContact CD2-CE1 4.48Å; L1781-F1805 HydrophobicContact CD2-CE2 3.6Å; L1781-F1805 HydrophobicContact CD2-CZ 3.69Å; A1799-F1805 WeakPolarHBondContact O-CD2 3.45Å; A1799-F1805 WeakPolarHBondContact O-CE2 3.27Å; H1802-F1805 PolarHBondContact O-N 2.84Å; P1803-F1805 VanDerWaalsContact C-N 3.27Å; P1803-F1805 PolarHBondContact O-N 2.94Å; F1805-H1807 PolarHBondContact O-N 3.35Å; F1805-H1807 VanDerWaalsContact O-N 3.14Å; F1805-L1808 HydrophobicContact CB-CD1 4.34Å; F1805-L1808 HydrophobicContact CD1-CD1 4.32Å; F1805-L1808 WeakPolarHBondContact O-CB 3.43Å; F1805-L1808 PolarHBondContact O-N 2.85Å
1806	L	90.7	Very high	90	Very high	98 Å²	98	54.4 Å²	54.4	51%	0.513	30%	0.3	S	S	.	.	H	α-helix	trans	-64.7	-13.9	171.6	-57.6	-175.8	0	0	0	112.6	H1802 P1803 R1813	H1802-L1806 PolarHBondContact O-N 3.34Å; P1803-L1806 WeakPolarHBondContact O-CA 3.09Å; P1803-L1806 VanDerWaalsContact O-CB 3.32Å; P1803-L1806 WeakPolarHBondContact O-CB 2.97Å; P1803-L1806 PolarHBondContact O-N 3.42Å; L1806-R1813 PolarHBondContact O-NH2 3.41Å
1807	H	87.9	Confident	88.1	Confident	103 Å²	103	57.8 Å²	57.8	48%	0.477	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.3	172.8	-71.6	-80.3	0	0	0	114.9	D1774 P1803 F1805	D1774-H1807 IonicContact OD1-CG 3.55Å; P1803-H1807 PolarHBondContact O-CD2 3.13Å; F1805-H1807 PolarHBondContact O-N 3.35Å; F1805-H1807 VanDerWaalsContact O-N 3.14Å
1808	L	91.2	Very high	86.1	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	33%	0.331	C	S	.	.	S	Bend	trans	-68.8	138.2	175.7	-77	171	0	0	0	112.7	R1595 H1596 Y1599 F1805 R1813	R1595-L1808 HydrophobicContact CB-CD2 4.25Å; R1595-L1808 HydrophobicContact CG-CD1 4.48Å; R1595-L1808 HydrophobicContact CG-CD2 3.73Å; R1595-L1808 HydrophobicContact CG-CG 3.84Å; H1596-L1808 HydrophobicContact CB-CD2 4.09Å; Y1599-L1808 HydrophobicContact CD1-CD1 3.59Å; Y1599-L1808 HydrophobicContact CD2-CD1 3.73Å; Y1599-L1808 HydrophobicContact CE1-CD1 4.21Å; Y1599-L1808 HydrophobicContact CE2-CD1 4.34Å; Y1599-L1808 HydrophobicContact CG-CD1 3.31Å; F1805-L1808 HydrophobicContact CB-CD1 4.34Å; F1805-L1808 HydrophobicContact CD1-CD1 4.32Å; F1805-L1808 WeakPolarHBondContact O-CB 3.43Å; F1805-L1808 PolarHBondContact O-N 2.85Å; L1808-R1813 HydrophobicContact CB-CG 4.19Å; L1808-R1813 VanDerWaalsContact O-CZ 3.26Å; L1808-R1813 PolarHBondContact O-NE 3.45Å; L1808-R1813 PolarHBondContact O-NH2 3.2Å
1809	P	89.3	Confident	84	Confident	41 Å²	41	61.2 Å²	61.2	27%	0.266	33%	0.33	S	S	.	.			trans	-50.2	142.9	166	-26.2	33.9	0	0	0	112.5	H1811 Q1812	P1809-H1811 WeakPolarHBondContact CB-CE1 3.26Å; P1809-H1811 PolarHBondContact O-N 2.71Å; P1809-H1811 VanDerWaalsContact O-N 3.12Å; P1809-Q1812 PolarHBondContact O-N 3.09Å
1810	S	85.3	Confident	81.6	Confident	106 Å²	106	65.5 Å²	65.5	74%	0.741	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-64.7	-19	-175.7	58.2	0	0	0	0	114.6
1811	H	85.4	Confident	79.3	Confident	153 Å²	153	70.5 Å²	70.5	71%	0.708	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-83.3	-12.7	175.8	65.8	-98.4	0	0	0	113.4	P1809	P1809-H1811 WeakPolarHBondContact CB-CE1 3.26Å; P1809-H1811 PolarHBondContact O-N 2.71Å; P1809-H1811 VanDerWaalsContact O-N 3.12Å
1812	Q	88.7	Confident	76.8	Confident	32 Å²	32	73 Å²	73	15%	0.15	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-97.6	5.4	174.4	-76.6	176.9	2.4	0	0	112.4	H1596 Y1599 P1809	H1596-Q1812 WeakPolarHBondContact NE2-CB 3.46Å; Y1599-Q1812 WeakPolarHBondContact CE1-O 3.13Å; P1809-Q1812 PolarHBondContact O-N 3.09Å
1813	R	85.9	Confident	74.1	Confident	103 Å²	103	77.8 Å²	77.8	39%	0.389	42%	0.424	S	S	.	.			trans	-100.2	124.4	-179.3	-63.1	-173.9	-162.8	-155.3	4.6	110.3	L1806 L1808	L1806-R1813 PolarHBondContact O-NH2 3.41Å; L1808-R1813 HydrophobicContact CB-CG 4.19Å; L1808-R1813 VanDerWaalsContact O-CZ 3.26Å; L1808-R1813 PolarHBondContact O-NE 3.45Å; L1808-R1813 PolarHBondContact O-NH2 3.2Å
1814	L	85.9	Confident	71.5	Confident	44 Å²	44	79.2 Å²	79.2	23%	0.23	43%	0.427	C	S	.	.			trans	-90.2	130.6	-178.9	-61.4	171.5	0	0	0	109.8	L1552 Y1599 Q1600 Y1603 Y1816	L1552-L1814 HydrophobicContact CD1-CD1 3.63Å; L1552-L1814 HydrophobicContact CD2-CD1 3.96Å; L1552-L1814 HydrophobicContact CG-CD1 4.1Å; Y1599-L1814 HydrophobicContact CE1-CB 4.41Å; Y1599-L1814 HydrophobicContact CE1-CG 4.34Å; Y1599-L1814 PolarHBondContact OH-N 2.84Å; Y1599-L1814 PolarHBondContact OH-O 3.41Å; Q1600-L1814 HydrophobicContact CG-CD1 4.44Å; Y1603-L1814 HydrophobicContact CD1-CD1 3.75Å; Y1603-L1814 HydrophobicContact CD2-CB 3.77Å; Y1603-L1814 HydrophobicContact CD2-CD1 4.2Å; Y1603-L1814 HydrophobicContact CE1-CB 4.36Å; Y1603-L1814 HydrophobicContact CE1-CD1 3.9Å; Y1603-L1814 HydrophobicContact CE2-CB 3.45Å; Y1603-L1814 VanDerWaalsContact CE2-CB 3.45Å; Y1603-L1814 HydrophobicContact CE2-CD1 4.32Å; Y1603-L1814 HydrophobicContact CG-CB 4.35Å; Y1603-L1814 HydrophobicContact CG-CD1 3.91Å; L1814-Y1816 PolarHBondContact O-N 3.05Å
1815	T	68.8	Low	68.6	Low	121 Å²	121	83.9 Å²	83.9	74%	0.742	46%	0.458	S	S	*	.			trans	-81.4	84.6	-179	49.9	0	0	0	0	110.7	T1817	T1815-T1817 PolarHBondContact O-N 2.72Å
1816	Y	63.7	Low	65.7	Low	49 Å²	49	89.5 Å²	89.5	19%	0.192	50%	0.495	C	S	.	.			trans	-59	110.3	172.2	-175.8	-82.7	0	0	0	110.4	Y1603 R1606 D1610 L1814 P1818	Y1603-Y1816 HydrophobicContact CE2-CD2 4.12Å; Y1603-Y1816 HydrophobicContact CE2-CG 4.49Å; R1606-Y1816 HydrophobicContact CG-CE2 4.26Å; R1606-Y1816 VanDerWaalsContact NH2-CE1 3.26Å; D1610-Y1816 WeakPolarHBondContact OD2-CE2 3.19Å; D1610-Y1816 PolarHBondContact OD2-OH 3.22Å; L1814-Y1816 PolarHBondContact O-N 3.05Å; Y1816-P1818 HydrophobicContact CD1-CG 4.09Å; Y1816-P1818 HydrophobicContact CE1-CB 3.9Å; Y1816-P1818 HydrophobicContact CE1-CG 3.76Å
1817	T	58.2	Low	63.3	Low	76 Å²	76	91.1 Å²	91.1	47%	0.466	50%	0.504	S	S	.	.			trans	-98.2	112.6	169.8	49.1	0	0	0	0	109.3	T1815 Y1819	T1815-T1817 PolarHBondContact O-N 2.72Å; T1817-Y1819 PolarHBondContact O-N 3.14Å
1818	P	54.2	Low	61.3	Low	94 Å²	94	94.5 Å²	94.5	61%	0.61	52%	0.52	S	S	*	.			trans	-61.3	130	177.3	-16.6	27.2	0	0	0	111.2	Y1816	Y1816-P1818 HydrophobicContact CD1-CG 4.09Å; Y1816-P1818 HydrophobicContact CE1-CB 3.9Å; Y1816-P1818 HydrophobicContact CE1-CG 3.76Å
1819	Y	52.8	Low	58.9	Low	71 Å²	71	103.3 Å²	103.3	28%	0.278	55%	0.553	S	S	.	*			trans	-65.8	138	172.3	-73.1	-101.5	0	0	0	110.1	R1545 V1549 F1607 T1817 L1821	R1545-Y1819 PolarHBondContact O-OH 3.21Å; V1549-Y1819 HydrophobicContact CB-CE2 4.39Å; V1549-Y1819 WeakPolarHBondContact CB-OH 3.36Å; V1549-Y1819 HydrophobicContact CG2-CE1 4.5Å; V1549-Y1819 HydrophobicContact CG2-CE2 3.99Å; V1549-Y1819 WeakPolarHBondContact CG2-OH 3.34Å; F1607-Y1819 HydrophobicContact CD2-CE2 4.2Å; F1607-Y1819 AromaticContact CE2-CE2 3.81Å; F1607-Y1819 HydrophobicContact CE2-CE2 3.81Å; T1817-Y1819 PolarHBondContact O-N 3.14Å; Y1819-L1821 PolarHBondContact O-N 2.63Å; Y1819-L1821 VanDerWaalsContact O-N 3.11Å
1820	P	45.9	Very low	56.2	Low	89 Å²	89	112.2 Å²	112.2	58%	0.578	58%	0.581	S	S	*	*			trans	-64.7	110.2	165.7	-19.2	32.5	0	0	0	109.8	D1822 T1823	P1820-D1822 PolarHBondContact O-N 2.85Å; P1820-T1823 PolarHBondContact O-N 3.04Å; P1820-T1823 VanDerWaalsContact O-N 3.12Å; P1820-T1823 PolarHBondContact O-OG1 2.74Å
1821	L	47.2	Very low	53.9	Low	130 Å²	130	114 Å²	114	68%	0.681	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-59.2	-16.4	-179.2	-71.4	165.9	0	0	0	113.8	Y1819 T1823	Y1819-L1821 PolarHBondContact O-N 2.63Å; Y1819-L1821 VanDerWaalsContact O-N 3.11Å; L1821-T1823 PolarHBondContact O-N 3.23Å
1822	D	43.1	Very low	51.5	Low	150 Å²	150	112.6 Å²	112.6	80%	0.802	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-70.2	-5.9	175.2	-63	-55.3	0	0	0	114.4	P1820 I1824	P1820-D1822 PolarHBondContact O-N 2.85Å; D1822-I1824 VanDerWaalsContact C-N 3.34Å; D1822-I1824 PolarHBondContact O-N 2.77Å
1823	T	41.6	Very low	48.9	Very low	110 Å²	110	114.8 Å²	114.8	68%	0.675	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-89	10	-173.5	-28.1	0	0	0	0	114.4	P1820 L1821	P1820-T1823 PolarHBondContact O-N 3.04Å; P1820-T1823 VanDerWaalsContact O-N 3.12Å; P1820-T1823 PolarHBondContact O-OG1 2.74Å; L1821-T1823 PolarHBondContact O-N 3.23Å
1824	I	41.3	Very low	46.6	Very low	86 Å²	86	115.6 Å²	115.6	44%	0.441	65%	0.647	S	S	.	*	S	Bend	trans	-62.8	125.6	169.6	-59.3	174.8	0	0	0	108.3	D1822	D1822-I1824 VanDerWaalsContact C-N 3.34Å; D1822-I1824 PolarHBondContact O-N 2.77Å
1825	P	37.6	Very low	44.2	Very low	99 Å²	99	122.1 Å²	122.1	64%	0.643	67%	0.669	S	S	*	*			trans	-58.4	136.9	-178.9	22.2	-32.5	0	0	0	110.7	N1827	P1825-N1827 PolarHBondContact O-N 2.67Å
1826	P	35.4	Very low	42.8	Very low	121 Å²	121	121 Å²	121	79%	0.786	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	11	-164.6	-24	35.6	0	0	0	117.5
1827	N	40.1	Very low	41.4	Very low	131 Å²	131	120.8 Å²	120.8	70%	0.701	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-16.2	-156.3	-143.6	30.5	0	0	0	115	P1825	P1825-N1827 PolarHBondContact O-N 2.67Å
1828	E	46.1	Very low	40.4	Very low	175 Å²	175	122 Å²	122	82%	0.818	69%	0.686	S	S	*	*	S	Bend	trans	-113.5	-9.7	-170.3	-62.7	-173.7	144	0	0	115	R1830	E1828-R1830 PolarHBondContact O-N 2.86Å
1829	R	39.8	Very low	39.5	Very low	189 Å²	189	123.2 Å²	123.2	71%	0.713	69%	0.692	S	S	*	*	S	Bend	trans	-75.6	34.6	-178.2	-62.1	-170.6	-177.9	-175.6	2.6	114.5
1830	R	34	Very low	38.6	Very low	228 Å²	228	125.8 Å²	125.8	86%	0.86	71%	0.711	S	S	*	*			trans	-144.7	48	-166.8	-75.8	-165	170.5	-170.3	-0.9	118.3	E1828	E1828-R1830 PolarHBondContact O-N 2.86Å
1831	T	35.8	Very low	38.2	Very low	143 Å²	143	129.3 Å²	129.3	88%	0.877	72%	0.72	S	S	*	*			trans	-134.3	50.1	169.2	51.1	0	0	0	0	115.7
1832	S	35.1	Very low	37.6	Very low	124 Å²	124	125.7 Å²	125.7	87%	0.867	70%	0.699	S	S	*	*	S	Bend	trans	-154.2	94.6	165.4	62.9	0	0	0	0	113.5
1833	G	34.7	Very low	37.7	Very low	77 Å²	77	121.7 Å²	121.7	79%	0.794	68%	0.681	S	S	*	*			trans	149	91.2	167.9	0	0	0	0	0	117
1834	S	36.6	Very low	37.4	Very low	120 Å²	120	121.1 Å²	121.1	84%	0.839	68%	0.682	S	S	*	*			trans	-168.7	156.1	163.3	-103.5	0	0	0	0	111
1835	R	36.9	Very low	37.1	Very low	182 Å²	182	123.1 Å²	123.1	69%	0.687	70%	0.698	S	S	*	*			cis	-153.5	129.7	22.8	-156.5	173.7	-178.6	-172	1.7	116.8
1836	S	39.4	Very low	37.1	Very low	96 Å²	96	124.7 Å²	124.7	67%	0.671	71%	0.706	S	S	*	*			trans	-162.3	156.6	166	52.2	0	0	0	0	111
1837	G	34.5	Very low	37.2	Very low	45 Å²	45	122.8 Å²	122.8	46%	0.464	70%	0.701	S	S	.	*			cis	131.6	123.1	-34.4	0	0	0	0	0	116.9	M1	M1-G1837 WeakPolarHBondContact CE-O 3.34Å; M1-G1837 WeakPolarHBondContact CG-O 3.43Å
1838	T	36.7	Very low	37.1	Very low	101 Å²	101	123 Å²	123	62%	0.62	70%	0.702	S	S	*	*			trans	58.7	123.6	167.6	54.4	0	0	0	0	117.6
1839	T	34.8	Very low	36.7	Very low	121 Å²	121	121.9 Å²	121.9	74%	0.742	70%	0.702	S	S	*	*			cis	-179.4	164.3	-3	19.8	0	0	0	0	107.7
1840	N	34.6	Very low	36.5	Very low	124 Å²	124	116.5 Å²	116.5	66%	0.663	70%	0.704	S	S	*	*			cis	-173.9	179	-26.9	-110.5	52	0	0	0	108.1
1841	Q	37.7	Very low	36.5	Very low	164 Å²	164	110.8 Å²	110.8	77%	0.766	70%	0.699	S	S	*	*			trans	97.4	91.8	161.4	-63	-174.6	85.9	0	0	121.3	D578	D578-Q1841 WeakPolarHBondContact OD2-CA 3.37Å; D578-Q1841 PolarHBondContact OD2-N 2.86Å
1842	Q	34.2	Very low	36.6	Very low	53 Å²	53	109.4 Å²	109.4	25%	0.248	70%	0.696	C	S	.	*				66.9	146.4	123.1	-55.3	-47	146.6	0	0	125.9	V577 D578 F579	V577-Q1842 WeakPolarHBondContact CG2-O 3.29Å; D578-Q1842 VanDerWaalsContact C-NE2 3.3Å; D578-Q1842 VanDerWaalsContact CG-CD 3.49Å; D578-Q1842 PolarHBondContact O-NE2 2.81Å; D578-Q1842 PolarHBondContact OD1-OE1 2.92Å; D578-Q1842 PolarHBondContact OD2-N 2.81Å; D578-Q1842 PolarHBondContact OD2-OE1 3.46Å; D578-Q1842 VanDerWaalsContact OD2-OE1 3.1Å; F579-Q1842 VanDerWaalsContact CD2-CD 3.45Å; F579-Q1842 HydrophobicContact CD2-CG 4.33Å; F579-Q1842 HydrophobicContact CE1-CG 4.17Å; F579-Q1842 HydrophobicContact CE2-CG 3.95Å; F579-Q1842 VanDerWaalsContact CG-CD 3.4Å; F579-Q1842 VanDerWaalsContact CG-OE1 3.24Å; F579-Q1842 HydrophobicContact CZ-CG 3.85Å; F579-Q1842 VanDerWaalsContact N-OE1 3.08Å
1843	P	44.6	Very low	36.7	Very low	66 Å²	66	108.5 Å²	108.5	43%	0.429	69%	0.69	S	S	.	*			trans	-115.5	-169	-170.5	46.7	-39.4	0	0	0	115.7	V577	V577-P1843 HydrophobicContact CG2-CB 3.99Å; V577-P1843 VanDerWaalsContact O-CB 3.3Å; V577-P1843 WeakPolarHBondContact O-CB 3.19Å; V577-P1843 VanDerWaalsContact O-CD 3.23Å; V577-P1843 WeakPolarHBondContact O-CD 3.31Å; V577-P1843 WeakPolarHBondContact O-CG 3.33Å
1844	S	34.7	Very low	36.7	Very low	99 Å²	99	109.7 Å²	109.7	69%	0.692	69%	0.685	S	S	*	*			trans	-179.6	141.7	133.7	34.3	0	0	0	0	116.7
1845	T	36.1	Very low	36.6	Very low	128 Å²	128	109.3 Å²	109.3	79%	0.785	68%	0.683	S	S	*	*			trans	62.9	159	149	52.4	0	0	0	0	119.6
1846	T	37.7	Very low	36.4	Very low	132 Å²	132	105.4 Å²	105.4	81%	0.81	68%	0.683	S	S	*	*			cis	-173	172.9	-7	28.1	0	0	0	0	107.4
1847	A	36.9	Very low	36	Very low	81 Å²	81	107 Å²	107	67%	0.669	69%	0.689	S	S	*	*			cis	-172.7	-172.9	-25.3	0	0	0	0	0	110.4
1848	N	38.5	Very low	35.8	Very low	135 Å²	135	109.8 Å²	109.8	72%	0.722	70%	0.701	S	S	*	*			trans	83.8	104.9	156.1	-68.6	-8.4	0	0	0	124.5
1849	N	36.8	Very low	35.7	Very low	152 Å²	152	110.3 Å²	110.3	81%	0.813	71%	0.709	S	S	*	*				77.5	120.3	113.2	-59.7	-12.2	0	0	0	125.6
1850	G	36.1	Very low	35.8	Very low	75 Å²	75	111 Å²	111	77%	0.773	71%	0.708	S	S	*	*				113.1	151.2	127.5	0	0	0	0	0	118.4
1851	S	35.2	Very low	35.5	Very low	108 Å²	108	112.1 Å²	112.1	76%	0.755	71%	0.707	S	S	*	*			cis	-174.6	153.4	-21.1	44.8	0	0	0	0	111.3
1852	S	37.4	Very low	35.3	Very low	114 Å²	114	112 Å²	112	80%	0.797	71%	0.705	S	S	*	*			trans	67.9	160.7	166	86.3	0	0	0	0	117.2
1853	S	36.2	Very low	35.1	Very low	106 Å²	106	117.5 Å²	117.5	74%	0.741	72%	0.723	S	S	*	*			cis	-174.7	166	-24.2	49.8	0	0	0	0	109.3
1854	S	34.9	Very low	34.3	Very low	101 Å²	101	122.4 Å²	122.4	71%	0.706	75%	0.746	S	S	*	*			cis	-169.8	170.4	-34.8	63.7	0	0	0	0	109.7
1855	S	34	Very low	34.1	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	76%	0.756	S	S	*	*			trans	71	158.3	170.7	93.3	0	0	0	0	116.5
1856	S	33	Very low	34	Very low	100 Å²	100	129.4 Å²	129.4	70%	0.699	76%	0.755	S	S	*	*			cis	-158	140.3	-8.6	25.7	0	0	0	0	114
1857	V	31.3	Very low	33.8	Very low	131 Å²	131	129.3 Å²	129.3	79%	0.794	75%	0.752	S	S	*	*			trans	65.2	110.2	130.1	-178.1	0	0	0	0	121.6
1858	S	30.2	Very low	33.6	Very low	103 Å²	103	131.9 Å²	131.9	72%	0.72	76%	0.757	S	S	*	*			trans	80	144.9	137.4	-69	0	0	0	0	124.6
1859	S	34.2	Very low	33.3	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	76%	0.759	S	S	*	*			trans	78.4	136.8	142	65.5	0	0	0	0	120.5
1860	D	36.7	Very low	33.1	Very low	136 Å²	136	130.5 Å²	130.5	73%	0.727	76%	0.755	S	S	*	*			cis	-165.7	174.5	-27.8	-147.5	-24.8	0	0	0	110.8
1861	F	29.9	Very low	32.9	Very low	148 Å²	148	134.2 Å²	134.2	65%	0.649	75%	0.754	S	S	*	*			trans	67.9	116	147.2	-95.6	-66.3	0	0	0	120.9
1862	K	32.7	Very low	32.7	Very low	162 Å²	162	136.1 Å²	136.1	70%	0.704	75%	0.754	S	S	*	*			trans	71.9	137.3	157.4	-63.8	133.7	-174.1	162.2	0	116.7
1863	R	30.9	Very low	32.4	Very low	168 Å²	168	137.8 Å²	137.8	63%	0.634	75%	0.751	S	S	*	*			cis	-162.1	105.7	-13.8	-121.2	-177.7	-169.1	169.2	3.2	107.3
1864	N	26.7	Very low	32.1	Very low	169 Å²	169	140.4 Å²	140.4	90%	0.904	75%	0.752	S	S	*	*			trans	-82.9	150.3	163.9	-79.6	-5.6	0	0	0	110.2
1865	R	30.4	Very low	31.8	Very low	244 Å²	244	144 Å²	144	92%	0.921	76%	0.756	S	S	*	*			trans	-136	0	160.6	-171.3	-170.2	-165.5	-178.2	5.9	106.3

Retrieved 1,865 of 1,865 residues in 947.3 ms (Link to these results)

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