A0A5K4F3A9_SCHMA Loading...

Nucleosome-remodeling factor subunit BPTF AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A5K4F3A9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 3,647 aa.

						>A0A5K4F3A9_SCHMA|A0A5K4F3A9
MDSSSAGTNGLAGGGAASALAGVKKRTKVVFLNPVEIANWDQIKENSKQNVIGQNDLINYEKMLKDDDSTSIPGSNAESRRQQGKKRGRPKGSRNGARKRPIDPSQPWLESSDSDEPNIGLEDELDDDEYFRRLEEEKMREDAEEVSRKRREMEARAAARANAQGRRGSAKVDPLITHQFQTPVNSDSNLSCQSGSQREFSNRNKRQNYAALAGFREVSDSDDLSELDDKGAGRSGFLQESDYPRSLDDIHEQNEEDYQEPASPFRQSVLDMLPPPPSPVIPSNSEEEKSNLKCESLSVASSNDLNALRTTVTNASLNDPHTQKMLEMDPIELRFRSPSLILPSSANDLACPREYILDVLSIYEVLRRYGSLLRLSPFRLEDFAASLISDENSNLLAEAHMVLLKALLREDEANGTTMCPVDCRDSVNLTFYLLDRFTWPYLLANYLSSIKSTEAAARLSAANTTTAAGSVGGPTGSGGADIVLTAALFPSDLIPLNPDYPFVPIKSRIAVLRGLTSLFLATGPVRGDILREGLMTHEDYCRVCHQSGEVLCCDGCTAVFHLHCLNPPLSSVPTTSWICPVCIRKRTPGVTDCLSEAEKSGVAHYQEPIGKDRAGRLYWYISRRLIIEPVDFSQCEPQLMGFHDGLVDNSWEMEYGRELMEDDPEVKDDEDDIDDNNNDNSDVNSTTDSADNNSLNLTSKVSHCDSSQPMPALNNKQKNCKKYQCNPSISYANEPCVYYYSSIEQVMHIRELLSTEWEPWLCYRLDALLPRMRNEMAITQKLTESGFLEFCSSRPNHKSVSLNNDSNQSCNLTADSPDTVYVYSVLEVERAAFKKSTISVKNHGETPEYPKTRLAIAASSLPSADIPVFPTLPEQLPSLLNKQPSDLPSCLVVTDENSCIVANEDQVITHMIKENSDDDVATYPPTILEPQEISTLHMLIDSDLLPNSNGCCLLAYRFSDEGNWRSWTNLYTSGVWTGEECTTMPDSQRNDDSSELKRIPSGTRNSNAVNSNNGNNNTVNADDPISDSVNVALTRAQHMEEKERRRLLSNKFNVSELCTDMWGYIDPIELSNTYKLVRDMMASVIELPQFSDFGFTRYECWPASPHQLLNLLRLTLCHFESKIPLAFYTPAWRAHRTNWIKDVIRSKSPSDLAFLLARLEASIRSVCFQRVWFNSLGHLTLERMTASQREEDKRLRQFDRFSSTVSGGVGSSNVNPANLPTNLIRTKTPRPVRHTVWKTRGEEYRRLGGDGWMWLSATRSNAGRMAEHALSIHPLISSGRQLELTATSSGNRLLIHRRGNPRGLQHGIGWGVCPEYLQDQIPVKPPKASECRGHVLHPITGIPLYLNPKRNPYIIPPDVLCSLNEQTLKSSTNNDQMNSSSSSHVDDDDAKKKNPDSYHEITVNKNENDDSMNNNFKENKIDQLDELHEHCNEPEIKIEQRKDSHSGQTSSINNNNTNDGDDNKNPVLNISYCLSNRIHFPPPIDREHSYPSSSSSSKRLRFRLDSLLEHRYIAAENDKKASAAALNAVSKLEAEIENLEKRHNEVVQRLTTLGTEAQQARTAKAQAVKAKQTALLIKPSQTSSLTLGSGGNVVMTNSRLIQLNENSNNTNNTIATTFAGGKQLIQQSVLTDQGVRYRVLAPRTIPNIHMNQVAFNPVQKTASVPINRTPQQTYRSNQKRRANRNSDLSESDSDSDSVTANTGRVNSWSARENVPLRRSARRVRAVRHDPDFVVDFDEDDDEDDGLNSKADDSDNFDPNDEIQGSSKKYSGQKRSQVSIHLNARSATRSLPQYDGVGDTTDEDIDEYDDDDNDAIDDEEEDIVDDYDYVDEDCDYNDDDDDDGEYYYDNEELEEDEVVEEDEDDNDEYFPILPRKHFHMESKNPEKSPKLSKIAAPCSTHSAKSDTAPAVPKVVILKNNTAPYIYGNTATTVKNKDNTNPRVLSIPSSTTTTTTTGQRIILPAKLKTPTNTNEKSISNNKTISLGNMKEGSSQALQLPPSQPSVNMPQGLRLVKIVRNPDGGTNIIPVAATDTILSPAMEPLNVNQTVDNSTVTNTTGQSDLVPSSSVTRLNPVDSNDIHLVLNSSNTTGFNSVVSLSKPSVVLTTATASSELKPAITNTPLVSISVENETAQQPITISTTNLQQCGIQLTDLITPATVSNTTVSIPALINQPATVNIATVGKLKPPSANSVRFIIAPTVCPTTTTSDSSGSINPPSQTPTITIVKASNQSDVSSDSNTITSMATSSFTPILPRKPPPAILRRTLAAAGSGGGPSSTSLILPVSSSSDYPQIVGTQQSSSLRTPSVASLVATNTARQLVCGGYNRYISTGPSIRPMISDSQGMSDLHQGRRSIAKAQHIRHNSLIDEDPRSIMNNQSKVLISDYKGLVRQFDSGSTAARLQTPIVDEATLALDRAVTESTAKLDSINAQIVSVRSEAQELESQINSLKSELSKYQEIVNRGSPVISSPYSLSIRNNADFDLNNKAFVNKFLRNNNRKTANQAGKEYGTTVDAHQAVLPQSLPYVNDYAWPLPDSISCNQFSSEQKQNMVLPKSSLFRLNPHNLRLTILSAGRREIPGYDVEKKRLSQVNWLYPSSRPNFAECWRFRLSQIRMNSYQKDNHNNNISFGLDLSNFAVLLRTLWHCIRWDDIMVEPDKDICVHDSNGRPCFRKTLNIDDDDDDVDVSGASGRHDDNKPYSVRRIVEIQPLDRFWLQANYKVRITTTYPARSNSSRRRKAAESSNRGRSTRGPCLQDSPEPDESTSRRKGRRGGQRNAQGGKDPDYDPAVDEGWRVGVPCSSRRQSRTNFRSYGRSSRGSFCDSDDDGDTEFCGGRRDLQSQRNEVSVEEKWMSEDAVFLWEIGVFMNSLLPPKSNYPPISDSSVSKIDPNDKTSQYVISSRLAALPPDSSSNGSASATVTTTEVNNSLISPSNIEGYVEKNGFLYDGGQPKGFLSNSSSSRSRSTLASALQSGRITVNSRSRSDDRSMSNNINTPRPLSPNTLEAKARARSIAATNAARASVAARRARFERALLEQRVRSLKSQFCSRKRLIFNWAKSLADIAVNEIKGAQQISKADKSNENSSKKLEQSSTQRHHHQTGEKLPIQKSRSNIVNQLNKSSTSSSSSTLLPKKKIGRPCKTKNDTTTVTTTTTSSTNKKNDVYHKRTKRKITPTFSPSSSAASSSSGDDENKNPNLINNKQSNQSELLANNRIPRKSALNHEFIKLSKKTQNNNRLTMKLSIKQSKKDSDDDNTTTITTHSSCSTASTSPGLGDDYENNIYQQKSTAPTKTNRSVTTKTKRLKHESTNSDASEHNYSVTESIKSPRSSVSGGGSKRGSSNASGTGRNNNSNKGGGRVKLSEKSDKNEAPTESITSVLQNVSSNSPVYCVCKTPYNPLREYIGCDLCRDWFHFECVGLDPKDSDKLGDSWHCPDCKQAELKANEMLYCVCRTPYEPTRVYIACDGCDEWYHPECVGLTPEQAVNHTDTYLCPTCCQLSQRTTNTTTTTTKSSGKSKKSKGSNKNHSAVTVVDQTAATKTIYETNLTSDRIKKLINLIEELQQHKMSWPFIHTPDPLKFPMARSLDDAFNLPSVIINLKTEVYKTLGDFSFDMNRLFTNSRLIYPKDTPEFNCTEIVEALFVQKMKQFKEENL
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 13 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31	Very low	27.6	Very low	242 Å²	242	134.3 Å²	134.3	100%	1.192	86%	0.855	S	S	*	*				0	111.3	0	-80.6	-176.7	162.7	0	0	106
2	D	29	Very low	27.5	Very low	168 Å²	168	131.3 Å²	131.3	90%	0.898	85%	0.852	S	S	*	*			trans	-67	133.4	178.9	-63.4	-53	0	0	0	110.9
3	S	32.3	Very low	27.4	Very low	103 Å²	103	127.6 Å²	127.6	72%	0.72	85%	0.853	S	S	*	*			trans	-179.1	82.8	149.8	48.4	0	0	0	0	107
4	S	28.3	Very low	27.3	Very low	104 Å²	104	124 Å²	124	73%	0.727	85%	0.848	S	S	*	*				71.1	126.2	80.5	72.2	0	0	0	0	114.4
5	S	27.1	Very low	27.2	Very low	118 Å²	118	121.3 Å²	121.3	83%	0.825	85%	0.85	S	S	*	*			trans	67	144.9	157.4	65.3	0	0	0	0	117
6	A	27.8	Very low	27.1	Very low	101 Å²	101	120 Å²	120	84%	0.835	85%	0.848	S	S	*	*			cis	-177	138.3	-7.4	0	0	0	0	0	100.5
7	G	24.9	Very low	27	Very low	72 Å²	72	119.1 Å²	119.1	74%	0.742	85%	0.849	S	S	*	*			cis	125.8	113.1	39.2	0	0	0	0	0	104.8
8	T	28.7	Very low	27	Very low	146 Å²	146	119.2 Å²	119.2	90%	0.896	85%	0.849	S	S	*	*			trans	-151.1	109.6	160.3	44.9	0	0	0	0	108.6
9	N	25.2	Very low	27.2	Very low	172 Å²	172	117.6 Å²	117.6	92%	0.92	84%	0.843	S	S	*	*			trans	-62.6	150.9	172.2	-64.2	-42.7	0	0	0	111.3
10	G	24.7	Very low	27.2	Very low	67 Å²	67	120.5 Å²	120.5	69%	0.691	85%	0.846	S	S	*	*			trans	160.8	85.4	156.5	0	0	0	0	0	115.4
11	L	25.1	Very low	27.3	Very low	184 Å²	184	119.6 Å²	119.6	96%	0.963	85%	0.846	S	S	*	*			trans	68.1	74.8	146.6	-61.4	158.3	0	0	0	117.4
12	A	26.5	Very low	27.2	Very low	99 Å²	99	111 Å²	111	82%	0.818	82%	0.819	S	S	*	*			trans	-116.7	113.7	145.3	0	0	0	0	0	107.5	G14	A12-G14 PolarHBondContact O-N 2.65Å
13	G	26.1	Very low	27.3	Very low	83 Å²	83	109.5 Å²	109.5	86%	0.856	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-55.3	125.8	178.7	0	0	0	0	0	110.7	G15	G13-G15 PolarHBondContact O-N 3.28Å
14	G	26	Very low	27.3	Very low	77 Å²	77	114 Å²	114	79%	0.794	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-60.5	119.9	-179.7	0	0	0	0	0	111.3	A12 A16	A12-G14 PolarHBondContact O-N 2.65Å; G14-A16 PolarHBondContact O-N 3.4Å
15	G	24.9	Very low	27.4	Very low	84 Å²	84	118.6 Å²	118.6	87%	0.866	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-60.2	122.4	161.3	0	0	0	0	0	110.6	G13	G13-G15 PolarHBondContact O-N 3.28Å
16	A	25.9	Very low	27.5	Very low	100 Å²	100	124.4 Å²	124.4	83%	0.826	83%	0.833	S	S	*	*			trans	-143.1	48.4	157.6	0	0	0	0	0	108.5	G14	G14-A16 PolarHBondContact O-N 3.4Å
17	A	26.3	Very low	27.7	Very low	105 Å²	105	125.4 Å²	125.4	87%	0.868	83%	0.829	S	S	*	*			trans	-108	64	168.8	0	0	0	0	0	108.7
18	S	27.2	Very low	27.8	Very low	121 Å²	121	131.3 Å²	131.3	85%	0.846	84%	0.835	S	S	*	*			trans	-144.3	64.5	166.2	-160.4	0	0	0	0	108.7
19	A	30.4	Very low	28.1	Very low	88 Å²	88	129 Å²	129	73%	0.727	82%	0.82	S	S	*	*	S	Bend	trans	-164.3	34.9	170.4	0	0	0	0	0	113.7
20	L	27.1	Very low	28.5	Very low	175 Å²	175	126.2 Å²	126.2	92%	0.916	81%	0.809	S	S	*	*			trans	-144.2	49.4	169.9	-76.4	175	0	0	0	112.1	G22	L20-G22 PolarHBondContact O-N 3.34Å
21	A	28.4	Very low	29.1	Very low	102 Å²	102	131.5 Å²	131.5	84%	0.843	81%	0.813	S	S	*	*			trans	-87.3	65.7	154.8	0	0	0	0	0	108.1	V23	A21-V23 PolarHBondContact O-N 3.23Å; A21-V23 VanDerWaalsContact O-N 3.17Å
22	G	28.6	Very low	29.3	Very low	61 Å²	61	128.6 Å²	128.6	63%	0.629	80%	0.798	S	S	*	*			trans	-64.3	112.8	166.8	0	0	0	0	0	107.6	L20 K24	L20-G22 PolarHBondContact O-N 3.34Å; G22-K24 PolarHBondContact O-N 3.42Å
23	V	32.1	Very low	29.6	Very low	137 Å²	137	128.4 Å²	128.4	83%	0.83	78%	0.783	S	S	*	*			trans	-50.4	101.6	172.4	175.9	0	0	0	0	107.8	A21 K25	A21-V23 PolarHBondContact O-N 3.23Å; A21-V23 VanDerWaalsContact O-N 3.17Å; V23-K25 PolarHBondContact O-N 3.43Å
24	K	31.4	Very low	30.2	Very low	199 Å²	199	129.1 Å²	129.1	87%	0.865	77%	0.773	S	S	*	*			trans	-56.2	113.3	166.8	-78.5	-179.1	175.7	178.5	0	105.6	G22 R26	G22-K24 PolarHBondContact O-N 3.42Å; K24-R26 PolarHBondContact O-N 3.48Å
25	K	31.5	Very low	30.9	Very low	200 Å²	200	130.8 Å²	130.8	87%	0.87	77%	0.767	S	S	*	*			trans	-48.6	108.9	174.2	-74.2	176.5	177	175.5	0	107.4	V23 T27	V23-K25 PolarHBondContact O-N 3.43Å; K25-T27 PolarHBondContact O-N 2.94Å
26	R	29.3	Very low	31.6	Very low	239 Å²	239	131.7 Å²	131.7	90%	0.902	75%	0.749	S	S	*	*			trans	-58.5	113.2	170.3	-169.3	175.4	-170.5	168.7	2.7	106	K24 K28	K24-R26 PolarHBondContact O-N 3.48Å; R26-K28 PolarHBondContact O-N 3.4Å; R26-K28 VanDerWaalsContact O-N 3.14Å
27	T	31.5	Very low	32.3	Very low	122 Å²	122	132.1 Å²	132.1	75%	0.748	74%	0.736	S	S	*	*			trans	-50.5	121.4	170.3	-7.2	0	0	0	0	106.5	K25 V29	K25-T27 PolarHBondContact O-N 2.94Å; T27-V29 PolarHBondContact O-N 3.49Å
28	K	28.1	Very low	33	Very low	197 Å²	197	131.4 Å²	131.4	86%	0.857	73%	0.73	S	S	*	*			trans	-70.6	89.8	179.7	-161.2	-178.6	-174.8	-173	0	106.3	R26 V30	R26-K28 PolarHBondContact O-N 3.4Å; R26-K28 VanDerWaalsContact O-N 3.14Å; K28-V30 PolarHBondContact O-N 2.99Å; K28-V30 VanDerWaalsContact O-N 3.15Å
29	V	34.1	Very low	33.5	Very low	96 Å²	96	130 Å²	130	58%	0.582	71%	0.714	S	S	*	*			trans	-63	111.9	171.1	-179.9	0	0	0	0	105.8	T27 F31	T27-V29 PolarHBondContact O-N 3.49Å; V29-F31 HydrophobicContact CB-CZ 4.49Å; V29-F31 HydrophobicContact CG1-CD1 4.5Å; V29-F31 HydrophobicContact CG1-CE1 4.31Å; V29-F31 HydrophobicContact CG1-CZ 4.45Å; V29-F31 WeakPolarHBondContact O-CD2 3.41Å; V29-F31 WeakPolarHBondContact O-CE2 3.5Å
30	V	34.3	Very low	33.5	Very low	115 Å²	115	135 Å²	135	70%	0.697	71%	0.714	S	S	*	*			trans	-81.1	114.8	171.5	179.1	0	0	0	0	105.5	K28 L32	K28-V30 PolarHBondContact O-N 2.99Å; K28-V30 VanDerWaalsContact O-N 3.15Å; V30-L32 PolarHBondContact O-N 3.41Å
31	F	35.9	Very low	34.2	Very low	177 Å²	177	132.4 Å²	132.4	78%	0.776	70%	0.701	S	S	*	*			trans	-77.7	115.5	-176.5	-65.7	-84.7	0	0	0	109	V29	V29-F31 HydrophobicContact CB-CZ 4.49Å; V29-F31 HydrophobicContact CG1-CD1 4.5Å; V29-F31 HydrophobicContact CG1-CE1 4.31Å; V29-F31 HydrophobicContact CG1-CZ 4.45Å; V29-F31 WeakPolarHBondContact O-CD2 3.41Å; V29-F31 WeakPolarHBondContact O-CE2 3.5Å
32	L	30.2	Very low	35	Very low	123 Å²	123	133.2 Å²	133.2	64%	0.644	69%	0.687	S	S	*	*			trans	-80.5	139	172.1	-64.9	164.7	0	0	0	108.5	V30 E36	V30-L32 PolarHBondContact O-N 3.41Å; L32-E36 WeakPolarHBondContact CB-OE2 3.36Å; L32-E36 WeakPolarHBondContact CD2-OE2 3.42Å
33	N	33.2	Very low	35.5	Very low	95 Å²	95	135.1 Å²	135.1	51%	0.508	68%	0.682	S	S	.	*			trans	-63.9	136.8	-177.9	-176.3	-9.5	0	0	0	109.3	V35 E36	N33-V35 PolarHBondContact O-N 2.99Å; N33-E36 WeakPolarHBondContact O-CB 3.39Å; N33-E36 PolarHBondContact O-N 3.48Å
34	P	38.5	Very low	36	Very low	98 Å²	98	135.8 Å²	135.8	64%	0.636	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-53.7	-18.8	179.3	-28.4	33.9	0	0	0	115.7	E36 I37	P34-E36 VanDerWaalsContact C-N 3.27Å; P34-E36 PolarHBondContact O-N 3.21Å; P34-I37 HydrophobicContact CB-CD1 4.48Å; P34-I37 WeakPolarHBondContact O-CB 3.49Å; P34-I37 PolarHBondContact O-N 3.47Å
35	V	39	Very low	36.8	Very low	112 Å²	112	133.1 Å²	133.1	68%	0.679	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-67.1	-27.5	172	-174.9	0	0	0	0	112.3	N33 I37 A38	N33-V35 PolarHBondContact O-N 2.99Å; V35-I37 PolarHBondContact O-N 2.81Å; V35-A38 PolarHBondContact O-N 3.45Å
36	E	40.4	Very low	37.4	Very low	104 Å²	104	128 Å²	128	49%	0.486	65%	0.646	S	S	.	*	G	3₁₀ helix	trans	-77.3	-8	177.7	-64.6	178.7	177.6	0	0	113.1	L32 N33 P34 A38	L32-E36 WeakPolarHBondContact CB-OE2 3.36Å; L32-E36 WeakPolarHBondContact CD2-OE2 3.42Å; N33-E36 WeakPolarHBondContact O-CB 3.39Å; N33-E36 PolarHBondContact O-N 3.48Å; P34-E36 VanDerWaalsContact C-N 3.27Å; P34-E36 PolarHBondContact O-N 3.21Å; E36-A38 PolarHBondContact O-N 3.3Å
37	I	40.1	Very low	37.8	Very low	108 Å²	108	120 Å²	120	55%	0.554	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-74.4	-16.6	174.6	-58.4	174.8	0	0	0	111	P34 V35 N39 W40	P34-I37 HydrophobicContact CB-CD1 4.48Å; P34-I37 WeakPolarHBondContact O-CB 3.49Å; P34-I37 PolarHBondContact O-N 3.47Å; V35-I37 PolarHBondContact O-N 2.81Å; I37-N39 VanDerWaalsContact C-N 3.34Å; I37-N39 PolarHBondContact O-N 2.92Å; I37-W40 PolarHBondContact O-NE1 3.12Å
38	A	40.9	Very low	38.4	Very low	90 Å²	90	122.3 Å²	122.3	74%	0.744	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-80	-10.1	-179.5	0	0	0	0	0	114.3	V35 E36	V35-A38 PolarHBondContact O-N 3.45Å; E36-A38 PolarHBondContact O-N 3.3Å
39	N	38.8	Very low	39.1	Very low	92 Å²	92	120.8 Å²	120.8	49%	0.492	62%	0.623	S	S	.	*			trans	-116.9	59.6	-173	-131.8	-3.5	0	0	0	112.6	I37 D41 Q42	I37-N39 VanDerWaalsContact C-N 3.34Å; I37-N39 PolarHBondContact O-N 2.92Å; N39-D41 PolarHBondContact O-N 3.42Å; N39-D41 VanDerWaalsContact O-N 3.13Å; N39-Q42 PolarHBondContact O-N 3.29Å
40	W	30.4	Very low	39.2	Very low	193 Å²	193	122.6 Å²	122.6	73%	0.731	63%	0.629	S	S	*	*	H	α-helix	trans	-56.4	-27.5	-176.4	-80	71	0	0	0	113.8	I37 I43	I37-W40 PolarHBondContact O-NE1 3.12Å; W40-I43 PolarHBondContact O-N 3.2Å
41	D	40.5	Very low	39.5	Very low	121 Å²	121	122.9 Å²	122.9	65%	0.647	63%	0.631	S	S	*	*	H	α-helix	trans	-72.7	-32.2	-177.1	-68.6	-37.6	0	0	0	113.5	N39 I43 K44 E45	N39-D41 PolarHBondContact O-N 3.42Å; N39-D41 VanDerWaalsContact O-N 3.13Å; D41-I43 VanDerWaalsContact C-N 3.28Å; D41-I43 PolarHBondContact O-N 2.94Å; D41-K44 PolarHBondContact O-N 3.2Å; D41-E45 PolarHBondContact O-N 3.24Å
42	Q	46.7	Very low	39.7	Very low	119 Å²	119	120.3 Å²	120.3	56%	0.556	62%	0.624	S	S	*	*	H	α-helix	trans	-68.7	-27	175.4	-104	179.4	9.1	0	0	112.9	N39 E45 N46	N39-Q42 PolarHBondContact O-N 3.29Å; Q42-E45 PolarHBondContact O-N 2.97Å; Q42-N46 PolarHBondContact O-N 3.41Å; Q42-N46 VanDerWaalsContact O-N 3.11Å; Q42-N46 PolarHBondContact O-ND2 3.39Å
43	I	39.6	Very low	40.3	Very low	101 Å²	101	116.1 Å²	116.1	52%	0.518	61%	0.61	S	S	.	*	H	α-helix	trans	-72.3	-33	177.9	-61.3	177.2	0	0	0	110.7	W40 D41 N46 S47	W40-I43 PolarHBondContact O-N 3.2Å; D41-I43 VanDerWaalsContact C-N 3.28Å; D41-I43 PolarHBondContact O-N 2.94Å; I43-N46 PolarHBondContact O-N 3.37Å; I43-S47 PolarHBondContact O-N 3.26Å
44	K	41.6	Very low	41	Very low	151 Å²	151	119.2 Å²	119.2	66%	0.657	62%	0.622	S	S	*	*	H	α-helix	trans	-64.7	-40.8	173.9	-88.8	-177.9	180	169.5	0	111.8	D41 S47 K48	D41-K44 PolarHBondContact O-N 3.2Å; K44-S47 PolarHBondContact O-N 3.03Å; K44-S47 PolarHBondContact O-OG 3.49Å; K44-K48 PolarHBondContact O-N 3.39Å
45	E	48.7	Very low	41.8	Very low	143 Å²	143	120.3 Å²	120.3	67%	0.668	62%	0.622	S	S	*	*	H	α-helix	trans	-65.3	-40.5	174.2	-84.1	-167.4	142.4	0	0	112.3	D41 Q42 S47 K48	D41-E45 PolarHBondContact O-N 3.24Å; Q42-E45 PolarHBondContact O-N 2.97Å; E45-S47 VanDerWaalsContact C-N 3.27Å; E45-S47 PolarHBondContact O-N 2.99Å; E45-K48 PolarHBondContact O-N 3.39Å; E45-K48 VanDerWaalsContact O-N 3.15Å
46	N	42.8	Very low	42.5	Very low	92 Å²	92	119.1 Å²	119.1	49%	0.492	61%	0.612	S	S	.	*	H	α-helix	trans	-67.4	-26.9	175.8	-74.7	-28	0	0	0	113.2	Q42 I43 K48 Q49	Q42-N46 PolarHBondContact O-N 3.41Å; Q42-N46 VanDerWaalsContact O-N 3.11Å; Q42-N46 PolarHBondContact O-ND2 3.39Å; I43-N46 PolarHBondContact O-N 3.37Å; N46-K48 VanDerWaalsContact C-N 3.27Å; N46-K48 PolarHBondContact O-N 2.94Å; N46-Q49 PolarHBondContact O-N 3.19Å
47	S	38.6	Very low	43.4	Very low	72 Å²	72	120 Å²	120	50%	0.503	62%	0.62	S	S	.	*	H	α-helix	trans	-67.4	-26.8	174.4	78.5	0	0	0	0	112.9	I43 K44 E45 Q49 N50	I43-S47 PolarHBondContact O-N 3.26Å; K44-S47 PolarHBondContact O-N 3.03Å; K44-S47 PolarHBondContact O-OG 3.49Å; E45-S47 VanDerWaalsContact C-N 3.27Å; E45-S47 PolarHBondContact O-N 2.99Å; S47-Q49 VanDerWaalsContact C-N 3.28Å; S47-Q49 PolarHBondContact O-N 3.03Å; S47-N50 PolarHBondContact O-N 3.2Å
48	K	44.4	Very low	44.5	Very low	170 Å²	170	119.2 Å²	119.2	74%	0.739	62%	0.615	S	S	*	*	H	α-helix	trans	-72.7	-19.2	174	-68.9	-177	-179.1	173.4	0	112.9	K44 E45 N46	K44-K48 PolarHBondContact O-N 3.39Å; E45-K48 PolarHBondContact O-N 3.39Å; E45-K48 VanDerWaalsContact O-N 3.15Å; N46-K48 VanDerWaalsContact C-N 3.27Å; N46-K48 PolarHBondContact O-N 2.94Å
49	Q	42.7	Very low	45.1	Very low	164 Å²	164	119.7 Å²	119.7	77%	0.766	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-5.6	177.6	-77.2	-172.1	-7.2	0	0	114.7	N46 S47	N46-Q49 PolarHBondContact O-N 3.19Å; S47-Q49 VanDerWaalsContact C-N 3.28Å; S47-Q49 PolarHBondContact O-N 3.03Å
50	N	36.7	Very low	45.7	Very low	134 Å²	134	123 Å²	123	72%	0.717	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	32.7	178.4	-76.9	-34.8	0	0	0	113.6	S47 I52	S47-N50 PolarHBondContact O-N 3.2Å; N50-I52 PolarHBondContact O-N 3.43Å
51	V	38.8	Very low	47.2	Very low	121 Å²	121	118.8 Å²	118.8	73%	0.733	60%	0.601	S	S	*	*			trans	-73.1	94.8	166.9	-175.9	0	0	0	0	108.1	G53	V51-G53 PolarHBondContact O-N 2.94Å
52	I	41	Very low	48	Very low	124 Å²	124	119.3 Å²	119.3	64%	0.636	60%	0.597	S	S	*	*			trans	-50.3	111.3	172	-63.5	169.7	0	0	0	107.8	N50 D56	N50-I52 PolarHBondContact O-N 3.43Å; I52-D56 HydrophobicContact CG2-CB 3.7Å
53	G	42.3	Very low	48.2	Very low	34 Å²	34	120.1 Å²	120.1	35%	0.351	60%	0.602	S	S	.	*			trans	-64	147.4	-173.1	0	0	0	0	0	111.1	V51 N55 D56	V51-G53 PolarHBondContact O-N 2.94Å; G53-N55 PolarHBondContact O-N 3.02Å; G53-D56 WeakPolarHBondContact O-CB 3.31Å; G53-D56 PolarHBondContact O-N 3.48Å
54	Q	49.3	Very low	48.5	Very low	160 Å²	160	122 Å²	122	75%	0.748	61%	0.613	S	S	*	*	H	α-helix	trans	-53.9	-23.5	-176.6	-166.4	155.5	-8	0	0	114.1	I58	Q54-I58 WeakPolarHBondContact O-CD1 3.37Å; Q54-I58 VanDerWaalsContact O-CG1 3.31Å; Q54-I58 WeakPolarHBondContact O-CG1 3.42Å; Q54-I58 PolarHBondContact O-N 3.15Å
55	N	54.5	Low	48.7	Very low	121 Å²	121	121.4 Å²	121.4	65%	0.647	61%	0.61	S	S	*	*	H	α-helix	trans	-71.4	-29.7	174.4	-67.9	-12.7	0	0	0	113.5	G53 I58 N59	G53-N55 PolarHBondContact O-N 3.02Å; N55-I58 PolarHBondContact O-N 3.49Å; N55-N59 WeakPolarHBondContact O-CB 3.22Å; N55-N59 PolarHBondContact O-N 3.43Å; N55-N59 PolarHBondContact O-ND2 3.04Å
56	D	53.8	Low	48.1	Very low	87 Å²	87	120.2 Å²	120.2	47%	0.465	61%	0.609	S	S	.	*	H	α-helix	trans	-74.1	-34.1	177.7	-66.4	-30.4	0	0	0	111	I52 G53 N59 Y60	I52-D56 HydrophobicContact CG2-CB 3.7Å; G53-D56 WeakPolarHBondContact O-CB 3.31Å; G53-D56 PolarHBondContact O-N 3.48Å; D56-N59 PolarHBondContact O-N 3.18Å; D56-Y60 PolarHBondContact O-N 2.9Å
57	L	58.8	Low	47.6	Very low	124 Å²	124	123 Å²	123	65%	0.649	62%	0.623	S	S	*	*	H	α-helix	trans	-66.7	-41.7	172.8	-137.1	81.4	0	0	0	111.4	N59 Y60 E61	L57-N59 VanDerWaalsContact C-N 3.34Å; L57-N59 PolarHBondContact O-N 3.46Å; L57-Y60 PolarHBondContact O-N 3.41Å; L57-E61 PolarHBondContact O-N 3.33Å
58	I	62.8	Low	47.2	Very low	90 Å²	90	126.4 Å²	126.4	46%	0.462	64%	0.636	S	S	.	*	H	α-helix	trans	-64.7	-39.8	175.9	-66.8	165.7	0	0	0	110.7	Q54 N55 E61 K62	Q54-I58 WeakPolarHBondContact O-CD1 3.37Å; Q54-I58 VanDerWaalsContact O-CG1 3.31Å; Q54-I58 WeakPolarHBondContact O-CG1 3.42Å; Q54-I58 PolarHBondContact O-N 3.15Å; N55-I58 PolarHBondContact O-N 3.49Å; I58-E61 PolarHBondContact O-N 3.22Å; I58-K62 WeakPolarHBondContact O-CB 3.48Å; I58-K62 PolarHBondContact O-N 2.86Å
59	N	54.9	Low	46.5	Very low	101 Å²	101	123.3 Å²	123.3	54%	0.54	64%	0.636	S	S	.	*	H	α-helix	trans	-66.7	-38	176.4	-80.6	-24.1	0	0	0	112.2	N55 D56 L57 K62 M63	N55-N59 WeakPolarHBondContact O-CB 3.22Å; N55-N59 PolarHBondContact O-N 3.43Å; N55-N59 PolarHBondContact O-ND2 3.04Å; D56-N59 PolarHBondContact O-N 3.18Å; L57-N59 VanDerWaalsContact C-N 3.34Å; L57-N59 PolarHBondContact O-N 3.46Å; N59-K62 PolarHBondContact O-N 3.05Å; N59-M63 WeakPolarHBondContact O-CB 3.35Å; N59-M63 PolarHBondContact O-N 3.38Å
60	Y	51.4	Low	45.9	Very low	160 Å²	160	122.5 Å²	122.5	63%	0.627	64%	0.642	S	S	*	*	H	α-helix	trans	-66.2	-41.8	174.6	-108.2	-82.3	0	0	0	112.5	D56 L57 K62 M63 L64	D56-Y60 PolarHBondContact O-N 2.9Å; L57-Y60 PolarHBondContact O-N 3.41Å; Y60-K62 VanDerWaalsContact C-N 3.32Å; Y60-K62 PolarHBondContact O-N 2.69Å; Y60-M63 PolarHBondContact O-N 3.24Å; Y60-L64 PolarHBondContact O-N 3Å; Y60-L64 VanDerWaalsContact O-N 3.12Å
61	E	61.8	Low	45.5	Very low	105 Å²	105	121.2 Å²	121.2	49%	0.491	64%	0.644	S	S	.	*	H	α-helix	trans	-66.3	-36.2	176.9	-165.4	-178.5	175.4	0	0	111.6	L57 I58 L64 K65	L57-E61 PolarHBondContact O-N 3.33Å; I58-E61 PolarHBondContact O-N 3.22Å; E61-L64 PolarHBondContact O-N 2.98Å; E61-K65 HydrophobicContact CG-CD 4.47Å; E61-K65 PolarHBondContact O-N 2.81Å; E61-K65 WeakPolarHBondContact OE1-CE 3.36Å; E61-K65 IonicContact OE1-NZ 2.65Å; E61-K65 PolarHBondContact OE1-NZ 2.6Å
62	K	57.8	Low	45	Very low	133 Å²	133	123.3 Å²	123.3	58%	0.578	65%	0.649	S	S	*	*	H	α-helix	trans	-67.1	-38.3	175.1	-147.1	175.1	-171.3	179.9	0	111.9	I58 N59 Y60 L64 K65 D66	I58-K62 WeakPolarHBondContact O-CB 3.48Å; I58-K62 PolarHBondContact O-N 2.86Å; N59-K62 PolarHBondContact O-N 3.05Å; Y60-K62 VanDerWaalsContact C-N 3.32Å; Y60-K62 PolarHBondContact O-N 2.69Å; K62-L64 VanDerWaalsContact C-N 3.29Å; K62-L64 PolarHBondContact O-N 3.25Å; K62-K65 PolarHBondContact O-N 3.42Å; K62-D66 PolarHBondContact O-N 3.15Å
63	M	49.8	Very low	44.5	Very low	135 Å²	135	123.2 Å²	123.2	67%	0.665	66%	0.657	S	S	*	*	H	α-helix	trans	-70.2	-26	178.7	-146.3	177	69.5	0	0	112.9	N59 Y60	N59-M63 WeakPolarHBondContact O-CB 3.35Å; N59-M63 PolarHBondContact O-N 3.38Å; Y60-M63 PolarHBondContact O-N 3.24Å
64	L	45.4	Very low	43.7	Very low	140 Å²	140	124.7 Å²	124.7	73%	0.733	67%	0.672	S	S	*	*	H	α-helix	trans	-84	-20.4	175.6	-80	162.2	0	0	0	113.8	Y60 E61 K62	Y60-L64 PolarHBondContact O-N 3Å; Y60-L64 VanDerWaalsContact O-N 3.12Å; E61-L64 PolarHBondContact O-N 2.98Å; K62-L64 VanDerWaalsContact C-N 3.29Å; K62-L64 PolarHBondContact O-N 3.25Å
65	K	46.7	Very low	42.7	Very low	140 Å²	140	122.7 Å²	122.7	61%	0.609	68%	0.676	S	S	*	*	H	α-helix	trans	-94.2	-14.3	-178.4	-74.5	-177.5	-174.7	170	0	114.7	E61 K62	E61-K65 HydrophobicContact CG-CD 4.47Å; E61-K65 PolarHBondContact O-N 2.81Å; E61-K65 WeakPolarHBondContact OE1-CE 3.36Å; E61-K65 IonicContact OE1-NZ 2.65Å; E61-K65 PolarHBondContact OE1-NZ 2.6Å; K62-K65 PolarHBondContact O-N 3.42Å
66	D	35.3	Very low	41.3	Very low	118 Å²	118	124.7 Å²	124.7	63%	0.631	69%	0.686	S	S	*	*			trans	-94.8	8	-173.3	-71.7	-15.2	0	0	0	114.6	K62 D68	K62-D66 PolarHBondContact O-N 3.15Å; D66-D68 VanDerWaalsContact C-N 3.3Å; D66-D68 PolarHBondContact O-N 2.82Å
67	D	31.8	Very low	40.3	Very low	149 Å²	149	125.5 Å²	125.5	80%	0.797	71%	0.705	S	S	*	*			trans	-90.2	52.4	170.7	-86.4	-18.3	0	0	0	111.9
68	D	30.3	Very low	38.8	Very low	144 Å²	144	128.4 Å²	128.4	77%	0.77	72%	0.715	S	S	*	*	S	Bend	trans	-147	119.9	164.9	-107.2	-26.2	0	0	0	113.1	D66	D66-D68 VanDerWaalsContact C-N 3.3Å; D66-D68 PolarHBondContact O-N 2.82Å
69	S	30.2	Very low	37.1	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	73%	0.729	S	S	*	*			trans	59.1	103.1	160.4	70.5	0	0	0	0	118.1
70	T	30.2	Very low	36	Very low	147 Å²	147	136 Å²	136	90%	0.902	75%	0.747	S	S	*	*			trans	-139.3	105.5	146.9	17.8	0	0	0	0	111.9
71	S	28.1	Very low	34.8	Very low	106 Å²	106	139.7 Å²	139.7	74%	0.741	76%	0.76	S	S	*	*			trans	-32.4	139.7	169.4	50.8	0	0	0	0	117.9	P73	S71-P73 WeakPolarHBondContact O-CD 3.4Å
72	I	29.8	Very low	33.3	Very low	166 Å²	166	143.3 Å²	143.3	85%	0.851	78%	0.777	S	S	*	*			trans	-46.2	132.5	158.1	-58.7	157.1	0	0	0	111.8
73	P	29.8	Very low	31.8	Very low	122 Å²	122	145.9 Å²	145.9	79%	0.792	79%	0.791	S	S	*	*			trans	-126.3	122.3	144.4	27.6	-10.2	0	0	0	110.3	S71	S71-P73 WeakPolarHBondContact O-CD 3.4Å
74	G	25.5	Very low	31	Very low	65 Å²	65	143 Å²	143	67%	0.67	80%	0.795	S	S	*	*			trans	-72.8	160.3	172.8	0	0	0	0	0	112.9
75	S	28.8	Very low	30.2	Very low	118 Å²	118	145.9 Å²	145.9	83%	0.825	80%	0.802	S	S	*	*				-179.5	121.5	129.8	38.4	0	0	0	0	111.1
76	N	24.9	Very low	29.3	Very low	162 Å²	162	149.2 Å²	149.2	87%	0.866	82%	0.816	S	S	*	*			trans	13.5	123.2	145.3	-64.2	-16.2	0	0	0	119.7
77	A	31.9	Very low	29	Very low	105 Å²	105	155.5 Å²	155.5	87%	0.868	83%	0.831	S	S	*	*			trans	-154.9	128.1	133.6	0	0	0	0	0	110.3
78	E	27.4	Very low	28.8	Very low	184 Å²	184	152 Å²	152	86%	0.86	83%	0.831	S	S	*	*			trans	-75.7	150.9	-167.2	-75.2	154.7	124.8	0	0	115.5
79	S	27.6	Very low	28.7	Very low	107 Å²	107	156.7 Å²	156.7	75%	0.748	84%	0.838	S	S	*	*			trans	36.1	107.9	143	70	0	0	0	0	119.9
80	R	31.1	Very low	28.9	Very low	243 Å²	243	157.6 Å²	157.6	92%	0.917	84%	0.841	S	S	*	*			trans	-144.1	91.2	134.3	-125.9	176.2	-177.6	-166.6	0.8	110.6
81	R	26.3	Very low	28.9	Very low	238 Å²	238	160.8 Å²	160.8	90%	0.898	84%	0.842	S	S	*	*			trans	-71.7	119.2	167.8	-74.6	175.9	171.1	179.5	-2.5	108.6
82	Q	31.4	Very low	29.1	Very low	181 Å²	181	159.5 Å²	159.5	85%	0.846	85%	0.846	S	S	*	*			trans	-128.9	126.7	152.6	-77.3	-169.4	3.2	0	0	109.6
83	Q	26.7	Very low	29.2	Very low	188 Å²	188	156.6 Å²	156.6	88%	0.879	84%	0.84	S	S	*	*			trans	-80	113.8	-169.8	-65.2	169.7	-10.8	0	0	110
84	G	31.6	Very low	29.4	Very low	73 Å²	73	162.4 Å²	162.4	75%	0.753	85%	0.846	S	S	*	*			trans	-99.9	107.1	164	0	0	0	0	0	109.8	K86	G84-K86 PolarHBondContact O-N 3.04Å
85	K	29.1	Very low	29.8	Very low	202 Å²	202	166.5 Å²	166.5	88%	0.878	85%	0.853	S	S	*	*			trans	-57.8	114	-175.1	-71.6	172.5	174.6	173.4	0	112.4	R87	K85-R87 PolarHBondContact O-N 3.04Å
86	K	28.1	Very low	30	Very low	210 Å²	210	164.3 Å²	164.3	91%	0.913	85%	0.849	S	S	*	*			trans	-67.6	113.4	162.9	-76.4	-179.4	174	179.6	0	109.4	G84 G88	G84-K86 PolarHBondContact O-N 3.04Å; K86-G88 PolarHBondContact O-N 3.09Å
87	R	29.6	Very low	30.5	Very low	250 Å²	250	161.5 Å²	161.5	94%	0.943	85%	0.848	S	S	*	*			trans	-79	107.3	163.8	-84.4	-178.4	164.9	-176.8	-4.4	108.3	K85	K85-R87 PolarHBondContact O-N 3.04Å
88	G	26.2	Very low	30.7	Very low	76 Å²	76	167.9 Å²	167.9	78%	0.784	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-72.4	131.8	174.9	0	0	0	0	0	111.5	K86	K86-G88 PolarHBondContact O-N 3.09Å
89	R	29.5	Very low	31	Very low	242 Å²	242	169 Å²	169	91%	0.913	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-90.5	133	167.9	-136.4	176.5	-176.5	-172.3	0.2	107.8
90	P	34.1	Very low	31.6	Very low	125 Å²	125	174.8 Å²	174.8	81%	0.812	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-76.8	143.9	-167.3	30.2	-33.3	0	0	0	112.5	G92	P90-G92 PolarHBondContact O-N 3.35Å
91	K	28.9	Very low	32	Very low	213 Å²	213	169.5 Å²	169.5	93%	0.926	85%	0.854	S	S	*	*			trans	-64.8	113.6	175.8	-75	175	170.9	177.4	0	110.4
92	G	32.2	Very low	32.8	Very low	79 Å²	79	164.8 Å²	164.8	81%	0.814	85%	0.846	S	S	*	*			trans	-76.3	125.4	166.3	0	0	0	0	0	110.8	P90	P90-G92 PolarHBondContact O-N 3.35Å
93	S	32.7	Very low	33.8	Very low	105 Å²	105	161.3 Å²	161.3	73%	0.734	83%	0.833	S	S	*	*			trans	-72.1	139	-174	-175.7	0	0	0	0	113	N95	S93-N95 PolarHBondContact O-N 3.19Å
94	R	33.5	Very low	34.9	Very low	244 Å²	244	158.1 Å²	158.1	92%	0.921	83%	0.828	S	S	*	*			trans	-62.4	113.8	169.1	-76.9	164.1	83.3	173.6	6	109.7
95	N	34.9	Very low	35.4	Very low	152 Å²	152	159 Å²	159	81%	0.813	82%	0.822	S	S	*	*			trans	-112.1	102.4	159.7	-75.8	-5.7	0	0	0	108.4	S93	S93-N95 PolarHBondContact O-N 3.19Å
96	G	32.8	Very low	36.1	Very low	72 Å²	72	155.2 Å²	155.2	74%	0.742	81%	0.808	S	S	*	*			trans	-68.7	132	175.8	0	0	0	0	0	111.4	R98	G96-R98 PolarHBondContact O-N 3.38Å
97	A	35.6	Very low	37.2	Very low	102 Å²	102	149.2 Å²	149.2	84%	0.843	79%	0.791	S	S	*	*			trans	-65.7	107.1	175.7	0	0	0	0	0	110.7	K99	A97-K99 PolarHBondContact O-N 3.11Å
98	R	35.7	Very low	37.9	Very low	240 Å²	240	147.3 Å²	147.3	91%	0.906	78%	0.784	S	S	*	*			trans	-83.1	104.7	166.9	-77.9	-178.8	161.6	-170.3	-5.5	108.5	G96 R100	G96-R98 PolarHBondContact O-N 3.38Å; R98-R100 PolarHBondContact O-N 2.99Å
99	K	32.5	Very low	38.4	Very low	208 Å²	208	149.6 Å²	149.6	90%	0.904	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-63.1	122.2	166	-70.7	-175.2	175.7	-175.2	0	108.5	A97	A97-K99 PolarHBondContact O-N 3.11Å
100	R	40.8	Very low	38.9	Very low	227 Å²	227	147 Å²	147	86%	0.857	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-85.1	145	174.5	-71.1	-177.9	179	178.3	0.1	109.8	R98	R98-R100 PolarHBondContact O-N 2.99Å
101	P	39.3	Very low	39	Very low	133 Å²	133	146 Å²	146	86%	0.864	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-78.1	131.1	-172.9	-3.8	22.7	0	0	0	110.6
102	I	43	Very low	39.4	Very low	139 Å²	139	141.3 Å²	141.3	71%	0.713	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-80.6	129.6	174.1	-70.4	133.1	0	0	0	108.3	P104	I102-P104 WeakPolarHBondContact O-CD 3.12Å
103	D	52.2	Low	39.6	Very low	108 Å²	108	145.5 Å²	145.5	58%	0.578	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-67	121.2	177.5	-171.2	-39.9	0	0	0	109.9	S105	D103-S105 PolarHBondContact O-N 3.27Å; D103-S105 VanDerWaalsContact O-N 3.17Å; D103-S105 PolarHBondContact OD1-N 3.1Å; D103-S105 PolarHBondContact OD1-OG 2.96Å
104	P	50.6	Low	39.7	Very low	121 Å²	121	144.9 Å²	144.9	79%	0.786	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-12.2	-174.2	-18.8	31	0	0	0	115.3	I102	I102-P104 WeakPolarHBondContact O-CD 3.12Å
105	S	42.9	Very low	39.7	Very low	90 Å²	90	140.6 Å²	140.6	63%	0.629	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-18.4	-175.1	62.7	0	0	0	0	114.2	D103	D103-S105 PolarHBondContact O-N 3.27Å; D103-S105 VanDerWaalsContact O-N 3.17Å; D103-S105 PolarHBondContact OD1-N 3.1Å; D103-S105 PolarHBondContact OD1-OG 2.96Å
106	Q	43.8	Very low	39.7	Very low	123 Å²	123	142.4 Å²	142.4	58%	0.575	76%	0.764	S	S	*	*			trans	-150.4	82.2	178.2	-64.4	-166.8	6.2	0	0	113	W108	Q106-W108 PolarHBondContact O-N 3.45Å
107	P	50.5	Low	39.9	Very low	84 Å²	84	144.1 Å²	144.1	55%	0.545	76%	0.762	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-9	-171.4	-1.7	15.6	0	0	0	115.7
108	W	45.1	Very low	39.8	Very low	211 Å²	211	147 Å²	147	80%	0.799	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	11.1	-171.7	57.3	73.6	0	0	0	114.6	Q106	Q106-W108 PolarHBondContact O-N 3.45Å
109	L	36.6	Very low	39.8	Very low	124 Å²	124	143 Å²	143	65%	0.649	76%	0.758	S	S	*	*			trans	-105.8	84.6	178.5	-144.3	78.1	0	0	0	109.5	S111	L109-S111 PolarHBondContact O-N 2.95Å
110	E	38.6	Very low	39.9	Very low	187 Å²	187	135.6 Å²	135.6	87%	0.874	74%	0.741	S	S	*	*			trans	-63.7	119.9	165.1	-69.7	179.3	166.2	0	0	107.8	S112	E110-S112 PolarHBondContact O-N 2.9Å
111	S	37.3	Very low	39.7	Very low	103 Å²	103	133.3 Å²	133.3	72%	0.72	75%	0.745	S	S	*	*			trans	-58.3	124.2	-176.9	47.6	0	0	0	0	110.5	L109 D113	L109-S111 PolarHBondContact O-N 2.95Å; S111-D113 PolarHBondContact O-N 2.68Å; S111-D113 VanDerWaalsContact O-N 3.16Å
112	S	36	Very low	39.5	Very low	116 Å²	116	135 Å²	135	81%	0.811	74%	0.741	S	S	*	*			trans	-57.9	109	174.7	-52.9	0	0	0	0	111.5	E110 S114	E110-S112 PolarHBondContact O-N 2.9Å; S112-S114 VanDerWaalsContact C-N 3.26Å; S112-S114 PolarHBondContact O-N 3.34Å
113	D	37.2	Very low	39.4	Very low	166 Å²	166	135.9 Å²	135.9	89%	0.888	75%	0.747	S	S	*	*			trans	-76.5	84.8	161.4	-74	-29.7	0	0	0	107.9	S111	S111-D113 PolarHBondContact O-N 2.68Å; S111-D113 VanDerWaalsContact O-N 3.16Å
114	S	34.3	Very low	39.2	Very low	93 Å²	93	139.5 Å²	139.5	65%	0.65	76%	0.76	S	S	*	*			trans	-76	129	157.7	60.4	0	0	0	0	108.3	S112	S112-S114 VanDerWaalsContact C-N 3.26Å; S112-S114 PolarHBondContact O-N 3.34Å
115	D	33.2	Very low	39	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	76%	0.755	S	S	*	*			trans	126.4	68.6	157.7	-61.2	-22.1	0	0	0	112.5
116	E	34.7	Very low	40	Very low	191 Å²	191	141.2 Å²	141.2	89%	0.893	76%	0.755	S	S	*	*			trans	-132.7	136.7	145.5	-79.1	-145.5	158	0	0	111.6
117	P	37.1	Very low	41.4	Very low	107 Å²	107	140.8 Å²	140.8	70%	0.695	76%	0.757	S	S	*	*			trans	-84.6	143.1	-163.3	34.2	-33.8	0	0	0	112.3	I119	P117-I119 PolarHBondContact O-N 3.29Å
118	N	34.9	Very low	42.6	Very low	163 Å²	163	141.4 Å²	141.4	87%	0.872	76%	0.756	S	S	*	*			trans	-35.3	95.2	170.2	-164.1	23.8	0	0	0	114.1
119	I	34.4	Very low	44.2	Very low	157 Å²	157	135 Å²	135	81%	0.805	74%	0.735	S	S	*	*			trans	-118.1	117.7	163.2	-64.2	171.7	0	0	0	106.3	P117	P117-I119 PolarHBondContact O-N 3.29Å
120	G	35.2	Very low	46.4	Very low	52 Å²	52	136 Å²	136	54%	0.536	73%	0.731	S	S	.	*			trans	-71.6	131.8	-171.7	0	0	0	0	0	113.4	E122	G120-E122 PolarHBondContact O-N 3.33Å
121	L	36.1	Very low	48.5	Very low	179 Å²	179	133.1 Å²	133.1	94%	0.937	72%	0.716	S	S	*	*	S	Bend	trans	37.7	60.4	137.2	-60.9	175.2	0	0	0	117.9
122	E	35.9	Very low	50.7	Low	167 Å²	167	134.3 Å²	134.3	78%	0.78	70%	0.704	S	S	*	*			trans	-130.3	16.5	162.1	-71.4	-169.2	174.3	0	0	114.2	G120	G120-E122 PolarHBondContact O-N 3.33Å
123	D	41.7	Very low	53.1	Low	158 Å²	158	136.7 Å²	136.7	85%	0.845	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-87.4	5.8	179.9	-77	-16.1	0	0	0	115.2	L125	D123-L125 PolarHBondContact O-N 3.29Å
124	E	47	Very low	55.4	Low	184 Å²	184	133.2 Å²	133.2	86%	0.86	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-79.8	5.9	174.2	-74.4	-173	170.3	0	0	113.7
125	L	47	Very low	57.9	Low	127 Å²	127	135.3 Å²	135.3	67%	0.665	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-105	-4.6	-178.5	-67.8	174.4	0	0	0	115.1	D123	D123-L125 PolarHBondContact O-N 3.29Å
126	D	63.7	Low	60.5	Low	121 Å²	121	134.1 Å²	134.1	65%	0.647	67%	0.666	S	S	*	*	H	α-helix	trans	-82.4	-28.8	-177.2	-146.1	18	0	0	0	112.7	E129 Y130	D126-E129 PolarHBondContact O-N 3.08Å; D126-Y130 PolarHBondContact O-N 3.34Å
127	D	73.1	Confident	63.1	Low	113 Å²	113	129.5 Å²	129.5	60%	0.604	64%	0.644	S	S	*	*	H	α-helix	trans	-66.6	-40.2	177.4	-74.9	-20.6	0	0	0	111.9	E129 Y130 F131	D127-E129 VanDerWaalsContact C-N 3.33Å; D127-E129 PolarHBondContact O-N 3.11Å; D127-Y130 WeakPolarHBondContact O-CB 3.33Å; D127-Y130 PolarHBondContact O-N 3.24Å; D127-F131 WeakPolarHBondContact O-CD2 3.35Å; D127-F131 PolarHBondContact O-N 3.11Å
128	D	75.3	Confident	65.7	Low	97 Å²	97	130.7 Å²	130.7	52%	0.519	64%	0.638	S	S	.	*	H	α-helix	trans	-67.3	-34.8	177.3	-76.1	-17.5	0	0	0	112	R132	D128-R132 WeakPolarHBondContact O-CB 3.41Å; D128-R132 PolarHBondContact O-N 3.18Å
129	E	78.6	Confident	68.2	Low	78 Å²	78	129.2 Å²	129.2	36%	0.364	63%	0.627	S	S	.	*	H	α-helix	trans	-67.9	-38.5	173.6	-168.1	77.1	-160	0	0	110.9	D126 D127 R132 R133	D126-E129 PolarHBondContact O-N 3.08Å; D127-E129 VanDerWaalsContact C-N 3.33Å; D127-E129 PolarHBondContact O-N 3.11Å; E129-R132 PolarHBondContact O-N 3.14Å; E129-R132 IonicContact OE1-NH1 2.93Å; E129-R132 IonicContact OE2-CZ 2.6Å; E129-R132 IonicContact OE2-NH1 3.71Å; E129-R132 PolarHBondContact OE2-NH1 3.49Å; E129-R133 PolarHBondContact O-N 3.45Å
130	Y	82.7	Confident	70.9	Confident	143 Å²	143	127.5 Å²	127.5	56%	0.561	61%	0.611	S	S	*	*	H	α-helix	trans	-62.8	-48.6	174.6	175.9	-97.2	0	0	0	112.2	D126 D127 R132 R133 L134	D126-Y130 PolarHBondContact O-N 3.34Å; D127-Y130 WeakPolarHBondContact O-CB 3.33Å; D127-Y130 PolarHBondContact O-N 3.24Å; Y130-R132 VanDerWaalsContact C-N 3.32Å; Y130-R132 PolarHBondContact O-N 3.43Å; Y130-R133 PolarHBondContact O-N 3.48Å; Y130-L134 PolarHBondContact O-N 3.36Å
131	F	83.3	Confident	73.4	Confident	127 Å²	127	131 Å²	131	56%	0.557	61%	0.613	S	S	*	*	H	α-helix	trans	-63	-39.6	176.8	-74.8	-65.8	0	0	0	111.9	D127 R133 L134 E135	D127-F131 WeakPolarHBondContact O-CD2 3.35Å; D127-F131 PolarHBondContact O-N 3.11Å; F131-R133 VanDerWaalsContact C-N 3.35Å; F131-R133 PolarHBondContact O-N 3.36Å; F131-L134 PolarHBondContact O-N 2.94Å; F131-E135 WeakPolarHBondContact O-CB 3.37Å; F131-E135 PolarHBondContact O-N 2.87Å
132	R	82.9	Confident	75.9	Confident	128 Å²	128	126.2 Å²	126.2	48%	0.483	59%	0.589	S	S	.	*	H	α-helix	trans	-63.2	-39.5	176.8	-158.8	-177.4	-52.2	121.5	10.4	112.2	D128 E129 Y130 E135 E136	D128-R132 WeakPolarHBondContact O-CB 3.41Å; D128-R132 PolarHBondContact O-N 3.18Å; E129-R132 PolarHBondContact O-N 3.14Å; E129-R132 IonicContact OE1-NH1 2.93Å; E129-R132 IonicContact OE2-CZ 2.6Å; E129-R132 IonicContact OE2-NH1 3.71Å; E129-R132 PolarHBondContact OE2-NH1 3.49Å; Y130-R132 VanDerWaalsContact C-N 3.32Å; Y130-R132 PolarHBondContact O-N 3.43Å; R132-E135 PolarHBondContact O-N 3.43Å; R132-E136 WeakPolarHBondContact O-CB 3.33Å; R132-E136 PolarHBondContact O-N 3.2Å
133	R	86.2	Confident	78.5	Confident	167 Å²	167	121.1 Å²	121.1	63%	0.63	58%	0.575	S	S	*	*	H	α-helix	trans	-65	-40.7	173	-85.7	-174.7	179.9	154.7	7.1	112.8	E129 Y130 F131 E135 E136 E137	E129-R133 PolarHBondContact O-N 3.45Å; Y130-R133 PolarHBondContact O-N 3.48Å; F131-R133 VanDerWaalsContact C-N 3.35Å; F131-R133 PolarHBondContact O-N 3.36Å; R133-E135 VanDerWaalsContact C-N 3.31Å; R133-E136 PolarHBondContact O-N 3.05Å; R133-E137 WeakPolarHBondContact O-CB 3.43Å; R133-E137 PolarHBondContact O-N 3.44Å
134	L	86.5	Confident	80.9	Confident	92 Å²	92	119.6 Å²	119.6	48%	0.482	56%	0.563	S	S	.	*	H	α-helix	trans	-64.2	-39.9	178.4	-149.5	85.4	0	0	0	111.1	Y130 F131 E137 K138	Y130-L134 PolarHBondContact O-N 3.36Å; F131-L134 PolarHBondContact O-N 2.94Å; L134-E137 PolarHBondContact O-N 3.19Å; L134-K138 WeakPolarHBondContact O-CB 3.38Å; L134-K138 PolarHBondContact O-N 3.35Å
135	E	85.7	Confident	82.8	Confident	137 Å²	137	114.3 Å²	114.3	64%	0.64	54%	0.538	S	S	*	.	H	α-helix	trans	-69.9	-39.3	177.1	-147.6	167.8	-140.1	0	0	111.6	F131 R132 R133 K138 M139	F131-E135 WeakPolarHBondContact O-CB 3.37Å; F131-E135 PolarHBondContact O-N 2.87Å; R132-E135 PolarHBondContact O-N 3.43Å; R133-E135 VanDerWaalsContact C-N 3.31Å; E135-K138 PolarHBondContact O-N 3.46Å; E135-M139 WeakPolarHBondContact O-CB 3.43Å; E135-M139 VanDerWaalsContact O-CG 3.24Å; E135-M139 WeakPolarHBondContact O-CG 3.49Å; E135-M139 PolarHBondContact O-N 3.37Å
136	E	87.8	Confident	84.8	Confident	129 Å²	129	112.9 Å²	112.9	60%	0.603	54%	0.535	S	S	*	.	H	α-helix	trans	-64.7	-38.3	172.1	-114	-176.6	175.8	0	0	112.9	R132 R133 R140	R132-E136 WeakPolarHBondContact O-CB 3.33Å; R132-E136 PolarHBondContact O-N 3.2Å; R133-E136 PolarHBondContact O-N 3.05Å; E136-R140 WeakPolarHBondContact O-CB 3.41Å; E136-R140 PolarHBondContact O-N 2.97Å
137	E	89.8	Confident	86	Confident	93 Å²	93	109.5 Å²	109.5	44%	0.435	52%	0.521	S	S	.	.	H	α-helix	trans	-67.5	-45.2	176.4	-169.2	119.3	-114.4	0	0	110.8	R133 L134 M139 R140 E141	R133-E137 WeakPolarHBondContact O-CB 3.43Å; R133-E137 PolarHBondContact O-N 3.44Å; L134-E137 PolarHBondContact O-N 3.19Å; E137-M139 PolarHBondContact O-N 2.82Å; E137-R140 WeakPolarHBondContact O-CA 3.49Å; E137-R140 WeakPolarHBondContact O-CB 3.28Å; E137-R140 PolarHBondContact O-N 3.05Å; E137-R140 VanDerWaalsContact O-N 3.1Å; E137-R140 IonicContact OE1-CZ 3.79Å; E137-R140 IonicContact OE1-NH1 3.36Å; E137-R140 PolarHBondContact OE1-NH1 3.34Å; E137-R140 IonicContact OE1-NH2 3.44Å; E137-E141 PolarHBondContact O-N 2.83Å
138	K	91.7	Very high	86.9	Confident	133 Å²	133	110.4 Å²	110.4	58%	0.578	52%	0.516	S	S	*	.	H	α-helix	trans	-60.1	-46.4	174.6	-174.5	179	178.8	-178.9	0	112	L134 E135 R140 E141 D142	L134-K138 WeakPolarHBondContact O-CB 3.38Å; L134-K138 PolarHBondContact O-N 3.35Å; E135-K138 PolarHBondContact O-N 3.46Å; K138-R140 PolarHBondContact O-N 3.19Å; K138-E141 PolarHBondContact O-N 3.25Å; K138-D142 WeakPolarHBondContact O-CB 3.46Å; K138-D142 VanDerWaalsContact O-CG 3.29Å; K138-D142 PolarHBondContact O-N 3.01Å
139	M	86.9	Confident	87.7	Confident	131 Å²	131	111.3 Å²	111.3	65%	0.645	52%	0.515	S	S	*	.	H	α-helix	trans	-61.8	-30.8	176	-75.4	-72	-72.9	0	0	112.4	E135 E137 A143	E135-M139 WeakPolarHBondContact O-CB 3.43Å; E135-M139 VanDerWaalsContact O-CG 3.24Å; E135-M139 WeakPolarHBondContact O-CG 3.49Å; E135-M139 PolarHBondContact O-N 3.37Å; E137-M139 PolarHBondContact O-N 2.82Å; M139-A143 VanDerWaalsContact O-CB 3.29Å; M139-A143 WeakPolarHBondContact O-CB 3.36Å; M139-A143 PolarHBondContact O-N 3.33Å
140	R	91.1	Very high	88.3	Confident	121 Å²	121	115.5 Å²	115.5	46%	0.457	53%	0.527	S	S	.	.	H	α-helix	trans	-72.8	-43.8	175.4	-159.5	-170.3	-47	127.6	8.3	111.5	E136 E137 K138 A143 E144	E136-R140 WeakPolarHBondContact O-CB 3.41Å; E136-R140 PolarHBondContact O-N 2.97Å; E137-R140 WeakPolarHBondContact O-CA 3.49Å; E137-R140 WeakPolarHBondContact O-CB 3.28Å; E137-R140 PolarHBondContact O-N 3.05Å; E137-R140 VanDerWaalsContact O-N 3.1Å; E137-R140 IonicContact OE1-CZ 3.79Å; E137-R140 IonicContact OE1-NH1 3.36Å; E137-R140 PolarHBondContact OE1-NH1 3.34Å; E137-R140 IonicContact OE1-NH2 3.44Å; K138-R140 PolarHBondContact O-N 3.19Å; R140-A143 PolarHBondContact O-N 3.27Å; R140-E144 WeakPolarHBondContact O-CG 3.43Å; R140-E144 PolarHBondContact O-N 3.21Å
141	E	87.9	Confident	88.6	Confident	126 Å²	126	117.1 Å²	117.1	59%	0.589	53%	0.533	S	S	*	.	H	α-helix	trans	-63.3	-44.1	175.1	-73.4	-174	158.6	0	0	111.5	E137 K138 A143 E144 E145	E137-E141 PolarHBondContact O-N 2.83Å; K138-E141 PolarHBondContact O-N 3.25Å; E141-A143 VanDerWaalsContact C-N 3.32Å; E141-A143 PolarHBondContact O-N 3.46Å; E141-E144 PolarHBondContact O-N 2.99Å; E141-E144 VanDerWaalsContact O-N 3.15Å; E141-E145 WeakPolarHBondContact O-CB 3.44Å; E141-E145 PolarHBondContact O-N 2.66Å
142	D	89.5	Confident	88.9	Confident	79 Å²	79	116.4 Å²	116.4	42%	0.422	53%	0.531	S	S	.	.	H	α-helix	trans	-61.3	-41.1	175.7	-71.4	-22.4	0	0	0	111.1	K138 E145 V146	K138-D142 WeakPolarHBondContact O-CB 3.46Å; K138-D142 VanDerWaalsContact O-CG 3.29Å; K138-D142 PolarHBondContact O-N 3.01Å; D142-E145 PolarHBondContact O-N 3.19Å; D142-V146 WeakPolarHBondContact O-CB 3.03Å; D142-V146 VanDerWaalsContact O-CG2 3.25Å; D142-V146 WeakPolarHBondContact O-CG2 3.3Å; D142-V146 PolarHBondContact O-N 3.27Å
143	A	89.4	Confident	89.1	Confident	60 Å²	60	116.9 Å²	116.9	50%	0.496	54%	0.54	S	S	.	.	H	α-helix	trans	-66.8	-36.8	175	0	0	0	0	0	112.8	M139 R140 E141 S147	M139-A143 VanDerWaalsContact O-CB 3.29Å; M139-A143 WeakPolarHBondContact O-CB 3.36Å; M139-A143 PolarHBondContact O-N 3.33Å; R140-A143 PolarHBondContact O-N 3.27Å; E141-A143 VanDerWaalsContact C-N 3.32Å; E141-A143 PolarHBondContact O-N 3.46Å; A143-S147 WeakPolarHBondContact O-CB 3.32Å; A143-S147 PolarHBondContact O-N 2.86Å
144	E	91.8	Very high	89.3	Confident	125 Å²	125	113.7 Å²	113.7	58%	0.584	53%	0.532	S	S	*	.	H	α-helix	trans	-68.9	-39.8	174.4	-76.4	-173.4	-173.9	0	0	112	R140 E141 S147 R148	R140-E144 WeakPolarHBondContact O-CG 3.43Å; R140-E144 PolarHBondContact O-N 3.21Å; E141-E144 PolarHBondContact O-N 2.99Å; E141-E144 VanDerWaalsContact O-N 3.15Å; E144-S147 WeakPolarHBondContact O-CB 3.29Å; E144-S147 PolarHBondContact O-N 3.1Å; E144-R148 WeakPolarHBondContact O-CB 3.37Å; E144-R148 PolarHBondContact O-N 3.32Å
145	E	88.5	Confident	89.3	Confident	73 Å²	73	112.3 Å²	112.3	34%	0.341	54%	0.535	S	S	.	.	H	α-helix	trans	-60.9	-47.4	173.6	-170.1	73.9	-105.6	0	0	110.8	E141 D142 S147 R148 K149	E141-E145 WeakPolarHBondContact O-CB 3.44Å; E141-E145 PolarHBondContact O-N 2.66Å; D142-E145 PolarHBondContact O-N 3.19Å; E145-S147 VanDerWaalsContact C-N 3.33Å; E145-S147 PolarHBondContact O-N 3.04Å; E145-R148 WeakPolarHBondContact O-CB 3.3Å; E145-R148 PolarHBondContact O-N 3.43Å; E145-R148 IonicContact OE1-CZ 3.68Å; E145-R148 IonicContact OE1-NE 3.91Å; E145-R148 PolarHBondContact OE1-NE 3Å; E145-R148 IonicContact OE1-NH2 2.68Å; E145-R148 PolarHBondContact OE1-NH2 3.05Å; E145-R148 IonicContact OE2-CZ 3.57Å; E145-R148 IonicContact OE2-NH2 3.86Å; E145-R148 PolarHBondContact OE2-NH2 3.32Å; E145-K149 WeakPolarHBondContact O-CB 3.27Å; E145-K149 WeakPolarHBondContact O-CG 3.4Å; E145-K149 PolarHBondContact O-N 3.08Å
146	V	88.9	Confident	89.3	Confident	97 Å²	97	113.5 Å²	113.5	59%	0.588	53%	0.533	S	S	*	.	H	α-helix	trans	-62.7	-39.9	175.6	171.6	0	0	0	0	111	D142 K149 R150	D142-V146 WeakPolarHBondContact O-CB 3.03Å; D142-V146 VanDerWaalsContact O-CG2 3.25Å; D142-V146 WeakPolarHBondContact O-CG2 3.3Å; D142-V146 PolarHBondContact O-N 3.27Å; V146-K149 PolarHBondContact O-N 2.64Å; V146-R150 VanDerWaalsContact O-CB 3.29Å; V146-R150 WeakPolarHBondContact O-CB 3.1Å; V146-R150 PolarHBondContact O-N 3.37Å
147	S	88.1	Confident	89.1	Confident	51 Å²	51	110 Å²	110	36%	0.357	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-39	175.5	-163	0	0	0	0	112.3	A143 E144 E145 R151	A143-S147 WeakPolarHBondContact O-CB 3.32Å; A143-S147 PolarHBondContact O-N 2.86Å; E144-S147 WeakPolarHBondContact O-CB 3.29Å; E144-S147 PolarHBondContact O-N 3.1Å; E145-S147 VanDerWaalsContact C-N 3.33Å; E145-S147 PolarHBondContact O-N 3.04Å; S147-R151 WeakPolarHBondContact O-CG 3.28Å; S147-R151 PolarHBondContact O-N 3.1Å
148	R	91.8	Very high	88.7	Confident	132 Å²	132	108 Å²	108	50%	0.498	53%	0.526	S	S	.	.	H	α-helix	trans	-64.3	-50.8	174.2	170.9	169.9	50.7	-144.8	-5.5	111.1	E144 E145 R150 R151 E152	E144-R148 WeakPolarHBondContact O-CB 3.37Å; E144-R148 PolarHBondContact O-N 3.32Å; E145-R148 WeakPolarHBondContact O-CB 3.3Å; E145-R148 PolarHBondContact O-N 3.43Å; E145-R148 IonicContact OE1-CZ 3.68Å; E145-R148 IonicContact OE1-NE 3.91Å; E145-R148 PolarHBondContact OE1-NE 3Å; E145-R148 IonicContact OE1-NH2 2.68Å; E145-R148 PolarHBondContact OE1-NH2 3.05Å; E145-R148 IonicContact OE2-CZ 3.57Å; E145-R148 IonicContact OE2-NH2 3.86Å; E145-R148 PolarHBondContact OE2-NH2 3.32Å; R148-R150 VanDerWaalsContact C-N 3.32Å; R148-R150 PolarHBondContact O-N 2.6Å; R148-R151 PolarHBondContact O-N 3.38Å; R148-E152 PolarHBondContact O-N 3.42Å
149	K	92.5	Very high	88.1	Confident	115 Å²	115	104.6 Å²	104.6	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-59	-41.4	175.8	-75.4	-178.8	178.2	176.6	0	111.8	E145 V146 E152 M153	E145-K149 WeakPolarHBondContact O-CB 3.27Å; E145-K149 WeakPolarHBondContact O-CG 3.4Å; E145-K149 PolarHBondContact O-N 3.08Å; V146-K149 PolarHBondContact O-N 2.64Å; K149-E152 PolarHBondContact O-N 3.38Å; K149-M153 WeakPolarHBondContact O-CB 3.34Å; K149-M153 PolarHBondContact O-N 3.13Å
150	R	90.7	Very high	87.7	Confident	166 Å²	166	106.8 Å²	106.8	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-63.5	-44.6	175.4	-176.3	177.1	173.3	173.6	4.6	112.2	V146 R148 E152 M153 E154	V146-R150 VanDerWaalsContact O-CB 3.29Å; V146-R150 WeakPolarHBondContact O-CB 3.1Å; V146-R150 PolarHBondContact O-N 3.37Å; R148-R150 VanDerWaalsContact C-N 3.32Å; R148-R150 PolarHBondContact O-N 2.6Å; R150-E152 VanDerWaalsContact C-N 3.34Å; R150-E152 PolarHBondContact O-N 3.28Å; R150-M153 PolarHBondContact O-N 3.43Å; R150-E154 HydrophobicContact CG-CG 4.49Å; R150-E154 IonicContact CZ-OE1 3.88Å; R150-E154 IonicContact NE-OE1 2.68Å; R150-E154 PolarHBondContact NE-OE1 3Å; R150-E154 IonicContact NH2-OE1 3.38Å; R150-E154 WeakPolarHBondContact O-CB 3.35Å; R150-E154 WeakPolarHBondContact O-CG 3.4Å; R150-E154 PolarHBondContact O-N 2.98Å
151	R	90.3	Very high	86.9	Confident	178 Å²	178	103.8 Å²	103.8	67%	0.672	52%	0.524	S	S	*	.	H	α-helix	trans	-62.3	-39.8	175.3	-81	-176.7	178.5	131.9	-0.4	112.3	S147 R148 A155	S147-R151 WeakPolarHBondContact O-CG 3.28Å; S147-R151 PolarHBondContact O-N 3.1Å; R148-R151 PolarHBondContact O-N 3.38Å; R151-A155 VanDerWaalsContact O-CB 3.24Å; R151-A155 WeakPolarHBondContact O-CB 3.37Å; R151-A155 PolarHBondContact O-N 2.78Å
152	E	88.9	Confident	86	Confident	111 Å²	111	103.8 Å²	103.8	52%	0.519	53%	0.528	S	S	.	.	H	α-helix	trans	-66.5	-39.4	175	-77.3	-168	163.3	0	0	112.4	R148 K149 R150 A155 R156	R148-E152 PolarHBondContact O-N 3.42Å; K149-E152 PolarHBondContact O-N 3.38Å; R150-E152 VanDerWaalsContact C-N 3.34Å; R150-E152 PolarHBondContact O-N 3.28Å; E152-A155 PolarHBondContact O-N 2.88Å; E152-R156 PolarHBondContact O-N 2.87Å
153	M	86.8	Confident	84.5	Confident	139 Å²	139	103.7 Å²	103.7	69%	0.685	54%	0.538	S	S	*	.	H	α-helix	trans	-66.8	-43.7	176.4	-166.4	-176	-69.7	0	0	111.4	K149 R150 A155 R156 A157	K149-M153 WeakPolarHBondContact O-CB 3.34Å; K149-M153 PolarHBondContact O-N 3.13Å; R150-M153 PolarHBondContact O-N 3.43Å; M153-A155 VanDerWaalsContact C-N 3.35Å; M153-R156 PolarHBondContact O-N 3.33Å; M153-A157 WeakPolarHBondContact O-CB 3.4Å; M153-A157 PolarHBondContact O-N 3.49Å
154	E	89.9	Confident	82.9	Confident	99 Å²	99	108.5 Å²	108.5	46%	0.463	55%	0.55	S	S	.	*	H	α-helix	trans	-63.1	-39.3	173.5	-75.5	175.2	-172.8	0	0	111.4	R150 A157 A158	R150-E154 HydrophobicContact CG-CG 4.49Å; R150-E154 IonicContact CZ-OE1 3.88Å; R150-E154 IonicContact NE-OE1 2.68Å; R150-E154 PolarHBondContact NE-OE1 3Å; R150-E154 IonicContact NH2-OE1 3.38Å; R150-E154 WeakPolarHBondContact O-CB 3.35Å; R150-E154 WeakPolarHBondContact O-CG 3.4Å; R150-E154 PolarHBondContact O-N 2.98Å; E154-A157 PolarHBondContact O-N 2.81Å; E154-A158 VanDerWaalsContact O-CB 3.29Å; E154-A158 WeakPolarHBondContact O-CB 3.32Å; E154-A158 PolarHBondContact O-N 2.9Å
155	A	86.6	Confident	80.9	Confident	64 Å²	64	105.7 Å²	105.7	53%	0.529	56%	0.556	S	S	.	*	H	α-helix	trans	-64.8	-41	174.1	0	0	0	0	0	112.1	R151 E152 M153 A158 A159	R151-A155 VanDerWaalsContact O-CB 3.24Å; R151-A155 WeakPolarHBondContact O-CB 3.37Å; R151-A155 PolarHBondContact O-N 2.78Å; E152-A155 PolarHBondContact O-N 2.88Å; M153-A155 VanDerWaalsContact C-N 3.35Å; A155-A158 PolarHBondContact O-N 2.63Å; A155-A159 VanDerWaalsContact O-CB 3.32Å; A155-A159 WeakPolarHBondContact O-CB 3.16Å; A155-A159 PolarHBondContact O-N 3Å
156	R	86.1	Confident	78.7	Confident	162 Å²	162	113.2 Å²	113.2	61%	0.611	58%	0.581	S	S	*	*	H	α-helix	trans	-64.1	-42.5	172.1	-97.5	-173.7	-169.9	105.8	0.4	111.9	E152 M153 A159 R160	E152-R156 PolarHBondContact O-N 2.87Å; M153-R156 PolarHBondContact O-N 3.33Å; R156-A159 PolarHBondContact O-N 3.06Å; R156-R160 WeakPolarHBondContact O-CG 3.09Å; R156-R160 PolarHBondContact O-N 2.83Å
157	A	83.6	Confident	76.2	Confident	56 Å²	56	120 Å²	120	46%	0.463	60%	0.596	S	S	.	*	H	α-helix	trans	-64.6	-43.2	177.7	0	0	0	0	0	111.2	M153 E154 R160 A161	M153-A157 WeakPolarHBondContact O-CB 3.4Å; M153-A157 PolarHBondContact O-N 3.49Å; E154-A157 PolarHBondContact O-N 2.81Å; A157-R160 PolarHBondContact O-N 3.24Å; A157-A161 WeakPolarHBondContact O-CB 3.46Å; A157-A161 PolarHBondContact O-N 3.26Å
158	A	82.3	Confident	73.6	Confident	50 Å²	50	121.1 Å²	121.1	41%	0.413	62%	0.616	S	S	.	*	H	α-helix	trans	-64	-39.4	174.2	0	0	0	0	0	112	E154 A155 A161 N162	E154-A158 VanDerWaalsContact O-CB 3.29Å; E154-A158 WeakPolarHBondContact O-CB 3.32Å; E154-A158 PolarHBondContact O-N 2.9Å; A155-A158 PolarHBondContact O-N 2.63Å; A158-A161 PolarHBondContact O-N 3.43Å; A158-N162 VanDerWaalsContact O-CB 3.28Å; A158-N162 WeakPolarHBondContact O-CB 3.42Å; A158-N162 VanDerWaalsContact O-CG 3.31Å; A158-N162 PolarHBondContact O-N 3.16Å; A158-N162 PolarHBondContact O-ND2 3.04Å
159	A	79.3	Confident	70.7	Confident	61 Å²	61	120.5 Å²	120.5	50%	0.504	63%	0.631	S	S	.	*	H	α-helix	trans	-63.1	-41.4	173.8	0	0	0	0	0	111.6	A155 R156 A163	A155-A159 VanDerWaalsContact O-CB 3.32Å; A155-A159 WeakPolarHBondContact O-CB 3.16Å; A155-A159 PolarHBondContact O-N 3Å; R156-A159 PolarHBondContact O-N 3.06Å; A159-A163 WeakPolarHBondContact O-CB 3.34Å; A159-A163 PolarHBondContact O-N 3.42Å
160	R	76.7	Confident	67.9	Low	177 Å²	177	119.8 Å²	119.8	67%	0.668	65%	0.647	S	S	*	*	H	α-helix	trans	-66.3	-43.9	174.9	-74.4	177.2	178.9	177.5	-0.1	112.3	R156 A157 A163 Q164	R156-R160 WeakPolarHBondContact O-CG 3.09Å; R156-R160 PolarHBondContact O-N 2.83Å; A157-R160 PolarHBondContact O-N 3.24Å; R160-A163 WeakPolarHBondContact O-CB 3.46Å; R160-A163 PolarHBondContact O-N 3.46Å; R160-Q164 WeakPolarHBondContact O-CG 3.48Å; R160-Q164 PolarHBondContact O-N 3.46Å
161	A	75	Confident	65	Low	58 Å²	58	121 Å²	121	48%	0.479	66%	0.657	S	S	.	*	H	α-helix	trans	-63.6	-41.8	176.5	0	0	0	0	0	111.5	A157 A158 A163 Q164 G165	A157-A161 WeakPolarHBondContact O-CB 3.46Å; A157-A161 PolarHBondContact O-N 3.26Å; A158-A161 PolarHBondContact O-N 3.43Å; A161-A163 VanDerWaalsContact C-N 3.3Å; A161-A163 PolarHBondContact O-N 3.35Å; A161-Q164 PolarHBondContact O-N 2.81Å; A161-G165 PolarHBondContact O-N 3.12Å
162	N	68.6	Low	62.3	Low	127 Å²	127	119.3 Å²	119.3	68%	0.679	67%	0.666	S	S	*	*	H	α-helix	trans	-65.9	-32.4	174.4	-78.2	-25	0	0	0	112.6	A158	A158-N162 VanDerWaalsContact O-CB 3.28Å; A158-N162 WeakPolarHBondContact O-CB 3.42Å; A158-N162 VanDerWaalsContact O-CG 3.31Å; A158-N162 PolarHBondContact O-N 3.16Å; A158-N162 PolarHBondContact O-ND2 3.04Å
163	A	58.1	Low	59.5	Low	76 Å²	76	121 Å²	121	63%	0.628	68%	0.679	S	S	*	*	H	α-helix	trans	-69.2	-35.3	173.4	0	0	0	0	0	112	A159 R160 A161	A159-A163 WeakPolarHBondContact O-CB 3.34Å; A159-A163 PolarHBondContact O-N 3.42Å; R160-A163 WeakPolarHBondContact O-CB 3.46Å; R160-A163 PolarHBondContact O-N 3.46Å; A161-A163 VanDerWaalsContact C-N 3.3Å; A161-A163 PolarHBondContact O-N 3.35Å
164	Q	55.7	Low	57.3	Low	161 Å²	161	119.4 Å²	119.4	75%	0.752	68%	0.679	S	S	*	*	H	α-helix	trans	-82.3	-23.4	179	-70.7	-179.1	-9.6	0	0	113.7	R160 A161 R166	R160-Q164 WeakPolarHBondContact O-CG 3.48Å; R160-Q164 PolarHBondContact O-N 3.46Å; A161-Q164 PolarHBondContact O-N 2.81Å; Q164-R166 PolarHBondContact O-N 2.76Å
165	G	51	Low	54.2	Low	67 Å²	67	122.2 Å²	122.2	69%	0.691	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	1.4	176.9	0	0	0	0	0	115.6	A161	A161-G165 PolarHBondContact O-N 3.12Å
166	R	41.6	Very low	51.4	Low	230 Å²	230	125.6 Å²	125.6	87%	0.868	70%	0.704	S	S	*	*			trans	-115.3	55.7	175.9	-76.4	-170.5	178.9	-158.7	0.4	112.6	Q164	Q164-R166 PolarHBondContact O-N 2.76Å
167	R	35.8	Very low	48.3	Very low	239 Å²	239	124.1 Å²	124.1	90%	0.902	71%	0.713	S	S	*	*	S	Bend	trans	-130.7	111.8	153.6	-76.3	-169	178.5	-169.6	-0.3	108.9
168	G	35.3	Very low	45.6	Very low	76 Å²	76	129.2 Å²	129.2	78%	0.784	73%	0.727	S	S	*	*			trans	-68	138.2	-175.5	0	0	0	0	0	112.8
169	S	30.8	Very low	42.7	Very low	118 Å²	118	133.7 Å²	133.7	83%	0.825	74%	0.739	S	S	*	*			trans	13.6	111.1	142.9	-155.1	0	0	0	0	117.7
170	A	33	Very low	40.2	Very low	100 Å²	100	138.5 Å²	138.5	83%	0.826	75%	0.749	S	S	*	*			trans	-137.6	114.2	146.3	0	0	0	0	0	107.6
171	K	30.3	Very low	37.6	Very low	192 Å²	192	137.7 Å²	137.7	84%	0.835	75%	0.753	S	S	*	*			trans	-60.4	147.3	168.3	-67.7	172.2	171.5	179.2	0	109.3
172	V	32.1	Very low	35.2	Very low	142 Å²	142	141 Å²	141	86%	0.861	77%	0.768	S	S	*	*			trans	167	144.9	130.7	161.4	0	0	0	0	108.5
173	D	30.5	Very low	33.3	Very low	148 Å²	148	140.3 Å²	140.3	79%	0.791	77%	0.77	S	S	*	*			trans	-60.4	160.1	-154.7	-74.4	-58.7	0	0	0	119.5
174	P	40.8	Very low	31.6	Very low	105 Å²	105	142.8 Å²	142.8	68%	0.682	78%	0.777	S	S	*	*			trans	-88.4	141.1	-179.8	35.3	-30.1	0	0	0	111.2
175	L	25.7	Very low	30.1	Very low	158 Å²	158	142.3 Å²	142.3	83%	0.827	78%	0.779	S	S	*	*			trans	177.8	132.3	143.9	-95.8	142.9	0	0	0	111.9
176	I	26.8	Very low	28.8	Very low	134 Å²	134	143.4 Å²	143.4	69%	0.687	78%	0.776	S	S	*	*			trans	79.6	94.3	146.2	-57.7	168.2	0	0	0	118.3
177	T	22.4	Very low	28	Very low	131 Å²	131	139.5 Å²	139.5	80%	0.804	77%	0.773	S	S	*	*			trans	-15.5	120	130.4	-32.4	0	0	0	0	115.2
178	H	26.3	Very low	27.4	Very low	163 Å²	163	132.3 Å²	132.3	76%	0.755	76%	0.759	S	S	*	*			trans	-158.3	136.8	136.9	-112.5	-79.4	0	0	0	111.7
179	Q	21.8	Very low	26.9	Very low	145 Å²	145	135.1 Å²	135.1	68%	0.678	76%	0.756	S	S	*	*			trans	-49.8	148.7	168.3	-65	155.6	-30.4	0	0	111.6
180	F	25.4	Very low	26.5	Very low	161 Å²	161	136.3 Å²	136.3	71%	0.706	75%	0.753	S	S	*	*				167.6	122.8	117.7	-88.8	-70.4	0	0	0	111
181	Q	23.1	Very low	26.1	Very low	161 Å²	161	135.9 Å²	135.9	75%	0.752	74%	0.743	S	S	*	*			trans	37.8	121.9	137.7	-70.6	170.6	-18.9	0	0	121.1
182	T	23.3	Very low	25.6	Very low	128 Å²	128	132.1 Å²	132.1	79%	0.785	74%	0.74	S	S	*	*			trans	6.8	133.6	135.1	52.9	0	0	0	0	116.9
183	P	29.9	Very low	25.2	Very low	112 Å²	112	134.2 Å²	134.2	73%	0.727	74%	0.741	S	S	*	*				-151.3	154.4	73.6	32.7	-10.9	0	0	0	117.4
184	V	22	Very low	24.8	Very low	127 Å²	127	132.8 Å²	132.8	77%	0.77	74%	0.742	S	S	*	*			trans	20.5	117.5	136	-146.4	0	0	0	0	117.8
185	N	25	Very low	23.8	Very low	152 Å²	152	131.5 Å²	131.5	81%	0.813	75%	0.748	S	S	*	*				-167.5	132.3	123.7	-97.6	-8.5	0	0	0	111.8
186	S	22.5	Very low	23.7	Very low	89 Å²	89	129.7 Å²	129.7	62%	0.622	75%	0.748	S	S	*	*			trans	-47.6	145.7	155.7	47	0	0	0	0	111.6
187	D	26.2	Very low	23.4	Very low	148 Å²	148	132 Å²	132	79%	0.791	76%	0.756	S	S	*	*				-173.1	126.9	117.1	-85.2	-17.7	0	0	0	111
188	S	22.6	Very low	23.5	Very low	89 Å²	89	136.9 Å²	136.9	62%	0.622	76%	0.76	S	S	*	*			trans	-37.6	139.7	154.4	48.4	0	0	0	0	113.2
189	N	23.5	Very low	23.2	Very low	134 Å²	134	137.7 Å²	137.7	72%	0.717	76%	0.764	S	S	*	*				167.5	137.9	107.2	-95.9	-37	0	0	0	114.4
190	L	23.8	Very low	23.4	Very low	144 Å²	144	140.3 Å²	140.3	75%	0.754	77%	0.774	S	S	*	*			trans	78.2	113.4	135	-70	162.7	0	0	0	121.2
191	S	23.2	Very low	23.3	Very low	90 Å²	90	138.1 Å²	138.1	63%	0.629	78%	0.778	S	S	*	*				78.2	105.7	119.7	74.9	0	0	0	0	119.3
192	C	20	Very low	23.2	Very low	113 Å²	113	137.7 Å²	137.7	76%	0.764	78%	0.781	S	S	*	*				7	123.6	129.1	52.1	0	0	0	0	118
193	Q	25.4	Very low	23.4	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.874	79%	0.788	S	S	*	*			trans	-162.6	108	133.9	-106.2	170.3	45.5	0	0	111.3
194	S	20.5	Very low	23.1	Very low	117 Å²	117	145.1 Å²	145.1	82%	0.818	79%	0.791	S	S	*	*			trans	26.2	125.8	131.4	10.8	0	0	0	0	120.4
195	G	20.4	Very low	23.4	Very low	79 Å²	79	148.7 Å²	148.7	81%	0.814	80%	0.796	S	S	*	*			trans	119.4	106.5	135.7	0	0	0	0	0	116.7
196	S	24.4	Very low	23.3	Very low	119 Å²	119	152.5 Å²	152.5	83%	0.832	80%	0.8	S	S	*	*				175.3	135.9	103.4	75.3	0	0	0	0	111.1
197	Q	19.8	Very low	23.6	Very low	183 Å²	183	157 Å²	157	86%	0.855	81%	0.811	S	S	*	*			trans	-50.5	140	169.8	-67.8	169.7	-34.7	0	0	112
198	R	24.9	Very low	23.5	Very low	234 Å²	234	157.5 Å²	157.5	88%	0.883	81%	0.814	S	S	*	*			trans	-149	105.5	147.9	-104.9	176.3	-170.8	-173.3	2	110.9
199	E	18.9	Very low	23.5	Very low	180 Å²	180	164.3 Å²	164.3	84%	0.841	83%	0.827	S	S	*	*			trans	-58.4	135.9	166.1	-59.4	171	142.7	0	0	110.9
200	F	26.5	Very low	23.6	Very low	199 Å²	199	162.7 Å²	162.7	87%	0.873	83%	0.832	S	S	*	*			trans	-148	103.6	153.9	-100	-75.3	0	0	0	112
201	S	23.8	Very low	23.8	Very low	115 Å²	115	161.1 Å²	161.1	80%	0.804	84%	0.84	S	S	*	*			trans	-2.8	124.4	157.3	-72.7	0	0	0	0	121.2
202	N	21.6	Very low	23.9	Very low	152 Å²	152	165.5 Å²	165.5	81%	0.813	86%	0.855	S	S	*	*			trans	-9.3	129.3	141.9	-83	-29.3	0	0	0	118.9
203	R	26.3	Very low	24.2	Very low	248 Å²	248	164.9 Å²	164.9	94%	0.936	86%	0.859	S	S	*	*			trans	-135.9	98.4	151.3	-128.3	179.2	-174.2	-173.6	2.5	111
204	N	24	Very low	24.3	Very low	148 Å²	148	159.8 Å²	159.8	79%	0.791	86%	0.856	S	S	*	*			trans	-58.1	128.4	170.1	-82.3	-32.2	0	0	0	112.1
205	K	27.8	Very low	24.5	Very low	202 Å²	202	164.8 Å²	164.8	88%	0.878	86%	0.863	S	S	*	*			trans	-130.1	101.1	159.4	-108	-178.6	177.1	-178.6	0	109.5
206	R	23.4	Very low	24.9	Very low	233 Å²	233	172.4 Å²	172.4	88%	0.879	87%	0.868	S	S	*	*			trans	-66.2	127.5	165.2	-71.7	174.9	168.7	175.3	-4.8	109.3
207	Q	28.1	Very low	25	Very low	183 Å²	183	175.5 Å²	175.5	86%	0.855	87%	0.869	S	S	*	*			trans	-136.4	123.3	155.6	-80.7	-175	-29.6	0	0	109.2
208	N	25.3	Very low	25.3	Very low	159 Å²	159	173.3 Å²	173.3	85%	0.85	87%	0.867	S	S	*	*			trans	-77.8	142.7	-170.7	-75.5	-24.8	0	0	0	112.2
209	Y	21.7	Very low	25.4	Very low	232 Å²	232	167.8 Å²	167.8	91%	0.91	87%	0.865	S	S	*	*			trans	-74.2	142.7	173.9	-68	-94.6	0	0	0	111.9
210	A	26.4	Very low	25.7	Very low	100 Å²	100	166.5 Å²	166.5	83%	0.826	86%	0.864	S	S	*	*			trans	-114.9	126.8	162.6	0	0	0	0	0	108.6
211	A	26.8	Very low	25.7	Very low	110 Å²	110	162 Å²	162	91%	0.909	86%	0.857	S	S	*	*			trans	-74.6	135	-173.6	0	0	0	0	0	112.4
212	L	26.9	Very low	26	Very low	182 Å²	182	164.4 Å²	164.4	95%	0.953	86%	0.861	S	S	*	*			trans	-99.2	122.4	170.1	-94.3	150.8	0	0	0	108.9
213	A	25.8	Very low	26.5	Very low	101 Å²	101	164.7 Å²	164.7	84%	0.835	86%	0.862	S	S	*	*			trans	-121.9	138.2	169.8	0	0	0	0	0	108.2
214	G	28.1	Very low	26.6	Very low	79 Å²	79	161 Å²	161	81%	0.814	86%	0.861	S	S	*	*			trans	129.2	85.6	166	0	0	0	0	0	114.4
215	F	24.2	Very low	26.8	Very low	223 Å²	223	158 Å²	158	98%	0.978	85%	0.851	S	S	*	*			trans	-59.5	129.8	159	-97.2	-103.4	0	0	0	110.3
216	R	28.1	Very low	27	Very low	239 Å²	239	156.3 Å²	156.3	90%	0.902	85%	0.846	S	S	*	*			trans	-149.1	143.3	152.9	-153.7	175.4	-177.5	-174.5	-1.3	109.5
217	E	26.2	Very low	27.4	Very low	184 Å²	184	153.9 Å²	153.9	86%	0.86	85%	0.85	S	S	*	*			trans	-55	143.8	-163.2	-67.6	159.9	150.7	0	0	115.5
218	V	26.7	Very low	27.6	Very low	136 Å²	136	152.2 Å²	152.2	82%	0.824	85%	0.847	S	S	*	*			trans	-72.8	123.7	-176.3	-176.5	0	0	0	0	109.5
219	S	26.8	Very low	27.7	Very low	118 Å²	118	152 Å²	152	83%	0.825	85%	0.845	S	S	*	*			trans	-109.7	133.1	159.1	-73.2	0	0	0	0	107.9
220	D	25.1	Very low	28.3	Very low	153 Å²	153	150.5 Å²	150.5	82%	0.818	84%	0.844	S	S	*	*			trans	-60.4	128.2	-175.9	-63.3	-49.8	0	0	0	113
221	S	26.7	Very low	28.2	Very low	105 Å²	105	149.2 Å²	149.2	73%	0.734	84%	0.841	S	S	*	*			trans	165.3	106.7	130.9	58.9	0	0	0	0	109.2
222	D	30.6	Very low	28.4	Very low	165 Å²	165	148.7 Å²	148.7	88%	0.882	84%	0.836	S	S	*	*			trans	-141	99.3	161.9	-86.9	-37.8	0	0	0	108.3
223	D	31.5	Very low	28.3	Very low	159 Å²	159	144.1 Å²	144.1	85%	0.85	83%	0.833	S	S	*	*			trans	-77.3	119.6	173.5	-93.8	-38.3	0	0	0	109.6
224	L	29.6	Very low	28.3	Very low	171 Å²	171	150.8 Å²	150.8	90%	0.895	84%	0.836	S	S	*	*			trans	-112.5	97.3	175.1	-95.4	157.8	0	0	0	109.3
225	S	27.7	Very low	28.1	Very low	85 Å²	85	153 Å²	153	59%	0.594	84%	0.839	S	S	*	*			trans	-153	111.7	160.6	61.7	0	0	0	0	110.2
226	E	31	Very low	28.3	Very low	165 Å²	165	145.9 Å²	145.9	77%	0.771	83%	0.828	S	S	*	*			trans	-176.5	96.1	153.9	-108.2	174.2	-173.1	0	0	108
227	L	33	Very low	28.2	Very low	183 Å²	183	144 Å²	144	96%	0.958	83%	0.827	S	S	*	*			trans	-126.4	115.4	156.8	-84.1	176.1	0	0	0	107.9
228	D	32.4	Very low	28	Very low	147 Å²	147	142.2 Å²	142.2	79%	0.786	82%	0.823	S	S	*	*			trans	-63.5	135.5	-166.6	-77.5	-51.6	0	0	0	114.2
229	D	27.3	Very low	28	Very low	155 Å²	155	144.4 Å²	144.4	83%	0.829	82%	0.824	S	S	*	*			trans	-63.9	121.4	162	-156.7	-4.2	0	0	0	110.2
230	K	33	Very low	27.7	Very low	200 Å²	200	147.5 Å²	147.5	87%	0.87	83%	0.825	S	S	*	*			trans	-125.4	93.7	164.3	-83.3	-161	175.6	-175.6	0	109.4
231	G	25.4	Very low	27.7	Very low	74 Å²	74	144.5 Å²	144.5	76%	0.763	82%	0.817	S	S	*	*			trans	-58.7	135.9	169.8	0	0	0	0	0	113.3
232	A	30.7	Very low	27.7	Very low	99 Å²	99	146.8 Å²	146.8	82%	0.818	82%	0.821	S	S	*	*			trans	-130.7	102	152.4	0	0	0	0	0	106.2
233	G	24.4	Very low	27.3	Very low	85 Å²	85	149.9 Å²	149.9	88%	0.876	82%	0.821	S	S	*	*			trans	-62.7	134.6	-179.6	0	0	0	0	0	111.8
234	R	26	Very low	27.3	Very low	242 Å²	242	148.3 Å²	148.3	91%	0.913	82%	0.82	S	S	*	*			trans	-144.6	96.3	154.2	-158.6	174.2	-176.6	-157.6	-0.9	108.9	G236	R234-G236 PolarHBondContact O-N 2.88Å
235	S	23.7	Very low	27.3	Very low	126 Å²	126	151.5 Å²	151.5	88%	0.881	82%	0.82	S	S	*	*			trans	-58.6	115.5	164.1	55.8	0	0	0	0	109.3
236	G	29.2	Very low	27.3	Very low	72 Å²	72	152 Å²	152	74%	0.742	82%	0.823	S	S	*	*			trans	-138.5	104	172.2	0	0	0	0	0	107.8	R234	R234-G236 PolarHBondContact O-N 2.88Å
237	F	25	Very low	27.2	Very low	201 Å²	201	151.8 Å²	151.8	88%	0.882	83%	0.827	S	S	*	*			trans	-62.1	144.8	-173.7	-174.1	-99.4	0	0	0	112.5
238	L	22.7	Very low	26.9	Very low	145 Å²	145	148.7 Å²	148.7	76%	0.759	81%	0.811	S	S	*	*			trans	-43.6	130.1	174.3	-77.5	146.1	0	0	0	113.5
239	Q	26.1	Very low	26.7	Very low	183 Å²	183	148.8 Å²	148.8	86%	0.855	81%	0.812	S	S	*	*			trans	-142.3	104.9	147.4	-167.8	159.3	23.8	0	0	108.9
240	E	21.3	Very low	26.9	Very low	182 Å²	182	149 Å²	149	85%	0.85	81%	0.811	S	S	*	*			trans	-57.2	130.2	158.3	-70.8	167.3	133.5	0	0	109.3
241	S	25.6	Very low	26.8	Very low	91 Å²	91	147 Å²	147	64%	0.636	80%	0.804	S	S	*	*			trans	-175.3	119.5	136.8	54.6	0	0	0	0	110.7
242	D	26.4	Very low	26.8	Very low	153 Å²	153	152.2 Å²	152.2	82%	0.818	81%	0.809	S	S	*	*			trans	71.2	108	141.1	-56.1	-30.8	0	0	0	121
243	Y	22.3	Very low	26.7	Very low	230 Å²	230	155.7 Å²	155.7	90%	0.902	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-47.8	124	161	-80.6	-99	0	0	0	112.7
244	P	31.3	Very low	26.9	Very low	125 Å²	125	158.3 Å²	158.3	81%	0.812	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-84.4	124.2	162.3	28.9	-21	0	0	0	109.8
245	R	28.5	Very low	27.2	Very low	238 Å²	238	156.5 Å²	156.5	90%	0.898	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-63.1	152.3	174	-71.9	177.4	170.3	-166.3	-4.9	112.7
246	S	28.4	Very low	27.5	Very low	95 Å²	95	157.9 Å²	157.9	66%	0.664	80%	0.797	S	S	*	*			trans	32.5	103	144.7	-125.8	0	0	0	0	116.3	D248	S246-D248 VanDerWaalsContact C-N 3.29Å; S246-D248 PolarHBondContact O-N 3.47Å; S246-D248 PolarHBondContact OG-OD2 3.35Å
247	L	29.1	Very low	27.5	Very low	162 Å²	162	161.1 Å²	161.1	85%	0.848	80%	0.797	S	S	*	*			trans	-87.7	76.2	161.4	-168.7	79.6	0	0	0	107.6
248	D	26	Very low	27.8	Very low	118 Å²	118	162.9 Å²	162.9	63%	0.631	80%	0.799	S	S	*	*			trans	-93.8	151	158.6	-68.2	-59.9	0	0	0	108	S246	S246-D248 VanDerWaalsContact C-N 3.29Å; S246-D248 PolarHBondContact O-N 3.47Å; S246-D248 PolarHBondContact OG-OD2 3.35Å
249	D	28.1	Very low	28	Very low	149 Å²	149	164.6 Å²	164.6	80%	0.797	80%	0.803	S	S	*	*			trans	80.1	73.6	177.1	-53.6	-25.7	0	0	0	117.1
250	I	32.3	Very low	28.2	Very low	158 Å²	158	164.6 Å²	164.6	81%	0.81	80%	0.804	S	S	*	*			trans	-100.8	101.1	145.1	-61.7	-178.9	0	0	0	107.7
251	H	30	Very low	28.6	Very low	159 Å²	159	161.6 Å²	161.6	74%	0.736	80%	0.8	S	S	*	*			trans	-46.9	133.8	176.1	-120.2	80	0	0	0	113.7	Q253	H251-Q253 PolarHBondContact O-N 3.4Å
252	E	26.9	Very low	28.7	Very low	183 Å²	183	162.1 Å²	162.1	86%	0.855	81%	0.809	S	S	*	*			trans	-46.8	124.6	157.7	-64.7	169.6	151.4	0	0	110.7
253	Q	27.4	Very low	28.7	Very low	172 Å²	172	160.5 Å²	160.5	80%	0.804	81%	0.81	S	S	*	*			trans	-131	101.2	163.9	-76.5	-171	-10.8	0	0	109.2	H251	H251-Q253 PolarHBondContact O-N 3.4Å
254	N	28.4	Very low	29.2	Very low	141 Å²	141	154.4 Å²	154.4	75%	0.754	80%	0.799	S	S	*	*			trans	37.8	87.5	141.1	-58.5	-9.8	0	0	0	117.1
255	E	31.6	Very low	29.2	Very low	203 Å²	203	157 Å²	157	95%	0.949	80%	0.797	S	S	*	*			trans	-88.1	95	151.3	-69.4	-157.5	155	0	0	108.6
256	E	30.2	Very low	29.2	Very low	156 Å²	156	157.9 Å²	157.9	73%	0.729	80%	0.801	S	S	*	*			trans	-80.4	128.6	167.8	-72.5	179.3	163.3	0	0	110.1
257	D	30.1	Very low	29.3	Very low	140 Å²	140	160.9 Å²	160.9	75%	0.749	80%	0.804	S	S	*	*			trans	47.8	82.3	145.8	-61.9	-21.4	0	0	0	119.1
258	Y	31	Very low	29.5	Very low	237 Å²	237	157.3 Å²	157.3	93%	0.929	79%	0.793	S	S	*	*			trans	-108.2	92.2	149.4	-86	-85.5	0	0	0	110.3	E260	Y258-E260 PolarHBondContact O-N 3.07Å
259	Q	28	Very low	30	Very low	181 Å²	181	156.9 Å²	156.9	85%	0.846	80%	0.795	S	S	*	*			trans	-87.2	96.2	175.3	-152.2	141.4	22.8	0	0	109.1
260	E	28.5	Very low	30.3	Very low	184 Å²	184	155.5 Å²	155.5	86%	0.86	79%	0.787	S	S	*	*			trans	-72.9	140.5	172.2	-115.5	-172	154.7	0	0	110.8	Y258	Y258-E260 PolarHBondContact O-N 3.07Å
261	P	31.1	Very low	30.7	Very low	119 Å²	119	155.2 Å²	155.2	77%	0.773	79%	0.787	S	S	*	*			trans	-81.8	134.7	-162.5	31.7	-32.1	0	0	0	112.6	S263	P261-S263 PolarHBondContact O-N 2.98Å
262	A	26.3	Very low	30.8	Very low	101 Å²	101	155.4 Å²	155.4	84%	0.835	79%	0.79	S	S	*	*			trans	-49.6	113.8	173.3	0	0	0	0	0	112.9
263	S	26.6	Very low	31	Very low	119 Å²	119	153.1 Å²	153.1	83%	0.832	78%	0.783	S	S	*	*			trans	-81.5	128.7	161.8	-176.3	0	0	0	0	109.1	P261	P261-S263 PolarHBondContact O-N 2.98Å
264	P	33.7	Very low	31.2	Very low	102 Å²	102	150.2 Å²	150.2	66%	0.662	78%	0.779	S	S	*	*			trans	-94.8	154.3	-162.9	38.9	-37	0	0	0	113.3
265	F	30.4	Very low	31.5	Very low	179 Å²	179	149.1 Å²	149.1	79%	0.785	78%	0.779	S	S	*	*			trans	65.7	84.8	165	-80.4	-88	0	0	0	118	Q267	F265-Q267 HydrophobicContact CD1-CG 4.46Å; F265-Q267 PolarHBondContact O-N 3.46Å
266	R	29.5	Very low	31.4	Very low	257 Å²	257	145 Å²	145	97%	0.97	77%	0.77	S	S	*	*			trans	-79.8	94.8	145.3	-89.9	-175.3	171.9	174.3	-2.3	108
267	Q	29.4	Very low	31.3	Very low	158 Å²	158	143.6 Å²	143.6	74%	0.738	77%	0.774	S	S	*	*			trans	-88.3	124.1	160.8	-109.2	172.1	-12.6	0	0	108	F265 V269	F265-Q267 HydrophobicContact CD1-CG 4.46Å; F265-Q267 PolarHBondContact O-N 3.46Å; Q267-V269 PolarHBondContact O-N 2.95Å
268	S	33	Very low	31.3	Very low	88 Å²	88	141.9 Å²	141.9	62%	0.615	77%	0.773	S	S	*	*			trans	-58.3	117.2	-179.6	-177.5	0	0	0	0	110.8	L270	S268-L270 PolarHBondContact O-N 3.27Å; S268-L270 WeakPolarHBondContact OG-CB 3.09Å; S268-L270 PolarHBondContact OG-N 3.3Å
269	V	36.9	Very low	31.3	Very low	109 Å²	109	136.1 Å²	136.1	66%	0.661	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-77.4	-2.8	174.2	172.3	0	0	0	0	111.3	Q267 D271 M272	Q267-V269 PolarHBondContact O-N 2.95Å; V269-D271 PolarHBondContact O-N 3.19Å; V269-M272 PolarHBondContact O-N 2.9Å
270	L	35.3	Very low	31.3	Very low	120 Å²	120	133.9 Å²	133.9	63%	0.628	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-64.6	-25.2	-178.2	-159.4	64.4	0	0	0	112.9	S268 M272	S268-L270 PolarHBondContact O-N 3.27Å; S268-L270 WeakPolarHBondContact OG-CB 3.09Å; S268-L270 PolarHBondContact OG-N 3.3Å; L270-M272 VanDerWaalsContact C-N 3.3Å; L270-M272 PolarHBondContact O-N 3.36Å
271	D	39.4	Very low	31.3	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	76%	0.757	S	S	*	*	G	3₁₀ helix	trans	-78.3	-5.8	178.2	-81.1	-19.3	0	0	0	115	V269	V269-D271 PolarHBondContact O-N 3.19Å
272	M	33	Very low	31.3	Very low	163 Å²	163	132 Å²	132	80%	0.803	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-109	8.4	-175.2	-75.7	-73.7	174.9	0	0	114.7	V269 L270	V269-M272 PolarHBondContact O-N 2.9Å; L270-M272 VanDerWaalsContact C-N 3.3Å; L270-M272 PolarHBondContact O-N 3.36Å
273	L	30.8	Very low	31.3	Very low	135 Å²	135	132.1 Å²	132.1	71%	0.707	75%	0.753	S	S	*	*			trans	-106.4	112.9	178.4	-69.2	172.1	0	0	0	111.3
274	P	31.6	Very low	31.5	Very low	111 Å²	111	134.2 Å²	134.2	72%	0.721	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-67.9	146.6	177.2	26.5	-31.5	0	0	0	111.3
275	P	34	Very low	31.2	Very low	117 Å²	117	135 Å²	135	76%	0.76	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-63.8	149.3	-174	24.7	-33.5	0	0	0	112.4
276	P	30	Very low	31.1	Very low	116 Å²	116	135.3 Å²	135.3	75%	0.753	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.7	140.7	-171.9	23.7	-33	0	0	0	111.9	S278	P276-S278 PolarHBondContact O-N 3.27Å
277	P	29.1	Very low	30.9	Very low	127 Å²	127	131.7 Å²	131.7	83%	0.825	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-65.7	120.7	-175.6	25.4	-32.2	0	0	0	110.7
278	S	30.4	Very low	30.8	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-57.7	138.5	174.3	-50	0	0	0	0	110.8	P276 V280	P276-S278 PolarHBondContact O-N 3.27Å; S278-V280 PolarHBondContact O-N 2.97Å
279	P	29.9	Very low	30.3	Very low	116 Å²	116	138.4 Å²	138.4	75%	0.753	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-66.1	120.2	-173.8	25.4	-31.7	0	0	0	110.2	I281	P279-I281 PolarHBondContact O-N 2.72Å
280	V	28.8	Very low	29.8	Very low	134 Å²	134	137.7 Å²	137.7	81%	0.812	78%	0.779	S	S	*	*			trans	-64.7	101.3	172	178.2	0	0	0	0	107.8	S278 P282	S278-V280 PolarHBondContact O-N 2.97Å; V280-P282 VanDerWaalsContact O-CD 3.22Å; V280-P282 WeakPolarHBondContact O-CD 3.49Å
281	I	28.8	Very low	29.2	Very low	143 Å²	143	140.2 Å²	140.2	73%	0.733	79%	0.793	S	S	*	*			trans	-67.1	112.9	168.6	-60.4	168.2	0	0	0	106.7	P279 S283	P279-I281 PolarHBondContact O-N 2.72Å; I281-S283 PolarHBondContact O-N 3.46Å
282	P	29.2	Very low	28.6	Very low	121 Å²	121	140.9 Å²	140.9	79%	0.786	80%	0.795	S	S	*	*			trans	-72.6	99.5	177.3	-5	22.4	0	0	0	107.7	V280 N284	V280-P282 VanDerWaalsContact O-CD 3.22Å; V280-P282 WeakPolarHBondContact O-CD 3.49Å; P282-N284 PolarHBondContact O-N 3.17Å
283	S	27.4	Very low	28	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	80%	0.797	S	S	*	*			trans	-75.7	98	165.7	23.5	0	0	0	0	107.2	I281	I281-S283 PolarHBondContact O-N 3.46Å
284	N	30.6	Very low	27.5	Very low	163 Å²	163	142 Å²	142	87%	0.872	81%	0.805	S	S	*	*			trans	-164.5	88.3	149.8	-89.3	-22	0	0	0	108.3	P282 E286	P282-N284 PolarHBondContact O-N 3.17Å; N284-E286 PolarHBondContact O-N 2.84Å
285	S	27	Very low	27	Very low	118 Å²	118	145 Å²	145	83%	0.825	81%	0.81	S	S	*	*			trans	-71.1	102.1	164.9	51.1	0	0	0	0	109.2
286	E	29.2	Very low	26.5	Very low	186 Å²	186	145 Å²	145	87%	0.869	81%	0.812	S	S	*	*			trans	-119.2	120.8	150.3	-72.6	-157.6	156.9	0	0	108.7	N284 E288	N284-E286 PolarHBondContact O-N 2.84Å; E286-E288 PolarHBondContact O-N 2.76Å
287	E	25.5	Very low	26.2	Very low	181 Å²	181	147.7 Å²	147.7	85%	0.846	82%	0.819	S	S	*	*			trans	-67.7	105.1	-176.3	-60.8	178.3	143.4	0	0	110.5
288	E	25.6	Very low	25.9	Very low	181 Å²	181	146.8 Å²	146.8	85%	0.846	82%	0.816	S	S	*	*			trans	-118.2	95.9	159.4	-78.2	-162.3	154.9	0	0	110.7	E286 S290	E286-E288 PolarHBondContact O-N 2.76Å; E288-S290 PolarHBondContact O-N 2.99Å
289	K	23.6	Very low	25.7	Very low	207 Å²	207	149 Å²	149	90%	0.9	83%	0.825	S	S	*	*			trans	-57.1	102.5	165.3	-71.8	173	177.6	169.1	0	109.5
290	S	26.1	Very low	25.6	Very low	94 Å²	94	147.9 Å²	147.9	66%	0.657	83%	0.826	S	S	*	*			trans	-122.2	106.8	163.5	57.1	0	0	0	0	110.4	E288 L292	E288-S290 PolarHBondContact O-N 2.99Å; S290-L292 PolarHBondContact O-N 3.31Å
291	N	23.6	Very low	25.7	Very low	172 Å²	172	145.6 Å²	145.6	92%	0.92	82%	0.816	S	S	*	*			trans	-60.5	96.6	168.1	-81.4	-32.7	0	0	0	109.2	K293	N291-K293 PolarHBondContact O-N 3.2Å
292	L	25.6	Very low	25.9	Very low	166 Å²	166	143.9 Å²	143.9	87%	0.869	82%	0.816	S	S	*	*			trans	-79.2	91.4	171	-85.3	152.8	0	0	0	109.4	S290	S290-L292 PolarHBondContact O-N 3.31Å
293	K	20.8	Very low	26.1	Very low	192 Å²	192	144.1 Å²	144.1	84%	0.835	81%	0.811	S	S	*	*			trans	-67.5	132.2	166.9	-145.3	175.5	-174.5	-178.7	0	108.4	N291 E295	N291-K293 PolarHBondContact O-N 3.2Å; K293-E295 PolarHBondContact O-N 2.91Å
294	C	20.2	Very low	26.8	Very low	130 Å²	130	145.1 Å²	145.1	88%	0.878	81%	0.808	S	S	*	*			trans	-62.1	111.5	-178.8	-157.1	0	0	0	0	111.1
295	E	21.9	Very low	27.1	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	80%	0.795	S	S	*	*			trans	-118	99.4	166.1	-79.9	-172.3	170.4	0	0	109.6	K293 L297	K293-E295 PolarHBondContact O-N 2.91Å; E295-L297 PolarHBondContact O-N 3.14Å
296	S	22.5	Very low	27.5	Very low	117 Å²	117	143.4 Å²	143.4	82%	0.818	79%	0.789	S	S	*	*			trans	27.7	74.6	137.1	-45.3	0	0	0	0	118.1	S298	S296-S298 PolarHBondContact O-N 3.03Å
297	L	24.6	Very low	27.8	Very low	172 Å²	172	136.1 Å²	136.1	90%	0.901	76%	0.761	S	S	*	*			trans	-85.7	108	162.4	-73.4	171.2	0	0	0	110	E295	E295-L297 PolarHBondContact O-N 3.14Å
298	S	22.9	Very low	28.3	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	74%	0.737	S	S	*	*			trans	-64.2	130.6	173.9	52.3	0	0	0	0	111.7	S296 A300	S296-S298 PolarHBondContact O-N 3.03Å; S298-A300 PolarHBondContact O-N 2.93Å
299	V	26.2	Very low	28.8	Very low	150 Å²	150	132.1 Å²	132.1	91%	0.909	74%	0.735	S	S	*	*			trans	-53.2	120.2	176.9	-178.7	0	0	0	0	111.5
300	A	28	Very low	29.2	Very low	93 Å²	93	126.6 Å²	126.6	77%	0.769	72%	0.719	S	S	*	*			trans	-133	106.1	172.1	0	0	0	0	0	111.9	S298	S298-A300 PolarHBondContact O-N 2.93Å
301	S	29.4	Very low	29.6	Very low	86 Å²	86	124.5 Å²	124.5	60%	0.601	70%	0.702	S	S	*	*			trans	68.5	78.7	141.3	-165.4	0	0	0	0	121.7	N303	S301-N303 VanDerWaalsContact C-N 3.33Å; S301-N303 PolarHBondContact O-N 3.35Å
302	S	32.9	Very low	30.3	Very low	107 Å²	107	118.8 Å²	118.8	75%	0.748	67%	0.673	S	S	*	*				27.6	17.7	120.7	60.1	0	0	0	0	125.4
303	N	34.5	Very low	30.9	Very low	125 Å²	125	115.9 Å²	115.9	67%	0.668	66%	0.662	S	S	*	*			trans	-99	7	173.5	-90.1	-3.1	0	0	0	115.7	S301 L305 A307	S301-N303 VanDerWaalsContact C-N 3.33Å; S301-N303 PolarHBondContact O-N 3.35Å; N303-L305 PolarHBondContact O-N 3.32Å; N303-A307 PolarHBondContact O-N 3.17Å
304	D	42.1	Very low	31.6	Very low	124 Å²	124	112.7 Å²	112.7	66%	0.663	66%	0.655	S	S	*	*	H	α-helix	trans	-78.6	-10.2	-171	-69.4	-27.5	0	0	0	115.8	L308	D304-L308 PolarHBondContact O-N 3.15Å
305	L	37.7	Very low	32.7	Very low	114 Å²	114	108 Å²	108	60%	0.597	63%	0.625	S	S	*	*	H	α-helix	trans	-81.2	-35.6	179.5	-136.7	88	0	0	0	113.4	N303 A307 L308 R309	N303-L305 PolarHBondContact O-N 3.32Å; L305-A307 VanDerWaalsContact C-N 3.34Å; L305-L308 VanDerWaalsContact O-CB 3.3Å; L305-L308 WeakPolarHBondContact O-CB 2.97Å; L305-L308 PolarHBondContact O-N 2.89Å; L305-R309 PolarHBondContact O-N 2.97Å; L305-R309 VanDerWaalsContact O-N 3.16Å
306	N	34.5	Very low	33.9	Very low	131 Å²	131	103.6 Å²	103.6	70%	0.701	61%	0.613	S	S	*	*	H	α-helix	trans	-76.1	-27.7	169.7	-81.4	-22.1	0	0	0	111.3	L308 R309 T310	N306-L308 VanDerWaalsContact C-N 3.3Å; N306-R309 PolarHBondContact O-N 3.11Å; N306-T310 PolarHBondContact O-N 3.46Å; N306-T310 PolarHBondContact O-OG1 3.27Å
307	A	35.2	Very low	35	Very low	34 Å²	34	101.4 Å²	101.4	28%	0.281	59%	0.592	S	S	.	*	H	α-helix	trans	-60.3	-42.9	162.9	0	0	0	0	0	109.7	N303 L305 R309 T310 T311	N303-A307 PolarHBondContact O-N 3.17Å; L305-A307 VanDerWaalsContact C-N 3.34Å; A307-R309 PolarHBondContact O-N 2.88Å; A307-T310 WeakPolarHBondContact CA-OG1 3.34Å; A307-T310 CarbonylContact O-C 3.46Å; A307-T310 PolarHBondContact O-N 3.14Å; A307-T310 PolarHBondContact O-OG1 3.41Å; A307-T310 VanDerWaalsContact O-OG1 3.05Å; A307-T311 WeakPolarHBondContact O-CB 3.42Å; A307-T311 WeakPolarHBondContact O-CG2 3.4Å; A307-T311 PolarHBondContact O-N 2.83Å; A307-T311 PolarHBondContact O-OG1 2.8Å
308	L	36.8	Very low	36.5	Very low	67 Å²	67	99.5 Å²	99.5	35%	0.351	58%	0.583	S	S	.	*	H	α-helix	trans	-58.8	-43.2	177.1	-132.2	82.1	0	0	0	113	D304 L305 N306 T310 T311 V312	D304-L308 PolarHBondContact O-N 3.15Å; L305-L308 VanDerWaalsContact O-CB 3.3Å; L305-L308 WeakPolarHBondContact O-CB 2.97Å; L305-L308 PolarHBondContact O-N 2.89Å; N306-L308 VanDerWaalsContact C-N 3.3Å; L308-T310 PolarHBondContact O-N 3.46Å; L308-T311 WeakPolarHBondContact CA-OG1 3.4Å; L308-T311 PolarHBondContact O-N 3.17Å; L308-V312 VanDerWaalsContact O-CB 3.3Å; L308-V312 WeakPolarHBondContact O-CB 3.29Å; L308-V312 WeakPolarHBondContact O-CG2 3.24Å; L308-V312 PolarHBondContact O-N 3.28Å
309	R	35.5	Very low	38.3	Very low	211 Å²	211	97.4 Å²	97.4	80%	0.796	56%	0.563	S	S	*	*	H	α-helix	trans	-64.9	-27.1	177.1	-131.8	180	-171.9	177.6	3	113	L305 N306 A307	L305-R309 PolarHBondContact O-N 2.97Å; L305-R309 VanDerWaalsContact O-N 3.16Å; N306-R309 PolarHBondContact O-N 3.11Å; A307-R309 PolarHBondContact O-N 2.88Å
310	T	33	Very low	40.3	Very low	91 Å²	91	95 Å²	95	56%	0.558	55%	0.55	S	S	*	*	H	α-helix	trans	-93.3	-29.3	176.9	44.7	0	0	0	0	113.3	N306 A307 L308 T313	N306-T310 PolarHBondContact O-N 3.46Å; N306-T310 PolarHBondContact O-OG1 3.27Å; A307-T310 WeakPolarHBondContact CA-OG1 3.34Å; A307-T310 CarbonylContact O-C 3.46Å; A307-T310 PolarHBondContact O-N 3.14Å; A307-T310 PolarHBondContact O-OG1 3.41Å; A307-T310 VanDerWaalsContact O-OG1 3.05Å; L308-T310 PolarHBondContact O-N 3.46Å; T310-T313 PolarHBondContact O-N 3.4Å; T310-T313 PolarHBondContact O-OG1 3.35Å
311	T	33.2	Very low	42.1	Very low	49 Å²	49	95 Å²	95	30%	0.301	53%	0.534	S	S	.	.	H	α-helix	trans	-83.1	-16.9	174.8	60.3	0	0	0	0	112.6	A307 L308 T313 N314 A315	A307-T311 WeakPolarHBondContact O-CB 3.42Å; A307-T311 WeakPolarHBondContact O-CG2 3.4Å; A307-T311 PolarHBondContact O-N 2.83Å; A307-T311 PolarHBondContact O-OG1 2.8Å; L308-T311 WeakPolarHBondContact CA-OG1 3.4Å; L308-T311 PolarHBondContact O-N 3.17Å; T311-T313 PolarHBondContact O-N 3.44Å; T311-N314 CarbonylContact O-C 3.52Å; T311-N314 WeakPolarHBondContact O-CA 3.48Å; T311-N314 PolarHBondContact O-N 3.13Å; T311-A315 PolarHBondContact O-N 2.82Å
312	V	38.4	Very low	43.7	Very low	53 Å²	53	92 Å²	92	32%	0.321	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.6	165.9	164.5	0	0	0	0	111.3	L308 N314	L308-V312 VanDerWaalsContact O-CB 3.3Å; L308-V312 WeakPolarHBondContact O-CB 3.29Å; L308-V312 WeakPolarHBondContact O-CG2 3.24Å; L308-V312 PolarHBondContact O-N 3.28Å; V312-N314 VanDerWaalsContact C-N 3.3Å
313	T	38.4	Very low	45.4	Very low	104 Å²	104	90.8 Å²	90.8	64%	0.638	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-12	168.5	63.1	0	0	0	0	114.1	T310 T311	T310-T313 PolarHBondContact O-N 3.4Å; T310-T313 PolarHBondContact O-OG1 3.35Å; T311-T313 PolarHBondContact O-N 3.44Å
314	N	35.6	Very low	47.1	Very low	126 Å²	126	90.5 Å²	90.5	67%	0.674	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	-13.5	-174.2	-70.3	-12.3	0	0	0	115.1	T311 V312 S316	T311-N314 CarbonylContact O-C 3.52Å; T311-N314 WeakPolarHBondContact O-CA 3.48Å; T311-N314 PolarHBondContact O-N 3.13Å; V312-N314 VanDerWaalsContact C-N 3.3Å; N314-S316 PolarHBondContact O-N 2.92Å; N314-S316 VanDerWaalsContact O-N 3.15Å
315	A	42.9	Very low	48.3	Very low	32 Å²	32	85.6 Å²	85.6	26%	0.264	46%	0.461	S	S	.	.	S	Bend	trans	-56.2	122.4	155	0	0	0	0	0	104.9	T311 L317 Y763	T311-A315 PolarHBondContact O-N 2.82Å; A315-L317 PolarHBondContact O-N 3.29Å; A315-Y763 HydrophobicContact CB-CE2 4.41Å
316	S	47.4	Very low	49.8	Very low	80 Å²	80	84.7 Å²	84.7	56%	0.559	46%	0.457	S	S	*	.			trans	-62.7	76.6	-167.4	-175.1	0	0	0	0	111.4	N314 N318 D319	N314-S316 PolarHBondContact O-N 2.92Å; N314-S316 VanDerWaalsContact O-N 3.15Å; S316-N318 PolarHBondContact O-N 2.86Å; S316-D319 WeakPolarHBondContact O-CB 3.41Å; S316-D319 PolarHBondContact O-N 2.87Å; S316-D319 PolarHBondContact OG-N 3.47Å
317	L	46.8	Very low	51.5	Low	72 Å²	72	85.9 Å²	85.9	38%	0.377	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-10.2	170.7	-113.6	146.3	0	0	0	111.1	A315 Q323	A315-L317 PolarHBondContact O-N 3.29Å; L317-Q323 WeakPolarHBondContact O-CG 3.43Å; L317-Q323 PolarHBondContact O-NE2 2.83Å
318	N	55.7	Low	53.1	Low	131 Å²	131	86 Å²	86	70%	0.701	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	0.5	177	-61.5	-13.5	0	0	0	112.6	S316 P320	S316-N318 PolarHBondContact O-N 2.86Å; N318-P320 WeakPolarHBondContact O-CD 3.4Å
319	D	61	Low	54.7	Low	66 Å²	66	84.9 Å²	84.9	35%	0.353	45%	0.447	S	S	.	.			trans	-66.2	120.3	169.8	173.9	65.8	0	0	0	108.6	S316 H321 T322 Q323	S316-D319 WeakPolarHBondContact O-CB 3.41Å; S316-D319 PolarHBondContact O-N 2.87Å; S316-D319 PolarHBondContact OG-N 3.47Å; D319-H321 PolarHBondContact O-N 3.39Å; D319-H321 WeakPolarHBondContact OD2-CB 3.42Å; D319-H321 PolarHBondContact OD2-N 2.94Å; D319-T322 PolarHBondContact O-N 2.83Å; D319-T322 VanDerWaalsContact O-N 3.09Å; D319-T322 PolarHBondContact OD2-N 2.85Å; D319-T322 PolarHBondContact OD2-OG1 3.2Å; D319-Q323 PolarHBondContact O-N 3.28Å; D319-Q323 VanDerWaalsContact O-N 3.11Å
320	P	67.6	Low	56.5	Low	98 Å²	98	77.8 Å²	77.8	64%	0.636	43%	0.429	S	S	*	.	H	α-helix	trans	-59.2	-33	-173	-23	32	0	0	0	113	N318 K324	N318-P320 WeakPolarHBondContact O-CD 3.4Å; P320-K324 WeakPolarHBondContact O-CB 3.44Å; P320-K324 PolarHBondContact O-N 2.93Å
321	H	64.9	Low	58.5	Low	94 Å²	94	74 Å²	74	44%	0.435	41%	0.405	S	S	.	.	H	α-helix	trans	-67	-45.7	177.9	-177.4	-57	0	0	0	110.7	D319 Q323 K324 M325 E756	D319-H321 PolarHBondContact O-N 3.39Å; D319-H321 WeakPolarHBondContact OD2-CB 3.42Å; D319-H321 PolarHBondContact OD2-N 2.94Å; H321-Q323 VanDerWaalsContact C-N 3.34Å; H321-Q323 PolarHBondContact O-N 3.25Å; H321-K324 PolarHBondContact O-N 2.97Å; H321-M325 WeakPolarHBondContact O-CB 3.36Å; H321-M325 PolarHBondContact O-N 3.32Å; H321-E756 PolarHBondContact CE1-O 2.87Å
322	T	64.8	Low	60.5	Low	23 Å²	23	73.2 Å²	73.2	14%	0.141	40%	0.398	C	S	.	.	H	α-helix	trans	-62.5	-40.1	178.4	-54.6	0	0	0	0	111.9	D319 L326 P759	D319-T322 PolarHBondContact O-N 2.83Å; D319-T322 VanDerWaalsContact O-N 3.09Å; D319-T322 PolarHBondContact OD2-N 2.85Å; D319-T322 PolarHBondContact OD2-OG1 3.2Å; T322-L326 HydrophobicContact CG2-CD1 4.22Å; T322-L326 VanDerWaalsContact O-CG 3.27Å; T322-L326 WeakPolarHBondContact O-CG 3.22Å; T322-L326 PolarHBondContact O-N 2.86Å; T322-P759 HydrophobicContact CG2-CB 4.39Å; T322-P759 HydrophobicContact CG2-CG 3.85Å
323	Q	67.7	Low	62.4	Low	81 Å²	81	71.8 Å²	71.8	38%	0.379	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-50	174.6	-75.6	-175	-13.3	0	0	112	L317 D319 H321 M325 L326 E327	L317-Q323 WeakPolarHBondContact O-CG 3.43Å; L317-Q323 PolarHBondContact O-NE2 2.83Å; D319-Q323 PolarHBondContact O-N 3.28Å; D319-Q323 VanDerWaalsContact O-N 3.11Å; H321-Q323 VanDerWaalsContact C-N 3.34Å; H321-Q323 PolarHBondContact O-N 3.25Å; Q323-M325 PolarHBondContact O-N 3.46Å; Q323-L326 PolarHBondContact O-N 3.37Å; Q323-L326 VanDerWaalsContact O-N 3.1Å; Q323-E327 WeakPolarHBondContact O-CG 3.47Å; Q323-E327 PolarHBondContact O-N 2.97Å
324	K	70.6	Confident	64.3	Low	120 Å²	120	67.9 Å²	67.9	52%	0.522	36%	0.362	S	S	.	.	H	α-helix	trans	-57.1	-40.5	178.8	-169.5	-179.7	-178.9	-174.3	0	111.5	P320 H321 E327 M328	P320-K324 WeakPolarHBondContact O-CB 3.44Å; P320-K324 PolarHBondContact O-N 2.93Å; H321-K324 PolarHBondContact O-N 2.97Å; K324-E327 PolarHBondContact O-N 2.71Å; K324-M328 WeakPolarHBondContact O-CG 3.43Å; K324-M328 PolarHBondContact O-N 3.17Å; K324-M328 VanDerWaalsContact O-N 3.08Å
325	M	67.7	Low	66.4	Low	20 Å²	20	62.2 Å²	62.2	10%	0.099	33%	0.331	C	S	.	.	H	α-helix	trans	-68.6	-38.9	177.2	-176.5	-146.8	71.8	0	0	112.9	H321 Q323 E327 M328 L333 W757 P759	H321-M325 WeakPolarHBondContact O-CB 3.36Å; H321-M325 PolarHBondContact O-N 3.32Å; Q323-M325 PolarHBondContact O-N 3.46Å; M325-E327 PolarHBondContact O-N 3.36Å; M325-M328 PolarHBondContact O-N 3.3Å; M325-L333 HydrophobicContact CG-CD1 4.02Å; M325-W757 VanDerWaalsContact SD-C 3.52Å; M325-P759 HydrophobicContact CE-CG 3.66Å; M325-P759 WeakPolarHBondContact SD-CD 3.33Å; M325-P759 HydrophobicContact SD-CG 3.91Å
326	L	67.6	Low	68.3	Low	96 Å²	96	62.9 Å²	62.9	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-68.5	-23.9	174.4	-72.6	170.6	0	0	0	112.8	T322 Q323	T322-L326 HydrophobicContact CG2-CD1 4.22Å; T322-L326 VanDerWaalsContact O-CG 3.27Å; T322-L326 WeakPolarHBondContact O-CG 3.22Å; T322-L326 PolarHBondContact O-N 2.86Å; Q323-L326 PolarHBondContact O-N 3.37Å; Q323-L326 VanDerWaalsContact O-N 3.1Å
327	E	70.7	Confident	70.1	Confident	156 Å²	156	59.1 Å²	59.1	73%	0.729	30%	0.3	S	S	*	.	H	α-helix	trans	-84.1	-19.8	175.1	-71.2	173.2	-178.8	0	0	113.1	Q323 K324 M325	Q323-E327 WeakPolarHBondContact O-CG 3.47Å; Q323-E327 PolarHBondContact O-N 2.97Å; K324-E327 PolarHBondContact O-N 2.71Å; M325-E327 PolarHBondContact O-N 3.36Å
328	M	68.6	Low	72	Confident	35 Å²	35	58.1 Å²	58.1	17%	0.172	30%	0.299	C	S	.	.	S	Bend	trans	-67.2	142	177.1	-79.4	176.2	65.9	0	0	111.5	K324 M325 E332 L333 R336	K324-M328 WeakPolarHBondContact O-CG 3.43Å; K324-M328 PolarHBondContact O-N 3.17Å; K324-M328 VanDerWaalsContact O-N 3.08Å; M325-M328 PolarHBondContact O-N 3.3Å; M328-E332 HydrophobicContact CE-CB 4.26Å; M328-E332 HydrophobicContact CE-CG 3.96Å; M328-L333 HydrophobicContact CE-CB 4.49Å; M328-L333 HydrophobicContact CE-CD1 4.28Å; M328-R336 HydrophobicContact CE-CB 4.3Å; M328-R336 HydrophobicContact CE-CG 4.44Å
329	D	70.4	Confident	73.4	Confident	44 Å²	44	54.7 Å²	54.7	24%	0.235	28%	0.284	C	S	.	.			trans	-60.7	133	171.8	-174.2	-30.5	0	0	0	109.6	I331 E332 L333 Y655 L659	D329-I331 PolarHBondContact O-N 2.98Å; D329-I331 VanDerWaalsContact O-N 3.14Å; D329-I331 PolarHBondContact OD1-N 3.05Å; D329-E332 HydrophobicContact CB-CB 4.02Å; D329-E332 WeakPolarHBondContact O-CB 3.37Å; D329-E332 PolarHBondContact O-N 3.14Å; D329-L333 PolarHBondContact O-N 3.12Å; D329-Y655 WeakPolarHBondContact OD2-CE1 3.49Å; D329-Y655 PolarHBondContact OD2-OH 3.34Å; D329-L659 HydrophobicContact CB-CD2 3.98Å
330	P	73.2	Confident	74.7	Confident	63 Å²	63	52 Å²	52	41%	0.409	27%	0.27	S	S	.	.	H	α-helix	trans	-47.1	-37.2	171.8	-29.6	34.5	0	0	0	114.6	R334 F632	P330-R334 WeakPolarHBondContact O-CG 3.17Å; P330-R334 PolarHBondContact O-N 3.1Å; P330-F632 HydrophobicContact CB-CD1 4.44Å; P330-F632 HydrophobicContact CB-CE1 3.55Å; P330-F632 HydrophobicContact CB-CZ 4.05Å
331	I	74.9	Confident	75.8	Confident	11 Å²	11	53.2 Å²	53.2	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-68.4	-47.1	178.1	-62.2	174.2	0	0	0	109.6	D329 L333 R334 F335 W651 E652 Y655	D329-I331 PolarHBondContact O-N 2.98Å; D329-I331 VanDerWaalsContact O-N 3.14Å; D329-I331 PolarHBondContact OD1-N 3.05Å; I331-L333 VanDerWaalsContact C-N 3.31Å; I331-L333 PolarHBondContact O-N 3.23Å; I331-R334 WeakPolarHBondContact O-CB 3.38Å; I331-R334 PolarHBondContact O-N 2.74Å; I331-R334 VanDerWaalsContact O-N 3.14Å; I331-F335 HydrophobicContact CG2-CD2 4.04Å; I331-F335 HydrophobicContact CG2-CE2 3.78Å; I331-F335 VanDerWaalsContact O-CD2 3.26Å; I331-F335 WeakPolarHBondContact O-CD2 3.38Å; I331-F335 PolarHBondContact O-N 3.1Å; I331-W651 HydrophobicContact CD1-CH2 4.25Å; I331-W651 HydrophobicContact CD1-CZ3 4.22Å; I331-E652 HydrophobicContact CD1-CG 4.36Å; I331-E652 HydrophobicContact CG2-CG 4.3Å; I331-Y655 HydrophobicContact CB-CD1 4.37Å; I331-Y655 HydrophobicContact CD1-CD1 3.54Å; I331-Y655 HydrophobicContact CD1-CE1 3.84Å; I331-Y655 HydrophobicContact CG2-CD1 4.19Å
332	E	75.4	Confident	77	Confident	32 Å²	32	49.4 Å²	49.4	15%	0.15	25%	0.253	C	S	.	.	H	α-helix	trans	-56.1	-45.1	175.6	-159.8	-172.5	146.5	0	0	112.3	M328 D329 R334 F335 R336 L659 M660	M328-E332 HydrophobicContact CE-CB 4.26Å; M328-E332 HydrophobicContact CE-CG 3.96Å; D329-E332 HydrophobicContact CB-CB 4.02Å; D329-E332 WeakPolarHBondContact O-CB 3.37Å; D329-E332 PolarHBondContact O-N 3.14Å; E332-R334 VanDerWaalsContact C-N 3.27Å; E332-R334 PolarHBondContact O-N 3.43Å; E332-F335 PolarHBondContact O-N 2.85Å; E332-R336 WeakPolarHBondContact O-CB 3.39Å; E332-R336 PolarHBondContact O-N 3.13Å; E332-R336 IonicContact OE1-CZ 2.89Å; E332-R336 IonicContact OE1-NE 3.79Å; E332-R336 PolarHBondContact OE1-NE 3.28Å; E332-R336 IonicContact OE1-NH1 3.05Å; E332-R336 PolarHBondContact OE1-NH1 3.05Å; E332-R336 IonicContact OE1-NH2 3.62Å; E332-L659 HydrophobicContact CB-CD2 3.48Å; E332-L659 VanDerWaalsContact CB-CD2 3.48Å; E332-L659 HydrophobicContact CG-CD2 3.71Å; E332-M660 HydrophobicContact CG-SD 4.44Å
333	L	78	Confident	78.1	Confident	24 Å²	24	49.6 Å²	49.6	13%	0.126	26%	0.255	C	S	.	.	H	α-helix	trans	-58.2	-39.2	179	-172.8	72	0	0	0	111.6	M325 M328 D329 I331 S337 W757	M325-L333 HydrophobicContact CG-CD1 4.02Å; M328-L333 HydrophobicContact CE-CB 4.49Å; M328-L333 HydrophobicContact CE-CD1 4.28Å; D329-L333 PolarHBondContact O-N 3.12Å; I331-L333 VanDerWaalsContact C-N 3.31Å; I331-L333 PolarHBondContact O-N 3.23Å; L333-S337 WeakPolarHBondContact O-CB 3.37Å; L333-S337 PolarHBondContact O-N 2.92Å; L333-S337 PolarHBondContact O-OG 3.25Å; L333-W757 HydrophobicContact CD1-CE3 3.82Å; L333-W757 HydrophobicContact CD1-CZ3 4.19Å
334	R	79.7	Confident	79	Confident	22 Å²	22	50.7 Å²	50.7	8%	0.083	27%	0.271	C	S	.	.	H	α-helix	trans	-66.7	-35	178.8	-69.3	178	99.3	-165	8.6	112.9	P330 I331 E332 R613 A614 E652 C725 P727	P330-R334 WeakPolarHBondContact O-CG 3.17Å; P330-R334 PolarHBondContact O-N 3.1Å; I331-R334 WeakPolarHBondContact O-CB 3.38Å; I331-R334 PolarHBondContact O-N 2.74Å; I331-R334 VanDerWaalsContact O-N 3.14Å; E332-R334 VanDerWaalsContact C-N 3.27Å; E332-R334 PolarHBondContact O-N 3.43Å; R334-R613 WeakPolarHBondContact CG-O 3.46Å; R334-A614 PolarHBondContact NE-O 3.47Å; R334-A614 PolarHBondContact NH2-O 3.29Å; R334-A614 VanDerWaalsContact NH2-O 3.11Å; R334-E652 IonicContact CZ-OE1 3.53Å; R334-E652 IonicContact NH1-OE1 2.94Å; R334-E652 PolarHBondContact NH1-OE1 2.71Å; R334-E652 IonicContact NH1-OE2 3.53Å; R334-C725 WeakPolarHBondContact O-CB 3.42Å; R334-P727 HydrophobicContact CB-CG 3.77Å
335	F	79.5	Confident	79.9	Confident	6 Å²	6	45.1 Å²	45.1	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-81.6	-34.1	179.7	-76.6	-79.1	0	0	0	112.9	I331 E332 Y723 Q724 C725 P727	I331-F335 HydrophobicContact CG2-CD2 4.04Å; I331-F335 HydrophobicContact CG2-CE2 3.78Å; I331-F335 VanDerWaalsContact O-CD2 3.26Å; I331-F335 WeakPolarHBondContact O-CD2 3.38Å; I331-F335 PolarHBondContact O-N 3.1Å; E332-F335 PolarHBondContact O-N 2.85Å; F335-Y723 HydrophobicContact CB-CD1 4.47Å; F335-Y723 AromaticContact CD1-CD1 3.81Å; F335-Y723 HydrophobicContact CD1-CD1 3.81Å; F335-Y723 HydrophobicContact CD1-CE1 4.3Å; F335-Y723 HydrophobicContact CG-CD1 4.49Å; F335-Q724 PolarHBondContact O-N 2.71Å; F335-Q724 VanDerWaalsContact O-N 3.11Å; F335-C725 WeakPolarHBondContact CD1-O 3.11Å; F335-C725 PolarHBondContact O-N 2.99Å; F335-P727 HydrophobicContact CD1-CG 4.33Å; F335-P727 HydrophobicContact CD2-CG 4.46Å; F335-P727 HydrophobicContact CE1-CG 4.15Å; F335-P727 HydrophobicContact CE2-CG 4.24Å; F335-P727 HydrophobicContact CG-CG 4.49Å; F335-P727 HydrophobicContact CZ-CG 4.09Å
336	R	82.3	Confident	80.9	Confident	47 Å²	47	44.2 Å²	44.2	18%	0.177	24%	0.243	C	C	.	.	H	α-helix	trans	-81.2	-28.9	-179.9	-78	-175	163.8	-176.4	-8.7	114	M328 E332 M660 D663 Q724	M328-R336 HydrophobicContact CE-CB 4.3Å; M328-R336 HydrophobicContact CE-CG 4.44Å; E332-R336 WeakPolarHBondContact O-CB 3.39Å; E332-R336 PolarHBondContact O-N 3.13Å; E332-R336 IonicContact OE1-CZ 2.89Å; E332-R336 IonicContact OE1-NE 3.79Å; E332-R336 PolarHBondContact OE1-NE 3.28Å; E332-R336 IonicContact OE1-NH1 3.05Å; E332-R336 PolarHBondContact OE1-NH1 3.05Å; E332-R336 IonicContact OE1-NH2 3.62Å; R336-M660 HydrophobicContact CG-CE 3.91Å; R336-M660 HydrophobicContact CG-SD 3.83Å; R336-D663 IonicContact CZ-OD2 2.64Å; R336-D663 IonicContact NH2-OD1 3.77Å; R336-D663 PolarHBondContact NH2-OD1 2.68Å; R336-D663 VanDerWaalsContact NH2-OD1 3.1Å; R336-D663 IonicContact NH2-OD2 3.03Å; R336-D663 PolarHBondContact NH2-OD2 3.45Å; R336-Q724 WeakPolarHBondContact O-CG 3.33Å; R336-Q724 PolarHBondContact O-NE2 2.91Å; R336-Q724 PolarHBondContact O-OE1 2.95Å
337	S	85	Confident	81.8	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	-84.9	153.1	-177.7	69	0	0	0	0	113	L333 R613 C725 W757	L333-S337 WeakPolarHBondContact O-CB 3.37Å; L333-S337 PolarHBondContact O-N 2.92Å; L333-S337 PolarHBondContact O-OG 3.25Å; S337-R613 WeakPolarHBondContact OG-CB 3.33Å; S337-C725 VanDerWaalsContact O-CB 3.24Å; S337-C725 WeakPolarHBondContact O-CB 3.46Å; S337-W757 VanDerWaalsContact CB-CE3 3.48Å
338	P	87.2	Confident	82.5	Confident	52 Å²	52	33.9 Å²	33.9	34%	0.338	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-60.2	147.4	169.9	-21.9	30.8	0	0	0	111.7	L340 R613 Q724	P338-L340 PolarHBondContact O-N 2.86Å; P338-R613 WeakPolarHBondContact O-CD 3.42Å; P338-Q724 VanDerWaalsContact CD-OE1 3.24Å
339	S	85.4	Confident	83.5	Confident	58 Å²	58	32.6 Å²	32.6	41%	0.406	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-63.4	133.8	178.5	59	0	0	0	0	112.1
340	L	88.6	Confident	84.1	Confident	9 Å²	9	30.9 Å²	30.9	5%	0.047	18%	0.179	C	C	.	.			trans	-106.3	104.2	178.7	176.6	62.7	0	0	0	110.1	P338 L342 D612 R613 R616 Y731 L752 L753	P338-L340 PolarHBondContact O-N 2.86Å; L340-L342 HydrophobicContact CD1-CD2 4.46Å; L340-L342 HydrophobicContact CD2-CD2 4.34Å; L340-L342 HydrophobicContact CG-CD2 4.18Å; L340-D612 HydrophobicContact CD2-CB 3.88Å; L340-D612 WeakPolarHBondContact CD2-OD2 3.33Å; L340-R613 HydrophobicContact CB-CG 3.95Å; L340-R613 HydrophobicContact CD2-CG 4.32Å; L340-R616 PolarHBondContact O-NH1 3.39Å; L340-R616 PolarHBondContact O-NH2 3.12Å; L340-Y731 PolarHBondContact N-OH 2.95Å; L340-Y731 VanDerWaalsContact N-OH 3.15Å; L340-L752 HydrophobicContact CD1-CB 4.02Å; L340-L753 HydrophobicContact CD2-CD2 3.88Å
341	I	88.9	Confident	84.7	Confident	125 Å²	125	28.1 Å²	28.1	64%	0.641	16%	0.161	S	C	*	.	P	Polyproline II helix	trans	-96.1	118.7	176.9	-56.3	174	0	0	0	109
342	L	91.2	Very high	85.3	Confident	13 Å²	13	27.6 Å²	27.6	7%	0.068	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-82.9	149.7	177.9	-60.8	178	0	0	0	111.3	L340 R616 I627 Y738 I749	L340-L342 HydrophobicContact CD1-CD2 4.46Å; L340-L342 HydrophobicContact CD2-CD2 4.34Å; L340-L342 HydrophobicContact CG-CD2 4.18Å; L342-R616 VanDerWaalsContact CG-NH1 3.32Å; L342-I627 HydrophobicContact CD1-CD1 3.73Å; L342-I627 HydrophobicContact CD1-CG2 4.13Å; L342-Y738 HydrophobicContact CB-CD1 4.36Å; L342-Y738 HydrophobicContact CB-CE1 4.05Å; L342-Y738 HydrophobicContact CD1-CD2 4.2Å; L342-Y738 HydrophobicContact CD1-CE2 4.21Å; L342-Y738 HydrophobicContact CD1-CG 4.36Å; L342-I749 HydrophobicContact CD2-CD1 3.88Å
343	P	87.8	Confident	85.8	Confident	28 Å²	28	28.9 Å²	28.9	18%	0.182	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-63.4	160	171.2	30.7	-37.9	0	0	0	110.7	S345 Y740 I749	P343-S345 PolarHBondContact O-N 3.21Å; P343-Y740 HydrophobicContact CG-CE1 3.9Å; P343-Y740 PolarHBondContact O-OH 2.95Å; P343-I749 HydrophobicContact CG-CD1 3.66Å; P343-I749 HydrophobicContact CG-CG1 4.37Å
344	S	85.4	Confident	86.3	Confident	103 Å²	103	32.4 Å²	32.4	72%	0.72	18%	0.178	S	C	*	.	P	Polyproline II helix	trans	-55.1	132.6	176.6	51.3	0	0	0	0	112.2
345	S	89.5	Confident	87	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.021	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-54.9	151.5	172.1	-176.1	0	0	0	0	112.2	P343 Y739	P343-S345 PolarHBondContact O-N 3.21Å; S345-Y739 VanDerWaalsContact OG-CD1 3.23Å; S345-Y739 WeakPolarHBondContact OG-CD1 2.9Å; S345-Y739 PolarHBondContact OG-N 3.49Å; S345-Y739 PolarHBondContact OG-O 3.43Å
346	A	89.5	Confident	87.6	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.008	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-63.8	164.9	169.3	0	0	0	0	0	112.1	Y739 S741	A346-Y739 VanDerWaalsContact C-CZ 3.44Å; A346-Y739 HydrophobicContact CB-CD2 3.89Å; A346-Y739 HydrophobicContact CB-CE2 3.62Å; A346-Y739 WeakPolarHBondContact CB-O 3.47Å; A346-Y739 PolarHBondContact N-O 2.81Å; A346-Y739 WeakPolarHBondContact O-CE1 3.44Å; A346-Y739 PolarHBondContact O-OH 3.17Å; A346-Y739 VanDerWaalsContact O-OH 3.08Å; A346-S741 VanDerWaalsContact CB-OG 3.3Å; A346-S741 WeakPolarHBondContact CB-OG 3.36Å
347	N	85.9	Confident	88.1	Confident	30 Å²	30	32.4 Å²	32.4	16%	0.16	18%	0.181	C	C	.	.			trans	-133.8	13.6	-175.9	-60.2	-59.5	0	0	0	112.7	L349 R353 Y739 E829 M938	N347-L349 VanDerWaalsContact C-N 3.33Å; N347-L349 PolarHBondContact O-N 2.85Å; N347-R353 PolarHBondContact OD1-NH2 3.35Å; N347-Y739 VanDerWaalsContact C-OH 3.28Å; N347-Y739 WeakPolarHBondContact CA-OH 3.14Å; N347-Y739 PolarHBondContact N-OH 3Å; N347-E829 WeakPolarHBondContact CA-OE1 3.43Å; N347-E829 PolarHBondContact N-OE1 2.89Å; N347-M938 HydrophobicContact CB-CG 3.68Å; N347-M938 HydrophobicContact CB-SD 4.02Å
348	D	87.4	Confident	88.5	Confident	5 Å²	5	34.8 Å²	34.8	3%	0.027	19%	0.194	C	C	.	.			trans	-76.7	-16.3	-176.5	71.4	-60	0	0	0	114	R624 Y739 S741 V825 R957	D348-R624 VanDerWaalsContact CG-NH1 3.28Å; D348-R624 IonicContact OD1-CZ 2.72Å; D348-R624 IonicContact OD1-NH1 2.98Å; D348-R624 PolarHBondContact OD1-NH1 3.5Å; D348-R624 IonicContact OD2-CZ 3.78Å; D348-R624 IonicContact OD2-NH1 3.72Å; D348-R624 PolarHBondContact OD2-NH1 2.85Å; D348-R624 IonicContact OD2-NH2 3.38Å; D348-R624 PolarHBondContact OD2-NH2 3.36Å; D348-Y739 PolarHBondContact N-OH 3.39Å; D348-Y739 WeakPolarHBondContact OD1-CE2 3.14Å; D348-S741 VanDerWaalsContact OD1-CB 3.28Å; D348-S741 WeakPolarHBondContact OD1-CB 3.34Å; D348-S741 PolarHBondContact OD1-OG 3.2Å; D348-V825 HydrophobicContact CB-CG1 3.93Å; D348-R957 WeakPolarHBondContact O-CB 3.3Å; D348-R957 WeakPolarHBondContact O-CD 3.43Å; D348-R957 WeakPolarHBondContact O-CG 3.17Å
349	L	88.9	Confident	89	Confident	8 Å²	8	32.5 Å²	32.5	4%	0.042	18%	0.179	C	C	.	.	S	Bend	trans	-76.7	142.8	173.4	-67.2	176.2	0	0	0	111.5	N347 C351 I356 L380 E381 Y739 R957	N347-L349 VanDerWaalsContact C-N 3.33Å; N347-L349 PolarHBondContact O-N 2.85Å; L349-C351 PolarHBondContact O-N 3.14Å; L349-I356 HydrophobicContact CD1-CD1 4.39Å; L349-L380 HydrophobicContact CD2-CD2 4.37Å; L349-E381 HydrophobicContact CD2-CG 4.12Å; L349-Y739 HydrophobicContact CB-CE2 4.29Å; L349-Y739 HydrophobicContact CD1-CD2 4.09Å; L349-Y739 HydrophobicContact CD1-CE1 4.41Å; L349-Y739 HydrophobicContact CD1-CE2 3.78Å; L349-Y739 HydrophobicContact CG-CD2 4.49Å; L349-Y739 HydrophobicContact CG-CE2 3.78Å; L349-Y739 PolarHBondContact N-OH 3.28Å; L349-R957 PolarHBondContact O-NH1 2.79Å
350	A	82.1	Confident	89.4	Confident	8 Å²	8	30 Å²	30	7%	0.066	16%	0.161	C	C	.	.	S	Bend	trans	-67.6	-20	177.7	0	0	0	0	0	113.5	A385 I388 L936	A350-A385 HydrophobicContact CB-CB 4.35Å; A350-I388 HydrophobicContact CB-CD1 3.96Å; A350-I388 WeakPolarHBondContact O-CD1 3.45Å; A350-L936 WeakPolarHBondContact O-CD2 3.45Å
351	C	86.6	Confident	89.7	Confident	6 Å²	6	32.2 Å²	32.2	4%	0.041	18%	0.177	C	C	.	.	S	Bend	trans	-85.7	137.2	-169.4	-171.8	0	0	0	0	114.8	L349 I356 A384 I388	L349-C351 PolarHBondContact O-N 3.14Å; C351-I356 HydrophobicContact CB-CG1 4.46Å; C351-A384 HydrophobicContact CB-CB 4.15Å; C351-I388 HydrophobicContact CB-CD1 4.14Å
352	P	87.1	Confident	90.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.147	C	C	.	.			trans	-57.8	146.8	169.1	-20.8	31.3	0	0	0	111.3	E354 Y355 L928 E932 L936	P352-E354 HydrophobicContact CB-CG 4.47Å; P352-E354 PolarHBondContact O-N 3.37Å; P352-Y355 HydrophobicContact CB-CD2 3.94Å; P352-Y355 HydrophobicContact CB-CE2 4.37Å; P352-Y355 HydrophobicContact CG-CD2 4.11Å; P352-Y355 HydrophobicContact CG-CE2 4.46Å; P352-Y355 PolarHBondContact O-N 2.88Å; P352-L928 HydrophobicContact CG-CD2 3.82Å; P352-E932 HydrophobicContact CB-CB 4.45Å; P352-E932 HydrophobicContact CG-CB 4.12Å; P352-L936 HydrophobicContact CG-CD2 4.25Å
353	R	86.9	Confident	90.3	Very high	59 Å²	59	25.9 Å²	25.9	22%	0.223	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-63.2	-39.5	-168.8	-66.3	-175.8	-176.6	-173	-2	113.7	N347 Y355 I356 V737	N347-R353 PolarHBondContact OD1-NH2 3.35Å; R353-Y355 PolarHBondContact O-N 3.32Å; R353-Y355 VanDerWaalsContact O-N 3.1Å; R353-I356 HydrophobicContact CB-CD1 4.37Å; R353-I356 HydrophobicContact CG-CD1 4.28Å; R353-I356 PolarHBondContact O-N 2.82Å; R353-I356 VanDerWaalsContact O-N 3.12Å; R353-V737 HydrophobicContact CB-CG1 4.27Å; R353-V737 WeakPolarHBondContact O-CG1 3.24Å
354	E	88.3	Confident	90.6	Very high	97 Å²	97	26.1 Å²	26.1	45%	0.453	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-58.7	-22.6	179.6	63.2	-163.9	-152.6	0	0	114.5	P352 C736	P352-E354 HydrophobicContact CB-CG 4.47Å; P352-E354 PolarHBondContact O-N 3.37Å; E354-C736 VanDerWaalsContact CA-SG 3.54Å
355	Y	92.7	Very high	91	Very high	23 Å²	23	22 Å²	22	9%	0.09	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-101.9	-6.1	-179	-61.9	-55.6	0	0	0	114	P352 R353 L357 D358 V359 I505 K506 I509 E932	P352-Y355 HydrophobicContact CB-CD2 3.94Å; P352-Y355 HydrophobicContact CB-CE2 4.37Å; P352-Y355 HydrophobicContact CG-CD2 4.11Å; P352-Y355 HydrophobicContact CG-CE2 4.46Å; P352-Y355 PolarHBondContact O-N 2.88Å; R353-Y355 PolarHBondContact O-N 3.32Å; R353-Y355 VanDerWaalsContact O-N 3.1Å; Y355-L357 PolarHBondContact O-N 3.42Å; Y355-D358 PolarHBondContact O-N 2.78Å; Y355-V359 WeakPolarHBondContact O-CB 3.48Å; Y355-V359 VanDerWaalsContact O-CG2 3.3Å; Y355-V359 WeakPolarHBondContact O-CG2 3.23Å; Y355-V359 PolarHBondContact O-N 3.14Å; Y355-I505 HydrophobicContact CD2-CD1 4.14Å; Y355-I505 HydrophobicContact CD2-CG2 3.87Å; Y355-I505 HydrophobicContact CE2-CG2 3.44Å; Y355-I505 VanDerWaalsContact CE2-CG2 3.44Å; Y355-K506 HydrophobicContact CE1-CB 4.12Å; Y355-K506 HydrophobicContact CE1-CG 4.27Å; Y355-I509 VanDerWaalsContact CB-CD1 3.47Å; Y355-I509 HydrophobicContact CD1-CD1 3.67Å; Y355-I509 HydrophobicContact CD2-CD1 4.4Å; Y355-I509 HydrophobicContact CG-CD1 3.58Å; Y355-E932 WeakPolarHBondContact CE2-OE1 3.07Å; Y355-E932 PolarHBondContact OH-OE1 3.47Å
356	I	93.3	Very high	91.2	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.015	11%	0.113	C	C	.	.	H	α-helix	trans	-60.1	-43.7	-170.5	-71.8	176.5	0	0	0	111.9	L349 C351 R353 V359 L360 V737 Y739	L349-I356 HydrophobicContact CD1-CD1 4.39Å; C351-I356 HydrophobicContact CB-CG1 4.46Å; R353-I356 HydrophobicContact CB-CD1 4.37Å; R353-I356 HydrophobicContact CG-CD1 4.28Å; R353-I356 PolarHBondContact O-N 2.82Å; R353-I356 VanDerWaalsContact O-N 3.12Å; I356-V359 PolarHBondContact O-N 2.93Å; I356-L360 HydrophobicContact CG2-CD1 3.75Å; I356-L360 HydrophobicContact CG2-CG 4.29Å; I356-L360 WeakPolarHBondContact O-CB 3.35Å; I356-L360 VanDerWaalsContact O-CG 3.25Å; I356-L360 WeakPolarHBondContact O-CG 3.42Å; I356-L360 PolarHBondContact O-N 2.96Å; I356-V737 HydrophobicContact CB-CG1 4.11Å; I356-V737 HydrophobicContact CD1-CG1 4.25Å; I356-Y739 HydrophobicContact CD1-CD1 3.57Å; I356-Y739 HydrophobicContact CD1-CE1 3.38Å
357	L	92.8	Very high	91.4	Very high	50 Å²	50	24 Å²	24	26%	0.262	12%	0.121	S	C	.	.	H	α-helix	trans	-66.1	-43.6	-179.1	-68.4	175	0	0	0	111.8	Y355 L360 S361 I626 E628 V737	Y355-L357 PolarHBondContact O-N 3.42Å; L357-L360 PolarHBondContact O-N 3.19Å; L357-S361 WeakPolarHBondContact O-CB 3.46Å; L357-S361 PolarHBondContact O-N 3.48Å; L357-I626 HydrophobicContact CD2-CG2 3.77Å; L357-E628 HydrophobicContact CD1-CB 4.2Å; L357-E628 HydrophobicContact CD1-CG 3.75Å; L357-V737 HydrophobicContact CD1-CB 4.43Å; L357-V737 HydrophobicContact CD1-CG2 4.33Å; L357-V737 HydrophobicContact CD2-CG2 4Å; L357-V737 HydrophobicContact CG-CB 4.38Å; L357-V737 HydrophobicContact CG-CG2 4.01Å
358	D	94.2	Very high	91.5	Very high	50 Å²	50	25.2 Å²	25.2	27%	0.267	12%	0.123	S	C	.	.	H	α-helix	trans	-60.9	-46.7	174.3	-81.1	-39.5	0	0	0	111.3	Y355 L360 S361 I362 I509	Y355-D358 PolarHBondContact O-N 2.78Å; D358-L360 VanDerWaalsContact C-N 3.34Å; D358-L360 PolarHBondContact O-N 2.96Å; D358-S361 PolarHBondContact O-N 3.36Å; D358-S361 PolarHBondContact O-OG 3.2Å; D358-I362 WeakPolarHBondContact O-CD1 3.42Å; D358-I362 WeakPolarHBondContact O-CG1 3.24Å; D358-I362 PolarHBondContact O-N 2.96Å; D358-I509 HydrophobicContact CB-CG2 3.61Å
359	V	96	Very high	91.7	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.024	12%	0.124	C	C	.	.	H	α-helix	trans	-61.5	-42.7	178.3	171.7	0	0	0	0	111.4	Y355 I356 I362 Y363 L380 F383 L387 I509	Y355-V359 WeakPolarHBondContact O-CB 3.48Å; Y355-V359 VanDerWaalsContact O-CG2 3.3Å; Y355-V359 WeakPolarHBondContact O-CG2 3.23Å; Y355-V359 PolarHBondContact O-N 3.14Å; I356-V359 PolarHBondContact O-N 2.93Å; V359-I362 PolarHBondContact O-N 3.03Å; V359-Y363 WeakPolarHBondContact O-CB 3.37Å; V359-Y363 PolarHBondContact O-N 3.4Å; V359-L380 HydrophobicContact CG1-CD1 4.26Å; V359-F383 HydrophobicContact CG1-CD1 3.9Å; V359-F383 HydrophobicContact CG1-CE1 4.03Å; V359-L387 HydrophobicContact CB-CD1 4.37Å; V359-L387 HydrophobicContact CG1-CD1 3.9Å; V359-L387 HydrophobicContact CG2-CD1 3.59Å; V359-I509 HydrophobicContact CG2-CD1 3.73Å; V359-I509 HydrophobicContact CG2-CG1 4.24Å
360	L	95.4	Very high	91.7	Very high	6 Å²	6	25.5 Å²	25.5	3%	0.031	13%	0.126	C	C	.	.	H	α-helix	trans	-61.6	-45.3	174.6	-77.1	169.7	0	0	0	111.1	I356 L357 D358 I362 Y363 E364 L380 I621 I626	I356-L360 HydrophobicContact CG2-CD1 3.75Å; I356-L360 HydrophobicContact CG2-CG 4.29Å; I356-L360 WeakPolarHBondContact O-CB 3.35Å; I356-L360 VanDerWaalsContact O-CG 3.25Å; I356-L360 WeakPolarHBondContact O-CG 3.42Å; I356-L360 PolarHBondContact O-N 2.96Å; L357-L360 PolarHBondContact O-N 3.19Å; D358-L360 VanDerWaalsContact C-N 3.34Å; D358-L360 PolarHBondContact O-N 2.96Å; L360-I362 VanDerWaalsContact C-N 3.35Å; L360-I362 PolarHBondContact O-N 2.98Å; L360-Y363 PolarHBondContact O-N 2.94Å; L360-E364 WeakPolarHBondContact O-CB 3.47Å; L360-E364 VanDerWaalsContact O-CG 3.26Å; L360-E364 WeakPolarHBondContact O-CG 3.26Å; L360-E364 PolarHBondContact O-N 2.88Å; L360-L380 HydrophobicContact CD2-CD1 3.93Å; L360-L380 HydrophobicContact CD2-CD2 3.48Å; L360-L380 VanDerWaalsContact CD2-CD2 3.48Å; L360-L380 HydrophobicContact CD2-CG 4.36Å; L360-I621 HydrophobicContact CD2-CG2 3.95Å; L360-I626 HydrophobicContact CD1-CD1 3.9Å; L360-I626 HydrophobicContact CD1-CG1 3.79Å; L360-I626 HydrophobicContact CD1-CG2 4.36Å
361	S	93.8	Very high	91.8	Very high	55 Å²	55	28.6 Å²	28.6	39%	0.385	15%	0.147	S	C	.	.	H	α-helix	trans	-59.4	-45.2	179.4	79.6	0	0	0	0	111.9	L357 D358 V365	L357-S361 WeakPolarHBondContact O-CB 3.46Å; L357-S361 PolarHBondContact O-N 3.48Å; D358-S361 PolarHBondContact O-N 3.36Å; D358-S361 PolarHBondContact O-OG 3.2Å; S361-V365 WeakPolarHBondContact O-CG2 3.48Å; S361-V365 PolarHBondContact O-N 3.27Å
362	I	96.8	Very high	91.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65	-48.7	177.7	-66.1	161.3	0	0	0	110	D358 V359 L360 E364 V365 L366 F383 I509 L512 R513 T516	D358-I362 WeakPolarHBondContact O-CD1 3.42Å; D358-I362 WeakPolarHBondContact O-CG1 3.24Å; D358-I362 PolarHBondContact O-N 2.96Å; V359-I362 PolarHBondContact O-N 3.03Å; L360-I362 VanDerWaalsContact C-N 3.35Å; L360-I362 PolarHBondContact O-N 2.98Å; I362-E364 VanDerWaalsContact C-N 3.32Å; I362-E364 PolarHBondContact O-N 2.9Å; I362-V365 PolarHBondContact O-N 3.26Å; I362-L366 HydrophobicContact CG2-CD1 4.04Å; I362-L366 HydrophobicContact CG2-CG 4.43Å; I362-L366 WeakPolarHBondContact O-CG 3.47Å; I362-L366 PolarHBondContact O-N 3.41Å; I362-F383 HydrophobicContact CB-CE1 4.37Å; I362-F383 HydrophobicContact CG2-CE1 3.97Å; I362-F383 HydrophobicContact CG2-CZ 3.69Å; I362-I509 HydrophobicContact CD1-CG2 4.02Å; I362-L512 HydrophobicContact CD1-CB 3.84Å; I362-L512 HydrophobicContact CG1-CB 4.43Å; I362-L512 HydrophobicContact CG2-CB 4.06Å; I362-R513 HydrophobicContact CD1-CB 4.22Å; I362-R513 HydrophobicContact CG1-CB 4.42Å; I362-T516 HydrophobicContact CG2-CG2 4.03Å
363	Y	96.2	Very high	92.1	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-59.4	-42.5	-179.7	173.3	-96.7	0	0	0	111.9	V359 L360 V365 L366 R367 F378 L380 F383 S622	V359-Y363 WeakPolarHBondContact O-CB 3.37Å; V359-Y363 PolarHBondContact O-N 3.4Å; L360-Y363 PolarHBondContact O-N 2.94Å; Y363-V365 VanDerWaalsContact C-N 3.33Å; Y363-V365 PolarHBondContact O-N 2.85Å; Y363-L366 PolarHBondContact O-N 3.13Å; Y363-R367 HydrophobicContact CE1-CB 4.25Å; Y363-R367 VanDerWaalsContact O-CB 3.23Å; Y363-R367 WeakPolarHBondContact O-CB 3.49Å; Y363-R367 PolarHBondContact O-N 3.39Å; Y363-F378 HydrophobicContact CD2-CD2 4.23Å; Y363-F378 AromaticContact CD2-CE2 3.61Å; Y363-F378 HydrophobicContact CD2-CE2 3.61Å; Y363-F378 HydrophobicContact CD2-CZ 4.27Å; Y363-F378 AromaticContact CE2-CD2 3.86Å; Y363-F378 HydrophobicContact CE2-CD2 3.86Å; Y363-F378 AromaticContact CE2-CE2 3.69Å; Y363-F378 HydrophobicContact CE2-CE2 3.69Å; Y363-F378 HydrophobicContact CE2-CZ 4.43Å; Y363-F378 WeakPolarHBondContact CE2-O 3.28Å; Y363-F378 PolarHBondContact OH-O 3.28Å; Y363-L380 HydrophobicContact CD1-CB 4.37Å; Y363-L380 HydrophobicContact CD1-CD1 4.02Å; Y363-L380 HydrophobicContact CD2-CB 4.49Å; Y363-L380 HydrophobicContact CD2-CD1 4.24Å; Y363-L380 HydrophobicContact CE1-CB 4.11Å; Y363-L380 HydrophobicContact CE2-CB 4.23Å; Y363-L380 HydrophobicContact CG-CD1 3.81Å; Y363-L380 PolarHBondContact OH-N 2.91Å; Y363-F383 HydrophobicContact CD2-CB 4.13Å; Y363-F383 HydrophobicContact CD2-CD1 4.1Å; Y363-F383 HydrophobicContact CD2-CG 4.27Å; Y363-F383 HydrophobicContact CG-CD1 4.45Å; Y363-S622 WeakPolarHBondContact CE1-OG 3.49Å
364	E	93.5	Very high	92.2	Very high	33 Å²	33	30.2 Å²	30.2	15%	0.154	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-40.8	178.8	-76.7	-59.7	124.5	0	0	111.8	L360 I362 R367 R368 I621 S622	L360-E364 WeakPolarHBondContact O-CB 3.47Å; L360-E364 VanDerWaalsContact O-CG 3.26Å; L360-E364 WeakPolarHBondContact O-CG 3.26Å; L360-E364 PolarHBondContact O-N 2.88Å; I362-E364 VanDerWaalsContact C-N 3.32Å; I362-E364 PolarHBondContact O-N 2.9Å; E364-R367 VanDerWaalsContact CD-NH2 3.26Å; E364-R367 IonicContact OE1-CZ 3.94Å; E364-R367 IonicContact OE1-NE 2.66Å; E364-R367 PolarHBondContact OE1-NE 3.41Å; E364-R367 IonicContact OE1-NH2 3.49Å; E364-R367 PolarHBondContact OE1-NH2 2.71Å; E364-R367 IonicContact OE2-CZ 2.96Å; E364-R367 IonicContact OE2-NE 3.98Å; E364-R367 IonicContact OE2-NH2 2.74Å; E364-R367 PolarHBondContact OE2-NH2 3.31Å; E364-R368 WeakPolarHBondContact O-CB 3.24Å; E364-R368 PolarHBondContact O-N 2.9Å; E364-I621 HydrophobicContact CG-CG2 3.77Å; E364-I621 WeakPolarHBondContact OE1-CG2 3.42Å; E364-S622 PolarHBondContact OE1-OG 2.9Å
365	V	93.6	Very high	92.3	Very high	17 Å²	17	26 Å²	26	10%	0.103	14%	0.136	C	C	.	.	H	α-helix	trans	-62.7	-48.2	173.5	176.2	0	0	0	0	111	S361 I362 Y363 R367 Y369 T516 F519 L520	S361-V365 WeakPolarHBondContact O-CG2 3.48Å; S361-V365 PolarHBondContact O-N 3.27Å; I362-V365 PolarHBondContact O-N 3.26Å; Y363-V365 VanDerWaalsContact C-N 3.33Å; Y363-V365 PolarHBondContact O-N 2.85Å; V365-R367 PolarHBondContact O-N 2.74Å; V365-Y369 HydrophobicContact CG1-CD2 4.01Å; V365-Y369 WeakPolarHBondContact O-CB 3.35Å; V365-Y369 WeakPolarHBondContact O-CD2 3.35Å; V365-Y369 PolarHBondContact O-N 3.31Å; V365-T516 HydrophobicContact CB-CG2 4.18Å; V365-T516 HydrophobicContact CG1-CG2 4Å; V365-F519 HydrophobicContact CG1-CD1 4.08Å; V365-L520 HydrophobicContact CG1-CD2 4.03Å; V365-L520 HydrophobicContact CG1-CG 4.21Å; V365-L520 HydrophobicContact CG2-CD1 3.91Å; V365-L520 HydrophobicContact CG2-CD2 4.18Å; V365-L520 HydrophobicContact CG2-CG 4.28Å
366	L	94.9	Very high	92	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-62.9	-40.8	-179.8	-67.1	178.8	0	0	0	112.3	I362 Y363 G370 L373 L375 F378 F383 A399 L403	I362-L366 HydrophobicContact CG2-CD1 4.04Å; I362-L366 HydrophobicContact CG2-CG 4.43Å; I362-L366 WeakPolarHBondContact O-CG 3.47Å; I362-L366 PolarHBondContact O-N 3.41Å; Y363-L366 PolarHBondContact O-N 3.13Å; L366-G370 VanDerWaalsContact O-CA 3.23Å; L366-G370 WeakPolarHBondContact O-CA 3.48Å; L366-G370 PolarHBondContact O-N 3.39Å; L366-G370 VanDerWaalsContact O-N 3.09Å; L366-L373 HydrophobicContact CD2-CD1 3.7Å; L366-L375 HydrophobicContact CB-CD2 4.14Å; L366-L375 HydrophobicContact CD2-CD2 4.12Å; L366-F378 HydrophobicContact CB-CE1 4.44Å; L366-F378 HydrophobicContact CB-CZ 3.95Å; L366-F378 HydrophobicContact CD1-CZ 3.96Å; L366-F383 HydrophobicContact CD1-CE2 3.96Å; L366-F383 HydrophobicContact CD1-CZ 3.94Å; L366-A399 HydrophobicContact CD1-CB 4.15Å; L366-L403 HydrophobicContact CD2-CD1 4.1Å; L366-L403 HydrophobicContact CD2-CD2 4.22Å; L366-L403 HydrophobicContact CD2-CG 4.15Å
367	R	92.5	Very high	91.8	Very high	45 Å²	45	26.9 Å²	26.9	17%	0.17	15%	0.145	C	C	.	.	H	α-helix	trans	-67.7	-51.6	177.7	179.7	174.4	75.2	104.9	5.6	111	Y363 E364 V365 G370 V590 E598	Y363-R367 HydrophobicContact CE1-CB 4.25Å; Y363-R367 VanDerWaalsContact O-CB 3.23Å; Y363-R367 WeakPolarHBondContact O-CB 3.49Å; Y363-R367 PolarHBondContact O-N 3.39Å; E364-R367 VanDerWaalsContact CD-NH2 3.26Å; E364-R367 IonicContact OE1-CZ 3.94Å; E364-R367 IonicContact OE1-NE 2.66Å; E364-R367 PolarHBondContact OE1-NE 3.41Å; E364-R367 IonicContact OE1-NH2 3.49Å; E364-R367 PolarHBondContact OE1-NH2 2.71Å; E364-R367 IonicContact OE2-CZ 2.96Å; E364-R367 IonicContact OE2-NE 3.98Å; E364-R367 IonicContact OE2-NH2 2.74Å; E364-R367 PolarHBondContact OE2-NH2 3.31Å; V365-R367 PolarHBondContact O-N 2.74Å; R367-G370 PolarHBondContact O-N 3.19Å; R367-V590 HydrophobicContact CG-CG1 4.34Å; R367-E598 IonicContact CZ-OE1 2.65Å; R367-E598 IonicContact NH1-OE1 3.38Å; R367-E598 PolarHBondContact NH1-OE1 3.3Å; R367-E598 IonicContact NH2-OE1 2.81Å; R367-E598 PolarHBondContact NH2-OE1 3.1Å
368	R	88.7	Confident	91.8	Very high	55 Å²	55	24.7 Å²	24.7	21%	0.208	13%	0.134	C	C	.	.	H	α-helix	trans	-65.2	-48.7	-174.8	175.1	59.5	-169.3	177.7	2.2	112	E364 G370 E598 G601 A603	E364-R368 WeakPolarHBondContact O-CB 3.24Å; E364-R368 PolarHBondContact O-N 2.9Å; R368-G370 VanDerWaalsContact C-N 3.31Å; R368-E598 PolarHBondContact NH1-O 3.39Å; R368-G601 VanDerWaalsContact NH2-CA 3.25Å; R368-G601 PolarHBondContact NH2-O 3.31Å; R368-A603 PolarHBondContact NE-O 2.89Å
369	Y	91.1	Very high	91.8	Very high	11 Å²	11	24 Å²	24	4%	0.043	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	17.3	-177.6	-59.6	-71	0	0	0	112.7	V365 S371 L372 L373 F519 L520 V525	V365-Y369 HydrophobicContact CG1-CD2 4.01Å; V365-Y369 WeakPolarHBondContact O-CB 3.35Å; V365-Y369 WeakPolarHBondContact O-CD2 3.35Å; V365-Y369 PolarHBondContact O-N 3.31Å; Y369-S371 PolarHBondContact O-N 3.35Å; Y369-S371 VanDerWaalsContact O-N 3.1Å; Y369-L372 HydrophobicContact CD1-CD1 3.71Å; Y369-L372 HydrophobicContact CE1-CD1 4.48Å; Y369-L372 HydrophobicContact CG-CD1 4.47Å; Y369-L372 PolarHBondContact O-N 3.04Å; Y369-L373 PolarHBondContact O-N 2.99Å; Y369-F519 HydrophobicContact CD2-CE1 4.17Å; Y369-F519 AromaticContact CG-CE1 3.92Å; Y369-F519 HydrophobicContact CG-CE1 3.92Å; Y369-L520 HydrophobicContact CD2-CD2 4.06Å; Y369-L520 HydrophobicContact CE2-CD2 3.46Å; Y369-L520 VanDerWaalsContact CE2-CD2 3.46Å; Y369-V525 HydrophobicContact CD1-CG2 4.32Å; Y369-V525 HydrophobicContact CE1-CG1 3.86Å; Y369-V525 HydrophobicContact CE1-CG2 4.43Å; Y369-V525 HydrophobicContact CE2-CG1 4.38Å
370	G	89.2	Confident	91.7	Very high	8 Å²	8	23.9 Å²	23.9	8%	0.082	13%	0.127	C	C	.	.	H	α-helix	trans	-55.2	-30.6	178.5	0	0	0	0	0	113	L366 R367 R368 R374 L375	L366-G370 VanDerWaalsContact O-CA 3.23Å; L366-G370 WeakPolarHBondContact O-CA 3.48Å; L366-G370 PolarHBondContact O-N 3.39Å; L366-G370 VanDerWaalsContact O-N 3.09Å; R367-G370 PolarHBondContact O-N 3.19Å; R368-G370 VanDerWaalsContact C-N 3.31Å; G370-R374 CarbonylContact O-C 2.95Å; G370-R374 VanDerWaalsContact O-CA 3.32Å; G370-R374 WeakPolarHBondContact O-CA 3.08Å; G370-R374 PolarHBondContact O-N 3.24Å; G370-L375 CarbonylContact C-O 3.53Å; G370-L375 PolarHBondContact O-N 3.4Å
371	S	84.5	Confident	91.5	Very high	74 Å²	74	23.9 Å²	23.9	52%	0.517	13%	0.126	S	C	.	.	H	α-helix	trans	-65.1	-45.5	173	59.6	0	0	0	0	112.9	Y369 R374	Y369-S371 PolarHBondContact O-N 3.35Å; Y369-S371 VanDerWaalsContact O-N 3.1Å; S371-R374 PolarHBondContact O-N 3.3Å
372	L	88.3	Confident	91.4	Very high	44 Å²	44	21.3 Å²	21.3	23%	0.23	11%	0.108	C	C	.	.	H	α-helix	trans	-69.4	-43.2	177.4	-63.8	-178.4	0	0	0	112	Y369 R374 R409 F519 P524 V525 D528	Y369-L372 HydrophobicContact CD1-CD1 3.71Å; Y369-L372 HydrophobicContact CE1-CD1 4.48Å; Y369-L372 HydrophobicContact CG-CD1 4.47Å; Y369-L372 PolarHBondContact O-N 3.04Å; L372-R374 PolarHBondContact O-N 2.9Å; L372-R409 PolarHBondContact O-NH2 2.77Å; L372-F519 HydrophobicContact CB-CZ 4.07Å; L372-F519 HydrophobicContact CD1-CZ 4.41Å; L372-P524 HydrophobicContact CD1-CB 4.49Å; L372-V525 HydrophobicContact CD1-CG2 4.1Å; L372-D528 HydrophobicContact CD1-CB 3.98Å
373	L	91.5	Very high	91.3	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-67.7	-18.6	175.6	-69.7	172.1	0	0	0	111.9	L366 Y369 L375 V402 L403 A406 F519	L366-L373 HydrophobicContact CD2-CD1 3.7Å; Y369-L373 PolarHBondContact O-N 2.99Å; L373-L375 HydrophobicContact CB-CB 4.13Å; L373-V402 HydrophobicContact CB-CB 4.36Å; L373-V402 HydrophobicContact CB-CG2 4.15Å; L373-V402 HydrophobicContact CD2-CG2 4.47Å; L373-V402 WeakPolarHBondContact O-CB 3.4Å; L373-L403 HydrophobicContact CD1-CD2 4.39Å; L373-L403 HydrophobicContact CD2-CD2 3.88Å; L373-L403 HydrophobicContact CD2-CG 4.48Å; L373-A406 HydrophobicContact CD2-CB 3.95Å; L373-F519 HydrophobicContact CD1-CE1 4.17Å; L373-F519 HydrophobicContact CD1-CZ 4.46Å; L373-F519 HydrophobicContact CD2-CD1 4.11Å; L373-F519 HydrophobicContact CD2-CD2 3.74Å; L373-F519 HydrophobicContact CD2-CE1 3.88Å; L373-F519 HydrophobicContact CD2-CE2 3.48Å; L373-F519 VanDerWaalsContact CD2-CE2 3.48Å; L373-F519 HydrophobicContact CD2-CG 4.04Å; L373-F519 HydrophobicContact CD2-CZ 3.56Å; L373-F519 HydrophobicContact CG-CD1 4.49Å; L373-F519 HydrophobicContact CG-CE1 3.89Å; L373-F519 HydrophobicContact CG-CE2 4.13Å; L373-F519 HydrophobicContact CG-CZ 3.68Å
374	R	88.6	Confident	91.1	Very high	53 Å²	53	21.2 Å²	21.2	20%	0.2	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	51.7	-169.2	-49	-174.7	-168.5	175	6.2	110.1	G370 S371 L372 R409 N969 Y971	G370-R374 CarbonylContact O-C 2.95Å; G370-R374 VanDerWaalsContact O-CA 3.32Å; G370-R374 WeakPolarHBondContact O-CA 3.08Å; G370-R374 PolarHBondContact O-N 3.24Å; S371-R374 PolarHBondContact O-N 3.3Å; L372-R374 PolarHBondContact O-N 2.9Å; R374-R409 VanDerWaalsContact NE-NH1 3.19Å; R374-N969 PolarHBondContact O-ND2 3.21Å; R374-N969 PolarHBondContact O-OD1 2.74Å; R374-Y971 VanDerWaalsContact C-CE2 3.48Å; R374-Y971 VanDerWaalsContact CA-CD2 3.41Å; R374-Y971 VanDerWaalsContact CA-CE2 3.43Å; R374-Y971 HydrophobicContact CB-CD1 3.98Å; R374-Y971 HydrophobicContact CB-CD2 3.7Å; R374-Y971 HydrophobicContact CB-CE1 4.34Å; R374-Y971 HydrophobicContact CB-CE2 4.04Å; R374-Y971 HydrophobicContact CB-CG 3.58Å; R374-Y971 HydrophobicContact CG-CD1 4.43Å; R374-Y971 HydrophobicContact CG-CG 4.5Å; R374-Y971 WeakPolarHBondContact O-CB 3.45Å; R374-Y971 WeakPolarHBondContact O-CD2 3.36Å
375	L	90.1	Very high	90.9	Very high	8 Å²	8	20.1 Å²	20.1	4%	0.042	11%	0.105	C	C	.	.			trans	-117.3	133	178.1	-172	59.7	0	0	0	108.6	L366 G370 L373 F378 E398 V402 N969	L366-L375 HydrophobicContact CB-CD2 4.14Å; L366-L375 HydrophobicContact CD2-CD2 4.12Å; G370-L375 CarbonylContact C-O 3.53Å; G370-L375 PolarHBondContact O-N 3.4Å; L373-L375 HydrophobicContact CB-CB 4.13Å; L375-F378 HydrophobicContact CD1-CE1 4.47Å; L375-F378 HydrophobicContact CD2-CD1 4.48Å; L375-F378 HydrophobicContact CD2-CE1 3.52Å; L375-F378 HydrophobicContact CD2-CZ 4.24Å; L375-F378 HydrophobicContact CG-CD1 4.43Å; L375-F378 HydrophobicContact CG-CE1 3.9Å; L375-E398 HydrophobicContact CD1-CB 4.46Å; L375-V402 HydrophobicContact CB-CG2 4.32Å; L375-V402 HydrophobicContact CD1-CG1 4.33Å; L375-V402 HydrophobicContact CD1-CG2 4.28Å; L375-V402 HydrophobicContact CD2-CG2 4.04Å; L375-V402 HydrophobicContact CG-CG2 4.46Å; L375-N969 HydrophobicContact CD1-CB 4.4Å
376	S	86.5	Confident	90.6	Very high	13 Å²	13	19.3 Å²	19.3	9%	0.091	10%	0.1	C	C	.	.			trans	-72.8	149	174.5	46.6	0	0	0	0	111	F378	S376-F378 WeakPolarHBondContact O-CD1 2.97Å; S376-F378 PolarHBondContact O-N 3.49Å
377	P	89.6	Confident	90.4	Very high	32 Å²	32	19.3 Å²	19.3	21%	0.208	10%	0.1	C	C	.	.			trans	-63.9	129.5	177.6	-17.5	30.4	0	0	0	111.3	T587 V590 T591 W967	P377-T587 WeakPolarHBondContact O-CB 3.48Å; P377-T587 PolarHBondContact O-OG1 2.99Å; P377-V590 HydrophobicContact CB-CB 4.4Å; P377-V590 HydrophobicContact CB-CG1 3.79Å; P377-T591 HydrophobicContact CB-CG2 4.13Å; P377-T591 HydrophobicContact CG-CG2 3.95Å; P377-W967 WeakPolarHBondContact O-CH2 3.43Å; P377-W967 WeakPolarHBondContact O-CZ3 3.19Å
378	F	92.7	Very high	90	Very high	4 Å²	4	18.5 Å²	18.5	2%	0.018	10%	0.099	C	C	.	.			trans	-126	164.3	173.8	54.9	-85.6	0	0	0	110.2	Y363 L366 L375 S376 F383 L395 V590 W967	Y363-F378 HydrophobicContact CD2-CD2 4.23Å; Y363-F378 AromaticContact CD2-CE2 3.61Å; Y363-F378 HydrophobicContact CD2-CE2 3.61Å; Y363-F378 HydrophobicContact CD2-CZ 4.27Å; Y363-F378 AromaticContact CE2-CD2 3.86Å; Y363-F378 HydrophobicContact CE2-CD2 3.86Å; Y363-F378 AromaticContact CE2-CE2 3.69Å; Y363-F378 HydrophobicContact CE2-CE2 3.69Å; Y363-F378 HydrophobicContact CE2-CZ 4.43Å; Y363-F378 WeakPolarHBondContact CE2-O 3.28Å; Y363-F378 PolarHBondContact OH-O 3.28Å; L366-F378 HydrophobicContact CB-CE1 4.44Å; L366-F378 HydrophobicContact CB-CZ 3.95Å; L366-F378 HydrophobicContact CD1-CZ 3.96Å; L375-F378 HydrophobicContact CD1-CE1 4.47Å; L375-F378 HydrophobicContact CD2-CD1 4.48Å; L375-F378 HydrophobicContact CD2-CE1 3.52Å; L375-F378 HydrophobicContact CD2-CZ 4.24Å; L375-F378 HydrophobicContact CG-CD1 4.43Å; L375-F378 HydrophobicContact CG-CE1 3.9Å; S376-F378 WeakPolarHBondContact O-CD1 2.97Å; S376-F378 PolarHBondContact O-N 3.49Å; F378-F383 HydrophobicContact CD2-CB 3.91Å; F378-F383 HydrophobicContact CD2-CG 4.48Å; F378-F383 HydrophobicContact CE2-CB 3.63Å; F378-F383 AromaticContact CE2-CD2 3.71Å; F378-F383 HydrophobicContact CE2-CD2 3.71Å; F378-F383 AromaticContact CE2-CG 3.73Å; F378-F383 HydrophobicContact CE2-CG 3.73Å; F378-F383 HydrophobicContact CZ-CD2 4.34Å; F378-L395 HydrophobicContact CB-CD1 4.14Å; F378-L395 HydrophobicContact CD1-CD1 3.71Å; F378-L395 HydrophobicContact CD2-CD1 3.79Å; F378-L395 HydrophobicContact CD2-CD2 3.86Å; F378-L395 HydrophobicContact CD2-CG 4.38Å; F378-L395 HydrophobicContact CE1-CD1 4.08Å; F378-L395 HydrophobicContact CE2-CD1 4.09Å; F378-L395 HydrophobicContact CE2-CD2 4.41Å; F378-L395 HydrophobicContact CG-CD1 3.59Å; F378-L395 HydrophobicContact CG-CD2 4.26Å; F378-L395 HydrophobicContact CZ-CD1 4.25Å; F378-V590 WeakPolarHBondContact O-CG2 3.18Å; F378-W967 VanDerWaalsContact CA-CH2 3.43Å; F378-W967 VanDerWaalsContact CA-CZ3 3.46Å; F378-W967 HydrophobicContact CB-CD2 3.91Å; F378-W967 HydrophobicContact CB-CE3 3.5Å; F378-W967 HydrophobicContact CB-CH2 3.7Å; F378-W967 HydrophobicContact CB-CZ2 4.03Å; F378-W967 HydrophobicContact CB-CZ3 3.42Å; F378-W967 VanDerWaalsContact CB-CZ3 3.42Å
379	R	93.3	Very high	89.6	Confident	34 Å²	34	16.4 Å²	16.4	13%	0.128	9%	0.093	C	C	.	.			trans	-82.7	151.5	-176.4	-58.1	173.6	-177.3	154.8	11.7	110.9	E381 D382 F383 T587 P588 V590	R379-E381 VanDerWaalsContact C-N 3.26Å; R379-E381 PolarHBondContact O-N 2.86Å; R379-D382 HydrophobicContact CB-CB 4.35Å; R379-D382 WeakPolarHBondContact CB-OD2 3.13Å; R379-D382 PolarHBondContact O-N 3.2Å; R379-F383 PolarHBondContact O-N 2.99Å; R379-F383 VanDerWaalsContact O-N 3.1Å; R379-T587 HydrophobicContact CG-CG2 3.97Å; R379-P588 PolarHBondContact NE-O 2.68Å; R379-V590 HydrophobicContact CB-CG2 4.39Å; R379-V590 HydrophobicContact CG-CG2 3.88Å
380	L	94.6	Very high	89.1	Confident	3 Å²	3	17.6 Å²	17.6	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-59.1	-41.2	174.7	173.5	66.2	0	0	0	111.2	L349 V359 L360 Y363 D382 F383 A384	L349-L380 HydrophobicContact CD2-CD2 4.37Å; V359-L380 HydrophobicContact CG1-CD1 4.26Å; L360-L380 HydrophobicContact CD2-CD1 3.93Å; L360-L380 HydrophobicContact CD2-CD2 3.48Å; L360-L380 VanDerWaalsContact CD2-CD2 3.48Å; L360-L380 HydrophobicContact CD2-CG 4.36Å; Y363-L380 HydrophobicContact CD1-CB 4.37Å; Y363-L380 HydrophobicContact CD1-CD1 4.02Å; Y363-L380 HydrophobicContact CD2-CB 4.49Å; Y363-L380 HydrophobicContact CD2-CD1 4.24Å; Y363-L380 HydrophobicContact CE1-CB 4.11Å; Y363-L380 HydrophobicContact CE2-CB 4.23Å; Y363-L380 HydrophobicContact CG-CD1 3.81Å; Y363-L380 PolarHBondContact OH-N 2.91Å; L380-D382 VanDerWaalsContact C-N 3.33Å; L380-D382 PolarHBondContact O-N 3.33Å; L380-F383 WeakPolarHBondContact O-CB 3.4Å; L380-F383 PolarHBondContact O-N 3.27Å; L380-A384 WeakPolarHBondContact O-CB 3.37Å; L380-A384 PolarHBondContact O-N 3.35Å
381	E	92.6	Very high	88.6	Confident	5 Å²	5	17.3 Å²	17.3	2%	0.023	10%	0.096	C	C	.	.	H	α-helix	trans	-62.3	-41.7	-179.4	-62.4	83.7	-179	0	0	111.8	L349 R379 F383 A384 A385 R623 R624 F958 S959	L349-E381 HydrophobicContact CD2-CG 4.12Å; R379-E381 VanDerWaalsContact C-N 3.26Å; R379-E381 PolarHBondContact O-N 2.86Å; E381-F383 VanDerWaalsContact C-N 3.33Å; E381-F383 PolarHBondContact O-N 3.12Å; E381-A384 PolarHBondContact O-N 2.68Å; E381-A385 WeakPolarHBondContact O-CB 3.22Å; E381-A385 PolarHBondContact O-N 2.78Å; E381-R623 IonicContact OE1-CZ 3.67Å; E381-R623 IonicContact OE1-NH2 3.19Å; E381-R623 PolarHBondContact OE1-NH2 2.9Å; E381-R623 IonicContact OE2-CZ 3.33Å; E381-R623 IonicContact OE2-NH2 2.82Å; E381-R623 PolarHBondContact OE2-NH2 3.3Å; E381-R624 IonicContact OE1-CZ 3.89Å; E381-R624 IonicContact OE1-NE 3.34Å; E381-R624 IonicContact OE1-NH2 2.94Å; E381-R624 PolarHBondContact OE1-NH2 3.41Å; E381-F958 HydrophobicContact CB-CD1 3.59Å; E381-F958 HydrophobicContact CB-CE1 4.15Å; E381-F958 HydrophobicContact CG-CD1 3.86Å; E381-S959 VanDerWaalsContact C-OG 3.27Å; E381-S959 WeakPolarHBondContact CB-OG 3.23Å
382	D	91.6	Very high	88.6	Confident	1 Å²	1	13.9 Å²	13.9	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-64.7	-39.6	176.2	-69	-36.6	0	0	0	111.2	R379 L380 S386 L395 S959 W964 W967	R379-D382 HydrophobicContact CB-CB 4.35Å; R379-D382 WeakPolarHBondContact CB-OD2 3.13Å; R379-D382 PolarHBondContact O-N 3.2Å; L380-D382 VanDerWaalsContact C-N 3.33Å; L380-D382 PolarHBondContact O-N 3.33Å; D382-S386 WeakPolarHBondContact O-CB 3.42Å; D382-S386 PolarHBondContact O-N 3.09Å; D382-L395 HydrophobicContact CB-CD2 4.1Å; D382-S959 PolarHBondContact N-OG 3.29Å; D382-S959 PolarHBondContact OD1-OG 3.45Å; D382-W964 HydrophobicContact CB-CB 3.66Å; D382-W964 WeakPolarHBondContact O-CB 3.35Å; D382-W967 WeakPolarHBondContact OD2-CZ2 3.3Å; D382-W967 PolarHBondContact OD2-NE1 3.12Å
383	F	94	Very high	88.5	Confident	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-66.3	-48.9	176.5	-173.1	-123.3	0	0	0	112.3	V359 I362 Y363 L366 F378 R379 L380 E381 A385 S386 L387 L395 L512	V359-F383 HydrophobicContact CG1-CD1 3.9Å; V359-F383 HydrophobicContact CG1-CE1 4.03Å; I362-F383 HydrophobicContact CB-CE1 4.37Å; I362-F383 HydrophobicContact CG2-CE1 3.97Å; I362-F383 HydrophobicContact CG2-CZ 3.69Å; Y363-F383 HydrophobicContact CD2-CB 4.13Å; Y363-F383 HydrophobicContact CD2-CD1 4.1Å; Y363-F383 HydrophobicContact CD2-CG 4.27Å; Y363-F383 HydrophobicContact CG-CD1 4.45Å; L366-F383 HydrophobicContact CD1-CE2 3.96Å; L366-F383 HydrophobicContact CD1-CZ 3.94Å; F378-F383 HydrophobicContact CD2-CB 3.91Å; F378-F383 HydrophobicContact CD2-CG 4.48Å; F378-F383 HydrophobicContact CE2-CB 3.63Å; F378-F383 AromaticContact CE2-CD2 3.71Å; F378-F383 HydrophobicContact CE2-CD2 3.71Å; F378-F383 AromaticContact CE2-CG 3.73Å; F378-F383 HydrophobicContact CE2-CG 3.73Å; F378-F383 HydrophobicContact CZ-CD2 4.34Å; R379-F383 PolarHBondContact O-N 2.99Å; R379-F383 VanDerWaalsContact O-N 3.1Å; L380-F383 WeakPolarHBondContact O-CB 3.4Å; L380-F383 PolarHBondContact O-N 3.27Å; E381-F383 VanDerWaalsContact C-N 3.33Å; E381-F383 PolarHBondContact O-N 3.12Å; F383-A385 VanDerWaalsContact C-N 3.33Å; F383-A385 PolarHBondContact O-N 2.99Å; F383-S386 WeakPolarHBondContact O-CB 3.13Å; F383-S386 PolarHBondContact O-N 2.94Å; F383-S386 VanDerWaalsContact O-N 3.12Å; F383-S386 PolarHBondContact O-OG 3.3Å; F383-L387 HydrophobicContact CD1-CD1 4.17Å; F383-L387 HydrophobicContact CE1-CD1 3.82Å; F383-L387 HydrophobicContact CE2-CD2 4.45Å; F383-L387 HydrophobicContact CE2-CG 4.43Å; F383-L387 HydrophobicContact CZ-CD1 4.02Å; F383-L387 HydrophobicContact CZ-CD2 4.31Å; F383-L387 HydrophobicContact CZ-CG 4.33Å; F383-L387 WeakPolarHBondContact O-CG 3.24Å; F383-L387 PolarHBondContact O-N 3.31Å; F383-L395 HydrophobicContact CB-CD2 4.33Å; F383-L395 HydrophobicContact CD2-CD2 4.46Å; F383-L512 HydrophobicContact CZ-CD1 4.16Å
384	A	92.2	Very high	88.1	Confident	3 Å²	3	13.1 Å²	13.1	3%	0.025	7%	0.068	C	C	.	.	H	α-helix	trans	-58.3	-45	176.7	0	0	0	0	0	111.4	C351 L380 E381 S386 L387 I388	C351-A384 HydrophobicContact CB-CB 4.15Å; L380-A384 WeakPolarHBondContact O-CB 3.37Å; L380-A384 PolarHBondContact O-N 3.35Å; E381-A384 PolarHBondContact O-N 2.68Å; A384-S386 VanDerWaalsContact C-N 3.33Å; A384-S386 PolarHBondContact O-N 3.28Å; A384-L387 PolarHBondContact O-N 3.02Å; A384-I388 VanDerWaalsContact O-CD1 3.3Å; A384-I388 WeakPolarHBondContact O-CD1 2.92Å; A384-I388 WeakPolarHBondContact O-CG1 3.38Å; A384-I388 PolarHBondContact O-N 3.32Å
385	A	88.1	Confident	88.1	Confident	9 Å²	9	10.8 Å²	10.8	7%	0.074	6%	0.06	C	C	.	.	H	α-helix	trans	-61.2	-41.6	175.2	0	0	0	0	0	111.9	A350 E381 F383 L387 I388 S389 W964	A350-A385 HydrophobicContact CB-CB 4.35Å; E381-A385 WeakPolarHBondContact O-CB 3.22Å; E381-A385 PolarHBondContact O-N 2.78Å; F383-A385 VanDerWaalsContact C-N 3.33Å; F383-A385 PolarHBondContact O-N 2.99Å; A385-L387 VanDerWaalsContact C-N 3.3Å; A385-L387 PolarHBondContact O-N 2.84Å; A385-I388 PolarHBondContact O-N 2.91Å; A385-S389 PolarHBondContact O-N 2.98Å; A385-S389 VanDerWaalsContact O-N 3.08Å; A385-W964 HydrophobicContact CB-CD2 4.21Å; A385-W964 HydrophobicContact CB-CG 4.03Å
386	S	88.7	Confident	88.2	Confident	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-65.6	-27.9	178.6	80.6	0	0	0	0	114.4	D382 F383 A384 S389	D382-S386 WeakPolarHBondContact O-CB 3.42Å; D382-S386 PolarHBondContact O-N 3.09Å; F383-S386 WeakPolarHBondContact O-CB 3.13Å; F383-S386 PolarHBondContact O-N 2.94Å; F383-S386 VanDerWaalsContact O-N 3.12Å; F383-S386 PolarHBondContact O-OG 3.3Å; A384-S386 VanDerWaalsContact C-N 3.33Å; A384-S386 PolarHBondContact O-N 3.28Å; S386-S389 PolarHBondContact O-OG 3.08Å
387	L	90	Very high	88.4	Confident	1 Å²	1	9.8 Å²	9.8	1%	0.005	5%	0.054	C	C	.	.	H	α-helix	trans	-74.3	-29.6	178.1	-73.6	172.8	0	0	0	112.7	V359 F383 A384 A385 L396 R508 L512	V359-L387 HydrophobicContact CB-CD1 4.37Å; V359-L387 HydrophobicContact CG1-CD1 3.9Å; V359-L387 HydrophobicContact CG2-CD1 3.59Å; F383-L387 HydrophobicContact CD1-CD1 4.17Å; F383-L387 HydrophobicContact CE1-CD1 3.82Å; F383-L387 HydrophobicContact CE2-CD2 4.45Å; F383-L387 HydrophobicContact CE2-CG 4.43Å; F383-L387 HydrophobicContact CZ-CD1 4.02Å; F383-L387 HydrophobicContact CZ-CD2 4.31Å; F383-L387 HydrophobicContact CZ-CG 4.33Å; F383-L387 WeakPolarHBondContact O-CG 3.24Å; F383-L387 PolarHBondContact O-N 3.31Å; A384-L387 PolarHBondContact O-N 3.02Å; A385-L387 VanDerWaalsContact C-N 3.3Å; A385-L387 PolarHBondContact O-N 2.84Å; L387-L396 HydrophobicContact CD2-CD1 3.92Å; L387-R508 WeakPolarHBondContact O-CD 3.45Å; L387-R508 PolarHBondContact O-NH1 3.31Å; L387-L512 HydrophobicContact CD2-CD1 3.57Å
388	I	84.8	Confident	88.5	Confident	28 Å²	28	9.5 Å²	9.5	14%	0.144	5%	0.049	C	C	.	.	H	α-helix	trans	-95	-25.8	-173.3	-63.3	161.7	0	0	0	111.6	A350 C351 A384 A385 D390 I505 L928	A350-I388 HydrophobicContact CB-CD1 3.96Å; A350-I388 WeakPolarHBondContact O-CD1 3.45Å; C351-I388 HydrophobicContact CB-CD1 4.14Å; A384-I388 VanDerWaalsContact O-CD1 3.3Å; A384-I388 WeakPolarHBondContact O-CD1 2.92Å; A384-I388 WeakPolarHBondContact O-CG1 3.38Å; A384-I388 PolarHBondContact O-N 3.32Å; A385-I388 PolarHBondContact O-N 2.91Å; I388-D390 PolarHBondContact O-N 3.17Å; I388-I505 HydrophobicContact CG1-CD1 3.7Å; I388-L928 HydrophobicContact CG2-CD1 3.61Å; I388-L928 HydrophobicContact CG2-CD2 4.22Å; I388-L928 HydrophobicContact CG2-CG 3.97Å
389	S	80.3	Confident	88.6	Confident	12 Å²	12	9.3 Å²	9.3	8%	0.084	5%	0.048	C	C	.	.	S	Bend	trans	-61.3	135.1	179.3	65.6	0	0	0	0	112.1	A385 S386 E391 R508 I927 W964	A385-S389 PolarHBondContact O-N 2.98Å; A385-S389 VanDerWaalsContact O-N 3.08Å; S386-S389 PolarHBondContact O-OG 3.08Å; S389-E391 PolarHBondContact O-N 3.02Å; S389-E391 WeakPolarHBondContact OG-CG 2.94Å; S389-R508 PolarHBondContact O-NH1 2.96Å; S389-R508 PolarHBondContact O-NH2 2.83Å; S389-I927 VanDerWaalsContact O-CD1 3.3Å; S389-I927 WeakPolarHBondContact O-CD1 3.13Å; S389-W964 VanDerWaalsContact OG-CH2 3.28Å; S389-W964 WeakPolarHBondContact OG-CH2 3.36Å; S389-W964 VanDerWaalsContact OG-CZ3 3.3Å; S389-W964 WeakPolarHBondContact OG-CZ3 3.35Å
390	D	79.5	Confident	88.7	Confident	36 Å²	36	7.8 Å²	7.8	19%	0.193	4%	0.043	C	C	.	.	S	Bend	trans	-80.2	59.6	177.5	-167	25.2	0	0	0	113.5	I388 I927	I388-D390 PolarHBondContact O-N 3.17Å; D390-I927 HydrophobicContact CB-CD1 3.69Å; D390-I927 HydrophobicContact CB-CG1 4.19Å; D390-I927 WeakPolarHBondContact OD1-CD1 3.27Å
391	E	79.9	Confident	88.7	Confident	2 Å²	2	8 Å²	8	1%	0.009	4%	0.044	C	C	.	.	S	Bend	trans	-158.5	162.5	-177.7	60.3	175	-147.3	0	0	114.1	S389 S393 W964 R965 P1102 A1103	S389-E391 PolarHBondContact O-N 3.02Å; S389-E391 WeakPolarHBondContact OG-CG 2.94Å; E391-S393 VanDerWaalsContact C-N 3.27Å; E391-S393 PolarHBondContact O-N 3.46Å; E391-S393 VanDerWaalsContact O-N 3.11Å; E391-W964 HydrophobicContact CG-CH2 4.23Å; E391-W964 HydrophobicContact CG-CZ3 4.3Å; E391-W964 WeakPolarHBondContact OE1-CH2 2.89Å; E391-W964 WeakPolarHBondContact OE1-CZ3 3.46Å; E391-R965 IonicContact OE1-CZ 3.88Å; E391-R965 IonicContact OE1-NE 3.75Å; E391-R965 IonicContact OE1-NH1 3.03Å; E391-R965 PolarHBondContact OE1-NH1 2.82Å; E391-R965 IonicContact OE1-NH2 2.72Å; E391-R965 IonicContact OE2-CZ 3.14Å; E391-R965 IonicContact OE2-NH1 3.06Å; E391-R965 PolarHBondContact OE2-NH1 2.85Å; E391-R965 IonicContact OE2-NH2 3.8Å; E391-P1102 WeakPolarHBondContact OE2-CA 3.39Å; E391-P1102 WeakPolarHBondContact OE2-CB 3.29Å; E391-A1103 PolarHBondContact OE2-N 2.92Å
392	N	84.9	Confident	88.8	Confident	2 Å²	2	8 Å²	8	1%	0.011	4%	0.044	C	C	.	.			trans	-83.1	70.6	166.6	-176.8	24.7	0	0	0	110.8	R436 W439 P501 F502 A1103	N392-R436 PolarHBondContact ND2-O 2.84Å; N392-R436 PolarHBondContact O-NE 2.85Å; N392-R436 PolarHBondContact O-NH2 2.96Å; N392-W439 WeakPolarHBondContact OD1-CZ2 3.47Å; N392-W439 PolarHBondContact OD1-NE1 3.31Å; N392-P501 HydrophobicContact CB-CG 4.1Å; N392-F502 HydrophobicContact CB-CZ 4.3Å; N392-A1103 HydrophobicContact CB-CB 3.99Å; N392-A1103 PolarHBondContact N-O 3.21Å; N392-A1103 VanDerWaalsContact N-O 3.08Å; N392-A1103 VanDerWaalsContact O-CB 3.3Å; N392-A1103 WeakPolarHBondContact O-CB 3.42Å
393	S	84.2	Confident	89	Confident	0 Å²	0	8 Å²	8	0%	0	4%	0.044	C	C	.	.			trans	-60.6	154.4	-178.3	79.2	0	0	0	0	112.6	E391 L395 L396 A397 W964	E391-S393 VanDerWaalsContact C-N 3.27Å; E391-S393 PolarHBondContact O-N 3.46Å; E391-S393 VanDerWaalsContact O-N 3.11Å; S393-L395 VanDerWaalsContact C-N 3.33Å; S393-L395 PolarHBondContact O-N 3.15Å; S393-L396 PolarHBondContact O-N 2.75Å; S393-L396 WeakPolarHBondContact OG-CB 3.48Å; S393-L396 PolarHBondContact OG-N 2.84Å; S393-L396 VanDerWaalsContact OG-N 3.09Å; S393-A397 WeakPolarHBondContact O-CB 3.49Å; S393-A397 PolarHBondContact O-N 3.4Å; S393-W964 VanDerWaalsContact CB-CZ3 3.43Å
394	N	84.3	Confident	89.1	Confident	29 Å²	29	8 Å²	8	16%	0.155	5%	0.045	C	C	.	.	H	α-helix	trans	-61.9	-42.7	179.2	-79.3	-46.3	0	0	0	111.7	A397 E398 R436 R965 W967	N394-A397 PolarHBondContact O-N 3.38Å; N394-E398 WeakPolarHBondContact O-CB 3.36Å; N394-E398 WeakPolarHBondContact O-CG 3.45Å; N394-E398 PolarHBondContact O-N 2.79Å; N394-R436 VanDerWaalsContact CG-CZ 3.41Å; N394-R436 VanDerWaalsContact CG-NH1 3.34Å; N394-R436 PolarHBondContact ND2-NH1 3.14Å; N394-R436 WeakPolarHBondContact OD1-CD 3.19Å; N394-R436 PolarHBondContact OD1-NE 3.17Å; N394-R436 VanDerWaalsContact OD1-NE 3.14Å; N394-R436 PolarHBondContact OD1-NH1 3.47Å; N394-R965 PolarHBondContact ND2-O 3.48Å; N394-W967 WeakPolarHBondContact CB-O 3.33Å
395	L	89.3	Confident	89.1	Confident	4 Å²	4	11.1 Å²	11.1	2%	0.021	6%	0.057	C	C	.	.	H	α-helix	trans	-62.3	-44.5	178.6	-178.4	55.6	0	0	0	111.8	F378 D382 F383 S393 A399 W967	F378-L395 HydrophobicContact CB-CD1 4.14Å; F378-L395 HydrophobicContact CD1-CD1 3.71Å; F378-L395 HydrophobicContact CD2-CD1 3.79Å; F378-L395 HydrophobicContact CD2-CD2 3.86Å; F378-L395 HydrophobicContact CD2-CG 4.38Å; F378-L395 HydrophobicContact CE1-CD1 4.08Å; F378-L395 HydrophobicContact CE2-CD1 4.09Å; F378-L395 HydrophobicContact CE2-CD2 4.41Å; F378-L395 HydrophobicContact CG-CD1 3.59Å; F378-L395 HydrophobicContact CG-CD2 4.26Å; F378-L395 HydrophobicContact CZ-CD1 4.25Å; D382-L395 HydrophobicContact CB-CD2 4.1Å; F383-L395 HydrophobicContact CB-CD2 4.33Å; F383-L395 HydrophobicContact CD2-CD2 4.46Å; S393-L395 VanDerWaalsContact C-N 3.33Å; S393-L395 PolarHBondContact O-N 3.15Å; L395-A399 WeakPolarHBondContact O-CB 3.45Å; L395-A399 PolarHBondContact O-N 3.36Å; L395-W967 HydrophobicContact CB-CB 4.12Å
396	L	91.4	Very high	89.3	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-64.4	-45.8	178.2	-175.2	67.3	0	0	0	111.5	L387 S393 A399 H400 P501 L512	L387-L396 HydrophobicContact CD2-CD1 3.92Å; S393-L396 PolarHBondContact O-N 2.75Å; S393-L396 WeakPolarHBondContact OG-CB 3.48Å; S393-L396 PolarHBondContact OG-N 2.84Å; S393-L396 VanDerWaalsContact OG-N 3.09Å; L396-A399 PolarHBondContact O-N 2.75Å; L396-H400 PolarHBondContact O-N 2.82Å; L396-H400 PolarHBondContact O-ND1 2.96Å; L396-P501 HydrophobicContact CD2-CB 4.2Å; L396-L512 HydrophobicContact CD1-CD1 4.33Å
397	A	91.6	Very high	89.5	Confident	1 Å²	1	11.1 Å²	11.1	1%	0.008	6%	0.057	C	C	.	.	H	α-helix	trans	-61.2	-49	178	0	0	0	0	0	111.5	S393 N394 A399 H400 M401 R436 W439	S393-A397 WeakPolarHBondContact O-CB 3.49Å; S393-A397 PolarHBondContact O-N 3.4Å; N394-A397 PolarHBondContact O-N 3.38Å; A397-A399 PolarHBondContact O-N 2.62Å; A397-H400 PolarHBondContact O-N 3.19Å; A397-M401 WeakPolarHBondContact O-CB 3.37Å; A397-M401 WeakPolarHBondContact O-CG 3.23Å; A397-M401 PolarHBondContact O-N 3.35Å; A397-R436 HydrophobicContact CB-CG 4.06Å; A397-W439 VanDerWaalsContact CB-NE1 3.35Å
398	E	91.3	Very high	89.5	Confident	25 Å²	25	12.2 Å²	12.2	12%	0.117	6%	0.063	C	C	.	.	H	α-helix	trans	-62.1	-43.2	179.6	-79.3	-70.4	168.9	0	0	111.9	L375 N394 H400 M401 V402 N969 T972	L375-E398 HydrophobicContact CD1-CB 4.46Å; N394-E398 WeakPolarHBondContact O-CB 3.36Å; N394-E398 WeakPolarHBondContact O-CG 3.45Å; N394-E398 PolarHBondContact O-N 2.79Å; E398-H400 VanDerWaalsContact C-N 3.33Å; E398-H400 PolarHBondContact O-N 3.15Å; E398-M401 PolarHBondContact O-N 2.98Å; E398-V402 WeakPolarHBondContact O-CG1 3.48Å; E398-V402 VanDerWaalsContact O-CG2 3.29Å; E398-V402 WeakPolarHBondContact O-CG2 3.47Å; E398-V402 PolarHBondContact O-N 3.45Å; E398-N969 HydrophobicContact CB-CB 4.38Å; E398-N969 VanDerWaalsContact CD-CB 3.5Å; E398-N969 HydrophobicContact CG-CB 3.93Å; E398-N969 VanDerWaalsContact OE2-CB 3.24Å; E398-N969 WeakPolarHBondContact OE2-CB 3.08Å; E398-N969 PolarHBondContact OE2-ND2 3.41Å; E398-N969 VanDerWaalsContact OE2-ND2 3.14Å; E398-T972 PolarHBondContact OE1-OG1 2.94Å
399	A	94	Very high	89.7	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-55.8	-46.4	176.4	0	0	0	0	0	112	L366 L395 L396 A397 V402 L403	L366-A399 HydrophobicContact CD1-CB 4.15Å; L395-A399 WeakPolarHBondContact O-CB 3.45Å; L395-A399 PolarHBondContact O-N 3.36Å; L396-A399 PolarHBondContact O-N 2.75Å; A397-A399 PolarHBondContact O-N 2.62Å; A399-V402 WeakPolarHBondContact O-CG2 3.32Å; A399-L403 WeakPolarHBondContact O-CD1 3.36Å; A399-L403 VanDerWaalsContact O-CG 3.29Å; A399-L403 WeakPolarHBondContact O-CG 3.31Å; A399-L403 PolarHBondContact O-N 3.32Å
400	H	95.8	Very high	90.2	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.009	7%	0.068	C	C	.	.	H	α-helix	trans	-67.5	-45.3	176.5	-73.9	91.2	0	0	0	112.6	L396 A397 E398 V402 L403 L404 W439 Y500 L512	L396-H400 PolarHBondContact O-N 2.82Å; L396-H400 PolarHBondContact O-ND1 2.96Å; A397-H400 PolarHBondContact O-N 3.19Å; E398-H400 VanDerWaalsContact C-N 3.33Å; E398-H400 PolarHBondContact O-N 3.15Å; H400-V402 PolarHBondContact O-N 3.09Å; H400-L403 PolarHBondContact O-N 2.99Å; H400-L404 VanDerWaalsContact O-CB 3.3Å; H400-L404 WeakPolarHBondContact O-CB 3.43Å; H400-L404 PolarHBondContact O-N 2.92Å; H400-W439 HydrophobicContact CB-CD2 4.05Å; H400-W439 HydrophobicContact CB-CE3 3.46Å; H400-W439 VanDerWaalsContact CB-CE3 3.46Å; H400-W439 HydrophobicContact CB-CH2 3.99Å; H400-W439 HydrophobicContact CB-CZ3 3.41Å; H400-W439 VanDerWaalsContact CB-CZ3 3.41Å; H400-W439 AromaticContact CD2-CZ3 3.53Å; H400-W439 AromaticContact CE1-CH2 3.9Å; H400-W439 AromaticContact CG-CE3 3.87Å; H400-W439 AromaticContact CG-CH2 3.56Å; H400-W439 AromaticContact CG-CZ3 3.25Å; H400-W439 AromaticContact ND1-CH2 3.5Å; H400-W439 WeakPolarHBondContact ND1-CH2 3.43Å; H400-W439 AromaticContact ND1-CZ3 3.73Å; H400-Y500 PolarHBondContact CE1-OH 3.34Å; H400-Y500 AromaticContact NE2-CZ 3.93Å; H400-Y500 PolarHBondContact NE2-OH 3.4Å; H400-L512 VanDerWaalsContact CE1-CD2 3.5Å; H400-L512 WeakPolarHBondContact CE1-CD2 3.34Å; H400-L512 WeakPolarHBondContact NE2-CD2 3.4Å; H400-L512 WeakPolarHBondContact NE2-CG 3.34Å
401	M	94.6	Very high	90.6	Very high	8 Å²	8	12.6 Å²	12.6	4%	0.039	6%	0.059	C	C	.	.	H	α-helix	trans	-62.4	-42	-178.5	-73.1	170.8	60.3	0	0	112	A397 E398 L404 K405 L434 D435 W439	A397-M401 WeakPolarHBondContact O-CB 3.37Å; A397-M401 WeakPolarHBondContact O-CG 3.23Å; A397-M401 PolarHBondContact O-N 3.35Å; E398-M401 PolarHBondContact O-N 2.98Å; M401-L404 PolarHBondContact O-N 3.3Å; M401-K405 VanDerWaalsContact O-CB 3.28Å; M401-K405 WeakPolarHBondContact O-CB 3.19Å; M401-K405 WeakPolarHBondContact O-CG 3.42Å; M401-K405 PolarHBondContact O-N 2.93Å; M401-L434 HydrophobicContact CE-CG 4.43Å; M401-L434 VanDerWaalsContact CE-O 3.28Å; M401-L434 WeakPolarHBondContact CE-O 3.32Å; M401-L434 HydrophobicContact CG-CD1 4.29Å; M401-L434 HydrophobicContact CG-CG 4.34Å; M401-D435 VanDerWaalsContact SD-C 3.51Å; M401-W439 HydrophobicContact CG-CB 3.52Å; M401-W439 HydrophobicContact CG-CG 3.87Å; M401-W439 HydrophobicContact SD-CB 4.28Å; M401-W439 HydrophobicContact SD-CG 4.4Å
402	V	94.5	Very high	90.9	Very high	5.5 Å²	5.5	16.6 Å²	16.6	3%	0.033	8%	0.078	C	C	.	.	H	α-helix	trans	-69.8	-38.3	179.5	-62.8	0	0	0	0	112.2	L373 L375 E398 A399 H400 K405 A406 N969	L373-V402 HydrophobicContact CB-CB 4.36Å; L373-V402 HydrophobicContact CB-CG2 4.15Å; L373-V402 HydrophobicContact CD2-CG2 4.47Å; L373-V402 WeakPolarHBondContact O-CB 3.4Å; L375-V402 HydrophobicContact CB-CG2 4.32Å; L375-V402 HydrophobicContact CD1-CG1 4.33Å; L375-V402 HydrophobicContact CD1-CG2 4.28Å; L375-V402 HydrophobicContact CD2-CG2 4.04Å; L375-V402 HydrophobicContact CG-CG2 4.46Å; E398-V402 WeakPolarHBondContact O-CG1 3.48Å; E398-V402 VanDerWaalsContact O-CG2 3.29Å; E398-V402 WeakPolarHBondContact O-CG2 3.47Å; E398-V402 PolarHBondContact O-N 3.45Å; A399-V402 WeakPolarHBondContact O-CG2 3.32Å; H400-V402 PolarHBondContact O-N 3.09Å; V402-K405 PolarHBondContact O-N 2.86Å; V402-A406 VanDerWaalsContact O-CB 3.31Å; V402-A406 WeakPolarHBondContact O-CB 3.42Å; V402-A406 PolarHBondContact O-N 3.24Å; V402-N969 WeakPolarHBondContact CG1-ND2 3.39Å
403	L	96.5	Very high	91	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-62.2	-50.2	173.3	-74.6	167.9	0	0	0	110	L366 L373 A399 H400 K405 A406 L407 L512 L515 T516 F519	L366-L403 HydrophobicContact CD2-CD1 4.1Å; L366-L403 HydrophobicContact CD2-CD2 4.22Å; L366-L403 HydrophobicContact CD2-CG 4.15Å; L373-L403 HydrophobicContact CD1-CD2 4.39Å; L373-L403 HydrophobicContact CD2-CD2 3.88Å; L373-L403 HydrophobicContact CD2-CG 4.48Å; A399-L403 WeakPolarHBondContact O-CD1 3.36Å; A399-L403 VanDerWaalsContact O-CG 3.29Å; A399-L403 WeakPolarHBondContact O-CG 3.31Å; A399-L403 PolarHBondContact O-N 3.32Å; H400-L403 PolarHBondContact O-N 2.99Å; L403-K405 PolarHBondContact O-N 3.1Å; L403-A406 WeakPolarHBondContact O-CB 3.4Å; L403-A406 PolarHBondContact O-N 2.96Å; L403-A406 VanDerWaalsContact O-N 3.14Å; L403-L407 VanDerWaalsContact O-CG 3.3Å; L403-L407 WeakPolarHBondContact O-CG 3.35Å; L403-L407 PolarHBondContact O-N 3.36Å; L403-L512 HydrophobicContact CD1-CD2 3.92Å; L403-L515 HydrophobicContact CB-CB 4.42Å; L403-L515 HydrophobicContact CD1-CB 3.95Å; L403-L515 HydrophobicContact CD1-CD1 4.41Å; L403-T516 HydrophobicContact CD1-CG2 4.15Å; L403-T516 HydrophobicContact CD2-CG2 4.17Å; L403-F519 HydrophobicContact CD2-CB 3.89Å; L403-F519 HydrophobicContact CD2-CD1 4.46Å; L403-F519 HydrophobicContact CD2-CG 4.13Å
404	L	95.2	Very high	91.1	Very high	1.5 Å²	1.5	21.8 Å²	21.8	1%	0.008	12%	0.116	C	C	.	.	H	α-helix	trans	-60.2	-45.6	178	-178.7	58.8	0	0	0	111.8	H400 M401 A406 L407 L408 L434 L442 L443 Y446	H400-L404 VanDerWaalsContact O-CB 3.3Å; H400-L404 WeakPolarHBondContact O-CB 3.43Å; H400-L404 PolarHBondContact O-N 2.92Å; M401-L404 PolarHBondContact O-N 3.3Å; L404-A406 VanDerWaalsContact C-N 3.31Å; L404-A406 PolarHBondContact O-N 3.15Å; L404-L407 PolarHBondContact O-N 2.78Å; L404-L408 HydrophobicContact CD1-CD1 4.17Å; L404-L408 HydrophobicContact CD1-CG 4.17Å; L404-L408 HydrophobicContact CG-CD1 3.97Å; L404-L408 HydrophobicContact CG-CG 4.43Å; L404-L408 WeakPolarHBondContact O-CB 3.32Å; L404-L408 VanDerWaalsContact O-CG 3.27Å; L404-L408 WeakPolarHBondContact O-CG 3.42Å; L404-L408 PolarHBondContact O-N 2.97Å; L404-L434 HydrophobicContact CD2-CD1 4.03Å; L404-L434 HydrophobicContact CD2-CD2 4Å; L404-L434 HydrophobicContact CG-CD2 4.31Å; L404-L442 HydrophobicContact CD2-CB 4.32Å; L404-L443 HydrophobicContact CD1-CD1 4.48Å; L404-L443 HydrophobicContact CD2-CB 4.39Å; L404-Y446 HydrophobicContact CD1-CD1 3.59Å; L404-Y446 HydrophobicContact CD1-CD2 4.08Å; L404-Y446 HydrophobicContact CD1-CE1 4.15Å; L404-Y446 HydrophobicContact CD1-CG 3.56Å
405	K	92.6	Very high	91.1	Very high	67.5 Å²	67.5	21.7 Å²	21.7	29%	0.293	12%	0.123	S	C	.	.	H	α-helix	trans	-60.8	-39.8	175.6	-75.9	173	-178.1	176.3	0	111.7	M401 V402 L403 R409 L434	M401-K405 VanDerWaalsContact O-CB 3.28Å; M401-K405 WeakPolarHBondContact O-CB 3.19Å; M401-K405 WeakPolarHBondContact O-CG 3.42Å; M401-K405 PolarHBondContact O-N 2.93Å; V402-K405 PolarHBondContact O-N 2.86Å; L403-K405 PolarHBondContact O-N 3.1Å; K405-R409 VanDerWaalsContact O-CG 3.29Å; K405-R409 WeakPolarHBondContact O-CG 3.38Å; K405-R409 PolarHBondContact O-N 3.06Å; K405-R409 VanDerWaalsContact O-N 3.11Å; K405-R409 PolarHBondContact O-NE 3.08Å; K405-L434 HydrophobicContact CD-CD2 4.26Å; K405-L434 HydrophobicContact CG-CD2 3.65Å
406	A	92.7	Very high	91	Very high	8 Å²	8	22 Å²	22	7%	0.066	13%	0.125	C	C	.	.	H	α-helix	trans	-65	-44	177.1	0	0	0	0	0	111.8	L373 V402 L403 L404 R409 E410 F519	L373-A406 HydrophobicContact CD2-CB 3.95Å; V402-A406 VanDerWaalsContact O-CB 3.31Å; V402-A406 WeakPolarHBondContact O-CB 3.42Å; V402-A406 PolarHBondContact O-N 3.24Å; L403-A406 WeakPolarHBondContact O-CB 3.4Å; L403-A406 PolarHBondContact O-N 2.96Å; L403-A406 VanDerWaalsContact O-N 3.14Å; L404-A406 VanDerWaalsContact C-N 3.31Å; L404-A406 PolarHBondContact O-N 3.15Å; A406-R409 PolarHBondContact O-N 3.18Å; A406-E410 PolarHBondContact O-N 3.06Å; A406-F519 HydrophobicContact CB-CD2 3.77Å; A406-F519 HydrophobicContact CB-CE2 3.78Å
407	L	93	Very high	90.7	Very high	1.5 Å²	1.5	24.2 Å²	24.2	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-66.1	-41.6	177.6	-66.3	174.1	0	0	0	112.5	L403 L404 R409 E410 D411 Y446 L515 L518 T522	L403-L407 VanDerWaalsContact O-CG 3.3Å; L403-L407 WeakPolarHBondContact O-CG 3.35Å; L403-L407 PolarHBondContact O-N 3.36Å; L404-L407 PolarHBondContact O-N 2.78Å; L407-R409 VanDerWaalsContact C-N 3.32Å; L407-R409 PolarHBondContact O-N 2.98Å; L407-E410 WeakPolarHBondContact O-CB 3.37Å; L407-E410 PolarHBondContact O-N 2.85Å; L407-D411 PolarHBondContact O-N 2.97Å; L407-Y446 HydrophobicContact CB-CE1 4.25Å; L407-Y446 WeakPolarHBondContact CB-OH 3.44Å; L407-Y446 HydrophobicContact CD1-CE1 4.02Å; L407-L515 HydrophobicContact CD1-CD2 3.76Å; L407-L518 HydrophobicContact CD1-CB 4.05Å; L407-L518 HydrophobicContact CD1-CD1 4.09Å; L407-L518 HydrophobicContact CD2-CB 3.72Å; L407-T522 HydrophobicContact CD2-CG2 4.01Å
408	L	90.3	Very high	90.3	Very high	24 Å²	24	24.8 Å²	24.8	13%	0.126	14%	0.141	C	C	.	.	H	α-helix	trans	-63.3	-38.3	175.7	-71.3	169.7	0	0	0	112.5	L404 E410 D411 E412 F431 Y446	L404-L408 HydrophobicContact CD1-CD1 4.17Å; L404-L408 HydrophobicContact CD1-CG 4.17Å; L404-L408 HydrophobicContact CG-CD1 3.97Å; L404-L408 HydrophobicContact CG-CG 4.43Å; L404-L408 WeakPolarHBondContact O-CB 3.32Å; L404-L408 VanDerWaalsContact O-CG 3.27Å; L404-L408 WeakPolarHBondContact O-CG 3.42Å; L404-L408 PolarHBondContact O-N 2.97Å; L408-E410 VanDerWaalsContact C-N 3.34Å; L408-D411 PolarHBondContact O-N 3.05Å; L408-E412 WeakPolarHBondContact O-CB 3.18Å; L408-E412 PolarHBondContact O-N 3.18Å; L408-F431 HydrophobicContact CD1-CB 4.39Å; L408-F431 HydrophobicContact CD1-CD1 3.38Å; L408-F431 HydrophobicContact CD1-CD2 4.35Å; L408-F431 HydrophobicContact CD1-CE1 3.58Å; L408-F431 HydrophobicContact CD1-CE2 4.32Å; L408-F431 HydrophobicContact CD1-CG 3.8Å; L408-F431 HydrophobicContact CD1-CZ 4.15Å; L408-F431 HydrophobicContact CD2-CD1 4.28Å; L408-F431 HydrophobicContact CD2-CD2 4.41Å; L408-F431 HydrophobicContact CD2-CE1 3.73Å; L408-F431 HydrophobicContact CD2-CE2 3.85Å; L408-F431 HydrophobicContact CD2-CZ 3.49Å; L408-F431 VanDerWaalsContact CD2-CZ 3.42Å; L408-F431 HydrophobicContact CG-CD1 4.46Å; L408-F431 HydrophobicContact CG-CE1 4.32Å; L408-F431 HydrophobicContact CG-CZ 4.39Å; L408-Y446 HydrophobicContact CD2-CD2 3.79Å; L408-Y446 HydrophobicContact CD2-CE2 3.79Å; L408-Y446 HydrophobicContact CG-CE2 4.47Å
409	R	88.3	Confident	89.8	Confident	68 Å²	68	24.4 Å²	24.4	26%	0.257	14%	0.14	S	C	.	.	H	α-helix	trans	-65.7	-39.1	174	-73.7	-177.7	-56.9	-142.1	4.5	111.8	L372 R374 K405 A406 L407 E412 A413	L372-R409 PolarHBondContact O-NH2 2.77Å; R374-R409 VanDerWaalsContact NE-NH1 3.19Å; K405-R409 VanDerWaalsContact O-CG 3.29Å; K405-R409 WeakPolarHBondContact O-CG 3.38Å; K405-R409 PolarHBondContact O-N 3.06Å; K405-R409 VanDerWaalsContact O-N 3.11Å; K405-R409 PolarHBondContact O-NE 3.08Å; A406-R409 PolarHBondContact O-N 3.18Å; L407-R409 VanDerWaalsContact C-N 3.32Å; L407-R409 PolarHBondContact O-N 2.98Å; R409-E412 PolarHBondContact O-N 3.04Å; R409-A413 WeakPolarHBondContact O-CB 3.48Å; R409-A413 PolarHBondContact O-N 3Å
410	E	90.3	Very high	88.8	Confident	14 Å²	14	25.5 Å²	25.5	7%	0.065	15%	0.148	C	C	.	.	H	α-helix	trans	-66	-45.6	175.8	-179.1	66.7	-172.5	0	0	111.3	A406 L407 L408 E412 A413 N414 G479 T522 G523 P524	A406-E410 PolarHBondContact O-N 3.06Å; L407-E410 WeakPolarHBondContact O-CB 3.37Å; L407-E410 PolarHBondContact O-N 2.85Å; L408-E410 VanDerWaalsContact C-N 3.34Å; E410-E412 VanDerWaalsContact C-N 3.32Å; E410-E412 PolarHBondContact O-N 3.02Å; E410-A413 PolarHBondContact O-N 3.35Å; E410-A413 VanDerWaalsContact O-N 3.16Å; E410-N414 VanDerWaalsContact CD-ND2 3.32Å; E410-N414 WeakPolarHBondContact CG-ND2 3.23Å; E410-N414 WeakPolarHBondContact O-CB 3.45Å; E410-N414 PolarHBondContact O-N 2.97Å; E410-N414 PolarHBondContact O-ND2 3.37Å; E410-N414 PolarHBondContact OE1-ND2 3.13Å; E410-G479 WeakPolarHBondContact OE1-CA 3.35Å; E410-T522 HydrophobicContact CB-CG2 4.1Å; E410-T522 HydrophobicContact CG-CG2 3.89Å; E410-G523 PolarHBondContact OE1-N 3.44Å; E410-G523 VanDerWaalsContact OE1-N 3.08Å; E410-G523 PolarHBondContact OE2-N 3.21Å; E410-P524 WeakPolarHBondContact OE2-CD 3.29Å
411	D	88.6	Confident	87.8	Confident	2.5 Å²	2.5	31.7 Å²	31.7	1%	0.013	19%	0.185	C	C	.	.	H	α-helix	trans	-59.8	-43.4	175.8	-85	-17.9	0	0	0	110.8	L407 L408 A413 N414 G415 T416 M418 Y446 R1183	L407-D411 PolarHBondContact O-N 2.97Å; L408-D411 PolarHBondContact O-N 3.05Å; D411-A413 PolarHBondContact O-N 2.85Å; D411-N414 PolarHBondContact O-N 2.9Å; D411-G415 PolarHBondContact O-N 2.95Å; D411-G415 VanDerWaalsContact O-N 3.09Å; D411-T416 HydrophobicContact CB-CG2 4.32Å; D411-T416 WeakPolarHBondContact O-CA 3.37Å; D411-T416 WeakPolarHBondContact O-CB 3.42Å; D411-T416 PolarHBondContact O-N 2.96Å; D411-M418 HydrophobicContact CB-CE 4.08Å; D411-M418 WeakPolarHBondContact OD2-CE 3.45Å; D411-Y446 VanDerWaalsContact OD2-CE2 3.25Å; D411-Y446 WeakPolarHBondContact OD2-CE2 3.48Å; D411-Y446 PolarHBondContact OD2-OH 3.19Å; D411-R1183 IonicContact OD1-CZ 3.45Å; D411-R1183 IonicContact OD1-NE 3.42Å; D411-R1183 IonicContact OD1-NH2 3.17Å; D411-R1183 PolarHBondContact OD1-NH2 3.31Å; D411-R1183 VanDerWaalsContact OD1-NH2 3.15Å; D411-R1183 IonicContact OD2-CZ 2.77Å; D411-R1183 IonicContact OD2-NE 3.5Å; D411-R1183 PolarHBondContact OD2-NE 3.34Å; D411-R1183 IonicContact OD2-NH2 3.9Å; D411-R1183 PolarHBondContact OD2-NH2 3.35Å
412	E	85.9	Confident	86.6	Confident	85.5 Å²	85.5	36.3 Å²	36.3	40%	0.4	21%	0.21	S	C	.	.	H	α-helix	trans	-62.9	-41	174.7	-177.1	164.1	-147.7	0	0	112.1	L408 R409 E410 N414 G415 R424 R1044	L408-E412 WeakPolarHBondContact O-CB 3.18Å; L408-E412 PolarHBondContact O-N 3.18Å; R409-E412 PolarHBondContact O-N 3.04Å; E410-E412 VanDerWaalsContact C-N 3.32Å; E410-E412 PolarHBondContact O-N 3.02Å; E412-N414 VanDerWaalsContact C-N 3.34Å; E412-N414 PolarHBondContact O-N 2.98Å; E412-G415 WeakPolarHBondContact O-CA 3.13Å; E412-G415 PolarHBondContact O-N 3.03Å; E412-G415 VanDerWaalsContact O-N 3.08Å; E412-R424 IonicContact OE1-CZ 3.76Å; E412-R424 IonicContact OE1-NH2 3.98Å; E412-R424 PolarHBondContact OE1-NH2 3.29Å; E412-R1044 IonicContact OE2-NH2 3.57Å; E412-R1044 PolarHBondContact OE2-NH2 3.27Å
413	A	87	Confident	85.6	Confident	80 Å²	80	36.6 Å²	36.6	66%	0.661	21%	0.212	S	C	*	.	H	α-helix	trans	-65.3	-36.5	177.2	0	0	0	0	0	112.8	R409 E410 D411 G415	R409-A413 WeakPolarHBondContact O-CB 3.48Å; R409-A413 PolarHBondContact O-N 3Å; E410-A413 PolarHBondContact O-N 3.35Å; E410-A413 VanDerWaalsContact O-N 3.16Å; D411-A413 PolarHBondContact O-N 2.85Å; A413-G415 PolarHBondContact O-N 3.04Å
414	N	85.7	Confident	84.8	Confident	30.5 Å²	30.5	42.4 Å²	42.4	16%	0.163	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-3	174	-67.8	-38.1	0	0	0	112.8	E410 D411 E412 T416 G479 A1186	E410-N414 VanDerWaalsContact CD-ND2 3.32Å; E410-N414 WeakPolarHBondContact CG-ND2 3.23Å; E410-N414 WeakPolarHBondContact O-CB 3.45Å; E410-N414 PolarHBondContact O-N 2.97Å; E410-N414 PolarHBondContact O-ND2 3.37Å; E410-N414 PolarHBondContact OE1-ND2 3.13Å; D411-N414 PolarHBondContact O-N 2.9Å; E412-N414 VanDerWaalsContact C-N 3.34Å; E412-N414 PolarHBondContact O-N 2.98Å; N414-T416 VanDerWaalsContact C-N 3.28Å; N414-T416 PolarHBondContact O-N 3.3Å; N414-G479 VanDerWaalsContact ND2-CA 3.27Å; N414-G479 WeakPolarHBondContact ND2-CA 3.44Å; N414-G479 PolarHBondContact ND2-N 2.98Å; N414-G479 PolarHBondContact ND2-O 2.98Å; N414-A1186 WeakPolarHBondContact O-CB 3.09Å
415	G	85.1	Confident	84	Confident	28 Å²	28	44.4 Å²	44.4	29%	0.289	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	15	-178.6	0	0	0	0	0	113.5	D411 E412 A413 T417 R1189	D411-G415 PolarHBondContact O-N 2.95Å; D411-G415 VanDerWaalsContact O-N 3.09Å; E412-G415 WeakPolarHBondContact O-CA 3.13Å; E412-G415 PolarHBondContact O-N 3.03Å; E412-G415 VanDerWaalsContact O-N 3.08Å; A413-G415 PolarHBondContact O-N 3.04Å; G415-T417 PolarHBondContact O-N 2.89Å; G415-R1189 PolarHBondContact O-NH1 3Å; G415-R1189 PolarHBondContact O-NH2 3.38Å
416	T	86.8	Confident	83.3	Confident	10 Å²	10	41.6 Å²	41.6	6%	0.061	23%	0.234	C	C	.	.			trans	-67.6	129.3	172.6	-67.8	0	0	0	0	109.6	D411 N414 M418 D481 R1183 T1185	D411-T416 HydrophobicContact CB-CG2 4.32Å; D411-T416 WeakPolarHBondContact O-CA 3.37Å; D411-T416 WeakPolarHBondContact O-CB 3.42Å; D411-T416 PolarHBondContact O-N 2.96Å; N414-T416 VanDerWaalsContact C-N 3.28Å; N414-T416 PolarHBondContact O-N 3.3Å; T416-M418 HydrophobicContact CG2-CE 4.2Å; T416-D481 PolarHBondContact OG1-OD1 3.24Å; T416-D481 VanDerWaalsContact OG1-OD1 3.1Å; T416-D481 PolarHBondContact OG1-OD2 3.05Å; T416-D481 VanDerWaalsContact OG1-OD2 3.09Å; T416-R1183 HydrophobicContact CG2-CG 3.83Å; T416-T1185 HydrophobicContact CG2-CG2 4.39Å
417	T	84.8	Confident	82.7	Confident	45.5 Å²	45.5	41.7 Å²	41.7	28%	0.279	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-108.8	133.6	-179.6	52.4	0	0	0	0	109.6	G415 R1183 M1184 R1189	G415-T417 PolarHBondContact O-N 2.89Å; T417-R1183 CarbonylContact O-C 3.58Å; T417-R1183 WeakPolarHBondContact O-CA 3.28Å; T417-M1184 PolarHBondContact N-O 3.28Å; T417-M1184 PolarHBondContact O-N 3.07Å; T417-M1184 PolarHBondContact OG1-O 2.84Å; T417-R1189 PolarHBondContact OG1-NH1 2.97Å
418	M	84.5	Confident	82.1	Confident	14.5 Å²	14.5	43.6 Å²	43.6	7%	0.071	24%	0.244	C	C	.	.	S	Bend	trans	-93.2	1.3	179.2	-62.3	-61.7	176.6	0	0	114	D411 T416 V427 Y446 L1181 E1182 R1183	D411-M418 HydrophobicContact CB-CE 4.08Å; D411-M418 WeakPolarHBondContact OD2-CE 3.45Å; T416-M418 HydrophobicContact CG2-CE 4.2Å; M418-V427 HydrophobicContact CB-CG1 4.36Å; M418-Y446 HydrophobicContact CE-CD2 4.03Å; M418-Y446 HydrophobicContact CE-CE2 3.53Å; M418-L1181 HydrophobicContact CB-CB 4.42Å; M418-L1181 HydrophobicContact CB-CD2 4.22Å; M418-E1182 CarbonylContact C-O 3.6Å; M418-E1182 WeakPolarHBondContact CA-O 3.43Å; M418-E1182 CarbonylContact O-C 3.57Å; M418-E1182 PolarHBondContact O-N 3.09Å; M418-E1182 VanDerWaalsContact O-O 3.12Å; M418-R1183 HydrophobicContact CE-CG 4.07Å; M418-R1183 HydrophobicContact SD-CB 3.78Å; M418-R1183 HydrophobicContact SD-CG 3.67Å
419	C	80.3	Confident	81.7	Confident	15.5 Å²	15.5	43.9 Å²	43.9	11%	0.105	25%	0.245	C	C	.	.	S	Bend	trans	-160	165.4	180	59.4	0	0	0	0	111.9	C423 R424 V427 E1182	C419-C423 HydrophobicContact CB-CB 4.34Å; C419-R424 VanDerWaalsContact SG-CA 3.56Å; C419-V427 HydrophobicContact CB-CB 4.22Å; C419-V427 HydrophobicContact CB-CG2 3.64Å; C419-E1182 PolarHBondContact N-O 3.25Å
420	P	73.1	Confident	81.4	Confident	24 Å²	24	43.4 Å²	43.4	16%	0.156	25%	0.25	C	C	.	.			trans	-54.1	150.2	163.3	-28.1	37.7	0	0	0	113.2	D422 C423 R424	P420-D422 VanDerWaalsContact C-N 3.27Å; P420-D422 WeakPolarHBondContact CB-OD1 3.23Å; P420-D422 PolarHBondContact O-N 2.9Å; P420-C423 PolarHBondContact O-N 3.34Å; P420-C423 VanDerWaalsContact O-N 3.08Å; P420-R424 PolarHBondContact O-N 3.03Å
421	V	73.5	Confident	80.9	Confident	131 Å²	131	44.5 Å²	44.5	79%	0.794	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-59.5	-35.3	-175.2	-178.6	0	0	0	0	112.7	C423 R424	V421-C423 VanDerWaalsContact C-N 3.26Å; V421-C423 PolarHBondContact O-N 2.9Å; V421-R424 PolarHBondContact O-N 3.05Å
422	D	70	Confident	80.5	Confident	105.5 Å²	105.5	47 Å²	47	56%	0.564	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-65.2	-24.1	177.8	-13.5	-53.6	0	0	0	113.5	P420	P420-D422 VanDerWaalsContact C-N 3.27Å; P420-D422 WeakPolarHBondContact CB-OD1 3.23Å; P420-D422 PolarHBondContact O-N 2.9Å
423	C	73.5	Confident	80.2	Confident	11 Å²	11	46.8 Å²	46.8	7%	0.074	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-106.8	6.8	-177.7	-60.2	0	0	0	0	112.8	C419 P420 V421 D425 S426 V427 H1178	C419-C423 HydrophobicContact CB-CB 4.34Å; P420-C423 PolarHBondContact O-N 3.34Å; P420-C423 VanDerWaalsContact O-N 3.08Å; V421-C423 VanDerWaalsContact C-N 3.26Å; V421-C423 PolarHBondContact O-N 2.9Å; C423-D425 VanDerWaalsContact C-N 3.26Å; C423-D425 PolarHBondContact O-N 3.1Å; C423-D425 VanDerWaalsContact O-N 3.16Å; C423-S426 PolarHBondContact O-N 3.3Å; C423-S426 VanDerWaalsContact O-N 3.15Å; C423-S426 PolarHBondContact O-OG 3.15Å; C423-V427 PolarHBondContact O-N 3.3Å; C423-V427 VanDerWaalsContact O-N 3.13Å; C423-H1178 PolarHBondContact SG-CD2 2.83Å; C423-H1178 PolarHBondContact SG-NE2 3.34Å
424	R	79	Confident	80.1	Confident	122.5 Å²	122.5	43.5 Å²	43.5	46%	0.462	24%	0.236	S	C	.	.	H	α-helix	trans	-54.8	-41.6	-176.9	-172.9	175.7	-177.7	-175.9	-1.2	112.5	E412 C419 P420 V421 N428	E412-R424 IonicContact OE1-CZ 3.76Å; E412-R424 IonicContact OE1-NH2 3.98Å; E412-R424 PolarHBondContact OE1-NH2 3.29Å; C419-R424 VanDerWaalsContact SG-CA 3.56Å; P420-R424 PolarHBondContact O-N 3.03Å; V421-R424 PolarHBondContact O-N 3.05Å; R424-N428 VanDerWaalsContact O-CB 3.24Å; R424-N428 WeakPolarHBondContact O-CB 3.43Å; R424-N428 PolarHBondContact O-N 3.38Å; R424-N428 PolarHBondContact O-ND2 3.16Å; R424-N428 PolarHBondContact O-OD1 3.01Å
425	D	78.6	Confident	79.9	Confident	42.5 Å²	42.5	44.6 Å²	44.6	23%	0.227	24%	0.243	C	C	.	.	H	α-helix	trans	-72.7	-31.8	-176.3	-61.8	-35.4	0	0	0	113	C423 L429 K1051 F1052	C423-D425 VanDerWaalsContact C-N 3.26Å; C423-D425 PolarHBondContact O-N 3.1Å; C423-D425 VanDerWaalsContact O-N 3.16Å; D425-L429 WeakPolarHBondContact O-CB 3.4Å; D425-L429 PolarHBondContact O-N 3.08Å; D425-K1051 HydrophobicContact CB-CD 3.88Å; D425-K1051 VanDerWaalsContact OD2-CD 3.24Å; D425-K1051 WeakPolarHBondContact OD2-CD 3.29Å; D425-K1051 WeakPolarHBondContact OD2-CE 3.31Å; D425-K1051 IonicContact OD2-NZ 3.96Å; D425-K1051 PolarHBondContact OD2-NZ 2.96Å; D425-F1052 HydrophobicContact CB-CE2 3.94Å; D425-F1052 HydrophobicContact CB-CZ 4.29Å; D425-F1052 VanDerWaalsContact O-CE2 3.28Å; D425-F1052 WeakPolarHBondContact O-CE2 3.45Å; D425-F1052 WeakPolarHBondContact O-CZ 3.36Å
426	S	77.5	Confident	79.7	Confident	10.5 Å²	10.5	45 Å²	45	7%	0.073	24%	0.235	C	C	.	.	H	α-helix	trans	-71.2	-40.2	176.4	53.2	0	0	0	0	111.6	C423 L429 T430 S1175 G1177	C423-S426 PolarHBondContact O-N 3.3Å; C423-S426 VanDerWaalsContact O-N 3.15Å; C423-S426 PolarHBondContact O-OG 3.15Å; S426-L429 WeakPolarHBondContact O-CB 3.43Å; S426-L429 PolarHBondContact O-N 3.29Å; S426-T430 PolarHBondContact O-N 3.13Å; S426-T430 VanDerWaalsContact O-N 3.11Å; S426-T430 PolarHBondContact O-OG1 3.28Å; S426-T430 VanDerWaalsContact O-OG1 3.12Å; S426-S1175 PolarHBondContact OG-O 3.13Å; S426-S1175 VanDerWaalsContact OG-O 3.07Å; S426-G1177 WeakPolarHBondContact OG-CA 3.19Å
427	V	80.6	Confident	79.5	Confident	9 Å²	9	46.8 Å²	46.8	6%	0.055	24%	0.242	C	C	.	.	H	α-helix	trans	-67.8	-39.7	173.6	173.5	0	0	0	0	111.7	M418 C419 C423 L429 T430 F431 L1181	M418-V427 HydrophobicContact CB-CG1 4.36Å; C419-V427 HydrophobicContact CB-CB 4.22Å; C419-V427 HydrophobicContact CB-CG2 3.64Å; C423-V427 PolarHBondContact O-N 3.3Å; C423-V427 VanDerWaalsContact O-N 3.13Å; V427-L429 VanDerWaalsContact C-N 3.28Å; V427-L429 PolarHBondContact O-N 3.28Å; V427-T430 VanDerWaalsContact O-CB 3.31Å; V427-T430 WeakPolarHBondContact O-CB 3.33Å; V427-T430 PolarHBondContact O-N 3.28Å; V427-T430 VanDerWaalsContact O-N 3.14Å; V427-F431 HydrophobicContact CG1-CD2 3.96Å; V427-F431 HydrophobicContact CG1-CE2 3.4Å; V427-F431 VanDerWaalsContact CG1-CE2 3.48Å; V427-F431 HydrophobicContact CG1-CZ 4.08Å; V427-F431 WeakPolarHBondContact O-CD2 3.2Å; V427-F431 PolarHBondContact O-N 3.21Å; V427-F431 VanDerWaalsContact O-N 3.14Å; V427-L1181 HydrophobicContact CG1-CD2 3.9Å; V427-L1181 HydrophobicContact CG2-CD2 4.37Å
428	N	81.6	Confident	79.5	Confident	42.5 Å²	42.5	46.6 Å²	46.6	23%	0.227	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-36.1	174.2	-75.8	-10.9	0	0	0	112.4	R424 T430 F431 Y432 L1048	R424-N428 VanDerWaalsContact O-CB 3.24Å; R424-N428 WeakPolarHBondContact O-CB 3.43Å; R424-N428 PolarHBondContact O-N 3.38Å; R424-N428 PolarHBondContact O-ND2 3.16Å; R424-N428 PolarHBondContact O-OD1 3.01Å; N428-T430 VanDerWaalsContact C-N 3.32Å; N428-F431 PolarHBondContact O-N 3.34Å; N428-Y432 WeakPolarHBondContact O-CB 3.22Å; N428-Y432 PolarHBondContact O-N 3.04Å; N428-L1048 HydrophobicContact CB-CD2 4.12Å
429	L	82	Confident	79.8	Confident	29.5 Å²	29.5	46 Å²	46	15%	0.154	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-44	173.1	-177.9	72.6	0	0	0	110.8	D425 S426 V427 F431 Y432 L433 L1048 F1052 V1054	D425-L429 WeakPolarHBondContact O-CB 3.4Å; D425-L429 PolarHBondContact O-N 3.08Å; S426-L429 WeakPolarHBondContact O-CB 3.43Å; S426-L429 PolarHBondContact O-N 3.29Å; V427-L429 VanDerWaalsContact C-N 3.28Å; V427-L429 PolarHBondContact O-N 3.28Å; L429-F431 VanDerWaalsContact C-N 3.28Å; L429-F431 PolarHBondContact O-N 2.92Å; L429-Y432 WeakPolarHBondContact O-CA 3.33Å; L429-Y432 WeakPolarHBondContact O-CB 3.24Å; L429-Y432 PolarHBondContact O-N 3.17Å; L429-L433 HydrophobicContact CD1-CD1 4.23Å; L429-L433 HydrophobicContact CD1-CG 4.35Å; L429-L433 HydrophobicContact CD2-CD1 4.38Å; L429-L433 HydrophobicContact CG-CD1 3.95Å; L429-L433 HydrophobicContact CG-CG 4.38Å; L429-L433 WeakPolarHBondContact O-CG 3.42Å; L429-L433 PolarHBondContact O-N 2.93Å; L429-L1048 HydrophobicContact CB-CD2 4.23Å; L429-L1048 HydrophobicContact CD1-CD2 4.48Å; L429-F1052 HydrophobicContact CB-CD2 4.13Å; L429-F1052 HydrophobicContact CB-CE2 4Å; L429-F1052 HydrophobicContact CB-CZ 4.3Å; L429-F1052 HydrophobicContact CD1-CB 3.99Å; L429-F1052 HydrophobicContact CD1-CD2 4.05Å; L429-F1052 HydrophobicContact CD1-CG 4.02Å; L429-F1052 HydrophobicContact CD2-CB 4.2Å; L429-F1052 HydrophobicContact CD2-CD1 3.54Å; L429-F1052 HydrophobicContact CD2-CD2 4.1Å; L429-F1052 HydrophobicContact CD2-CE1 3.78Å; L429-F1052 HydrophobicContact CD2-CE2 4.34Å; L429-F1052 HydrophobicContact CD2-CG 3.69Å; L429-F1052 HydrophobicContact CD2-CZ 4.2Å; L429-F1052 HydrophobicContact CG-CD2 4.32Å; L429-F1052 HydrophobicContact CG-CG 4.3Å; L429-V1054 HydrophobicContact CD1-CG2 4.13Å
430	T	80.7	Confident	80.4	Confident	57 Å²	57	46.1 Å²	46.1	35%	0.35	24%	0.238	S	C	.	.	H	α-helix	trans	-56.5	-43.1	177.2	-55.6	0	0	0	0	111.7	S426 V427 N428 L433 L434 L442	S426-T430 PolarHBondContact O-N 3.13Å; S426-T430 VanDerWaalsContact O-N 3.11Å; S426-T430 PolarHBondContact O-OG1 3.28Å; S426-T430 VanDerWaalsContact O-OG1 3.12Å; V427-T430 VanDerWaalsContact O-CB 3.31Å; V427-T430 WeakPolarHBondContact O-CB 3.33Å; V427-T430 PolarHBondContact O-N 3.28Å; V427-T430 VanDerWaalsContact O-N 3.14Å; N428-T430 VanDerWaalsContact C-N 3.32Å; T430-L433 CarbonylContact O-C 3.57Å; T430-L433 PolarHBondContact O-N 3.16Å; T430-L434 PolarHBondContact O-N 3.18Å; T430-L442 HydrophobicContact CG2-CD1 3.99Å; T430-L442 HydrophobicContact CG2-CD2 3.14Å; T430-L442 HydrophobicContact CG2-CG 4.19Å; T430-L442 WeakPolarHBondContact O-CD1 3.23Å
431	F	81	Confident	81.3	Confident	37.5 Å²	37.5	50.5 Å²	50.5	16%	0.164	25%	0.253	C	S	.	.	H	α-helix	trans	-75.1	-25.7	175.9	-61.8	-48.3	0	0	0	113.9	L408 V427 N428 L429 L433 L434 L1181	L408-F431 HydrophobicContact CD1-CB 4.39Å; L408-F431 HydrophobicContact CD1-CD1 3.38Å; L408-F431 HydrophobicContact CD1-CD2 4.35Å; L408-F431 HydrophobicContact CD1-CE1 3.58Å; L408-F431 HydrophobicContact CD1-CE2 4.32Å; L408-F431 HydrophobicContact CD1-CG 3.8Å; L408-F431 HydrophobicContact CD1-CZ 4.15Å; L408-F431 HydrophobicContact CD2-CD1 4.28Å; L408-F431 HydrophobicContact CD2-CD2 4.41Å; L408-F431 HydrophobicContact CD2-CE1 3.73Å; L408-F431 HydrophobicContact CD2-CE2 3.85Å; L408-F431 HydrophobicContact CD2-CZ 3.49Å; L408-F431 VanDerWaalsContact CD2-CZ 3.42Å; L408-F431 HydrophobicContact CG-CD1 4.46Å; L408-F431 HydrophobicContact CG-CE1 4.32Å; L408-F431 HydrophobicContact CG-CZ 4.39Å; V427-F431 HydrophobicContact CG1-CD2 3.96Å; V427-F431 HydrophobicContact CG1-CE2 3.4Å; V427-F431 VanDerWaalsContact CG1-CE2 3.48Å; V427-F431 HydrophobicContact CG1-CZ 4.08Å; V427-F431 WeakPolarHBondContact O-CD2 3.2Å; V427-F431 PolarHBondContact O-N 3.21Å; V427-F431 VanDerWaalsContact O-N 3.14Å; N428-F431 PolarHBondContact O-N 3.34Å; L429-F431 VanDerWaalsContact C-N 3.28Å; L429-F431 PolarHBondContact O-N 2.92Å; F431-L433 VanDerWaalsContact C-N 3.32Å; F431-L434 VanDerWaalsContact O-CB 3.27Å; F431-L434 WeakPolarHBondContact O-CB 3.24Å; F431-L434 PolarHBondContact O-N 3.43Å; F431-L1181 HydrophobicContact CZ-CD1 4.02Å; F431-L1181 HydrophobicContact CZ-CD2 4.36Å
432	Y	79.9	Confident	82.1	Confident	55 Å²	55	44.7 Å²	44.7	22%	0.216	22%	0.217	C	C	.	.	H	α-helix	trans	-67.9	-35.5	171.7	-178.9	-91.4	0	0	0	111.6	N428 L429 L434 R1044 R1045 L1048 V1054 T1059	N428-Y432 WeakPolarHBondContact O-CB 3.22Å; N428-Y432 PolarHBondContact O-N 3.04Å; L429-Y432 WeakPolarHBondContact O-CA 3.33Å; L429-Y432 WeakPolarHBondContact O-CB 3.24Å; L429-Y432 PolarHBondContact O-N 3.17Å; Y432-L434 VanDerWaalsContact C-N 3.27Å; Y432-L434 PolarHBondContact O-N 3.23Å; Y432-R1044 HydrophobicContact CD2-CG 4.13Å; Y432-R1045 HydrophobicContact CE2-CG 3.85Å; Y432-R1045 WeakPolarHBondContact OH-CG 3.31Å; Y432-L1048 HydrophobicContact CD1-CD1 4.18Å; Y432-L1048 HydrophobicContact CD2-CD1 3.61Å; Y432-L1048 HydrophobicContact CE2-CD1 4.42Å; Y432-L1048 HydrophobicContact CG-CD1 3.46Å; Y432-V1054 HydrophobicContact CD1-CG1 4.23Å; Y432-V1054 HydrophobicContact CE1-CG1 3.39Å; Y432-V1054 VanDerWaalsContact CE1-CG1 3.48Å; Y432-T1059 HydrophobicContact CE1-CG2 4.25Å
433	L	78.4	Confident	83.3	Confident	82 Å²	82	39.7 Å²	39.7	43%	0.429	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	17.1	175.9	-59.4	175.3	0	0	0	112.9	L429 T430 F431 D435 T438	L429-L433 HydrophobicContact CD1-CD1 4.23Å; L429-L433 HydrophobicContact CD1-CG 4.35Å; L429-L433 HydrophobicContact CD2-CD1 4.38Å; L429-L433 HydrophobicContact CG-CD1 3.95Å; L429-L433 HydrophobicContact CG-CG 4.38Å; L429-L433 WeakPolarHBondContact O-CG 3.42Å; L429-L433 PolarHBondContact O-N 2.93Å; T430-L433 CarbonylContact O-C 3.57Å; T430-L433 PolarHBondContact O-N 3.16Å; F431-L433 VanDerWaalsContact C-N 3.32Å; L433-D435 PolarHBondContact O-N 3.25Å; L433-T438 PolarHBondContact O-OG1 3.05Å
434	L	85.4	Confident	84.3	Confident	9 Å²	9	40.2 Å²	40.2	5%	0.047	20%	0.196	C	C	.	.			trans	-69.1	105.8	173.8	175.2	63.9	0	0	0	109.7	M401 L404 K405 T430 F431 Y432 W439 L442	M401-L434 HydrophobicContact CE-CG 4.43Å; M401-L434 VanDerWaalsContact CE-O 3.28Å; M401-L434 WeakPolarHBondContact CE-O 3.32Å; M401-L434 HydrophobicContact CG-CD1 4.29Å; M401-L434 HydrophobicContact CG-CG 4.34Å; L404-L434 HydrophobicContact CD2-CD1 4.03Å; L404-L434 HydrophobicContact CD2-CD2 4Å; L404-L434 HydrophobicContact CG-CD2 4.31Å; K405-L434 HydrophobicContact CD-CD2 4.26Å; K405-L434 HydrophobicContact CG-CD2 3.65Å; T430-L434 PolarHBondContact O-N 3.18Å; F431-L434 VanDerWaalsContact O-CB 3.27Å; F431-L434 WeakPolarHBondContact O-CB 3.24Å; F431-L434 PolarHBondContact O-N 3.43Å; Y432-L434 VanDerWaalsContact C-N 3.27Å; Y432-L434 PolarHBondContact O-N 3.23Å; L434-W439 VanDerWaalsContact CD1-CA 3.49Å; L434-W439 HydrophobicContact CD1-CB 3.52Å; L434-W439 VanDerWaalsContact CD1-CB 3.49Å; L434-L442 HydrophobicContact CB-CD1 4.07Å; L434-L442 HydrophobicContact CD1-CB 4.22Å; L434-L442 HydrophobicContact CD1-CD1 3.73Å; L434-L442 HydrophobicContact CD1-CG 4.5Å; L434-L442 HydrophobicContact CG-CD1 4.48Å
435	D	82.8	Confident	84.9	Confident	55 Å²	55	35.7 Å²	35.7	29%	0.294	18%	0.181	S	C	.	.			trans	-132.6	-176.5	-175.9	68.3	22.5	0	0	0	112	M401 L433 F437 T438 W439 Y1064	M401-D435 VanDerWaalsContact SD-C 3.51Å; L433-D435 PolarHBondContact O-N 3.25Å; D435-F437 PolarHBondContact O-N 2.94Å; D435-F437 VanDerWaalsContact O-N 3.12Å; D435-F437 WeakPolarHBondContact OD1-CA 3.39Å; D435-F437 PolarHBondContact OD1-N 3.37Å; D435-T438 PolarHBondContact N-OG1 3.27Å; D435-T438 PolarHBondContact O-N 3.32Å; D435-T438 WeakPolarHBondContact OD1-CB 3.48Å; D435-T438 WeakPolarHBondContact OD1-CG2 3.25Å; D435-T438 PolarHBondContact OD1-N 3.14Å; D435-T438 PolarHBondContact OD1-OG1 3.37Å; D435-W439 WeakPolarHBondContact O-CB 3.35Å; D435-W439 PolarHBondContact O-N 3.35Å; D435-W439 VanDerWaalsContact O-N 3.09Å; D435-Y1064 WeakPolarHBondContact OD2-CE2 3.49Å
436	R	80	Confident	85.5	Confident	36 Å²	36	33.7 Å²	33.7	14%	0.136	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.7	-179.4	123.6	175.9	-125.3	-179.2	1.1	113.9	N392 N394 A397 W439	N392-R436 PolarHBondContact ND2-O 2.84Å; N392-R436 PolarHBondContact O-NE 2.85Å; N392-R436 PolarHBondContact O-NH2 2.96Å; N394-R436 VanDerWaalsContact CG-CZ 3.41Å; N394-R436 VanDerWaalsContact CG-NH1 3.34Å; N394-R436 PolarHBondContact ND2-NH1 3.14Å; N394-R436 WeakPolarHBondContact OD1-CD 3.19Å; N394-R436 PolarHBondContact OD1-NE 3.17Å; N394-R436 VanDerWaalsContact OD1-NE 3.14Å; N394-R436 PolarHBondContact OD1-NH1 3.47Å; A397-R436 HydrophobicContact CB-CG 4.06Å; R436-W439 PolarHBondContact O-NE1 2.94Å
437	F	81.5	Confident	86.2	Confident	48.5 Å²	48.5	33.2 Å²	33.2	21%	0.213	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-29	-174.2	-56.2	-65.1	0	0	0	112.7	D435 Y1064 L1108 L1111	D435-F437 PolarHBondContact O-N 2.94Å; D435-F437 VanDerWaalsContact O-N 3.12Å; D435-F437 WeakPolarHBondContact OD1-CA 3.39Å; D435-F437 PolarHBondContact OD1-N 3.37Å; F437-Y1064 HydrophobicContact CB-CE2 4.32Å; F437-Y1064 HydrophobicContact CD2-CD1 4.14Å; F437-Y1064 AromaticContact CD2-CD2 3.49Å; F437-Y1064 HydrophobicContact CD2-CD2 3.49Å; F437-Y1064 VanDerWaalsContact CD2-CD2 3.49Å; F437-Y1064 HydrophobicContact CD2-CE1 4.36Å; F437-Y1064 AromaticContact CD2-CE2 3.75Å; F437-Y1064 HydrophobicContact CD2-CE2 3.75Å; F437-Y1064 AromaticContact CD2-CG 3.7Å; F437-Y1064 HydrophobicContact CD2-CG 3.7Å; F437-Y1064 HydrophobicContact CE2-CD1 4.48Å; F437-Y1064 AromaticContact CE2-CD2 3.94Å; F437-Y1064 HydrophobicContact CE2-CD2 3.94Å; F437-Y1064 AromaticContact CE2-CG 3.86Å; F437-Y1064 HydrophobicContact CE2-CG 3.86Å; F437-Y1064 HydrophobicContact CG-CE2 4.44Å; F437-L1108 HydrophobicContact CD1-CD1 3.37Å; F437-L1108 VanDerWaalsContact CD1-CD1 3.42Å; F437-L1108 HydrophobicContact CE1-CD1 3.82Å; F437-L1108 HydrophobicContact CG-CD1 4.3Å; F437-L1111 HydrophobicContact CD1-CD2 4.37Å; F437-L1111 HydrophobicContact CE1-CD2 3.47Å; F437-L1111 HydrophobicContact CE1-CG 4.41Å; F437-L1111 HydrophobicContact CE2-CD2 3.94Å; F437-L1111 HydrophobicContact CZ-CD2 3.22Å; F437-L1111 HydrophobicContact CZ-CG 4.28Å
438	T	85.5	Confident	86.6	Confident	41 Å²	41	34.9 Å²	34.9	25%	0.252	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-21.6	-176.8	59.7	0	0	0	0	113.3	L433 D435 Y441 L442	L433-T438 PolarHBondContact O-OG1 3.05Å; D435-T438 PolarHBondContact N-OG1 3.27Å; D435-T438 PolarHBondContact O-N 3.32Å; D435-T438 WeakPolarHBondContact OD1-CB 3.48Å; D435-T438 WeakPolarHBondContact OD1-CG2 3.25Å; D435-T438 PolarHBondContact OD1-N 3.14Å; D435-T438 PolarHBondContact OD1-OG1 3.37Å; T438-Y441 PolarHBondContact O-N 3.21Å; T438-L442 WeakPolarHBondContact O-CG 3.36Å; T438-L442 PolarHBondContact O-N 3.27Å; T438-L442 VanDerWaalsContact O-N 3.15Å
439	W	91.8	Very high	86.9	Confident	1 Å²	1	33 Å²	33	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-55.3	-37	-174.7	77.8	-97	0	0	0	115.7	N392 A397 H400 M401 L434 D435 R436 Y441 L442 L443 Y500 P501	N392-W439 WeakPolarHBondContact OD1-CZ2 3.47Å; N392-W439 PolarHBondContact OD1-NE1 3.31Å; A397-W439 VanDerWaalsContact CB-NE1 3.35Å; H400-W439 HydrophobicContact CB-CD2 4.05Å; H400-W439 HydrophobicContact CB-CE3 3.46Å; H400-W439 VanDerWaalsContact CB-CE3 3.46Å; H400-W439 HydrophobicContact CB-CH2 3.99Å; H400-W439 HydrophobicContact CB-CZ3 3.41Å; H400-W439 VanDerWaalsContact CB-CZ3 3.41Å; H400-W439 AromaticContact CD2-CZ3 3.53Å; H400-W439 AromaticContact CE1-CH2 3.9Å; H400-W439 AromaticContact CG-CE3 3.87Å; H400-W439 AromaticContact CG-CH2 3.56Å; H400-W439 AromaticContact CG-CZ3 3.25Å; H400-W439 AromaticContact ND1-CH2 3.5Å; H400-W439 WeakPolarHBondContact ND1-CH2 3.43Å; H400-W439 AromaticContact ND1-CZ3 3.73Å; M401-W439 HydrophobicContact CG-CB 3.52Å; M401-W439 HydrophobicContact CG-CG 3.87Å; M401-W439 HydrophobicContact SD-CB 4.28Å; M401-W439 HydrophobicContact SD-CG 4.4Å; L434-W439 VanDerWaalsContact CD1-CA 3.49Å; L434-W439 HydrophobicContact CD1-CB 3.52Å; L434-W439 VanDerWaalsContact CD1-CB 3.49Å; D435-W439 WeakPolarHBondContact O-CB 3.35Å; D435-W439 PolarHBondContact O-N 3.35Å; D435-W439 VanDerWaalsContact O-N 3.09Å; R436-W439 PolarHBondContact O-NE1 2.94Å; W439-Y441 PolarHBondContact O-N 3.2Å; W439-L442 PolarHBondContact O-N 3.06Å; W439-L443 HydrophobicContact CE3-CB 4.38Å; W439-L443 HydrophobicContact CE3-CD2 4.13Å; W439-L443 HydrophobicContact CZ3-CD2 3.75Å; W439-L443 WeakPolarHBondContact O-CB 3.45Å; W439-L443 PolarHBondContact O-N 3.02Å; W439-Y500 HydrophobicContact CH2-CD1 4.1Å; W439-Y500 AromaticContact CH2-CE1 3.49Å; W439-Y500 HydrophobicContact CH2-CE1 3.49Å; W439-Y500 VanDerWaalsContact CH2-CE1 3.49Å; W439-Y500 HydrophobicContact CZ3-CD1 4.16Å; W439-Y500 AromaticContact CZ3-CE1 3.6Å; W439-Y500 HydrophobicContact CZ3-CE1 3.6Å; W439-P501 HydrophobicContact CH2-CB 3.96Å; W439-P501 HydrophobicContact CH2-CG 4.36Å; W439-P501 HydrophobicContact CZ2-CB 4.04Å; W439-P501 HydrophobicContact CZ2-CG 3.99Å
440	P	92.6	Very high	87.1	Confident	17.5 Å²	17.5	31.7 Å²	31.7	11%	0.114	16%	0.162	C	C	.	.	H	α-helix	trans	-64.7	-43.1	-177.8	-20	32.8	0	0	0	111.5	L443 A444 Y500 P501	P440-L443 PolarHBondContact O-N 2.86Å; P440-A444 WeakPolarHBondContact O-CB 3.27Å; P440-A444 PolarHBondContact O-N 2.99Å; P440-Y500 HydrophobicContact CB-CD1 4.44Å; P440-Y500 WeakPolarHBondContact CB-O 3.37Å; P440-P501 HydrophobicContact CG-CG 4.5Å
441	Y	90.7	Very high	87.5	Confident	118 Å²	118	32.3 Å²	32.3	46%	0.463	16%	0.159	S	C	.	.	H	α-helix	trans	-64.7	-43.3	176.7	174.7	-106.4	0	0	0	111.8	T438 W439 A444 N445 L1179	T438-Y441 PolarHBondContact O-N 3.21Å; W439-Y441 PolarHBondContact O-N 3.2Å; Y441-A444 PolarHBondContact O-N 3.04Å; Y441-N445 WeakPolarHBondContact CE1-ND2 3.32Å; Y441-N445 PolarHBondContact O-N 3.17Å; Y441-N445 PolarHBondContact OH-ND2 2.88Å; Y441-L1179 PolarHBondContact OH-O 2.94Å; Y441-L1179 VanDerWaalsContact OH-O 3.1Å
442	L	91.7	Very high	87.5	Confident	7.5 Å²	7.5	34.4 Å²	34.4	4%	0.039	18%	0.179	C	C	.	.	H	α-helix	trans	-68.2	-36.4	179.3	-61.8	-174.4	0	0	0	112.6	L404 T430 L434 T438 W439 Y446	L404-L442 HydrophobicContact CD2-CB 4.32Å; T430-L442 HydrophobicContact CG2-CD1 3.99Å; T430-L442 HydrophobicContact CG2-CD2 3.14Å; T430-L442 HydrophobicContact CG2-CG 4.19Å; T430-L442 WeakPolarHBondContact O-CD1 3.23Å; L434-L442 HydrophobicContact CB-CD1 4.07Å; L434-L442 HydrophobicContact CD1-CB 4.22Å; L434-L442 HydrophobicContact CD1-CD1 3.73Å; L434-L442 HydrophobicContact CD1-CG 4.5Å; L434-L442 HydrophobicContact CG-CD1 4.48Å; T438-L442 WeakPolarHBondContact O-CG 3.36Å; T438-L442 PolarHBondContact O-N 3.27Å; T438-L442 VanDerWaalsContact O-N 3.15Å; W439-L442 PolarHBondContact O-N 3.06Å; L442-Y446 VanDerWaalsContact O-CB 3.29Å; L442-Y446 WeakPolarHBondContact O-CB 3.4Å; L442-Y446 PolarHBondContact O-N 3.28Å
443	L	94.8	Very high	87.5	Confident	0.5 Å²	0.5	32.3 Å²	32.3	0%	0.003	17%	0.172	C	C	.	.	H	α-helix	trans	-64	-46.5	172.1	177.3	62.7	0	0	0	111.3	L404 W439 P440 N445 Y446 L447 L496 Y500 V511 L515	L404-L443 HydrophobicContact CD1-CD1 4.48Å; L404-L443 HydrophobicContact CD2-CB 4.39Å; W439-L443 HydrophobicContact CE3-CB 4.38Å; W439-L443 HydrophobicContact CE3-CD2 4.13Å; W439-L443 HydrophobicContact CZ3-CD2 3.75Å; W439-L443 WeakPolarHBondContact O-CB 3.45Å; W439-L443 PolarHBondContact O-N 3.02Å; P440-L443 PolarHBondContact O-N 2.86Å; L443-N445 VanDerWaalsContact C-N 3.31Å; L443-N445 PolarHBondContact O-N 3.12Å; L443-Y446 WeakPolarHBondContact O-CB 3.46Å; L443-Y446 PolarHBondContact O-N 3.06Å; L443-Y446 VanDerWaalsContact O-N 3.13Å; L443-L447 HydrophobicContact CD1-CD1 4.11Å; L443-L447 HydrophobicContact CD1-CD2 4.46Å; L443-L447 HydrophobicContact CD1-CG 3.97Å; L443-L447 HydrophobicContact CG-CD1 4.18Å; L443-L447 HydrophobicContact CG-CG 4.39Å; L443-L447 WeakPolarHBondContact O-CG 3.41Å; L443-L447 PolarHBondContact O-N 2.87Å; L443-L496 HydrophobicContact CD2-CD1 4.24Å; L443-L496 HydrophobicContact CG-CD1 4.09Å; L443-Y500 HydrophobicContact CD2-CE1 4.34Å; L443-V511 HydrophobicContact CD2-CG1 3.9Å; L443-L515 HydrophobicContact CD1-CD1 3.88Å; L443-L515 HydrophobicContact CD1-CD2 3.89Å; L443-L515 HydrophobicContact CD1-CG 4.43Å; L443-L515 HydrophobicContact CD2-CD1 4.18Å
444	A	94.1	Very high	87.7	Confident	22.5 Å²	22.5	29 Å²	29	19%	0.186	15%	0.154	C	C	.	.	H	α-helix	trans	-57.7	-46.9	177.2	0	0	0	0	0	111.6	P440 Y441 Y446 L447 S448 L496	P440-A444 WeakPolarHBondContact O-CB 3.27Å; P440-A444 PolarHBondContact O-N 2.99Å; Y441-A444 PolarHBondContact O-N 3.04Å; A444-Y446 VanDerWaalsContact C-N 3.32Å; A444-Y446 PolarHBondContact O-N 3.19Å; A444-L447 PolarHBondContact O-N 2.7Å; A444-S448 VanDerWaalsContact O-CB 3.28Å; A444-S448 WeakPolarHBondContact O-CB 3.48Å; A444-S448 PolarHBondContact O-N 3.01Å; A444-S448 PolarHBondContact O-OG 3.02Å; A444-S448 VanDerWaalsContact O-OG 3.14Å; A444-L496 HydrophobicContact CB-CB 4.13Å; A444-L496 HydrophobicContact CB-CD1 4.02Å; A444-L496 HydrophobicContact CB-CG 4.39Å
445	N	90.8	Very high	87.4	Confident	28 Å²	28	31.5 Å²	31.5	15%	0.15	18%	0.176	C	C	.	.	H	α-helix	trans	-60.6	-42.5	175.2	-80.3	-16.2	0	0	0	112.5	Y441 L443 S449 L1179 L1181	Y441-N445 WeakPolarHBondContact CE1-ND2 3.32Å; Y441-N445 PolarHBondContact O-N 3.17Å; Y441-N445 PolarHBondContact OH-ND2 2.88Å; L443-N445 VanDerWaalsContact C-N 3.31Å; L443-N445 PolarHBondContact O-N 3.12Å; N445-S449 WeakPolarHBondContact O-CB 3.29Å; N445-S449 PolarHBondContact O-N 3.13Å; N445-L1179 PolarHBondContact ND2-O 3.27Å; N445-L1179 PolarHBondContact OD1-O 2.99Å; N445-L1181 HydrophobicContact CB-CD1 4.13Å; N445-L1181 HydrophobicContact CB-CG 4.24Å
446	Y	91.5	Very high	87	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-50.2	178.2	179.7	-101.5	0	0	0	111.9	L404 L407 L408 D411 M418 L442 L443 A444 S448 S449 I450	L404-Y446 HydrophobicContact CD1-CD1 3.59Å; L404-Y446 HydrophobicContact CD1-CD2 4.08Å; L404-Y446 HydrophobicContact CD1-CE1 4.15Å; L404-Y446 HydrophobicContact CD1-CG 3.56Å; L407-Y446 HydrophobicContact CB-CE1 4.25Å; L407-Y446 WeakPolarHBondContact CB-OH 3.44Å; L407-Y446 HydrophobicContact CD1-CE1 4.02Å; L408-Y446 HydrophobicContact CD2-CD2 3.79Å; L408-Y446 HydrophobicContact CD2-CE2 3.79Å; L408-Y446 HydrophobicContact CG-CE2 4.47Å; D411-Y446 VanDerWaalsContact OD2-CE2 3.25Å; D411-Y446 WeakPolarHBondContact OD2-CE2 3.48Å; D411-Y446 PolarHBondContact OD2-OH 3.19Å; M418-Y446 HydrophobicContact CE-CD2 4.03Å; M418-Y446 HydrophobicContact CE-CE2 3.53Å; L442-Y446 VanDerWaalsContact O-CB 3.29Å; L442-Y446 WeakPolarHBondContact O-CB 3.4Å; L442-Y446 PolarHBondContact O-N 3.28Å; L443-Y446 WeakPolarHBondContact O-CB 3.46Å; L443-Y446 PolarHBondContact O-N 3.06Å; L443-Y446 VanDerWaalsContact O-N 3.13Å; A444-Y446 VanDerWaalsContact C-N 3.32Å; A444-Y446 PolarHBondContact O-N 3.19Å; Y446-S448 VanDerWaalsContact C-N 3.34Å; Y446-S448 PolarHBondContact O-N 3.06Å; Y446-S449 WeakPolarHBondContact O-CA 3.47Å; Y446-S449 WeakPolarHBondContact O-CB 3.41Å; Y446-S449 PolarHBondContact O-N 3.13Å; Y446-S449 VanDerWaalsContact O-N 3.09Å; Y446-S449 PolarHBondContact O-OG 3.31Å; Y446-I450 HydrophobicContact CD1-CD1 3.79Å; Y446-I450 HydrophobicContact CE1-CD1 3.22Å; Y446-I450 HydrophobicContact CE1-CG1 4.16Å; Y446-I450 HydrophobicContact CE2-CD1 4.47Å; Y446-I450 PolarHBondContact O-N 2.75Å
447	L	92.1	Very high	86.7	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-40	178.4	-68.1	-177.6	0	0	0	112.3	L443 A444 S449 I450 K451 F489 I494 L496 V511 L515	L443-L447 HydrophobicContact CD1-CD1 4.11Å; L443-L447 HydrophobicContact CD1-CD2 4.46Å; L443-L447 HydrophobicContact CD1-CG 3.97Å; L443-L447 HydrophobicContact CG-CD1 4.18Å; L443-L447 HydrophobicContact CG-CG 4.39Å; L443-L447 WeakPolarHBondContact O-CG 3.41Å; L443-L447 PolarHBondContact O-N 2.87Å; A444-L447 PolarHBondContact O-N 2.7Å; L447-S449 VanDerWaalsContact C-N 3.26Å; L447-S449 PolarHBondContact O-N 3.22Å; L447-I450 HydrophobicContact CD2-CD1 4.31Å; L447-I450 PolarHBondContact O-N 2.93Å; L447-K451 PolarHBondContact O-N 3.26Å; L447-F489 HydrophobicContact CD2-CE1 4.13Å; L447-F489 HydrophobicContact CD2-CE2 4.39Å; L447-F489 HydrophobicContact CD2-CZ 3.73Å; L447-I494 HydrophobicContact CB-CD1 4.1Å; L447-I494 HydrophobicContact CB-CG1 4.32Å; L447-I494 HydrophobicContact CB-CG2 4.47Å; L447-L496 HydrophobicContact CD1-CD1 3.86Å; L447-L496 HydrophobicContact CD1-CD2 3.85Å; L447-L496 HydrophobicContact CD1-CG 3.9Å; L447-V511 HydrophobicContact CD1-CG1 4.47Å; L447-L515 HydrophobicContact CD2-CD2 4.14Å
448	S	90.2	Very high	86.4	Confident	45 Å²	45	32.2 Å²	32.2	32%	0.315	18%	0.182	S	C	.	.	H	α-helix	trans	-59.5	-38.8	172.7	-65.1	0	0	0	0	111.6	A444 Y446 K451 S452	A444-S448 VanDerWaalsContact O-CB 3.28Å; A444-S448 WeakPolarHBondContact O-CB 3.48Å; A444-S448 PolarHBondContact O-N 3.01Å; A444-S448 PolarHBondContact O-OG 3.02Å; A444-S448 VanDerWaalsContact O-OG 3.14Å; Y446-S448 VanDerWaalsContact C-N 3.34Å; Y446-S448 PolarHBondContact O-N 3.06Å; S448-K451 PolarHBondContact O-N 2.79Å; S448-S452 WeakPolarHBondContact O-CB 3.37Å; S448-S452 PolarHBondContact O-N 3.2Å
449	S	87.6	Confident	85.8	Confident	1.5 Å²	1.5	35.5 Å²	35.5	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-41.5	176.4	86.8	0	0	0	0	112.2	N445 Y446 L447 S452 T453	N445-S449 WeakPolarHBondContact O-CB 3.29Å; N445-S449 PolarHBondContact O-N 3.13Å; Y446-S449 WeakPolarHBondContact O-CA 3.47Å; Y446-S449 WeakPolarHBondContact O-CB 3.41Å; Y446-S449 PolarHBondContact O-N 3.13Å; Y446-S449 VanDerWaalsContact O-N 3.09Å; Y446-S449 PolarHBondContact O-OG 3.31Å; L447-S449 VanDerWaalsContact C-N 3.26Å; L447-S449 PolarHBondContact O-N 3.22Å; S449-S452 PolarHBondContact O-N 2.95Å; S449-S452 PolarHBondContact O-OG 2.81Å; S449-T453 PolarHBondContact O-N 2.82Å; S449-T453 PolarHBondContact O-OG1 3.09Å
450	I	86.8	Confident	84.6	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-49.9	175.9	-61.7	170.5	0	0	0	110	Y446 L447 S452 T453 E454 T485 L518	Y446-I450 HydrophobicContact CD1-CD1 3.79Å; Y446-I450 HydrophobicContact CE1-CD1 3.22Å; Y446-I450 HydrophobicContact CE1-CG1 4.16Å; Y446-I450 HydrophobicContact CE2-CD1 4.47Å; Y446-I450 PolarHBondContact O-N 2.75Å; L447-I450 HydrophobicContact CD2-CD1 4.31Å; L447-I450 PolarHBondContact O-N 2.93Å; I450-S452 VanDerWaalsContact C-N 3.27Å; I450-S452 PolarHBondContact O-N 3.03Å; I450-T453 PolarHBondContact O-N 2.97Å; I450-T453 PolarHBondContact O-OG1 3.34Å; I450-E454 PolarHBondContact O-N 3.08Å; I450-T485 HydrophobicContact CB-CG2 4.2Å; I450-T485 HydrophobicContact CG2-CG2 3.43Å; I450-T485 VanDerWaalsContact CG2-CG2 3.43Å; I450-L518 HydrophobicContact CD1-CD1 4.01Å
451	K	87.1	Confident	83.4	Confident	69 Å²	69	37.5 Å²	37.5	30%	0.3	21%	0.214	S	C	.	.	H	α-helix	trans	-59.1	-39.1	179.6	-176.3	111.4	176.7	172.9	0	112	L447 S448 T453 E454 T485 S491 I494	L447-K451 PolarHBondContact O-N 3.26Å; S448-K451 PolarHBondContact O-N 2.79Å; K451-T453 VanDerWaalsContact C-N 3.26Å; K451-T453 PolarHBondContact O-N 3.37Å; K451-E454 IonicContact NZ-OE1 3.42Å; K451-E454 IonicContact NZ-OE2 2.84Å; K451-E454 PolarHBondContact NZ-OE2 3.14Å; K451-E454 VanDerWaalsContact O-CB 3.27Å; K451-E454 WeakPolarHBondContact O-CB 3.27Å; K451-E454 PolarHBondContact O-N 3.09Å; K451-E454 VanDerWaalsContact O-N 3.16Å; K451-T485 HydrophobicContact CB-CG2 4.47Å; K451-T485 VanDerWaalsContact CD-OG1 3.23Å; K451-T485 WeakPolarHBondContact CD-OG1 3.4Å; K451-S491 PolarHBondContact NZ-O 3.2Å; K451-I494 HydrophobicContact CB-CB 4.42Å; K451-I494 HydrophobicContact CB-CD1 4.43Å; K451-I494 HydrophobicContact CB-CG2 3.71Å; K451-I494 HydrophobicContact CD-CB 3.59Å; K451-I494 HydrophobicContact CD-CG2 3.57Å; K451-I494 WeakPolarHBondContact CE-O 3.41Å; K451-I494 HydrophobicContact CG-CB 4.34Å; K451-I494 HydrophobicContact CG-CG2 4.1Å; K451-I494 PolarHBondContact NZ-O 3.42Å
452	S	82.6	Confident	82.3	Confident	82 Å²	82	34.4 Å²	34.4	57%	0.573	21%	0.213	S	C	*	.	H	α-helix	trans	-63.6	-28.4	176.3	77	0	0	0	0	113.4	S448 S449 I450	S448-S452 WeakPolarHBondContact O-CB 3.37Å; S448-S452 PolarHBondContact O-N 3.2Å; S449-S452 PolarHBondContact O-N 2.95Å; S449-S452 PolarHBondContact O-OG 2.81Å; I450-S452 VanDerWaalsContact C-N 3.27Å; I450-S452 PolarHBondContact O-N 3.03Å
453	T	80.1	Confident	80.9	Confident	11.5 Å²	11.5	38.1 Å²	38.1	7%	0.071	23%	0.233	C	C	.	.	H	α-helix	trans	-89.5	-3	177.4	55	0	0	0	0	114.3	S449 I450 K451 A455 A456 A457 R1183	S449-T453 PolarHBondContact O-N 2.82Å; S449-T453 PolarHBondContact O-OG1 3.09Å; I450-T453 PolarHBondContact O-N 2.97Å; I450-T453 PolarHBondContact O-OG1 3.34Å; K451-T453 VanDerWaalsContact C-N 3.26Å; K451-T453 PolarHBondContact O-N 3.37Å; T453-A455 VanDerWaalsContact C-N 3.29Å; T453-A455 PolarHBondContact O-N 3.32Å; T453-A456 PolarHBondContact O-N 3.05Å; T453-A456 VanDerWaalsContact O-N 3.15Å; T453-A457 PolarHBondContact O-N 2.77Å; T453-R1183 HydrophobicContact CG2-CB 3.65Å; T453-R1183 HydrophobicContact CG2-CG 3.87Å; T453-R1183 VanDerWaalsContact CG2-O 3.26Å; T453-R1183 WeakPolarHBondContact CG2-O 3.44Å; T453-R1183 PolarHBondContact OG1-NH1 2.84Å
454	E	81.3	Confident	78.9	Confident	13 Å²	13	43 Å²	43	6%	0.061	26%	0.263	C	S	.	.	H	α-helix	trans	-59.8	-37.7	-175.6	-172.6	178.4	-144.7	0	0	112.5	I450 K451 A456 A457 R458 L484 T485 A486	I450-E454 PolarHBondContact O-N 3.08Å; K451-E454 IonicContact NZ-OE1 3.42Å; K451-E454 IonicContact NZ-OE2 2.84Å; K451-E454 PolarHBondContact NZ-OE2 3.14Å; K451-E454 VanDerWaalsContact O-CB 3.27Å; K451-E454 WeakPolarHBondContact O-CB 3.27Å; K451-E454 PolarHBondContact O-N 3.09Å; K451-E454 VanDerWaalsContact O-N 3.16Å; E454-A456 VanDerWaalsContact C-N 3.35Å; E454-A456 PolarHBondContact O-N 2.96Å; E454-A457 WeakPolarHBondContact O-CB 3.24Å; E454-A457 PolarHBondContact O-N 3.22Å; E454-R458 VanDerWaalsContact CD-CZ 3.44Å; E454-R458 WeakPolarHBondContact O-CG 3.47Å; E454-R458 PolarHBondContact O-N 3.31Å; E454-R458 IonicContact OE1-CZ 3.3Å; E454-R458 IonicContact OE1-NH2 3.08Å; E454-R458 PolarHBondContact OE1-NH2 3.33Å; E454-R458 IonicContact OE2-CZ 3.3Å; E454-R458 IonicContact OE2-NH1 3.2Å; E454-R458 PolarHBondContact OE2-NH1 3.02Å; E454-R458 IonicContact OE2-NH2 2.74Å; E454-R458 PolarHBondContact OE2-NH2 3.28Å; E454-R458 VanDerWaalsContact OE2-NH2 3.13Å; E454-L484 HydrophobicContact CG-CD2 4.2Å; E454-T485 PolarHBondContact OE1-N 3.17Å; E454-T485 VanDerWaalsContact OE1-N 3.11Å; E454-T485 PolarHBondContact OE1-OG1 3.19Å; E454-T485 PolarHBondContact OE2-OG1 3.07Å; E454-A486 VanDerWaalsContact OE1-CB 3.27Å; E454-A486 WeakPolarHBondContact OE1-CB 3.28Å; E454-A486 PolarHBondContact OE1-N 2.83Å
455	A	79.2	Confident	76.6	Confident	61.5 Å²	61.5	47.5 Å²	47.5	51%	0.508	29%	0.288	S	S	.	.	H	α-helix	trans	-63.4	-41.5	177	0	0	0	0	0	112.3	T453 R458 L459	T453-A455 VanDerWaalsContact C-N 3.29Å; T453-A455 PolarHBondContact O-N 3.32Å; A455-R458 PolarHBondContact O-N 2.85Å; A455-L459 WeakPolarHBondContact O-CG 3.22Å; A455-L459 PolarHBondContact O-N 3.43Å; A455-L459 VanDerWaalsContact O-N 3.11Å
456	A	74.6	Confident	74.2	Confident	32.5 Å²	32.5	51.5 Å²	51.5	27%	0.269	31%	0.314	S	S	.	.	H	α-helix	trans	-67.9	-40.3	175.7	0	0	0	0	0	111.2	T453 E454 R458 L459 S460	T453-A456 PolarHBondContact O-N 3.05Å; T453-A456 VanDerWaalsContact O-N 3.15Å; E454-A456 VanDerWaalsContact C-N 3.35Å; E454-A456 PolarHBondContact O-N 2.96Å; A456-R458 PolarHBondContact O-N 3.26Å; A456-L459 PolarHBondContact O-N 3.17Å; A456-S460 WeakPolarHBondContact O-CB 3.29Å; A456-S460 PolarHBondContact O-N 2.87Å; A456-S460 PolarHBondContact O-OG 2.72Å
457	A	74.5	Confident	71.4	Confident	8 Å²	8	54.9 Å²	54.9	7%	0.066	34%	0.341	C	S	.	.	H	α-helix	trans	-58.9	-46.9	174.1	0	0	0	0	0	111.4	T453 E454 L459 S460 A461 D481 L484	T453-A457 PolarHBondContact O-N 2.77Å; E454-A457 WeakPolarHBondContact O-CB 3.24Å; E454-A457 PolarHBondContact O-N 3.22Å; A457-L459 PolarHBondContact O-N 3.23Å; A457-S460 PolarHBondContact O-N 3.43Å; A457-S460 PolarHBondContact O-OG 3.48Å; A457-A461 WeakPolarHBondContact O-CB 3.26Å; A457-A461 PolarHBondContact O-N 3.45Å; A457-D481 VanDerWaalsContact CB-O 3.27Å; A457-D481 WeakPolarHBondContact CB-O 3.41Å; A457-L484 HydrophobicContact CB-CD2 4.39Å
458	R	74.4	Confident	68.6	Low	113 Å²	113	60 Å²	60	43%	0.426	38%	0.384	S	S	.	.	H	α-helix	trans	-57.3	-45.6	175.2	-74.1	-176.3	-173.7	122.2	4.4	112.5	E454 A455 A456 A461 A462 L484	E454-R458 VanDerWaalsContact CD-CZ 3.44Å; E454-R458 WeakPolarHBondContact O-CG 3.47Å; E454-R458 PolarHBondContact O-N 3.31Å; E454-R458 IonicContact OE1-CZ 3.3Å; E454-R458 IonicContact OE1-NH2 3.08Å; E454-R458 PolarHBondContact OE1-NH2 3.33Å; E454-R458 IonicContact OE2-CZ 3.3Å; E454-R458 IonicContact OE2-NH1 3.2Å; E454-R458 PolarHBondContact OE2-NH1 3.02Å; E454-R458 IonicContact OE2-NH2 2.74Å; E454-R458 PolarHBondContact OE2-NH2 3.28Å; E454-R458 VanDerWaalsContact OE2-NH2 3.13Å; A455-R458 PolarHBondContact O-N 2.85Å; A456-R458 PolarHBondContact O-N 3.26Å; R458-A461 PolarHBondContact O-N 3.19Å; R458-A462 WeakPolarHBondContact O-CB 3.4Å; R458-A462 PolarHBondContact O-N 3.16Å; R458-L484 HydrophobicContact CB-CD2 4.39Å; R458-L484 HydrophobicContact CG-CD1 4.4Å; R458-L484 HydrophobicContact CG-CD2 3.36Å; R458-L484 HydrophobicContact CG-CG 4.48Å
459	L	72.7	Confident	65.7	Low	109.5 Å²	109.5	61.4 Å²	61.4	57%	0.573	41%	0.405	S	S	*	.	H	α-helix	trans	-63.8	-42.7	177.7	-70.6	172.1	0	0	0	111.7	A455 A456 A457 A461 A462 N463	A455-L459 WeakPolarHBondContact O-CG 3.22Å; A455-L459 PolarHBondContact O-N 3.43Å; A455-L459 VanDerWaalsContact O-N 3.11Å; A456-L459 PolarHBondContact O-N 3.17Å; A457-L459 PolarHBondContact O-N 3.23Å; L459-A461 VanDerWaalsContact C-N 3.35Å; L459-A461 PolarHBondContact O-N 3.12Å; L459-A462 PolarHBondContact O-N 2.82Å; L459-N463 WeakPolarHBondContact O-CB 3.47Å; L459-N463 PolarHBondContact O-N 3.19Å; L459-N463 PolarHBondContact O-ND2 3.46Å
460	S	67.6	Low	62.9	Low	28.5 Å²	28.5	66.4 Å²	66.4	20%	0.199	44%	0.441	C	S	.	.	H	α-helix	trans	-63.5	-40.9	177.2	75	0	0	0	0	112.2	A456 A457 N463 T464	A456-S460 WeakPolarHBondContact O-CB 3.29Å; A456-S460 PolarHBondContact O-N 2.87Å; A456-S460 PolarHBondContact O-OG 2.72Å; A457-S460 PolarHBondContact O-N 3.43Å; A457-S460 PolarHBondContact O-OG 3.48Å; S460-N463 PolarHBondContact O-N 3.18Å; S460-T464 PolarHBondContact O-N 3.18Å; S460-T464 PolarHBondContact O-OG1 3.1Å
461	A	67	Low	60.2	Low	32 Å²	32	74.2 Å²	74.2	26%	0.264	49%	0.488	S	S	.	.	H	α-helix	trans	-65.4	-41.6	176.1	0	0	0	0	0	111.9	A457 R458 L459 N463 T464	A457-A461 WeakPolarHBondContact O-CB 3.26Å; A457-A461 PolarHBondContact O-N 3.45Å; R458-A461 PolarHBondContact O-N 3.19Å; L459-A461 VanDerWaalsContact C-N 3.35Å; L459-A461 PolarHBondContact O-N 3.12Å; A461-N463 VanDerWaalsContact C-N 3.34Å; A461-N463 PolarHBondContact O-N 3.24Å; A461-T464 VanDerWaalsContact C-OG1 3.28Å; A461-T464 WeakPolarHBondContact CA-OG1 3.19Å; A461-T464 WeakPolarHBondContact O-CB 3.4Å; A461-T464 PolarHBondContact O-N 3.23Å; A461-T464 VanDerWaalsContact O-N 3.13Å; A461-T464 PolarHBondContact O-OG1 3.15Å
462	A	68.1	Low	57.3	Low	53.5 Å²	53.5	73.9 Å²	73.9	44%	0.442	51%	0.505	S	S	.	.	H	α-helix	trans	-65	-36.2	176.2	0	0	0	0	0	112.7	R458 L459 T464 T465	R458-A462 WeakPolarHBondContact O-CB 3.4Å; R458-A462 PolarHBondContact O-N 3.16Å; L459-A462 PolarHBondContact O-N 2.82Å; A462-T464 PolarHBondContact O-N 2.92Å; A462-T465 PolarHBondContact O-N 3.06Å; A462-T465 PolarHBondContact O-OG1 3.1Å
463	N	62	Low	54.7	Low	86 Å²	86	72.5 Å²	72.5	46%	0.46	50%	0.503	S	S	.	.	H	α-helix	trans	-70.1	-27.2	176.8	-73	-18.3	0	0	0	112.5	L459 S460 A461 T465 T466	L459-N463 WeakPolarHBondContact O-CB 3.47Å; L459-N463 PolarHBondContact O-N 3.19Å; L459-N463 PolarHBondContact O-ND2 3.46Å; S460-N463 PolarHBondContact O-N 3.18Å; A461-N463 VanDerWaalsContact C-N 3.34Å; A461-N463 PolarHBondContact O-N 3.24Å; N463-T465 VanDerWaalsContact C-N 3.33Å; N463-T465 PolarHBondContact O-N 3.01Å; N463-T466 PolarHBondContact O-N 2.67Å; N463-T466 PolarHBondContact O-OG1 3.14Å
464	T	52.5	Low	52.5	Low	102.5 Å²	102.5	78 Å²	78	63%	0.629	54%	0.539	S	S	*	.	H	α-helix	trans	-68.8	-27.2	179.3	-13.4	0	0	0	0	113.3	S460 A461 A462	S460-T464 PolarHBondContact O-N 3.18Å; S460-T464 PolarHBondContact O-OG1 3.1Å; A461-T464 VanDerWaalsContact C-OG1 3.28Å; A461-T464 WeakPolarHBondContact CA-OG1 3.19Å; A461-T464 WeakPolarHBondContact O-CB 3.4Å; A461-T464 PolarHBondContact O-N 3.23Å; A461-T464 VanDerWaalsContact O-N 3.13Å; A461-T464 PolarHBondContact O-OG1 3.15Å; A462-T464 PolarHBondContact O-N 2.92Å
465	T	46	Very low	50.2	Low	116.5 Å²	116.5	84 Å²	84	72%	0.715	58%	0.577	S	S	*	*	H	α-helix	trans	-80.8	-21.5	-179.6	54.6	0	0	0	0	113.7	A462 N463	A462-T465 PolarHBondContact O-N 3.06Å; A462-T465 PolarHBondContact O-OG1 3.1Å; N463-T465 VanDerWaalsContact C-N 3.33Å; N463-T465 PolarHBondContact O-N 3.01Å
466	T	40.5	Very low	48.3	Very low	114 Å²	114	83.9 Å²	83.9	70%	0.699	58%	0.582	S	S	*	*	H	α-helix	trans	-91.1	-16.9	-178	55.5	0	0	0	0	113.9	N463 A468	N463-T466 PolarHBondContact O-N 2.67Å; N463-T466 PolarHBondContact O-OG1 3.14Å; T466-A468 VanDerWaalsContact C-N 3.34Å; T466-A468 PolarHBondContact O-N 3.21Å
467	A	33.1	Very low	46.8	Very low	69.5 Å²	69.5	84.7 Å²	84.7	57%	0.574	59%	0.585	S	S	*	*			trans	-91.4	53	-178.6	0	0	0	0	0	113.3	G469	A467-G469 PolarHBondContact O-N 2.94Å
468	A	32	Very low	45.2	Very low	107 Å²	107	86.1 Å²	86.1	88%	0.884	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	16.6	174.6	0	0	0	0	0	114.6	T466	T466-A468 VanDerWaalsContact C-N 3.34Å; T466-A468 PolarHBondContact O-N 3.21Å
469	G	29.1	Very low	44.1	Very low	74.5 Å²	74.5	80.7 Å²	80.7	77%	0.768	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-0.6	-171.6	0	0	0	0	0	116.6	A467	A467-G469 PolarHBondContact O-N 2.94Å
470	S	28.7	Very low	43.1	Very low	108 Å²	108	75.7 Å²	75.7	76%	0.755	55%	0.554	S	S	*	*	S	Bend	trans	-129.4	111.8	179.6	-108.2	0	0	0	0	110.9	G472	S470-G472 VanDerWaalsContact C-N 3.26Å; S470-G472 PolarHBondContact O-N 3.34Å
471	V	30.1	Very low	42.4	Very low	165.5 Å²	165.5	74.7 Å²	74.7	100%	1.003	55%	0.547	S	S	*	.			trans	-68.9	77.8	178.3	-178.4	0	0	0	0	109.1
472	G	26.4	Very low	42.1	Very low	63.5 Å²	63.5	77.5 Å²	77.5	66%	0.655	56%	0.557	S	S	*	*			trans	-157.1	82.8	173.9	0	0	0	0	0	107.5	S470	S470-G472 VanDerWaalsContact C-N 3.26Å; S470-G472 PolarHBondContact O-N 3.34Å
473	G	28	Very low	41.9	Very low	53 Å²	53	76.3 Å²	76.3	55%	0.546	54%	0.544	S	S	.	.			trans	-56.5	161.4	177	0	0	0	0	0	112	T475	G473-T475 VanDerWaalsContact C-N 3.28Å; G473-T475 PolarHBondContact O-N 3.04Å
474	P	34.6	Very low	42.1	Very low	125.5 Å²	125.5	75 Å²	75	82%	0.815	54%	0.536	S	S	*	.			trans	-72.3	75.8	-170.6	30.8	-34.5	0	0	0	111.2	G476	P474-G476 PolarHBondContact O-N 3.16Å
475	T	33.1	Very low	43	Very low	140 Å²	140	70.3 Å²	70.3	86%	0.859	51%	0.507	S	S	*	.			trans	-90.6	85.7	170	59.6	0	0	0	0	107.8	G473	G473-T475 VanDerWaalsContact C-N 3.28Å; G473-T475 PolarHBondContact O-N 3.04Å
476	G	38.7	Very low	44	Very low	59.5 Å²	59.5	67.6 Å²	67.6	61%	0.613	50%	0.497	S	S	*	.	S	Bend	trans	165.6	-37.5	163.6	0	0	0	0	0	118.6	P474	P474-G476 PolarHBondContact O-N 3.16Å
477	S	43.2	Very low	45.7	Very low	49.5 Å²	49.5	66 Å²	66	35%	0.346	50%	0.496	S	S	.	.			trans	-114.5	37.5	-167.9	72.4	0	0	0	0	114.2	G479	S477-G479 VanDerWaalsContact C-N 3.31Å; S477-G479 PolarHBondContact O-N 3.47Å
478	G	41.2	Very low	48.1	Very low	36.5 Å²	36.5	64.6 Å²	64.6	38%	0.376	48%	0.478	S	S	.	.			trans	-70.6	3.7	-178.1	0	0	0	0	0	115.6
479	G	52	Low	50.8	Low	1 Å²	1	59.9 Å²	59.9	1%	0.01	44%	0.438	C	S	.	.	S	Bend	trans	-83.4	148.2	179.6	0	0	0	0	0	112.5	E410 N414 S477 D481	E410-G479 WeakPolarHBondContact OE1-CA 3.35Å; N414-G479 VanDerWaalsContact ND2-CA 3.27Å; N414-G479 WeakPolarHBondContact ND2-CA 3.44Å; N414-G479 PolarHBondContact ND2-N 2.98Å; N414-G479 PolarHBondContact ND2-O 2.98Å; S477-G479 VanDerWaalsContact C-N 3.31Å; S477-G479 PolarHBondContact O-N 3.47Å; G479-D481 PolarHBondContact O-N 3.22Å
480	A	51.2	Low	53.5	Low	3.5 Å²	3.5	59 Å²	59	3%	0.029	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	2.9	-13	173.5	0	0	0	0	0	116.7	I482 V483 L518	A480-I482 VanDerWaalsContact C-N 3.33Å; A480-I482 PolarHBondContact O-N 2.93Å; A480-V483 VanDerWaalsContact O-CB 3.28Å; A480-V483 WeakPolarHBondContact O-CB 3.34Å; A480-V483 PolarHBondContact O-N 2.97Å; A480-L518 HydrophobicContact CB-CD2 4.22Å
481	D	54.2	Low	56	Low	7.5 Å²	7.5	58.7 Å²	58.7	4%	0.04	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-28.8	-173.3	-69.9	-13.9	0	0	0	114	T416 A457 G479 V483 R1183 T1185	T416-D481 PolarHBondContact OG1-OD1 3.24Å; T416-D481 VanDerWaalsContact OG1-OD1 3.1Å; T416-D481 PolarHBondContact OG1-OD2 3.05Å; T416-D481 VanDerWaalsContact OG1-OD2 3.09Å; A457-D481 VanDerWaalsContact CB-O 3.27Å; A457-D481 WeakPolarHBondContact CB-O 3.41Å; G479-D481 PolarHBondContact O-N 3.22Å; D481-V483 VanDerWaalsContact C-N 3.33Å; D481-R1183 IonicContact OD1-CZ 3.72Å; D481-R1183 IonicContact OD1-NH1 2.55Å; D481-R1183 PolarHBondContact OD1-NH1 3.12Å; D481-R1183 IonicContact OD1-NH2 2.79Å; D481-R1183 PolarHBondContact OD1-NH2 3.37Å; D481-T1185 HydrophobicContact CB-CG2 4.05Å; D481-T1185 VanDerWaalsContact CG-CG2 3.45Å; D481-T1185 VanDerWaalsContact OD1-CG2 3.28Å; D481-T1185 WeakPolarHBondContact OD1-CG2 3.45Å
482	I	59.6	Low	58.6	Low	91.5 Å²	91.5	57.2 Å²	57.2	47%	0.469	40%	0.403	S	S	.	.	S	Bend	trans	-88	-9.8	175.6	-56.8	172.7	0	0	0	110.8	A480 L484	A480-I482 VanDerWaalsContact C-N 3.33Å; A480-I482 PolarHBondContact O-N 2.93Å; I482-L484 PolarHBondContact O-N 3.39Å
483	V	64.3	Low	61.7	Low	27.5 Å²	27.5	55.1 Å²	55.1	17%	0.167	38%	0.377	C	S	.	.			trans	-77.8	119.1	-169.2	-179.4	0	0	0	0	110.9	A480 D481 L488 L518 A521	A480-V483 VanDerWaalsContact O-CB 3.28Å; A480-V483 WeakPolarHBondContact O-CB 3.34Å; A480-V483 PolarHBondContact O-N 2.97Å; D481-V483 VanDerWaalsContact C-N 3.33Å; V483-L488 HydrophobicContact CG1-CD1 3.17Å; V483-L488 HydrophobicContact CG1-CG 3.74Å; V483-L518 HydrophobicContact CB-CD2 4.04Å; V483-L518 HydrophobicContact CG1-CD2 3.62Å; V483-L518 HydrophobicContact CG2-CD2 4.29Å; V483-A521 HydrophobicContact CG2-CB 4.49Å
484	L	65.3	Low	64.6	Low	58.5 Å²	58.5	53.1 Å²	53.1	31%	0.306	35%	0.353	S	S	.	.			trans	-82	117.2	174.8	-59.9	-179.2	0	0	0	109.6	E454 A457 R458 I482 A486 A487	E454-L484 HydrophobicContact CG-CD2 4.2Å; A457-L484 HydrophobicContact CB-CD2 4.39Å; R458-L484 HydrophobicContact CB-CD2 4.39Å; R458-L484 HydrophobicContact CG-CD1 4.4Å; R458-L484 HydrophobicContact CG-CD2 3.36Å; R458-L484 HydrophobicContact CG-CG 4.48Å; I482-L484 PolarHBondContact O-N 3.39Å; L484-A486 PolarHBondContact O-N 3.32Å; L484-A487 HydrophobicContact CB-CB 4.36Å; L484-A487 WeakPolarHBondContact O-CB 3.42Å; L484-A487 PolarHBondContact O-N 3.21Å
485	T	72.5	Confident	67.2	Low	4 Å²	4	52 Å²	52	3%	0.025	35%	0.346	C	S	.	.	H	α-helix	trans	-56.3	-35.6	177.1	36.4	0	0	0	0	112.6	I450 K451 E454 A487 L488 F489 I494	I450-T485 HydrophobicContact CB-CG2 4.2Å; I450-T485 HydrophobicContact CG2-CG2 3.43Å; I450-T485 VanDerWaalsContact CG2-CG2 3.43Å; K451-T485 HydrophobicContact CB-CG2 4.47Å; K451-T485 VanDerWaalsContact CD-OG1 3.23Å; K451-T485 WeakPolarHBondContact CD-OG1 3.4Å; E454-T485 PolarHBondContact OE1-N 3.17Å; E454-T485 VanDerWaalsContact OE1-N 3.11Å; E454-T485 PolarHBondContact OE1-OG1 3.19Å; E454-T485 PolarHBondContact OE2-OG1 3.07Å; T485-A487 PolarHBondContact O-N 2.96Å; T485-L488 PolarHBondContact O-N 3.47Å; T485-L488 VanDerWaalsContact O-N 3.08Å; T485-F489 HydrophobicContact CG2-CD2 4.02Å; T485-F489 HydrophobicContact CG2-CE2 4.25Å; T485-F489 PolarHBondContact O-N 3.23Å; T485-I494 HydrophobicContact CG2-CD1 4.11Å
486	A	66.8	Low	70	Confident	60 Å²	60	46 Å²	46	50%	0.496	31%	0.308	S	S	.	.	H	α-helix	trans	-61.4	-21.9	177	0	0	0	0	0	113.9	E454 L484	E454-A486 VanDerWaalsContact OE1-CB 3.27Å; E454-A486 WeakPolarHBondContact OE1-CB 3.28Å; E454-A486 PolarHBondContact OE1-N 2.83Å; L484-A486 PolarHBondContact O-N 3.32Å
487	A	76.6	Confident	72.5	Confident	81.5 Å²	81.5	46.9 Å²	46.9	67%	0.674	30%	0.299	S	S	*	.	H	α-helix	trans	-88.2	-21.6	176.3	0	0	0	0	0	113	L484 T485	L484-A487 HydrophobicContact CB-CB 4.36Å; L484-A487 WeakPolarHBondContact O-CB 3.42Å; L484-A487 PolarHBondContact O-N 3.21Å; T485-A487 PolarHBondContact O-N 2.96Å
488	L	82.4	Confident	74.6	Confident	39 Å²	39	50.5 Å²	50.5	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-108.5	-27.5	-173.8	-64.1	-162.7	0	0	0	114.2	V483 T485 G514 L518	V483-L488 HydrophobicContact CG1-CD1 3.17Å; V483-L488 HydrophobicContact CG1-CG 3.74Å; T485-L488 PolarHBondContact O-N 3.47Å; T485-L488 VanDerWaalsContact O-N 3.08Å; L488-G514 WeakPolarHBondContact O-CA 3.45Å; L488-L518 HydrophobicContact CD1-CD2 3.79Å; L488-L518 HydrophobicContact CD1-CG 3.74Å
489	F	88.9	Confident	76.8	Confident	7.5 Å²	7.5	53.5 Å²	53.5	3%	0.033	33%	0.329	C	S	.	.	S	Bend	trans	-125.3	142	-176.4	-58.2	-85.4	0	0	0	109.1	L447 T485 S491 L493 I494 G514 L518	L447-F489 HydrophobicContact CD2-CE1 4.13Å; L447-F489 HydrophobicContact CD2-CE2 4.39Å; L447-F489 HydrophobicContact CD2-CZ 3.73Å; T485-F489 HydrophobicContact CG2-CD2 4.02Å; T485-F489 HydrophobicContact CG2-CE2 4.25Å; T485-F489 PolarHBondContact O-N 3.23Å; F489-S491 PolarHBondContact O-N 3.48Å; F489-L493 HydrophobicContact CB-CD2 4.22Å; F489-L493 HydrophobicContact CD1-CD2 3.83Å; F489-L493 HydrophobicContact CG-CD2 4.49Å; F489-I494 HydrophobicContact CB-CD1 4.25Å; F489-I494 HydrophobicContact CD1-CD1 4.47Å; F489-I494 HydrophobicContact CD2-CD1 4.02Å; F489-I494 HydrophobicContact CE2-CD1 4.47Å; F489-I494 HydrophobicContact CG-CD1 4.02Å; F489-G514 VanDerWaalsContact CE1-CA 3.42Å; F489-L518 HydrophobicContact CE2-CD1 3.89Å; F489-L518 HydrophobicContact CE2-CG 4.39Å; F489-L518 HydrophobicContact CZ-CD1 3.7Å; F489-L518 HydrophobicContact CZ-CG 4.42Å
490	P	86.7	Confident	78.6	Confident	56 Å²	56	54.2 Å²	54.2	36%	0.364	33%	0.331	S	S	.	.			trans	-50.6	142.4	167.4	-24.7	33.6	0	0	0	111.1	D492 L493 A510	P490-D492 VanDerWaalsContact CB-OD1 3.31Å; P490-D492 WeakPolarHBondContact CB-OD1 3.3Å; P490-D492 PolarHBondContact O-N 3.33Å; P490-D492 VanDerWaalsContact O-N 3.1Å; P490-L493 HydrophobicContact CB-CB 4.19Å; P490-L493 HydrophobicContact CG-CB 4.46Å; P490-L493 WeakPolarHBondContact O-CB 3.39Å; P490-L493 PolarHBondContact O-N 3.18Å; P490-A510 HydrophobicContact CG-CB 4.08Å
491	S	81.4	Confident	80.5	Confident	102.5 Å²	102.5	54.1 Å²	54.1	72%	0.717	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-27.6	-171.6	46.8	0	0	0	0	113.9	K451 F489	K451-S491 PolarHBondContact NZ-O 3.2Å; F489-S491 PolarHBondContact O-N 3.48Å
492	D	84.5	Confident	82.1	Confident	133 Å²	133	55.9 Å²	55.9	71%	0.711	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-7	-179.3	61.6	-27.9	0	0	0	114	P490 I494	P490-D492 VanDerWaalsContact CB-OD1 3.31Å; P490-D492 WeakPolarHBondContact CB-OD1 3.3Å; P490-D492 PolarHBondContact O-N 3.33Å; P490-D492 VanDerWaalsContact O-N 3.1Å; D492-I494 PolarHBondContact O-N 3.02Å
493	L	89.9	Confident	83.5	Confident	21 Å²	21	51.9 Å²	51.9	11%	0.11	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-28.2	-175.6	-173.3	64.8	0	0	0	113.6	F489 P490 P495 L496 A510 V511	F489-L493 HydrophobicContact CB-CD2 4.22Å; F489-L493 HydrophobicContact CD1-CD2 3.83Å; F489-L493 HydrophobicContact CG-CD2 4.49Å; P490-L493 HydrophobicContact CB-CB 4.19Å; P490-L493 HydrophobicContact CG-CB 4.46Å; P490-L493 WeakPolarHBondContact O-CB 3.39Å; P490-L493 PolarHBondContact O-N 3.18Å; L493-P495 CarbonylContact O-C 3.46Å; L493-P495 VanDerWaalsContact O-C 3.28Å; L493-P495 VanDerWaalsContact O-O 3.07Å; L493-L496 HydrophobicContact CD1-CD2 4.41Å; L493-L496 HydrophobicContact CG-CD2 4.26Å; L493-L496 WeakPolarHBondContact O-CA 3.44Å; L493-L496 PolarHBondContact O-N 3.32Å; L493-A510 HydrophobicContact CD1-CB 4.47Å; L493-A510 HydrophobicContact CD2-CB 3.81Å; L493-V511 HydrophobicContact CD1-CG2 4.02Å; L493-V511 HydrophobicContact CD2-CG2 3.85Å; L493-V511 HydrophobicContact CG-CG2 4.2Å
494	I	90	Very high	84.7	Confident	11 Å²	11	54.3 Å²	54.3	6%	0.056	33%	0.334	C	S	.	.	S	Bend	trans	-113.9	125.2	-178.9	-55.3	171.6	0	0	0	108.8	L447 K451 T485 F489 D492	L447-I494 HydrophobicContact CB-CD1 4.1Å; L447-I494 HydrophobicContact CB-CG1 4.32Å; L447-I494 HydrophobicContact CB-CG2 4.47Å; K451-I494 HydrophobicContact CB-CB 4.42Å; K451-I494 HydrophobicContact CB-CD1 4.43Å; K451-I494 HydrophobicContact CB-CG2 3.71Å; K451-I494 HydrophobicContact CD-CB 3.59Å; K451-I494 HydrophobicContact CD-CG2 3.57Å; K451-I494 WeakPolarHBondContact CE-O 3.41Å; K451-I494 HydrophobicContact CG-CB 4.34Å; K451-I494 HydrophobicContact CG-CG2 4.1Å; K451-I494 PolarHBondContact NZ-O 3.42Å; T485-I494 HydrophobicContact CG2-CD1 4.11Å; F489-I494 HydrophobicContact CB-CD1 4.25Å; F489-I494 HydrophobicContact CD1-CD1 4.47Å; F489-I494 HydrophobicContact CD2-CD1 4.02Å; F489-I494 HydrophobicContact CE2-CD1 4.47Å; F489-I494 HydrophobicContact CG-CD1 4.02Å; D492-I494 PolarHBondContact O-N 3.02Å
495	P	88.8	Confident	85.8	Confident	101 Å²	101	52.2 Å²	52.2	66%	0.656	32%	0.323	S	S	*	.	S	Bend	cis	-68.9	147.6	6.6	30.4	-35.9	0	0	0	112.8	L493	L493-P495 CarbonylContact O-C 3.46Å; L493-P495 VanDerWaalsContact O-C 3.28Å; L493-P495 VanDerWaalsContact O-O 3.07Å
496	L	91.9	Very high	86.7	Confident	14 Å²	14	58.6 Å²	58.6	7%	0.073	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-59.4	146	176.3	-69	-173.8	0	0	0	110.4	L443 A444 L447 L493 Y500 V511	L443-L496 HydrophobicContact CD2-CD1 4.24Å; L443-L496 HydrophobicContact CG-CD1 4.09Å; A444-L496 HydrophobicContact CB-CB 4.13Å; A444-L496 HydrophobicContact CB-CD1 4.02Å; A444-L496 HydrophobicContact CB-CG 4.39Å; L447-L496 HydrophobicContact CD1-CD1 3.86Å; L447-L496 HydrophobicContact CD1-CD2 3.85Å; L447-L496 HydrophobicContact CD1-CG 3.9Å; L493-L496 HydrophobicContact CD1-CD2 4.41Å; L493-L496 HydrophobicContact CG-CD2 4.26Å; L493-L496 WeakPolarHBondContact O-CA 3.44Å; L493-L496 PolarHBondContact O-N 3.32Å; L496-Y500 HydrophobicContact CD1-CD1 4.49Å; L496-Y500 HydrophobicContact CD1-CG 4.49Å; L496-V511 HydrophobicContact CD2-CG2 3.55Å
497	N	90.2	Very high	87.9	Confident	79 Å²	79	57.7 Å²	57.7	42%	0.422	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-55.2	129.3	168.6	-177.5	-28.3	0	0	0	109.2	D499 Y500 V503	N497-D499 PolarHBondContact O-N 3.33Å; N497-D499 VanDerWaalsContact O-N 3.12Å; N497-D499 WeakPolarHBondContact OD1-CB 3.4Å; N497-D499 PolarHBondContact OD1-N 3.24Å; N497-D499 PolarHBondContact OD1-OD2 3.22Å; N497-Y500 VanDerWaalsContact O-CB 3.25Å; N497-Y500 WeakPolarHBondContact O-CB 3.13Å; N497-Y500 PolarHBondContact O-N 3.21Å; N497-V503 HydrophobicContact CB-CG1 3.99Å
498	P	88	Confident	88.8	Confident	124 Å²	124	53.9 Å²	53.9	81%	0.805	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.1	178.7	25.2	-36.7	0	0	0	114.1	Y500	P498-Y500 VanDerWaalsContact C-N 3.27Å; P498-Y500 PolarHBondContact O-N 2.84Å
499	D	86.6	Confident	89.4	Confident	100.5 Å²	100.5	52.3 Å²	52.3	54%	0.537	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-5.9	177.9	-58.9	-34.4	0	0	0	112.9	N497 F502 V503	N497-D499 PolarHBondContact O-N 3.33Å; N497-D499 VanDerWaalsContact O-N 3.12Å; N497-D499 WeakPolarHBondContact OD1-CB 3.4Å; N497-D499 PolarHBondContact OD1-N 3.24Å; N497-D499 PolarHBondContact OD1-OD2 3.22Å; D499-F502 WeakPolarHBondContact O-CA 3.25Å; D499-F502 VanDerWaalsContact O-CB 3.31Å; D499-F502 WeakPolarHBondContact O-CB 3.46Å; D499-F502 WeakPolarHBondContact O-CD2 3.47Å; D499-F502 PolarHBondContact O-N 3.1Å; D499-V503 HydrophobicContact CB-CG1 4.47Å
500	Y	91.5	Very high	89.7	Confident	15 Å²	15	52.6 Å²	52.6	6%	0.059	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	131.1	177.5	-163.7	-87.6	0	0	0	111.2	H400 W439 P440 L443 L496 N497 P498 V503 R508 V511	H400-Y500 PolarHBondContact CE1-OH 3.34Å; H400-Y500 AromaticContact NE2-CZ 3.93Å; H400-Y500 PolarHBondContact NE2-OH 3.4Å; W439-Y500 HydrophobicContact CH2-CD1 4.1Å; W439-Y500 AromaticContact CH2-CE1 3.49Å; W439-Y500 HydrophobicContact CH2-CE1 3.49Å; W439-Y500 VanDerWaalsContact CH2-CE1 3.49Å; W439-Y500 HydrophobicContact CZ3-CD1 4.16Å; W439-Y500 AromaticContact CZ3-CE1 3.6Å; W439-Y500 HydrophobicContact CZ3-CE1 3.6Å; P440-Y500 HydrophobicContact CB-CD1 4.44Å; P440-Y500 WeakPolarHBondContact CB-O 3.37Å; L443-Y500 HydrophobicContact CD2-CE1 4.34Å; L496-Y500 HydrophobicContact CD1-CD1 4.49Å; L496-Y500 HydrophobicContact CD1-CG 4.49Å; N497-Y500 VanDerWaalsContact O-CB 3.25Å; N497-Y500 WeakPolarHBondContact O-CB 3.13Å; N497-Y500 PolarHBondContact O-N 3.21Å; P498-Y500 VanDerWaalsContact C-N 3.27Å; P498-Y500 PolarHBondContact O-N 2.84Å; Y500-V503 HydrophobicContact CD2-CG1 4.36Å; Y500-V503 HydrophobicContact CD2-CG2 3.43Å; Y500-V503 VanDerWaalsContact CD2-CG2 3.43Å; Y500-V503 HydrophobicContact CE2-CG2 3.75Å; Y500-V503 HydrophobicContact CG-CG2 4.44Å; Y500-R508 HydrophobicContact CE2-CG 4.17Å; Y500-V511 HydrophobicContact CE2-CB 4.32Å; Y500-V511 HydrophobicContact CE2-CG2 3.86Å
501	P	90.5	Very high	90.1	Very high	2.5 Å²	2.5	50 Å²	50	2%	0.016	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	cis	-90.2	3.2	15	36	-36.6	0	0	0	116	N392 L396 W439 P440 V503 R508	N392-P501 HydrophobicContact CB-CG 4.1Å; L396-P501 HydrophobicContact CD2-CB 4.2Å; W439-P501 HydrophobicContact CH2-CB 3.96Å; W439-P501 HydrophobicContact CH2-CG 4.36Å; W439-P501 HydrophobicContact CZ2-CB 4.04Å; W439-P501 HydrophobicContact CZ2-CG 3.99Å; P440-P501 HydrophobicContact CG-CG 4.5Å; P501-V503 PolarHBondContact O-N 3.01Å; P501-R508 PolarHBondContact O-NE 3.3Å; P501-R508 PolarHBondContact O-NH2 3.06Å
502	F	88.5	Confident	90.9	Very high	45 Å²	45	45.1 Å²	45.1	20%	0.197	25%	0.253	C	S	.	.	S	Bend	trans	-79.3	51.8	-178.2	-47.3	-75.1	0	0	0	112.5	N392 D499 A1103 P1105 L1108	N392-F502 HydrophobicContact CB-CZ 4.3Å; D499-F502 WeakPolarHBondContact O-CA 3.25Å; D499-F502 VanDerWaalsContact O-CB 3.31Å; D499-F502 WeakPolarHBondContact O-CB 3.46Å; D499-F502 WeakPolarHBondContact O-CD2 3.47Å; D499-F502 PolarHBondContact O-N 3.1Å; F502-A1103 WeakPolarHBondContact CE1-O 3.41Å; F502-A1103 WeakPolarHBondContact CZ-O 3.29Å; F502-P1105 HydrophobicContact CB-CG 4.28Å; F502-P1105 HydrophobicContact CD1-CG 3.58Å; F502-P1105 HydrophobicContact CD2-CG 3.96Å; F502-P1105 VanDerWaalsContact CE1-CD 3.48Å; F502-P1105 HydrophobicContact CE1-CG 3.7Å; F502-P1105 HydrophobicContact CE2-CG 4.08Å; F502-P1105 HydrophobicContact CG-CG 3.71Å; F502-P1105 HydrophobicContact CZ-CG 3.95Å; F502-L1108 HydrophobicContact CE2-CD2 4.5Å
503	V	89.1	Confident	91.4	Very high	6.5 Å²	6.5	44.1 Å²	44.1	4%	0.039	24%	0.24	C	C	.	.	S	Bend	trans	-119.8	162.9	179.8	-62.5	0	0	0	0	110	N497 D499 Y500 P501 R508	N497-V503 HydrophobicContact CB-CG1 3.99Å; D499-V503 HydrophobicContact CB-CG1 4.47Å; Y500-V503 HydrophobicContact CD2-CG1 4.36Å; Y500-V503 HydrophobicContact CD2-CG2 3.43Å; Y500-V503 VanDerWaalsContact CD2-CG2 3.43Å; Y500-V503 HydrophobicContact CE2-CG2 3.75Å; Y500-V503 HydrophobicContact CG-CG2 4.44Å; P501-V503 PolarHBondContact O-N 3.01Å; V503-R508 HydrophobicContact CG2-CG 3.89Å; V503-R508 PolarHBondContact O-NE 2.98Å; V503-R508 PolarHBondContact O-NH2 3Å
504	P	88	Confident	91.5	Very high	79.5 Å²	79.5	43.1 Å²	43.1	52%	0.516	23%	0.234	S	C	.	.			trans	-54.3	151.8	175.6	-26.5	35.5	0	0	0	113.2	K506 S507 R508 I927	P504-K506 PolarHBondContact O-N 3.21Å; P504-K506 VanDerWaalsContact O-N 3.09Å; P504-S507 PolarHBondContact O-N 3.22Å; P504-R508 PolarHBondContact O-N 3.1Å; P504-I927 WeakPolarHBondContact CA-O 3.15Å
505	I	89.8	Confident	91.8	Very high	13.5 Å²	13.5	42.6 Å²	42.6	7%	0.069	23%	0.232	C	C	.	.	H	α-helix	trans	-53.1	-38.9	-175.6	-173	175.8	0	0	0	112.7	Y355 I388 S507 R508 I509 I927 L928	Y355-I505 HydrophobicContact CD2-CD1 4.14Å; Y355-I505 HydrophobicContact CD2-CG2 3.87Å; Y355-I505 HydrophobicContact CE2-CG2 3.44Å; Y355-I505 VanDerWaalsContact CE2-CG2 3.44Å; I388-I505 HydrophobicContact CG1-CD1 3.7Å; I505-S507 VanDerWaalsContact C-N 3.29Å; I505-S507 PolarHBondContact O-N 3.24Å; I505-R508 WeakPolarHBondContact O-CB 3.34Å; I505-R508 PolarHBondContact O-N 2.97Å; I505-I509 HydrophobicContact CD1-CD1 4.03Å; I505-I509 HydrophobicContact CG1-CD1 3.71Å; I505-I509 HydrophobicContact CG1-CG1 4.09Å; I505-I509 WeakPolarHBondContact O-CG1 3.44Å; I505-I509 PolarHBondContact O-N 3.28Å; I505-I927 HydrophobicContact CB-CG2 3.94Å; I505-I927 PolarHBondContact N-O 2.75Å; I505-L928 HydrophobicContact CB-CD2 4.31Å; I505-L928 HydrophobicContact CD1-CD2 4.49Å; I505-L928 HydrophobicContact CG2-CD2 3.86Å
506	K	91.1	Very high	92.1	Very high	139 Å²	139	38 Å²	38	60%	0.604	20%	0.202	S	C	*	.	H	α-helix	trans	-50.6	-47.4	176.5	-174.3	175.6	178.8	175.9	0	112.5	Y355 P504 I509 A510	Y355-K506 HydrophobicContact CE1-CB 4.12Å; Y355-K506 HydrophobicContact CE1-CG 4.27Å; P504-K506 PolarHBondContact O-N 3.21Å; P504-K506 VanDerWaalsContact O-N 3.09Å; K506-I509 PolarHBondContact O-N 3.44Å; K506-A510 WeakPolarHBondContact O-CB 3.32Å; K506-A510 PolarHBondContact O-N 2.85Å
507	S	92.1	Very high	92.1	Very high	41.5 Å²	41.5	39.3 Å²	39.3	29%	0.29	21%	0.212	S	C	.	.	H	α-helix	trans	-69.3	-37.3	-179.9	-59.2	0	0	0	0	111.7	P504 I505 A510 V511	P504-S507 PolarHBondContact O-N 3.22Å; I505-S507 VanDerWaalsContact C-N 3.29Å; I505-S507 PolarHBondContact O-N 3.24Å; S507-A510 PolarHBondContact O-N 3.23Å; S507-V511 WeakPolarHBondContact O-CG2 3.25Å; S507-V511 PolarHBondContact O-N 2.78Å; S507-V511 VanDerWaalsContact O-N 3.12Å
508	R	94.1	Very high	92.2	Very high	1.5 Å²	1.5	35.6 Å²	35.6	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-45.7	176.2	-60.8	-179.6	-177.7	-171.4	-6.2	111.7	L387 S389 Y500 P501 V503 P504 I505 V511 L512	L387-R508 WeakPolarHBondContact O-CD 3.45Å; L387-R508 PolarHBondContact O-NH1 3.31Å; S389-R508 PolarHBondContact O-NH1 2.96Å; S389-R508 PolarHBondContact O-NH2 2.83Å; Y500-R508 HydrophobicContact CE2-CG 4.17Å; P501-R508 PolarHBondContact O-NE 3.3Å; P501-R508 PolarHBondContact O-NH2 3.06Å; V503-R508 HydrophobicContact CG2-CG 3.89Å; V503-R508 PolarHBondContact O-NE 2.98Å; V503-R508 PolarHBondContact O-NH2 3Å; P504-R508 PolarHBondContact O-N 3.1Å; I505-R508 WeakPolarHBondContact O-CB 3.34Å; I505-R508 PolarHBondContact O-N 2.97Å; R508-V511 PolarHBondContact O-N 3.33Å; R508-L512 PolarHBondContact O-N 2.94Å
509	I	95.7	Very high	92.4	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-62.7	-46	177.3	-70	175.6	0	0	0	110.5	Y355 D358 V359 I362 I505 K506 V511 L512 R513	Y355-I509 VanDerWaalsContact CB-CD1 3.47Å; Y355-I509 HydrophobicContact CD1-CD1 3.67Å; Y355-I509 HydrophobicContact CD2-CD1 4.4Å; Y355-I509 HydrophobicContact CG-CD1 3.58Å; D358-I509 HydrophobicContact CB-CG2 3.61Å; V359-I509 HydrophobicContact CG2-CD1 3.73Å; V359-I509 HydrophobicContact CG2-CG1 4.24Å; I362-I509 HydrophobicContact CD1-CG2 4.02Å; I505-I509 HydrophobicContact CD1-CD1 4.03Å; I505-I509 HydrophobicContact CG1-CD1 3.71Å; I505-I509 HydrophobicContact CG1-CG1 4.09Å; I505-I509 WeakPolarHBondContact O-CG1 3.44Å; I505-I509 PolarHBondContact O-N 3.28Å; K506-I509 PolarHBondContact O-N 3.44Å; I509-V511 VanDerWaalsContact C-N 3.31Å; I509-V511 PolarHBondContact O-N 2.75Å; I509-L512 PolarHBondContact O-N 2.84Å; I509-R513 VanDerWaalsContact O-CB 3.24Å; I509-R513 WeakPolarHBondContact O-CB 3.26Å; I509-R513 PolarHBondContact O-N 3.06Å
510	A	94.7	Very high	92.7	Very high	15.5 Å²	15.5	28.4 Å²	28.4	13%	0.128	15%	0.147	C	C	.	.	H	α-helix	trans	-59.5	-40.9	179.6	0	0	0	0	0	112.5	P490 L493 K506 S507 G514	P490-A510 HydrophobicContact CG-CB 4.08Å; L493-A510 HydrophobicContact CD1-CB 4.47Å; L493-A510 HydrophobicContact CD2-CB 3.81Å; K506-A510 WeakPolarHBondContact O-CB 3.32Å; K506-A510 PolarHBondContact O-N 2.85Å; S507-A510 PolarHBondContact O-N 3.23Å; A510-G514 PolarHBondContact O-N 3.41Å; A510-G514 VanDerWaalsContact O-N 3.1Å
511	V	96	Very high	92.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-51.4	174.3	173.5	0	0	0	0	111.1	L443 L447 L493 L496 Y500 S507 R508 I509 R513 G514 L515	L443-V511 HydrophobicContact CD2-CG1 3.9Å; L447-V511 HydrophobicContact CD1-CG1 4.47Å; L493-V511 HydrophobicContact CD1-CG2 4.02Å; L493-V511 HydrophobicContact CD2-CG2 3.85Å; L493-V511 HydrophobicContact CG-CG2 4.2Å; L496-V511 HydrophobicContact CD2-CG2 3.55Å; Y500-V511 HydrophobicContact CE2-CB 4.32Å; Y500-V511 HydrophobicContact CE2-CG2 3.86Å; S507-V511 WeakPolarHBondContact O-CG2 3.25Å; S507-V511 PolarHBondContact O-N 2.78Å; S507-V511 VanDerWaalsContact O-N 3.12Å; R508-V511 PolarHBondContact O-N 3.33Å; I509-V511 VanDerWaalsContact C-N 3.31Å; I509-V511 PolarHBondContact O-N 2.75Å; V511-R513 PolarHBondContact O-N 2.76Å; V511-G514 PolarHBondContact O-N 2.96Å; V511-L515 HydrophobicContact CG1-CD1 3.91Å; V511-L515 HydrophobicContact CG1-CG 4.34Å; V511-L515 WeakPolarHBondContact O-CB 3.19Å; V511-L515 WeakPolarHBondContact O-CG 3.32Å; V511-L515 PolarHBondContact O-N 3.12Å
512	L	97.2	Very high	92.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.5	-38.6	-178.5	-78.7	169.8	0	0	0	112.8	I362 F383 L387 L396 H400 L403 R508 I509 L515 T516	I362-L512 HydrophobicContact CD1-CB 3.84Å; I362-L512 HydrophobicContact CG1-CB 4.43Å; I362-L512 HydrophobicContact CG2-CB 4.06Å; F383-L512 HydrophobicContact CZ-CD1 4.16Å; L387-L512 HydrophobicContact CD2-CD1 3.57Å; L396-L512 HydrophobicContact CD1-CD1 4.33Å; H400-L512 VanDerWaalsContact CE1-CD2 3.5Å; H400-L512 WeakPolarHBondContact CE1-CD2 3.34Å; H400-L512 WeakPolarHBondContact NE2-CD2 3.4Å; H400-L512 WeakPolarHBondContact NE2-CG 3.34Å; L403-L512 HydrophobicContact CD1-CD2 3.92Å; R508-L512 PolarHBondContact O-N 2.94Å; I509-L512 PolarHBondContact O-N 2.84Å; L512-L515 PolarHBondContact O-N 2.73Å; L512-T516 WeakPolarHBondContact O-CB 3.23Å; L512-T516 WeakPolarHBondContact O-CG2 3.43Å; L512-T516 PolarHBondContact O-N 3.04Å; L512-T516 PolarHBondContact O-OG1 2.98Å
513	R	95.2	Very high	92.5	Very high	112.5 Å²	112.5	28.4 Å²	28.4	43%	0.425	16%	0.159	S	C	.	.	H	α-helix	trans	-60.8	-47.3	174.2	-175.8	178.5	115.4	167	-0.8	111	I362 I509 V511 L515 T516 S517	I362-R513 HydrophobicContact CD1-CB 4.22Å; I362-R513 HydrophobicContact CG1-CB 4.42Å; I509-R513 VanDerWaalsContact O-CB 3.24Å; I509-R513 WeakPolarHBondContact O-CB 3.26Å; I509-R513 PolarHBondContact O-N 3.06Å; V511-R513 PolarHBondContact O-N 2.76Å; R513-L515 PolarHBondContact O-N 3.09Å; R513-T516 WeakPolarHBondContact CA-OG1 3.37Å; R513-T516 PolarHBondContact O-N 2.86Å; R513-T516 PolarHBondContact O-OG1 3.19Å; R513-S517 VanDerWaalsContact O-CB 3.32Å; R513-S517 WeakPolarHBondContact O-CB 3.32Å; R513-S517 PolarHBondContact O-N 3.12Å; R513-S517 PolarHBondContact O-OG 3.07Å; R513-S517 VanDerWaalsContact O-OG 3.06Å
514	G	93.2	Very high	92.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.2	-38.5	177.1	0	0	0	0	0	113	L488 F489 A510 V511 S517 L518	L488-G514 WeakPolarHBondContact O-CA 3.45Å; F489-G514 VanDerWaalsContact CE1-CA 3.42Å; A510-G514 PolarHBondContact O-N 3.41Å; A510-G514 VanDerWaalsContact O-N 3.1Å; V511-G514 PolarHBondContact O-N 2.96Å; G514-S517 PolarHBondContact O-N 3Å; G514-L518 WeakPolarHBondContact O-CG 3.47Å; G514-L518 PolarHBondContact O-N 3.1Å
515	L	95.7	Very high	92.6	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.8	-41.5	175.6	-72.4	176.7	0	0	0	113.2	L403 L407 L443 L447 V511 L512 R513 S517 L518 F519	L403-L515 HydrophobicContact CB-CB 4.42Å; L403-L515 HydrophobicContact CD1-CB 3.95Å; L403-L515 HydrophobicContact CD1-CD1 4.41Å; L407-L515 HydrophobicContact CD1-CD2 3.76Å; L443-L515 HydrophobicContact CD1-CD1 3.88Å; L443-L515 HydrophobicContact CD1-CD2 3.89Å; L443-L515 HydrophobicContact CD1-CG 4.43Å; L443-L515 HydrophobicContact CD2-CD1 4.18Å; L447-L515 HydrophobicContact CD2-CD2 4.14Å; V511-L515 HydrophobicContact CG1-CD1 3.91Å; V511-L515 HydrophobicContact CG1-CG 4.34Å; V511-L515 WeakPolarHBondContact O-CB 3.19Å; V511-L515 WeakPolarHBondContact O-CG 3.32Å; V511-L515 PolarHBondContact O-N 3.12Å; L512-L515 PolarHBondContact O-N 2.73Å; R513-L515 PolarHBondContact O-N 3.09Å; L515-S517 VanDerWaalsContact C-N 3.34Å; L515-L518 HydrophobicContact CD2-CD1 4.4Å; L515-L518 WeakPolarHBondContact O-CB 3.48Å; L515-L518 PolarHBondContact O-N 2.84Å; L515-F519 WeakPolarHBondContact O-CB 3.35Å; L515-F519 PolarHBondContact O-N 3.29Å
516	T	95	Very high	92.6	Very high	4.5 Å²	4.5	33.1 Å²	33.1	3%	0.028	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-40.5	175.1	46.4	0	0	0	0	110.9	I362 V365 L403 L512 R513 L518 F519 L520	I362-T516 HydrophobicContact CG2-CG2 4.03Å; V365-T516 HydrophobicContact CB-CG2 4.18Å; V365-T516 HydrophobicContact CG1-CG2 4Å; L403-T516 HydrophobicContact CD1-CG2 4.15Å; L403-T516 HydrophobicContact CD2-CG2 4.17Å; L512-T516 WeakPolarHBondContact O-CB 3.23Å; L512-T516 WeakPolarHBondContact O-CG2 3.43Å; L512-T516 PolarHBondContact O-N 3.04Å; L512-T516 PolarHBondContact O-OG1 2.98Å; R513-T516 WeakPolarHBondContact CA-OG1 3.37Å; R513-T516 PolarHBondContact O-N 2.86Å; R513-T516 PolarHBondContact O-OG1 3.19Å; T516-L518 PolarHBondContact O-N 3.47Å; T516-F519 WeakPolarHBondContact O-CB 3.39Å; T516-F519 PolarHBondContact O-N 2.86Å; T516-F519 VanDerWaalsContact O-N 3.14Å; T516-L520 VanDerWaalsContact O-CG 3.32Å; T516-L520 WeakPolarHBondContact O-CG 3.27Å; T516-L520 PolarHBondContact O-N 3.46Å
517	S	92	Very high	92.5	Very high	41.5 Å²	41.5	28.1 Å²	28.1	29%	0.29	16%	0.161	S	C	.	.	H	α-helix	trans	-61.4	-43.3	173.1	-61.7	0	0	0	0	112.5	R513 G514 L515 F519 L520 A521	R513-S517 VanDerWaalsContact O-CB 3.32Å; R513-S517 WeakPolarHBondContact O-CB 3.32Å; R513-S517 PolarHBondContact O-N 3.12Å; R513-S517 PolarHBondContact O-OG 3.07Å; R513-S517 VanDerWaalsContact O-OG 3.06Å; G514-S517 PolarHBondContact O-N 3Å; L515-S517 VanDerWaalsContact C-N 3.34Å; S517-F519 VanDerWaalsContact C-N 3.3Å; S517-F519 PolarHBondContact O-N 2.91Å; S517-L520 PolarHBondContact O-N 3.05Å; S517-A521 PolarHBondContact O-N 3.36Å
518	L	91.7	Very high	92.2	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-58.9	-43.6	171.8	-78.5	171.1	0	0	0	111.5	L407 I450 A480 V483 L488 F489 G514 L515 T516 A521 T522	L407-L518 HydrophobicContact CD1-CB 4.05Å; L407-L518 HydrophobicContact CD1-CD1 4.09Å; L407-L518 HydrophobicContact CD2-CB 3.72Å; I450-L518 HydrophobicContact CD1-CD1 4.01Å; A480-L518 HydrophobicContact CB-CD2 4.22Å; V483-L518 HydrophobicContact CB-CD2 4.04Å; V483-L518 HydrophobicContact CG1-CD2 3.62Å; V483-L518 HydrophobicContact CG2-CD2 4.29Å; L488-L518 HydrophobicContact CD1-CD2 3.79Å; L488-L518 HydrophobicContact CD1-CG 3.74Å; F489-L518 HydrophobicContact CE2-CD1 3.89Å; F489-L518 HydrophobicContact CE2-CG 4.39Å; F489-L518 HydrophobicContact CZ-CD1 3.7Å; F489-L518 HydrophobicContact CZ-CG 4.42Å; G514-L518 WeakPolarHBondContact O-CG 3.47Å; G514-L518 PolarHBondContact O-N 3.1Å; L515-L518 HydrophobicContact CD2-CD1 4.4Å; L515-L518 WeakPolarHBondContact O-CB 3.48Å; L515-L518 PolarHBondContact O-N 2.84Å; T516-L518 PolarHBondContact O-N 3.47Å; L518-A521 PolarHBondContact O-N 3.02Å; L518-T522 WeakPolarHBondContact O-CG2 3.39Å
519	F	93.5	Very high	91.8	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.018	17%	0.168	C	C	.	.	H	α-helix	trans	-66	-39.6	-179.5	174.3	-105.2	0	0	0	112.4	V365 Y369 L372 L373 L403 A406 L515 T516 S517 A521 T522 V525	V365-F519 HydrophobicContact CG1-CD1 4.08Å; Y369-F519 HydrophobicContact CD2-CE1 4.17Å; Y369-F519 AromaticContact CG-CE1 3.92Å; Y369-F519 HydrophobicContact CG-CE1 3.92Å; L372-F519 HydrophobicContact CB-CZ 4.07Å; L372-F519 HydrophobicContact CD1-CZ 4.41Å; L373-F519 HydrophobicContact CD1-CE1 4.17Å; L373-F519 HydrophobicContact CD1-CZ 4.46Å; L373-F519 HydrophobicContact CD2-CD1 4.11Å; L373-F519 HydrophobicContact CD2-CD2 3.74Å; L373-F519 HydrophobicContact CD2-CE1 3.88Å; L373-F519 HydrophobicContact CD2-CE2 3.48Å; L373-F519 VanDerWaalsContact CD2-CE2 3.48Å; L373-F519 HydrophobicContact CD2-CG 4.04Å; L373-F519 HydrophobicContact CD2-CZ 3.56Å; L373-F519 HydrophobicContact CG-CD1 4.49Å; L373-F519 HydrophobicContact CG-CE1 3.89Å; L373-F519 HydrophobicContact CG-CE2 4.13Å; L373-F519 HydrophobicContact CG-CZ 3.68Å; L403-F519 HydrophobicContact CD2-CB 3.89Å; L403-F519 HydrophobicContact CD2-CD1 4.46Å; L403-F519 HydrophobicContact CD2-CG 4.13Å; A406-F519 HydrophobicContact CB-CD2 3.77Å; A406-F519 HydrophobicContact CB-CE2 3.78Å; L515-F519 WeakPolarHBondContact O-CB 3.35Å; L515-F519 PolarHBondContact O-N 3.29Å; T516-F519 WeakPolarHBondContact O-CB 3.39Å; T516-F519 PolarHBondContact O-N 2.86Å; T516-F519 VanDerWaalsContact O-N 3.14Å; S517-F519 VanDerWaalsContact C-N 3.3Å; S517-F519 PolarHBondContact O-N 2.91Å; F519-A521 PolarHBondContact O-N 3.25Å; F519-T522 HydrophobicContact CD2-CG2 4.32Å; F519-T522 VanDerWaalsContact O-CB 3.31Å; F519-T522 WeakPolarHBondContact O-CB 3.44Å; F519-T522 WeakPolarHBondContact O-CG2 3.25Å; F519-T522 PolarHBondContact O-N 3.24Å; F519-T522 PolarHBondContact O-OG1 2.92Å; F519-V525 HydrophobicContact CD1-CG2 4.04Å; F519-V525 HydrophobicContact CE1-CG2 3.51Å; F519-V525 VanDerWaalsContact CE1-CG2 3.49Å; F519-V525 HydrophobicContact CE2-CG2 4.08Å; F519-V525 HydrophobicContact CZ-CG2 3.53Å; F519-V525 WeakPolarHBondContact O-CG2 3.37Å
520	L	91.7	Very high	91.4	Very high	70 Å²	70	36.2 Å²	36.2	37%	0.366	20%	0.2	S	C	.	.	H	α-helix	trans	-62.5	-26.9	176.7	-72.5	174.4	0	0	0	112.9	V365 Y369 T516 S517 T522 V525	V365-L520 HydrophobicContact CG1-CD2 4.03Å; V365-L520 HydrophobicContact CG1-CG 4.21Å; V365-L520 HydrophobicContact CG2-CD1 3.91Å; V365-L520 HydrophobicContact CG2-CD2 4.18Å; V365-L520 HydrophobicContact CG2-CG 4.28Å; Y369-L520 HydrophobicContact CD2-CD2 4.06Å; Y369-L520 HydrophobicContact CE2-CD2 3.46Å; Y369-L520 VanDerWaalsContact CE2-CD2 3.46Å; T516-L520 VanDerWaalsContact O-CG 3.32Å; T516-L520 WeakPolarHBondContact O-CG 3.27Å; T516-L520 PolarHBondContact O-N 3.46Å; S517-L520 PolarHBondContact O-N 3.05Å; L520-T522 VanDerWaalsContact C-N 3.28Å; L520-T522 PolarHBondContact O-N 3.29Å; L520-V525 HydrophobicContact CD2-CG1 4.24Å
521	A	88	Confident	90.8	Very high	42 Å²	42	39.1 Å²	39.1	35%	0.347	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-6.9	175.6	0	0	0	0	0	114	V483 S517 L518 F519	V483-A521 HydrophobicContact CG2-CB 4.49Å; S517-A521 PolarHBondContact O-N 3.36Å; L518-A521 PolarHBondContact O-N 3.02Å; F519-A521 PolarHBondContact O-N 3.25Å
522	T	89.7	Confident	90.1	Very high	2.5 Å²	2.5	45.7 Å²	45.7	2%	0.015	24%	0.238	C	C	.	.	S	Bend	trans	-73.8	154.7	-173	65.9	0	0	0	0	113.6	L407 E410 L518 F519 L520 V525 R526	L407-T522 HydrophobicContact CD2-CG2 4.01Å; E410-T522 HydrophobicContact CB-CG2 4.1Å; E410-T522 HydrophobicContact CG-CG2 3.89Å; L518-T522 WeakPolarHBondContact O-CG2 3.39Å; F519-T522 HydrophobicContact CD2-CG2 4.32Å; F519-T522 VanDerWaalsContact O-CB 3.31Å; F519-T522 WeakPolarHBondContact O-CB 3.44Å; F519-T522 WeakPolarHBondContact O-CG2 3.25Å; F519-T522 PolarHBondContact O-N 3.24Å; F519-T522 PolarHBondContact O-OG1 2.92Å; L520-T522 VanDerWaalsContact C-N 3.28Å; L520-T522 PolarHBondContact O-N 3.29Å; T522-V525 PolarHBondContact O-N 2.97Å; T522-R526 PolarHBondContact O-N 2.98Å
523	G	89.2	Confident	89	Confident	16.5 Å²	16.5	46.7 Å²	46.7	17%	0.17	25%	0.249	C	C	.	.	H	α-helix	trans	-54	-44.8	175.1	0	0	0	0	0	115.1	E410 V525 R526 G527	E410-G523 PolarHBondContact OE1-N 3.44Å; E410-G523 VanDerWaalsContact OE1-N 3.08Å; E410-G523 PolarHBondContact OE2-N 3.21Å; G523-V525 PolarHBondContact O-N 3.13Å; G523-R526 PolarHBondContact O-N 3.01Å; G523-G527 PolarHBondContact O-N 3.44Å
524	P	89.4	Confident	88.1	Confident	64.5 Å²	64.5	47.4 Å²	47.4	42%	0.419	26%	0.26	S	S	.	.	H	α-helix	trans	-58.6	-41	176.6	-29.6	36.2	0	0	0	114.3	L372 E410 G527 D528	L372-P524 HydrophobicContact CD1-CB 4.49Å; E410-P524 WeakPolarHBondContact OE2-CD 3.29Å; P524-G527 PolarHBondContact O-N 3.1Å; P524-D528 WeakPolarHBondContact O-CB 3.1Å; P524-D528 PolarHBondContact O-N 2.89Å
525	V	89.9	Confident	87.4	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	28%	0.283	C	S	.	.	H	α-helix	trans	-65.9	-47.1	177.2	171.9	0	0	0	0	110.2	Y369 L372 F519 L520 T522 G523 G527 D528 I529	Y369-V525 HydrophobicContact CD1-CG2 4.32Å; Y369-V525 HydrophobicContact CE1-CG1 3.86Å; Y369-V525 HydrophobicContact CE1-CG2 4.43Å; Y369-V525 HydrophobicContact CE2-CG1 4.38Å; L372-V525 HydrophobicContact CD1-CG2 4.1Å; F519-V525 HydrophobicContact CD1-CG2 4.04Å; F519-V525 HydrophobicContact CE1-CG2 3.51Å; F519-V525 VanDerWaalsContact CE1-CG2 3.49Å; F519-V525 HydrophobicContact CE2-CG2 4.08Å; F519-V525 HydrophobicContact CZ-CG2 3.53Å; F519-V525 WeakPolarHBondContact O-CG2 3.37Å; L520-V525 HydrophobicContact CD2-CG1 4.24Å; T522-V525 PolarHBondContact O-N 2.97Å; G523-V525 PolarHBondContact O-N 3.13Å; V525-G527 VanDerWaalsContact C-N 3.28Å; V525-G527 PolarHBondContact O-N 3.24Å; V525-D528 WeakPolarHBondContact O-CA 3.35Å; V525-D528 WeakPolarHBondContact O-CB 3.27Å; V525-D528 PolarHBondContact O-N 2.94Å; V525-I529 HydrophobicContact CG1-CD1 3.91Å; V525-I529 HydrophobicContact CG1-CG1 4.49Å; V525-I529 WeakPolarHBondContact O-CG1 3.44Å; V525-I529 PolarHBondContact O-N 3.24Å
526	R	89.5	Confident	86.6	Confident	134.5 Å²	134.5	56.5 Å²	56.5	51%	0.508	31%	0.311	S	S	.	.	H	α-helix	trans	-58.7	-40.3	174.5	178.1	170.2	48.9	91.8	4.4	112.2	T522 G523 D528 I529 L530	T522-R526 PolarHBondContact O-N 2.98Å; G523-R526 PolarHBondContact O-N 3.01Å; R526-D528 VanDerWaalsContact C-N 3.31Å; R526-D528 PolarHBondContact O-N 3.04Å; R526-I529 PolarHBondContact O-N 3.11Å; R526-L530 HydrophobicContact CG-CD1 4.1Å; R526-L530 WeakPolarHBondContact O-CB 3.41Å; R526-L530 VanDerWaalsContact O-CG 3.25Å; R526-L530 WeakPolarHBondContact O-CG 3.25Å; R526-L530 PolarHBondContact O-N 2.78Å
527	G	88.1	Confident	86.3	Confident	33.5 Å²	33.5	59.6 Å²	59.6	35%	0.345	33%	0.325	S	S	.	.	H	α-helix	trans	-66.8	-30.3	175.3	0	0	0	0	0	113.5	G523 P524 V525 R531	G523-G527 PolarHBondContact O-N 3.44Å; P524-G527 PolarHBondContact O-N 3.1Å; V525-G527 VanDerWaalsContact C-N 3.28Å; V525-G527 PolarHBondContact O-N 3.24Å; G527-R531 WeakPolarHBondContact O-CB 3.43Å; G527-R531 PolarHBondContact O-N 3.32Å; G527-R531 PolarHBondContact O-NH1 3.2Å
528	D	86.2	Confident	86.2	Confident	16 Å²	16	59.7 Å²	59.7	9%	0.086	32%	0.321	C	S	.	.	H	α-helix	trans	-69.7	-45.4	172	-162.3	72	0	0	0	112	L372 P524 V525 R526 L530 R531	L372-D528 HydrophobicContact CD1-CB 3.98Å; P524-D528 WeakPolarHBondContact O-CB 3.1Å; P524-D528 PolarHBondContact O-N 2.89Å; V525-D528 WeakPolarHBondContact O-CA 3.35Å; V525-D528 WeakPolarHBondContact O-CB 3.27Å; V525-D528 PolarHBondContact O-N 2.94Å; R526-D528 VanDerWaalsContact C-N 3.31Å; R526-D528 PolarHBondContact O-N 3.04Å; D528-L530 PolarHBondContact O-N 3.27Å; D528-R531 WeakPolarHBondContact O-CB 3.26Å; D528-R531 PolarHBondContact O-N 3.34Å; D528-R531 VanDerWaalsContact O-N 3.15Å; D528-R531 IonicContact OD1-CZ 3.43Å; D528-R531 IonicContact OD1-NH1 2.94Å; D528-R531 IonicContact OD1-NH2 3.31Å; D528-R531 PolarHBondContact OD1-NH2 3.11Å
529	I	86.4	Confident	86.2	Confident	68.5 Å²	68.5	65.3 Å²	65.3	35%	0.351	35%	0.351	S	S	.	.	H	α-helix	trans	-59.6	-48.7	176.4	-64.6	166	0	0	0	110.8	V525 R526 R531 E532 H604	V525-I529 HydrophobicContact CG1-CD1 3.91Å; V525-I529 HydrophobicContact CG1-CG1 4.49Å; V525-I529 WeakPolarHBondContact O-CG1 3.44Å; V525-I529 PolarHBondContact O-N 3.24Å; R526-I529 PolarHBondContact O-N 3.11Å; I529-R531 PolarHBondContact O-N 3.14Å; I529-R531 VanDerWaalsContact O-N 3.12Å; I529-E532 PolarHBondContact O-N 3.08Å; I529-E532 VanDerWaalsContact O-N 3.12Å; I529-H604 VanDerWaalsContact CA-CE1 3.49Å; I529-H604 WeakPolarHBondContact CA-CE1 3.46Å; I529-H604 PolarHBondContact O-NE2 2.77Å
530	L	87	Confident	86.2	Confident	131.5 Å²	131.5	69.5 Å²	69.5	69%	0.688	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-16	-179.7	-71.3	172.4	0	0	0	114.3	R526 D528	R526-L530 HydrophobicContact CG-CD1 4.1Å; R526-L530 WeakPolarHBondContact O-CB 3.41Å; R526-L530 VanDerWaalsContact O-CG 3.25Å; R526-L530 WeakPolarHBondContact O-CG 3.25Å; R526-L530 PolarHBondContact O-N 2.78Å; D528-L530 PolarHBondContact O-N 3.27Å
531	R	82.8	Confident	86.3	Confident	78 Å²	78	66.1 Å²	66.1	29%	0.294	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-12.9	179.5	-166.8	166.3	69.8	-98.1	-4.3	112.3	G527 D528 I529 G533 L534	G527-R531 WeakPolarHBondContact O-CB 3.43Å; G527-R531 PolarHBondContact O-N 3.32Å; G527-R531 PolarHBondContact O-NH1 3.2Å; D528-R531 WeakPolarHBondContact O-CB 3.26Å; D528-R531 PolarHBondContact O-N 3.34Å; D528-R531 VanDerWaalsContact O-N 3.15Å; D528-R531 IonicContact OD1-CZ 3.43Å; D528-R531 IonicContact OD1-NH1 2.94Å; D528-R531 IonicContact OD1-NH2 3.31Å; D528-R531 PolarHBondContact OD1-NH2 3.11Å; I529-R531 PolarHBondContact O-N 3.14Å; I529-R531 VanDerWaalsContact O-N 3.12Å; R531-G533 PolarHBondContact O-N 3.43Å; R531-G533 VanDerWaalsContact O-N 3.12Å; R531-L534 WeakPolarHBondContact CD-O 3.35Å; R531-L534 HydrophobicContact CG-CB 3.77Å; R531-L534 WeakPolarHBondContact CG-O 3.36Å; R531-L534 PolarHBondContact NE-O 2.99Å; R531-L534 VanDerWaalsContact O-CB 3.3Å; R531-L534 WeakPolarHBondContact O-CB 3.26Å; R531-L534 WeakPolarHBondContact O-CG 3.37Å; R531-L534 PolarHBondContact O-N 3.15Å
532	E	81.1	Confident	86.5	Confident	137 Å²	137	64.8 Å²	64.8	64%	0.64	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	44.5	177	-62.2	-177.6	174	0	0	112.6	I529 L534	I529-E532 PolarHBondContact O-N 3.08Å; I529-E532 VanDerWaalsContact O-N 3.12Å; E532-L534 VanDerWaalsContact C-N 3.29Å; E532-L534 PolarHBondContact O-N 3.28Å
533	G	74.2	Confident	86.5	Confident	22 Å²	22	65.9 Å²	65.9	23%	0.227	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-0.5	176.8	0	0	0	0	0	116.7	R531 M535 S600 G601	R531-G533 PolarHBondContact O-N 3.43Å; R531-G533 VanDerWaalsContact O-N 3.12Å; G533-M535 PolarHBondContact O-N 3.08Å; G533-S600 CarbonylContact C-O 3.3Å; G533-S600 WeakPolarHBondContact CA-O 3.46Å; G533-S600 VanDerWaalsContact O-O 3.08Å; G533-G601 PolarHBondContact N-O 3.14Å
534	L	76.3	Confident	86.6	Confident	127 Å²	127	67.2 Å²	67.2	67%	0.665	35%	0.348	S	S	*	.			trans	-63.5	100.8	173.5	-65.2	166.8	0	0	0	110.1	R531 E532 T536	R531-L534 WeakPolarHBondContact CD-O 3.35Å; R531-L534 HydrophobicContact CG-CB 3.77Å; R531-L534 WeakPolarHBondContact CG-O 3.36Å; R531-L534 PolarHBondContact NE-O 2.99Å; R531-L534 VanDerWaalsContact O-CB 3.3Å; R531-L534 WeakPolarHBondContact O-CB 3.26Å; R531-L534 WeakPolarHBondContact O-CG 3.37Å; R531-L534 PolarHBondContact O-N 3.15Å; E532-L534 VanDerWaalsContact C-N 3.29Å; E532-L534 PolarHBondContact O-N 3.28Å; L534-T536 PolarHBondContact O-N 3.4Å
535	M	77.1	Confident	86.7	Confident	95 Å²	95	65.8 Å²	65.8	47%	0.468	34%	0.336	S	S	.	.			trans	-77.6	110.1	177.7	-170.7	76.3	69.1	0	0	109.4	G533 T557	G533-M535 PolarHBondContact O-N 3.08Å; M535-T557 HydrophobicContact CG-CG2 4.16Å; M535-T557 HydrophobicContact SD-CG2 3.43Å; M535-T557 WeakPolarHBondContact SD-CG2 3.44Å
536	T	80.2	Confident	86.9	Confident	96 Å²	96	72 Å²	72	59%	0.589	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-91.6	117.3	173.7	50.6	0	0	0	0	109.5	L534 T557	L534-T536 PolarHBondContact O-N 3.4Å; T536-T557 WeakPolarHBondContact O-CB 3.26Å; T536-T557 VanDerWaalsContact O-CG2 3.25Å; T536-T557 WeakPolarHBondContact O-CG2 3.39Å
537	H	88.2	Confident	87	Confident	70.5 Å²	70.5	69.3 Å²	69.3	33%	0.326	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-69.7	153.3	174.8	-65.9	-68	0	0	0	111.4	C553 C556 T557 V559	H537-C553 PolarHBondContact CE1-O 3Å; H537-C556 PolarHBondContact CE1-O 3.48Å; H537-C556 VanDerWaalsContact CE1-O 3.26Å; H537-C556 PolarHBondContact ND1-O 3.15Å; H537-T557 WeakPolarHBondContact CA-O 3.38Å; H537-V559 HydrophobicContact CB-CG1 3.75Å
538	E	89.8	Confident	87.1	Confident	42 Å²	42	70.2 Å²	70.2	20%	0.196	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-76.8	157.5	173.4	-71.7	163.7	-141.8	0	0	111.7	R542 T557 V559 T1034	E538-R542 IonicContact OE1-CZ 3.27Å; E538-R542 IonicContact OE1-NE 3.67Å; E538-R542 IonicContact OE1-NH2 3.81Å; E538-R542 PolarHBondContact OE1-NH2 3.2Å; E538-R542 IonicContact OE2-CZ 3.35Å; E538-R542 IonicContact OE2-NE 3.11Å; E538-R542 PolarHBondContact OE2-NE 3.46Å; E538-R542 IonicContact OE2-NH2 2.98Å; E538-R542 PolarHBondContact OE2-NH2 3.24Å; E538-T557 PolarHBondContact N-O 3.28Å; E538-T557 PolarHBondContact OE1-OG1 2.89Å; E538-T557 VanDerWaalsContact OE1-OG1 3.05Å; E538-V559 WeakPolarHBondContact O-CG1 3.18Å; E538-V559 VanDerWaalsContact O-CG2 3.25Å; E538-V559 WeakPolarHBondContact O-CG2 3.39Å; E538-T1034 VanDerWaalsContact OE1-CG2 3.29Å; E538-T1034 WeakPolarHBondContact OE1-CG2 3.35Å; E538-T1034 WeakPolarHBondContact OE2-CB 3.28Å
539	D	92.1	Very high	87.4	Confident	120 Å²	120	78.2 Å²	78.2	64%	0.642	41%	0.413	S	S	*	.	S	Bend	trans	-86.7	-9.1	178.4	-58.1	-48.8	0	0	0	113.7	S547	D539-S547 WeakPolarHBondContact O-CA 3.34Å; D539-S547 WeakPolarHBondContact O-CB 3.2Å
540	Y	94	Very high	87.7	Confident	90.5 Å²	90.5	77.1 Å²	77.1	36%	0.355	41%	0.409	S	S	.	.	S	Bend	trans	-120.8	131.6	-169.6	-59.9	-73.6	0	0	0	111.9	R542 V559	Y540-R542 PolarHBondContact O-N 2.74Å; Y540-V559 VanDerWaalsContact C-CG2 3.46Å; Y540-V559 WeakPolarHBondContact O-CG2 3.31Å
541	C	94.1	Very high	88	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.381	C	S	.	.			trans	-57.9	133.7	175.4	174.2	0	0	0	0	111.7	V543 H545 Q546 V550 V559 H561	C541-V543 PolarHBondContact O-N 3.07Å; C541-V543 PolarHBondContact SG-N 3.41Å; C541-V543 VanDerWaalsContact SG-N 3.41Å; C541-H545 WeakPolarHBondContact O-CA 3.44Å; C541-H545 PolarHBondContact O-N 3.21Å; C541-Q546 PolarHBondContact N-O 3.13Å; C541-V550 HydrophobicContact CB-CG1 4.43Å; C541-V559 VanDerWaalsContact CA-O 3.31Å; C541-V559 WeakPolarHBondContact CA-O 3.4Å; C541-H561 VanDerWaalsContact CB-CE1 3.44Å; C541-H561 WeakPolarHBondContact CB-CE1 3.31Å; C541-H561 VanDerWaalsContact CB-ND1 3.27Å; C541-H561 WeakPolarHBondContact CB-ND1 3.41Å; C541-H561 PolarHBondContact SG-N 2.89Å
542	R	91.3	Very high	88.5	Confident	13.5 Å²	13.5	70.5 Å²	70.5	5%	0.051	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.8	178.8	-66	-54.6	-168.3	90.9	8.2	114.8	E538 Y540 H545 A558 V559 F560 V1031 A1032 L1033 T1034	E538-R542 IonicContact OE1-CZ 3.27Å; E538-R542 IonicContact OE1-NE 3.67Å; E538-R542 IonicContact OE1-NH2 3.81Å; E538-R542 PolarHBondContact OE1-NH2 3.2Å; E538-R542 IonicContact OE2-CZ 3.35Å; E538-R542 IonicContact OE2-NE 3.11Å; E538-R542 PolarHBondContact OE2-NE 3.46Å; E538-R542 IonicContact OE2-NH2 2.98Å; E538-R542 PolarHBondContact OE2-NH2 3.24Å; Y540-R542 PolarHBondContact O-N 2.74Å; R542-H545 PolarHBondContact O-CE1 3.38Å; R542-H545 VanDerWaalsContact O-CE1 3.31Å; R542-A558 HydrophobicContact CG-CB 3.84Å; R542-V559 PolarHBondContact N-O 3.22Å; R542-F560 HydrophobicContact CB-CD1 4.34Å; R542-F560 HydrophobicContact CB-CE1 3.7Å; R542-F560 HydrophobicContact CB-CE2 4.4Å; R542-F560 HydrophobicContact CB-CZ 3.75Å; R542-F560 HydrophobicContact CG-CE1 4.38Å; R542-F560 HydrophobicContact CG-CE2 4.28Å; R542-F560 HydrophobicContact CG-CZ 3.95Å; R542-V1031 HydrophobicContact CB-CB 4.17Å; R542-V1031 HydrophobicContact CB-CG1 4.48Å; R542-V1031 PolarHBondContact NH1-O 2.88Å; R542-A1032 PolarHBondContact NH1-O 2.79Å; R542-L1033 WeakPolarHBondContact CD-O 3.43Å; R542-L1033 PolarHBondContact NH1-O 3.23Å; R542-T1034 VanDerWaalsContact NH1-N 3.16Å
543	V	90.6	Very high	89	Confident	26.5 Å²	26.5	64 Å²	64	16%	0.161	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-62.2	-178.4	178.8	0	0	0	0	111.2	C541 F560 C564 T977 V1031	C541-V543 PolarHBondContact O-N 3.07Å; C541-V543 PolarHBondContact SG-N 3.41Å; C541-V543 VanDerWaalsContact SG-N 3.41Å; V543-F560 HydrophobicContact CG2-CD1 3.83Å; V543-F560 HydrophobicContact CG2-CE1 3.98Å; V543-C564 HydrophobicContact CB-CB 3.84Å; V543-C564 HydrophobicContact CG1-CB 4.06Å; V543-C564 HydrophobicContact CG2-CB 4.11Å; V543-T977 HydrophobicContact CB-CG2 4.48Å; V543-T977 HydrophobicContact CG1-CG2 3.95Å; V543-T977 HydrophobicContact CG2-CG2 3.87Å; V543-V1031 HydrophobicContact CB-CG1 4.48Å; V543-V1031 HydrophobicContact CG2-CG1 3.63Å
544	C	91.2	Very high	89.7	Confident	44.5 Å²	44.5	67.8 Å²	67.8	30%	0.301	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-6.6	-175.1	66.3	0	0	0	0	114.2	Q546 H561	C544-Q546 PolarHBondContact O-N 3.11Å; C544-Q546 VanDerWaalsContact O-N 3.11Å; C544-H561 PolarHBondContact SG-CE1 2.92Å; C544-H561 PolarHBondContact SG-ND1 3.19Å
545	H	91	Very high	90	Very high	35 Å²	35	63.8 Å²	63.8	16%	0.162	36%	0.358	C	S	.	.			trans	59.1	16.8	-178	-55.2	-44.8	0	0	0	115.6	C541 R542 R1035 H1038	C541-H545 WeakPolarHBondContact O-CA 3.44Å; C541-H545 PolarHBondContact O-N 3.21Å; R542-H545 PolarHBondContact O-CE1 3.38Å; R542-H545 VanDerWaalsContact O-CE1 3.31Å; H545-R1035 HydrophobicContact CB-CG 4.05Å; H545-R1035 WeakPolarHBondContact O-CD 3.26Å; H545-R1035 PolarHBondContact O-NH1 2.99Å; H545-H1038 AromaticContact NE2-CG 3.96Å; H545-H1038 AromaticContact NE2-ND1 3.84Å
546	Q	92.6	Very high	90.5	Very high	130 Å²	130	60.4 Å²	60.4	61%	0.607	34%	0.343	S	S	*	.			trans	-98.1	153.1	175.4	-62.2	176.3	19.1	0	0	110.9	C541 C544 H561	C541-Q546 PolarHBondContact N-O 3.13Å; C544-Q546 PolarHBondContact O-N 3.11Å; C544-Q546 VanDerWaalsContact O-N 3.11Å; Q546-H561 PolarHBondContact O-CE1 3.27Å
547	S	92.3	Very high	90.9	Very high	78.5 Å²	78.5	57.8 Å²	57.8	55%	0.549	33%	0.327	S	S	.	.			trans	-86.3	158.5	169.3	54.2	0	0	0	0	110	D539	D539-S547 WeakPolarHBondContact O-CA 3.34Å; D539-S547 WeakPolarHBondContact O-CB 3.2Å
548	G	90.9	Very high	91	Very high	51.5 Å²	51.5	54.5 Å²	54.5	53%	0.531	31%	0.312	S	S	.	.	S	Bend	trans	160.4	-154.1	-178.9	0	0	0	0	0	112	V550	G548-V550 PolarHBondContact O-N 3.36Å; G548-V550 VanDerWaalsContact O-N 3.15Å
549	E	91.7	Very high	91.2	Very high	185.5 Å²	185.5	52.5 Å²	52.5	87%	0.867	30%	0.303	S	S	*	.	S	Bend	trans	-75.9	98	172.1	-69	-176.8	-179.6	0	0	110	H561	E549-H561 PolarHBondContact O-CD2 2.95Å; E549-H561 VanDerWaalsContact O-CD2 3.29Å
550	V	93.4	Very high	91.3	Very high	44 Å²	44	46.9 Å²	46.9	27%	0.267	27%	0.273	S	S	.	.			trans	-111.2	145.8	-174.7	-64.6	0	0	0	0	111.8	C541 G548 V559	C541-V550 HydrophobicContact CB-CG1 4.43Å; G548-V550 PolarHBondContact O-N 3.36Å; G548-V550 VanDerWaalsContact O-N 3.15Å; V550-V559 HydrophobicContact CB-CB 3.88Å; V550-V559 HydrophobicContact CB-CG2 4.03Å; V550-V559 HydrophobicContact CG1-CG2 4.19Å; V550-V559 HydrophobicContact CG2-CB 3.81Å; V550-V559 HydrophobicContact CG2-CG1 4.23Å; V550-V559 HydrophobicContact CG2-CG2 3.93Å
551	L	93.6	Very high	91.3	Very high	20.5 Å²	20.5	44.2 Å²	44.2	11%	0.107	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.7	170.7	-177.5	63.6	0	0	0	109.5	V559 F560 L562 L565 L569 V572 P573 W577	L551-V559 CarbonylContact O-C 3.53Å; L551-V559 VanDerWaalsContact O-CA 3.27Å; L551-V559 WeakPolarHBondContact O-CA 3.43Å; L551-F560 WeakPolarHBondContact CB-O 3.36Å; L551-F560 PolarHBondContact N-O 3.06Å; L551-F560 PolarHBondContact O-N 3.18Å; L551-L562 HydrophobicContact CB-CD2 4.23Å; L551-L562 HydrophobicContact CD2-CD2 3.97Å; L551-L565 HydrophobicContact CD2-CD1 4.24Å; L551-L569 HydrophobicContact CD2-CD1 4Å; L551-V572 HydrophobicContact CD1-CG1 4.01Å; L551-P573 HydrophobicContact CD2-CG 4.35Å; L551-W577 HydrophobicContact CD2-CB 4.46Å; L551-W577 HydrophobicContact CD2-CD2 3.45Å; L551-W577 VanDerWaalsContact CD2-CD2 3.45Å; L551-W577 HydrophobicContact CD2-CE3 3.61Å; L551-W577 HydrophobicContact CD2-CG 3.83Å; L551-W577 HydrophobicContact CD2-CH2 4.32Å; L551-W577 HydrophobicContact CD2-CZ2 4.21Å; L551-W577 HydrophobicContact CD2-CZ3 4.04Å; L551-W577 HydrophobicContact CG-CD2 4.11Å; L551-W577 HydrophobicContact CG-CE3 3.75Å; L551-W577 HydrophobicContact CG-CZ3 4.1Å
552	C	92.7	Very high	91.3	Very high	51 Å²	51	46.2 Å²	46.2	35%	0.345	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	138	175.5	-60.6	0	0	0	0	111
553	C	92.4	Very high	91.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-84.3	129.2	173.1	177.3	0	0	0	0	110.8	H537 G555 C556 A558 W577 C579	H537-C553 PolarHBondContact CE1-O 3Å; C553-G555 PolarHBondContact O-N 3.29Å; C553-G555 VanDerWaalsContact O-N 3.12Å; C553-G555 PolarHBondContact SG-N 3.11Å; C553-G555 VanDerWaalsContact SG-N 3.4Å; C553-C556 PolarHBondContact O-N 3Å; C553-C556 VanDerWaalsContact SG-SG 3.65Å; C553-A558 WeakPolarHBondContact CB-O 3.41Å; C553-A558 PolarHBondContact N-O 3.34Å; C553-A558 VanDerWaalsContact N-O 3.13Å; C553-W577 HydrophobicContact CB-CE3 4.29Å; C553-W577 HydrophobicContact CB-CZ3 3.89Å; C553-C579 HydrophobicContact CB-CB 3.95Å; C553-C579 PolarHBondContact SG-N 3.45Å; C553-C579 PolarHBondContact SG-SG 3.05Å
554	D	87.2	Confident	91.3	Very high	103 Å²	103	53.3 Å²	53.3	55%	0.551	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.5	179.4	-62.2	-35.7	0	0	0	113.5	S576 W577	D554-S576 VanDerWaalsContact OD2-C 3.26Å; D554-S576 WeakPolarHBondContact OD2-CA 3.24Å; D554-S576 WeakPolarHBondContact OD2-CB 3.38Å; D554-W577 PolarHBondContact N-O 3.09Å; D554-W577 PolarHBondContact OD2-N 3.3Å
555	G	83.1	Confident	91.2	Very high	42.5 Å²	42.5	51.8 Å²	51.8	44%	0.438	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-8.4	-176.4	0	0	0	0	0	116.1	C553	C553-G555 PolarHBondContact O-N 3.29Å; C553-G555 VanDerWaalsContact O-N 3.12Å; C553-G555 PolarHBondContact SG-N 3.11Å; C553-G555 VanDerWaalsContact SG-N 3.4Å
556	C	87.6	Confident	90.7	Very high	23 Å²	23	56 Å²	56	16%	0.155	32%	0.321	C	S	.	.	S	Bend	trans	-163.5	174.4	179.2	69	0	0	0	0	112.4	H537 C553 A558 C579 C582	H537-C556 PolarHBondContact CE1-O 3.48Å; H537-C556 VanDerWaalsContact CE1-O 3.26Å; H537-C556 PolarHBondContact ND1-O 3.15Å; C553-C556 PolarHBondContact O-N 3Å; C553-C556 VanDerWaalsContact SG-SG 3.65Å; C556-A558 PolarHBondContact O-N 3.16Å; C556-A558 VanDerWaalsContact O-N 3.08Å; C556-A558 WeakPolarHBondContact SG-CB 3.43Å; C556-C579 VanDerWaalsContact SG-SG 3.69Å; C556-C582 VanDerWaalsContact CB-SG 3.6Å; C556-C582 PolarHBondContact SG-SG 3.1Å
557	T	88.6	Confident	90.3	Very high	42 Å²	42	54.6 Å²	54.6	26%	0.258	32%	0.323	S	S	.	.	S	Bend	trans	-67.2	-6.3	179.2	64.1	0	0	0	0	114.8	M535 T536 H537 E538	M535-T557 HydrophobicContact CG-CG2 4.16Å; M535-T557 HydrophobicContact SD-CG2 3.43Å; M535-T557 WeakPolarHBondContact SD-CG2 3.44Å; T536-T557 WeakPolarHBondContact O-CB 3.26Å; T536-T557 VanDerWaalsContact O-CG2 3.25Å; T536-T557 WeakPolarHBondContact O-CG2 3.39Å; H537-T557 WeakPolarHBondContact CA-O 3.38Å; E538-T557 PolarHBondContact N-O 3.28Å; E538-T557 PolarHBondContact OE1-OG1 2.89Å; E538-T557 VanDerWaalsContact OE1-OG1 3.05Å
558	A	91.6	Very high	90	Very high	2 Å²	2	54.5 Å²	54.5	2%	0.017	32%	0.32	C	S	.	.			trans	-71.4	144.6	-172.9	0	0	0	0	0	112.6	R542 C553 C556 F560	R542-A558 HydrophobicContact CG-CB 3.84Å; C553-A558 WeakPolarHBondContact CB-O 3.41Å; C553-A558 PolarHBondContact N-O 3.34Å; C553-A558 VanDerWaalsContact N-O 3.13Å; C556-A558 PolarHBondContact O-N 3.16Å; C556-A558 VanDerWaalsContact O-N 3.08Å; C556-A558 WeakPolarHBondContact SG-CB 3.43Å; A558-F560 HydrophobicContact CB-CE2 3.67Å; A558-F560 HydrophobicContact CB-CZ 4.31Å
559	V	93.8	Very high	90	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.1	175.6	-55.9	0	0	0	0	111.3	H537 E538 Y540 C541 R542 V550 L551	H537-V559 HydrophobicContact CB-CG1 3.75Å; E538-V559 WeakPolarHBondContact O-CG1 3.18Å; E538-V559 VanDerWaalsContact O-CG2 3.25Å; E538-V559 WeakPolarHBondContact O-CG2 3.39Å; Y540-V559 VanDerWaalsContact C-CG2 3.46Å; Y540-V559 WeakPolarHBondContact O-CG2 3.31Å; C541-V559 VanDerWaalsContact CA-O 3.31Å; C541-V559 WeakPolarHBondContact CA-O 3.4Å; R542-V559 PolarHBondContact N-O 3.22Å; V550-V559 HydrophobicContact CB-CB 3.88Å; V550-V559 HydrophobicContact CB-CG2 4.03Å; V550-V559 HydrophobicContact CG1-CG2 4.19Å; V550-V559 HydrophobicContact CG2-CB 3.81Å; V550-V559 HydrophobicContact CG2-CG1 4.23Å; V550-V559 HydrophobicContact CG2-CG2 3.93Å; L551-V559 CarbonylContact O-C 3.53Å; L551-V559 VanDerWaalsContact O-CA 3.27Å; L551-V559 WeakPolarHBondContact O-CA 3.43Å
560	F	94.4	Very high	89.7	Confident	1.5 Å²	1.5	51.6 Å²	51.6	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	140.2	-174.8	-64.4	-98.7	0	0	0	111.6	R542 V543 L551 A558 L565 W577 C579 V1031	R542-F560 HydrophobicContact CB-CD1 4.34Å; R542-F560 HydrophobicContact CB-CE1 3.7Å; R542-F560 HydrophobicContact CB-CE2 4.4Å; R542-F560 HydrophobicContact CB-CZ 3.75Å; R542-F560 HydrophobicContact CG-CE1 4.38Å; R542-F560 HydrophobicContact CG-CE2 4.28Å; R542-F560 HydrophobicContact CG-CZ 3.95Å; V543-F560 HydrophobicContact CG2-CD1 3.83Å; V543-F560 HydrophobicContact CG2-CE1 3.98Å; L551-F560 WeakPolarHBondContact CB-O 3.36Å; L551-F560 PolarHBondContact N-O 3.06Å; L551-F560 PolarHBondContact O-N 3.18Å; A558-F560 HydrophobicContact CB-CE2 3.67Å; A558-F560 HydrophobicContact CB-CZ 4.31Å; F560-L565 HydrophobicContact CB-CD1 4.5Å; F560-L565 HydrophobicContact CB-CD2 3.69Å; F560-L565 HydrophobicContact CB-CG 4.09Å; F560-L565 HydrophobicContact CD1-CD2 3.77Å; F560-L565 HydrophobicContact CG-CD2 3.76Å; F560-W577 HydrophobicContact CB-CH2 4.27Å; F560-W577 AromaticContact CD2-CH2 3.59Å; F560-W577 HydrophobicContact CD2-CH2 3.59Å; F560-W577 AromaticContact CD2-CZ3 3.98Å; F560-W577 HydrophobicContact CD2-CZ3 4.03Å; F560-W577 HydrophobicContact CE2-CH2 4.2Å; F560-W577 HydrophobicContact CG-CH2 4.08Å; F560-C579 HydrophobicContact CD2-CB 4.02Å; F560-C579 HydrophobicContact CE2-CB 3.38Å; F560-C579 HydrophobicContact CZ-CB 4Å; F560-V1031 HydrophobicContact CE1-CB 4.17Å; F560-V1031 HydrophobicContact CE1-CG1 4.33Å; F560-V1031 HydrophobicContact CZ-CB 4.39Å
561	H	94.1	Very high	89.5	Confident	33 Å²	33	53.2 Å²	53.2	15%	0.153	32%	0.322	C	S	.	.			trans	-70.4	145.8	164.3	-59.4	112.8	0	0	0	109.7	C541 C544 Q546 E549 H563 C564 L565	C541-H561 VanDerWaalsContact CB-CE1 3.44Å; C541-H561 WeakPolarHBondContact CB-CE1 3.31Å; C541-H561 VanDerWaalsContact CB-ND1 3.27Å; C541-H561 WeakPolarHBondContact CB-ND1 3.41Å; C541-H561 PolarHBondContact SG-N 2.89Å; C544-H561 PolarHBondContact SG-CE1 2.92Å; C544-H561 PolarHBondContact SG-ND1 3.19Å; Q546-H561 PolarHBondContact O-CE1 3.27Å; E549-H561 PolarHBondContact O-CD2 2.95Å; E549-H561 VanDerWaalsContact O-CD2 3.29Å; H561-H563 VanDerWaalsContact C-N 3.26Å; H561-H563 PolarHBondContact O-N 3.1Å; H561-C564 HydrophobicContact CB-CB 4.05Å; H561-C564 WeakPolarHBondContact O-CB 3.27Å; H561-C564 PolarHBondContact O-N 3.04Å; H561-L565 PolarHBondContact O-N 3.21Å
562	L	93	Very high	89.4	Confident	42.5 Å²	42.5	56.8 Å²	56.8	22%	0.223	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-56.3	-40.4	178.6	-63.8	177.9	0	0	0	112.5	L551 C564 L565 P568 L569 V572	L551-L562 HydrophobicContact CB-CD2 4.23Å; L551-L562 HydrophobicContact CD2-CD2 3.97Å; L562-C564 VanDerWaalsContact C-N 3.34Å; L562-L565 PolarHBondContact O-N 3.37Å; L562-P568 WeakPolarHBondContact O-CA 3.42Å; L562-L569 HydrophobicContact CB-CB 4.22Å; L562-L569 WeakPolarHBondContact CB-O 3.45Å; L562-L569 HydrophobicContact CD2-CB 3.9Å; L562-L569 HydrophobicContact CD2-CD1 4.14Å; L562-L569 PolarHBondContact O-N 3.44Å; L562-V572 HydrophobicContact CD1-CG2 4.2Å
563	H	90.7	Very high	89.2	Confident	158.5 Å²	158.5	56.2 Å²	56.2	73%	0.734	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-74.2	-21	177.3	-179.1	58	0	0	0	113.8	H561 L565	H561-H563 VanDerWaalsContact C-N 3.26Å; H561-H563 PolarHBondContact O-N 3.1Å; H563-L565 VanDerWaalsContact C-N 3.29Å
564	C	91.5	Very high	88.9	Confident	31.5 Å²	31.5	63.3 Å²	63.3	21%	0.213	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-81.4	-8.9	177.8	-71.5	0	0	0	0	113.3	V543 H561 L562	V543-C564 HydrophobicContact CB-CB 3.84Å; V543-C564 HydrophobicContact CG1-CB 4.06Å; V543-C564 HydrophobicContact CG2-CB 4.11Å; H561-C564 HydrophobicContact CB-CB 4.05Å; H561-C564 WeakPolarHBondContact O-CB 3.27Å; H561-C564 PolarHBondContact O-N 3.04Å; L562-C564 VanDerWaalsContact C-N 3.34Å
565	L	88.3	Confident	88.9	Confident	12.5 Å²	12.5	63.2 Å²	63.2	7%	0.065	39%	0.386	C	S	.	.	S	Bend	trans	-78.8	154.2	176.8	-66.2	171.5	0	0	0	110.7	L551 F560 H561 L562 H563 P567 P568 L569 W577 P580	L551-L565 HydrophobicContact CD2-CD1 4.24Å; F560-L565 HydrophobicContact CB-CD1 4.5Å; F560-L565 HydrophobicContact CB-CD2 3.69Å; F560-L565 HydrophobicContact CB-CG 4.09Å; F560-L565 HydrophobicContact CD1-CD2 3.77Å; F560-L565 HydrophobicContact CG-CD2 3.76Å; H561-L565 PolarHBondContact O-N 3.21Å; L562-L565 PolarHBondContact O-N 3.37Å; H563-L565 VanDerWaalsContact C-N 3.29Å; L565-P567 CarbonylContact C-O 3.54Å; L565-P567 CarbonylContact O-C 3.43Å; L565-P568 WeakPolarHBondContact O-CA 3.27Å; L565-L569 HydrophobicContact CD1-CD1 3.48Å; L565-L569 VanDerWaalsContact CD1-CD1 3.48Å; L565-L569 HydrophobicContact CD1-CG 3.82Å; L565-W577 HydrophobicContact CD1-CH2 4.22Å; L565-W577 HydrophobicContact CD1-CZ2 3.59Å; L565-W577 HydrophobicContact CD2-CH2 3.9Å; L565-W577 HydrophobicContact CD2-CZ2 3.61Å; L565-W577 HydrophobicContact CG-CZ2 4.27Å; L565-P580 HydrophobicContact CD2-CG 4.42Å
566	N	81.1	Confident	89	Confident	123.5 Å²	123.5	65.6 Å²	65.6	66%	0.66	40%	0.396	S	S	*	.	S	Bend	trans	-122.3	113.1	173.3	-171.4	11.8	0	0	0	109.9
567	P	84.8	Confident	89.1	Confident	99.5 Å²	99.5	66.4 Å²	66.4	65%	0.646	40%	0.396	S	S	*	.	S	Bend	cis	-67.3	153.3	-6.1	29.7	-35	0	0	0	112.1	L565	L565-P567 CarbonylContact C-O 3.54Å; L565-P567 CarbonylContact O-C 3.43Å
568	P	86.5	Confident	89.2	Confident	76 Å²	76	66.6 Å²	66.6	49%	0.494	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-66.1	137.6	178.8	25.4	-33.2	0	0	0	110.5	L562 L565	L562-P568 WeakPolarHBondContact O-CA 3.42Å; L565-P568 WeakPolarHBondContact O-CA 3.27Å
569	L	89.2	Confident	89.2	Confident	54.5 Å²	54.5	66.5 Å²	66.5	29%	0.285	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-85.9	136.6	177.8	-63.8	-178.7	0	0	0	110	L551 L562 L565 P573	L551-L569 HydrophobicContact CD2-CD1 4Å; L562-L569 HydrophobicContact CB-CB 4.22Å; L562-L569 WeakPolarHBondContact CB-O 3.45Å; L562-L569 HydrophobicContact CD2-CB 3.9Å; L562-L569 HydrophobicContact CD2-CD1 4.14Å; L562-L569 PolarHBondContact O-N 3.44Å; L565-L569 HydrophobicContact CD1-CD1 3.48Å; L565-L569 VanDerWaalsContact CD1-CD1 3.48Å; L565-L569 HydrophobicContact CD1-CG 3.82Å; L569-P573 HydrophobicContact CD1-CG 3.87Å
570	S	86.9	Confident	88.8	Confident	123.5 Å²	123.5	68.6 Å²	68.6	86%	0.864	41%	0.408	S	S	*	.	S	Bend	trans	-82.8	-26.7	176.9	54.8	0	0	0	0	113
571	S	88.9	Confident	88.5	Confident	77 Å²	77	68.8 Å²	68.8	54%	0.538	41%	0.409	S	S	.	.	S	Bend	trans	-149	160.4	-179.1	57.6	0	0	0	0	110.5
572	V	90.3	Very high	88.3	Confident	95 Å²	95	68.1 Å²	68.1	58%	0.576	41%	0.408	S	S	*	.			trans	-61	128	174.4	178.3	0	0	0	0	109.2	L551 L562	L551-V572 HydrophobicContact CD1-CG1 4.01Å; L562-V572 HydrophobicContact CD1-CG2 4.2Å
573	P	88.6	Confident	88	Confident	38.5 Å²	38.5	70.5 Å²	70.5	25%	0.25	42%	0.42	C	S	.	.			trans	-57.4	140.7	176	-24.9	34.7	0	0	0	111.9	L551 L569 T575 W577	L551-P573 HydrophobicContact CD2-CG 4.35Å; L569-P573 HydrophobicContact CD1-CG 3.87Å; P573-T575 VanDerWaalsContact C-N 3.28Å; P573-W577 HydrophobicContact CB-CB 4.33Å; P573-W577 HydrophobicContact CG-CB 4.1Å; P573-W577 HydrophobicContact CG-CG 4.1Å
574	T	86.4	Confident	87.7	Confident	149 Å²	149	69.8 Å²	69.8	91%	0.914	41%	0.411	S	S	*	.	S	Bend	trans	-80.3	-12.2	176.9	54.8	0	0	0	0	113.3
575	T	86.6	Confident	87.4	Confident	102 Å²	102	69.7 Å²	69.7	63%	0.626	41%	0.407	S	S	*	.	S	Bend	trans	-111.5	166.6	178.8	60.2	0	0	0	0	110.3	P573 W577	P573-T575 VanDerWaalsContact C-N 3.28Å; T575-W577 PolarHBondContact O-N 3.08Å
576	S	85.3	Confident	87.3	Confident	92.5 Å²	92.5	76.1 Å²	76.1	65%	0.647	43%	0.43	S	S	*	.			trans	-49	128.2	171.8	58	0	0	0	0	111.1	D554	D554-S576 VanDerWaalsContact OD2-C 3.26Å; D554-S576 WeakPolarHBondContact OD2-CA 3.24Å; D554-S576 WeakPolarHBondContact OD2-CB 3.38Å
577	W	91	Very high	87.7	Confident	39.5 Å²	39.5	71.2 Å²	71.2	15%	0.15	41%	0.405	C	S	.	.			trans	-113.6	135.6	-177.4	179	84	0	0	0	110.8	L551 C553 D554 F560 L565 P573 T575 C579	L551-W577 HydrophobicContact CD2-CB 4.46Å; L551-W577 HydrophobicContact CD2-CD2 3.45Å; L551-W577 VanDerWaalsContact CD2-CD2 3.45Å; L551-W577 HydrophobicContact CD2-CE3 3.61Å; L551-W577 HydrophobicContact CD2-CG 3.83Å; L551-W577 HydrophobicContact CD2-CH2 4.32Å; L551-W577 HydrophobicContact CD2-CZ2 4.21Å; L551-W577 HydrophobicContact CD2-CZ3 4.04Å; L551-W577 HydrophobicContact CG-CD2 4.11Å; L551-W577 HydrophobicContact CG-CE3 3.75Å; L551-W577 HydrophobicContact CG-CZ3 4.1Å; C553-W577 HydrophobicContact CB-CE3 4.29Å; C553-W577 HydrophobicContact CB-CZ3 3.89Å; D554-W577 PolarHBondContact N-O 3.09Å; D554-W577 PolarHBondContact OD2-N 3.3Å; F560-W577 HydrophobicContact CB-CH2 4.27Å; F560-W577 AromaticContact CD2-CH2 3.59Å; F560-W577 HydrophobicContact CD2-CH2 3.59Å; F560-W577 AromaticContact CD2-CZ3 3.98Å; F560-W577 HydrophobicContact CD2-CZ3 4.03Å; F560-W577 HydrophobicContact CE2-CH2 4.2Å; F560-W577 HydrophobicContact CG-CH2 4.08Å; L565-W577 HydrophobicContact CD1-CH2 4.22Å; L565-W577 HydrophobicContact CD1-CZ2 3.59Å; L565-W577 HydrophobicContact CD2-CH2 3.9Å; L565-W577 HydrophobicContact CD2-CZ2 3.61Å; L565-W577 HydrophobicContact CG-CZ2 4.27Å; P573-W577 HydrophobicContact CB-CB 4.33Å; P573-W577 HydrophobicContact CG-CB 4.1Å; P573-W577 HydrophobicContact CG-CG 4.1Å; T575-W577 PolarHBondContact O-N 3.08Å; W577-C579 VanDerWaalsContact CH2-CA 3.44Å; W577-C579 HydrophobicContact CH2-CB 3.44Å; W577-C579 VanDerWaalsContact CH2-CB 3.44Å; W577-C579 HydrophobicContact CZ2-CB 4.18Å; W577-C579 HydrophobicContact CZ3-CB 3.75Å
578	I	90.5	Very high	87.8	Confident	46 Å²	46	69.8 Å²	69.8	24%	0.236	40%	0.396	C	S	.	.			trans	-122.1	129.1	-178.1	-59.9	-168.8	0	0	0	108.5	C582 I583	I578-C582 HydrophobicContact CG2-CB 3.2Å; I578-I583 HydrophobicContact CB-CG1 4.43Å; I578-I583 HydrophobicContact CG2-CG1 4.05Å; I578-I583 WeakPolarHBondContact O-CD1 3.36Å
579	C	90.9	Very high	88	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	37%	0.374	C	S	.	.			trans	-69.3	160.9	-176.8	73.8	0	0	0	0	113	C553 C556 F560 W577 V581 C582 I583	C553-C579 HydrophobicContact CB-CB 3.95Å; C553-C579 PolarHBondContact SG-N 3.45Å; C553-C579 PolarHBondContact SG-SG 3.05Å; C556-C579 VanDerWaalsContact SG-SG 3.69Å; F560-C579 HydrophobicContact CD2-CB 4.02Å; F560-C579 HydrophobicContact CE2-CB 3.38Å; F560-C579 HydrophobicContact CZ-CB 4Å; W577-C579 VanDerWaalsContact CH2-CA 3.44Å; W577-C579 HydrophobicContact CH2-CB 3.44Å; W577-C579 VanDerWaalsContact CH2-CB 3.44Å; W577-C579 HydrophobicContact CZ2-CB 4.18Å; W577-C579 HydrophobicContact CZ3-CB 3.75Å; C579-V581 PolarHBondContact O-N 2.85Å; C579-V581 VanDerWaalsContact O-N 3.13Å; C579-C582 PolarHBondContact O-N 3.19Å; C579-C582 PolarHBondContact SG-N 3.26Å; C579-C582 VanDerWaalsContact SG-N 3.42Å; C579-I583 WeakPolarHBondContact O-CG1 3.33Å; C579-I583 PolarHBondContact O-N 2.93Å
580	P	86.7	Confident	88.1	Confident	45 Å²	45	64 Å²	64	29%	0.292	36%	0.362	S	S	.	.	H	α-helix	trans	-54.6	-34.1	178.7	-27.6	35.6	0	0	0	113.9	L565 I583 R584	L565-P580 HydrophobicContact CD2-CG 4.42Å; P580-I583 PolarHBondContact O-N 2.99Å; P580-R584 WeakPolarHBondContact O-CB 3.34Å; P580-R584 PolarHBondContact O-N 3.33Å
581	V	87.9	Confident	88.1	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.03	34%	0.335	C	S	.	.	H	α-helix	trans	-64.3	-49.4	176	-178.1	0	0	0	0	110.8	C579 I583 R584 K585 L970 V975 V1031 A1032	C579-V581 PolarHBondContact O-N 2.85Å; C579-V581 VanDerWaalsContact O-N 3.13Å; V581-I583 VanDerWaalsContact C-N 3.34Å; V581-I583 PolarHBondContact O-N 3.06Å; V581-R584 PolarHBondContact O-N 3.42Å; V581-K585 HydrophobicContact CG1-CD 4.23Å; V581-K585 WeakPolarHBondContact O-CG 3.36Å; V581-K585 PolarHBondContact O-N 3.24Å; V581-L970 HydrophobicContact CG1-CD2 4.15Å; V581-V975 HydrophobicContact CG1-CG2 4.43Å; V581-V975 HydrophobicContact CG2-CB 4.29Å; V581-V975 HydrophobicContact CG2-CG1 4.49Å; V581-V975 HydrophobicContact CG2-CG2 4.22Å; V581-V1031 HydrophobicContact CG2-CB 4.35Å; V581-V1031 HydrophobicContact CG2-CG2 3.67Å; V581-V1031 WeakPolarHBondContact CG2-O 3.5Å; V581-A1032 HydrophobicContact CG1-CB 4.16Å; V581-A1032 HydrophobicContact CG2-CB 4.47Å
582	C	88.9	Confident	88	Confident	18 Å²	18	60.5 Å²	60.5	12%	0.122	33%	0.329	C	S	.	.	H	α-helix	trans	-68.5	-33.5	179.5	-76.1	0	0	0	0	112.1	C556 I578 C579 R584 K585 R586	C556-C582 VanDerWaalsContact CB-SG 3.6Å; C556-C582 PolarHBondContact SG-SG 3.1Å; I578-C582 HydrophobicContact CG2-CB 3.2Å; C579-C582 PolarHBondContact O-N 3.19Å; C579-C582 PolarHBondContact SG-N 3.26Å; C579-C582 VanDerWaalsContact SG-N 3.42Å; C582-R584 VanDerWaalsContact C-N 3.35Å; C582-K585 PolarHBondContact O-N 2.97Å; C582-R586 WeakPolarHBondContact O-CG 3.48Å; C582-R586 PolarHBondContact O-N 3.13Å
583	I	87.2	Confident	87.9	Confident	94 Å²	94	56.2 Å²	56.2	48%	0.482	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-48.6	172	-67	169.8	0	0	0	109.9	I578 C579 P580 V581 K585 R586	I578-I583 HydrophobicContact CB-CG1 4.43Å; I578-I583 HydrophobicContact CG2-CG1 4.05Å; I578-I583 WeakPolarHBondContact O-CD1 3.36Å; C579-I583 WeakPolarHBondContact O-CG1 3.33Å; C579-I583 PolarHBondContact O-N 2.93Å; P580-I583 PolarHBondContact O-N 2.99Å; V581-I583 VanDerWaalsContact C-N 3.34Å; V581-I583 PolarHBondContact O-N 3.06Å; I583-K585 VanDerWaalsContact C-N 3.27Å; I583-K585 PolarHBondContact O-N 3.41Å; I583-R586 WeakPolarHBondContact O-CB 3.39Å; I583-R586 WeakPolarHBondContact O-CG 3.29Å; I583-R586 PolarHBondContact O-N 3.31Å; I583-R586 VanDerWaalsContact O-N 3.09Å
584	R	84	Confident	87.8	Confident	142.5 Å²	142.5	56.7 Å²	56.7	54%	0.538	30%	0.304	S	S	.	.	H	α-helix	trans	-69.9	-21.7	-179	-165.2	157.2	179.2	131.8	-2.4	113.8	P580 V581 C582 R586 L970 E980	P580-R584 WeakPolarHBondContact O-CB 3.34Å; P580-R584 PolarHBondContact O-N 3.33Å; V581-R584 PolarHBondContact O-N 3.42Å; C582-R584 VanDerWaalsContact C-N 3.35Å; R584-R586 VanDerWaalsContact C-N 3.33Å; R584-L970 HydrophobicContact CB-CD1 4.49Å; R584-L970 HydrophobicContact CB-CD2 4.05Å; R584-L970 HydrophobicContact CG-CD1 3.84Å; R584-L970 HydrophobicContact CG-CD2 4.2Å; R584-E980 IonicContact CZ-OE1 2.61Å; R584-E980 IonicContact NH1-OE1 3.43Å; R584-E980 PolarHBondContact NH1-OE1 3.35Å; R584-E980 IonicContact NH1-OE2 3.07Å
585	K	84.7	Confident	87.6	Confident	31 Å²	31	50.8 Å²	50.8	14%	0.135	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-4	172.2	-74.5	178.8	-177.9	168.4	0	114.4	V581 C582 I583 T587 L970 Y971	V581-K585 HydrophobicContact CG1-CD 4.23Å; V581-K585 WeakPolarHBondContact O-CG 3.36Å; V581-K585 PolarHBondContact O-N 3.24Å; C582-K585 PolarHBondContact O-N 2.97Å; I583-K585 VanDerWaalsContact C-N 3.27Å; I583-K585 PolarHBondContact O-N 3.41Å; K585-T587 PolarHBondContact O-N 3.29Å; K585-T587 VanDerWaalsContact O-N 3.09Å; K585-L970 HydrophobicContact CD-CD2 4.43Å; K585-L970 HydrophobicContact CG-CD2 3.58Å; K585-Y971 VanDerWaalsContact NZ-CE2 3.34Å; K585-Y971 PolarHBondContact NZ-OH 3.21Å
586	R	86.6	Confident	87.2	Confident	145.5 Å²	145.5	51 Å²	51	55%	0.549	26%	0.263	S	S	.	.			trans	-68.3	107.5	-179.8	-70.4	-174.9	-178.7	-173.4	2.3	109.9	C582 I583 R584	C582-R586 WeakPolarHBondContact O-CG 3.48Å; C582-R586 PolarHBondContact O-N 3.13Å; I583-R586 WeakPolarHBondContact O-CB 3.39Å; I583-R586 WeakPolarHBondContact O-CG 3.29Å; I583-R586 PolarHBondContact O-N 3.31Å; I583-R586 VanDerWaalsContact O-N 3.09Å; R584-R586 VanDerWaalsContact C-N 3.33Å
587	T	89.5	Confident	86.8	Confident	21 Å²	21	48.3 Å²	48.3	13%	0.129	25%	0.246	C	C	.	.			trans	-104.2	115.1	173.6	-58.8	0	0	0	0	108.5	P377 R379 K585 V590 T591 W967	P377-T587 WeakPolarHBondContact O-CB 3.48Å; P377-T587 PolarHBondContact O-OG1 2.99Å; R379-T587 HydrophobicContact CG-CG2 3.97Å; K585-T587 PolarHBondContact O-N 3.29Å; K585-T587 VanDerWaalsContact O-N 3.09Å; T587-V590 HydrophobicContact CG2-CB 4.24Å; T587-V590 HydrophobicContact CG2-CG2 3.76Å; T587-V590 PolarHBondContact O-N 3.08Å; T587-V590 VanDerWaalsContact O-N 3.08Å; T587-T591 PolarHBondContact N-OG1 3.2Å; T587-T591 PolarHBondContact O-N 3.1Å; T587-T591 PolarHBondContact O-OG1 2.91Å; T587-W967 HydrophobicContact CG2-CH2 3.69Å; T587-W967 HydrophobicContact CG2-CZ2 4.46Å
588	P	87.9	Confident	86.4	Confident	70.5 Å²	70.5	47.5 Å²	47.5	46%	0.458	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	139	174.2	-24.5	33.9	0	0	0	111.6	R379 V590 L782	R379-P588 PolarHBondContact NE-O 2.68Å; P588-V590 VanDerWaalsContact C-N 3.28Å; P588-V590 PolarHBondContact O-N 2.95Å; P588-L782 HydrophobicContact CB-CD2 4.32Å
589	G	89.7	Confident	85.8	Confident	3.5 Å²	3.5	50.5 Å²	50.5	4%	0.036	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	-16.2	-171.5	0	0	0	0	0	114.7	D592 C593 R623	G589-D592 WeakPolarHBondContact CA-OD1 3.36Å; G589-D592 PolarHBondContact N-OD1 3.07Å; G589-D592 PolarHBondContact N-OD2 2.87Å; G589-C593 PolarHBondContact O-SG 3.18Å; G589-R623 PolarHBondContact O-NH1 2.83Å
590	V	92.2	Very high	85	Confident	6 Å²	6	53.1 Å²	53.1	4%	0.036	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-60.1	-177.5	-174	0	0	0	0	110.2	R367 P377 F378 R379 T587 P588 D592 C593 L594	R367-V590 HydrophobicContact CG-CG1 4.34Å; P377-V590 HydrophobicContact CB-CB 4.4Å; P377-V590 HydrophobicContact CB-CG1 3.79Å; F378-V590 WeakPolarHBondContact O-CG2 3.18Å; R379-V590 HydrophobicContact CB-CG2 4.39Å; R379-V590 HydrophobicContact CG-CG2 3.88Å; T587-V590 HydrophobicContact CG2-CB 4.24Å; T587-V590 HydrophobicContact CG2-CG2 3.76Å; T587-V590 PolarHBondContact O-N 3.08Å; T587-V590 VanDerWaalsContact O-N 3.08Å; P588-V590 VanDerWaalsContact C-N 3.28Å; P588-V590 PolarHBondContact O-N 2.95Å; V590-D592 VanDerWaalsContact C-N 3.32Å; V590-D592 PolarHBondContact N-OD1 3.15Å; V590-D592 VanDerWaalsContact N-OD1 3.1Å; V590-D592 PolarHBondContact O-N 2.93Å; V590-C593 PolarHBondContact O-N 3.32Å; V590-L594 WeakPolarHBondContact O-CG 3.25Å
591	T	86.9	Confident	84.4	Confident	47 Å²	47	51.7 Å²	51.7	29%	0.288	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-22.8	-173.3	54.6	0	0	0	0	113.8	P377 T587	P377-T591 HydrophobicContact CB-CG2 4.13Å; P377-T591 HydrophobicContact CG-CG2 3.95Å; T587-T591 PolarHBondContact N-OG1 3.2Å; T587-T591 PolarHBondContact O-N 3.1Å; T587-T591 PolarHBondContact O-OG1 2.91Å
592	D	86.3	Confident	83.6	Confident	78.5 Å²	78.5	54.8 Å²	54.8	42%	0.42	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-13.5	177.7	55.3	-16.8	0	0	0	113.6	G589 V590 I778	G589-D592 WeakPolarHBondContact CA-OD1 3.36Å; G589-D592 PolarHBondContact N-OD1 3.07Å; G589-D592 PolarHBondContact N-OD2 2.87Å; V590-D592 VanDerWaalsContact C-N 3.32Å; V590-D592 PolarHBondContact N-OD1 3.15Å; V590-D592 VanDerWaalsContact N-OD1 3.1Å; V590-D592 PolarHBondContact O-N 2.93Å; D592-I778 WeakPolarHBondContact OD2-CD1 3.41Å
593	C	89.1	Confident	82.8	Confident	6 Å²	6	55.5 Å²	55.5	4%	0.041	29%	0.293	C	S	.	.	S	Bend	trans	-104.4	11.8	-177.8	-57.9	0	0	0	0	113.4	G589 V590 R623 R771 E775	G589-C593 PolarHBondContact O-SG 3.18Å; V590-C593 PolarHBondContact O-N 3.32Å; C593-R623 HydrophobicContact CB-CG 4.18Å; C593-R623 VanDerWaalsContact SG-CD 3.6Å; C593-R771 PolarHBondContact O-NH2 3.19Å; C593-E775 HydrophobicContact CB-CG 3.95Å; C593-E775 VanDerWaalsContact O-OE1 3.13Å
594	L	85.6	Confident	82.1	Confident	48.5 Å²	48.5	53.6 Å²	53.6	25%	0.254	28%	0.282	S	S	.	.			trans	-78	134.4	177	-58.3	-179.9	0	0	0	110.7	V590 E598 K599	V590-L594 WeakPolarHBondContact O-CG 3.25Å; L594-E598 HydrophobicContact CB-CB 4.3Å; L594-E598 HydrophobicContact CD2-CB 4.44Å; L594-K599 HydrophobicContact CB-CG 3.71Å; L594-K599 HydrophobicContact CD1-CG 4.32Å; L594-K599 WeakPolarHBondContact O-CE 3.42Å
595	S	82.5	Confident	81.7	Confident	25.5 Å²	25.5	54.8 Å²	54.8	18%	0.178	29%	0.287	C	S	.	.			trans	-66.9	160.2	167.3	64.3	0	0	0	0	111.5	A597 E598 K599	S595-A597 PolarHBondContact O-N 3.39Å; S595-E598 VanDerWaalsContact CB-OE2 3.23Å; S595-E598 WeakPolarHBondContact CB-OE2 3.38Å; S595-E598 PolarHBondContact N-OE2 2.84Å; S595-E598 PolarHBondContact O-N 3.19Å; S595-E598 VanDerWaalsContact O-N 3.12Å; S595-E598 WeakPolarHBondContact OG-CB 3.09Å; S595-E598 VanDerWaalsContact OG-CG 3.23Å; S595-E598 WeakPolarHBondContact OG-CG 3.35Å; S595-E598 PolarHBondContact OG-N 3.04Å; S595-E598 VanDerWaalsContact OG-N 3.09Å; S595-E598 PolarHBondContact OG-OE2 3Å; S595-K599 WeakPolarHBondContact O-CG 3.43Å; S595-K599 PolarHBondContact O-N 3.18Å
596	E	78.5	Confident	81.5	Confident	105.5 Å²	105.5	56.9 Å²	56.9	49%	0.493	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-31.6	174.6	-63.4	-53.7	125.5	0	0	112.2	K599 S600	E596-K599 IonicContact OE1-NZ 2.72Å; E596-K599 PolarHBondContact OE1-NZ 2.89Å; E596-S600 VanDerWaalsContact O-CB 3.23Å; E596-S600 WeakPolarHBondContact O-CB 3.25Å; E596-S600 PolarHBondContact O-N 3.09Å; E596-S600 PolarHBondContact O-OG 3.14Å
597	A	77.2	Confident	81.1	Confident	35 Å²	35	54.9 Å²	54.9	29%	0.289	29%	0.294	S	S	.	.	H	α-helix	trans	-68.8	-38.4	174.1	0	0	0	0	0	112.4	S595 S600 G601 V602 A603	S595-A597 PolarHBondContact O-N 3.39Å; A597-S600 WeakPolarHBondContact CA-OG 3.4Å; A597-S600 PolarHBondContact O-OG 3.03Å; A597-S600 VanDerWaalsContact O-OG 3.12Å; A597-G601 PolarHBondContact O-N 3.22Å; A597-V602 PolarHBondContact O-N 3.31Å; A597-A603 HydrophobicContact CB-CB 4.02Å; A597-A603 PolarHBondContact O-N 3.04Å; A597-A603 VanDerWaalsContact O-N 3.16Å
598	E	82.9	Confident	81	Confident	23.5 Å²	23.5	55.9 Å²	55.9	11%	0.11	30%	0.301	C	S	.	.	H	α-helix	trans	-67.9	-46.4	173.6	-73.6	164.5	107	0	0	111	R367 R368 L594 S595 G601 A603 R771	R367-E598 IonicContact CZ-OE1 2.65Å; R367-E598 IonicContact NH1-OE1 3.38Å; R367-E598 PolarHBondContact NH1-OE1 3.3Å; R367-E598 IonicContact NH2-OE1 2.81Å; R367-E598 PolarHBondContact NH2-OE1 3.1Å; R368-E598 PolarHBondContact NH1-O 3.39Å; L594-E598 HydrophobicContact CB-CB 4.3Å; L594-E598 HydrophobicContact CD2-CB 4.44Å; S595-E598 VanDerWaalsContact CB-OE2 3.23Å; S595-E598 WeakPolarHBondContact CB-OE2 3.38Å; S595-E598 PolarHBondContact N-OE2 2.84Å; S595-E598 PolarHBondContact O-N 3.19Å; S595-E598 VanDerWaalsContact O-N 3.12Å; S595-E598 WeakPolarHBondContact OG-CB 3.09Å; S595-E598 VanDerWaalsContact OG-CG 3.23Å; S595-E598 WeakPolarHBondContact OG-CG 3.35Å; S595-E598 PolarHBondContact OG-N 3.04Å; S595-E598 VanDerWaalsContact OG-N 3.09Å; S595-E598 PolarHBondContact OG-OE2 3Å; E598-G601 PolarHBondContact O-N 3.17Å; E598-G601 VanDerWaalsContact O-N 3.08Å; E598-A603 HydrophobicContact CG-CB 4.15Å; E598-R771 IonicContact OE2-NH2 3.14Å; E598-R771 PolarHBondContact OE2-NH2 2.99Å
599	K	77.7	Confident	81.1	Confident	109 Å²	109	52.7 Å²	52.7	47%	0.474	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-43.6	178.4	-71.4	176.8	-170	162.2	0	112.4	L594 S595 E596 G601	L594-K599 HydrophobicContact CB-CG 3.71Å; L594-K599 HydrophobicContact CD1-CG 4.32Å; L594-K599 WeakPolarHBondContact O-CE 3.42Å; S595-K599 WeakPolarHBondContact O-CG 3.43Å; S595-K599 PolarHBondContact O-N 3.18Å; E596-K599 IonicContact OE1-NZ 2.72Å; E596-K599 PolarHBondContact OE1-NZ 2.89Å; K599-G601 PolarHBondContact O-N 3.38Å
600	S	74	Confident	80.9	Confident	55 Å²	55	53.1 Å²	53.1	39%	0.385	29%	0.285	S	S	.	.	H	α-helix	trans	-70.9	-13.3	176.8	56.3	0	0	0	0	112.7	G533 E596 A597	G533-S600 CarbonylContact C-O 3.3Å; G533-S600 WeakPolarHBondContact CA-O 3.46Å; G533-S600 VanDerWaalsContact O-O 3.08Å; E596-S600 VanDerWaalsContact O-CB 3.23Å; E596-S600 WeakPolarHBondContact O-CB 3.25Å; E596-S600 PolarHBondContact O-N 3.09Å; E596-S600 PolarHBondContact O-OG 3.14Å; A597-S600 WeakPolarHBondContact CA-OG 3.4Å; A597-S600 PolarHBondContact O-OG 3.03Å; A597-S600 VanDerWaalsContact O-OG 3.12Å
601	G	72.7	Confident	80.6	Confident	16 Å²	16	58.3 Å²	58.3	17%	0.165	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	14.6	177.9	0	0	0	0	0	114.6	R368 G533 A597 E598 K599 H604	R368-G601 VanDerWaalsContact NH2-CA 3.25Å; R368-G601 PolarHBondContact NH2-O 3.31Å; G533-G601 PolarHBondContact N-O 3.14Å; A597-G601 PolarHBondContact O-N 3.22Å; E598-G601 PolarHBondContact O-N 3.17Å; E598-G601 VanDerWaalsContact O-N 3.08Å; K599-G601 PolarHBondContact O-N 3.38Å; G601-H604 PolarHBondContact O-CE1 3.24Å; G601-H604 PolarHBondContact O-NE2 2.93Å; G601-H604 VanDerWaalsContact O-NE2 3.08Å
602	V	71.3	Confident	80.6	Confident	68.3333 Å²	68.3333	56.4 Å²	56.4	41%	0.414	30%	0.295	S	S	.	.			trans	-91.9	-26.4	-178	-174.8	0	0	0	0	112.1	A597 H604	A597-V602 PolarHBondContact O-N 3.31Å; V602-H604 PolarHBondContact O-CD2 3.2Å; V602-H604 VanDerWaalsContact O-CD2 3.29Å; V602-H604 PolarHBondContact O-N 3.45Å
603	A	72.6	Confident	80.6	Confident	32.6667 Å²	32.6667	55.4 Å²	55.4	27%	0.27	29%	0.285	S	S	.	.			trans	-80.1	92.5	177.4	0	0	0	0	0	111.3	R368 A597 E598 Y605	R368-A603 PolarHBondContact NE-O 2.89Å; A597-A603 HydrophobicContact CB-CB 4.02Å; A597-A603 PolarHBondContact O-N 3.04Å; A597-A603 VanDerWaalsContact O-N 3.16Å; E598-A603 HydrophobicContact CG-CB 4.15Å; A603-Y605 VanDerWaalsContact C-N 3.31Å
604	H	71.3	Confident	80.2	Confident	55 Å²	55	55.3 Å²	55.3	26%	0.255	29%	0.285	S	S	.	.			trans	-85.7	-23.6	177.1	-61.3	-61.7	0	0	0	113.8	I529 G601 V602	I529-H604 VanDerWaalsContact CA-CE1 3.49Å; I529-H604 WeakPolarHBondContact CA-CE1 3.46Å; I529-H604 PolarHBondContact O-NE2 2.77Å; G601-H604 PolarHBondContact O-CE1 3.24Å; G601-H604 PolarHBondContact O-NE2 2.93Å; G601-H604 VanDerWaalsContact O-NE2 3.08Å; V602-H604 PolarHBondContact O-CD2 3.2Å; V602-H604 VanDerWaalsContact O-CD2 3.29Å; V602-H604 PolarHBondContact O-N 3.45Å
605	Y	76.9	Confident	80	Confident	168 Å²	168	53.5 Å²	53.5	66%	0.659	28%	0.278	S	S	*	.	S	Bend	trans	-133.5	146.4	177.5	27.8	-83	0	0	0	109	A603 E607	A603-Y605 VanDerWaalsContact C-N 3.31Å; Y605-E607 HydrophobicContact CD2-CG 3.87Å; Y605-E607 HydrophobicContact CE2-CG 3.35Å; Y605-E607 WeakPolarHBondContact CE2-OE1 3.19Å; Y605-E607 PolarHBondContact O-N 3.16Å; Y605-E607 PolarHBondContact OH-OE1 2.92Å; Y605-E607 VanDerWaalsContact OH-OE1 3.1Å
606	Q	79.3	Confident	80.2	Confident	74.3333 Å²	74.3333	53.1 Å²	53.1	35%	0.347	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-80.7	124.7	170.7	-175.8	59.4	43.3	0	0	108.5	W619 I621	Q606-W619 HydrophobicContact CG-CE3 4.43Å; Q606-W619 WeakPolarHBondContact O-CZ3 3.25Å; Q606-I621 HydrophobicContact CG-CD1 4.37Å; Q606-I621 HydrophobicContact CG-CG1 3.99Å
607	E	80.1	Confident	80.7	Confident	103.333 Å²	103.333	49.5 Å²	49.5	48%	0.483	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-83.6	141.3	171.9	-73.5	-178.7	178.2	0	0	110.4	Y605	Y605-E607 HydrophobicContact CD2-CG 3.87Å; Y605-E607 HydrophobicContact CE2-CG 3.35Å; Y605-E607 WeakPolarHBondContact CE2-OE1 3.19Å; Y605-E607 PolarHBondContact O-N 3.16Å; Y605-E607 PolarHBondContact OH-OE1 2.92Å; Y605-E607 VanDerWaalsContact OH-OE1 3.1Å
608	P	87.4	Confident	81.5	Confident	42.3333 Å²	42.3333	48.1 Å²	48.1	28%	0.275	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-63.8	144	169.5	28	-32.1	0	0	0	109.3	G610 L617 Y618 W619 R764	P608-G610 VanDerWaalsContact C-N 3.29Å; P608-G610 PolarHBondContact O-N 2.92Å; P608-L617 HydrophobicContact CB-CD2 3.86Å; P608-L617 HydrophobicContact CG-CD2 4.13Å; P608-Y618 CarbonylContact C-O 3.53Å; P608-Y618 WeakPolarHBondContact CA-O 3.4Å; P608-W619 HydrophobicContact CB-CD2 4.1Å; P608-W619 HydrophobicContact CB-CE3 3.9Å; P608-W619 HydrophobicContact CB-CH2 3.98Å; P608-W619 HydrophobicContact CB-CZ2 4.18Å; P608-W619 HydrophobicContact CB-CZ3 3.84Å; P608-W619 VanDerWaalsContact CD-CZ3 3.48Å; P608-W619 HydrophobicContact CG-CH2 4.09Å; P608-W619 HydrophobicContact CG-CZ3 4.12Å; P608-R764 PolarHBondContact O-NH1 3.09Å; P608-R764 PolarHBondContact O-NH2 3.14Å
609	I	88.5	Confident	81.9	Confident	3.66667 Å²	3.66667	49.3 Å²	49.3	2%	0.019	25%	0.248	C	C	.	.			trans	-63.8	-40.2	176	-51.1	174.2	0	0	0	109.7	Y618 L625 W760 L761 R764 L765 L768 M772	I609-Y618 PolarHBondContact N-O 3.21Å; I609-L625 HydrophobicContact CD1-CD1 3.67Å; I609-W760 WeakPolarHBondContact O-CZ3 3.36Å; I609-L761 HydrophobicContact CB-CD1 4.21Å; I609-L761 HydrophobicContact CG2-CD1 3.91Å; I609-R764 VanDerWaalsContact C-NH1 3.26Å; I609-R764 HydrophobicContact CG2-CB 3.7Å; I609-R764 VanDerWaalsContact O-CD 3.28Å; I609-R764 WeakPolarHBondContact O-CD 3.31Å; I609-R764 VanDerWaalsContact O-CZ 3.28Å; I609-R764 PolarHBondContact O-NE 2.97Å; I609-R764 PolarHBondContact O-NH1 2.98Å; I609-L765 HydrophobicContact CD1-CD1 4.45Å; I609-L768 HydrophobicContact CD1-CD1 4.13Å; I609-L768 HydrophobicContact CG1-CD1 4.08Å; I609-L768 HydrophobicContact CG2-CD1 4.28Å; I609-M772 HydrophobicContact CD1-CE 3.97Å
610	G	86	Confident	82.6	Confident	11.6667 Å²	11.6667	44.5 Å²	44.5	12%	0.12	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.4	-176.2	178.9	0	0	0	0	0	111.7	P608 Y618	P608-G610 VanDerWaalsContact C-N 3.29Å; P608-G610 PolarHBondContact O-N 2.92Å; G610-Y618 PolarHBondContact O-N 2.9Å
611	K	86.7	Confident	83.3	Confident	115 Å²	115	43.6 Å²	43.6	50%	0.5	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	144.2	173.7	-67.7	-178.2	178.6	-174.7	0	110.1	R616 L617	K611-R616 VanDerWaalsContact CA-O 3.23Å; K611-R616 WeakPolarHBondContact CA-O 3.36Å; K611-L617 HydrophobicContact CD-CD2 4.1Å; K611-L617 VanDerWaalsContact CE-CD2 3.45Å; K611-L617 HydrophobicContact CG-CD2 3.53Å; K611-L617 VanDerWaalsContact CG-CD2 3.48Å; K611-L617 HydrophobicContact CG-CG 4.1Å
612	D	86.9	Confident	83.9	Confident	7.66667 Å²	7.66667	44.8 Å²	44.8	4%	0.041	22%	0.223	C	C	.	.			trans	-87.3	176.5	170.6	69.9	14.3	0	0	0	112.4	L340 A614 G615 R616 Y618 L753 E758 L761	L340-D612 HydrophobicContact CD2-CB 3.88Å; L340-D612 WeakPolarHBondContact CD2-OD2 3.33Å; D612-A614 PolarHBondContact O-N 3.02Å; D612-A614 VanDerWaalsContact OD1-C 3.28Å; D612-A614 VanDerWaalsContact OD1-CA 3.31Å; D612-A614 WeakPolarHBondContact OD1-CA 3.16Å; D612-A614 WeakPolarHBondContact OD1-CB 3.34Å; D612-A614 PolarHBondContact OD1-N 2.92Å; D612-G615 WeakPolarHBondContact O-CA 3.19Å; D612-G615 PolarHBondContact O-N 3.21Å; D612-G615 PolarHBondContact OD1-N 3.2Å; D612-R616 PolarHBondContact N-O 2.89Å; D612-R616 WeakPolarHBondContact OD1-CB 3.37Å; D612-R616 WeakPolarHBondContact OD1-CG 3.34Å; D612-R616 PolarHBondContact OD1-N 3.29Å; D612-R616 WeakPolarHBondContact OD2-CB 3.27Å; D612-R616 VanDerWaalsContact OD2-CD 3.27Å; D612-R616 WeakPolarHBondContact OD2-CD 3.35Å; D612-R616 WeakPolarHBondContact OD2-CG 3.33Å; D612-R616 IonicContact OD2-CZ 3.09Å; D612-R616 IonicContact OD2-NE 2.77Å; D612-R616 IonicContact OD2-NH1 3.76Å; D612-R616 PolarHBondContact OD2-NH1 3.24Å; D612-Y618 HydrophobicContact CB-CD2 4.5Å; D612-Y618 HydrophobicContact CB-CE2 3.63Å; D612-Y618 WeakPolarHBondContact OD2-CE2 3.4Å; D612-Y618 PolarHBondContact OD2-OH 3.31Å; D612-L753 HydrophobicContact CB-CD2 4.22Å; D612-E758 HydrophobicContact CB-CG 4.17Å; D612-E758 WeakPolarHBondContact CB-OE1 3.18Å; D612-L761 HydrophobicContact CB-CD2 4.01Å
613	R	84.5	Confident	84.8	Confident	56.6667 Å²	56.6667	42 Å²	42	21%	0.214	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.6	177.2	74.1	-172.6	72.6	-170.5	2.4	114.1	R334 S337 P338 L340 G615 S754 W757 E758	R334-R613 WeakPolarHBondContact CG-O 3.46Å; S337-R613 WeakPolarHBondContact OG-CB 3.33Å; P338-R613 WeakPolarHBondContact O-CD 3.42Å; L340-R613 HydrophobicContact CB-CG 3.95Å; L340-R613 HydrophobicContact CD2-CG 4.32Å; R613-G615 VanDerWaalsContact C-N 3.27Å; R613-S754 VanDerWaalsContact NH2-N 3.13Å; R613-S754 PolarHBondContact NH2-OG 3.42Å; R613-W757 HydrophobicContact CB-CB 4.19Å; R613-W757 VanDerWaalsContact CZ-CB 3.48Å; R613-W757 VanDerWaalsContact CZ-CG 3.48Å; R613-W757 VanDerWaalsContact NH2-CD1 3.31Å; R613-E758 HydrophobicContact CB-CG 4.48Å; R613-E758 WeakPolarHBondContact CB-OE1 3.32Å; R613-E758 WeakPolarHBondContact CD-OE1 3.23Å; R613-E758 WeakPolarHBondContact CG-OE1 3.37Å; R613-E758 IonicContact CZ-OE1 3.22Å; R613-E758 IonicContact CZ-OE2 3.29Å; R613-E758 PolarHBondContact N-OE1 3.24Å; R613-E758 IonicContact NE-OE1 3.43Å; R613-E758 PolarHBondContact NE-OE1 2.95Å; R613-E758 IonicContact NE-OE2 3.38Å; R613-E758 PolarHBondContact NE-OE2 3.24Å; R613-E758 IonicContact NH2-OE1 3.42Å; R613-E758 IonicContact NH2-OE2 3.31Å; R613-E758 PolarHBondContact NH2-OE2 3.11Å
614	A	81.6	Confident	85.6	Confident	5.66667 Å²	5.66667	40.8 Å²	40.8	5%	0.047	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-3.9	173.1	0	0	0	0	0	111.9	R334 D612 R616 Y731	R334-A614 PolarHBondContact NE-O 3.47Å; R334-A614 PolarHBondContact NH2-O 3.29Å; R334-A614 VanDerWaalsContact NH2-O 3.11Å; D612-A614 PolarHBondContact O-N 3.02Å; D612-A614 VanDerWaalsContact OD1-C 3.28Å; D612-A614 VanDerWaalsContact OD1-CA 3.31Å; D612-A614 WeakPolarHBondContact OD1-CA 3.16Å; D612-A614 WeakPolarHBondContact OD1-CB 3.34Å; D612-A614 PolarHBondContact OD1-N 2.92Å; A614-R616 HydrophobicContact CB-CG 4.08Å; A614-Y731 HydrophobicContact CB-CD2 4.38Å; A614-Y731 HydrophobicContact CB-CE1 4.03Å; A614-Y731 HydrophobicContact CB-CE2 3.82Å; A614-Y731 VanDerWaalsContact CB-CZ 3.48Å; A614-Y731 WeakPolarHBondContact CB-OH 3.19Å
615	G	81.2	Confident	86.7	Confident	10 Å²	10	38.1 Å²	38.1	10%	0.103	18%	0.181	C	C	.	.			trans	87.9	-1.2	-179.9	0	0	0	0	0	114.6	D612 R613 V630	D612-G615 WeakPolarHBondContact O-CA 3.19Å; D612-G615 PolarHBondContact O-N 3.21Å; D612-G615 PolarHBondContact OD1-N 3.2Å; R613-G615 VanDerWaalsContact C-N 3.27Å; G615-V630 VanDerWaalsContact C-CG2 3.45Å; G615-V630 WeakPolarHBondContact O-CB 3.45Å; G615-V630 WeakPolarHBondContact O-CG2 3.38Å
616	R	87.6	Confident	87.4	Confident	17.6667 Å²	17.6667	30.9 Å²	30.9	7%	0.067	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-68.5	138.9	-175.3	-44.6	-178.8	-168	127	-2.5	110.7	L340 L342 K611 D612 A614 Y618 I627 E628 P629 E734	L340-R616 PolarHBondContact O-NH1 3.39Å; L340-R616 PolarHBondContact O-NH2 3.12Å; L342-R616 VanDerWaalsContact CG-NH1 3.32Å; K611-R616 VanDerWaalsContact CA-O 3.23Å; K611-R616 WeakPolarHBondContact CA-O 3.36Å; D612-R616 PolarHBondContact N-O 2.89Å; D612-R616 WeakPolarHBondContact OD1-CB 3.37Å; D612-R616 WeakPolarHBondContact OD1-CG 3.34Å; D612-R616 PolarHBondContact OD1-N 3.29Å; D612-R616 WeakPolarHBondContact OD2-CB 3.27Å; D612-R616 VanDerWaalsContact OD2-CD 3.27Å; D612-R616 WeakPolarHBondContact OD2-CD 3.35Å; D612-R616 WeakPolarHBondContact OD2-CG 3.33Å; D612-R616 IonicContact OD2-CZ 3.09Å; D612-R616 IonicContact OD2-NE 2.77Å; D612-R616 IonicContact OD2-NH1 3.76Å; D612-R616 PolarHBondContact OD2-NH1 3.24Å; A614-R616 HydrophobicContact CB-CG 4.08Å; R616-Y618 HydrophobicContact CB-CE2 4.34Å; R616-Y618 WeakPolarHBondContact O-CD2 3.39Å; R616-I627 HydrophobicContact CB-CG2 3.64Å; R616-I627 HydrophobicContact CG-CG2 4.45Å; R616-E628 CarbonylContact C-O 3.5Å; R616-E628 WeakPolarHBondContact CA-O 3.36Å; R616-P629 HydrophobicContact CG-CB 4.48Å; R616-E734 IonicContact CZ-OE1 3.61Å; R616-E734 VanDerWaalsContact CZ-OE1 3.28Å; R616-E734 IonicContact CZ-OE2 3.07Å; R616-E734 IonicContact NE-OE1 3.42Å; R616-E734 PolarHBondContact NE-OE1 2.91Å; R616-E734 IonicContact NE-OE2 3.01Å; R616-E734 PolarHBondContact NE-OE2 3.36Å; R616-E734 VanDerWaalsContact NE-OE2 3.08Å; R616-E734 IonicContact NH1-OE1 2.68Å; R616-E734 IonicContact NH1-OE2 2.67Å; R616-E734 IonicContact NH2-OE1 3.51Å; R616-E734 PolarHBondContact NH2-OE1 3.05Å; R616-E734 IonicContact NH2-OE2 3.1Å; R616-E734 PolarHBondContact NH2-OE2 2.98Å; R616-E734 VanDerWaalsContact NH2-OE2 3.08Å
617	L	89	Confident	88	Confident	30 Å²	30	27.4 Å²	27.4	16%	0.157	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.3	179.4	-80.3	164.1	0	0	0	111.1	P608 K611 W619 I627 E628 V630	P608-L617 HydrophobicContact CB-CD2 3.86Å; P608-L617 HydrophobicContact CG-CD2 4.13Å; K611-L617 HydrophobicContact CD-CD2 4.1Å; K611-L617 VanDerWaalsContact CE-CD2 3.45Å; K611-L617 HydrophobicContact CG-CD2 3.53Å; K611-L617 VanDerWaalsContact CG-CD2 3.48Å; K611-L617 HydrophobicContact CG-CG 4.1Å; L617-W619 HydrophobicContact CB-CZ2 4.37Å; L617-W619 HydrophobicContact CD1-CZ2 4.2Å; L617-I627 CarbonylContact O-C 3.52Å; L617-I627 VanDerWaalsContact O-CA 3.31Å; L617-I627 WeakPolarHBondContact O-CA 3.26Å; L617-E628 HydrophobicContact CB-CB 4.34Å; L617-E628 PolarHBondContact N-O 3.27Å; L617-E628 PolarHBondContact O-N 3.23Å; L617-V630 HydrophobicContact CB-CG2 4.13Å; L617-V630 HydrophobicContact CD1-CG2 3.62Å; L617-V630 VanDerWaalsContact CD1-CG2 3.48Å; L617-V630 HydrophobicContact CG-CG2 3.71Å
618	Y	93	Very high	88.4	Confident	3.66667 Å²	3.66667	25.3 Å²	25.3	1%	0.014	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	128.6	179.1	-74.1	-120.9	0	0	0	109.4	P608 I609 G610 D612 R616 L625 I626 I627 I749 L753 L761	P608-Y618 CarbonylContact C-O 3.53Å; P608-Y618 WeakPolarHBondContact CA-O 3.4Å; I609-Y618 PolarHBondContact N-O 3.21Å; G610-Y618 PolarHBondContact O-N 2.9Å; D612-Y618 HydrophobicContact CB-CD2 4.5Å; D612-Y618 HydrophobicContact CB-CE2 3.63Å; D612-Y618 WeakPolarHBondContact OD2-CE2 3.4Å; D612-Y618 PolarHBondContact OD2-OH 3.31Å; R616-Y618 HydrophobicContact CB-CE2 4.34Å; R616-Y618 WeakPolarHBondContact O-CD2 3.39Å; Y618-L625 HydrophobicContact CD1-CD1 4.28Å; Y618-L625 HydrophobicContact CD1-CD2 4.39Å; Y618-I626 CarbonylContact C-O 3.58Å; Y618-I627 HydrophobicContact CD1-CD1 3.89Å; Y618-I627 HydrophobicContact CD1-CG1 3.77Å; Y618-I627 HydrophobicContact CD2-CG1 4.44Å; Y618-I627 HydrophobicContact CD2-CG2 4Å; Y618-I627 HydrophobicContact CE1-CD1 3.31Å; Y618-I627 HydrophobicContact CE1-CG1 3.72Å; Y618-I627 HydrophobicContact CE1-CG2 4.48Å; Y618-I627 HydrophobicContact CE2-CD1 4.34Å; Y618-I627 HydrophobicContact CE2-CG1 4.35Å; Y618-I627 HydrophobicContact CE2-CG2 3.68Å; Y618-I627 HydrophobicContact CG-CG1 4.16Å; Y618-I627 HydrophobicContact CG-CG2 4.46Å; Y618-I749 HydrophobicContact CE1-CG2 3.89Å; Y618-L753 HydrophobicContact CE1-CD1 4.37Å; Y618-L761 HydrophobicContact CD1-CD1 4.14Å; Y618-L761 HydrophobicContact CD1-CD2 4.31Å; Y618-L761 HydrophobicContact CD2-CD1 4.19Å; Y618-L761 HydrophobicContact CD2-CD2 3.84Å; Y618-L761 HydrophobicContact CE1-CD2 4.26Å; Y618-L761 HydrophobicContact CE2-CD2 3.85Å; Y618-L761 HydrophobicContact CG-CD1 3.79Å; Y618-L761 HydrophobicContact CG-CD2 4.12Å
619	W	92.1	Very high	88.2	Confident	50 Å²	50	24.7 Å²	24.7	19%	0.189	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	141.6	179.7	-51.5	92.3	0	0	0	109.8	Q606 P608 L617 I621 L625 I626 E628	Q606-W619 HydrophobicContact CG-CE3 4.43Å; Q606-W619 WeakPolarHBondContact O-CZ3 3.25Å; P608-W619 HydrophobicContact CB-CD2 4.1Å; P608-W619 HydrophobicContact CB-CE3 3.9Å; P608-W619 HydrophobicContact CB-CH2 3.98Å; P608-W619 HydrophobicContact CB-CZ2 4.18Å; P608-W619 HydrophobicContact CB-CZ3 3.84Å; P608-W619 VanDerWaalsContact CD-CZ3 3.48Å; P608-W619 HydrophobicContact CG-CH2 4.09Å; P608-W619 HydrophobicContact CG-CZ3 4.12Å; L617-W619 HydrophobicContact CB-CZ2 4.37Å; L617-W619 HydrophobicContact CD1-CZ2 4.2Å; W619-I621 HydrophobicContact CB-CD1 3.87Å; W619-I621 HydrophobicContact CB-CG1 4.08Å; W619-I621 HydrophobicContact CG-CD1 4.41Å; W619-L625 CarbonylContact O-C 3.49Å; W619-L625 WeakPolarHBondContact O-CA 3.42Å; W619-I626 WeakPolarHBondContact CA-O 3.41Å; W619-I626 HydrophobicContact CB-CB 4.2Å; W619-I626 WeakPolarHBondContact CB-O 3.49Å; W619-I626 PolarHBondContact N-O 3.2Å; W619-I626 PolarHBondContact O-N 3.16Å; W619-E628 PolarHBondContact NE1-OE2 3.01Å
620	Y	91.8	Very high	87.5	Confident	8.66667 Å²	8.66667	26.6 Å²	26.6	3%	0.034	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	103.7	168	-174.2	-112.9	0	0	0	108.9	R623 R624 M772 E775 M776	Y620-R623 WeakPolarHBondContact OH-CA 3.4Å; Y620-R624 WeakPolarHBondContact CA-O 3.39Å; Y620-R624 VanDerWaalsContact CD2-O 3.24Å; Y620-R624 WeakPolarHBondContact CD2-O 3.3Å; Y620-M772 HydrophobicContact CD1-CE 4.36Å; Y620-M772 HydrophobicContact CD1-CG 4.5Å; Y620-M772 HydrophobicContact CD2-CE 3.49Å; Y620-M772 VanDerWaalsContact CD2-CE 3.42Å; Y620-M772 HydrophobicContact CD2-CG 3.97Å; Y620-M772 HydrophobicContact CD2-SD 4.13Å; Y620-M772 HydrophobicContact CE1-CG 4.27Å; Y620-M772 HydrophobicContact CE2-CB 4.28Å; Y620-M772 HydrophobicContact CE2-CE 4.11Å; Y620-M772 HydrophobicContact CE2-CG 3.56Å; Y620-M772 HydrophobicContact CE2-SD 4.2Å; Y620-M772 HydrophobicContact CG-CE 3.68Å; Y620-M772 HydrophobicContact CG-CG 4.43Å; Y620-M772 WeakPolarHBondContact OH-CA 3.37Å; Y620-E775 VanDerWaalsContact CE1-OE2 3.26Å; Y620-E775 WeakPolarHBondContact CE1-OE2 3.39Å; Y620-E775 VanDerWaalsContact CZ-OE2 3.23Å; Y620-E775 VanDerWaalsContact OH-CB 3.26Å; Y620-E775 WeakPolarHBondContact OH-CB 3.18Å; Y620-E775 PolarHBondContact OH-OE2 2.97Å; Y620-M776 HydrophobicContact CE2-CE 4.21Å
621	I	88	Confident	86.4	Confident	35.6667 Å²	35.6667	30.1 Å²	30.1	18%	0.183	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	133.9	-172.4	-57.2	173.5	0	0	0	108.3	L360 E364 Q606 W619 R623 R624 I626	L360-I621 HydrophobicContact CD2-CG2 3.95Å; E364-I621 HydrophobicContact CG-CG2 3.77Å; E364-I621 WeakPolarHBondContact OE1-CG2 3.42Å; Q606-I621 HydrophobicContact CG-CD1 4.37Å; Q606-I621 HydrophobicContact CG-CG1 3.99Å; W619-I621 HydrophobicContact CB-CD1 3.87Å; W619-I621 HydrophobicContact CB-CG1 4.08Å; W619-I621 HydrophobicContact CG-CD1 4.41Å; I621-R623 VanDerWaalsContact C-N 3.32Å; I621-R623 PolarHBondContact O-N 3.05Å; I621-R624 PolarHBondContact N-O 3.27Å; I621-R624 PolarHBondContact O-N 3.15Å; I621-I626 HydrophobicContact CB-CD1 4.38Å
622	S	85.5	Confident	84.9	Confident	41.6667 Å²	41.6667	27.4 Å²	27.4	29%	0.291	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	47.6	172.6	-66.3	0	0	0	0	114.3	Y363 E364 R624	Y363-S622 WeakPolarHBondContact CE1-OG 3.49Å; E364-S622 PolarHBondContact OE1-OG 2.9Å; S622-R624 VanDerWaalsContact C-N 3.26Å; S622-R624 PolarHBondContact O-N 3.25Å
623	R	90.2	Very high	83.3	Confident	9 Å²	9	28.9 Å²	28.9	3%	0.034	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	19.9	180	-41.9	177.3	-64.2	-121.1	-2.1	114.6	E381 G589 C593 Y620 I621 E775 M776 T779 D960	E381-R623 IonicContact OE1-CZ 3.67Å; E381-R623 IonicContact OE1-NH2 3.19Å; E381-R623 PolarHBondContact OE1-NH2 2.9Å; E381-R623 IonicContact OE2-CZ 3.33Å; E381-R623 IonicContact OE2-NH2 2.82Å; E381-R623 PolarHBondContact OE2-NH2 3.3Å; G589-R623 PolarHBondContact O-NH1 2.83Å; C593-R623 HydrophobicContact CB-CG 4.18Å; C593-R623 VanDerWaalsContact SG-CD 3.6Å; Y620-R623 WeakPolarHBondContact OH-CA 3.4Å; I621-R623 VanDerWaalsContact C-N 3.32Å; I621-R623 PolarHBondContact O-N 3.05Å; R623-E775 HydrophobicContact CB-CB 4.24Å; R623-E775 HydrophobicContact CG-CB 4.08Å; R623-M776 WeakPolarHBondContact O-CG 3.19Å; R623-T779 WeakPolarHBondContact CB-OG1 3.19Å; R623-T779 WeakPolarHBondContact CD-OG1 3.33Å; R623-T779 PolarHBondContact NE-OG1 3.34Å; R623-D960 IonicContact CZ-OD2 3.08Å; R623-D960 IonicContact NH2-OD2 3Å; R623-D960 PolarHBondContact NH2-OD2 2.81Å
624	R	90.9	Very high	81.6	Confident	6.33333 Å²	6.33333	31 Å²	31	2%	0.024	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.4	-178.4	-62.4	-150.7	-176.4	-49.4	-8.2	111	D348 E381 Y620 I621 S622 I626 Y739 Y740 S741 T779 D960	D348-R624 VanDerWaalsContact CG-NH1 3.28Å; D348-R624 IonicContact OD1-CZ 2.72Å; D348-R624 IonicContact OD1-NH1 2.98Å; D348-R624 PolarHBondContact OD1-NH1 3.5Å; D348-R624 IonicContact OD2-CZ 3.78Å; D348-R624 IonicContact OD2-NH1 3.72Å; D348-R624 PolarHBondContact OD2-NH1 2.85Å; D348-R624 IonicContact OD2-NH2 3.38Å; D348-R624 PolarHBondContact OD2-NH2 3.36Å; E381-R624 IonicContact OE1-CZ 3.89Å; E381-R624 IonicContact OE1-NE 3.34Å; E381-R624 IonicContact OE1-NH2 2.94Å; E381-R624 PolarHBondContact OE1-NH2 3.41Å; Y620-R624 WeakPolarHBondContact CA-O 3.39Å; Y620-R624 VanDerWaalsContact CD2-O 3.24Å; Y620-R624 WeakPolarHBondContact CD2-O 3.3Å; I621-R624 PolarHBondContact N-O 3.27Å; I621-R624 PolarHBondContact O-N 3.15Å; S622-R624 VanDerWaalsContact C-N 3.26Å; S622-R624 PolarHBondContact O-N 3.25Å; R624-I626 HydrophobicContact CB-CD1 3.8Å; R624-Y739 HydrophobicContact CB-CE2 3.92Å; R624-Y739 VanDerWaalsContact CD-OH 3.25Å; R624-Y739 WeakPolarHBondContact CD-OH 3.49Å; R624-Y739 HydrophobicContact CG-CE2 3.78Å; R624-Y739 PolarHBondContact NE-OH 3.23Å; R624-Y740 WeakPolarHBondContact CA-O 3.27Å; R624-S741 WeakPolarHBondContact CD-OG 3.44Å; R624-S741 VanDerWaalsContact CZ-OG 3.27Å; R624-S741 PolarHBondContact NE-OG 3.5Å; R624-S741 PolarHBondContact NH1-OG 3.43Å; R624-T779 VanDerWaalsContact CZ-CG2 3.44Å; R624-T779 VanDerWaalsContact NH1-CG2 3.29Å; R624-T779 PolarHBondContact NH1-OG1 2.98Å; R624-D960 IonicContact CZ-OD2 3.61Å; R624-D960 IonicContact NH2-OD2 3.08Å; R624-D960 PolarHBondContact NH2-OD2 3.22Å
625	L	93	Very high	79.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	116.2	167.8	-177.7	72.8	0	0	0	107.7	I609 Y618 W619 I627 Y739 Y740 V746 I749 L765 M772	I609-L625 HydrophobicContact CD1-CD1 3.67Å; Y618-L625 HydrophobicContact CD1-CD1 4.28Å; Y618-L625 HydrophobicContact CD1-CD2 4.39Å; W619-L625 CarbonylContact O-C 3.49Å; W619-L625 WeakPolarHBondContact O-CA 3.42Å; L625-I627 HydrophobicContact CG-CG1 4.45Å; L625-Y739 CarbonylContact O-C 3.54Å; L625-Y739 VanDerWaalsContact O-CA 3.26Å; L625-Y739 WeakPolarHBondContact O-CA 3.38Å; L625-Y740 HydrophobicContact CD2-CD2 4.31Å; L625-Y740 HydrophobicContact CG-CD2 4.5Å; L625-Y740 PolarHBondContact N-O 2.91Å; L625-Y740 VanDerWaalsContact N-O 3.08Å; L625-Y740 PolarHBondContact O-N 2.91Å; L625-V746 HydrophobicContact CB-CG2 4.12Å; L625-V746 HydrophobicContact CD2-CG1 4.4Å; L625-V746 HydrophobicContact CD2-CG2 4.19Å; L625-I749 HydrophobicContact CD2-CD1 3.8Å; L625-I749 HydrophobicContact CD2-CG2 4.29Å; L625-L765 HydrophobicContact CD1-CD1 4.21Å; L625-M772 HydrophobicContact CD1-CE 4.24Å
626	I	92.5	Very high	77.7	Confident	15.3333 Å²	15.3333	41.8 Å²	41.8	8%	0.079	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.1	178.2	-49.8	-90.9	0	0	0	107.5	L357 L360 Y618 W619 I621 R624 V737 Y738 Y739	L357-I626 HydrophobicContact CD2-CG2 3.77Å; L360-I626 HydrophobicContact CD1-CD1 3.9Å; L360-I626 HydrophobicContact CD1-CG1 3.79Å; L360-I626 HydrophobicContact CD1-CG2 4.36Å; Y618-I626 CarbonylContact C-O 3.58Å; W619-I626 WeakPolarHBondContact CA-O 3.41Å; W619-I626 HydrophobicContact CB-CB 4.2Å; W619-I626 WeakPolarHBondContact CB-O 3.49Å; W619-I626 PolarHBondContact N-O 3.2Å; W619-I626 PolarHBondContact O-N 3.16Å; I621-I626 HydrophobicContact CB-CD1 4.38Å; R624-I626 HydrophobicContact CB-CD1 3.8Å; I626-V737 HydrophobicContact CG2-CG1 3.36Å; I626-V737 HydrophobicContact CG2-CG2 3.53Å; I626-V737 VanDerWaalsContact CG2-CG2 3.5Å; I626-Y738 CarbonylContact C-O 3.49Å; I626-Y738 WeakPolarHBondContact CA-O 3.41Å; I626-Y739 VanDerWaalsContact CD1-CB 3.45Å; I626-Y739 HydrophobicContact CG1-CD2 4.4Å
627	I	91.8	Very high	75.4	Confident	1.33333 Å²	1.33333	46.6 Å²	46.6	1%	0.007	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	117.5	176.3	-50	173.7	0	0	0	107.6	L342 R616 L617 Y618 L625 P629 V737 Y738 Y740 I749	L342-I627 HydrophobicContact CD1-CD1 3.73Å; L342-I627 HydrophobicContact CD1-CG2 4.13Å; R616-I627 HydrophobicContact CB-CG2 3.64Å; R616-I627 HydrophobicContact CG-CG2 4.45Å; L617-I627 CarbonylContact O-C 3.52Å; L617-I627 VanDerWaalsContact O-CA 3.31Å; L617-I627 WeakPolarHBondContact O-CA 3.26Å; Y618-I627 HydrophobicContact CD1-CD1 3.89Å; Y618-I627 HydrophobicContact CD1-CG1 3.77Å; Y618-I627 HydrophobicContact CD2-CG1 4.44Å; Y618-I627 HydrophobicContact CD2-CG2 4Å; Y618-I627 HydrophobicContact CE1-CD1 3.31Å; Y618-I627 HydrophobicContact CE1-CG1 3.72Å; Y618-I627 HydrophobicContact CE1-CG2 4.48Å; Y618-I627 HydrophobicContact CE2-CD1 4.34Å; Y618-I627 HydrophobicContact CE2-CG1 4.35Å; Y618-I627 HydrophobicContact CE2-CG2 3.68Å; Y618-I627 HydrophobicContact CG-CG1 4.16Å; Y618-I627 HydrophobicContact CG-CG2 4.46Å; L625-I627 HydrophobicContact CG-CG1 4.45Å; I627-P629 WeakPolarHBondContact O-CD 3.46Å; I627-V737 CarbonylContact O-C 3.56Å; I627-V737 WeakPolarHBondContact O-CA 3.24Å; I627-Y738 HydrophobicContact CB-CD2 4.29Å; I627-Y738 HydrophobicContact CB-CG 4.47Å; I627-Y738 HydrophobicContact CG2-CD2 4.27Å; I627-Y738 PolarHBondContact N-O 3.1Å; I627-Y738 PolarHBondContact O-N 3.23Å; I627-Y740 HydrophobicContact CD1-CD2 4.27Å; I627-Y740 HydrophobicContact CD1-CE2 3.61Å; I627-Y740 HydrophobicContact CG1-CD2 4.4Å; I627-Y740 HydrophobicContact CG1-CE2 4.26Å; I627-I749 HydrophobicContact CD1-CD1 4.37Å; I627-I749 HydrophobicContact CD1-CG2 4.49Å
628	E	88.8	Confident	72.9	Confident	59.3333 Å²	59.3333	52.7 Å²	52.7	28%	0.277	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	112.4	-179.8	176.6	-179.8	-157.9	0	0	108.7	L357 R616 L617 W619 V630	L357-E628 HydrophobicContact CD1-CB 4.2Å; L357-E628 HydrophobicContact CD1-CG 3.75Å; R616-E628 CarbonylContact C-O 3.5Å; R616-E628 WeakPolarHBondContact CA-O 3.36Å; L617-E628 HydrophobicContact CB-CB 4.34Å; L617-E628 PolarHBondContact N-O 3.27Å; L617-E628 PolarHBondContact O-N 3.23Å; W619-E628 PolarHBondContact NE1-OE2 3.01Å; E628-V630 PolarHBondContact O-N 3.27Å
629	P	83.1	Confident	70	Confident	30.3333 Å²	30.3333	59.6 Å²	59.6	20%	0.197	32%	0.316	C	S	.	.			trans	-59.6	134.7	167.9	-6.5	14.4	0	0	0	110	R616 I627 D631 P735 C736 Y738	R616-P629 HydrophobicContact CG-CB 4.48Å; I627-P629 WeakPolarHBondContact O-CD 3.46Å; P629-D631 PolarHBondContact O-N 3.13Å; P629-P735 WeakPolarHBondContact CG-O 3.31Å; P629-C736 WeakPolarHBondContact CD-O 3.45Å; P629-C736 WeakPolarHBondContact CG-O 3.44Å; P629-Y738 HydrophobicContact CG-CD2 4.21Å; P629-Y738 HydrophobicContact CG-CE2 3.92Å
630	V	73.4	Confident	67.2	Low	42 Å²	42	66.3 Å²	66.3	26%	0.255	35%	0.352	S	S	.	.			trans	-81.5	122	176.3	178.6	0	0	0	0	108	G615 L617 E628 F632	G615-V630 VanDerWaalsContact C-CG2 3.45Å; G615-V630 WeakPolarHBondContact O-CB 3.45Å; G615-V630 WeakPolarHBondContact O-CG2 3.38Å; L617-V630 HydrophobicContact CB-CG2 4.13Å; L617-V630 HydrophobicContact CD1-CG2 3.62Å; L617-V630 VanDerWaalsContact CD1-CG2 3.48Å; L617-V630 HydrophobicContact CG-CG2 3.71Å; E628-V630 PolarHBondContact O-N 3.27Å; V630-F632 HydrophobicContact CB-CD2 4.38Å; V630-F632 HydrophobicContact CB-CE2 4.12Å; V630-F632 HydrophobicContact CB-CZ 3.98Å; V630-F632 HydrophobicContact CG1-CD1 4.13Å; V630-F632 HydrophobicContact CG1-CD2 4.29Å; V630-F632 HydrophobicContact CG1-CE1 4.13Å; V630-F632 HydrophobicContact CG1-CE2 3.95Å; V630-F632 HydrophobicContact CG1-CZ 3.87Å; V630-F632 VanDerWaalsContact O-CD2 3.23Å; V630-F632 WeakPolarHBondContact O-CD2 3.42Å; V630-F632 PolarHBondContact O-N 3.35Å
631	D	62.3	Low	64.7	Low	85.6667 Å²	85.6667	69.3 Å²	69.3	46%	0.458	39%	0.385	S	S	.	.			trans	-75.4	109.8	168.1	-167.4	-10.5	0	0	0	108.3	P629 S633 Q634	P629-D631 PolarHBondContact O-N 3.13Å; D631-S633 PolarHBondContact O-N 3.41Å; D631-S633 VanDerWaalsContact OD1-CB 3.27Å; D631-S633 WeakPolarHBondContact OD1-CB 3.47Å; D631-S633 PolarHBondContact OD1-N 3.05Å; D631-S633 VanDerWaalsContact OD1-N 3.13Å; D631-S633 PolarHBondContact OD1-OG 3.17Å; D631-S633 PolarHBondContact OD2-OG 3.22Å; D631-S633 VanDerWaalsContact OD2-OG 3.11Å; D631-Q634 HydrophobicContact CB-CB 4.33Å; D631-Q634 HydrophobicContact CB-CG 3.93Å; D631-Q634 PolarHBondContact O-N 2.96Å; D631-Q634 WeakPolarHBondContact OD2-CG 3.26Å; D631-Q634 PolarHBondContact OD2-NE2 3Å
632	F	56.6	Low	62.2	Low	59.3333 Å²	59.3333	76.5 Å²	76.5	26%	0.26	42%	0.416	S	S	.	.			trans	-80.8	3.3	178	-69.2	-82	0	0	0	112.5	P330 V630 Q634 W651 E652 P727	P330-F632 HydrophobicContact CB-CD1 4.44Å; P330-F632 HydrophobicContact CB-CE1 3.55Å; P330-F632 HydrophobicContact CB-CZ 4.05Å; V630-F632 HydrophobicContact CB-CD2 4.38Å; V630-F632 HydrophobicContact CB-CE2 4.12Å; V630-F632 HydrophobicContact CB-CZ 3.98Å; V630-F632 HydrophobicContact CG1-CD1 4.13Å; V630-F632 HydrophobicContact CG1-CD2 4.29Å; V630-F632 HydrophobicContact CG1-CE1 4.13Å; V630-F632 HydrophobicContact CG1-CE2 3.95Å; V630-F632 HydrophobicContact CG1-CZ 3.87Å; V630-F632 VanDerWaalsContact O-CD2 3.23Å; V630-F632 WeakPolarHBondContact O-CD2 3.42Å; V630-F632 PolarHBondContact O-N 3.35Å; F632-Q634 PolarHBondContact O-N 2.95Å; F632-W651 WeakPolarHBondContact O-CZ3 3.34Å; F632-E652 HydrophobicContact CB-CG 3.93Å; F632-P727 HydrophobicContact CE2-CB 3.84Å; F632-P727 HydrophobicContact CZ-CB 3.66Å; F632-P727 HydrophobicContact CZ-CG 4.21Å
633	S	53.5	Low	59.8	Low	38 Å²	38	82.8 Å²	82.8	27%	0.266	44%	0.44	S	S	.	.			trans	-72.9	16.8	171.5	64.8	0	0	0	0	113.1	D631 C635 V647 D648	D631-S633 PolarHBondContact O-N 3.41Å; D631-S633 VanDerWaalsContact OD1-CB 3.27Å; D631-S633 WeakPolarHBondContact OD1-CB 3.47Å; D631-S633 PolarHBondContact OD1-N 3.05Å; D631-S633 VanDerWaalsContact OD1-N 3.13Å; D631-S633 PolarHBondContact OD1-OG 3.17Å; D631-S633 PolarHBondContact OD2-OG 3.22Å; D631-S633 VanDerWaalsContact OD2-OG 3.11Å; S633-C635 PolarHBondContact O-N 3.18Å; S633-V647 WeakPolarHBondContact O-CA 3.23Å; S633-V647 WeakPolarHBondContact OG-CG1 3.39Å; S633-D648 PolarHBondContact O-N 3.13Å
634	Q	47.8	Very low	57.4	Low	101.333 Å²	101.333	89.9 Å²	89.9	47%	0.474	48%	0.479	S	S	.	.			trans	-60.1	84.7	178.3	-64.4	-168.8	8	0	0	114.8	D631 F632 E636 V647 W651	D631-Q634 HydrophobicContact CB-CB 4.33Å; D631-Q634 HydrophobicContact CB-CG 3.93Å; D631-Q634 PolarHBondContact O-N 2.96Å; D631-Q634 WeakPolarHBondContact OD2-CG 3.26Å; D631-Q634 PolarHBondContact OD2-NE2 3Å; F632-Q634 PolarHBondContact O-N 2.95Å; Q634-E636 PolarHBondContact O-N 3.45Å; Q634-E636 VanDerWaalsContact O-N 3.13Å; Q634-V647 HydrophobicContact CG-CG2 3.97Å; Q634-W651 HydrophobicContact CG-CD2 4.32Å; Q634-W651 HydrophobicContact CG-CE3 3.77Å; Q634-W651 HydrophobicContact CG-CH2 4.03Å; Q634-W651 HydrophobicContact CG-CZ3 3.61Å
635	C	41.9	Very low	55.2	Low	95.3333 Å²	95.3333	91.9 Å²	91.9	64%	0.644	50%	0.502	S	S	*	.			trans	-70.8	62.6	162.1	-75.3	0	0	0	0	111	S633 P637 L646 W651	S633-C635 PolarHBondContact O-N 3.18Å; C635-P637 WeakPolarHBondContact O-CD 3.15Å; C635-L646 PolarHBondContact N-O 3.47Å; C635-W651 HydrophobicContact CB-CD2 4.33Å; C635-W651 HydrophobicContact CB-CG 4.41Å; C635-W651 VanDerWaalsContact SG-CB 3.57Å
636	E	39.3	Very low	53	Low	147 Å²	147	99.3 Å²	99.3	69%	0.687	54%	0.54	S	S	*	.			trans	-80.4	123.9	177.7	-97.2	-174.1	167.7	0	0	111.2	Q634 Q638	Q634-E636 PolarHBondContact O-N 3.45Å; Q634-E636 VanDerWaalsContact O-N 3.13Å; E636-Q638 VanDerWaalsContact C-N 3.33Å; E636-Q638 PolarHBondContact O-N 3.21Å; E636-Q638 PolarHBondContact OE2-NE2 3.31Å
637	P	39.4	Very low	51.1	Low	118 Å²	118	102.8 Å²	102.8	77%	0.766	56%	0.562	S	S	*	*			trans	-77.1	60.9	178.4	23.7	-22.4	0	0	0	111.3	C635 L639	C635-P637 WeakPolarHBondContact O-CD 3.15Å; P637-L639 PolarHBondContact O-N 3.15Å
638	Q	35.1	Very low	49.5	Very low	158.667 Å²	158.667	106.2 Å²	106.2	74%	0.741	58%	0.581	S	S	*	*			trans	-77.2	80.3	178.4	-78.2	-176.5	9.4	0	0	111.3	E636	E636-Q638 VanDerWaalsContact C-N 3.33Å; E636-Q638 PolarHBondContact O-N 3.21Å; E636-Q638 PolarHBondContact OE2-NE2 3.31Å
639	L	33.4	Very low	48.2	Very low	149 Å²	149	108.6 Å²	108.6	78%	0.78	60%	0.595	S	S	*	*			trans	-42.5	116.1	164.8	-77.7	126.4	0	0	0	113.8	P637 G641	P637-L639 PolarHBondContact O-N 3.15Å; L639-G641 PolarHBondContact O-N 3.4Å
640	M	32.4	Very low	47.3	Very low	190.333 Å²	190.333	111 Å²	111	94%	0.938	61%	0.613	S	S	*	*	S	Bend	trans	-10.1	108.1	162.2	-82.2	-83.3	141.4	0	0	114.8
641	G	39.4	Very low	47.1	Very low	71 Å²	71	114 Å²	114	73%	0.732	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	115.7	10.6	153.2	0	0	0	0	0	118.9	L639	L639-G641 PolarHBondContact O-N 3.4Å
642	F	36	Very low	47.2	Very low	187 Å²	187	112 Å²	112	82%	0.82	61%	0.608	S	S	*	*			trans	-124.4	122.4	178.1	-76.6	-84.5	0	0	0	113.8
643	H	35.2	Very low	47.7	Very low	174.333 Å²	174.333	113.6 Å²	113.6	81%	0.807	62%	0.617	S	S	*	*			trans	-82	148.2	-174.4	-63.6	-76.5	0	0	0	113.6	G645	H643-G645 PolarHBondContact O-N 3.1Å
644	D	40	Very low	48.4	Very low	158.333 Å²	158.333	116.9 Å²	116.9	85%	0.847	63%	0.628	S	S	*	*			trans	-49.5	130.4	172.6	-65.1	-35.8	0	0	0	110	L646	D644-L646 PolarHBondContact O-N 2.89Å; D644-L646 VanDerWaalsContact O-N 3.1Å
645	G	43.7	Very low	49.4	Very low	48.6667 Å²	48.6667	116 Å²	116	50%	0.502	62%	0.621	S	S	.	*			trans	-54.1	136.1	-178.7	0	0	0	0	0	111.5	H643 V647	H643-G645 PolarHBondContact O-N 3.1Å; G645-V647 PolarHBondContact O-N 3.33Å; G645-V647 VanDerWaalsContact O-N 3.12Å
646	L	47.4	Very low	50.7	Low	154.333 Å²	154.333	112 Å²	112	81%	0.808	60%	0.596	S	S	*	*			trans	-70.5	118.4	175.1	-134.2	109.5	0	0	0	108.8	C635 D644 D648	C635-L646 PolarHBondContact N-O 3.47Å; D644-L646 PolarHBondContact O-N 2.89Å; D644-L646 VanDerWaalsContact O-N 3.1Å; L646-D648 PolarHBondContact O-N 2.98Å
647	V	51.8	Low	52.2	Low	89 Å²	89	109.9 Å²	109.9	54%	0.539	58%	0.582	S	S	.	*			trans	-68.8	113	174.2	177.3	0	0	0	0	108.9	S633 Q634 G645 N649	S633-V647 WeakPolarHBondContact O-CA 3.23Å; S633-V647 WeakPolarHBondContact OG-CG1 3.39Å; Q634-V647 HydrophobicContact CG-CG2 3.97Å; G645-V647 PolarHBondContact O-N 3.33Å; G645-V647 VanDerWaalsContact O-N 3.12Å; V647-N649 WeakPolarHBondContact CG1-OD1 3.49Å; V647-N649 PolarHBondContact O-N 2.97Å
648	D	58.1	Low	53.7	Low	74 Å²	74	109.6 Å²	109.6	40%	0.396	57%	0.57	S	S	.	*			trans	-114.8	94.3	174.2	-172.1	-4.1	0	0	0	110.6	S633 L646 S650 W651 E652	S633-D648 PolarHBondContact O-N 3.13Å; L646-D648 PolarHBondContact O-N 2.98Å; D648-S650 PolarHBondContact O-N 3.18Å; D648-S650 VanDerWaalsContact O-N 3.09Å; D648-S650 WeakPolarHBondContact OD1-CA 3.28Å; D648-S650 VanDerWaalsContact OD1-CB 3.29Å; D648-S650 WeakPolarHBondContact OD1-CB 3.36Å; D648-S650 PolarHBondContact OD1-N 3.31Å; D648-S650 PolarHBondContact OD1-OG 3.46Å; D648-S650 PolarHBondContact OD2-OG 2.94Å; D648-W651 HydrophobicContact CB-CB 3.99Å; D648-W651 WeakPolarHBondContact O-CB 3.37Å; D648-W651 PolarHBondContact O-N 3.05Å; D648-W651 VanDerWaalsContact O-N 3.1Å; D648-W651 PolarHBondContact OD1-N 3.26Å; D648-W651 VanDerWaalsContact OD1-N 3.15Å; D648-E652 PolarHBondContact O-N 3.1Å
649	N	61.9	Low	55.3	Low	109.333 Å²	109.333	105.1 Å²	105.1	59%	0.585	55%	0.551	S	S	*	*	H	α-helix	trans	-58.9	-22.9	176.5	-67.4	-14	0	0	0	112.9	V647 M653	V647-N649 WeakPolarHBondContact CG1-OD1 3.49Å; V647-N649 PolarHBondContact O-N 2.97Å; N649-M653 WeakPolarHBondContact O-CB 3.38Å; N649-M653 PolarHBondContact O-N 3.01Å; N649-M653 VanDerWaalsContact O-N 3.15Å
650	S	65.1	Low	56.8	Low	81.3333 Å²	81.3333	101.1 Å²	101.1	57%	0.569	53%	0.529	S	S	*	.	H	α-helix	trans	-79.6	-32.3	178.8	44.1	0	0	0	0	111.8	D648 M653 E654	D648-S650 PolarHBondContact O-N 3.18Å; D648-S650 VanDerWaalsContact O-N 3.09Å; D648-S650 WeakPolarHBondContact OD1-CA 3.28Å; D648-S650 VanDerWaalsContact OD1-CB 3.29Å; D648-S650 WeakPolarHBondContact OD1-CB 3.36Å; D648-S650 PolarHBondContact OD1-N 3.31Å; D648-S650 PolarHBondContact OD1-OG 3.46Å; D648-S650 PolarHBondContact OD2-OG 2.94Å; S650-M653 PolarHBondContact O-N 3.09Å; S650-E654 WeakPolarHBondContact O-CB 3.27Å; S650-E654 PolarHBondContact O-N 2.97Å
651	W	67.7	Low	58.4	Low	104.333 Å²	104.333	97.8 Å²	97.8	40%	0.395	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-44	177	179.8	82.6	0	0	0	112.2	I331 F632 Q634 C635 D648 M653 E654 Y655	I331-W651 HydrophobicContact CD1-CH2 4.25Å; I331-W651 HydrophobicContact CD1-CZ3 4.22Å; F632-W651 WeakPolarHBondContact O-CZ3 3.34Å; Q634-W651 HydrophobicContact CG-CD2 4.32Å; Q634-W651 HydrophobicContact CG-CE3 3.77Å; Q634-W651 HydrophobicContact CG-CH2 4.03Å; Q634-W651 HydrophobicContact CG-CZ3 3.61Å; C635-W651 HydrophobicContact CB-CD2 4.33Å; C635-W651 HydrophobicContact CB-CG 4.41Å; C635-W651 VanDerWaalsContact SG-CB 3.57Å; D648-W651 HydrophobicContact CB-CB 3.99Å; D648-W651 WeakPolarHBondContact O-CB 3.37Å; D648-W651 PolarHBondContact O-N 3.05Å; D648-W651 VanDerWaalsContact O-N 3.1Å; D648-W651 PolarHBondContact OD1-N 3.26Å; D648-W651 VanDerWaalsContact OD1-N 3.15Å; W651-M653 VanDerWaalsContact C-N 3.26Å; W651-M653 PolarHBondContact O-N 3.07Å; W651-E654 PolarHBondContact O-N 3.04Å; W651-E654 VanDerWaalsContact O-N 3.1Å; W651-Y655 HydrophobicContact CH2-CD1 4.17Å; W651-Y655 HydrophobicContact CH2-CD2 4.16Å; W651-Y655 HydrophobicContact CH2-CE1 4.49Å; W651-Y655 HydrophobicContact CH2-CG 4.26Å; W651-Y655 HydrophobicContact CZ2-CD1 4.23Å; W651-Y655 HydrophobicContact CZ2-CD2 4.15Å; W651-Y655 AromaticContact CZ2-CG 3.88Å; W651-Y655 HydrophobicContact CZ2-CG 3.88Å; W651-Y655 HydrophobicContact CZ3-CG 4.47Å; W651-Y655 VanDerWaalsContact O-CB 3.27Å; W651-Y655 WeakPolarHBondContact O-CB 3.38Å; W651-Y655 PolarHBondContact O-N 3.19Å
652	E	65.6	Low	59.4	Low	43.6667 Å²	43.6667	99.6 Å²	99.6	20%	0.204	50%	0.504	C	S	.	.	H	α-helix	trans	-59.5	-41.2	178.3	-143.7	-169.4	166.1	0	0	111.7	I331 R334 F632 D648 G656	I331-E652 HydrophobicContact CD1-CG 4.36Å; I331-E652 HydrophobicContact CG2-CG 4.3Å; R334-E652 IonicContact CZ-OE1 3.53Å; R334-E652 IonicContact NH1-OE1 2.94Å; R334-E652 PolarHBondContact NH1-OE1 2.71Å; R334-E652 IonicContact NH1-OE2 3.53Å; F632-E652 HydrophobicContact CB-CG 3.93Å; D648-E652 PolarHBondContact O-N 3.1Å; E652-G656 PolarHBondContact O-N 2.92Å
653	M	66.2	Low	60.5	Low	93 Å²	93	92.6 Å²	92.6	46%	0.458	48%	0.476	S	S	.	.	H	α-helix	trans	-67.9	-40.5	177.2	-107.5	-163.5	-170	0	0	112.4	N649 S650 W651 G656 R657 N726 S728	N649-M653 WeakPolarHBondContact O-CB 3.38Å; N649-M653 PolarHBondContact O-N 3.01Å; N649-M653 VanDerWaalsContact O-N 3.15Å; S650-M653 PolarHBondContact O-N 3.09Å; W651-M653 VanDerWaalsContact C-N 3.26Å; W651-M653 PolarHBondContact O-N 3.07Å; M653-G656 PolarHBondContact O-N 3.29Å; M653-R657 WeakPolarHBondContact O-CB 3.42Å; M653-R657 PolarHBondContact O-N 3.36Å; M653-N726 WeakPolarHBondContact CE-OD1 3.46Å; M653-S728 WeakPolarHBondContact CE-OG 3.32Å; M653-S728 WeakPolarHBondContact CG-OG 3.13Å
654	E	68.8	Low	61.6	Low	107.667 Å²	107.667	88.6 Å²	88.6	50%	0.503	47%	0.465	S	S	.	.	H	α-helix	trans	-71.8	-40.7	179.8	-165.9	62.3	-169.8	0	0	111.6	S650 W651 G656 R657 E658	S650-E654 WeakPolarHBondContact O-CB 3.27Å; S650-E654 PolarHBondContact O-N 2.97Å; W651-E654 PolarHBondContact O-N 3.04Å; W651-E654 VanDerWaalsContact O-N 3.1Å; E654-G656 VanDerWaalsContact C-N 3.33Å; E654-G656 PolarHBondContact O-N 3.14Å; E654-R657 WeakPolarHBondContact O-CB 3.42Å; E654-R657 PolarHBondContact O-N 3.11Å; E654-R657 VanDerWaalsContact O-N 3.15Å; E654-R657 IonicContact OE1-NE 3.43Å; E654-R657 IonicContact OE2-CZ 2.6Å; E654-R657 IonicContact OE2-NE 3.01Å; E654-R657 PolarHBondContact OE2-NE 3.21Å; E654-R657 VanDerWaalsContact OE2-NE 3.13Å; E654-R657 IonicContact OE2-NH2 3.1Å; E654-E658 WeakPolarHBondContact O-CB 3.48Å; E654-E658 PolarHBondContact O-N 2.98Å
655	Y	68.7	Low	62.4	Low	81 Å²	81	86.5 Å²	86.5	32%	0.318	45%	0.45	S	S	.	.	H	α-helix	trans	-63.6	-42.7	173.8	-174.6	-106.5	0	0	0	111.6	D329 I331 W651 R657 E658 L659	D329-Y655 WeakPolarHBondContact OD2-CE1 3.49Å; D329-Y655 PolarHBondContact OD2-OH 3.34Å; I331-Y655 HydrophobicContact CB-CD1 4.37Å; I331-Y655 HydrophobicContact CD1-CD1 3.54Å; I331-Y655 HydrophobicContact CD1-CE1 3.84Å; I331-Y655 HydrophobicContact CG2-CD1 4.19Å; W651-Y655 HydrophobicContact CH2-CD1 4.17Å; W651-Y655 HydrophobicContact CH2-CD2 4.16Å; W651-Y655 HydrophobicContact CH2-CE1 4.49Å; W651-Y655 HydrophobicContact CH2-CG 4.26Å; W651-Y655 HydrophobicContact CZ2-CD1 4.23Å; W651-Y655 HydrophobicContact CZ2-CD2 4.15Å; W651-Y655 AromaticContact CZ2-CG 3.88Å; W651-Y655 HydrophobicContact CZ2-CG 3.88Å; W651-Y655 HydrophobicContact CZ3-CG 4.47Å; W651-Y655 VanDerWaalsContact O-CB 3.27Å; W651-Y655 WeakPolarHBondContact O-CB 3.38Å; W651-Y655 PolarHBondContact O-N 3.19Å; Y655-R657 VanDerWaalsContact C-N 3.29Å; Y655-R657 PolarHBondContact O-N 3.23Å; Y655-E658 PolarHBondContact O-N 3.01Å; Y655-L659 HydrophobicContact CD1-CD1 3.97Å; Y655-L659 HydrophobicContact CE1-CD1 3.47Å; Y655-L659 HydrophobicContact CE1-CG 4.19Å; Y655-L659 HydrophobicContact CE2-CD1 4.28Å; Y655-L659 HydrophobicContact CG-CD1 4.3Å; Y655-L659 WeakPolarHBondContact O-CB 3.39Å; Y655-L659 WeakPolarHBondContact O-CG 2.97Å; Y655-L659 PolarHBondContact O-N 3.2Å
656	G	69.5	Low	62.8	Low	12 Å²	12	87.8 Å²	87.8	12%	0.124	45%	0.448	C	S	.	.	H	α-helix	trans	-62.9	-33.9	173.2	0	0	0	0	0	113.2	E652 M653 E654 M660	E652-G656 PolarHBondContact O-N 2.92Å; M653-G656 PolarHBondContact O-N 3.29Å; E654-G656 VanDerWaalsContact C-N 3.33Å; E654-G656 PolarHBondContact O-N 3.14Å; G656-M660 WeakPolarHBondContact O-CB 3.39Å; G656-M660 VanDerWaalsContact O-CG 3.25Å; G656-M660 WeakPolarHBondContact O-CG 3.37Å; G656-M660 PolarHBondContact O-N 3Å
657	R	70.9	Confident	62.7	Low	102 Å²	102	87.5 Å²	87.5	39%	0.385	44%	0.44	S	S	.	.	H	α-helix	trans	-69.3	-48.6	174.2	-176.1	-162.8	-55.8	-78.1	-6.5	111.4	M653 E654 Y655 L659 M660 E661	M653-R657 WeakPolarHBondContact O-CB 3.42Å; M653-R657 PolarHBondContact O-N 3.36Å; E654-R657 WeakPolarHBondContact O-CB 3.42Å; E654-R657 PolarHBondContact O-N 3.11Å; E654-R657 VanDerWaalsContact O-N 3.15Å; E654-R657 IonicContact OE1-NE 3.43Å; E654-R657 IonicContact OE2-CZ 2.6Å; E654-R657 IonicContact OE2-NE 3.01Å; E654-R657 PolarHBondContact OE2-NE 3.21Å; E654-R657 VanDerWaalsContact OE2-NE 3.13Å; E654-R657 IonicContact OE2-NH2 3.1Å; Y655-R657 VanDerWaalsContact C-N 3.29Å; Y655-R657 PolarHBondContact O-N 3.23Å; R657-L659 VanDerWaalsContact C-N 3.35Å; R657-L659 PolarHBondContact O-N 3.25Å; R657-M660 CarbonylContact O-C 3.38Å; R657-M660 WeakPolarHBondContact O-CA 3.47Å; R657-M660 WeakPolarHBondContact O-CB 3.37Å; R657-M660 PolarHBondContact O-N 2.84Å; R657-M660 VanDerWaalsContact O-N 3.13Å; R657-E661 VanDerWaalsContact CD-OE1 3.32Å; R657-E661 WeakPolarHBondContact CD-OE1 3.39Å; R657-E661 HydrophobicContact CG-CG 4.31Å; R657-E661 VanDerWaalsContact CG-OE1 3.29Å; R657-E661 WeakPolarHBondContact CG-OE1 3.41Å; R657-E661 WeakPolarHBondContact O-CG 3.21Å; R657-E661 PolarHBondContact O-N 3.43Å
658	E	70.7	Confident	62.6	Low	112 Å²	112	89.5 Å²	89.5	52%	0.523	45%	0.448	S	S	.	.	H	α-helix	trans	-57.6	-44.7	178.9	-172.2	176.2	-166.8	0	0	111	E654 Y655 M660 E661 D662	E654-E658 WeakPolarHBondContact O-CB 3.48Å; E654-E658 PolarHBondContact O-N 2.98Å; Y655-E658 PolarHBondContact O-N 3.01Å; E658-M660 VanDerWaalsContact C-N 3.27Å; E658-M660 PolarHBondContact O-N 3.02Å; E658-M660 VanDerWaalsContact O-N 3.17Å; E658-E661 PolarHBondContact O-N 3.35Å; E658-D662 PolarHBondContact O-N 2.96Å
659	L	68.4	Low	62.1	Low	65.6667 Å²	65.6667	92.5 Å²	92.5	34%	0.344	46%	0.464	S	S	.	.	H	α-helix	trans	-59.6	-30.9	175.4	-106.4	130.5	0	0	0	113.7	D329 E332 Y655 R657	D329-L659 HydrophobicContact CB-CD2 3.98Å; E332-L659 HydrophobicContact CB-CD2 3.48Å; E332-L659 VanDerWaalsContact CB-CD2 3.48Å; E332-L659 HydrophobicContact CG-CD2 3.71Å; Y655-L659 HydrophobicContact CD1-CD1 3.97Å; Y655-L659 HydrophobicContact CE1-CD1 3.47Å; Y655-L659 HydrophobicContact CE1-CG 4.19Å; Y655-L659 HydrophobicContact CE2-CD1 4.28Å; Y655-L659 HydrophobicContact CG-CD1 4.3Å; Y655-L659 WeakPolarHBondContact O-CB 3.39Å; Y655-L659 WeakPolarHBondContact O-CG 2.97Å; Y655-L659 PolarHBondContact O-N 3.2Å; R657-L659 VanDerWaalsContact C-N 3.35Å; R657-L659 PolarHBondContact O-N 3.25Å
660	M	65.4	Low	61.4	Low	64.6667 Å²	64.6667	93.9 Å²	93.9	32%	0.319	47%	0.467	S	S	.	.	H	α-helix	trans	-89	-25.9	179.7	-65.3	-84.3	-68.7	0	0	112.7	E332 R336 G656 R657 E658 K722 Y723	E332-M660 HydrophobicContact CG-SD 4.44Å; R336-M660 HydrophobicContact CG-CE 3.91Å; R336-M660 HydrophobicContact CG-SD 3.83Å; G656-M660 WeakPolarHBondContact O-CB 3.39Å; G656-M660 VanDerWaalsContact O-CG 3.25Å; G656-M660 WeakPolarHBondContact O-CG 3.37Å; G656-M660 PolarHBondContact O-N 3Å; R657-M660 CarbonylContact O-C 3.38Å; R657-M660 WeakPolarHBondContact O-CA 3.47Å; R657-M660 WeakPolarHBondContact O-CB 3.37Å; R657-M660 PolarHBondContact O-N 2.84Å; R657-M660 VanDerWaalsContact O-N 3.13Å; E658-M660 VanDerWaalsContact C-N 3.27Å; E658-M660 PolarHBondContact O-N 3.02Å; E658-M660 VanDerWaalsContact O-N 3.17Å; M660-K722 WeakPolarHBondContact CE-O 3.38Å; M660-K722 WeakPolarHBondContact O-CE 3.49Å; M660-K722 PolarHBondContact O-NZ 3.35Å; M660-Y723 HydrophobicContact CB-CE1 4.36Å; M660-Y723 HydrophobicContact CG-CE1 4.26Å
661	E	66.4	Low	60.5	Low	120.333 Å²	120.333	97.3 Å²	97.3	56%	0.562	48%	0.479	S	S	*	.	H	α-helix	trans	-79.7	-29.1	177.1	-74.5	-179.1	-172.4	0	0	112.8	R657 E658 D663	R657-E661 VanDerWaalsContact CD-OE1 3.32Å; R657-E661 WeakPolarHBondContact CD-OE1 3.39Å; R657-E661 HydrophobicContact CG-CG 4.31Å; R657-E661 VanDerWaalsContact CG-OE1 3.29Å; R657-E661 WeakPolarHBondContact CG-OE1 3.41Å; R657-E661 WeakPolarHBondContact O-CG 3.21Å; R657-E661 PolarHBondContact O-N 3.43Å; E658-E661 PolarHBondContact O-N 3.35Å; E661-D663 VanDerWaalsContact C-N 3.3Å; E661-D663 PolarHBondContact O-N 3.19Å
662	D	59	Low	59.5	Low	109.333 Å²	109.333	100 Å²	100	59%	0.585	50%	0.501	S	S	*	.	S	Bend	trans	-81.8	6	177	-85	-25	0	0	0	114.5	E658 P664	E658-D662 PolarHBondContact O-N 2.96Å; D662-P664 WeakPolarHBondContact O-CD 3.34Å
663	D	59.6	Low	58.4	Low	40.3333 Å²	40.3333	105 Å²	105	22%	0.216	53%	0.528	C	S	.	.			trans	-70.4	111.5	177.2	-165.7	5.3	0	0	0	111.1	R336 E661 E665 V666	R336-D663 IonicContact CZ-OD2 2.64Å; R336-D663 IonicContact NH2-OD1 3.77Å; R336-D663 PolarHBondContact NH2-OD1 2.68Å; R336-D663 VanDerWaalsContact NH2-OD1 3.1Å; R336-D663 IonicContact NH2-OD2 3.03Å; R336-D663 PolarHBondContact NH2-OD2 3.45Å; E661-D663 VanDerWaalsContact C-N 3.3Å; E661-D663 PolarHBondContact O-N 3.19Å; D663-E665 PolarHBondContact O-N 3.06Å; D663-E665 VanDerWaalsContact O-N 3.1Å; D663-E665 PolarHBondContact OD1-N 2.77Å; D663-V666 HydrophobicContact CB-CG2 4.22Å; D663-V666 WeakPolarHBondContact O-CB 3.45Å; D663-V666 PolarHBondContact O-N 3.26Å; D663-V666 VanDerWaalsContact O-N 3.08Å
664	P	58.1	Low	57.3	Low	90.3333 Å²	90.3333	108 Å²	108	59%	0.587	55%	0.546	S	S	*	.	H	α-helix	trans	-62.6	-19.4	-177.8	25.1	-35.3	0	0	0	113.6	D662 V666 K667	D662-P664 WeakPolarHBondContact O-CD 3.34Å; P664-V666 VanDerWaalsContact C-N 3.27Å; P664-V666 PolarHBondContact O-N 2.99Å; P664-V666 VanDerWaalsContact O-N 3.11Å; P664-K667 PolarHBondContact O-N 2.87Å; P664-K667 VanDerWaalsContact O-N 3.11Å
665	E	57.4	Low	56	Low	112.667 Å²	112.667	109.2 Å²	109.2	53%	0.526	56%	0.555	S	S	.	*	H	α-helix	trans	-68.3	-12.5	176.4	-68.8	-178	175.1	0	0	113.1	D663 K721	D663-E665 PolarHBondContact O-N 3.06Å; D663-E665 VanDerWaalsContact O-N 3.1Å; D663-E665 PolarHBondContact OD1-N 2.77Å; E665-K721 IonicContact OE2-NZ 3.8Å; E665-K721 PolarHBondContact OE2-NZ 3.29Å
666	V	51.7	Low	54.5	Low	77.6667 Å²	77.6667	112 Å²	112	47%	0.471	58%	0.576	S	S	.	*	H	α-helix	trans	-90.8	-17.3	176.5	-176.1	0	0	0	0	112.1	D663 P664 D668 D669	D663-V666 HydrophobicContact CB-CG2 4.22Å; D663-V666 WeakPolarHBondContact O-CB 3.45Å; D663-V666 PolarHBondContact O-N 3.26Å; D663-V666 VanDerWaalsContact O-N 3.08Å; P664-V666 VanDerWaalsContact C-N 3.27Å; P664-V666 PolarHBondContact O-N 2.99Å; P664-V666 VanDerWaalsContact O-N 3.11Å; V666-D668 VanDerWaalsContact C-N 3.27Å; V666-D668 PolarHBondContact O-N 3.24Å; V666-D669 PolarHBondContact O-N 2.87Å
667	K	46.4	Very low	52.9	Low	147.667 Å²	147.667	118.8 Å²	118.8	64%	0.642	61%	0.61	S	S	*	*	H	α-helix	trans	-84.9	-15.5	-178.9	-79.4	-179.7	178.8	160.5	0	113.8	P664 D669	P664-K667 PolarHBondContact O-N 2.87Å; P664-K667 VanDerWaalsContact O-N 3.11Å; K667-D669 PolarHBondContact O-N 3.07Å
668	D	48.7	Very low	51.1	Low	131.333 Å²	131.333	120.5 Å²	120.5	70%	0.702	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-5.6	-177.3	-68.6	-20.1	0	0	0	113.9	V666	V666-D668 VanDerWaalsContact C-N 3.27Å; V666-D668 PolarHBondContact O-N 3.24Å
669	D	48.5	Very low	49.5	Very low	136.667 Å²	136.667	120.8 Å²	120.8	73%	0.731	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	10.2	-178.1	-73.3	-32.4	0	0	0	114.4	V666 K667	V666-D669 PolarHBondContact O-N 2.87Å; K667-D669 PolarHBondContact O-N 3.07Å
670	E	47.3	Very low	47.8	Very low	137.667 Å²	137.667	124.9 Å²	124.9	64%	0.643	65%	0.653	S	S	*	*	S	Bend	trans	-111	13.5	177.4	-69.3	-140.1	171.4	0	0	114.7	K718	E670-K718 VanDerWaalsContact OE1-CE 3.29Å; E670-K718 WeakPolarHBondContact OE1-CE 3.38Å; E670-K718 IonicContact OE1-NZ 3.07Å; E670-K718 PolarHBondContact OE1-NZ 3.4Å; E670-K718 IonicContact OE2-NZ 3.3Å; E670-K718 PolarHBondContact OE2-NZ 2.8Å
671	D	45.6	Very low	46.3	Very low	153.667 Å²	153.667	126.8 Å²	126.8	82%	0.822	67%	0.673	S	S	*	*	S	Bend	trans	-99.3	23.1	178	-79.6	-26.9	0	0	0	113.6
672	D	47.7	Very low	44.5	Very low	160 Å²	160	128.3 Å²	128.3	86%	0.856	69%	0.685	S	S	*	*			trans	-124.3	53	175.9	-87.1	-20.8	0	0	0	112.8	D674	D672-D674 PolarHBondContact O-N 3.37Å
673	I	42.3	Very low	43.4	Very low	149 Å²	149	129.6 Å²	129.6	76%	0.764	70%	0.697	S	S	*	*			trans	-114.5	84.4	164.5	-55.5	178.3	0	0	0	109	D675	I673-D675 PolarHBondContact O-N 3.13Å
674	D	43.1	Very low	41.9	Very low	156.333 Å²	156.333	134.7 Å²	134.7	84%	0.836	72%	0.724	S	S	*	*			trans	-80.5	118.5	165.6	-126.6	-3.1	0	0	0	109.3	D672 N676	D672-D674 PolarHBondContact O-N 3.37Å; D674-N676 PolarHBondContact O-N 3.22Å
675	D	41.5	Very low	40.5	Very low	132.667 Å²	132.667	135.7 Å²	135.7	71%	0.709	73%	0.733	S	S	*	*			trans	-28.7	109.6	167.5	-81.2	-33.6	0	0	0	114.9	I673	I673-D675 PolarHBondContact O-N 3.13Å
676	N	36.5	Very low	38.9	Very low	141 Å²	141	136.1 Å²	136.1	75%	0.754	74%	0.743	S	S	*	*			trans	164.9	98.1	145.8	-89.4	-42	0	0	0	113.4	D674 N678	D674-N676 PolarHBondContact O-N 3.22Å; N676-N678 PolarHBondContact O-N 2.82Å
677	N	36.2	Very low	37.8	Very low	154.333 Å²	154.333	138.5 Å²	138.5	83%	0.825	76%	0.759	S	S	*	*				-151.9	114.3	125.7	-87.1	-41.9	0	0	0	110.9
678	N	33.2	Very low	36.8	Very low	137.333 Å²	137.333	138.5 Å²	138.5	73%	0.734	77%	0.766	S	S	*	*			trans	-89.6	127.5	152	-127.2	18.9	0	0	0	114.7	N676	N676-N678 PolarHBondContact O-N 2.82Å
679	D	35.9	Very low	35.8	Very low	119 Å²	119	137.6 Å²	137.6	64%	0.636	77%	0.77	S	S	*	*			trans	66.2	104.4	143.8	-63.7	-27.4	0	0	0	119.8
680	N	33.6	Very low	34.7	Very low	150 Å²	150	135 Å²	135	80%	0.802	77%	0.767	S	S	*	*				90.6	124	113.3	-73.3	-43.3	0	0	0	117.4
681	S	33.3	Very low	33.8	Very low	105.667 Å²	105.667	135.5 Å²	135.5	74%	0.739	77%	0.774	S	S	*	*			trans	-144.4	139.6	140.3	56.4	0	0	0	0	112.9
682	D	29.5	Very low	33	Very low	151.333 Å²	151.333	136 Å²	136	81%	0.809	78%	0.777	S	S	*	*			trans	-31.8	134.1	162.9	-57.7	-59.8	0	0	0	116.7
683	V	34.7	Very low	32	Very low	136.333 Å²	136.333	135.4 Å²	135.4	83%	0.826	77%	0.774	S	S	*	*			trans	-176.3	100.8	145.4	-170.8	0	0	0	0	112.4
684	N	27.7	Very low	31.4	Very low	148.333 Å²	148.333	133.3 Å²	133.3	79%	0.793	77%	0.772	S	S	*	*			trans	-33.8	122.1	151	-76.1	-31.5	0	0	0	113.9
685	S	29	Very low	30.5	Very low	111 Å²	111	133.5 Å²	133.5	78%	0.776	77%	0.772	S	S	*	*			trans	-111.9	108.7	139.4	63.5	0	0	0	0	112.3
686	T	25.4	Very low	29.7	Very low	120.667 Å²	120.667	134.6 Å²	134.6	74%	0.74	78%	0.778	S	S	*	*			trans	-89	118.6	163.3	38.3	0	0	0	0	109.5
687	T	28.3	Very low	29.2	Very low	129.333 Å²	129.333	135.8 Å²	135.8	79%	0.793	78%	0.783	S	S	*	*			trans	-155.7	109.1	137.5	51.4	0	0	0	0	109.9
688	D	25.4	Very low	28.7	Very low	147.667 Å²	147.667	134.5 Å²	134.5	79%	0.79	78%	0.782	S	S	*	*			trans	-96.5	139.3	153.7	-80	-40.9	0	0	0	112.7
689	S	27.9	Very low	28.3	Very low	112.333 Å²	112.333	133 Å²	133	79%	0.786	78%	0.781	S	S	*	*			trans	96.7	108.1	138.9	21	0	0	0	0	115.2
690	A	25.4	Very low	27.8	Very low	81.3333 Å²	81.3333	137.4 Å²	137.4	67%	0.672	80%	0.795	S	S	*	*				-82.4	138	125.4	0	0	0	0	0	111.6
691	D	28.1	Very low	27.5	Very low	147.333 Å²	147.333	136.8 Å²	136.8	79%	0.788	80%	0.797	S	S	*	*				150.9	92.8	127.9	-77.6	-20.9	0	0	0	113.6
692	N	28	Very low	27.2	Very low	164 Å²	164	136.9 Å²	136.9	88%	0.877	80%	0.797	S	S	*	*			trans	-99.2	98.6	161	-82.6	-30.8	0	0	0	108.9	S694	N692-S694 PolarHBondContact O-N 3.27Å
693	N	27.5	Very low	26.9	Very low	149.333 Å²	149.333	138.7 Å²	138.7	80%	0.799	80%	0.8	S	S	*	*			trans	-106.7	99.9	165	-92.2	-30.3	0	0	0	110.6
694	S	28.4	Very low	26.4	Very low	104 Å²	104	137.8 Å²	137.8	73%	0.727	80%	0.799	S	S	*	*			trans	-54.5	116.1	158	95.6	0	0	0	0	113.4	N692 N696	N692-S694 PolarHBondContact O-N 3.27Å; S694-N696 PolarHBondContact O-N 3.3Å
695	L	25.8	Very low	26.4	Very low	160 Å²	160	138.3 Å²	138.3	84%	0.838	80%	0.802	S	S	*	*			trans	-32.9	116.4	164	-68.7	160.6	0	0	0	113.7	L697	L695-L697 PolarHBondContact O-N 3.22Å
696	N	24.6	Very low	26.3	Very low	156.333 Å²	156.333	138.2 Å²	138.2	84%	0.836	80%	0.801	S	S	*	*			trans	-97.8	115.9	149.6	-90.8	-34.9	0	0	0	111.1	S694	S694-N696 PolarHBondContact O-N 3.3Å
697	L	25.5	Very low	26.4	Very low	165.333 Å²	165.333	137.6 Å²	137.6	87%	0.866	80%	0.802	S	S	*	*			trans	-83.2	106.6	163.6	-138.4	78.9	0	0	0	110.3	L695	L695-L697 PolarHBondContact O-N 3.22Å
698	T	24.8	Very low	26.5	Very low	128 Å²	128	140.3 Å²	140.3	79%	0.785	81%	0.805	S	S	*	*			trans	-109.2	116.9	154.5	49.2	0	0	0	0	110.9
699	S	26.2	Very low	26.8	Very low	104.667 Å²	104.667	139 Å²	139	73%	0.732	81%	0.805	S	S	*	*			trans	-68.2	116.8	156.7	56.1	0	0	0	0	113.3	V701	S699-V701 PolarHBondContact O-N 3.07Å
700	K	25	Very low	26.6	Very low	212 Å²	212	142.1 Å²	142.1	92%	0.922	81%	0.809	S	S	*	*			trans	-82.8	105	163	-88.6	169.1	173.9	173.6	0	110.1	S702	K700-S702 PolarHBondContact O-N 3.43Å
701	V	27.6	Very low	26.8	Very low	138 Å²	138	143.4 Å²	143.4	84%	0.836	81%	0.811	S	S	*	*			trans	-97.8	127.5	159.6	-179.7	0	0	0	0	107.6	S699	S699-V701 PolarHBondContact O-N 3.07Å
702	S	26.2	Very low	26.8	Very low	108 Å²	108	141.2 Å²	141.2	76%	0.755	81%	0.813	S	S	*	*			trans	-81.5	133.5	-170.2	48.2	0	0	0	0	114	K700	K700-S702 PolarHBondContact O-N 3.43Å
703	H	24.3	Very low	26.7	Very low	188 Å²	188	140.9 Å²	140.9	87%	0.87	81%	0.811	S	S	*	*			trans	-8.8	117	162.8	-82.1	-20.4	0	0	0	118.3
704	C	24.2	Very low	26.8	Very low	117.667 Å²	117.667	141.1 Å²	141.1	80%	0.795	81%	0.812	S	S	*	*			trans	-111.4	115.5	146.5	54.8	0	0	0	0	109.2	S706	C704-S706 PolarHBondContact O-N 3.15Å
705	D	26	Very low	26.8	Very low	159.333 Å²	159.333	143 Å²	143	85%	0.852	81%	0.814	S	S	*	*			trans	-83.2	110.5	175.8	-133.1	-15.4	0	0	0	109.2
706	S	28.6	Very low	27.1	Very low	108 Å²	108	144.6 Å²	144.6	76%	0.755	81%	0.814	S	S	*	*			trans	-120.9	99.2	173.5	-68.1	0	0	0	0	108.8	C704 Q708	C704-S706 PolarHBondContact O-N 3.15Å; S706-Q708 PolarHBondContact O-N 3.11Å
707	S	25.6	Very low	27.4	Very low	109.667 Å²	109.667	146.5 Å²	146.5	77%	0.767	82%	0.818	S	S	*	*			trans	-108.1	106.9	161.4	54.4	0	0	0	0	111.4
708	Q	31	Very low	27.8	Very low	184.667 Å²	184.667	146.2 Å²	146.2	86%	0.863	81%	0.81	S	S	*	*				-169.6	140.7	128.8	-101.7	-172.7	2	0	0	110.9	S706	S706-Q708 PolarHBondContact O-N 3.11Å
709	P	31.8	Very low	28.2	Very low	120.667 Å²	120.667	147.6 Å²	147.6	78%	0.784	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-89.4	130.1	-160.3	29	-22.6	0	0	0	112.7
710	M	23.8	Very low	28.7	Very low	178 Å²	178	148 Å²	148	88%	0.877	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-44.8	127.2	165.3	-71.2	-71.9	-77.3	0	0	113.5
711	P	29.8	Very low	29.7	Very low	108.667 Å²	108.667	144.6 Å²	144.6	71%	0.706	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-84.1	137.9	174.8	31.2	-27.7	0	0	0	111.1	L713	P711-L713 PolarHBondContact O-N 3.15Å
712	A	27.2	Very low	30.9	Very low	101.333 Å²	101.333	145.5 Å²	145.5	84%	0.837	79%	0.792	S	S	*	*			trans	-59	112.7	-177.8	0	0	0	0	0	112.8	N714	A712-N714 PolarHBondContact O-N 3.14Å
713	L	27	Very low	32.4	Very low	156.667 Å²	156.667	146.7 Å²	146.7	82%	0.82	78%	0.78	S	S	*	*			trans	-68.4	103.3	165.5	-115.2	96.6	0	0	0	110.2	P711 N715	P711-L713 PolarHBondContact O-N 3.15Å; L713-N715 PolarHBondContact O-N 3.29Å
714	N	28.4	Very low	34.3	Very low	153.667 Å²	153.667	144.5 Å²	144.5	82%	0.822	77%	0.771	S	S	*	*			trans	-78.6	108.6	156.2	-95.4	-21.3	0	0	0	108.8	A712 K716	A712-N714 PolarHBondContact O-N 3.14Å; N714-K716 PolarHBondContact O-N 3.26Å
715	N	30.3	Very low	36.3	Very low	143.667 Å²	143.667	140.3 Å²	140.3	77%	0.768	74%	0.742	S	S	*	*			trans	-112.8	111.3	157.1	-86.4	-21.5	0	0	0	110.8	L713 Q717	L713-N715 PolarHBondContact O-N 3.29Å; N715-Q717 PolarHBondContact O-N 3.21Å
716	K	31.4	Very low	38.4	Very low	194.333 Å²	194.333	135.3 Å²	135.3	85%	0.845	72%	0.716	S	S	*	*			trans	-41.5	112.1	153.3	-69.2	-179.1	175.9	-179	0	110.4	N714 K718	N714-K716 PolarHBondContact O-N 3.26Å; K716-K718 VanDerWaalsContact C-N 3.29Å; K716-K718 PolarHBondContact O-N 3.2Å
717	Q	30.5	Very low	40.3	Very low	196 Å²	196	131 Å²	131	92%	0.916	69%	0.685	S	S	*	*			trans	-52.1	93.8	169.1	-76.6	166.2	-34.7	0	0	109.2	N715 N719	N715-Q717 PolarHBondContact O-N 3.21Å; Q717-N719 PolarHBondContact O-N 3.16Å
718	K	33.5	Very low	42.3	Very low	160 Å²	160	128.3 Å²	128.3	70%	0.696	67%	0.666	S	S	*	*			trans	-65	125.7	162.2	-81.2	-172.6	173.4	-169.9	0	106.2	E670 K716 C720	E670-K718 VanDerWaalsContact OE1-CE 3.29Å; E670-K718 WeakPolarHBondContact OE1-CE 3.38Å; E670-K718 IonicContact OE1-NZ 3.07Å; E670-K718 PolarHBondContact OE1-NZ 3.4Å; E670-K718 IonicContact OE2-NZ 3.3Å; E670-K718 PolarHBondContact OE2-NZ 2.8Å; K716-K718 VanDerWaalsContact C-N 3.29Å; K716-K718 PolarHBondContact O-N 3.2Å; K718-C720 VanDerWaalsContact C-N 3.27Å; K718-C720 PolarHBondContact O-N 3.27Å
719	N	34.5	Very low	44.2	Very low	156 Å²	156	125.1 Å²	125.1	83%	0.834	65%	0.654	S	S	*	*			trans	-56.8	87.4	174.9	-82	-27.5	0	0	0	109.9	Q717 K721	Q717-N719 PolarHBondContact O-N 3.16Å; N719-K721 PolarHBondContact O-N 3.25Å; N719-K721 VanDerWaalsContact O-N 3.12Å
720	C	36.4	Very low	46.1	Very low	114.667 Å²	114.667	122 Å²	122	78%	0.775	64%	0.635	S	S	*	*			trans	-67.2	93.7	168.5	-69.1	0	0	0	0	108.2	K718 K722	K718-C720 VanDerWaalsContact C-N 3.27Å; K718-C720 PolarHBondContact O-N 3.27Å; C720-K722 PolarHBondContact O-N 3.05Å; C720-K722 VanDerWaalsContact O-N 3.1Å
721	K	45.4	Very low	48.5	Very low	139.667 Å²	139.667	115.3 Å²	115.3	61%	0.607	60%	0.6	S	S	*	*			trans	-61.2	90	168.1	-73.3	-176.2	178.8	177.2	0	108.6	E665 N719 Y723	E665-K721 IonicContact OE2-NZ 3.8Å; E665-K721 PolarHBondContact OE2-NZ 3.29Å; N719-K721 PolarHBondContact O-N 3.25Å; N719-K721 VanDerWaalsContact O-N 3.12Å; K721-Y723 HydrophobicContact CB-CE2 4.1Å; K721-Y723 VanDerWaalsContact O-CD2 3.24Å; K721-Y723 WeakPolarHBondContact O-CD2 3.49Å; K721-Y723 PolarHBondContact O-N 2.89Å
722	K	53.2	Low	50.5	Low	156.667 Å²	156.667	113.3 Å²	113.3	68%	0.681	59%	0.593	S	S	*	*			trans	-69.5	76.3	-172.4	-107.2	178.9	178.9	-178.8	0	111	M660 C720 Q724	M660-K722 WeakPolarHBondContact CE-O 3.38Å; M660-K722 WeakPolarHBondContact O-CE 3.49Å; M660-K722 PolarHBondContact O-NZ 3.35Å; C720-K722 PolarHBondContact O-N 3.05Å; C720-K722 VanDerWaalsContact O-N 3.1Å; K722-Q724 PolarHBondContact O-N 3.19Å
723	Y	56.5	Low	52.7	Low	132.667 Å²	132.667	116.2 Å²	116.2	52%	0.52	59%	0.594	S	S	.	*			trans	-77.8	118.8	170.7	-57.5	-79.7	0	0	0	109.1	F335 M660 K721 C725	F335-Y723 HydrophobicContact CB-CD1 4.47Å; F335-Y723 AromaticContact CD1-CD1 3.81Å; F335-Y723 HydrophobicContact CD1-CD1 3.81Å; F335-Y723 HydrophobicContact CD1-CE1 4.3Å; F335-Y723 HydrophobicContact CG-CD1 4.49Å; M660-Y723 HydrophobicContact CB-CE1 4.36Å; M660-Y723 HydrophobicContact CG-CE1 4.26Å; K721-Y723 HydrophobicContact CB-CE2 4.1Å; K721-Y723 VanDerWaalsContact O-CD2 3.24Å; K721-Y723 WeakPolarHBondContact O-CD2 3.49Å; K721-Y723 PolarHBondContact O-N 2.89Å; Y723-C725 PolarHBondContact O-N 3.2Å; Y723-C725 VanDerWaalsContact O-N 3.11Å
724	Q	64.9	Low	55.2	Low	143.333 Å²	143.333	110.8 Å²	110.8	67%	0.67	57%	0.565	S	S	*	*	S	Bend	trans	-78	-2	173.7	-98.3	-175.6	20.9	0	0	109.9	F335 R336 P338 K722 N726	F335-Q724 PolarHBondContact O-N 2.71Å; F335-Q724 VanDerWaalsContact O-N 3.11Å; R336-Q724 WeakPolarHBondContact O-CG 3.33Å; R336-Q724 PolarHBondContact O-NE2 2.91Å; R336-Q724 PolarHBondContact O-OE1 2.95Å; P338-Q724 VanDerWaalsContact CD-OE1 3.24Å; K722-Q724 PolarHBondContact O-N 3.19Å; Q724-N726 PolarHBondContact O-N 3.33Å
725	C	66.5	Low	57.5	Low	28.3333 Å²	28.3333	105.6 Å²	105.6	19%	0.191	54%	0.539	C	S	.	.			trans	-111.9	136.5	177.5	146.7	0	0	0	0	109.5	R334 F335 S337 Y723 P727 S730	R334-C725 WeakPolarHBondContact O-CB 3.42Å; F335-C725 WeakPolarHBondContact CD1-O 3.11Å; F335-C725 PolarHBondContact O-N 2.99Å; S337-C725 VanDerWaalsContact O-CB 3.24Å; S337-C725 WeakPolarHBondContact O-CB 3.46Å; Y723-C725 PolarHBondContact O-N 3.2Å; Y723-C725 VanDerWaalsContact O-N 3.11Å; C725-P727 WeakPolarHBondContact O-CD 3.03Å; C725-S730 VanDerWaalsContact SG-CB 3.58Å; C725-S730 PolarHBondContact SG-OG 2.87Å; C725-S730 VanDerWaalsContact SG-OG 3.37Å
726	N	70.2	Confident	59.8	Low	55.6667 Å²	55.6667	102.8 Å²	102.8	30%	0.298	53%	0.531	S	S	.	.			trans	-97.2	104.1	165.4	-175.6	-20.6	0	0	0	107.2	M653 Q724 S728 I729 S730	M653-N726 WeakPolarHBondContact CE-OD1 3.46Å; Q724-N726 PolarHBondContact O-N 3.33Å; N726-S728 VanDerWaalsContact C-N 3.28Å; N726-S728 PolarHBondContact O-N 3.02Å; N726-S728 PolarHBondContact OD1-N 3.02Å; N726-S728 PolarHBondContact OD1-OG 3.36Å; N726-I729 HydrophobicContact CB-CB 4.39Å; N726-I729 HydrophobicContact CB-CD1 4.32Å; N726-I729 HydrophobicContact CB-CG1 4.44Å; N726-I729 WeakPolarHBondContact ND2-CD1 3.35Å; N726-I729 PolarHBondContact O-N 3.05Å; N726-S730 WeakPolarHBondContact O-CB 3.41Å; N726-S730 PolarHBondContact O-N 2.94Å; N726-S730 PolarHBondContact O-OG 3.08Å; N726-S730 VanDerWaalsContact O-OG 3.06Å
727	P	68.4	Low	62.4	Low	16 Å²	16	94.8 Å²	94.8	10%	0.104	50%	0.498	C	S	.	.	H	α-helix	trans	-57.7	-37	-173.9	-25.8	36.6	0	0	0	112.9	R334 F335 F632 C725 I729 S730 Y731	R334-P727 HydrophobicContact CB-CG 3.77Å; F335-P727 HydrophobicContact CD1-CG 4.33Å; F335-P727 HydrophobicContact CD2-CG 4.46Å; F335-P727 HydrophobicContact CE1-CG 4.15Å; F335-P727 HydrophobicContact CE2-CG 4.24Å; F335-P727 HydrophobicContact CG-CG 4.49Å; F335-P727 HydrophobicContact CZ-CG 4.09Å; F632-P727 HydrophobicContact CE2-CB 3.84Å; F632-P727 HydrophobicContact CZ-CB 3.66Å; F632-P727 HydrophobicContact CZ-CG 4.21Å; C725-P727 WeakPolarHBondContact O-CD 3.03Å; P727-I729 VanDerWaalsContact C-N 3.26Å; P727-I729 PolarHBondContact O-N 2.88Å; P727-I729 VanDerWaalsContact O-N 3.14Å; P727-S730 PolarHBondContact O-N 3.09Å; P727-Y731 HydrophobicContact CB-CD2 3.87Å; P727-Y731 HydrophobicContact CB-CE2 4.18Å; P727-Y731 WeakPolarHBondContact O-CB 3.22Å; P727-Y731 VanDerWaalsContact O-CD2 3.23Å; P727-Y731 WeakPolarHBondContact O-CD2 3.3Å; P727-Y731 PolarHBondContact O-N 3.23Å; P727-Y731 VanDerWaalsContact O-N 3.15Å
728	S	67.8	Low	65.2	Low	52.6667 Å²	52.6667	86.7 Å²	86.7	37%	0.368	46%	0.459	S	S	.	.	H	α-helix	trans	-66	-19.3	-179.1	-44.2	0	0	0	0	113.6	M653 N726 A732	M653-S728 WeakPolarHBondContact CE-OG 3.32Å; M653-S728 WeakPolarHBondContact CG-OG 3.13Å; N726-S728 VanDerWaalsContact C-N 3.28Å; N726-S728 PolarHBondContact O-N 3.02Å; N726-S728 PolarHBondContact OD1-N 3.02Å; N726-S728 PolarHBondContact OD1-OG 3.36Å; S728-A732 WeakPolarHBondContact O-CB 3.38Å
729	I	71	Confident	67.8	Low	118.333 Å²	118.333	80.6 Å²	80.6	61%	0.607	43%	0.432	S	S	*	.	H	α-helix	trans	-100.8	-47.6	176	-59	175.7	0	0	0	110.2	N726 P727 Y731 A732	N726-I729 HydrophobicContact CB-CB 4.39Å; N726-I729 HydrophobicContact CB-CD1 4.32Å; N726-I729 HydrophobicContact CB-CG1 4.44Å; N726-I729 WeakPolarHBondContact ND2-CD1 3.35Å; N726-I729 PolarHBondContact O-N 3.05Å; P727-I729 VanDerWaalsContact C-N 3.26Å; P727-I729 PolarHBondContact O-N 2.88Å; P727-I729 VanDerWaalsContact O-N 3.14Å; I729-Y731 VanDerWaalsContact C-N 3.27Å; I729-Y731 PolarHBondContact O-N 2.97Å; I729-A732 PolarHBondContact O-N 3.37Å
730	S	70.7	Confident	70.5	Confident	56.6667 Å²	56.6667	73.9 Å²	73.9	40%	0.396	40%	0.395	S	S	.	.	H	α-helix	trans	-65.4	-29.9	-174.8	-60.7	0	0	0	0	112.9	C725 N726 P727	C725-S730 VanDerWaalsContact SG-CB 3.58Å; C725-S730 PolarHBondContact SG-OG 2.87Å; C725-S730 VanDerWaalsContact SG-OG 3.37Å; N726-S730 WeakPolarHBondContact O-CB 3.41Å; N726-S730 PolarHBondContact O-N 2.94Å; N726-S730 PolarHBondContact O-OG 3.08Å; N726-S730 VanDerWaalsContact O-OG 3.06Å; P727-S730 PolarHBondContact O-N 3.09Å
731	Y	75.4	Confident	73	Confident	36.3333 Å²	36.3333	68.6 Å²	68.6	14%	0.142	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	11.9	-174	-52.1	-50.6	0	0	0	113.3	L340 A614 P727 I729 N733 E734	L340-Y731 PolarHBondContact N-OH 2.95Å; L340-Y731 VanDerWaalsContact N-OH 3.15Å; A614-Y731 HydrophobicContact CB-CD2 4.38Å; A614-Y731 HydrophobicContact CB-CE1 4.03Å; A614-Y731 HydrophobicContact CB-CE2 3.82Å; A614-Y731 VanDerWaalsContact CB-CZ 3.48Å; A614-Y731 WeakPolarHBondContact CB-OH 3.19Å; P727-Y731 HydrophobicContact CB-CD2 3.87Å; P727-Y731 HydrophobicContact CB-CE2 4.18Å; P727-Y731 WeakPolarHBondContact O-CB 3.22Å; P727-Y731 VanDerWaalsContact O-CD2 3.23Å; P727-Y731 WeakPolarHBondContact O-CD2 3.3Å; P727-Y731 PolarHBondContact O-N 3.23Å; P727-Y731 VanDerWaalsContact O-N 3.15Å; I729-Y731 VanDerWaalsContact C-N 3.27Å; I729-Y731 PolarHBondContact O-N 2.97Å; Y731-N733 VanDerWaalsContact C-N 3.28Å; Y731-N733 PolarHBondContact O-N 2.98Å; Y731-N733 VanDerWaalsContact O-N 3.09Å; Y731-E734 VanDerWaalsContact CB-OE1 3.27Å; Y731-E734 WeakPolarHBondContact CB-OE1 3.4Å; Y731-E734 HydrophobicContact CD1-CG 4.33Å; Y731-E734 WeakPolarHBondContact CD1-OE1 3.31Å; Y731-E734 VanDerWaalsContact CG-OE1 3.3Å; Y731-E734 WeakPolarHBondContact O-CB 3.46Å; Y731-E734 WeakPolarHBondContact O-CG 3.26Å; Y731-E734 PolarHBondContact O-N 3.33Å
732	A	70.5	Confident	75.1	Confident	66.6667 Å²	66.6667	62 Å²	62	55%	0.551	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-29.9	-175.4	0	0	0	0	0	114.4	S728 I729	S728-A732 WeakPolarHBondContact O-CB 3.38Å; I729-A732 PolarHBondContact O-N 3.37Å
733	N	73.8	Confident	76.9	Confident	162.667 Å²	162.667	55.8 Å²	55.8	87%	0.87	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	18.1	-175.1	-63.3	-39.3	0	0	0	112.8	Y731	Y731-N733 VanDerWaalsContact C-N 3.28Å; Y731-N733 PolarHBondContact O-N 2.98Å; Y731-N733 VanDerWaalsContact O-N 3.09Å
734	E	78.9	Confident	78.4	Confident	42.3333 Å²	42.3333	52.9 Å²	52.9	20%	0.198	30%	0.296	C	S	.	.			trans	-71	141.5	178.3	-68.7	-165.4	179.2	0	0	111.7	R616 Y731 Y738	R616-E734 IonicContact CZ-OE1 3.61Å; R616-E734 VanDerWaalsContact CZ-OE1 3.28Å; R616-E734 IonicContact CZ-OE2 3.07Å; R616-E734 IonicContact NE-OE1 3.42Å; R616-E734 PolarHBondContact NE-OE1 2.91Å; R616-E734 IonicContact NE-OE2 3.01Å; R616-E734 PolarHBondContact NE-OE2 3.36Å; R616-E734 VanDerWaalsContact NE-OE2 3.08Å; R616-E734 IonicContact NH1-OE1 2.68Å; R616-E734 IonicContact NH1-OE2 2.67Å; R616-E734 IonicContact NH2-OE1 3.51Å; R616-E734 PolarHBondContact NH2-OE1 3.05Å; R616-E734 IonicContact NH2-OE2 3.1Å; R616-E734 PolarHBondContact NH2-OE2 2.98Å; R616-E734 VanDerWaalsContact NH2-OE2 3.08Å; Y731-E734 VanDerWaalsContact CB-OE1 3.27Å; Y731-E734 WeakPolarHBondContact CB-OE1 3.4Å; Y731-E734 HydrophobicContact CD1-CG 4.33Å; Y731-E734 WeakPolarHBondContact CD1-OE1 3.31Å; Y731-E734 VanDerWaalsContact CG-OE1 3.3Å; Y731-E734 WeakPolarHBondContact O-CB 3.46Å; Y731-E734 WeakPolarHBondContact O-CG 3.26Å; Y731-E734 PolarHBondContact O-N 3.33Å; E734-Y738 HydrophobicContact CB-CE2 4.45Å; E734-Y738 WeakPolarHBondContact CG-OH 3.47Å; E734-Y738 PolarHBondContact OE1-OH 2.95Å; E734-Y738 PolarHBondContact OE2-OH 3.44Å
735	P	77.5	Confident	79.6	Confident	44.3333 Å²	44.3333	46.4 Å²	46.4	29%	0.288	27%	0.266	S	S	.	.			trans	-62	149.3	169	29.8	-35.3	0	0	0	110.1	P629 V737 Y738	P629-P735 WeakPolarHBondContact CG-O 3.31Å; P735-V737 PolarHBondContact O-N 3.12Å; P735-V737 VanDerWaalsContact O-N 3.08Å; P735-Y738 VanDerWaalsContact CD-OH 3.29Å; P735-Y738 WeakPolarHBondContact CD-OH 3.29Å; P735-Y738 HydrophobicContact CG-CD1 3.8Å; P735-Y738 HydrophobicContact CG-CD2 4Å; P735-Y738 HydrophobicContact CG-CE1 3.45Å; P735-Y738 VanDerWaalsContact CG-CE1 3.5Å; P735-Y738 HydrophobicContact CG-CE2 3.86Å; P735-Y738 HydrophobicContact CG-CG 4.15Å; P735-Y738 VanDerWaalsContact CG-CZ 3.48Å
736	C	79.1	Confident	80.8	Confident	86.3333 Å²	86.3333	45.1 Å²	45.1	58%	0.583	26%	0.256	S	S	*	.	S	Bend	trans	-58.7	-21.7	178	23.5	0	0	0	0	114.3	E354 P629	E354-C736 VanDerWaalsContact CA-SG 3.54Å; P629-C736 WeakPolarHBondContact CD-O 3.45Å; P629-C736 WeakPolarHBondContact CG-O 3.44Å
737	V	86.1	Confident	81.8	Confident	26.3333 Å²	26.3333	45.8 Å²	45.8	16%	0.16	26%	0.259	C	S	.	.			trans	-157.1	142.6	174.9	96.9	0	0	0	0	109.4	R353 I356 L357 I626 I627 P735	R353-V737 HydrophobicContact CB-CG1 4.27Å; R353-V737 WeakPolarHBondContact O-CG1 3.24Å; I356-V737 HydrophobicContact CB-CG1 4.11Å; I356-V737 HydrophobicContact CD1-CG1 4.25Å; L357-V737 HydrophobicContact CD1-CB 4.43Å; L357-V737 HydrophobicContact CD1-CG2 4.33Å; L357-V737 HydrophobicContact CD2-CG2 4Å; L357-V737 HydrophobicContact CG-CB 4.38Å; L357-V737 HydrophobicContact CG-CG2 4.01Å; I626-V737 HydrophobicContact CG2-CG1 3.36Å; I626-V737 HydrophobicContact CG2-CG2 3.53Å; I626-V737 VanDerWaalsContact CG2-CG2 3.5Å; I627-V737 CarbonylContact O-C 3.56Å; I627-V737 WeakPolarHBondContact O-CA 3.24Å; P735-V737 PolarHBondContact O-N 3.12Å; P735-V737 VanDerWaalsContact O-N 3.08Å
738	Y	88.3	Confident	82.7	Confident	25.6667 Å²	25.6667	46.8 Å²	46.8	10%	0.101	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	142.4	166.1	-53.4	-103.4	0	0	0	109.8	L342 I626 I627 P629 E734 P735	L342-Y738 HydrophobicContact CB-CD1 4.36Å; L342-Y738 HydrophobicContact CB-CE1 4.05Å; L342-Y738 HydrophobicContact CD1-CD2 4.2Å; L342-Y738 HydrophobicContact CD1-CE2 4.21Å; L342-Y738 HydrophobicContact CD1-CG 4.36Å; I626-Y738 CarbonylContact C-O 3.49Å; I626-Y738 WeakPolarHBondContact CA-O 3.41Å; I627-Y738 HydrophobicContact CB-CD2 4.29Å; I627-Y738 HydrophobicContact CB-CG 4.47Å; I627-Y738 HydrophobicContact CG2-CD2 4.27Å; I627-Y738 PolarHBondContact N-O 3.1Å; I627-Y738 PolarHBondContact O-N 3.23Å; P629-Y738 HydrophobicContact CG-CD2 4.21Å; P629-Y738 HydrophobicContact CG-CE2 3.92Å; E734-Y738 HydrophobicContact CB-CE2 4.45Å; E734-Y738 WeakPolarHBondContact CG-OH 3.47Å; E734-Y738 PolarHBondContact OE1-OH 2.95Å; E734-Y738 PolarHBondContact OE2-OH 3.44Å; P735-Y738 VanDerWaalsContact CD-OH 3.29Å; P735-Y738 WeakPolarHBondContact CD-OH 3.29Å; P735-Y738 HydrophobicContact CG-CD1 3.8Å; P735-Y738 HydrophobicContact CG-CD2 4Å; P735-Y738 HydrophobicContact CG-CE1 3.45Å; P735-Y738 VanDerWaalsContact CG-CE1 3.5Å; P735-Y738 HydrophobicContact CG-CE2 3.86Å; P735-Y738 HydrophobicContact CG-CG 4.15Å; P735-Y738 VanDerWaalsContact CG-CZ 3.48Å
739	Y	89.6	Confident	83.8	Confident	30.6667 Å²	30.6667	44.5 Å²	44.5	12%	0.12	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	141.6	172.8	100.9	-88	0	0	0	111.3	S345 A346 N347 D348 L349 I356 R624 L625 I626 R957	S345-Y739 VanDerWaalsContact OG-CD1 3.23Å; S345-Y739 WeakPolarHBondContact OG-CD1 2.9Å; S345-Y739 PolarHBondContact OG-N 3.49Å; S345-Y739 PolarHBondContact OG-O 3.43Å; A346-Y739 VanDerWaalsContact C-CZ 3.44Å; A346-Y739 HydrophobicContact CB-CD2 3.89Å; A346-Y739 HydrophobicContact CB-CE2 3.62Å; A346-Y739 WeakPolarHBondContact CB-O 3.47Å; A346-Y739 PolarHBondContact N-O 2.81Å; A346-Y739 WeakPolarHBondContact O-CE1 3.44Å; A346-Y739 PolarHBondContact O-OH 3.17Å; A346-Y739 VanDerWaalsContact O-OH 3.08Å; N347-Y739 VanDerWaalsContact C-OH 3.28Å; N347-Y739 WeakPolarHBondContact CA-OH 3.14Å; N347-Y739 PolarHBondContact N-OH 3Å; D348-Y739 PolarHBondContact N-OH 3.39Å; D348-Y739 WeakPolarHBondContact OD1-CE2 3.14Å; L349-Y739 HydrophobicContact CB-CE2 4.29Å; L349-Y739 HydrophobicContact CD1-CD2 4.09Å; L349-Y739 HydrophobicContact CD1-CE1 4.41Å; L349-Y739 HydrophobicContact CD1-CE2 3.78Å; L349-Y739 HydrophobicContact CG-CD2 4.49Å; L349-Y739 HydrophobicContact CG-CE2 3.78Å; L349-Y739 PolarHBondContact N-OH 3.28Å; I356-Y739 HydrophobicContact CD1-CD1 3.57Å; I356-Y739 HydrophobicContact CD1-CE1 3.38Å; R624-Y739 HydrophobicContact CB-CE2 3.92Å; R624-Y739 VanDerWaalsContact CD-OH 3.25Å; R624-Y739 WeakPolarHBondContact CD-OH 3.49Å; R624-Y739 HydrophobicContact CG-CE2 3.78Å; R624-Y739 PolarHBondContact NE-OH 3.23Å; L625-Y739 CarbonylContact O-C 3.54Å; L625-Y739 VanDerWaalsContact O-CA 3.26Å; L625-Y739 WeakPolarHBondContact O-CA 3.38Å; I626-Y739 VanDerWaalsContact CD1-CB 3.45Å; I626-Y739 HydrophobicContact CG1-CD2 4.4Å; Y739-R957 PolarHBondContact OH-NH2 3.23Å
740	Y	90.8	Very high	84.8	Confident	16.6667 Å²	16.6667	40.9 Å²	40.9	7%	0.065	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.5	179.4	-54.1	-82	0	0	0	111	P343 R624 L625 I627 Q745 I749 M776 F833	P343-Y740 HydrophobicContact CG-CE1 3.9Å; P343-Y740 PolarHBondContact O-OH 2.95Å; R624-Y740 WeakPolarHBondContact CA-O 3.27Å; L625-Y740 HydrophobicContact CD2-CD2 4.31Å; L625-Y740 HydrophobicContact CG-CD2 4.5Å; L625-Y740 PolarHBondContact N-O 2.91Å; L625-Y740 VanDerWaalsContact N-O 3.08Å; L625-Y740 PolarHBondContact O-N 2.91Å; I627-Y740 HydrophobicContact CD1-CD2 4.27Å; I627-Y740 HydrophobicContact CD1-CE2 3.61Å; I627-Y740 HydrophobicContact CG1-CD2 4.4Å; I627-Y740 HydrophobicContact CG1-CE2 4.26Å; Y740-Q745 HydrophobicContact CD1-CB 3.8Å; Y740-Q745 HydrophobicContact CD1-CG 4.19Å; Y740-Q745 HydrophobicContact CG-CB 4.25Å; Y740-I749 HydrophobicContact CD1-CD1 3.8Å; Y740-I749 HydrophobicContact CD2-CD1 3.61Å; Y740-I749 VanDerWaalsContact CD2-CD1 3.46Å; Y740-I749 HydrophobicContact CD2-CG1 4.09Å; Y740-I749 HydrophobicContact CE1-CD1 3.96Å; Y740-I749 HydrophobicContact CE1-CG1 4.45Å; Y740-I749 HydrophobicContact CE2-CD1 3.39Å; Y740-I749 VanDerWaalsContact CE2-CD1 3.44Å; Y740-I749 HydrophobicContact CE2-CG1 4.08Å; Y740-I749 HydrophobicContact CG-CD1 3.53Å; Y740-I749 VanDerWaalsContact CG-CD1 3.45Å; Y740-M776 WeakPolarHBondContact O-CE 3.37Å; Y740-F833 HydrophobicContact CE1-CZ 4.48Å
741	S	88.7	Confident	85.7	Confident	1.66667 Å²	1.66667	44.8 Å²	44.8	1%	0.012	24%	0.236	C	C	.	.			trans	-115.9	-14.6	-166.3	-27.3	0	0	0	0	113.1	A346 D348 R624 Q745 L826 E829	A346-S741 VanDerWaalsContact CB-OG 3.3Å; A346-S741 WeakPolarHBondContact CB-OG 3.36Å; D348-S741 VanDerWaalsContact OD1-CB 3.28Å; D348-S741 WeakPolarHBondContact OD1-CB 3.34Å; D348-S741 PolarHBondContact OD1-OG 3.2Å; R624-S741 WeakPolarHBondContact CD-OG 3.44Å; R624-S741 VanDerWaalsContact CZ-OG 3.27Å; R624-S741 PolarHBondContact NE-OG 3.5Å; R624-S741 PolarHBondContact NH1-OG 3.43Å; S741-Q745 VanDerWaalsContact N-OE1 3.08Å; S741-L826 WeakPolarHBondContact OG-CD2 3.43Å; S741-E829 WeakPolarHBondContact CB-OE2 3.07Å; S741-E829 PolarHBondContact OG-OE2 2.79Å
742	S	88.4	Confident	86.3	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.021	25%	0.25	C	C	.	.	S	Bend	trans	-117.8	148.6	-178.1	96.1	0	0	0	0	112	E744 Q745 V746 R830	S742-E744 VanDerWaalsContact C-N 3.28Å; S742-E744 WeakPolarHBondContact CB-OE2 3.34Å; S742-E744 PolarHBondContact O-N 3.09Å; S742-E744 PolarHBondContact OG-OE2 3.07Å; S742-Q745 VanDerWaalsContact N-OE1 3.11Å; S742-Q745 WeakPolarHBondContact O-CB 3.44Å; S742-Q745 PolarHBondContact O-N 3.06Å; S742-Q745 WeakPolarHBondContact OG-CG 3.31Å; S742-Q745 PolarHBondContact OG-N 3.27Å; S742-Q745 PolarHBondContact OG-OE1 3.38Å; S742-V746 PolarHBondContact O-N 3.15Å; S742-R830 PolarHBondContact OG-NE 2.96Å; S742-R830 PolarHBondContact OG-NH2 2.7Å
743	I	91.2	Very high	87.3	Confident	24.6667 Å²	24.6667	44.1 Å²	44.1	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-66.6	-30.3	-179.6	-170.9	59.1	0	0	0	111.8	Q745 V746 M747 L769 M772 R773 M776	I743-Q745 VanDerWaalsContact C-N 3.31Å; I743-Q745 PolarHBondContact O-N 2.97Å; I743-V746 HydrophobicContact CD1-CB 4.4Å; I743-V746 PolarHBondContact O-N 3.17Å; I743-M747 HydrophobicContact CG1-CG 4.32Å; I743-M747 WeakPolarHBondContact O-CG 3.33Å; I743-M747 PolarHBondContact O-N 3.35Å; I743-L769 HydrophobicContact CD1-CD2 4.36Å; I743-M772 HydrophobicContact CD1-CB 4.19Å; I743-R773 HydrophobicContact CD1-CB 4.12Å; I743-R773 HydrophobicContact CG1-CB 4.1Å; I743-R773 HydrophobicContact CG1-CG 4.33Å; I743-M776 HydrophobicContact CB-SD 4.35Å; I743-M776 PolarHBondContact N-SD 3.08Å
744	E	88.7	Confident	87.9	Confident	71.6667 Å²	71.6667	38 Å²	38	34%	0.335	20%	0.195	S	C	.	.	H	α-helix	trans	-63.2	-41.4	176.4	-62	78.4	-169.5	0	0	111.5	S742 M747 H748 R830 F833	S742-E744 VanDerWaalsContact C-N 3.28Å; S742-E744 WeakPolarHBondContact CB-OE2 3.34Å; S742-E744 PolarHBondContact O-N 3.09Å; S742-E744 PolarHBondContact OG-OE2 3.07Å; E744-M747 PolarHBondContact O-N 3.02Å; E744-H748 PolarHBondContact O-N 2.89Å; E744-H748 VanDerWaalsContact O-N 3.09Å; E744-R830 IonicContact OE1-CZ 2.96Å; E744-R830 IonicContact OE1-NE 3.31Å; E744-R830 IonicContact OE1-NH2 2.82Å; E744-R830 PolarHBondContact OE1-NH2 3.17Å; E744-R830 IonicContact OE2-CZ 2.81Å; E744-R830 IonicContact OE2-NE 3.46Å; E744-R830 PolarHBondContact OE2-NE 3.38Å; E744-R830 IonicContact OE2-NH2 3.42Å; E744-R830 PolarHBondContact OE2-NH2 3.41Å; E744-F833 HydrophobicContact CB-CD1 4.33Å; E744-F833 HydrophobicContact CB-CE1 4.36Å
745	Q	89.5	Confident	88.2	Confident	8.66667 Å²	8.66667	40.2 Å²	40.2	4%	0.04	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-44.8	174.2	-70.7	165.9	-29.9	0	0	111.1	Y740 S741 S742 I743 M747 H748 I749 F833	Y740-Q745 HydrophobicContact CD1-CB 3.8Å; Y740-Q745 HydrophobicContact CD1-CG 4.19Å; Y740-Q745 HydrophobicContact CG-CB 4.25Å; S741-Q745 VanDerWaalsContact N-OE1 3.08Å; S742-Q745 VanDerWaalsContact N-OE1 3.11Å; S742-Q745 WeakPolarHBondContact O-CB 3.44Å; S742-Q745 PolarHBondContact O-N 3.06Å; S742-Q745 WeakPolarHBondContact OG-CG 3.31Å; S742-Q745 PolarHBondContact OG-N 3.27Å; S742-Q745 PolarHBondContact OG-OE1 3.38Å; I743-Q745 VanDerWaalsContact C-N 3.31Å; I743-Q745 PolarHBondContact O-N 2.97Å; Q745-M747 VanDerWaalsContact C-N 3.33Å; Q745-M747 PolarHBondContact O-N 3.08Å; Q745-H748 WeakPolarHBondContact O-CB 3.39Å; Q745-H748 PolarHBondContact O-N 3.13Å; Q745-I749 WeakPolarHBondContact O-CG1 3.37Å; Q745-I749 PolarHBondContact O-N 2.84Å; Q745-F833 HydrophobicContact CB-CD2 4.42Å; Q745-F833 HydrophobicContact CB-CE2 4.42Å; Q745-F833 HydrophobicContact CG-CB 4.24Å; Q745-F833 HydrophobicContact CG-CD1 4.04Å; Q745-F833 HydrophobicContact CG-CD2 3.9Å; Q745-F833 HydrophobicContact CG-CE1 4.01Å; Q745-F833 HydrophobicContact CG-CE2 3.88Å; Q745-F833 HydrophobicContact CG-CG 3.72Å; Q745-F833 HydrophobicContact CG-CZ 3.82Å; Q745-F833 VanDerWaalsContact NE2-CE2 3.34Å
746	V	91.4	Very high	88.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.7	-40.9	178.8	176.8	0	0	0	0	111.7	L625 S742 I743 H748 I749 R750 L765 L769 M772 M776	L625-V746 HydrophobicContact CB-CG2 4.12Å; L625-V746 HydrophobicContact CD2-CG1 4.4Å; L625-V746 HydrophobicContact CD2-CG2 4.19Å; S742-V746 PolarHBondContact O-N 3.15Å; I743-V746 HydrophobicContact CD1-CB 4.4Å; I743-V746 PolarHBondContact O-N 3.17Å; V746-H748 VanDerWaalsContact C-N 3.31Å; V746-H748 PolarHBondContact O-N 2.96Å; V746-I749 PolarHBondContact O-N 3.18Å; V746-R750 WeakPolarHBondContact O-CB 3.47Å; V746-R750 PolarHBondContact O-N 2.94Å; V746-L765 HydrophobicContact CG1-CD1 4.35Å; V746-L769 HydrophobicContact CG1-CD2 3.73Å; V746-M772 HydrophobicContact CG1-SD 3.88Å; V746-M776 HydrophobicContact CG2-CE 3.57Å; V746-M776 VanDerWaalsContact CG2-CE 3.5Å; V746-M776 HydrophobicContact CG2-SD 3.88Å
747	M	91.1	Very high	88.6	Confident	70.6667 Å²	70.6667	45 Å²	45	35%	0.348	22%	0.218	S	C	.	.	H	α-helix	trans	-61.9	-39.4	176.8	-69.3	-119.5	62.8	0	0	111.3	I743 E744 Q745 R750 E751 L769	I743-M747 HydrophobicContact CG1-CG 4.32Å; I743-M747 WeakPolarHBondContact O-CG 3.33Å; I743-M747 PolarHBondContact O-N 3.35Å; E744-M747 PolarHBondContact O-N 3.02Å; Q745-M747 VanDerWaalsContact C-N 3.33Å; Q745-M747 PolarHBondContact O-N 3.08Å; M747-R750 HydrophobicContact CE-CB 4.46Å; M747-R750 WeakPolarHBondContact O-CB 3.42Å; M747-R750 PolarHBondContact O-N 3.21Å; M747-E751 WeakPolarHBondContact O-CG 3.37Å; M747-E751 PolarHBondContact O-N 3.05Å; M747-L769 HydrophobicContact CE-CD1 3.54Å; M747-L769 VanDerWaalsContact CE-CD1 3.45Å; M747-L769 HydrophobicContact CE-CD2 4.02Å; M747-L769 HydrophobicContact CE-CG 4.31Å
748	H	88.1	Confident	88.6	Confident	37 Å²	37	44 Å²	44	17%	0.171	21%	0.211	C	C	.	.	H	α-helix	trans	-67.9	-41.3	176.1	-174.2	55	0	0	0	113.2	E744 Q745 V746 R750 E751 L752 F833	E744-H748 PolarHBondContact O-N 2.89Å; E744-H748 VanDerWaalsContact O-N 3.09Å; Q745-H748 WeakPolarHBondContact O-CB 3.39Å; Q745-H748 PolarHBondContact O-N 3.13Å; V746-H748 VanDerWaalsContact C-N 3.31Å; V746-H748 PolarHBondContact O-N 2.96Å; H748-R750 VanDerWaalsContact C-N 3.28Å; H748-R750 PolarHBondContact O-N 3.23Å; H748-E751 IonicContact ND1-OE2 3.26Å; H748-E751 PolarHBondContact ND1-OE2 2.91Å; H748-E751 WeakPolarHBondContact O-CB 3.31Å; H748-E751 PolarHBondContact O-N 2.95Å; H748-E751 VanDerWaalsContact O-N 3.12Å; H748-L752 WeakPolarHBondContact O-CG 3.36Å; H748-L752 PolarHBondContact O-N 3.34Å; H748-L752 VanDerWaalsContact O-N 3.11Å; H748-F833 HydrophobicContact CB-CE1 4.25Å; H748-F833 HydrophobicContact CB-CE2 3.89Å; H748-F833 HydrophobicContact CB-CZ 3.29Å; H748-F833 AromaticContact CD2-CE2 3.59Å; H748-F833 AromaticContact CD2-CZ 3.7Å; H748-F833 AromaticContact CG-CE2 3.62Å; H748-F833 AromaticContact CG-CZ 3.47Å
749	I	91.1	Very high	88.4	Confident	3.33333 Å²	3.33333	44.6 Å²	44.6	2%	0.017	22%	0.218	C	C	.	.	H	α-helix	trans	-57.7	-43.1	172.3	-66.5	-169	0	0	0	109.9	L342 P343 Y618 L625 I627 Y740 Q745 V746 E751 L752 L753	L342-I749 HydrophobicContact CD2-CD1 3.88Å; P343-I749 HydrophobicContact CG-CD1 3.66Å; P343-I749 HydrophobicContact CG-CG1 4.37Å; Y618-I749 HydrophobicContact CE1-CG2 3.89Å; L625-I749 HydrophobicContact CD2-CD1 3.8Å; L625-I749 HydrophobicContact CD2-CG2 4.29Å; I627-I749 HydrophobicContact CD1-CD1 4.37Å; I627-I749 HydrophobicContact CD1-CG2 4.49Å; Y740-I749 HydrophobicContact CD1-CD1 3.8Å; Y740-I749 HydrophobicContact CD2-CD1 3.61Å; Y740-I749 VanDerWaalsContact CD2-CD1 3.46Å; Y740-I749 HydrophobicContact CD2-CG1 4.09Å; Y740-I749 HydrophobicContact CE1-CD1 3.96Å; Y740-I749 HydrophobicContact CE1-CG1 4.45Å; Y740-I749 HydrophobicContact CE2-CD1 3.39Å; Y740-I749 VanDerWaalsContact CE2-CD1 3.44Å; Y740-I749 HydrophobicContact CE2-CG1 4.08Å; Y740-I749 HydrophobicContact CG-CD1 3.53Å; Y740-I749 VanDerWaalsContact CG-CD1 3.45Å; Q745-I749 WeakPolarHBondContact O-CG1 3.37Å; Q745-I749 PolarHBondContact O-N 2.84Å; V746-I749 PolarHBondContact O-N 3.18Å; I749-E751 VanDerWaalsContact C-N 3.28Å; I749-E751 PolarHBondContact O-N 3.14Å; I749-L752 PolarHBondContact O-N 3.15Å; I749-L752 VanDerWaalsContact O-N 3.1Å; I749-L753 HydrophobicContact CG2-CD1 4.32Å; I749-L753 WeakPolarHBondContact O-CG 3.41Å; I749-L753 PolarHBondContact O-N 3.21Å; I749-L753 VanDerWaalsContact O-N 3.15Å
750	R	91.4	Very high	88.2	Confident	44 Å²	44	49.1 Å²	49.1	17%	0.166	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-33	176.8	178.8	59.8	-172	94.2	-3.6	113.1	V746 M747 H748 C762 L765 D766	V746-R750 WeakPolarHBondContact O-CB 3.47Å; V746-R750 PolarHBondContact O-N 2.94Å; M747-R750 HydrophobicContact CE-CB 4.46Å; M747-R750 WeakPolarHBondContact O-CB 3.42Å; M747-R750 PolarHBondContact O-N 3.21Å; H748-R750 VanDerWaalsContact C-N 3.28Å; H748-R750 PolarHBondContact O-N 3.23Å; R750-C762 PolarHBondContact NH1-SG 3.17Å; R750-C762 VanDerWaalsContact NH1-SG 3.42Å; R750-L765 HydrophobicContact CB-CD2 4.06Å; R750-L765 HydrophobicContact CG-CD2 4.48Å; R750-D766 WeakPolarHBondContact CD-OD1 3.33Å; R750-D766 IonicContact CZ-OD1 3.31Å; R750-D766 IonicContact CZ-OD2 3.19Å; R750-D766 VanDerWaalsContact NE-CG 3.26Å; R750-D766 IonicContact NE-OD1 3.4Å; R750-D766 PolarHBondContact NE-OD1 3.13Å; R750-D766 IonicContact NE-OD2 3.8Å; R750-D766 PolarHBondContact NE-OD2 3.07Å; R750-D766 VanDerWaalsContact NE-OD2 3.14Å; R750-D766 IonicContact NH2-OD1 3.74Å; R750-D766 IonicContact NH2-OD2 3.59Å; R750-D766 PolarHBondContact NH2-OD2 3.05Å
751	E	89.9	Confident	88.1	Confident	138.333 Å²	138.333	48.4 Å²	48.4	65%	0.646	23%	0.232	S	C	*	.	H	α-helix	trans	-69.4	-30.6	174	-70.1	170.9	173.5	0	0	112.9	M747 H748 I749	M747-E751 WeakPolarHBondContact O-CG 3.37Å; M747-E751 PolarHBondContact O-N 3.05Å; H748-E751 IonicContact ND1-OE2 3.26Å; H748-E751 PolarHBondContact ND1-OE2 2.91Å; H748-E751 WeakPolarHBondContact O-CB 3.31Å; H748-E751 PolarHBondContact O-N 2.95Å; H748-E751 VanDerWaalsContact O-N 3.12Å; I749-E751 VanDerWaalsContact C-N 3.28Å; I749-E751 PolarHBondContact O-N 3.14Å
752	L	89	Confident	88.3	Confident	80.3333 Å²	80.3333	48.4 Å²	48.4	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-78.8	-28.8	178.8	-64.5	173.6	0	0	0	112.9	L340 H748 I749	L340-L752 HydrophobicContact CD1-CB 4.02Å; H748-L752 WeakPolarHBondContact O-CG 3.36Å; H748-L752 PolarHBondContact O-N 3.34Å; H748-L752 VanDerWaalsContact O-N 3.11Å; I749-L752 PolarHBondContact O-N 3.15Å; I749-L752 VanDerWaalsContact O-N 3.1Å
753	L	90.3	Very high	88.3	Confident	8.66667 Å²	8.66667	53.4 Å²	53.4	5%	0.045	25%	0.252	C	S	.	.	S	Bend	trans	-72.9	134.9	176.7	-64.4	174.2	0	0	0	110.8	L340 D612 Y618 I749 E758 L761 L765	L340-L753 HydrophobicContact CD2-CD2 3.88Å; D612-L753 HydrophobicContact CB-CD2 4.22Å; Y618-L753 HydrophobicContact CE1-CD1 4.37Å; I749-L753 HydrophobicContact CG2-CD1 4.32Å; I749-L753 WeakPolarHBondContact O-CG 3.41Å; I749-L753 PolarHBondContact O-N 3.21Å; I749-L753 VanDerWaalsContact O-N 3.15Å; L753-E758 WeakPolarHBondContact CA-OE2 3.15Å; L753-E758 HydrophobicContact CD2-CG 4.42Å; L753-E758 WeakPolarHBondContact CD2-OE2 3.37Å; L753-L761 HydrophobicContact CD1-CD2 3.81Å; L753-L761 HydrophobicContact CD1-CG 4.04Å; L753-L761 HydrophobicContact CD2-CD2 3.91Å; L753-L761 HydrophobicContact CG-CD2 4.43Å; L753-L765 HydrophobicContact CD1-CD2 3.88Å
754	S	86	Confident	88.3	Confident	32.6667 Å²	32.6667	55.4 Å²	55.4	23%	0.228	26%	0.257	C	S	.	.			trans	-102.3	136	178.2	139.2	0	0	0	0	111.4	R613 E756 W757 E758	R613-S754 VanDerWaalsContact NH2-N 3.13Å; R613-S754 PolarHBondContact NH2-OG 3.42Å; S754-E756 PolarHBondContact O-N 3.15Å; S754-E756 VanDerWaalsContact O-N 3.14Å; S754-E756 PolarHBondContact OG-N 2.88Å; S754-W757 PolarHBondContact O-N 3.08Å; S754-E758 PolarHBondContact N-OE2 3.23Å; S754-E758 WeakPolarHBondContact O-CA 3.42Å; S754-E758 WeakPolarHBondContact O-CB 3.45Å; S754-E758 PolarHBondContact O-N 3Å
755	T	85.1	Confident	88.5	Confident	89 Å²	89	52 Å²	52	55%	0.546	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-14.2	177.5	51.3	0	0	0	0	113.1	P759 C762	T755-P759 WeakPolarHBondContact O-CB 3.36Å; T755-P759 WeakPolarHBondContact O-CD 3.47Å; T755-C762 HydrophobicContact CG2-CB 4.27Å
756	E	82.1	Confident	88.7	Confident	133.667 Å²	133.667	54.6 Å²	54.6	63%	0.625	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-44.3	176	-62.4	178.8	166.7	0	0	111.1	H321 S754	H321-E756 PolarHBondContact CE1-O 2.87Å; S754-E756 PolarHBondContact O-N 3.15Å; S754-E756 VanDerWaalsContact O-N 3.14Å; S754-E756 PolarHBondContact OG-N 2.88Å
757	W	83.4	Confident	88.7	Confident	98.6667 Å²	98.6667	57.3 Å²	57.3	37%	0.374	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-22.5	-174.6	-56.9	91.2	0	0	0	113.6	M325 L333 S337 R613 S754 P759	M325-W757 VanDerWaalsContact SD-C 3.52Å; L333-W757 HydrophobicContact CD1-CE3 3.82Å; L333-W757 HydrophobicContact CD1-CZ3 4.19Å; S337-W757 VanDerWaalsContact CB-CE3 3.48Å; R613-W757 HydrophobicContact CB-CB 4.19Å; R613-W757 VanDerWaalsContact CZ-CB 3.48Å; R613-W757 VanDerWaalsContact CZ-CG 3.48Å; R613-W757 VanDerWaalsContact NH2-CD1 3.31Å; S754-W757 PolarHBondContact O-N 3.08Å; W757-P759 VanDerWaalsContact C-CD 3.47Å; W757-P759 WeakPolarHBondContact O-CD 3.31Å
758	E	86.4	Confident	88.7	Confident	5.66667 Å²	5.66667	56.1 Å²	56.1	3%	0.026	27%	0.273	C	S	.	.			trans	-132.2	47.2	-179.3	-57.3	110.8	169.5	0	0	113.1	D612 R613 L753 S754 W760 L761 C762	D612-E758 HydrophobicContact CB-CG 4.17Å; D612-E758 WeakPolarHBondContact CB-OE1 3.18Å; R613-E758 HydrophobicContact CB-CG 4.48Å; R613-E758 WeakPolarHBondContact CB-OE1 3.32Å; R613-E758 WeakPolarHBondContact CD-OE1 3.23Å; R613-E758 WeakPolarHBondContact CG-OE1 3.37Å; R613-E758 IonicContact CZ-OE1 3.22Å; R613-E758 IonicContact CZ-OE2 3.29Å; R613-E758 PolarHBondContact N-OE1 3.24Å; R613-E758 IonicContact NE-OE1 3.43Å; R613-E758 PolarHBondContact NE-OE1 2.95Å; R613-E758 IonicContact NE-OE2 3.38Å; R613-E758 PolarHBondContact NE-OE2 3.24Å; R613-E758 IonicContact NH2-OE1 3.42Å; R613-E758 IonicContact NH2-OE2 3.31Å; R613-E758 PolarHBondContact NH2-OE2 3.11Å; L753-E758 WeakPolarHBondContact CA-OE2 3.15Å; L753-E758 HydrophobicContact CD2-CG 4.42Å; L753-E758 WeakPolarHBondContact CD2-OE2 3.37Å; S754-E758 PolarHBondContact N-OE2 3.23Å; S754-E758 WeakPolarHBondContact O-CA 3.42Å; S754-E758 WeakPolarHBondContact O-CB 3.45Å; S754-E758 PolarHBondContact O-N 3Å; E758-W760 VanDerWaalsContact C-N 3.3Å; E758-W760 PolarHBondContact O-N 3.08Å; E758-W760 VanDerWaalsContact O-N 3.12Å; E758-L761 HydrophobicContact CB-CB 4.13Å; E758-L761 HydrophobicContact CB-CD2 4.42Å; E758-L761 HydrophobicContact CG-CD2 4.47Å; E758-L761 PolarHBondContact O-N 3.16Å; E758-C762 WeakPolarHBondContact O-CB 3.42Å; E758-C762 PolarHBondContact O-N 3.25Å; E758-C762 PolarHBondContact O-SG 3.29Å; E758-C762 VanDerWaalsContact O-SG 3.4Å
759	P	85.3	Confident	88.9	Confident	38 Å²	38	55.4 Å²	55.4	25%	0.247	27%	0.27	C	S	.	.	H	α-helix	trans	-55.9	-41.1	-174.4	21.4	-32.5	0	0	0	112.6	T322 M325 T755 W757 Y763	T322-P759 HydrophobicContact CG2-CB 4.39Å; T322-P759 HydrophobicContact CG2-CG 3.85Å; M325-P759 HydrophobicContact CE-CG 3.66Å; M325-P759 WeakPolarHBondContact SD-CD 3.33Å; M325-P759 HydrophobicContact SD-CG 3.91Å; T755-P759 WeakPolarHBondContact O-CB 3.36Å; T755-P759 WeakPolarHBondContact O-CD 3.47Å; W757-P759 VanDerWaalsContact C-CD 3.47Å; W757-P759 WeakPolarHBondContact O-CD 3.31Å; P759-Y763 VanDerWaalsContact O-CB 3.25Å; P759-Y763 WeakPolarHBondContact O-CB 3.39Å; P759-Y763 PolarHBondContact O-N 3.4Å
760	W	84	Confident	89	Confident	124.667 Å²	124.667	59 Å²	59	47%	0.472	29%	0.294	S	S	.	.	H	α-helix	trans	-71	-42	-177.5	-129.1	88.5	0	0	0	113.1	I609 E758 Y763 R764	I609-W760 WeakPolarHBondContact O-CZ3 3.36Å; E758-W760 VanDerWaalsContact C-N 3.3Å; E758-W760 PolarHBondContact O-N 3.08Å; E758-W760 VanDerWaalsContact O-N 3.12Å; W760-Y763 PolarHBondContact O-N 3.44Å; W760-R764 HydrophobicContact CD2-CG 4.42Å; W760-R764 HydrophobicContact CE3-CG 4.26Å; W760-R764 VanDerWaalsContact CH2-CD 3.47Å; W760-R764 HydrophobicContact CZ2-CG 4.47Å; W760-R764 HydrophobicContact CZ3-CG 4.34Å; W760-R764 VanDerWaalsContact CZ3-NH1 3.31Å; W760-R764 WeakPolarHBondContact O-CB 3.39Å; W760-R764 PolarHBondContact O-N 3.39Å
761	L	89.8	Confident	89	Confident	2.66667 Å²	2.66667	60.1 Å²	60.1	1%	0.014	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-46.4	175.6	175.8	61.9	0	0	0	110.2	I609 D612 Y618 L753 E758 Y763 R764 L765	I609-L761 HydrophobicContact CB-CD1 4.21Å; I609-L761 HydrophobicContact CG2-CD1 3.91Å; D612-L761 HydrophobicContact CB-CD2 4.01Å; Y618-L761 HydrophobicContact CD1-CD1 4.14Å; Y618-L761 HydrophobicContact CD1-CD2 4.31Å; Y618-L761 HydrophobicContact CD2-CD1 4.19Å; Y618-L761 HydrophobicContact CD2-CD2 3.84Å; Y618-L761 HydrophobicContact CE1-CD2 4.26Å; Y618-L761 HydrophobicContact CE2-CD2 3.85Å; Y618-L761 HydrophobicContact CG-CD1 3.79Å; Y618-L761 HydrophobicContact CG-CD2 4.12Å; L753-L761 HydrophobicContact CD1-CD2 3.81Å; L753-L761 HydrophobicContact CD1-CG 4.04Å; L753-L761 HydrophobicContact CD2-CD2 3.91Å; L753-L761 HydrophobicContact CG-CD2 4.43Å; E758-L761 HydrophobicContact CB-CB 4.13Å; E758-L761 HydrophobicContact CB-CD2 4.42Å; E758-L761 HydrophobicContact CG-CD2 4.47Å; E758-L761 PolarHBondContact O-N 3.16Å; L761-Y763 VanDerWaalsContact C-N 3.35Å; L761-Y763 PolarHBondContact O-N 3.03Å; L761-R764 PolarHBondContact O-N 3.3Å; L761-L765 WeakPolarHBondContact O-CB 3.44Å; L761-L765 PolarHBondContact O-N 3.04Å
762	C	91.5	Very high	89.1	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.014	27%	0.268	C	S	.	.	H	α-helix	trans	-56.6	-49.3	175.9	-71.4	0	0	0	0	111.6	R750 T755 E758 R764 L765 D766	R750-C762 PolarHBondContact NH1-SG 3.17Å; R750-C762 VanDerWaalsContact NH1-SG 3.42Å; T755-C762 HydrophobicContact CG2-CB 4.27Å; E758-C762 WeakPolarHBondContact O-CB 3.42Å; E758-C762 PolarHBondContact O-N 3.25Å; E758-C762 PolarHBondContact O-SG 3.29Å; E758-C762 VanDerWaalsContact O-SG 3.4Å; C762-R764 PolarHBondContact O-N 3.19Å; C762-L765 PolarHBondContact O-N 3.24Å; C762-D766 WeakPolarHBondContact O-CB 3.31Å; C762-D766 PolarHBondContact O-N 3.35Å
763	Y	89.9	Confident	89.3	Confident	108 Å²	108	56.3 Å²	56.3	42%	0.424	27%	0.273	S	S	.	.	H	α-helix	trans	-60	-48.2	179.9	175.8	-97.9	0	0	0	112.5	A315 P759 W760 L761 D766 A767	A315-Y763 HydrophobicContact CB-CE2 4.41Å; P759-Y763 VanDerWaalsContact O-CB 3.25Å; P759-Y763 WeakPolarHBondContact O-CB 3.39Å; P759-Y763 PolarHBondContact O-N 3.4Å; W760-Y763 PolarHBondContact O-N 3.44Å; L761-Y763 VanDerWaalsContact C-N 3.35Å; L761-Y763 PolarHBondContact O-N 3.03Å; Y763-D766 PolarHBondContact O-N 2.97Å; Y763-A767 WeakPolarHBondContact O-CB 3.42Å; Y763-A767 PolarHBondContact O-N 3.27Å
764	R	90.5	Very high	89.4	Confident	65 Å²	65	61.2 Å²	61.2	25%	0.245	30%	0.299	C	S	.	.	H	α-helix	trans	-68.7	-37	179.7	-74.4	-175	94.4	-159.2	3.8	112.2	P608 I609 W760 L761 C762 A767 L768	P608-R764 PolarHBondContact O-NH1 3.09Å; P608-R764 PolarHBondContact O-NH2 3.14Å; I609-R764 VanDerWaalsContact C-NH1 3.26Å; I609-R764 HydrophobicContact CG2-CB 3.7Å; I609-R764 VanDerWaalsContact O-CD 3.28Å; I609-R764 WeakPolarHBondContact O-CD 3.31Å; I609-R764 VanDerWaalsContact O-CZ 3.28Å; I609-R764 PolarHBondContact O-NE 2.97Å; I609-R764 PolarHBondContact O-NH1 2.98Å; W760-R764 HydrophobicContact CD2-CG 4.42Å; W760-R764 HydrophobicContact CE3-CG 4.26Å; W760-R764 VanDerWaalsContact CH2-CD 3.47Å; W760-R764 HydrophobicContact CZ2-CG 4.47Å; W760-R764 HydrophobicContact CZ3-CG 4.34Å; W760-R764 VanDerWaalsContact CZ3-NH1 3.31Å; W760-R764 WeakPolarHBondContact O-CB 3.39Å; W760-R764 PolarHBondContact O-N 3.39Å; L761-R764 PolarHBondContact O-N 3.3Å; C762-R764 PolarHBondContact O-N 3.19Å; R764-A767 PolarHBondContact O-N 3.39Å; R764-L768 WeakPolarHBondContact O-CG 3.32Å; R764-L768 PolarHBondContact O-N 3.39Å; R764-L768 VanDerWaalsContact O-N 3.12Å
765	L	92.8	Very high	89.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.3	-47.6	174.9	-171.4	61.9	0	0	0	110.3	I609 L625 V746 R750 L753 L761 C762 A767 L768 L769 M772	I609-L765 HydrophobicContact CD1-CD1 4.45Å; L625-L765 HydrophobicContact CD1-CD1 4.21Å; V746-L765 HydrophobicContact CG1-CD1 4.35Å; R750-L765 HydrophobicContact CB-CD2 4.06Å; R750-L765 HydrophobicContact CG-CD2 4.48Å; L753-L765 HydrophobicContact CD1-CD2 3.88Å; L761-L765 WeakPolarHBondContact O-CB 3.44Å; L761-L765 PolarHBondContact O-N 3.04Å; C762-L765 PolarHBondContact O-N 3.24Å; L765-A767 VanDerWaalsContact C-N 3.3Å; L765-A767 PolarHBondContact O-N 3.1Å; L765-L768 CarbonylContact O-C 3.55Å; L765-L768 WeakPolarHBondContact O-CA 3.45Å; L765-L768 PolarHBondContact O-N 3.21Å; L765-L769 WeakPolarHBondContact O-CG 3.35Å; L765-L769 PolarHBondContact O-N 3.39Å; L765-M772 HydrophobicContact CD1-CE 3.71Å; L765-M772 HydrophobicContact CD1-SD 4.02Å
766	D	93.3	Very high	89.9	Confident	63.6667 Å²	63.6667	56.4 Å²	56.4	34%	0.34	27%	0.266	S	S	.	.	H	α-helix	trans	-59.2	-39.9	177.3	-72.3	-24	0	0	0	112.3	R750 C762 Y763 L768 L769	R750-D766 WeakPolarHBondContact CD-OD1 3.33Å; R750-D766 IonicContact CZ-OD1 3.31Å; R750-D766 IonicContact CZ-OD2 3.19Å; R750-D766 VanDerWaalsContact NE-CG 3.26Å; R750-D766 IonicContact NE-OD1 3.4Å; R750-D766 PolarHBondContact NE-OD1 3.13Å; R750-D766 IonicContact NE-OD2 3.8Å; R750-D766 PolarHBondContact NE-OD2 3.07Å; R750-D766 VanDerWaalsContact NE-OD2 3.14Å; R750-D766 IonicContact NH2-OD1 3.74Å; R750-D766 IonicContact NH2-OD2 3.59Å; R750-D766 PolarHBondContact NH2-OD2 3.05Å; C762-D766 WeakPolarHBondContact O-CB 3.31Å; C762-D766 PolarHBondContact O-N 3.35Å; Y763-D766 PolarHBondContact O-N 2.97Å; D766-L768 VanDerWaalsContact C-N 3.28Å; D766-L768 PolarHBondContact O-N 3.03Å; D766-L769 PolarHBondContact O-N 3.4Å
767	A	91.5	Very high	90.3	Very high	58.3333 Å²	58.3333	51.7 Å²	51.7	48%	0.482	25%	0.25	S	S	.	.	H	α-helix	trans	-64.8	-30.8	174.9	0	0	0	0	0	113	Y763 R764 L765	Y763-A767 WeakPolarHBondContact O-CB 3.42Å; Y763-A767 PolarHBondContact O-N 3.27Å; R764-A767 PolarHBondContact O-N 3.39Å; L765-A767 VanDerWaalsContact C-N 3.3Å; L765-A767 PolarHBondContact O-N 3.1Å
768	L	91.1	Very high	90.6	Very high	43.6667 Å²	43.6667	48.9 Å²	48.9	23%	0.229	24%	0.243	C	C	.	.	H	α-helix	trans	-87.6	-20.3	178.9	-70.3	173.8	0	0	0	113.5	I609 R764 L765 D766 P770 R771 M772	I609-L768 HydrophobicContact CD1-CD1 4.13Å; I609-L768 HydrophobicContact CG1-CD1 4.08Å; I609-L768 HydrophobicContact CG2-CD1 4.28Å; R764-L768 WeakPolarHBondContact O-CG 3.32Å; R764-L768 PolarHBondContact O-N 3.39Å; R764-L768 VanDerWaalsContact O-N 3.12Å; L765-L768 CarbonylContact O-C 3.55Å; L765-L768 WeakPolarHBondContact O-CA 3.45Å; L765-L768 PolarHBondContact O-N 3.21Å; D766-L768 VanDerWaalsContact C-N 3.28Å; D766-L768 PolarHBondContact O-N 3.03Å; L768-P770 VanDerWaalsContact C-CD 3.45Å; L768-R771 WeakPolarHBondContact O-CA 3.39Å; L768-R771 WeakPolarHBondContact O-CB 3.37Å; L768-R771 PolarHBondContact O-N 3.12Å; L768-M772 HydrophobicContact CB-CE 3.72Å; L768-M772 HydrophobicContact CB-CG 4.36Å; L768-M772 HydrophobicContact CB-SD 4.22Å; L768-M772 HydrophobicContact CD1-CE 4.03Å; L768-M772 WeakPolarHBondContact O-CG 3.34Å; L768-M772 PolarHBondContact O-N 3.02Å
769	L	93.5	Very high	90.7	Very high	22.3333 Å²	22.3333	48.7 Å²	48.7	12%	0.117	24%	0.242	C	C	.	.	H	α-helix	trans	-50.5	-43.5	-176.3	-78.2	177.8	0	0	0	114.8	I743 V746 M747 L765 D766 R771 M772 R773	I743-L769 HydrophobicContact CD1-CD2 4.36Å; V746-L769 HydrophobicContact CG1-CD2 3.73Å; M747-L769 HydrophobicContact CE-CD1 3.54Å; M747-L769 VanDerWaalsContact CE-CD1 3.45Å; M747-L769 HydrophobicContact CE-CD2 4.02Å; M747-L769 HydrophobicContact CE-CG 4.31Å; L765-L769 WeakPolarHBondContact O-CG 3.35Å; L765-L769 PolarHBondContact O-N 3.39Å; D766-L769 PolarHBondContact O-N 3.4Å; L769-R771 VanDerWaalsContact C-N 3.31Å; L769-R771 PolarHBondContact O-N 3.13Å; L769-M772 HydrophobicContact CD2-SD 4.45Å; L769-M772 PolarHBondContact O-N 3.06Å; L769-R773 WeakPolarHBondContact O-CB 3.39Å; L769-R773 PolarHBondContact O-N 3.36Å
770	P	92.2	Very high	90.8	Very high	80 Å²	80	49.4 Å²	49.4	52%	0.519	24%	0.242	S	C	.	.	H	α-helix	trans	-61.6	-38.9	177.4	-23.4	34.7	0	0	0	112.8	L768 N774	L768-P770 VanDerWaalsContact C-CD 3.45Å; P770-N774 PolarHBondContact O-N 3.45Å
771	R	91	Very high	91	Very high	67.6667 Å²	67.6667	50.3 Å²	50.3	26%	0.255	25%	0.249	S	C	.	.	H	α-helix	trans	-66.4	-50	174.9	178.9	-176.5	178.9	-169.7	0.5	110.4	C593 E598 L768 L769 R773 N774 E775	C593-R771 PolarHBondContact O-NH2 3.19Å; E598-R771 IonicContact OE2-NH2 3.14Å; E598-R771 PolarHBondContact OE2-NH2 2.99Å; L768-R771 WeakPolarHBondContact O-CA 3.39Å; L768-R771 WeakPolarHBondContact O-CB 3.37Å; L768-R771 PolarHBondContact O-N 3.12Å; L769-R771 VanDerWaalsContact C-N 3.31Å; L769-R771 PolarHBondContact O-N 3.13Å; R771-R773 VanDerWaalsContact C-N 3.28Å; R771-R773 PolarHBondContact O-N 3.04Å; R771-N774 PolarHBondContact O-N 3.16Å; R771-N774 VanDerWaalsContact O-N 3.12Å; R771-E775 HydrophobicContact CG-CG 4.31Å; R771-E775 VanDerWaalsContact CG-OE1 3.25Å; R771-E775 WeakPolarHBondContact CG-OE1 3.32Å; R771-E775 IonicContact CZ-OE1 3.05Å; R771-E775 IonicContact NE-OE1 2.97Å; R771-E775 PolarHBondContact NE-OE1 3.16Å; R771-E775 IonicContact NE-OE2 3.02Å; R771-E775 IonicContact NH2-OE1 3.1Å; R771-E775 PolarHBondContact NH2-OE1 3.02Å; R771-E775 WeakPolarHBondContact O-CG 3.43Å; R771-E775 PolarHBondContact O-N 3.21Å
772	M	92.9	Very high	90.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-56.3	-42.6	179	-64.6	-175.2	176.7	0	0	111.7	I609 Y620 L625 I743 V746 L765 L768 L769 N774 E775 M776	I609-M772 HydrophobicContact CD1-CE 3.97Å; Y620-M772 HydrophobicContact CD1-CE 4.36Å; Y620-M772 HydrophobicContact CD1-CG 4.5Å; Y620-M772 HydrophobicContact CD2-CE 3.49Å; Y620-M772 VanDerWaalsContact CD2-CE 3.42Å; Y620-M772 HydrophobicContact CD2-CG 3.97Å; Y620-M772 HydrophobicContact CD2-SD 4.13Å; Y620-M772 HydrophobicContact CE1-CG 4.27Å; Y620-M772 HydrophobicContact CE2-CB 4.28Å; Y620-M772 HydrophobicContact CE2-CE 4.11Å; Y620-M772 HydrophobicContact CE2-CG 3.56Å; Y620-M772 HydrophobicContact CE2-SD 4.2Å; Y620-M772 HydrophobicContact CG-CE 3.68Å; Y620-M772 HydrophobicContact CG-CG 4.43Å; Y620-M772 WeakPolarHBondContact OH-CA 3.37Å; L625-M772 HydrophobicContact CD1-CE 4.24Å; I743-M772 HydrophobicContact CD1-CB 4.19Å; V746-M772 HydrophobicContact CG1-SD 3.88Å; L765-M772 HydrophobicContact CD1-CE 3.71Å; L765-M772 HydrophobicContact CD1-SD 4.02Å; L768-M772 HydrophobicContact CB-CE 3.72Å; L768-M772 HydrophobicContact CB-CG 4.36Å; L768-M772 HydrophobicContact CB-SD 4.22Å; L768-M772 HydrophobicContact CD1-CE 4.03Å; L768-M772 WeakPolarHBondContact O-CG 3.34Å; L768-M772 PolarHBondContact O-N 3.02Å; L769-M772 HydrophobicContact CD2-SD 4.45Å; L769-M772 PolarHBondContact O-N 3.06Å; M772-N774 PolarHBondContact O-N 3.21Å; M772-E775 PolarHBondContact O-N 3.26Å; M772-M776 HydrophobicContact CB-SD 4.46Å; M772-M776 WeakPolarHBondContact O-CB 3.31Å; M772-M776 VanDerWaalsContact O-CG 3.25Å; M772-M776 WeakPolarHBondContact O-CG 3.36Å; M772-M776 PolarHBondContact O-N 3.01Å
773	R	93.6	Very high	90.4	Very high	139 Å²	139	51.6 Å²	51.6	53%	0.525	26%	0.256	S	S	.	.	H	α-helix	trans	-58.3	-46.4	177	-177.2	-178.9	-64.4	168	0.8	112.2	I743 L769 R771 A777	I743-R773 HydrophobicContact CD1-CB 4.12Å; I743-R773 HydrophobicContact CG1-CB 4.1Å; I743-R773 HydrophobicContact CG1-CG 4.33Å; L769-R773 WeakPolarHBondContact O-CB 3.39Å; L769-R773 PolarHBondContact O-N 3.36Å; R771-R773 VanDerWaalsContact C-N 3.28Å; R771-R773 PolarHBondContact O-N 3.04Å; R773-A777 VanDerWaalsContact O-CB 3.25Å; R773-A777 WeakPolarHBondContact O-CB 3.33Å; R773-A777 PolarHBondContact O-N 2.9Å; R773-A777 VanDerWaalsContact O-N 3.13Å
774	N	91.2	Very high	90.2	Very high	110.333 Å²	110.333	50.7 Å²	50.7	59%	0.59	26%	0.256	S	S	*	.	H	α-helix	trans	-68.3	-46.1	-179.4	-71.1	-13.2	0	0	0	111.5	P770 R771 M772 A777 I778	P770-N774 PolarHBondContact O-N 3.45Å; R771-N774 PolarHBondContact O-N 3.16Å; R771-N774 VanDerWaalsContact O-N 3.12Å; M772-N774 PolarHBondContact O-N 3.21Å; N774-A777 PolarHBondContact O-N 3.1Å; N774-I778 WeakPolarHBondContact O-CG1 3.34Å; N774-I778 PolarHBondContact O-N 3.1Å
775	E	91.3	Very high	89.8	Confident	15 Å²	15	50.7 Å²	50.7	7%	0.07	27%	0.265	C	S	.	.	H	α-helix	trans	-70.5	-40.4	-177.1	-70.2	-177.1	-170.1	0	0	112.8	C593 Y620 R623 R771 M772 A777 I778 T779	C593-E775 HydrophobicContact CB-CG 3.95Å; C593-E775 VanDerWaalsContact O-OE1 3.13Å; Y620-E775 VanDerWaalsContact CE1-OE2 3.26Å; Y620-E775 WeakPolarHBondContact CE1-OE2 3.39Å; Y620-E775 VanDerWaalsContact CZ-OE2 3.23Å; Y620-E775 VanDerWaalsContact OH-CB 3.26Å; Y620-E775 WeakPolarHBondContact OH-CB 3.18Å; Y620-E775 PolarHBondContact OH-OE2 2.97Å; R623-E775 HydrophobicContact CB-CB 4.24Å; R623-E775 HydrophobicContact CG-CB 4.08Å; R771-E775 HydrophobicContact CG-CG 4.31Å; R771-E775 VanDerWaalsContact CG-OE1 3.25Å; R771-E775 WeakPolarHBondContact CG-OE1 3.32Å; R771-E775 IonicContact CZ-OE1 3.05Å; R771-E775 IonicContact NE-OE1 2.97Å; R771-E775 PolarHBondContact NE-OE1 3.16Å; R771-E775 IonicContact NE-OE2 3.02Å; R771-E775 IonicContact NH2-OE1 3.1Å; R771-E775 PolarHBondContact NH2-OE1 3.02Å; R771-E775 WeakPolarHBondContact O-CG 3.43Å; R771-E775 PolarHBondContact O-N 3.21Å; M772-E775 PolarHBondContact O-N 3.26Å; E775-A777 VanDerWaalsContact C-N 3.31Å; E775-A777 PolarHBondContact O-N 3.29Å; E775-I778 WeakPolarHBondContact O-CB 3.24Å; E775-I778 PolarHBondContact O-N 3.07Å; E775-I778 VanDerWaalsContact O-N 3.13Å; E775-T779 PolarHBondContact O-N 3.26Å; E775-T779 VanDerWaalsContact O-N 3.08Å; E775-T779 PolarHBondContact O-OG1 3.05Å; E775-T779 VanDerWaalsContact O-OG1 3.11Å
776	M	91.3	Very high	89.2	Confident	5.66667 Å²	5.66667	51 Å²	51	3%	0.028	27%	0.268	C	S	.	.	H	α-helix	trans	-69.3	-30.2	174.3	-68.2	-179.8	165.7	0	0	112.1	Y620 R623 Y740 I743 V746 M772 I778 T779 Q780	Y620-M776 HydrophobicContact CE2-CE 4.21Å; R623-M776 WeakPolarHBondContact O-CG 3.19Å; Y740-M776 WeakPolarHBondContact O-CE 3.37Å; I743-M776 HydrophobicContact CB-SD 4.35Å; I743-M776 PolarHBondContact N-SD 3.08Å; V746-M776 HydrophobicContact CG2-CE 3.57Å; V746-M776 VanDerWaalsContact CG2-CE 3.5Å; V746-M776 HydrophobicContact CG2-SD 3.88Å; M772-M776 HydrophobicContact CB-SD 4.46Å; M772-M776 WeakPolarHBondContact O-CB 3.31Å; M772-M776 VanDerWaalsContact O-CG 3.25Å; M772-M776 WeakPolarHBondContact O-CG 3.36Å; M772-M776 PolarHBondContact O-N 3.01Å; M776-I778 VanDerWaalsContact C-N 3.28Å; M776-I778 PolarHBondContact O-N 3.39Å; M776-T779 WeakPolarHBondContact O-CB 3.35Å; M776-T779 PolarHBondContact O-N 3.11Å; M776-Q780 PolarHBondContact O-N 3.46Å
777	A	90.7	Very high	88.6	Confident	35 Å²	35	48.8 Å²	48.8	29%	0.289	26%	0.256	S	S	.	.	H	α-helix	trans	-66.8	-31.4	170.8	0	0	0	0	0	112.4	R773 N774 E775 T779 Q780 K781	R773-A777 VanDerWaalsContact O-CB 3.25Å; R773-A777 WeakPolarHBondContact O-CB 3.33Å; R773-A777 PolarHBondContact O-N 2.9Å; R773-A777 VanDerWaalsContact O-N 3.13Å; N774-A777 PolarHBondContact O-N 3.1Å; E775-A777 VanDerWaalsContact C-N 3.31Å; E775-A777 PolarHBondContact O-N 3.29Å; A777-T779 VanDerWaalsContact C-N 3.34Å; A777-Q780 PolarHBondContact O-N 2.76Å; A777-K781 WeakPolarHBondContact O-CG 3.34Å; A777-K781 PolarHBondContact O-N 3.06Å; A777-K781 VanDerWaalsContact O-N 3.11Å
778	I	89.1	Confident	88.1	Confident	41 Å²	41	51.4 Å²	51.4	21%	0.21	26%	0.261	C	S	.	.	H	α-helix	trans	-66.8	-45.6	171.4	-65.2	162.3	0	0	0	109.8	D592 N774 E775 M776 Q780 K781 L782	D592-I778 WeakPolarHBondContact OD2-CD1 3.41Å; N774-I778 WeakPolarHBondContact O-CG1 3.34Å; N774-I778 PolarHBondContact O-N 3.1Å; E775-I778 WeakPolarHBondContact O-CB 3.24Å; E775-I778 PolarHBondContact O-N 3.07Å; E775-I778 VanDerWaalsContact O-N 3.13Å; M776-I778 VanDerWaalsContact C-N 3.28Å; M776-I778 PolarHBondContact O-N 3.39Å; I778-Q780 VanDerWaalsContact C-N 3.29Å; I778-Q780 PolarHBondContact O-N 3Å; I778-K781 PolarHBondContact O-N 3.07Å; I778-K781 VanDerWaalsContact O-N 3.13Å; I778-L782 HydrophobicContact CG2-CD1 3.83Å; I778-L782 HydrophobicContact CG2-CG 4.18Å; I778-L782 WeakPolarHBondContact O-CB 3.45Å; I778-L782 VanDerWaalsContact O-CG 3.31Å; I778-L782 WeakPolarHBondContact O-CG 3.4Å; I778-L782 PolarHBondContact O-N 2.93Å
779	T	87.8	Confident	87.4	Confident	0.333333 Å²	0.333333	52.9 Å²	52.9	0%	0.002	27%	0.267	C	S	.	.	H	α-helix	trans	-52.2	-48.8	173.6	-56.5	0	0	0	0	110.7	R623 R624 E775 M776 A777 K781 L782 T783 L826	R623-T779 WeakPolarHBondContact CB-OG1 3.19Å; R623-T779 WeakPolarHBondContact CD-OG1 3.33Å; R623-T779 PolarHBondContact NE-OG1 3.34Å; R624-T779 VanDerWaalsContact CZ-CG2 3.44Å; R624-T779 VanDerWaalsContact NH1-CG2 3.29Å; R624-T779 PolarHBondContact NH1-OG1 2.98Å; E775-T779 PolarHBondContact O-N 3.26Å; E775-T779 VanDerWaalsContact O-N 3.08Å; E775-T779 PolarHBondContact O-OG1 3.05Å; E775-T779 VanDerWaalsContact O-OG1 3.11Å; M776-T779 WeakPolarHBondContact O-CB 3.35Å; M776-T779 PolarHBondContact O-N 3.11Å; A777-T779 VanDerWaalsContact C-N 3.34Å; T779-K781 PolarHBondContact O-N 3.11Å; T779-L782 PolarHBondContact O-N 3.31Å; T779-T783 PolarHBondContact O-N 2.93Å; T779-T783 PolarHBondContact O-OG1 3.28Å; T779-T783 VanDerWaalsContact O-OG1 3.06Å; T779-L826 HydrophobicContact CG2-CD1 4.25Å; T779-L826 HydrophobicContact CG2-CD2 4.31Å
780	Q	86.8	Confident	86.5	Confident	53 Å²	53	52.2 Å²	52.2	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-56.7	-52.1	177.1	176.8	179.7	-5.5	0	0	112.5	M776 A777 I778 L782 T783 E784 L826 R830	M776-Q780 PolarHBondContact O-N 3.46Å; A777-Q780 PolarHBondContact O-N 2.76Å; I778-Q780 VanDerWaalsContact C-N 3.29Å; I778-Q780 PolarHBondContact O-N 3Å; Q780-L782 VanDerWaalsContact C-N 3.28Å; Q780-L782 PolarHBondContact O-N 3.19Å; Q780-T783 PolarHBondContact O-N 3.04Å; Q780-E784 HydrophobicContact CG-CG 4.37Å; Q780-E784 VanDerWaalsContact CG-OE1 3.23Å; Q780-E784 WeakPolarHBondContact CG-OE1 3.29Å; Q780-E784 PolarHBondContact NE2-OE1 3.09Å; Q780-E784 WeakPolarHBondContact O-CB 3.43Å; Q780-E784 WeakPolarHBondContact O-CG 3.36Å; Q780-E784 PolarHBondContact O-N 3.02Å; Q780-L826 HydrophobicContact CB-CD2 4.25Å; Q780-R830 VanDerWaalsContact OE1-NH2 3.11Å
781	K	88.4	Confident	85.7	Confident	142.667 Å²	142.667	49.1 Å²	49.1	62%	0.62	24%	0.243	S	C	*	.	H	α-helix	trans	-60	-40.2	-179.1	-73.4	175	-178.7	179.6	0	112.1	A777 I778 T779 E784 S785	A777-K781 WeakPolarHBondContact O-CG 3.34Å; A777-K781 PolarHBondContact O-N 3.06Å; A777-K781 VanDerWaalsContact O-N 3.11Å; I778-K781 PolarHBondContact O-N 3.07Å; I778-K781 VanDerWaalsContact O-N 3.13Å; T779-K781 PolarHBondContact O-N 3.11Å; K781-E784 PolarHBondContact O-N 3.08Å; K781-S785 VanDerWaalsContact O-CB 3.3Å; K781-S785 WeakPolarHBondContact O-CB 3.41Å; K781-S785 PolarHBondContact O-N 3.09Å; K781-S785 PolarHBondContact O-OG 3.25Å; K781-S785 VanDerWaalsContact O-OG 3.04Å
782	L	85	Confident	84.9	Confident	26 Å²	26	50 Å²	50	14%	0.136	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-45.5	177.4	-69.7	174.4	0	0	0	111.1	P588 I778 T779 Q780 E784 S785 G786 F958	P588-L782 HydrophobicContact CB-CD2 4.32Å; I778-L782 HydrophobicContact CG2-CD1 3.83Å; I778-L782 HydrophobicContact CG2-CG 4.18Å; I778-L782 WeakPolarHBondContact O-CB 3.45Å; I778-L782 VanDerWaalsContact O-CG 3.31Å; I778-L782 WeakPolarHBondContact O-CG 3.4Å; I778-L782 PolarHBondContact O-N 2.93Å; T779-L782 PolarHBondContact O-N 3.31Å; Q780-L782 VanDerWaalsContact C-N 3.28Å; Q780-L782 PolarHBondContact O-N 3.19Å; L782-E784 PolarHBondContact O-N 3.12Å; L782-S785 WeakPolarHBondContact CA-OG 3.37Å; L782-S785 PolarHBondContact O-N 3.26Å; L782-S785 PolarHBondContact O-OG 3.07Å; L782-S785 VanDerWaalsContact O-OG 3.06Å; L782-G786 PolarHBondContact O-N 3.12Å; L782-F958 HydrophobicContact CB-CD2 4.19Å; L782-F958 HydrophobicContact CB-CE1 4.24Å; L782-F958 HydrophobicContact CB-CE2 4.06Å; L782-F958 HydrophobicContact CB-CZ 3.57Å; L782-F958 HydrophobicContact CD1-CZ 4.34Å; L782-F958 HydrophobicContact CG-CZ 4.47Å; L782-F958 WeakPolarHBondContact O-CD2 3.28Å; L782-F958 WeakPolarHBondContact O-CE2 3.35Å
783	T	84.2	Confident	83.4	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-44.6	175.6	-55.4	0	0	0	0	111.9	T779 Q780 G786 F787 L826 Y956 F958	T779-T783 PolarHBondContact O-N 2.93Å; T779-T783 PolarHBondContact O-OG1 3.28Å; T779-T783 VanDerWaalsContact O-OG1 3.06Å; Q780-T783 PolarHBondContact O-N 3.04Å; T783-G786 PolarHBondContact O-N 3.48Å; T783-F787 VanDerWaalsContact O-CB 3.24Å; T783-F787 WeakPolarHBondContact O-CB 3.34Å; T783-F787 PolarHBondContact O-N 3.27Å; T783-L826 HydrophobicContact CG2-CB 4.18Å; T783-L826 HydrophobicContact CG2-CD1 3.96Å; T783-L826 HydrophobicContact CG2-CD2 4.27Å; T783-L826 HydrophobicContact CG2-CG 4.39Å; T783-L826 WeakPolarHBondContact OG1-CD1 3.46Å; T783-Y956 HydrophobicContact CG2-CD1 4.48Å; T783-Y956 HydrophobicContact CG2-CE1 4.18Å; T783-Y956 WeakPolarHBondContact O-CE1 3.29Å; T783-F958 HydrophobicContact CG2-CB 4.25Å
784	E	85.1	Confident	82.3	Confident	91 Å²	91	47.5 Å²	47.5	43%	0.425	26%	0.256	S	S	.	.	H	α-helix	trans	-64.6	-42.9	178	-73.2	169.6	-175.5	0	0	112.1	Q780 K781 L782 F787 L788 R830	Q780-E784 HydrophobicContact CG-CG 4.37Å; Q780-E784 VanDerWaalsContact CG-OE1 3.23Å; Q780-E784 WeakPolarHBondContact CG-OE1 3.29Å; Q780-E784 PolarHBondContact NE2-OE1 3.09Å; Q780-E784 WeakPolarHBondContact O-CB 3.43Å; Q780-E784 WeakPolarHBondContact O-CG 3.36Å; Q780-E784 PolarHBondContact O-N 3.02Å; K781-E784 PolarHBondContact O-N 3.08Å; L782-E784 PolarHBondContact O-N 3.12Å; E784-F787 PolarHBondContact O-N 3.29Å; E784-L788 WeakPolarHBondContact O-CB 3.08Å; E784-L788 PolarHBondContact O-N 3.06Å; E784-L788 VanDerWaalsContact O-N 3.08Å; E784-R830 IonicContact OE1-NH1 2.65Å
785	S	82.8	Confident	81.1	Confident	64.3333 Å²	64.3333	47.3 Å²	47.3	45%	0.45	26%	0.261	S	S	.	.	H	α-helix	trans	-65.9	-44.5	177.7	61.8	0	0	0	0	112.4	K781 L782 F787 L788 E789	K781-S785 VanDerWaalsContact O-CB 3.3Å; K781-S785 WeakPolarHBondContact O-CB 3.41Å; K781-S785 PolarHBondContact O-N 3.09Å; K781-S785 PolarHBondContact O-OG 3.25Å; K781-S785 VanDerWaalsContact O-OG 3.04Å; L782-S785 WeakPolarHBondContact CA-OG 3.37Å; L782-S785 PolarHBondContact O-N 3.26Å; L782-S785 PolarHBondContact O-OG 3.07Å; L782-S785 VanDerWaalsContact O-OG 3.06Å; S785-F787 VanDerWaalsContact C-N 3.26Å; S785-F787 PolarHBondContact O-N 2.67Å; S785-L788 PolarHBondContact O-N 3Å; S785-E789 WeakPolarHBondContact O-CB 3.33Å; S785-E789 PolarHBondContact O-N 3.13Å; S785-E789 VanDerWaalsContact O-N 3.09Å
786	G	80.9	Confident	80	Confident	6 Å²	6	50.3 Å²	50.3	6%	0.062	28%	0.277	C	S	.	.	H	α-helix	trans	-65.4	-36.8	176.1	0	0	0	0	0	112.1	L782 T783 E789 F790 Y956	L782-G786 PolarHBondContact O-N 3.12Å; T783-G786 PolarHBondContact O-N 3.48Å; G786-E789 PolarHBondContact O-N 2.99Å; G786-F790 VanDerWaalsContact O-CB 3.25Å; G786-F790 WeakPolarHBondContact O-CB 3.45Å; G786-F790 PolarHBondContact O-N 3.05Å; G786-Y956 VanDerWaalsContact C-CZ 3.41Å; G786-Y956 VanDerWaalsContact CA-OH 3.24Å; G786-Y956 WeakPolarHBondContact CA-OH 3.29Å; G786-Y956 PolarHBondContact O-OH 3Å
787	F	80.9	Confident	79.1	Confident	18 Å²	18	51.5 Å²	51.5	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-64.3	-44	175.1	-179.6	-116.2	0	0	0	112.1	T783 E784 S785 E789 F790 C791 S799 V822 Y823 Y956 F958	T783-F787 VanDerWaalsContact O-CB 3.24Å; T783-F787 WeakPolarHBondContact O-CB 3.34Å; T783-F787 PolarHBondContact O-N 3.27Å; E784-F787 PolarHBondContact O-N 3.29Å; S785-F787 VanDerWaalsContact C-N 3.26Å; S785-F787 PolarHBondContact O-N 2.67Å; F787-E789 VanDerWaalsContact C-N 3.34Å; F787-E789 PolarHBondContact O-N 3.25Å; F787-F790 WeakPolarHBondContact O-CB 3.42Å; F787-F790 PolarHBondContact O-N 3.19Å; F787-C791 PolarHBondContact O-N 3.34Å; F787-S799 VanDerWaalsContact CE1-CB 3.4Å; F787-S799 VanDerWaalsContact CZ-CB 3.48Å; F787-V822 HydrophobicContact CD2-CG1 4.45Å; F787-V822 HydrophobicContact CE2-CB 4.09Å; F787-V822 HydrophobicContact CE2-CG1 3.61Å; F787-V822 HydrophobicContact CZ-CB 4.04Å; F787-V822 HydrophobicContact CZ-CG1 3.61Å; F787-V822 WeakPolarHBondContact CZ-O 3.19Å; F787-Y823 VanDerWaalsContact CE2-C 3.44Å; F787-Y956 VanDerWaalsContact CA-CE1 3.45Å; F787-Y956 HydrophobicContact CB-CD1 3.63Å; F787-Y956 HydrophobicContact CB-CE1 3.54Å; F787-Y956 HydrophobicContact CB-CG 4.36Å; F787-Y956 AromaticContact CD2-CD1 3.65Å; F787-Y956 HydrophobicContact CD2-CD1 3.65Å; F787-Y956 HydrophobicContact CD2-CD2 4.33Å; F787-Y956 HydrophobicContact CD2-CE1 4.37Å; F787-Y956 AromaticContact CD2-CG 3.64Å; F787-Y956 HydrophobicContact CD2-CG 3.64Å; F787-Y956 HydrophobicContact CE2-CG 4.46Å; F787-Y956 HydrophobicContact CG-CD1 4.01Å; F787-Y956 HydrophobicContact CG-CE1 4.41Å; F787-Y956 HydrophobicContact CG-CG 4.44Å; F787-Y956 VanDerWaalsContact N-CE1 3.31Å; F787-Y956 PolarHBondContact N-OH 2.86Å; F787-F958 HydrophobicContact CB-CD2 3.97Å; F787-F958 HydrophobicContact CB-CE2 4.31Å; F787-F958 AromaticContact CD2-CD2 3.66Å; F787-F958 HydrophobicContact CD2-CD2 3.66Å; F787-F958 AromaticContact CD2-CE2 3.44Å; F787-F958 HydrophobicContact CD2-CE2 3.44Å; F787-F958 VanDerWaalsContact CD2-CE2 3.44Å; F787-F958 HydrophobicContact CE2-CE2 4.12Å; F787-F958 HydrophobicContact CG-CD2 4.29Å; F787-F958 HydrophobicContact CG-CE2 4.24Å
788	L	80.1	Confident	78.3	Confident	113.333 Å²	113.333	54 Å²	54	59%	0.593	29%	0.287	S	S	*	.	H	α-helix	trans	-63.4	-42.8	175.9	-174.3	74.3	0	0	0	111.4	E784 S785 F790 C791 S792	E784-L788 WeakPolarHBondContact O-CB 3.08Å; E784-L788 PolarHBondContact O-N 3.06Å; E784-L788 VanDerWaalsContact O-N 3.08Å; S785-L788 PolarHBondContact O-N 3Å; L788-F790 VanDerWaalsContact C-N 3.29Å; L788-F790 PolarHBondContact O-N 3.49Å; L788-C791 PolarHBondContact O-N 3.39Å; L788-S792 VanDerWaalsContact O-CB 3.29Å; L788-S792 WeakPolarHBondContact O-CB 3.38Å; L788-S792 PolarHBondContact O-N 3.11Å; L788-S792 PolarHBondContact O-OG 3.23Å
789	E	76.2	Confident	77.8	Confident	73.3333 Å²	73.3333	55.1 Å²	55.1	34%	0.343	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-41.9	176	-170.8	-175.3	170.6	0	0	111.3	S785 G786 F787 C791 S792 S793 N963 R1097	S785-E789 WeakPolarHBondContact O-CB 3.33Å; S785-E789 PolarHBondContact O-N 3.13Å; S785-E789 VanDerWaalsContact O-N 3.09Å; G786-E789 PolarHBondContact O-N 2.99Å; F787-E789 VanDerWaalsContact C-N 3.34Å; F787-E789 PolarHBondContact O-N 3.25Å; E789-C791 PolarHBondContact O-N 2.96Å; E789-S792 PolarHBondContact O-N 3Å; E789-S793 VanDerWaalsContact O-CB 3.3Å; E789-S793 WeakPolarHBondContact O-CB 3.32Å; E789-S793 PolarHBondContact O-N 3.18Å; E789-S793 PolarHBondContact O-OG 3Å; E789-S793 VanDerWaalsContact O-OG 3.05Å; E789-N963 PolarHBondContact OE2-ND2 2.92Å; E789-R1097 PolarHBondContact O-NH2 3.12Å; E789-R1097 IonicContact OE1-CZ 3.27Å; E789-R1097 IonicContact OE1-NH1 2.98Å; E789-R1097 PolarHBondContact OE1-NH1 2.81Å; E789-R1097 IonicContact OE1-NH2 3.21Å; E789-R1097 PolarHBondContact OE1-NH2 3.23Å
790	F	76	Confident	77.1	Confident	8.33333 Å²	8.33333	56.1 Å²	56.1	4%	0.037	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-50.5	175.6	177	-85.2	0	0	0	111.7	G786 F787 L788 S792 S793 R794 H797 V822 A857 L954 Y956 F958 D960 E961	G786-F790 VanDerWaalsContact O-CB 3.25Å; G786-F790 WeakPolarHBondContact O-CB 3.45Å; G786-F790 PolarHBondContact O-N 3.05Å; F787-F790 WeakPolarHBondContact O-CB 3.42Å; F787-F790 PolarHBondContact O-N 3.19Å; L788-F790 VanDerWaalsContact C-N 3.29Å; L788-F790 PolarHBondContact O-N 3.49Å; F790-S792 VanDerWaalsContact C-N 3.31Å; F790-S792 PolarHBondContact O-N 3.22Å; F790-S793 PolarHBondContact O-N 2.94Å; F790-S793 PolarHBondContact O-OG 3.42Å; F790-R794 VanDerWaalsContact CE2-NE 3.34Å; F790-R794 PolarHBondContact O-N 3.34Å; F790-R794 PolarHBondContact O-NH1 3.04Å; F790-H797 HydrophobicContact CE1-CB 4.28Å; F790-H797 AromaticContact CE1-CD2 3.72Å; F790-H797 AromaticContact CZ-CD2 3.6Å; F790-V822 HydrophobicContact CD1-CG1 4.29Å; F790-V822 HydrophobicContact CE1-CG1 3.96Å; F790-V822 HydrophobicContact CE1-CG2 4.19Å; F790-A857 HydrophobicContact CZ-CB 4.3Å; F790-L954 HydrophobicContact CE1-CD2 4.12Å; F790-L954 HydrophobicContact CZ-CD2 3.8Å; F790-Y956 HydrophobicContact CB-CD2 3.94Å; F790-Y956 HydrophobicContact CB-CE2 3.64Å; F790-Y956 HydrophobicContact CD1-CD2 4.13Å; F790-Y956 AromaticContact CD2-CD2 3.6Å; F790-Y956 HydrophobicContact CD2-CD2 3.6Å; F790-Y956 AromaticContact CD2-CE2 3.61Å; F790-Y956 HydrophobicContact CD2-CE2 3.61Å; F790-Y956 HydrophobicContact CE1-CD1 4.39Å; F790-Y956 HydrophobicContact CE1-CE1 4.33Å; F790-Y956 HydrophobicContact CE2-CD1 4.36Å; F790-Y956 AromaticContact CE2-CD2 4Å; F790-Y956 HydrophobicContact CE2-CD2 4.1Å; F790-Y956 HydrophobicContact CE2-CE1 4.14Å; F790-Y956 HydrophobicContact CE2-CE2 4.32Å; F790-Y956 AromaticContact CG-CD2 3.63Å; F790-Y956 HydrophobicContact CG-CD2 3.63Å; F790-Y956 AromaticContact CG-CE2 3.74Å; F790-Y956 HydrophobicContact CG-CE2 3.74Å; F790-Y956 AromaticContact CZ-CD1 3.9Å; F790-Y956 HydrophobicContact CZ-CD1 3.9Å; F790-Y956 AromaticContact CZ-CE1 3.56Å; F790-Y956 HydrophobicContact CZ-CE1 3.56Å; F790-Y956 HydrophobicContact CZ-CE2 4.39Å; F790-Y956 HydrophobicContact CZ-CG 4.47Å; F790-Y956 AromaticContact CZ-CZ 3.81Å; F790-F958 HydrophobicContact CB-CE1 3.79Å; F790-F958 HydrophobicContact CB-CE2 3.82Å; F790-F958 HydrophobicContact CB-CZ 3.43Å; F790-F958 VanDerWaalsContact CB-CZ 3.43Å; F790-F958 HydrophobicContact CD1-CE1 4.32Å; F790-F958 AromaticContact CD1-CE2 3.79Å; F790-F958 HydrophobicContact CD1-CE2 3.79Å; F790-F958 AromaticContact CD1-CZ 3.34Å; F790-F958 HydrophobicContact CD1-CZ 3.34Å; F790-F958 AromaticContact CD2-CE1 3.35Å; F790-F958 HydrophobicContact CD2-CE1 3.35Å; F790-F958 HydrophobicContact CD2-CE2 4.3Å; F790-F958 AromaticContact CD2-CZ 3.18Å; F790-F958 HydrophobicContact CD2-CZ 3.18Å; F790-F958 HydrophobicContact CE1-CE2 4.36Å; F790-F958 AromaticContact CE1-CZ 3.75Å; F790-F958 HydrophobicContact CE1-CZ 3.75Å; F790-F958 AromaticContact CE2-CE1 3.88Å; F790-F958 HydrophobicContact CE2-CE1 3.88Å; F790-F958 AromaticContact CE2-CZ 3.59Å; F790-F958 HydrophobicContact CE2-CZ 3.59Å; F790-F958 AromaticContact CG-CE1 3.58Å; F790-F958 HydrophobicContact CG-CE1 3.58Å; F790-F958 AromaticContact CG-CE2 3.73Å; F790-F958 HydrophobicContact CG-CE2 3.73Å; F790-F958 AromaticContact CG-CZ 3.01Å; F790-F958 HydrophobicContact CG-CZ 3.01Å; F790-F958 AromaticContact CZ-CZ 3.86Å; F790-F958 HydrophobicContact CZ-CZ 3.86Å; F790-D960 HydrophobicContact CD2-CB 4.36Å; F790-D960 HydrophobicContact CE2-CB 4.13Å; F790-E961 HydrophobicContact CB-CB 4.19Å; F790-E961 HydrophobicContact CD2-CB 4.4Å
791	C	75.1	Confident	76.3	Confident	15.6667 Å²	15.6667	56.9 Å²	56.9	11%	0.106	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-40.3	177.3	-70	0	0	0	0	112	F787 L788 E789 S793 R794	F787-C791 PolarHBondContact O-N 3.34Å; L788-C791 PolarHBondContact O-N 3.39Å; E789-C791 PolarHBondContact O-N 2.96Å; C791-S793 VanDerWaalsContact C-N 3.28Å; C791-S793 PolarHBondContact O-N 3.17Å; C791-R794 CarbonylContact O-C 3.42Å; C791-R794 PolarHBondContact O-N 3.04Å; C791-R794 VanDerWaalsContact O-N 3.09Å; C791-R794 VanDerWaalsContact O-O 3.13Å
792	S	73.3	Confident	75.1	Confident	87 Å²	87	52.8 Å²	52.8	61%	0.608	30%	0.3	S	S	*	.	H	α-helix	trans	-65.6	-31.4	179.7	-57.7	0	0	0	0	112.5	L788 E789 F790 R794 F1095	L788-S792 VanDerWaalsContact O-CB 3.29Å; L788-S792 WeakPolarHBondContact O-CB 3.38Å; L788-S792 PolarHBondContact O-N 3.11Å; L788-S792 PolarHBondContact O-OG 3.23Å; E789-S792 PolarHBondContact O-N 3Å; F790-S792 VanDerWaalsContact C-N 3.31Å; F790-S792 PolarHBondContact O-N 3.22Å; S792-R794 VanDerWaalsContact C-N 3.32Å; S792-R794 PolarHBondContact O-N 3.38Å; S792-F1095 VanDerWaalsContact O-CE1 3.3Å; S792-F1095 WeakPolarHBondContact O-CE1 3.47Å
793	S	62.7	Low	73.8	Confident	37.3333 Å²	37.3333	55 Å²	55	26%	0.261	31%	0.312	S	S	.	.	H	α-helix	trans	-77.4	-15	177.7	69.1	0	0	0	0	114.3	E789 F790 C791 R1097	E789-S793 VanDerWaalsContact O-CB 3.3Å; E789-S793 WeakPolarHBondContact O-CB 3.32Å; E789-S793 PolarHBondContact O-N 3.18Å; E789-S793 PolarHBondContact O-OG 3Å; E789-S793 VanDerWaalsContact O-OG 3.05Å; F790-S793 PolarHBondContact O-N 2.94Å; F790-S793 PolarHBondContact O-OG 3.42Å; C791-S793 VanDerWaalsContact C-N 3.28Å; C791-S793 PolarHBondContact O-N 3.17Å; S793-R1097 PolarHBondContact OG-NE 3.06Å; S793-R1097 PolarHBondContact OG-NH2 3.49Å
794	R	68.8	Low	72	Confident	48.6667 Å²	48.6667	60.4 Å²	60.4	18%	0.184	34%	0.341	C	S	.	.			trans	-127.7	101.2	-175	-64.4	-172.4	178.9	121.6	-7.5	110.4	F790 C791 S792 N796 H797 S859 D865	F790-R794 VanDerWaalsContact CE2-NE 3.34Å; F790-R794 PolarHBondContact O-N 3.34Å; F790-R794 PolarHBondContact O-NH1 3.04Å; C791-R794 CarbonylContact O-C 3.42Å; C791-R794 PolarHBondContact O-N 3.04Å; C791-R794 VanDerWaalsContact O-N 3.09Å; C791-R794 VanDerWaalsContact O-O 3.13Å; S792-R794 VanDerWaalsContact C-N 3.32Å; S792-R794 PolarHBondContact O-N 3.38Å; R794-N796 VanDerWaalsContact C-N 3.27Å; R794-N796 PolarHBondContact O-N 3.25Å; R794-N796 VanDerWaalsContact O-N 3.15Å; R794-H797 HydrophobicContact CB-CB 3.95Å; R794-H797 VanDerWaalsContact CB-ND1 3.33Å; R794-H797 WeakPolarHBondContact CB-ND1 3.28Å; R794-H797 PolarHBondContact NH1-NE2 2.9Å; R794-H797 VanDerWaalsContact NH1-NE2 3.16Å; R794-H797 WeakPolarHBondContact O-CB 3.45Å; R794-H797 PolarHBondContact O-N 3.32Å; R794-S859 PolarHBondContact NH2-OG 3.26Å; R794-D865 IonicContact CZ-OD2 2.77Å; R794-D865 IonicContact NE-OD2 3.82Å; R794-D865 IonicContact NH2-OD1 2.67Å; R794-D865 IonicContact NH2-OD2 3.47Å; R794-D865 PolarHBondContact NH2-OD2 3.4Å
795	P	65.9	Low	70.2	Confident	106 Å²	106	63.4 Å²	63.4	69%	0.688	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-27.4	-171.4	21.3	-31.9	0	0	0	114.4	H797 F1095	P795-H797 VanDerWaalsContact C-N 3.28Å; P795-H797 PolarHBondContact O-N 3.04Å; P795-F1095 VanDerWaalsContact CD-CE1 3.43Å; P795-F1095 HydrophobicContact CG-CE1 3.78Å; P795-F1095 HydrophobicContact CG-CZ 3.93Å
796	N	68.8	Low	68.1	Low	78 Å²	78	63.3 Å²	63.3	42%	0.417	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-3.5	177.7	-64.2	-1.2	0	0	0	113.4	R794 T819 V820 F1095	R794-N796 VanDerWaalsContact C-N 3.27Å; R794-N796 PolarHBondContact O-N 3.25Å; R794-N796 VanDerWaalsContact O-N 3.15Å; N796-T819 CarbonylContact O-C 3.38Å; N796-T819 WeakPolarHBondContact O-CA 3.41Å; N796-V820 PolarHBondContact O-N 3.15Å; N796-F1095 HydrophobicContact CB-CE1 4.17Å; N796-F1095 HydrophobicContact CB-CZ 4.35Å; N796-F1095 VanDerWaalsContact CG-CZ 3.49Å; N796-F1095 WeakPolarHBondContact ND2-CZ 3.39Å; N796-F1095 WeakPolarHBondContact OD1-CZ 3.19Å
797	H	72.4	Confident	66.1	Low	30 Å²	30	71.5 Å²	71.5	14%	0.139	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.5	-175.9	-66.9	56.3	0	0	0	110.3	F790 R794 P795 V820 V822	F790-H797 HydrophobicContact CE1-CB 4.28Å; F790-H797 AromaticContact CE1-CD2 3.72Å; F790-H797 AromaticContact CZ-CD2 3.6Å; R794-H797 HydrophobicContact CB-CB 3.95Å; R794-H797 VanDerWaalsContact CB-ND1 3.33Å; R794-H797 WeakPolarHBondContact CB-ND1 3.28Å; R794-H797 PolarHBondContact NH1-NE2 2.9Å; R794-H797 VanDerWaalsContact NH1-NE2 3.16Å; R794-H797 WeakPolarHBondContact O-CB 3.45Å; R794-H797 PolarHBondContact O-N 3.32Å; P795-H797 VanDerWaalsContact C-N 3.28Å; P795-H797 PolarHBondContact O-N 3.04Å; H797-V820 CarbonylContact C-O 3.41Å; H797-V820 VanDerWaalsContact CA-O 3.31Å; H797-V820 WeakPolarHBondContact CA-O 3.45Å; H797-V822 HydrophobicContact CB-CG2 3.92Å
798	K	75.2	Confident	63.9	Low	87.3333 Å²	87.3333	78.1 Å²	78.1	38%	0.38	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127	178.4	-96	-176.4	-176.6	179.8	0	110.5	D815 T819 V820 Y821 V822	K798-D815 VanDerWaalsContact NZ-CG 3.25Å; K798-D815 IonicContact NZ-OD1 2.86Å; K798-D815 IonicContact NZ-OD2 2.87Å; K798-D815 PolarHBondContact NZ-OD2 3.1Å; K798-T819 HydrophobicContact CB-CG2 4.18Å; K798-T819 HydrophobicContact CD-CG2 3.82Å; K798-T819 HydrophobicContact CG-CG2 3.94Å; K798-V820 PolarHBondContact N-O 3.22Å; K798-Y821 HydrophobicContact CB-CD1 4.12Å; K798-Y821 HydrophobicContact CB-CE1 4.21Å; K798-Y821 HydrophobicContact CD-CE1 4.25Å; K798-Y821 WeakPolarHBondContact O-CA 3.32Å; K798-V822 PolarHBondContact O-N 3.11Å; K798-V822 VanDerWaalsContact O-N 3.07Å
799	S	76.8	Confident	62	Low	64.6667 Å²	64.6667	76 Å²	76	45%	0.452	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	133.9	176.2	56.7	0	0	0	0	111.5	F787 V822	F787-S799 VanDerWaalsContact CE1-CB 3.4Å; F787-S799 VanDerWaalsContact CZ-CB 3.48Å; S799-V822 CarbonylContact C-O 3.42Å; S799-V822 WeakPolarHBondContact CA-O 3.49Å
800	V	73.9	Confident	60.3	Low	20.6667 Å²	20.6667	75.6 Å²	75.6	13%	0.125	43%	0.432	C	S	.	.			trans	-112.8	120.7	171.3	-179.1	0	0	0	0	108.7	L802 L812 Y821 V822	V800-L802 HydrophobicContact CG1-CD1 4.43Å; V800-L812 HydrophobicContact CG2-CD2 4.24Å; V800-Y821 HydrophobicContact CG2-CD1 3.7Å; V800-Y821 VanDerWaalsContact CG2-CD1 3.42Å; V800-Y821 HydrophobicContact CG2-CE1 4.4Å; V800-Y821 HydrophobicContact CG2-CG 4.12Å; V800-V822 PolarHBondContact N-O 3.16Å
801	S	69	Low	58.7	Low	69.75 Å²	69.75	80.9 Å²	80.9	49%	0.488	46%	0.461	S	S	.	.			trans	-97.4	129	174.9	-65.2	0	0	0	0	111	N803 E827	S801-N803 PolarHBondContact O-N 3.03Å; S801-N803 VanDerWaalsContact O-N 3.13Å; S801-E827 WeakPolarHBondContact CA-OE1 3.38Å; S801-E827 WeakPolarHBondContact CB-OE1 3.4Å; S801-E827 PolarHBondContact OG-OE1 2.94Å
802	L	64.3	Low	57.5	Low	56.75 Å²	56.75	81.9 Å²	81.9	30%	0.297	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-4.8	179.2	-81.2	116.3	0	0	0	113.5	V800 N804 Y823 E827 V828 A831 L944	V800-L802 HydrophobicContact CG1-CD1 4.43Å; L802-N804 VanDerWaalsContact C-N 3.27Å; L802-N804 PolarHBondContact O-N 3.04Å; L802-N804 VanDerWaalsContact O-N 3.14Å; L802-Y823 HydrophobicContact CD1-CD1 4.04Å; L802-Y823 HydrophobicContact CD1-CE1 4.07Å; L802-Y823 HydrophobicContact CD1-CG 4.21Å; L802-Y823 HydrophobicContact CD2-CD1 4.47Å; L802-Y823 HydrophobicContact CD2-CE1 4.05Å; L802-Y823 HydrophobicContact CG-CD1 3.68Å; L802-Y823 HydrophobicContact CG-CE1 3.65Å; L802-E827 HydrophobicContact CB-CB 4.49Å; L802-E827 HydrophobicContact CD1-CB 4.23Å; L802-E827 PolarHBondContact N-OE1 3.07Å; L802-V828 HydrophobicContact CD1-CB 4.38Å; L802-V828 HydrophobicContact CD1-CG2 3.67Å; L802-V828 HydrophobicContact CD2-CG2 4.02Å; L802-A831 HydrophobicContact CB-CB 4.26Å; L802-A831 HydrophobicContact CD1-CB 4.32Å; L802-A831 HydrophobicContact CD2-CB 3.8Å; L802-L944 WeakPolarHBondContact CD2-O 3.38Å
803	N	56.8	Low	56.3	Low	72.5 Å²	72.5	82.1 Å²	82.1	39%	0.388	46%	0.463	S	S	.	.			trans	-83.7	9	-170.4	-78.1	-44.5	0	0	0	116.2	S801 D805 E827 K834	S801-N803 PolarHBondContact O-N 3.03Å; S801-N803 VanDerWaalsContact O-N 3.13Å; N803-D805 PolarHBondContact O-N 3.11Å; N803-D805 VanDerWaalsContact O-N 3.08Å; N803-E827 VanDerWaalsContact CG-OE1 3.3Å; N803-E827 PolarHBondContact N-OE1 3.2Å; N803-E827 VanDerWaalsContact N-OE1 3.14Å; N803-E827 PolarHBondContact ND2-OE1 3.09Å; N803-K834 PolarHBondContact OD1-NZ 3.42Å
804	N	46.5	Very low	55.6	Low	120.5 Å²	120.5	84 Å²	84	64%	0.644	48%	0.48	S	S	*	.			trans	-83.1	91.6	178.7	-77.7	-11.8	0	0	0	111.2	L802 S806	L802-N804 VanDerWaalsContact C-N 3.27Å; L802-N804 PolarHBondContact O-N 3.04Å; L802-N804 VanDerWaalsContact O-N 3.14Å; N804-S806 PolarHBondContact O-N 3.27Å; N804-S806 VanDerWaalsContact O-N 3.1Å
805	D	47.1	Very low	54.9	Low	154 Å²	154	86.4 Å²	86.4	82%	0.824	50%	0.497	S	S	*	.			trans	-62.9	3.8	170.4	-72.2	-37.6	0	0	0	113.5	N803 N807 K834	N803-D805 PolarHBondContact O-N 3.11Å; N803-D805 VanDerWaalsContact O-N 3.08Å; D805-N807 PolarHBondContact O-N 3.44Å; D805-K834 IonicContact OD1-NZ 3.45Å; D805-K834 IonicContact OD2-NZ 3.71Å; D805-K834 PolarHBondContact OD2-NZ 2.59Å
806	S	39	Very low	54.4	Low	62.5 Å²	62.5	83.7 Å²	83.7	44%	0.437	48%	0.481	S	S	.	.	S	Bend	trans	-89.5	125.4	170.4	58.4	0	0	0	0	109.8	N804 Q808	N804-S806 PolarHBondContact O-N 3.27Å; N804-S806 VanDerWaalsContact O-N 3.1Å; S806-Q808 PolarHBondContact O-N 3.22Å
807	N	39.1	Very low	53.9	Low	177 Å²	177	86 Å²	86	95%	0.947	50%	0.5	S	S	*	.			trans	-56.7	27.4	172.5	-75.7	-23.3	0	0	0	115.8	D805 S809	D805-N807 PolarHBondContact O-N 3.44Å; N807-S809 PolarHBondContact O-N 2.98Å; N807-S809 VanDerWaalsContact O-N 3.14Å
808	Q	36.1	Very low	53.3	Low	156.25 Å²	156.25	89.9 Å²	89.9	73%	0.73	52%	0.522	S	S	*	.			trans	-77.8	105.5	158.6	-69.9	-178.3	12.1	0	0	106.7	S806 C810	S806-Q808 PolarHBondContact O-N 3.22Å; Q808-C810 PolarHBondContact O-N 3.17Å; Q808-C810 VanDerWaalsContact O-N 3.16Å
809	S	39.1	Very low	52.7	Low	70 Å²	70	86.6 Å²	86.6	49%	0.49	51%	0.509	S	S	.	.			trans	-40.9	127.5	158.1	49.7	0	0	0	0	108	N807 N811	N807-S809 PolarHBondContact O-N 2.98Å; N807-S809 VanDerWaalsContact O-N 3.14Å; S809-N811 WeakPolarHBondContact CB-OD1 3.39Å; S809-N811 PolarHBondContact O-N 3.12Å; S809-N811 PolarHBondContact O-OD1 2.96Å; S809-N811 PolarHBondContact OG-OD1 3.13Å
810	C	40.1	Very low	52.1	Low	63.75 Å²	63.75	84.7 Å²	84.7	43%	0.431	50%	0.495	S	S	.	.			trans	-61.7	89	166.7	21.4	0	0	0	0	106.2	Q808 L812 L944 P946	Q808-C810 PolarHBondContact O-N 3.17Å; Q808-C810 VanDerWaalsContact O-N 3.16Å; C810-L812 VanDerWaalsContact C-N 3.29Å; C810-L812 HydrophobicContact CB-CG 4.33Å; C810-L812 PolarHBondContact O-N 3.06Å; C810-L944 VanDerWaalsContact SG-CD2 3.55Å; C810-P946 WeakPolarHBondContact O-CB 3.47Å; C810-P946 VanDerWaalsContact SG-CG 3.59Å
811	N	43.2	Very low	51.9	Low	119.75 Å²	119.75	84.3 Å²	84.3	64%	0.64	49%	0.491	S	S	*	.			trans	-68.9	84.5	173.4	-74.3	-9.1	0	0	0	105.5	S809 T813	S809-N811 WeakPolarHBondContact CB-OD1 3.39Å; S809-N811 PolarHBondContact O-N 3.12Å; S809-N811 PolarHBondContact O-OD1 2.96Å; S809-N811 PolarHBondContact OG-OD1 3.13Å; N811-T813 PolarHBondContact O-N 3.17Å
812	L	49.2	Very low	51.9	Low	38.25 Å²	38.25	81 Å²	81	20%	0.2	47%	0.468	C	S	.	.			trans	-64.5	83.6	166.9	-61.6	177.4	0	0	0	105.8	V800 C810 A814 Y821 L944 L945 P946 C951 L953	V800-L812 HydrophobicContact CG2-CD2 4.24Å; C810-L812 VanDerWaalsContact C-N 3.29Å; C810-L812 HydrophobicContact CB-CG 4.33Å; C810-L812 PolarHBondContact O-N 3.06Å; L812-A814 PolarHBondContact O-N 3.03Å; L812-A814 VanDerWaalsContact O-N 3.1Å; L812-Y821 HydrophobicContact CB-CE2 4.32Å; L812-Y821 HydrophobicContact CD1-CD2 4.25Å; L812-Y821 HydrophobicContact CD1-CE2 4.4Å; L812-Y821 HydrophobicContact CD1-CG 4.13Å; L812-Y821 HydrophobicContact CD2-CD1 3.87Å; L812-Y821 HydrophobicContact CD2-CD2 4.42Å; L812-Y821 HydrophobicContact CD2-CE1 3.67Å; L812-Y821 HydrophobicContact CD2-CE2 4.28Å; L812-Y821 HydrophobicContact CD2-CG 4.31Å; L812-L944 WeakPolarHBondContact CD1-O 3.2Å; L812-L945 HydrophobicContact CD1-CD2 3.66Å; L812-P946 HydrophobicContact CB-CG 4.15Å; L812-P946 HydrophobicContact CD1-CB 4.29Å; L812-P946 HydrophobicContact CD1-CG 3.62Å; L812-P946 HydrophobicContact CD2-CG 4.31Å; L812-P946 HydrophobicContact CG-CB 4.02Å; L812-P946 HydrophobicContact CG-CG 3.7Å; L812-C951 HydrophobicContact CD1-CB 4.47Å; L812-L953 HydrophobicContact CD1-CD2 4.47Å
813	T	47.7	Very low	52.2	Low	90.75 Å²	90.75	78.7 Å²	78.7	56%	0.557	46%	0.455	S	S	*	.			trans	-63.7	120.9	164.9	48.1	0	0	0	0	105.7	N811 D815 Y821	N811-T813 PolarHBondContact O-N 3.17Å; T813-D815 VanDerWaalsContact C-N 3.32Å; T813-D815 PolarHBondContact O-N 3.04Å; T813-D815 PolarHBondContact OG1-OD1 3.21Å; T813-D815 PolarHBondContact OG1-OD2 3.15Å; T813-Y821 PolarHBondContact O-OH 3.13Å; T813-Y821 VanDerWaalsContact O-OH 3.09Å
814	A	48.9	Very low	53.1	Low	76.5 Å²	76.5	75.5 Å²	75.5	63%	0.632	44%	0.439	S	S	*	.			trans	-65.1	84.7	174	0	0	0	0	0	108.4	L812 S816	L812-A814 PolarHBondContact O-N 3.03Å; L812-A814 VanDerWaalsContact O-N 3.1Å; A814-S816 PolarHBondContact O-N 2.94Å
815	D	53.9	Low	54.3	Low	99 Å²	99	70.3 Å²	70.3	53%	0.529	41%	0.411	S	S	.	.	S	Bend	trans	-64.3	-34	174.1	-64.6	-30.9	0	0	0	109.9	K798 T813	K798-D815 VanDerWaalsContact NZ-CG 3.25Å; K798-D815 IonicContact NZ-OD1 2.86Å; K798-D815 IonicContact NZ-OD2 2.87Å; K798-D815 PolarHBondContact NZ-OD2 3.1Å; T813-D815 VanDerWaalsContact C-N 3.32Å; T813-D815 PolarHBondContact O-N 3.04Å; T813-D815 PolarHBondContact OG1-OD1 3.21Å; T813-D815 PolarHBondContact OG1-OD2 3.15Å
816	S	55.3	Low	55.7	Low	50.75 Å²	50.75	63.5 Å²	63.5	36%	0.355	38%	0.375	S	S	.	.			trans	-134.5	149.2	173.7	93.8	0	0	0	0	111.2	A814 D818 T819	A814-S816 PolarHBondContact O-N 2.94Å; S816-D818 PolarHBondContact O-N 2.89Å; S816-D818 PolarHBondContact OG-N 3Å; S816-T819 WeakPolarHBondContact O-CB 3.37Å; S816-T819 PolarHBondContact O-N 3.24Å; S816-T819 PolarHBondContact O-OG1 3Å; S816-T819 PolarHBondContact OG-N 3.21Å; S816-T819 PolarHBondContact OG-OG1 3.23Å
817	P	58.5	Low	57.3	Low	125.5 Å²	125.5	61.5 Å²	61.5	82%	0.815	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.2	176.4	25.5	-34.7	0	0	0	114	T819	P817-T819 PolarHBondContact O-N 3.33Å
818	D	60.1	Low	58.8	Low	111.75 Å²	111.75	53.6 Å²	53.6	60%	0.598	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	5.6	-178.1	-55.8	-30	0	0	0	113.5	S816 V820	S816-D818 PolarHBondContact O-N 2.89Å; S816-D818 PolarHBondContact OG-N 3Å; D818-V820 PolarHBondContact O-N 3.14Å
819	T	61.8	Low	60.5	Low	17 Å²	17	46.9 Å²	46.9	10%	0.104	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-78	116.2	-179.4	-53.6	0	0	0	0	110.7	N796 K798 S816 P817 Y821	N796-T819 CarbonylContact O-C 3.38Å; N796-T819 WeakPolarHBondContact O-CA 3.41Å; K798-T819 HydrophobicContact CB-CG2 4.18Å; K798-T819 HydrophobicContact CD-CG2 3.82Å; K798-T819 HydrophobicContact CG-CG2 3.94Å; S816-T819 WeakPolarHBondContact O-CB 3.37Å; S816-T819 PolarHBondContact O-N 3.24Å; S816-T819 PolarHBondContact O-OG1 3Å; S816-T819 PolarHBondContact OG-N 3.21Å; S816-T819 PolarHBondContact OG-OG1 3.23Å; P817-T819 PolarHBondContact O-N 3.33Å; T819-Y821 HydrophobicContact CG2-CE1 4.17Å; T819-Y821 HydrophobicContact CG2-CE2 4.2Å
820	V	65.8	Low	62.2	Low	25.75 Å²	25.75	44.9 Å²	44.9	16%	0.156	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.5	174	-177.1	0	0	0	0	109	N796 H797 K798 D818 V822 L861 C952 L954	N796-V820 PolarHBondContact O-N 3.15Å; H797-V820 CarbonylContact C-O 3.41Å; H797-V820 VanDerWaalsContact CA-O 3.31Å; H797-V820 WeakPolarHBondContact CA-O 3.45Å; K798-V820 PolarHBondContact N-O 3.22Å; D818-V820 PolarHBondContact O-N 3.14Å; V820-V822 HydrophobicContact CG1-CG2 4.16Å; V820-L861 HydrophobicContact CG2-CD2 3.99Å; V820-C952 HydrophobicContact CG1-CB 4.46Å; V820-C952 HydrophobicContact CG2-CB 4.34Å; V820-L954 HydrophobicContact CG1-CB 3.94Å; V820-L954 HydrophobicContact CG1-CD1 3.66Å
821	Y	67.9	Low	63.6	Low	12.5 Å²	12.5	42.8 Å²	42.8	5%	0.049	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	128.2	177	-69.2	-74.3	0	0	0	110.4	K798 V800 L812 T813 T819 C951 C952 L953 L954	K798-Y821 HydrophobicContact CB-CD1 4.12Å; K798-Y821 HydrophobicContact CB-CE1 4.21Å; K798-Y821 HydrophobicContact CD-CE1 4.25Å; K798-Y821 WeakPolarHBondContact O-CA 3.32Å; V800-Y821 HydrophobicContact CG2-CD1 3.7Å; V800-Y821 VanDerWaalsContact CG2-CD1 3.42Å; V800-Y821 HydrophobicContact CG2-CE1 4.4Å; V800-Y821 HydrophobicContact CG2-CG 4.12Å; L812-Y821 HydrophobicContact CB-CE2 4.32Å; L812-Y821 HydrophobicContact CD1-CD2 4.25Å; L812-Y821 HydrophobicContact CD1-CE2 4.4Å; L812-Y821 HydrophobicContact CD1-CG 4.13Å; L812-Y821 HydrophobicContact CD2-CD1 3.87Å; L812-Y821 HydrophobicContact CD2-CD2 4.42Å; L812-Y821 HydrophobicContact CD2-CE1 3.67Å; L812-Y821 HydrophobicContact CD2-CE2 4.28Å; L812-Y821 HydrophobicContact CD2-CG 4.31Å; T813-Y821 PolarHBondContact O-OH 3.13Å; T813-Y821 VanDerWaalsContact O-OH 3.09Å; T819-Y821 HydrophobicContact CG2-CE1 4.17Å; T819-Y821 HydrophobicContact CG2-CE2 4.2Å; Y821-C951 HydrophobicContact CD2-CB 3.85Å; Y821-C951 HydrophobicContact CE2-CB 4.01Å; Y821-C952 PolarHBondContact N-O 2.99Å; Y821-L953 CarbonylContact O-C 3.58Å; Y821-L953 VanDerWaalsContact O-CA 3.3Å; Y821-L953 WeakPolarHBondContact O-CA 3.19Å; Y821-L954 PolarHBondContact O-N 3.2Å; Y821-L954 VanDerWaalsContact O-N 3.09Å
822	V	68.9	Low	64.8	Low	0 Å²	0	38.9 Å²	38.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	135.9	-168.8	-173.2	0	0	0	0	109.8	F787 F790 H797 K798 S799 V800 V820 L954 Y956	F787-V822 HydrophobicContact CD2-CG1 4.45Å; F787-V822 HydrophobicContact CE2-CB 4.09Å; F787-V822 HydrophobicContact CE2-CG1 3.61Å; F787-V822 HydrophobicContact CZ-CB 4.04Å; F787-V822 HydrophobicContact CZ-CG1 3.61Å; F787-V822 WeakPolarHBondContact CZ-O 3.19Å; F790-V822 HydrophobicContact CD1-CG1 4.29Å; F790-V822 HydrophobicContact CE1-CG1 3.96Å; F790-V822 HydrophobicContact CE1-CG2 4.19Å; H797-V822 HydrophobicContact CB-CG2 3.92Å; K798-V822 PolarHBondContact O-N 3.11Å; K798-V822 VanDerWaalsContact O-N 3.07Å; S799-V822 CarbonylContact C-O 3.42Å; S799-V822 WeakPolarHBondContact CA-O 3.49Å; V800-V822 PolarHBondContact N-O 3.16Å; V820-V822 HydrophobicContact CG1-CG2 4.16Å; V822-L954 VanDerWaalsContact CA-O 3.31Å; V822-L954 WeakPolarHBondContact CA-O 3.35Å; V822-L954 HydrophobicContact CG1-CB 4.28Å; V822-L954 HydrophobicContact CG1-CD2 4.3Å; V822-L954 HydrophobicContact CG1-CG 4.39Å; V822-L954 WeakPolarHBondContact CG1-O 3.31Å; V822-L954 HydrophobicContact CG2-CB 4.3Å; V822-L954 HydrophobicContact CG2-CD2 4.32Å; V822-Y956 HydrophobicContact CB-CD2 4.21Å; V822-Y956 HydrophobicContact CB-CE2 4.34Å; V822-Y956 HydrophobicContact CG1-CD2 3.35Å; V822-Y956 HydrophobicContact CG1-CE2 3.62Å; V822-Y956 HydrophobicContact CG1-CG 3.85Å; V822-Y956 HydrophobicContact CG2-CD2 4.2Å; V822-Y956 HydrophobicContact CG2-CE2 3.92Å
823	Y	72.1	Confident	65.7	Low	8 Å²	8	38.3 Å²	38.3	3%	0.031	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	154.1	176.1	43	-91.7	0	0	0	111.4	F787 L802 V828 L854 I856 I940 L953 L954 A955 Y956	F787-Y823 VanDerWaalsContact CE2-C 3.44Å; L802-Y823 HydrophobicContact CD1-CD1 4.04Å; L802-Y823 HydrophobicContact CD1-CE1 4.07Å; L802-Y823 HydrophobicContact CD1-CG 4.21Å; L802-Y823 HydrophobicContact CD2-CD1 4.47Å; L802-Y823 HydrophobicContact CD2-CE1 4.05Å; L802-Y823 HydrophobicContact CG-CD1 3.68Å; L802-Y823 HydrophobicContact CG-CE1 3.65Å; Y823-V828 HydrophobicContact CD2-CB 4.48Å; Y823-V828 HydrophobicContact CD2-CG2 3.31Å; Y823-V828 VanDerWaalsContact CD2-CG2 3.47Å; Y823-V828 HydrophobicContact CE2-CB 4.47Å; Y823-V828 HydrophobicContact CE2-CG2 3.55Å; Y823-V828 HydrophobicContact CG-CG2 4.31Å; Y823-L854 HydrophobicContact CE1-CB 4.45Å; Y823-L854 HydrophobicContact CE1-CD1 4.05Å; Y823-L854 HydrophobicContact CE1-CD2 4.47Å; Y823-L854 WeakPolarHBondContact OH-CB 3.22Å; Y823-L854 WeakPolarHBondContact OH-CD1 3.27Å; Y823-I856 WeakPolarHBondContact OH-CD1 3.34Å; Y823-I940 HydrophobicContact CE1-CD1 4.43Å; Y823-I940 HydrophobicContact CE2-CD1 3.66Å; Y823-I940 WeakPolarHBondContact OH-CD1 3.33Å; Y823-L953 HydrophobicContact CD1-CD2 4.26Å; Y823-L953 HydrophobicContact CE1-CB 4.31Å; Y823-L953 HydrophobicContact CE2-CB 4.15Å; Y823-L953 HydrophobicContact CE2-CD1 4.16Å; Y823-L953 HydrophobicContact CE2-CD2 4.1Å; Y823-L953 HydrophobicContact CE2-CG 4.35Å; Y823-L954 WeakPolarHBondContact CD1-O 3.32Å; Y823-L954 PolarHBondContact N-O 3.19Å; Y823-A955 HydrophobicContact CD2-CB 4.19Å; Y823-A955 HydrophobicContact CE1-CB 4.11Å; Y823-A955 HydrophobicContact CE2-CB 3.53Å; Y823-A955 VanDerWaalsContact CZ-CB 3.49Å; Y823-A955 WeakPolarHBondContact O-CA 3.43Å; Y823-A955 WeakPolarHBondContact OH-CB 3.25Å; Y823-Y956 WeakPolarHBondContact O-CB 3.27Å; Y823-Y956 PolarHBondContact O-N 3.16Å; Y823-Y956 VanDerWaalsContact O-N 3.08Å
824	S	74.1	Confident	66.7	Low	6 Å²	6	38.1 Å²	38.1	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	133.6	174.5	123.3	0	0	0	0	111.2	L826 E827 V828	S824-L826 VanDerWaalsContact C-N 3.28Å; S824-L826 PolarHBondContact O-N 3.17Å; S824-E827 WeakPolarHBondContact CB-OE2 3.42Å; S824-E827 PolarHBondContact N-OE2 3.39Å; S824-E827 VanDerWaalsContact N-OE2 3.13Å; S824-E827 PolarHBondContact O-N 3.02Å; S824-E827 VanDerWaalsContact O-N 3.16Å; S824-E827 WeakPolarHBondContact OG-CB 3.14Å; S824-E827 VanDerWaalsContact OG-CD 3.23Å; S824-E827 WeakPolarHBondContact OG-CG 3.35Å; S824-E827 PolarHBondContact OG-N 3.13Å; S824-E827 PolarHBondContact OG-OE2 2.82Å; S824-V828 WeakPolarHBondContact O-CG2 3.38Å; S824-V828 PolarHBondContact O-N 3.2Å; S824-V828 VanDerWaalsContact O-N 3.11Å
825	V	73.2	Confident	67.5	Low	10.75 Å²	10.75	40.4 Å²	40.4	7%	0.065	22%	0.222	C	C	.	.	H	α-helix	trans	-58.2	-38.7	176.4	167.3	0	0	0	0	111.7	D348 E827 V828 E829 L936 M938 A955 Y956 R957	D348-V825 HydrophobicContact CB-CG1 3.93Å; V825-E827 VanDerWaalsContact C-N 3.32Å; V825-E827 PolarHBondContact O-N 3.24Å; V825-V828 WeakPolarHBondContact O-CB 3.5Å; V825-V828 PolarHBondContact O-N 3.1Å; V825-E829 HydrophobicContact CG1-CG 4.28Å; V825-E829 WeakPolarHBondContact CG1-OE1 3.26Å; V825-E829 WeakPolarHBondContact O-CG 3.31Å; V825-E829 PolarHBondContact O-N 3.13Å; V825-L936 HydrophobicContact CG1-CD2 4.22Å; V825-L936 HydrophobicContact CG2-CD1 4.37Å; V825-M938 HydrophobicContact CB-SD 4.01Å; V825-M938 HydrophobicContact CG1-CE 4.4Å; V825-M938 HydrophobicContact CG1-SD 3.44Å; V825-M938 WeakPolarHBondContact CG1-SD 3.45Å; V825-M938 HydrophobicContact CG2-SD 3.73Å; V825-A955 HydrophobicContact CG2-CB 3.84Å; V825-Y956 WeakPolarHBondContact CG2-O 3.45Å; V825-Y956 PolarHBondContact N-O 2.98Å; V825-R957 HydrophobicContact CB-CB 4.24Å; V825-R957 HydrophobicContact CB-CG 4.33Å; V825-R957 HydrophobicContact CG1-CG 4.5Å; V825-R957 HydrophobicContact CG2-CB 3.89Å; V825-R957 HydrophobicContact CG2-CG 3.96Å
826	L	75.5	Confident	67.8	Low	11.75 Å²	11.75	38.1 Å²	38.1	6%	0.062	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-33.3	178.4	-121.7	116.9	0	0	0	112.7	S741 T779 Q780 T783 S824 V828 E829 R830	S741-L826 WeakPolarHBondContact OG-CD2 3.43Å; T779-L826 HydrophobicContact CG2-CD1 4.25Å; T779-L826 HydrophobicContact CG2-CD2 4.31Å; Q780-L826 HydrophobicContact CB-CD2 4.25Å; T783-L826 HydrophobicContact CG2-CB 4.18Å; T783-L826 HydrophobicContact CG2-CD1 3.96Å; T783-L826 HydrophobicContact CG2-CD2 4.27Å; T783-L826 HydrophobicContact CG2-CG 4.39Å; T783-L826 WeakPolarHBondContact OG1-CD1 3.46Å; S824-L826 VanDerWaalsContact C-N 3.28Å; S824-L826 PolarHBondContact O-N 3.17Å; L826-V828 VanDerWaalsContact C-N 3.33Å; L826-E829 WeakPolarHBondContact CD2-OE2 3.32Å; L826-R830 VanDerWaalsContact CD2-NH2 3.28Å; L826-R830 WeakPolarHBondContact O-CB 3.21Å; L826-R830 WeakPolarHBondContact O-CD 3.3Å; L826-R830 VanDerWaalsContact O-CG 3.27Å; L826-R830 WeakPolarHBondContact O-CG 3.42Å; L826-R830 PolarHBondContact O-N 3.02Å; L826-R830 VanDerWaalsContact O-N 3.16Å
827	E	73.6	Confident	68	Low	20.75 Å²	20.75	37.3 Å²	37.3	10%	0.097	21%	0.207	C	C	.	.	H	α-helix	trans	-69.3	-40	173.9	-124	175.5	147.9	0	0	111.7	S801 L802 N803 S824 V825 R830 A831	S801-E827 WeakPolarHBondContact CA-OE1 3.38Å; S801-E827 WeakPolarHBondContact CB-OE1 3.4Å; S801-E827 PolarHBondContact OG-OE1 2.94Å; L802-E827 HydrophobicContact CB-CB 4.49Å; L802-E827 HydrophobicContact CD1-CB 4.23Å; L802-E827 PolarHBondContact N-OE1 3.07Å; N803-E827 VanDerWaalsContact CG-OE1 3.3Å; N803-E827 PolarHBondContact N-OE1 3.2Å; N803-E827 VanDerWaalsContact N-OE1 3.14Å; N803-E827 PolarHBondContact ND2-OE1 3.09Å; S824-E827 WeakPolarHBondContact CB-OE2 3.42Å; S824-E827 PolarHBondContact N-OE2 3.39Å; S824-E827 VanDerWaalsContact N-OE2 3.13Å; S824-E827 PolarHBondContact O-N 3.02Å; S824-E827 VanDerWaalsContact O-N 3.16Å; S824-E827 WeakPolarHBondContact OG-CB 3.14Å; S824-E827 VanDerWaalsContact OG-CD 3.23Å; S824-E827 WeakPolarHBondContact OG-CG 3.35Å; S824-E827 PolarHBondContact OG-N 3.13Å; S824-E827 PolarHBondContact OG-OE2 2.82Å; V825-E827 VanDerWaalsContact C-N 3.32Å; V825-E827 PolarHBondContact O-N 3.24Å; E827-R830 PolarHBondContact O-N 2.97Å; E827-A831 VanDerWaalsContact O-CB 3.3Å; E827-A831 WeakPolarHBondContact O-CB 3.47Å; E827-A831 PolarHBondContact O-N 3.18Å
828	V	71	Confident	67.9	Low	10.25 Å²	10.25	36.5 Å²	36.5	6%	0.062	19%	0.194	C	C	.	.	H	α-helix	trans	-63.3	-48.8	176	174.6	0	0	0	0	111	L802 Y823 S824 V825 L826 R830 A831 A832 L936 M938 L939 I940 A955	L802-V828 HydrophobicContact CD1-CB 4.38Å; L802-V828 HydrophobicContact CD1-CG2 3.67Å; L802-V828 HydrophobicContact CD2-CG2 4.02Å; Y823-V828 HydrophobicContact CD2-CB 4.48Å; Y823-V828 HydrophobicContact CD2-CG2 3.31Å; Y823-V828 VanDerWaalsContact CD2-CG2 3.47Å; Y823-V828 HydrophobicContact CE2-CB 4.47Å; Y823-V828 HydrophobicContact CE2-CG2 3.55Å; Y823-V828 HydrophobicContact CG-CG2 4.31Å; S824-V828 WeakPolarHBondContact O-CG2 3.38Å; S824-V828 PolarHBondContact O-N 3.2Å; S824-V828 VanDerWaalsContact O-N 3.11Å; V825-V828 WeakPolarHBondContact O-CB 3.5Å; V825-V828 PolarHBondContact O-N 3.1Å; L826-V828 VanDerWaalsContact C-N 3.33Å; V828-R830 VanDerWaalsContact C-N 3.25Å; V828-R830 PolarHBondContact O-N 3.19Å; V828-A831 PolarHBondContact O-N 3.35Å; V828-A831 VanDerWaalsContact O-N 3.15Å; V828-A832 VanDerWaalsContact O-CB 3.3Å; V828-A832 WeakPolarHBondContact O-CB 3.32Å; V828-A832 PolarHBondContact O-N 2.89Å; V828-L936 HydrophobicContact CG1-CD2 4.13Å; V828-M938 HydrophobicContact CG1-CE 3.89Å; V828-M938 HydrophobicContact CG1-SD 3.77Å; V828-M938 WeakPolarHBondContact CG1-SD 3.31Å; V828-L939 HydrophobicContact CG1-CB 4.03Å; V828-L939 HydrophobicContact CG1-CD1 3.96Å; V828-L939 HydrophobicContact CG1-CD2 4.27Å; V828-L939 HydrophobicContact CG1-CG 4.29Å; V828-I940 HydrophobicContact CB-CD1 4.22Å; V828-I940 HydrophobicContact CG1-CD1 3.43Å; V828-I940 VanDerWaalsContact CG1-CD1 3.43Å; V828-I940 HydrophobicContact CG1-CG1 3.9Å; V828-I940 HydrophobicContact CG1-CG2 4.46Å; V828-I940 HydrophobicContact CG2-CD1 3.82Å; V828-A955 HydrophobicContact CG2-CB 4.44Å
829	E	71.6	Confident	67.3	Low	15.5 Å²	15.5	35 Å²	35	7%	0.072	19%	0.192	C	C	.	.	H	α-helix	trans	-58.2	-41.2	178.4	-73.6	176.5	178	0	0	111.3	N347 S741 V825 L826 A831 A832 F833 M938	N347-E829 WeakPolarHBondContact CA-OE1 3.43Å; N347-E829 PolarHBondContact N-OE1 2.89Å; S741-E829 WeakPolarHBondContact CB-OE2 3.07Å; S741-E829 PolarHBondContact OG-OE2 2.79Å; V825-E829 HydrophobicContact CG1-CG 4.28Å; V825-E829 WeakPolarHBondContact CG1-OE1 3.26Å; V825-E829 WeakPolarHBondContact O-CG 3.31Å; V825-E829 PolarHBondContact O-N 3.13Å; L826-E829 WeakPolarHBondContact CD2-OE2 3.32Å; E829-A831 VanDerWaalsContact C-N 3.32Å; E829-A831 PolarHBondContact O-N 2.88Å; E829-A832 WeakPolarHBondContact O-CB 3.45Å; E829-A832 PolarHBondContact O-N 2.93Å; E829-A832 VanDerWaalsContact O-N 3.14Å; E829-F833 WeakPolarHBondContact O-CB 3.4Å; E829-F833 VanDerWaalsContact O-CD2 3.3Å; E829-F833 WeakPolarHBondContact O-CD2 3.4Å; E829-F833 PolarHBondContact O-N 3.07Å; E829-M938 HydrophobicContact CG-CE 3.84Å
830	R	73.2	Confident	66.6	Low	28.75 Å²	28.75	39.4 Å²	39.4	11%	0.108	22%	0.219	C	C	.	.	H	α-helix	trans	-66.2	-43.1	174.9	-74.1	174.2	159	174.8	2.4	113	S742 E744 Q780 E784 L826 E827 V828 A832 F833 K834	S742-R830 PolarHBondContact OG-NE 2.96Å; S742-R830 PolarHBondContact OG-NH2 2.7Å; E744-R830 IonicContact OE1-CZ 2.96Å; E744-R830 IonicContact OE1-NE 3.31Å; E744-R830 IonicContact OE1-NH2 2.82Å; E744-R830 PolarHBondContact OE1-NH2 3.17Å; E744-R830 IonicContact OE2-CZ 2.81Å; E744-R830 IonicContact OE2-NE 3.46Å; E744-R830 PolarHBondContact OE2-NE 3.38Å; E744-R830 IonicContact OE2-NH2 3.42Å; E744-R830 PolarHBondContact OE2-NH2 3.41Å; Q780-R830 VanDerWaalsContact OE1-NH2 3.11Å; E784-R830 IonicContact OE1-NH1 2.65Å; L826-R830 VanDerWaalsContact CD2-NH2 3.28Å; L826-R830 WeakPolarHBondContact O-CB 3.21Å; L826-R830 WeakPolarHBondContact O-CD 3.3Å; L826-R830 VanDerWaalsContact O-CG 3.27Å; L826-R830 WeakPolarHBondContact O-CG 3.42Å; L826-R830 PolarHBondContact O-N 3.02Å; L826-R830 VanDerWaalsContact O-N 3.16Å; E827-R830 PolarHBondContact O-N 2.97Å; V828-R830 VanDerWaalsContact C-N 3.25Å; V828-R830 PolarHBondContact O-N 3.19Å; R830-A832 VanDerWaalsContact C-N 3.32Å; R830-F833 PolarHBondContact O-N 3.18Å; R830-K834 WeakPolarHBondContact O-CB 3.37Å; R830-K834 VanDerWaalsContact O-CG 3.31Å; R830-K834 WeakPolarHBondContact O-CG 3.28Å; R830-K834 PolarHBondContact O-N 3.08Å
831	A	70.3	Confident	65.7	Low	19.25 Å²	19.25	45.9 Å²	45.9	16%	0.159	25%	0.245	C	C	.	.	H	α-helix	trans	-64.6	-43.1	179.1	0	0	0	0	0	111.4	L802 E827 V828 E829 F833 K834 K835 L939 L944	L802-A831 HydrophobicContact CB-CB 4.26Å; L802-A831 HydrophobicContact CD1-CB 4.32Å; L802-A831 HydrophobicContact CD2-CB 3.8Å; E827-A831 VanDerWaalsContact O-CB 3.3Å; E827-A831 WeakPolarHBondContact O-CB 3.47Å; E827-A831 PolarHBondContact O-N 3.18Å; V828-A831 PolarHBondContact O-N 3.35Å; V828-A831 VanDerWaalsContact O-N 3.15Å; E829-A831 VanDerWaalsContact C-N 3.32Å; E829-A831 PolarHBondContact O-N 2.88Å; A831-F833 VanDerWaalsContact C-N 3.3Å; A831-F833 PolarHBondContact O-N 3.17Å; A831-K834 PolarHBondContact O-N 3.13Å; A831-K835 WeakPolarHBondContact O-CB 3.46Å; A831-K835 WeakPolarHBondContact O-CG 3.31Å; A831-K835 PolarHBondContact O-N 2.84Å; A831-K835 VanDerWaalsContact O-N 3.11Å; A831-L939 HydrophobicContact CB-CD2 4.07Å; A831-L944 HydrophobicContact CB-CD2 4.19Å
832	A	67.8	Low	64.4	Low	38.75 Å²	38.75	51 Å²	51	32%	0.32	27%	0.273	S	S	.	.	H	α-helix	trans	-61.6	-43.1	174.7	0	0	0	0	0	111.5	V828 E829 R830 K835 S836 L939 L944	V828-A832 VanDerWaalsContact O-CB 3.3Å; V828-A832 WeakPolarHBondContact O-CB 3.32Å; V828-A832 PolarHBondContact O-N 2.89Å; E829-A832 WeakPolarHBondContact O-CB 3.45Å; E829-A832 PolarHBondContact O-N 2.93Å; E829-A832 VanDerWaalsContact O-N 3.14Å; R830-A832 VanDerWaalsContact C-N 3.32Å; A832-K835 WeakPolarHBondContact O-CB 3.41Å; A832-K835 PolarHBondContact O-N 3.05Å; A832-S836 PolarHBondContact O-N 3.19Å; A832-S836 PolarHBondContact O-OG 3.29Å; A832-L939 HydrophobicContact CB-CD1 3.51Å; A832-L939 HydrophobicContact CB-CD2 3.81Å; A832-L939 HydrophobicContact CB-CG 4.2Å; A832-L944 HydrophobicContact CB-CD1 4.19Å
833	F	67.9	Low	62.6	Low	24.5 Å²	24.5	59.2 Å²	59.2	11%	0.107	31%	0.311	C	S	.	.	H	α-helix	trans	-66.1	-38.4	177.5	-158.2	-95.2	0	0	0	113.4	Y740 E744 Q745 H748 E829 R830 A831 K835 S836 T837	Y740-F833 HydrophobicContact CE1-CZ 4.48Å; E744-F833 HydrophobicContact CB-CD1 4.33Å; E744-F833 HydrophobicContact CB-CE1 4.36Å; Q745-F833 HydrophobicContact CB-CD2 4.42Å; Q745-F833 HydrophobicContact CB-CE2 4.42Å; Q745-F833 HydrophobicContact CG-CB 4.24Å; Q745-F833 HydrophobicContact CG-CD1 4.04Å; Q745-F833 HydrophobicContact CG-CD2 3.9Å; Q745-F833 HydrophobicContact CG-CE1 4.01Å; Q745-F833 HydrophobicContact CG-CE2 3.88Å; Q745-F833 HydrophobicContact CG-CG 3.72Å; Q745-F833 HydrophobicContact CG-CZ 3.82Å; Q745-F833 VanDerWaalsContact NE2-CE2 3.34Å; H748-F833 HydrophobicContact CB-CE1 4.25Å; H748-F833 HydrophobicContact CB-CE2 3.89Å; H748-F833 HydrophobicContact CB-CZ 3.29Å; H748-F833 AromaticContact CD2-CE2 3.59Å; H748-F833 AromaticContact CD2-CZ 3.7Å; H748-F833 AromaticContact CG-CE2 3.62Å; H748-F833 AromaticContact CG-CZ 3.47Å; E829-F833 WeakPolarHBondContact O-CB 3.4Å; E829-F833 VanDerWaalsContact O-CD2 3.3Å; E829-F833 WeakPolarHBondContact O-CD2 3.4Å; E829-F833 PolarHBondContact O-N 3.07Å; R830-F833 PolarHBondContact O-N 3.18Å; A831-F833 VanDerWaalsContact C-N 3.3Å; A831-F833 PolarHBondContact O-N 3.17Å; F833-K835 VanDerWaalsContact C-N 3.32Å; F833-K835 PolarHBondContact O-N 3Å; F833-S836 WeakPolarHBondContact CA-OG 3.29Å; F833-S836 PolarHBondContact O-N 3.14Å; F833-S836 PolarHBondContact O-OG 3.06Å; F833-S836 VanDerWaalsContact O-OG 3.09Å; F833-T837 HydrophobicContact CD1-CG2 4.43Å; F833-T837 HydrophobicContact CE1-CG2 3.66Å; F833-T837 HydrophobicContact CE2-CG2 4.4Å; F833-T837 HydrophobicContact CZ-CG2 3.56Å; F833-T837 WeakPolarHBondContact CZ-OG1 3.4Å; F833-T837 VanDerWaalsContact O-CB 3.31Å; F833-T837 WeakPolarHBondContact O-CB 3.37Å; F833-T837 PolarHBondContact O-N 2.9Å; F833-T837 VanDerWaalsContact O-N 3.16Å; F833-T837 PolarHBondContact O-OG1 3.01Å
834	K	69.1	Low	60.7	Low	87.25 Å²	87.25	62.5 Å²	62.5	38%	0.379	35%	0.348	S	S	.	.	H	α-helix	trans	-62.2	-41.4	172.1	-75.2	177	180	-178.9	0	111.4	N803 D805 R830 A831 T837 I838	N803-K834 PolarHBondContact OD1-NZ 3.42Å; D805-K834 IonicContact OD1-NZ 3.45Å; D805-K834 IonicContact OD2-NZ 3.71Å; D805-K834 PolarHBondContact OD2-NZ 2.59Å; R830-K834 WeakPolarHBondContact O-CB 3.37Å; R830-K834 VanDerWaalsContact O-CG 3.31Å; R830-K834 WeakPolarHBondContact O-CG 3.28Å; R830-K834 PolarHBondContact O-N 3.08Å; A831-K834 PolarHBondContact O-N 3.13Å; K834-T837 WeakPolarHBondContact CA-OG1 3.35Å; K834-T837 PolarHBondContact O-N 3Å; K834-T837 PolarHBondContact O-OG1 3.36Å; K834-T837 VanDerWaalsContact O-OG1 3.09Å; K834-I838 WeakPolarHBondContact O-CB 3.41Å; K834-I838 WeakPolarHBondContact O-CD1 3.39Å; K834-I838 VanDerWaalsContact O-CG1 3.26Å; K834-I838 WeakPolarHBondContact O-CG1 3.24Å; K834-I838 PolarHBondContact O-N 3.33Å
835	K	65.9	Low	58.7	Low	124.5 Å²	124.5	70.7 Å²	70.7	54%	0.541	39%	0.386	S	S	.	.	H	α-helix	trans	-65.3	-44.6	178.4	-92.3	-179.1	-179.2	-176.3	0	112.1	A831 A832 F833 T837 I838 S839 L944	A831-K835 WeakPolarHBondContact O-CB 3.46Å; A831-K835 WeakPolarHBondContact O-CG 3.31Å; A831-K835 PolarHBondContact O-N 2.84Å; A831-K835 VanDerWaalsContact O-N 3.11Å; A832-K835 WeakPolarHBondContact O-CB 3.41Å; A832-K835 PolarHBondContact O-N 3.05Å; F833-K835 VanDerWaalsContact C-N 3.32Å; F833-K835 PolarHBondContact O-N 3Å; K835-T837 VanDerWaalsContact C-N 3.34Å; K835-T837 PolarHBondContact O-N 3.15Å; K835-I838 PolarHBondContact O-N 3.25Å; K835-S839 PolarHBondContact O-N 2.96Å; K835-S839 VanDerWaalsContact O-N 3.1Å; K835-L944 HydrophobicContact CD-CD2 3.95Å; K835-L944 HydrophobicContact CD-CG 4.44Å
836	S	60.5	Low	56.7	Low	51.5 Å²	51.5	76.6 Å²	76.6	36%	0.36	42%	0.421	S	S	.	.	H	α-helix	trans	-64.6	-41.3	178	61.8	0	0	0	0	112.2	A832 F833 I838 S839 V840	A832-S836 PolarHBondContact O-N 3.19Å; A832-S836 PolarHBondContact O-OG 3.29Å; F833-S836 WeakPolarHBondContact CA-OG 3.29Å; F833-S836 PolarHBondContact O-N 3.14Å; F833-S836 PolarHBondContact O-OG 3.06Å; F833-S836 VanDerWaalsContact O-OG 3.09Å; S836-I838 VanDerWaalsContact C-N 3.3Å; S836-I838 PolarHBondContact O-N 2.84Å; S836-S839 WeakPolarHBondContact O-CB 3.45Å; S836-S839 PolarHBondContact O-N 3.24Å; S836-S839 VanDerWaalsContact O-N 3.15Å; S836-V840 WeakPolarHBondContact O-CG2 3.36Å; S836-V840 PolarHBondContact O-N 3.31Å; S836-V840 VanDerWaalsContact O-N 3.13Å
837	T	58.1	Low	54.6	Low	34.25 Å²	34.25	80.2 Å²	80.2	21%	0.21	45%	0.446	C	S	.	.	H	α-helix	trans	-65.3	-31.9	177.5	-7.3	0	0	0	0	113.3	F833 K834 K835 K841	F833-T837 HydrophobicContact CD1-CG2 4.43Å; F833-T837 HydrophobicContact CE1-CG2 3.66Å; F833-T837 HydrophobicContact CE2-CG2 4.4Å; F833-T837 HydrophobicContact CZ-CG2 3.56Å; F833-T837 WeakPolarHBondContact CZ-OG1 3.4Å; F833-T837 VanDerWaalsContact O-CB 3.31Å; F833-T837 WeakPolarHBondContact O-CB 3.37Å; F833-T837 PolarHBondContact O-N 2.9Å; F833-T837 VanDerWaalsContact O-N 3.16Å; F833-T837 PolarHBondContact O-OG1 3.01Å; K834-T837 WeakPolarHBondContact CA-OG1 3.35Å; K834-T837 PolarHBondContact O-N 3Å; K834-T837 PolarHBondContact O-OG1 3.36Å; K834-T837 VanDerWaalsContact O-OG1 3.09Å; K835-T837 VanDerWaalsContact C-N 3.34Å; K835-T837 PolarHBondContact O-N 3.15Å; T837-K841 HydrophobicContact CG2-CD 4.14Å; T837-K841 WeakPolarHBondContact O-CG 3.17Å; T837-K841 PolarHBondContact O-N 3.03Å
838	I	57.7	Low	52.4	Low	108.25 Å²	108.25	88.5 Å²	88.5	56%	0.555	48%	0.484	S	S	*	.	H	α-helix	trans	-73.6	-40.7	175.1	-67.5	165	0	0	0	111.1	K834 K835 S836 V840 K841 N842	K834-I838 WeakPolarHBondContact O-CB 3.41Å; K834-I838 WeakPolarHBondContact O-CD1 3.39Å; K834-I838 VanDerWaalsContact O-CG1 3.26Å; K834-I838 WeakPolarHBondContact O-CG1 3.24Å; K834-I838 PolarHBondContact O-N 3.33Å; K835-I838 PolarHBondContact O-N 3.25Å; S836-I838 VanDerWaalsContact C-N 3.3Å; S836-I838 PolarHBondContact O-N 2.84Å; I838-V840 VanDerWaalsContact C-N 3.33Å; I838-V840 PolarHBondContact O-N 3.05Å; I838-K841 PolarHBondContact O-N 3.12Å; I838-K841 VanDerWaalsContact O-N 3.15Å; I838-N842 PolarHBondContact O-N 3.38Å; I838-N842 PolarHBondContact O-ND2 3.04Å
839	S	47.2	Very low	50.5	Low	80 Å²	80	95.3 Å²	95.3	56%	0.559	51%	0.51	S	S	*	.	H	α-helix	trans	-60.5	-44	178.7	-178	0	0	0	0	112	K835 S836 K841 N842	K835-S839 PolarHBondContact O-N 2.96Å; K835-S839 VanDerWaalsContact O-N 3.1Å; S836-S839 WeakPolarHBondContact O-CB 3.45Å; S836-S839 PolarHBondContact O-N 3.24Å; S836-S839 VanDerWaalsContact O-N 3.15Å; S839-K841 VanDerWaalsContact C-N 3.32Å; S839-K841 PolarHBondContact O-N 3.12Å; S839-K841 VanDerWaalsContact O-N 3.17Å; S839-N842 CarbonylContact O-C 3.48Å; S839-N842 PolarHBondContact O-N 3.01Å; S839-N842 VanDerWaalsContact O-N 3.09Å
840	V	47.6	Very low	48.6	Very low	109 Å²	109	99.2 Å²	99.2	66%	0.661	54%	0.537	S	S	*	.	H	α-helix	trans	-61.5	-25	179.4	175.5	0	0	0	0	112.9	S836 I838	S836-V840 WeakPolarHBondContact O-CG2 3.36Å; S836-V840 PolarHBondContact O-N 3.31Å; S836-V840 VanDerWaalsContact O-N 3.13Å; I838-V840 VanDerWaalsContact C-N 3.33Å; I838-V840 PolarHBondContact O-N 3.05Å
841	K	47.2	Very low	46.8	Very low	162.75 Å²	162.75	106.7 Å²	106.7	71%	0.708	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-15	178.3	-70.8	-179.2	179.8	176.2	0	114.1	T837 I838 S839	T837-K841 HydrophobicContact CG2-CD 4.14Å; T837-K841 WeakPolarHBondContact O-CG 3.17Å; T837-K841 PolarHBondContact O-N 3.03Å; I838-K841 PolarHBondContact O-N 3.12Å; I838-K841 VanDerWaalsContact O-N 3.15Å; S839-K841 VanDerWaalsContact C-N 3.32Å; S839-K841 PolarHBondContact O-N 3.12Å; S839-K841 VanDerWaalsContact O-N 3.17Å
842	N	40	Very low	45.1	Very low	118.75 Å²	118.75	109.4 Å²	109.4	64%	0.635	59%	0.585	S	S	*	*	S	Bend	trans	-115.9	74.1	-177.3	-72.1	-23.7	0	0	0	111.7	I838 S839 G844	I838-N842 PolarHBondContact O-N 3.38Å; I838-N842 PolarHBondContact O-ND2 3.04Å; S839-N842 CarbonylContact O-C 3.48Å; S839-N842 PolarHBondContact O-N 3.01Å; S839-N842 VanDerWaalsContact O-N 3.09Å; N842-G844 PolarHBondContact O-N 3.05Å
843	H	31.4	Very low	43.5	Very low	172.5 Å²	172.5	116.4 Å²	116.4	80%	0.799	60%	0.603	S	S	*	*			trans	-66.8	113	171.9	-81.6	-72.5	0	0	0	113.4	E845	H843-E845 VanDerWaalsContact C-N 3.33Å; H843-E845 PolarHBondContact O-N 3.26Å
844	G	31.6	Very low	42	Very low	78 Å²	78	118.2 Å²	118.2	80%	0.804	61%	0.613	S	S	*	*			trans	148.4	67.3	155.8	0	0	0	0	0	115.5	N842	N842-G844 PolarHBondContact O-N 3.05Å
845	E	31.8	Very low	40.3	Very low	178.5 Å²	178.5	116.6 Å²	116.6	83%	0.834	62%	0.616	S	S	*	*			trans	-67.8	124.6	170.4	-65.2	177.1	179.4	0	0	113.1	H843 P847	H843-E845 VanDerWaalsContact C-N 3.33Å; H843-E845 PolarHBondContact O-N 3.26Å; E845-P847 VanDerWaalsContact O-CD 3.25Å; E845-P847 WeakPolarHBondContact O-CD 3.38Å
846	T	30.4	Very low	39	Very low	133 Å²	133	113.6 Å²	113.6	82%	0.816	61%	0.606	S	S	*	*			trans	-59.4	118.9	176.9	43.7	0	0	0	0	111.2	E848	T846-E848 PolarHBondContact O-N 3.05Å; T846-E848 VanDerWaalsContact O-N 3.09Å
847	P	31.9	Very low	37.7	Very low	87.75 Å²	87.75	112.4 Å²	112.4	57%	0.57	60%	0.599	S	S	*	*			trans	-74.5	116.7	174.1	20.6	-16.8	0	0	0	108.9	E845 Y849	E845-P847 VanDerWaalsContact O-CD 3.25Å; E845-P847 WeakPolarHBondContact O-CD 3.38Å; P847-Y849 HydrophobicContact CB-CD2 4.23Å; P847-Y849 HydrophobicContact CB-CE1 4.47Å; P847-Y849 HydrophobicContact CB-CE2 3.9Å; P847-Y849 HydrophobicContact CG-CD2 4.42Å; P847-Y849 HydrophobicContact CG-CE2 3.92Å; P847-Y849 VanDerWaalsContact CG-CE2 3.48Å; P847-Y849 VanDerWaalsContact O-CD2 3.29Å; P847-Y849 WeakPolarHBondContact O-CD2 3.36Å; P847-Y849 PolarHBondContact O-N 3.35Å
848	E	28.2	Very low	36.6	Very low	194.5 Å²	194.5	113.3 Å²	113.3	91%	0.909	61%	0.61	S	S	*	*			trans	-61.5	105.7	159.2	-80.5	-173.8	141.5	0	0	107.8	T846 P850	T846-E848 PolarHBondContact O-N 3.05Å; T846-E848 VanDerWaalsContact O-N 3.09Å; E848-P850 WeakPolarHBondContact O-CD 3.41Å; E848-P850 VanDerWaalsContact O-N 3.07Å
849	Y	30.7	Very low	35.4	Very low	154.25 Å²	154.25	110.8 Å²	110.8	61%	0.605	60%	0.602	S	S	*	*			trans	-68.5	128	175.9	-75.7	-91.4	0	0	0	109.6	P847 K851 M938	P847-Y849 HydrophobicContact CB-CD2 4.23Å; P847-Y849 HydrophobicContact CB-CE1 4.47Å; P847-Y849 HydrophobicContact CB-CE2 3.9Å; P847-Y849 HydrophobicContact CG-CD2 4.42Å; P847-Y849 HydrophobicContact CG-CE2 3.92Å; P847-Y849 VanDerWaalsContact CG-CE2 3.48Å; P847-Y849 VanDerWaalsContact O-CD2 3.29Å; P847-Y849 WeakPolarHBondContact O-CD2 3.36Å; P847-Y849 PolarHBondContact O-N 3.35Å; Y849-K851 PolarHBondContact O-N 3.04Å; Y849-K851 VanDerWaalsContact O-N 3.1Å; Y849-M938 HydrophobicContact CD1-CE 3.17Å; Y849-M938 HydrophobicContact CD2-CE 3.6Å; Y849-M938 HydrophobicContact CE1-CE 3.29Å; Y849-M938 HydrophobicContact CE2-CE 3.72Å; Y849-M938 HydrophobicContact CG-CE 3.32Å
850	P	32.9	Very low	34.7	Very low	97.25 Å²	97.25	109.5 Å²	109.5	63%	0.631	59%	0.593	S	S	*	*			trans	-66.5	118	174.7	28.1	-32.4	0	0	0	108.1	E848 T852 S942	E848-P850 WeakPolarHBondContact O-CD 3.41Å; E848-P850 VanDerWaalsContact O-N 3.07Å; P850-T852 HydrophobicContact CB-CG2 4.28Å; P850-T852 WeakPolarHBondContact CB-OG1 3.46Å; P850-T852 PolarHBondContact O-N 3.05Å; P850-T852 PolarHBondContact O-OG1 3.06Å; P850-T852 VanDerWaalsContact O-OG1 3.13Å; P850-S942 PolarHBondContact O-OG 3.46Å
851	K	34.7	Very low	34.1	Very low	185.25 Å²	185.25	108.2 Å²	108.2	81%	0.805	58%	0.582	S	S	*	*			trans	-67.9	61.5	174	-68	-179.4	178.8	177.4	0	111.1	Y849 R853 L939	Y849-K851 PolarHBondContact O-N 3.04Å; Y849-K851 VanDerWaalsContact O-N 3.1Å; K851-R853 VanDerWaalsContact C-N 3.34Å; K851-R853 PolarHBondContact O-N 3.11Å; K851-L939 HydrophobicContact CB-CD2 3.84Å; K851-L939 HydrophobicContact CD-CB 4.42Å
852	T	34.8	Very low	33.4	Very low	76.5 Å²	76.5	104 Å²	104	47%	0.469	57%	0.571	S	S	.	*			trans	-78.1	105.6	174.8	35.4	0	0	0	0	109.1	P850 L854 I940 D941 S942	P850-T852 HydrophobicContact CB-CG2 4.28Å; P850-T852 WeakPolarHBondContact CB-OG1 3.46Å; P850-T852 PolarHBondContact O-N 3.05Å; P850-T852 PolarHBondContact O-OG1 3.06Å; P850-T852 VanDerWaalsContact O-OG1 3.13Å; T852-L854 PolarHBondContact O-N 3.19Å; T852-L854 VanDerWaalsContact O-N 3.1Å; T852-I940 PolarHBondContact N-O 2.97Å; T852-D941 WeakPolarHBondContact CG2-OD2 3.18Å; T852-S942 VanDerWaalsContact CG2-CB 3.41Å; T852-S942 WeakPolarHBondContact CG2-OG 3.45Å; T852-S942 PolarHBondContact OG1-OG 3.46Å
853	R	33.8	Very low	33.3	Very low	185.5 Å²	185.5	101.7 Å²	101.7	70%	0.7	57%	0.565	S	S	*	*			trans	-68.5	105	177.7	-116.5	-178.5	-176.4	-178.1	0.1	108.5	K851 A855 S934 H937 L939	K851-R853 VanDerWaalsContact C-N 3.34Å; K851-R853 PolarHBondContact O-N 3.11Å; R853-A855 VanDerWaalsContact C-N 3.28Å; R853-A855 HydrophobicContact CB-CB 4.37Å; R853-A855 WeakPolarHBondContact O-CB 3.4Å; R853-A855 PolarHBondContact O-N 3.06Å; R853-S934 PolarHBondContact NH1-OG 3.35Å; R853-S934 PolarHBondContact NH2-O 3.36Å; R853-S934 VanDerWaalsContact NH2-O 3.08Å; R853-S934 PolarHBondContact NH2-OG 3.47Å; R853-H937 HydrophobicContact CG-CB 3.98Å; R853-L939 HydrophobicContact CB-CD2 4.48Å; R853-L939 HydrophobicContact CG-CD2 4.45Å
854	L	35.7	Very low	33.5	Very low	62 Å²	62	97.3 Å²	97.3	33%	0.325	56%	0.558	S	S	.	*			trans	-76.8	107.3	174.7	-116.5	135	0	0	0	108.6	Y823 T852 I856 H937 M938 I940 L945 L953	Y823-L854 HydrophobicContact CE1-CB 4.45Å; Y823-L854 HydrophobicContact CE1-CD1 4.05Å; Y823-L854 HydrophobicContact CE1-CD2 4.47Å; Y823-L854 WeakPolarHBondContact OH-CB 3.22Å; Y823-L854 WeakPolarHBondContact OH-CD1 3.27Å; T852-L854 PolarHBondContact O-N 3.19Å; T852-L854 VanDerWaalsContact O-N 3.1Å; L854-I856 PolarHBondContact O-N 2.76Å; L854-H937 VanDerWaalsContact CB-CE1 3.44Å; L854-H937 WeakPolarHBondContact CB-CE1 3.49Å; L854-H937 WeakPolarHBondContact CB-ND1 3.29Å; L854-H937 PolarHBondContact O-CE1 2.8Å; L854-H937 PolarHBondContact O-ND1 2.88Å; L854-H937 PolarHBondContact O-NE2 2.79Å; L854-M938 HydrophobicContact CD1-CE 3.48Å; L854-M938 VanDerWaalsContact CD1-CE 3.48Å; L854-M938 HydrophobicContact CD1-SD 3.69Å; L854-M938 PolarHBondContact N-O 3.14Å; L854-I940 HydrophobicContact CD1-CB 3.9Å; L854-I940 HydrophobicContact CD1-CD1 3.45Å; L854-I940 VanDerWaalsContact CD1-CD1 3.45Å; L854-I940 HydrophobicContact CD1-CG1 3.69Å; L854-L945 HydrophobicContact CD1-CD1 3.81Å; L854-L945 HydrophobicContact CD1-CD2 3.56Å; L854-L945 HydrophobicContact CD1-CG 4.35Å; L854-L945 HydrophobicContact CD2-CD1 4Å; L854-L945 HydrophobicContact CD2-CD2 3.73Å; L854-L945 HydrophobicContact CG-CD2 4.13Å; L854-L953 HydrophobicContact CD2-CB 3.57Å; L854-L953 HydrophobicContact CD2-CD1 3.74Å; L854-L953 VanDerWaalsContact CD2-CD1 3.49Å; L854-L953 HydrophobicContact CD2-CG 4.37Å
855	A	35.2	Very low	33.7	Very low	54.25 Å²	54.25	99.1 Å²	99.1	45%	0.448	55%	0.549	S	S	.	.			trans	-87.5	113.1	-178.5	0	0	0	0	0	109.1	R853 A857 T935 L954 A955	R853-A855 VanDerWaalsContact C-N 3.28Å; R853-A855 HydrophobicContact CB-CB 4.37Å; R853-A855 WeakPolarHBondContact O-CB 3.4Å; R853-A855 PolarHBondContact O-N 3.06Å; A855-A857 PolarHBondContact O-N 3.35Å; A855-T935 WeakPolarHBondContact CB-O 3.5Å; A855-L954 WeakPolarHBondContact O-CA 3.45Å; A855-A955 PolarHBondContact O-N 3.01Å; A855-A955 VanDerWaalsContact O-N 3.15Å
856	I	37.3	Very low	34	Very low	61.5 Å²	61.5	95.7 Å²	95.7	32%	0.315	54%	0.536	S	S	.	.			trans	-81.5	113.5	177.4	-58.3	170.9	0	0	0	107.3	Y823 L854 A858 I933 L936 A955 R957	Y823-I856 WeakPolarHBondContact OH-CD1 3.34Å; L854-I856 PolarHBondContact O-N 2.76Å; I856-A858 HydrophobicContact CG2-CB 4.44Å; I856-A858 PolarHBondContact O-N 2.95Å; I856-I933 HydrophobicContact CD1-CG2 4.11Å; I856-L936 HydrophobicContact CD1-CB 3.13Å; I856-L936 HydrophobicContact CD1-CG 4.47Å; I856-L936 WeakPolarHBondContact CD1-O 3.35Å; I856-L936 WeakPolarHBondContact O-CB 3.32Å; I856-L936 WeakPolarHBondContact O-CD2 3.43Å; I856-L936 WeakPolarHBondContact O-CG 3.47Å; I856-A955 HydrophobicContact CG2-CB 4.3Å; I856-A955 WeakPolarHBondContact CG2-O 3.45Å; I856-R957 VanDerWaalsContact CG2-NE 3.32Å
857	A	34.4	Very low	34.4	Very low	26.75 Å²	26.75	92.2 Å²	92.2	22%	0.221	52%	0.516	C	S	.	.			trans	-71	89	172.5	0	0	0	0	0	111.2	F790 A855 S859 L936 L954 A955 D960	F790-A857 HydrophobicContact CZ-CB 4.3Å; A855-A857 PolarHBondContact O-N 3.35Å; A857-S859 PolarHBondContact O-N 3.15Å; A857-L936 WeakPolarHBondContact CA-O 3.22Å; A857-L936 WeakPolarHBondContact CB-O 2.73Å; A857-L954 HydrophobicContact CB-CD1 4.22Å; A857-L954 HydrophobicContact CB-CD2 3.24Å; A857-L954 HydrophobicContact CB-CG 3.39Å; A857-A955 WeakPolarHBondContact CA-O 3.39Å; A857-A955 HydrophobicContact CB-CB 3.49Å; A857-A955 VanDerWaalsContact CB-CB 3.49Å; A857-A955 WeakPolarHBondContact CB-O 2.96Å; A857-A955 PolarHBondContact N-O 3.48Å; A857-D960 HydrophobicContact CB-CB 4.49Å; A857-D960 VanDerWaalsContact O-CG 3.26Å
858	A	35.2	Very low	34.8	Very low	52 Å²	52	91.9 Å²	91.9	43%	0.43	51%	0.512	S	S	.	.			trans	-95.4	45.8	159.4	0	0	0	0	0	109.4	I856 S860 L861 I927 L928 L936	I856-A858 HydrophobicContact CG2-CB 4.44Å; I856-A858 PolarHBondContact O-N 2.95Å; A858-S860 PolarHBondContact O-N 3Å; A858-L861 HydrophobicContact CB-CD1 3.73Å; A858-L861 HydrophobicContact CB-CG 4.41Å; A858-L861 PolarHBondContact O-N 3.46Å; A858-I927 HydrophobicContact CB-CG1 4.11Å; A858-I927 HydrophobicContact CB-CG2 4.36Å; A858-L928 HydrophobicContact CB-CD1 3.94Å; A858-L936 VanDerWaalsContact C-CD1 3.45Å; A858-L936 HydrophobicContact CB-CD1 4.04Å; A858-L936 WeakPolarHBondContact O-CD1 3.31Å
859	S	32.5	Very low	35.7	Very low	57.5 Å²	57.5	85.6 Å²	85.6	40%	0.402	48%	0.482	S	S	.	.			trans	-84.3	114.2	177.5	55.8	0	0	0	0	109.2	R794 A857 L861 H937	R794-S859 PolarHBondContact NH2-OG 3.26Å; A857-S859 PolarHBondContact O-N 3.15Å; S859-L861 PolarHBondContact O-N 3.11Å; S859-H937 VanDerWaalsContact CB-CE1 3.45Å; S859-H937 WeakPolarHBondContact CB-CE1 3.48Å
860	S	32.2	Very low	36.4	Very low	52.75 Å²	52.75	79.9 Å²	79.9	37%	0.369	46%	0.463	S	S	.	.			trans	58.2	86.9	160.7	56.4	0	0	0	0	115.2	A858 P862 H937 R965	A858-S860 PolarHBondContact O-N 3Å; S860-P862 VanDerWaalsContact O-CD 3.3Å; S860-P862 WeakPolarHBondContact O-CD 3.26Å; S860-H937 PolarHBondContact OG-CE1 3.4Å; S860-H937 PolarHBondContact OG-NE2 3.09Å; S860-H937 VanDerWaalsContact OG-NE2 3.07Å; S860-R965 PolarHBondContact OG-NH2 3.02Å
861	L	34.6	Very low	37.2	Very low	80.75 Å²	80.75	80.1 Å²	80.1	42%	0.423	46%	0.463	S	S	.	.			trans	-75.9	125.4	147.1	-86	117.9	0	0	0	107.2	V820 A858 S859 S863 D865 P925 T926 C1100	V820-L861 HydrophobicContact CG2-CD2 3.99Å; A858-L861 HydrophobicContact CB-CD1 3.73Å; A858-L861 HydrophobicContact CB-CG 4.41Å; A858-L861 PolarHBondContact O-N 3.46Å; S859-L861 PolarHBondContact O-N 3.11Å; L861-S863 PolarHBondContact O-N 2.77Å; L861-D865 HydrophobicContact CD2-CB 3.42Å; L861-D865 VanDerWaalsContact CD2-CB 3.42Å; L861-D865 HydrophobicContact CG-CB 3.98Å; L861-P925 HydrophobicContact CB-CG 3.82Å; L861-P925 HydrophobicContact CD1-CB 4.36Å; L861-P925 HydrophobicContact CD1-CG 3.89Å; L861-P925 HydrophobicContact CD2-CB 4.14Å; L861-P925 HydrophobicContact CD2-CG 3.75Å; L861-P925 HydrophobicContact CG-CG 4.03Å; L861-T926 HydrophobicContact CD2-CG2 3.21Å; L861-C1100 HydrophobicContact CD2-CB 4.38Å
862	P	33	Very low	38.2	Very low	73.75 Å²	73.75	73.3 Å²	73.3	48%	0.479	44%	0.435	S	S	.	.			trans	-57.8	137.2	177.9	19.6	-20.4	0	0	0	109.2	S860 A864 D865 I866 V920 L954	S860-P862 VanDerWaalsContact O-CD 3.3Å; S860-P862 WeakPolarHBondContact O-CD 3.26Å; P862-A864 PolarHBondContact O-N 3.1Å; P862-D865 PolarHBondContact O-N 3.16Å; P862-I866 HydrophobicContact CB-CD1 4.35Å; P862-V920 HydrophobicContact CB-CG1 4.49Å; P862-L954 HydrophobicContact CG-CD1 3.67Å; P862-L954 HydrophobicContact CG-CD2 4.11Å; P862-L954 HydrophobicContact CG-CG 4.45Å
863	S	36.2	Very low	39.2	Very low	71.75 Å²	71.75	71 Å²	71	50%	0.502	42%	0.421	S	S	.	.			trans	-70.5	68.8	177.1	9.4	0	0	0	0	112.4	L861 D865 I866 Y923 P1102	L861-S863 PolarHBondContact O-N 2.77Å; S863-D865 PolarHBondContact O-N 3.1Å; S863-I866 WeakPolarHBondContact O-CG1 3.27Å; S863-I866 PolarHBondContact O-N 3.46Å; S863-Y923 WeakPolarHBondContact OG-CD2 3.33Å; S863-P1102 WeakPolarHBondContact OG-CB 3.26Å
864	A	35.9	Very low	40.5	Very low	80.75 Å²	80.75	70.1 Å²	70.1	67%	0.667	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	3.7	175	0	0	0	0	0	114.8	P862 I866	P862-A864 PolarHBondContact O-N 3.1Å; A864-I866 VanDerWaalsContact C-N 3.28Å; A864-I866 PolarHBondContact O-N 3.06Å; A864-I866 VanDerWaalsContact O-O 3.13Å
865	D	35.6	Very low	41.7	Very low	115.5 Å²	115.5	72.8 Å²	72.8	62%	0.618	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	34	160.7	-73.7	-23.2	0	0	0	112.6	R794 L861 P862 S863 P867	R794-D865 IonicContact CZ-OD2 2.77Å; R794-D865 IonicContact NE-OD2 3.82Å; R794-D865 IonicContact NH2-OD1 2.67Å; R794-D865 IonicContact NH2-OD2 3.47Å; R794-D865 PolarHBondContact NH2-OD2 3.4Å; L861-D865 HydrophobicContact CD2-CB 3.42Å; L861-D865 VanDerWaalsContact CD2-CB 3.42Å; L861-D865 HydrophobicContact CG-CB 3.98Å; P862-D865 PolarHBondContact O-N 3.16Å; S863-D865 PolarHBondContact O-N 3.1Å; D865-P867 WeakPolarHBondContact O-CD 3.45Å
866	I	39.3	Very low	42.9	Very low	106.25 Å²	106.25	70.5 Å²	70.5	55%	0.545	42%	0.416	S	S	.	.	S	Bend	trans	-51.2	116.6	163.5	-57.1	167.8	0	0	0	107.5	P862 S863 A864 V868 E896	P862-I866 HydrophobicContact CB-CD1 4.35Å; S863-I866 WeakPolarHBondContact O-CG1 3.27Å; S863-I866 PolarHBondContact O-N 3.46Å; A864-I866 VanDerWaalsContact C-N 3.28Å; A864-I866 PolarHBondContact O-N 3.06Å; A864-I866 VanDerWaalsContact O-O 3.13Å; I866-V868 HydrophobicContact CB-CG2 3.88Å; I866-V868 HydrophobicContact CG2-CG2 3.83Å; I866-V868 WeakPolarHBondContact O-CG2 3.11Å; I866-V868 PolarHBondContact O-N 2.94Å; I866-V868 VanDerWaalsContact O-N 3.09Å; I866-E896 WeakPolarHBondContact CG2-OE1 3.2Å
867	P	38.9	Very low	44.1	Very low	60.5 Å²	60.5	69 Å²	69	39%	0.393	41%	0.41	S	S	.	.			trans	-64.1	107.5	168.2	18.1	-19.6	0	0	0	107.5	D865 F869 E896	D865-P867 WeakPolarHBondContact O-CD 3.45Å; P867-F869 HydrophobicContact CB-CE2 4.44Å; P867-F869 VanDerWaalsContact CB-O 3.24Å; P867-F869 WeakPolarHBondContact CB-O 3.44Å; P867-F869 HydrophobicContact CG-CE2 4.13Å; P867-F869 HydrophobicContact CG-CZ 4.49Å; P867-F869 WeakPolarHBondContact O-CD2 3.41Å; P867-F869 PolarHBondContact O-N 3.05Å; P867-E896 WeakPolarHBondContact CA-OE1 3.2Å; P867-E896 VanDerWaalsContact CB-CD 3.47Å; P867-E896 HydrophobicContact CB-CG 3.8Å; P867-E896 WeakPolarHBondContact CB-OE1 3.24Å; P867-E896 VanDerWaalsContact CG-CD 3.47Å; P867-E896 HydrophobicContact CG-CG 4.31Å; P867-E896 WeakPolarHBondContact CG-OE1 3.47Å
868	V	40.5	Very low	45.5	Very low	80.75 Å²	80.75	71 Å²	71	49%	0.489	42%	0.423	S	S	.	.			trans	-72.6	90.2	172.2	179.8	0	0	0	0	105.6	I866 P870 W1101 Q1107	I866-V868 HydrophobicContact CB-CG2 3.88Å; I866-V868 HydrophobicContact CG2-CG2 3.83Å; I866-V868 WeakPolarHBondContact O-CG2 3.11Å; I866-V868 PolarHBondContact O-N 2.94Å; I866-V868 VanDerWaalsContact O-N 3.09Å; V868-P870 VanDerWaalsContact C-N 3.31Å; V868-P870 VanDerWaalsContact O-CD 3.32Å; V868-P870 WeakPolarHBondContact O-CD 3.39Å; V868-W1101 VanDerWaalsContact CG1-CD1 3.42Å; V868-Q1107 HydrophobicContact CG2-CG 4.43Å
869	F	45.6	Very low	46.7	Very low	62.75 Å²	62.75	70.7 Å²	70.7	28%	0.275	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-80.8	125.2	168.3	-69.2	-82.9	0	0	0	107	P867 T871 T894 D895 E896 L1070 Y1074 Y1098 W1101 N1110 L1114	P867-F869 HydrophobicContact CB-CE2 4.44Å; P867-F869 VanDerWaalsContact CB-O 3.24Å; P867-F869 WeakPolarHBondContact CB-O 3.44Å; P867-F869 HydrophobicContact CG-CE2 4.13Å; P867-F869 HydrophobicContact CG-CZ 4.49Å; P867-F869 WeakPolarHBondContact O-CD2 3.41Å; P867-F869 PolarHBondContact O-N 3.05Å; F869-T871 PolarHBondContact O-N 3.03Å; F869-T871 VanDerWaalsContact O-N 3.08Å; F869-T894 WeakPolarHBondContact CB-O 3.03Å; F869-T894 WeakPolarHBondContact CD1-O 3.32Å; F869-T894 VanDerWaalsContact CE1-O 3.26Å; F869-T894 WeakPolarHBondContact CE1-O 3.27Å; F869-T894 VanDerWaalsContact CG-O 3.31Å; F869-T894 WeakPolarHBondContact CG-O 3.15Å; F869-D895 VanDerWaalsContact CB-CA 3.47Å; F869-D895 HydrophobicContact CB-CB 3.63Å; F869-D895 HydrophobicContact CD2-CB 4.47Å; F869-D895 HydrophobicContact CG-CB 4.08Å; F869-E896 HydrophobicContact CB-CG 4.37Å; F869-E896 HydrophobicContact CD2-CG 4.14Å; F869-L1070 HydrophobicContact CD2-CD2 4.14Å; F869-L1070 HydrophobicContact CE1-CB 4.48Å; F869-L1070 HydrophobicContact CE1-CD2 4.07Å; F869-L1070 HydrophobicContact CE1-CG 3.87Å; F869-L1070 HydrophobicContact CE2-CD2 3.42Å; F869-L1070 VanDerWaalsContact CE2-CD2 3.42Å; F869-L1070 HydrophobicContact CE2-CG 4.2Å; F869-L1070 HydrophobicContact CZ-CB 4.24Å; F869-L1070 HydrophobicContact CZ-CD2 3.37Å; F869-L1070 HydrophobicContact CZ-CG 3.71Å; F869-Y1074 HydrophobicContact CB-CE1 4.09Å; F869-Y1074 HydrophobicContact CB-CE2 3.81Å; F869-Y1074 AromaticContact CD1-CD2 3.39Å; F869-Y1074 HydrophobicContact CD1-CD2 3.39Å; F869-Y1074 HydrophobicContact CD1-CE1 4.5Å; F869-Y1074 AromaticContact CD1-CE2 3.47Å; F869-Y1074 HydrophobicContact CD1-CE2 3.79Å; F869-Y1074 HydrophobicContact CD1-CG 4.06Å; F869-Y1074 AromaticContact CD1-CZ 3.83Å; F869-Y1074 VanDerWaalsContact CD1-OH 3.29Å; F869-Y1074 WeakPolarHBondContact CD1-OH 3.12Å; F869-Y1074 HydrophobicContact CD2-CE2 4.49Å; F869-Y1074 AromaticContact CE1-CD2 3.85Å; F869-Y1074 HydrophobicContact CE1-CD2 3.85Å; F869-Y1074 AromaticContact CE1-CE2 3.87Å; F869-Y1074 HydrophobicContact CE1-CE2 3.96Å; F869-Y1074 HydrophobicContact CG-CD2 4.17Å; F869-Y1074 AromaticContact CG-CE2 3.63Å; F869-Y1074 HydrophobicContact CG-CE2 3.63Å; F869-Y1074 AromaticContact CG-CZ 3.95Å; F869-Y1098 AromaticContact CD1-CD1 3.74Å; F869-Y1098 HydrophobicContact CD1-CD1 3.74Å; F869-Y1098 AromaticContact CD1-CE1 3.56Å; F869-Y1098 HydrophobicContact CD1-CE1 3.56Å; F869-Y1098 AromaticContact CE1-CD1 3.54Å; F869-Y1098 HydrophobicContact CE1-CD1 3.54Å; F869-Y1098 AromaticContact CE1-CE1 3.86Å; F869-Y1098 HydrophobicContact CE1-CE1 3.86Å; F869-W1101 HydrophobicContact CE1-CZ2 4.31Å; F869-W1101 HydrophobicContact CZ-CH2 4.36Å; F869-W1101 AromaticContact CZ-CZ2 3.8Å; F869-W1101 HydrophobicContact CZ-CZ2 3.8Å; F869-W1101 AromaticContact CZ-NE1 3.84Å; F869-N1110 HydrophobicContact CZ-CB 4.36Å; F869-L1114 HydrophobicContact CE1-CD1 4.5Å
870	P	46.7	Very low	48	Very low	33.75 Å²	33.75	69.6 Å²	69.6	22%	0.219	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-60.1	138.4	178.3	10.8	-14.1	0	0	0	109.5	V868 L872 D895 Y1074 F1093	V868-P870 VanDerWaalsContact C-N 3.31Å; V868-P870 VanDerWaalsContact O-CD 3.32Å; V868-P870 WeakPolarHBondContact O-CD 3.39Å; P870-L872 PolarHBondContact O-N 3.25Å; P870-L872 VanDerWaalsContact O-N 3.11Å; P870-D895 WeakPolarHBondContact O-CB 3.4Å; P870-Y1074 HydrophobicContact CG-CD1 4.23Å; P870-Y1074 HydrophobicContact CG-CE1 4.07Å; P870-F1093 HydrophobicContact CB-CD1 3.48Å; P870-F1093 VanDerWaalsContact CB-CD1 3.48Å; P870-F1093 HydrophobicContact CB-CD2 3.78Å; P870-F1093 HydrophobicContact CB-CE1 3.89Å; P870-F1093 HydrophobicContact CB-CE2 3.62Å; P870-F1093 VanDerWaalsContact CB-CE2 3.48Å; P870-F1093 HydrophobicContact CB-CG 4.08Å; P870-F1093 HydrophobicContact CB-CZ 3.44Å; P870-F1093 VanDerWaalsContact CD-CZ 3.48Å; P870-F1093 HydrophobicContact CG-CD1 3.5Å; P870-F1093 HydrophobicContact CG-CD2 4.1Å; P870-F1093 HydrophobicContact CG-CE1 3.28Å; P870-F1093 VanDerWaalsContact CG-CE1 3.48Å; P870-F1093 HydrophobicContact CG-CE2 3.95Å; P870-F1093 VanDerWaalsContact CG-CE2 3.45Å; P870-F1093 HydrophobicContact CG-CG 3.98Å; P870-F1093 HydrophobicContact CG-CZ 3.33Å; P870-F1093 VanDerWaalsContact CG-CZ 3.49Å
871	T	49.4	Very low	49.4	Very low	102.25 Å²	102.25	72.5 Å²	72.5	63%	0.627	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-62.1	129	175	7.3	0	0	0	0	109.4	F869 P873 D895	F869-T871 PolarHBondContact O-N 3.03Å; F869-T871 VanDerWaalsContact O-N 3.08Å; T871-P873 WeakPolarHBondContact O-CD 3.26Å; T871-D895 WeakPolarHBondContact CA-OD2 3.43Å; T871-D895 VanDerWaalsContact CG2-OD2 3.29Å; T871-D895 WeakPolarHBondContact CG2-OD2 3.33Å
872	L	54.6	Low	50.5	Low	41.5 Å²	41.5	75.7 Å²	75.7	22%	0.217	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-73.3	136.9	-179.7	-65.9	167.5	0	0	0	109.6	P870 E874 L876 V893 D895 S898 I900 Y1074 M1081	P870-L872 PolarHBondContact O-N 3.25Å; P870-L872 VanDerWaalsContact O-N 3.11Å; L872-E874 PolarHBondContact O-N 3.02Å; L872-L876 HydrophobicContact CB-CB 4.49Å; L872-L876 HydrophobicContact CB-CD2 4.42Å; L872-L876 HydrophobicContact CD1-CD2 4.39Å; L872-L876 HydrophobicContact CD2-CD2 3.85Å; L872-L876 HydrophobicContact CG-CD2 4.47Å; L872-V893 HydrophobicContact CD1-CB 4.06Å; L872-V893 VanDerWaalsContact CD1-CB 3.46Å; L872-V893 HydrophobicContact CD1-CG1 3.79Å; L872-V893 HydrophobicContact CD1-CG2 4.44Å; L872-V893 WeakPolarHBondContact CD1-O 3.35Å; L872-V893 HydrophobicContact CD2-CB 4.27Å; L872-V893 HydrophobicContact CD2-CG1 3.44Å; L872-V893 VanDerWaalsContact CD2-CG1 3.47Å; L872-V893 HydrophobicContact CG-CB 4.49Å; L872-V893 HydrophobicContact CG-CG1 4.18Å; L872-D895 WeakPolarHBondContact CB-OD2 3.35Å; L872-D895 HydrophobicContact CD1-CB 4.36Å; L872-D895 HydrophobicContact CG-CB 4.05Å; L872-D895 PolarHBondContact N-OD2 2.84Å; L872-S898 WeakPolarHBondContact CD1-OG 3.46Å; L872-I900 HydrophobicContact CB-CD1 4.28Å; L872-I900 HydrophobicContact CD1-CD1 3.92Å; L872-I900 HydrophobicContact CD1-CG1 4.28Å; L872-Y1074 HydrophobicContact CD2-CE1 3.75Å; L872-M1081 HydrophobicContact CD2-CE 3.98Å
873	P	56.8	Low	51.5	Low	28.5 Å²	28.5	77.5 Å²	77.5	19%	0.185	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-59.4	137	174.8	-15	20.6	0	0	0	111.7	T871 Q875 L876 P877 E914 M1081 F1090	T871-P873 WeakPolarHBondContact O-CD 3.26Å; P873-Q875 PolarHBondContact O-N 3.21Å; P873-L876 HydrophobicContact CB-CB 4.4Å; P873-L876 HydrophobicContact CG-CB 4.35Å; P873-L876 VanDerWaalsContact O-CB 3.26Å; P873-L876 WeakPolarHBondContact O-CB 3.25Å; P873-L876 PolarHBondContact O-N 3.22Å; P873-P877 VanDerWaalsContact O-CD 3.23Å; P873-P877 WeakPolarHBondContact O-CD 3.24Å; P873-E914 VanDerWaalsContact CA-OE1 3.23Å; P873-E914 WeakPolarHBondContact CA-OE1 3.4Å; P873-E914 HydrophobicContact CB-CG 4.27Å; P873-E914 WeakPolarHBondContact CB-OE1 3.37Å; P873-E914 HydrophobicContact CG-CG 4.39Å; P873-M1081 HydrophobicContact CB-CE 4.12Å; P873-M1081 VanDerWaalsContact CD-CE 3.43Å; P873-M1081 HydrophobicContact CG-CE 3.75Å; P873-M1081 VanDerWaalsContact CG-CE 3.41Å; P873-M1081 HydrophobicContact CG-SD 3.81Å; P873-F1090 HydrophobicContact CG-CZ 4.2Å
874	E	60.3	Low	52.2	Low	166 Å²	166	78.2 Å²	78.2	78%	0.776	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.4	-179.4	-72.6	-167.4	151.6	0	0	113.5	L872 L876 P877 I912	L872-E874 PolarHBondContact O-N 3.02Å; E874-L876 VanDerWaalsContact C-N 3.34Å; E874-P877 WeakPolarHBondContact O-CD 3.24Å; E874-I912 HydrophobicContact CG-CD1 4.44Å
875	Q	61.4	Low	53	Low	118.75 Å²	118.75	79 Å²	79	56%	0.555	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-13	179.6	-57.1	131	0.4	0	0	113.6	P873 P877 S878 L879	P873-Q875 PolarHBondContact O-N 3.21Å; Q875-P877 VanDerWaalsContact C-CD 3.5Å; Q875-S878 WeakPolarHBondContact O-CA 3.45Å; Q875-S878 WeakPolarHBondContact O-CB 3.32Å; Q875-S878 PolarHBondContact O-N 3.31Å; Q875-S878 VanDerWaalsContact O-N 3.08Å; Q875-S878 PolarHBondContact O-OG 3.16Å; Q875-S878 VanDerWaalsContact O-OG 3.13Å; Q875-L879 PolarHBondContact O-N 3.17Å; Q875-L879 VanDerWaalsContact O-N 3.1Å
876	L	61.3	Low	53.8	Low	7 Å²	7	79 Å²	79	4%	0.037	43%	0.431	C	S	.	.	H	α-helix	trans	-58.9	-44.8	-176.3	-171.5	64.6	0	0	0	113.4	L872 P873 E874 S878 L879 L880 I900 V1077 M1081	L872-L876 HydrophobicContact CB-CB 4.49Å; L872-L876 HydrophobicContact CB-CD2 4.42Å; L872-L876 HydrophobicContact CD1-CD2 4.39Å; L872-L876 HydrophobicContact CD2-CD2 3.85Å; L872-L876 HydrophobicContact CG-CD2 4.47Å; P873-L876 HydrophobicContact CB-CB 4.4Å; P873-L876 HydrophobicContact CG-CB 4.35Å; P873-L876 VanDerWaalsContact O-CB 3.26Å; P873-L876 WeakPolarHBondContact O-CB 3.25Å; P873-L876 PolarHBondContact O-N 3.22Å; E874-L876 VanDerWaalsContact C-N 3.34Å; L876-S878 VanDerWaalsContact C-N 3.29Å; L876-S878 PolarHBondContact O-N 3.09Å; L876-S878 VanDerWaalsContact O-N 3.15Å; L876-L879 WeakPolarHBondContact O-CB 3.38Å; L876-L879 PolarHBondContact O-N 3.09Å; L876-L880 HydrophobicContact CD1-CD1 4.06Å; L876-L880 HydrophobicContact CD1-CD2 4.14Å; L876-L880 HydrophobicContact CD1-CG 3.84Å; L876-L880 HydrophobicContact CD2-CD1 4.14Å; L876-L880 HydrophobicContact CG-CD1 3.94Å; L876-L880 HydrophobicContact CG-CG 4.19Å; L876-L880 WeakPolarHBondContact O-CB 3.49Å; L876-L880 WeakPolarHBondContact O-CG 3.33Å; L876-L880 PolarHBondContact O-N 3.09Å; L876-I900 HydrophobicContact CB-CD1 4.18Å; L876-I900 HydrophobicContact CD2-CD1 3.38Å; L876-I900 VanDerWaalsContact CD2-CD1 3.49Å; L876-I900 HydrophobicContact CG-CD1 3.79Å; L876-V1077 HydrophobicContact CD1-CG1 4.07Å; L876-V1077 HydrophobicContact CD2-CG1 4.06Å; L876-M1081 HydrophobicContact CB-CE 3.92Å; L876-M1081 HydrophobicContact CD1-CE 3.43Å; L876-M1081 VanDerWaalsContact CD1-CE 3.44Å; L876-M1081 HydrophobicContact CD1-CG 4.29Å; L876-M1081 HydrophobicContact CD1-SD 4.33Å; L876-M1081 HydrophobicContact CD2-CE 3.59Å; L876-M1081 HydrophobicContact CG-CE 3.8Å
877	P	61.8	Low	54.5	Low	28.5 Å²	28.5	75.8 Å²	75.8	19%	0.185	42%	0.415	C	S	.	.	H	α-helix	trans	-60.6	-33.6	178	-23.3	34.2	0	0	0	113.4	P873 E874 Q875 L879 N881 I900 I908 H910	P873-P877 VanDerWaalsContact O-CD 3.23Å; P873-P877 WeakPolarHBondContact O-CD 3.24Å; E874-P877 WeakPolarHBondContact O-CD 3.24Å; Q875-P877 VanDerWaalsContact C-CD 3.5Å; P877-L879 VanDerWaalsContact C-N 3.33Å; P877-N881 VanDerWaalsContact O-CB 3.28Å; P877-N881 WeakPolarHBondContact O-CB 3.34Å; P877-N881 VanDerWaalsContact O-CG 3.22Å; P877-N881 PolarHBondContact O-N 3.01Å; P877-N881 VanDerWaalsContact O-N 3.12Å; P877-N881 PolarHBondContact O-ND2 3.26Å; P877-N881 VanDerWaalsContact O-ND2 3.09Å; P877-I900 HydrophobicContact CG-CD1 3.95Å; P877-I900 HydrophobicContact CG-CG1 4.37Å; P877-I908 HydrophobicContact CB-CG2 4.27Å; P877-H910 HydrophobicContact CB-CB 4.2Å; P877-H910 HydrophobicContact CG-CB 3.62Å; P877-H910 VanDerWaalsContact CG-CB 3.41Å
878	S	63.2	Low	55.2	Low	70.75 Å²	70.75	75.8 Å²	75.8	50%	0.495	41%	0.414	S	S	.	.	H	α-helix	trans	-74.9	-27.7	178	-13	0	0	0	0	112.5	Q875 L876 K882	Q875-S878 WeakPolarHBondContact O-CA 3.45Å; Q875-S878 WeakPolarHBondContact O-CB 3.32Å; Q875-S878 PolarHBondContact O-N 3.31Å; Q875-S878 VanDerWaalsContact O-N 3.08Å; Q875-S878 PolarHBondContact O-OG 3.16Å; Q875-S878 VanDerWaalsContact O-OG 3.13Å; L876-S878 VanDerWaalsContact C-N 3.29Å; L876-S878 PolarHBondContact O-N 3.09Å; L876-S878 VanDerWaalsContact O-N 3.15Å; S878-K882 WeakPolarHBondContact O-CD 3.28Å; S878-K882 VanDerWaalsContact O-CG 3.26Å; S878-K882 WeakPolarHBondContact O-CG 3.2Å
879	L	60.2	Low	55.9	Low	44.75 Å²	44.75	74.9 Å²	74.9	23%	0.234	41%	0.412	C	S	.	.	H	α-helix	trans	-74	-44.6	172	-72.2	169.6	0	0	0	111.6	Q875 L876 P877 N881 K882 I912 V1084 I1085	Q875-L879 PolarHBondContact O-N 3.17Å; Q875-L879 VanDerWaalsContact O-N 3.1Å; L876-L879 WeakPolarHBondContact O-CB 3.38Å; L876-L879 PolarHBondContact O-N 3.09Å; P877-L879 VanDerWaalsContact C-N 3.33Å; L879-N881 VanDerWaalsContact C-N 3.31Å; L879-N881 PolarHBondContact O-N 3.26Å; L879-K882 WeakPolarHBondContact O-CB 3.33Å; L879-K882 PolarHBondContact O-N 3.04Å; L879-I912 HydrophobicContact CD1-CD1 4.1Å; L879-V1084 HydrophobicContact CD1-CG1 4.13Å; L879-V1084 HydrophobicContact CD2-CB 4.34Å; L879-V1084 HydrophobicContact CD2-CG1 3.78Å; L879-V1084 HydrophobicContact CD2-CG2 4.43Å; L879-I1085 HydrophobicContact CD1-CD1 4.2Å; L879-I1085 HydrophobicContact CD1-CG1 4.47Å
880	L	61.3	Low	56.5	Low	34 Å²	34	73.1 Å²	73.1	18%	0.178	41%	0.407	C	S	.	.	H	α-helix	trans	-65	-32.2	-179.9	-68.2	171.6	0	0	0	112.9	L876 K882 Q883 L887 L891 I900 I908 M1080	L876-L880 HydrophobicContact CD1-CD1 4.06Å; L876-L880 HydrophobicContact CD1-CD2 4.14Å; L876-L880 HydrophobicContact CD1-CG 3.84Å; L876-L880 HydrophobicContact CD2-CD1 4.14Å; L876-L880 HydrophobicContact CG-CD1 3.94Å; L876-L880 HydrophobicContact CG-CG 4.19Å; L876-L880 WeakPolarHBondContact O-CB 3.49Å; L876-L880 WeakPolarHBondContact O-CG 3.33Å; L876-L880 PolarHBondContact O-N 3.09Å; L880-K882 VanDerWaalsContact C-N 3.28Å; L880-K882 PolarHBondContact O-N 3.12Å; L880-Q883 PolarHBondContact O-N 3.05Å; L880-L887 HydrophobicContact CB-CD2 4.5Å; L880-L887 HydrophobicContact CD2-CD1 3.84Å; L880-L887 HydrophobicContact CD2-CD2 3.66Å; L880-L887 HydrophobicContact CD2-CG 4.36Å; L880-L887 HydrophobicContact CG-CD2 4.37Å; L880-L891 HydrophobicContact CD1-CD2 3.77Å; L880-L891 HydrophobicContact CD2-CD2 4.15Å; L880-L891 HydrophobicContact CG-CD2 4.46Å; L880-I900 HydrophobicContact CD1-CD1 4.12Å; L880-I900 HydrophobicContact CD1-CG2 3.95Å; L880-I908 VanDerWaalsContact C-CD1 3.48Å; L880-I908 HydrophobicContact CB-CD1 3.52Å; L880-I908 VanDerWaalsContact CB-CD1 3.42Å; L880-I908 HydrophobicContact CB-CG1 4.29Å; L880-M1080 HydrophobicContact CD2-CE 4.45Å
881	N	61.3	Low	57.1	Low	113.5 Å²	113.5	72.5 Å²	72.5	61%	0.607	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.9	175.4	-81.1	-34.4	0	0	0	114.1	P877 L879 I908	P877-N881 VanDerWaalsContact O-CB 3.28Å; P877-N881 WeakPolarHBondContact O-CB 3.34Å; P877-N881 VanDerWaalsContact O-CG 3.22Å; P877-N881 PolarHBondContact O-N 3.01Å; P877-N881 VanDerWaalsContact O-N 3.12Å; P877-N881 PolarHBondContact O-ND2 3.26Å; P877-N881 VanDerWaalsContact O-ND2 3.09Å; L879-N881 VanDerWaalsContact C-N 3.31Å; L879-N881 PolarHBondContact O-N 3.26Å; N881-I908 HydrophobicContact CB-CD1 4.4Å; N881-I908 VanDerWaalsContact OD1-CD1 3.3Å; N881-I908 WeakPolarHBondContact OD1-CD1 3.34Å
882	K	57.8	Low	57.6	Low	149.25 Å²	149.25	68.4 Å²	68.4	65%	0.649	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-10.9	-179.5	-69	177.5	-177.9	-179.8	0	113.1	S878 L879 L880 P884 L887	S878-K882 WeakPolarHBondContact O-CD 3.28Å; S878-K882 VanDerWaalsContact O-CG 3.26Å; S878-K882 WeakPolarHBondContact O-CG 3.2Å; L879-K882 WeakPolarHBondContact O-CB 3.33Å; L879-K882 PolarHBondContact O-N 3.04Å; L880-K882 VanDerWaalsContact C-N 3.28Å; L880-K882 PolarHBondContact O-N 3.12Å; K882-P884 VanDerWaalsContact O-CD 3.26Å; K882-P884 WeakPolarHBondContact O-CD 3.23Å; K882-L887 HydrophobicContact CB-CD1 4.07Å; K882-L887 HydrophobicContact CB-CD2 4.27Å; K882-L887 HydrophobicContact CB-CG 3.98Å; K882-L887 HydrophobicContact CD-CD2 4.42Å
883	Q	53.8	Low	57.8	Low	110.25 Å²	110.25	66.8 Å²	66.8	52%	0.515	37%	0.368	S	S	.	.			trans	-112.4	94.9	-176.9	-77.4	-97.7	-6.8	0	0	111.3	L880 S885 D886 M1080	L880-Q883 PolarHBondContact O-N 3.05Å; Q883-S885 WeakPolarHBondContact CB-OG 3.43Å; Q883-S885 PolarHBondContact O-N 3.08Å; Q883-D886 PolarHBondContact O-N 3.26Å; Q883-M1080 HydrophobicContact CB-CE 4.28Å
884	P	50.5	Low	57.8	Low	87.25 Å²	87.25	66.7 Å²	66.7	57%	0.567	37%	0.367	S	S	*	.			trans	-80.6	-10.3	-175.1	30.5	-34.6	0	0	0	115.3	K882 D886 Q906	K882-P884 VanDerWaalsContact O-CD 3.26Å; K882-P884 WeakPolarHBondContact O-CD 3.23Å; P884-D886 VanDerWaalsContact C-N 3.34Å; P884-D886 PolarHBondContact O-N 2.81Å; P884-Q906 PolarHBondContact O-NE2 3.35Å
885	S	53	Low	57.6	Low	97.75 Å²	97.75	60 Å²	60	68%	0.684	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-26.6	-176.7	56.5	0	0	0	0	114.5	Q883	Q883-S885 WeakPolarHBondContact CB-OG 3.43Å; Q883-S885 PolarHBondContact O-N 3.08Å
886	D	53	Low	57.2	Low	114.5 Å²	114.5	59.3 Å²	59.3	61%	0.612	33%	0.334	S	S	*	.	S	Bend	trans	-110.6	1.9	-166.2	-58.1	-1.2	0	0	0	112.5	Q883 P884 P888	Q883-D886 PolarHBondContact O-N 3.26Å; P884-D886 VanDerWaalsContact C-N 3.34Å; P884-D886 PolarHBondContact O-N 2.81Å; D886-P888 WeakPolarHBondContact O-CD 3.4Å
887	L	52.2	Low	57	Low	39.5 Å²	39.5	61.5 Å²	61.5	21%	0.207	35%	0.345	C	S	.	.	S	Bend	trans	-93.2	123.6	-177.4	-107.8	103.1	0	0	0	111.2	L880 K882 S889 L891 A902 M1080	L880-L887 HydrophobicContact CB-CD2 4.5Å; L880-L887 HydrophobicContact CD2-CD1 3.84Å; L880-L887 HydrophobicContact CD2-CD2 3.66Å; L880-L887 HydrophobicContact CD2-CG 4.36Å; L880-L887 HydrophobicContact CG-CD2 4.37Å; K882-L887 HydrophobicContact CB-CD1 4.07Å; K882-L887 HydrophobicContact CB-CD2 4.27Å; K882-L887 HydrophobicContact CB-CG 3.98Å; K882-L887 HydrophobicContact CD-CD2 4.42Å; L887-S889 PolarHBondContact O-N 3.05Å; L887-L891 HydrophobicContact CD1-CD2 4.34Å; L887-L891 HydrophobicContact CD2-CB 4.16Å; L887-L891 HydrophobicContact CD2-CD1 4.06Å; L887-L891 HydrophobicContact CD2-CD2 4.13Å; L887-L891 HydrophobicContact CD2-CG 3.94Å; L887-L891 HydrophobicContact CG-CD1 4.16Å; L887-L891 HydrophobicContact CG-CD2 4.46Å; L887-A902 HydrophobicContact CD2-CB 4.41Å; L887-M1080 HydrophobicContact CD1-CE 3.41Å; L887-M1080 HydrophobicContact CD1-SD 3.73Å; L887-M1080 WeakPolarHBondContact CD1-SD 3.05Å; L887-M1080 HydrophobicContact CG-CE 4.46Å
888	P	54.6	Low	57	Low	60.25 Å²	60.25	60.5 Å²	60.5	39%	0.391	34%	0.339	S	S	.	.			trans	-60.6	124.2	170.3	26.1	-33.9	0	0	0	110.3	D886 C890 L891 N903 E904 L1076	D886-P888 WeakPolarHBondContact O-CD 3.4Å; P888-C890 PolarHBondContact O-N 3.09Å; P888-L891 HydrophobicContact CG-CB 4.32Å; P888-L891 HydrophobicContact CG-CD1 3.96Å; P888-N903 VanDerWaalsContact O-CA 3.24Å; P888-N903 WeakPolarHBondContact O-CA 2.95Å; P888-E904 HydrophobicContact CB-CG 4.37Å; P888-E904 PolarHBondContact O-N 3.03Å; P888-L1076 HydrophobicContact CG-CD2 4.13Å
889	S	54.3	Low	57.2	Low	62.5 Å²	62.5	57.3 Å²	57.3	44%	0.437	32%	0.317	S	S	.	.	S	Bend	trans	-78.4	13.4	-171.6	37	0	0	0	0	114.1	L887 A902 N903 E904 K1122	L887-S889 PolarHBondContact O-N 3.05Å; S889-A902 CarbonylContact C-O 3.58Å; S889-A902 WeakPolarHBondContact CA-O 3.45Å; S889-N903 CarbonylContact O-C 3.51Å; S889-E904 WeakPolarHBondContact O-CA 3.28Å; S889-E904 PolarHBondContact O-N 3.02Å; S889-E904 PolarHBondContact OG-OE1 3.32Å; S889-K1122 PolarHBondContact OG-NZ 2.79Å
890	C	58.5	Low	57.6	Low	24.25 Å²	24.25	55.3 Å²	55.3	16%	0.164	31%	0.306	C	S	.	.	S	Bend	trans	-142.4	101.5	178.1	-178.1	0	0	0	0	109.8	P888 V892 A902 E904 Y1064 H1118 S1121 K1122	P888-C890 PolarHBondContact O-N 3.09Å; C890-V892 WeakPolarHBondContact O-CG2 3.18Å; C890-V892 PolarHBondContact O-N 3.31Å; C890-V892 VanDerWaalsContact O-N 3.14Å; C890-A902 CarbonylContact C-O 3.6Å; C890-A902 VanDerWaalsContact CA-O 3.28Å; C890-A902 WeakPolarHBondContact CA-O 3.37Å; C890-A902 PolarHBondContact N-O 2.89Å; C890-A902 PolarHBondContact O-N 3.47Å; C890-E904 HydrophobicContact CB-CG 4.45Å; C890-Y1064 HydrophobicContact CB-CE1 4.39Å; C890-Y1064 PolarHBondContact O-OH 3.04Å; C890-H1118 PolarHBondContact SG-CE1 3.16Å; C890-H1118 VanDerWaalsContact SG-CE1 3.57Å; C890-H1118 PolarHBondContact SG-ND1 3.23Å; C890-S1121 PolarHBondContact SG-OG 3.33Å; C890-K1122 HydrophobicContact CB-CD 3.95Å; C890-K1122 HydrophobicContact CB-CG 4.47Å
891	L	58.8	Low	57.9	Low	22 Å²	22	53.8 Å²	53.8	12%	0.115	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.4	174.3	-170.8	80.1	0	0	0	109.3	L880 L887 P888 V893 T894 C899 I900 V901 A902 T1073 V1077	L880-L891 HydrophobicContact CD1-CD2 3.77Å; L880-L891 HydrophobicContact CD2-CD2 4.15Å; L880-L891 HydrophobicContact CG-CD2 4.46Å; L887-L891 HydrophobicContact CD1-CD2 4.34Å; L887-L891 HydrophobicContact CD2-CB 4.16Å; L887-L891 HydrophobicContact CD2-CD1 4.06Å; L887-L891 HydrophobicContact CD2-CD2 4.13Å; L887-L891 HydrophobicContact CD2-CG 3.94Å; L887-L891 HydrophobicContact CG-CD1 4.16Å; L887-L891 HydrophobicContact CG-CD2 4.46Å; P888-L891 HydrophobicContact CG-CB 4.32Å; P888-L891 HydrophobicContact CG-CD1 3.96Å; L891-V893 HydrophobicContact CD1-CG2 4.03Å; L891-V893 HydrophobicContact CD2-CG2 3.7Å; L891-V893 HydrophobicContact CG-CG2 3.65Å; L891-T894 HydrophobicContact CD1-CG2 4.19Å; L891-T894 HydrophobicContact CD2-CG2 3.93Å; L891-T894 HydrophobicContact CG-CG2 4.27Å; L891-C899 HydrophobicContact CD1-CB 3.83Å; L891-I900 CarbonylContact C-O 3.43Å; L891-I900 HydrophobicContact CD2-CB 4.45Å; L891-I900 HydrophobicContact CD2-CG2 3.94Å; L891-I900 CarbonylContact O-C 3.59Å; L891-I900 VanDerWaalsContact O-C 3.31Å; L891-I900 VanDerWaalsContact O-O 3.06Å; L891-V901 HydrophobicContact CD1-CG2 4.05Å; L891-V901 CarbonylContact O-C 3.5Å; L891-V901 VanDerWaalsContact O-CA 3.31Å; L891-V901 WeakPolarHBondContact O-CA 3.35Å; L891-A902 HydrophobicContact CB-CB 4.12Å; L891-A902 PolarHBondContact N-O 2.76Å; L891-A902 PolarHBondContact O-N 3.32Å; L891-T1073 HydrophobicContact CD1-CG2 3.71Å; L891-T1073 HydrophobicContact CG-CG2 3.97Å; L891-V1077 HydrophobicContact CD1-CG2 3.89Å; L891-V1077 HydrophobicContact CD2-CG2 4.3Å; L891-V1077 HydrophobicContact CG-CG2 4.44Å
892	V	61.3	Low	58.2	Low	15.75 Å²	15.75	48.7 Å²	48.7	10%	0.095	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	88.1	175.4	-176.6	0	0	0	0	109	C890 T894 I900 V901 A902 Y1064 I1065 L1070 L1114 C1117 H1118	C890-V892 WeakPolarHBondContact O-CG2 3.18Å; C890-V892 PolarHBondContact O-N 3.31Å; C890-V892 VanDerWaalsContact O-N 3.14Å; V892-T894 HydrophobicContact CG1-CG2 3.92Å; V892-T894 VanDerWaalsContact CG1-CG2 3.42Å; V892-I900 VanDerWaalsContact CA-O 3.26Å; V892-I900 WeakPolarHBondContact CA-O 3.21Å; V892-I900 PolarHBondContact N-O 2.97Å; V892-V901 HydrophobicContact CG1-CG2 4.32Å; V892-V901 HydrophobicContact CG2-CG1 4.18Å; V892-V901 HydrophobicContact CG2-CG2 4.31Å; V892-A902 HydrophobicContact CG2-CB 3.75Å; V892-Y1064 HydrophobicContact CB-CE1 4.15Å; V892-Y1064 HydrophobicContact CG2-CE1 4.23Å; V892-Y1064 PolarHBondContact N-OH 2.78Å; V892-Y1064 VanDerWaalsContact N-OH 3.14Å; V892-Y1064 WeakPolarHBondContact O-CE1 3.44Å; V892-Y1064 PolarHBondContact O-OH 3.36Å; V892-I1065 HydrophobicContact CB-CD1 3.82Å; V892-I1065 HydrophobicContact CG1-CD1 3.69Å; V892-I1065 HydrophobicContact CG2-CD1 4.18Å; V892-L1070 WeakPolarHBondContact O-CD1 3.5Å; V892-L1114 HydrophobicContact CG1-CB 4.39Å; V892-L1114 HydrophobicContact CG1-CD1 3.57Å; V892-L1114 HydrophobicContact CG1-CD2 4.08Å; V892-C1117 HydrophobicContact CG1-CB 4.16Å; V892-H1118 HydrophobicContact CG2-CB 4.21Å
893	V	59.1	Low	58.5	Low	7 Å²	7	42.3 Å²	42.3	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.6	177.4	-166.1	0	0	0	0	108.4	L872 L891 C899 I900 Y1064 T1073 Y1074 V1077	L872-V893 HydrophobicContact CD1-CB 4.06Å; L872-V893 VanDerWaalsContact CD1-CB 3.46Å; L872-V893 HydrophobicContact CD1-CG1 3.79Å; L872-V893 HydrophobicContact CD1-CG2 4.44Å; L872-V893 WeakPolarHBondContact CD1-O 3.35Å; L872-V893 HydrophobicContact CD2-CB 4.27Å; L872-V893 HydrophobicContact CD2-CG1 3.44Å; L872-V893 VanDerWaalsContact CD2-CG1 3.47Å; L872-V893 HydrophobicContact CG-CB 4.49Å; L872-V893 HydrophobicContact CG-CG1 4.18Å; L891-V893 HydrophobicContact CD1-CG2 4.03Å; L891-V893 HydrophobicContact CD2-CG2 3.7Å; L891-V893 HydrophobicContact CG-CG2 3.65Å; V893-C899 CarbonylContact O-C 3.54Å; V893-C899 VanDerWaalsContact O-CA 3.27Å; V893-C899 WeakPolarHBondContact O-CA 3.31Å; V893-C899 WeakPolarHBondContact O-CB 3.31Å; V893-I900 HydrophobicContact CB-CB 4.39Å; V893-I900 HydrophobicContact CB-CD1 4.16Å; V893-I900 HydrophobicContact CB-CG1 4.37Å; V893-I900 HydrophobicContact CG2-CD1 4.22Å; V893-I900 PolarHBondContact N-O 3.16Å; V893-I900 VanDerWaalsContact N-O 3.09Å; V893-I900 PolarHBondContact O-N 2.98Å; V893-Y1064 HydrophobicContact CG1-CE1 4.34Å; V893-Y1064 WeakPolarHBondContact CG1-OH 3.32Å; V893-T1073 HydrophobicContact CG2-CG2 3.42Å; V893-T1073 VanDerWaalsContact CG2-CG2 3.42Å; V893-Y1074 HydrophobicContact CG1-CD1 4.09Å; V893-Y1074 HydrophobicContact CG1-CD2 4.3Å; V893-Y1074 HydrophobicContact CG1-CE1 3.6Å; V893-Y1074 HydrophobicContact CG1-CE2 4.07Å; V893-Y1074 VanDerWaalsContact CG1-CZ 3.45Å; V893-Y1074 WeakPolarHBondContact CG1-OH 3.32Å; V893-V1077 HydrophobicContact CG1-CG1 4.45Å; V893-V1077 HydrophobicContact CG1-CG2 4.18Å; V893-V1077 HydrophobicContact CG2-CG1 4.49Å; V893-V1077 HydrophobicContact CG2-CG2 3.82Å
894	T	56.9	Low	58.9	Low	27.25 Å²	27.25	42.1 Å²	42.1	17%	0.167	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	124.7	-174.8	77.6	0	0	0	0	112.2	F869 L891 V892 S898 C899 L1070 Y1074 L1114	F869-T894 WeakPolarHBondContact CB-O 3.03Å; F869-T894 WeakPolarHBondContact CD1-O 3.32Å; F869-T894 VanDerWaalsContact CE1-O 3.26Å; F869-T894 WeakPolarHBondContact CE1-O 3.27Å; F869-T894 VanDerWaalsContact CG-O 3.31Å; F869-T894 WeakPolarHBondContact CG-O 3.15Å; L891-T894 HydrophobicContact CD1-CG2 4.19Å; L891-T894 HydrophobicContact CD2-CG2 3.93Å; L891-T894 HydrophobicContact CG-CG2 4.27Å; V892-T894 HydrophobicContact CG1-CG2 3.92Å; V892-T894 VanDerWaalsContact CG1-CG2 3.42Å; T894-S898 CarbonylContact C-O 3.55Å; T894-S898 VanDerWaalsContact CA-O 3.28Å; T894-S898 WeakPolarHBondContact CA-O 3.47Å; T894-S898 WeakPolarHBondContact CB-O 3.19Å; T894-S898 PolarHBondContact OG1-O 2.9Å; T894-C899 HydrophobicContact CG2-CB 3.7Å; T894-C899 WeakPolarHBondContact CG2-SG 3.26Å; T894-L1070 HydrophobicContact CG2-CD1 4.38Å; T894-L1070 HydrophobicContact CG2-CD2 3.86Å; T894-Y1074 WeakPolarHBondContact CA-OH 3.27Å; T894-Y1074 PolarHBondContact N-OH 3.38Å; T894-Y1074 PolarHBondContact O-OH 3.26Å; T894-Y1074 PolarHBondContact OG1-OH 3.23Å; T894-Y1074 VanDerWaalsContact OG1-OH 3.12Å; T894-L1114 VanDerWaalsContact CB-CD1 3.43Å; T894-L1114 HydrophobicContact CG2-CD1 3.77Å; T894-L1114 VanDerWaalsContact CG2-CD1 3.5Å; T894-L1114 HydrophobicContact CG2-CD2 3.33Å; T894-L1114 HydrophobicContact CG2-CG 4.1Å; T894-L1114 VanDerWaalsContact OG1-CD1 3.27Å; T894-L1114 WeakPolarHBondContact OG1-CD1 3.21Å; T894-L1114 VanDerWaalsContact OG1-CD2 3.25Å; T894-L1114 WeakPolarHBondContact OG1-CD2 3.35Å
895	D	55.9	Low	59.5	Low	26 Å²	26	42.5 Å²	42.5	14%	0.139	24%	0.241	C	C	.	.			trans	-97.2	-173.8	159.9	69.4	42.2	0	0	0	110.5	F869 P870 T871 L872 N897 S898 Y1064 Y1074	F869-D895 VanDerWaalsContact CB-CA 3.47Å; F869-D895 HydrophobicContact CB-CB 3.63Å; F869-D895 HydrophobicContact CD2-CB 4.47Å; F869-D895 HydrophobicContact CG-CB 4.08Å; P870-D895 WeakPolarHBondContact O-CB 3.4Å; T871-D895 WeakPolarHBondContact CA-OD2 3.43Å; T871-D895 VanDerWaalsContact CG2-OD2 3.29Å; T871-D895 WeakPolarHBondContact CG2-OD2 3.33Å; L872-D895 WeakPolarHBondContact CB-OD2 3.35Å; L872-D895 HydrophobicContact CD1-CB 4.36Å; L872-D895 HydrophobicContact CG-CB 4.05Å; L872-D895 PolarHBondContact N-OD2 2.84Å; D895-N897 VanDerWaalsContact C-N 3.25Å; D895-N897 PolarHBondContact O-N 3.06Å; D895-N897 VanDerWaalsContact O-N 3.16Å; D895-N897 WeakPolarHBondContact OD1-CA 3.36Å; D895-N897 WeakPolarHBondContact OD1-CB 3.42Å; D895-N897 PolarHBondContact OD1-N 3.05Å; D895-S898 PolarHBondContact N-O 3.08Å; D895-S898 VanDerWaalsContact OD1-CA 3.29Å; D895-S898 WeakPolarHBondContact OD1-CA 3.22Å; D895-S898 WeakPolarHBondContact OD1-CB 3.48Å; D895-S898 PolarHBondContact OD1-N 3.05Å; D895-S898 VanDerWaalsContact OD1-O 3.13Å; D895-S898 PolarHBondContact OD1-OG 3.02Å; D895-S898 WeakPolarHBondContact OD2-CB 3.29Å; D895-S898 PolarHBondContact OD2-OG 3.14Å; D895-Y1064 WeakPolarHBondContact OD2-CE2 3.48Å; D895-Y1074 PolarHBondContact N-OH 3.07Å; D895-Y1074 VanDerWaalsContact N-OH 3.15Å
896	E	51.5	Low	59.8	Low	103.5 Å²	103.5	43.8 Å²	43.8	48%	0.484	24%	0.236	S	C	.	.	S	Bend	trans	-60.7	-24.6	178.1	-42	178.8	-176.4	0	0	113.5	I866 P867 F869	I866-E896 WeakPolarHBondContact CG2-OE1 3.2Å; P867-E896 WeakPolarHBondContact CA-OE1 3.2Å; P867-E896 VanDerWaalsContact CB-CD 3.47Å; P867-E896 HydrophobicContact CB-CG 3.8Å; P867-E896 WeakPolarHBondContact CB-OE1 3.24Å; P867-E896 VanDerWaalsContact CG-CD 3.47Å; P867-E896 HydrophobicContact CG-CG 4.31Å; P867-E896 WeakPolarHBondContact CG-OE1 3.47Å; F869-E896 HydrophobicContact CB-CG 4.37Å; F869-E896 HydrophobicContact CD2-CG 4.14Å
897	N	57.3	Low	60.3	Low	52.25 Å²	52.25	41.5 Å²	41.5	28%	0.279	23%	0.227	S	C	.	.	S	Bend	trans	-126.6	0.5	-170.1	-56.8	-41.2	0	0	0	113.6	D895 I912 K913 E914 N915	D895-N897 VanDerWaalsContact C-N 3.25Å; D895-N897 PolarHBondContact O-N 3.06Å; D895-N897 VanDerWaalsContact O-N 3.16Å; D895-N897 WeakPolarHBondContact OD1-CA 3.36Å; D895-N897 WeakPolarHBondContact OD1-CB 3.42Å; D895-N897 PolarHBondContact OD1-N 3.05Å; N897-I912 CarbonylContact O-C 3.29Å; N897-I912 VanDerWaalsContact O-CA 3.3Å; N897-I912 WeakPolarHBondContact O-CA 3.42Å; N897-I912 WeakPolarHBondContact O-CG2 3.32Å; N897-K913 HydrophobicContact CB-CB 4.28Å; N897-K913 WeakPolarHBondContact O-CB 3.45Å; N897-K913 PolarHBondContact O-N 3.15Å; N897-E914 PolarHBondContact O-N 3.38Å; N897-N915 PolarHBondContact ND2-OD1 3.13Å; N897-N915 VanDerWaalsContact ND2-OD1 3.14Å; N897-N915 PolarHBondContact OD1-OD1 3.35Å; N897-N915 VanDerWaalsContact OD1-OD1 3.14Å
898	S	62.6	Low	60.9	Low	9.25 Å²	9.25	41 Å²	41	7%	0.065	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	152.7	-174.9	85	0	0	0	0	113	L872 T894 D895 H910 M911 I912	L872-S898 WeakPolarHBondContact CD1-OG 3.46Å; T894-S898 CarbonylContact C-O 3.55Å; T894-S898 VanDerWaalsContact CA-O 3.28Å; T894-S898 WeakPolarHBondContact CA-O 3.47Å; T894-S898 WeakPolarHBondContact CB-O 3.19Å; T894-S898 PolarHBondContact OG1-O 2.9Å; D895-S898 PolarHBondContact N-O 3.08Å; D895-S898 VanDerWaalsContact OD1-CA 3.29Å; D895-S898 WeakPolarHBondContact OD1-CA 3.22Å; D895-S898 WeakPolarHBondContact OD1-CB 3.48Å; D895-S898 PolarHBondContact OD1-N 3.05Å; D895-S898 VanDerWaalsContact OD1-O 3.13Å; D895-S898 PolarHBondContact OD1-OG 3.02Å; D895-S898 WeakPolarHBondContact OD2-CB 3.29Å; D895-S898 PolarHBondContact OD2-OG 3.14Å; S898-H910 WeakPolarHBondContact CB-NE2 3.38Å; S898-M911 CarbonylContact C-O 3.54Å; S898-M911 WeakPolarHBondContact CA-O 3.37Å; S898-M911 WeakPolarHBondContact CB-O 3.45Å; S898-I912 CarbonylContact C-O 3.58Å; S898-I912 VanDerWaalsContact CA-O 3.22Å; S898-I912 WeakPolarHBondContact CA-O 3.4Å; S898-I912 VanDerWaalsContact CB-O 3.32Å; S898-I912 WeakPolarHBondContact CB-O 3.3Å
899	C	67.7	Low	61.5	Low	2.75 Å²	2.75	39.5 Å²	39.5	2%	0.019	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	137.5	174.1	128.1	0	0	0	0	111.5	L891 V893 T894 H910 M911 I912 L1114 I1144	L891-C899 HydrophobicContact CD1-CB 3.83Å; V893-C899 CarbonylContact O-C 3.54Å; V893-C899 VanDerWaalsContact O-CA 3.27Å; V893-C899 WeakPolarHBondContact O-CA 3.31Å; V893-C899 WeakPolarHBondContact O-CB 3.31Å; T894-C899 HydrophobicContact CG2-CB 3.7Å; T894-C899 WeakPolarHBondContact CG2-SG 3.26Å; C899-H910 CarbonylContact O-C 3.57Å; C899-H910 WeakPolarHBondContact O-CA 3.39Å; C899-H910 PolarHBondContact O-CD2 3.21Å; C899-M911 PolarHBondContact N-O 2.89Å; C899-M911 CarbonylContact O-C 3.56Å; C899-M911 WeakPolarHBondContact O-CA 2.99Å; C899-M911 PolarHBondContact O-N 3.44Å; C899-I912 PolarHBondContact N-O 2.91Å; C899-I912 PolarHBondContact O-N 2.75Å; C899-L1114 HydrophobicContact CB-CD2 4.27Å; C899-I1144 HydrophobicContact CB-CD1 3.55Å; C899-I1144 VanDerWaalsContact CB-CD1 3.47Å; C899-I1144 HydrophobicContact CB-CG1 4.14Å; C899-I1144 WeakPolarHBondContact SG-CD1 3.09Å
900	I	67.9	Low	62.3	Low	2.25 Å²	2.25	39.3 Å²	39.3	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.7	175	-58.8	173.3	0	0	0	108.2	L872 L876 P877 L880 L891 V892 V893 I908 T909 H910 M911	L872-I900 HydrophobicContact CB-CD1 4.28Å; L872-I900 HydrophobicContact CD1-CD1 3.92Å; L872-I900 HydrophobicContact CD1-CG1 4.28Å; L876-I900 HydrophobicContact CB-CD1 4.18Å; L876-I900 HydrophobicContact CD2-CD1 3.38Å; L876-I900 VanDerWaalsContact CD2-CD1 3.49Å; L876-I900 HydrophobicContact CG-CD1 3.79Å; P877-I900 HydrophobicContact CG-CD1 3.95Å; P877-I900 HydrophobicContact CG-CG1 4.37Å; L880-I900 HydrophobicContact CD1-CD1 4.12Å; L880-I900 HydrophobicContact CD1-CG2 3.95Å; L891-I900 CarbonylContact C-O 3.43Å; L891-I900 HydrophobicContact CD2-CB 4.45Å; L891-I900 HydrophobicContact CD2-CG2 3.94Å; L891-I900 CarbonylContact O-C 3.59Å; L891-I900 VanDerWaalsContact O-C 3.31Å; L891-I900 VanDerWaalsContact O-O 3.06Å; V892-I900 VanDerWaalsContact CA-O 3.26Å; V892-I900 WeakPolarHBondContact CA-O 3.21Å; V892-I900 PolarHBondContact N-O 2.97Å; V893-I900 HydrophobicContact CB-CB 4.39Å; V893-I900 HydrophobicContact CB-CD1 4.16Å; V893-I900 HydrophobicContact CB-CG1 4.37Å; V893-I900 HydrophobicContact CG2-CD1 4.22Å; V893-I900 PolarHBondContact N-O 3.16Å; V893-I900 VanDerWaalsContact N-O 3.09Å; V893-I900 PolarHBondContact O-N 2.98Å; I900-I908 HydrophobicContact CG2-CD1 4.23Å; I900-I908 HydrophobicContact CG2-CG1 4.24Å; I900-I908 HydrophobicContact CG2-CG2 3.78Å; I900-T909 CarbonylContact C-O 3.55Å; I900-T909 WeakPolarHBondContact CA-O 3.3Å; I900-H910 HydrophobicContact CG1-CB 4.21Å; I900-H910 VanDerWaalsContact CG1-CD2 3.41Å; I900-H910 WeakPolarHBondContact CG1-CD2 3.29Å; I900-M911 HydrophobicContact CG1-CG 4.21Å
901	V	68.3	Low	62.8	Low	3 Å²	3	39.4 Å²	39.4	2%	0.018	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.9	179.1	-177.3	0	0	0	0	109.6	L891 V892 N903 I908 T909 H910 C1117 S1121	L891-V901 HydrophobicContact CD1-CG2 4.05Å; L891-V901 CarbonylContact O-C 3.5Å; L891-V901 VanDerWaalsContact O-CA 3.31Å; L891-V901 WeakPolarHBondContact O-CA 3.35Å; V892-V901 HydrophobicContact CG1-CG2 4.32Å; V892-V901 HydrophobicContact CG2-CG1 4.18Å; V892-V901 HydrophobicContact CG2-CG2 4.31Å; V901-N903 VanDerWaalsContact CG1-OD1 3.31Å; V901-N903 WeakPolarHBondContact CG1-OD1 3.46Å; V901-I908 CarbonylContact O-C 3.53Å; V901-I908 WeakPolarHBondContact O-CA 3.39Å; V901-T909 PolarHBondContact N-O 3.04Å; V901-T909 PolarHBondContact O-N 2.85Å; V901-T909 PolarHBondContact O-OG1 2.57Å; V901-H910 VanDerWaalsContact CB-CE1 3.45Å; V901-H910 WeakPolarHBondContact CB-CE1 3.35Å; V901-H910 WeakPolarHBondContact CG1-CE1 3.08Å; V901-H910 PolarHBondContact N-O 3.34Å; V901-H910 PolarHBondContact O-N 3.18Å; V901-C1117 HydrophobicContact CG2-CB 4.03Å; V901-S1121 VanDerWaalsContact CG1-CB 3.42Å
902	A	66.2	Low	63.2	Low	6.25 Å²	6.25	42.3 Å²	42.3	5%	0.052	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.2	171.2	0	0	0	0	0	110.6	L887 S889 C890 L891 V892 V907 I908	L887-A902 HydrophobicContact CD2-CB 4.41Å; S889-A902 CarbonylContact C-O 3.58Å; S889-A902 WeakPolarHBondContact CA-O 3.45Å; C890-A902 CarbonylContact C-O 3.6Å; C890-A902 VanDerWaalsContact CA-O 3.28Å; C890-A902 WeakPolarHBondContact CA-O 3.37Å; C890-A902 PolarHBondContact N-O 2.89Å; C890-A902 PolarHBondContact O-N 3.47Å; L891-A902 HydrophobicContact CB-CB 4.12Å; L891-A902 PolarHBondContact N-O 2.76Å; L891-A902 PolarHBondContact O-N 3.32Å; V892-A902 HydrophobicContact CG2-CB 3.75Å; A902-V907 CarbonylContact C-O 3.45Å; A902-V907 WeakPolarHBondContact CA-O 3.43Å; A902-I908 HydrophobicContact CB-CG1 3.9Å
903	N	65	Low	63.2	Low	14.25 Å²	14.25	44.7 Å²	44.7	8%	0.076	23%	0.228	C	C	.	.			trans	-85.6	170.6	174.1	-68.5	9.3	0	0	0	112.3	P888 S889 V901 D905 Q906 V907 T909 S1121 R1136	P888-N903 VanDerWaalsContact O-CA 3.24Å; P888-N903 WeakPolarHBondContact O-CA 2.95Å; S889-N903 CarbonylContact O-C 3.51Å; V901-N903 VanDerWaalsContact CG1-OD1 3.31Å; V901-N903 WeakPolarHBondContact CG1-OD1 3.46Å; N903-D905 VanDerWaalsContact C-N 3.28Å; N903-D905 PolarHBondContact ND2-OD2 2.95Å; N903-D905 PolarHBondContact O-N 3.21Å; N903-D905 VanDerWaalsContact O-N 3.14Å; N903-D905 WeakPolarHBondContact OD1-CA 3.44Å; N903-D905 WeakPolarHBondContact OD1-CB 3.24Å; N903-D905 PolarHBondContact OD1-N 3Å; N903-D905 VanDerWaalsContact OD1-N 3.17Å; N903-Q906 WeakPolarHBondContact O-CA 3.31Å; N903-Q906 PolarHBondContact O-N 3.08Å; N903-Q906 PolarHBondContact OD1-N 3.45Å; N903-V907 PolarHBondContact N-O 3.1Å; N903-V907 VanDerWaalsContact N-O 3.13Å; N903-V907 WeakPolarHBondContact OD1-CA 3.26Å; N903-V907 WeakPolarHBondContact OD1-CB 3.39Å; N903-V907 PolarHBondContact OD1-N 2.91Å; N903-V907 PolarHBondContact OD1-O 3.06Å; N903-T909 HydrophobicContact CB-CG2 3.82Å; N903-S1121 VanDerWaalsContact OD1-CA 3.28Å; N903-S1121 WeakPolarHBondContact OD1-CA 3.43Å; N903-S1121 WeakPolarHBondContact OD1-CB 3.3Å; N903-R1136 VanDerWaalsContact CG-NH2 3.3Å; N903-R1136 PolarHBondContact ND2-NE 2.88Å; N903-R1136 PolarHBondContact ND2-NH2 3Å; N903-R1136 PolarHBondContact OD1-NH2 2.84Å
904	E	63.3	Low	63.1	Low	107 Å²	107	50.6 Å²	50.6	50%	0.5	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-29.7	170.6	-64.5	-166.3	157.1	0	0	113.3	P888 S889 C890 Q906 S1121 P1124	P888-E904 HydrophobicContact CB-CG 4.37Å; P888-E904 PolarHBondContact O-N 3.03Å; S889-E904 WeakPolarHBondContact O-CA 3.28Å; S889-E904 PolarHBondContact O-N 3.02Å; S889-E904 PolarHBondContact OG-OE1 3.32Å; C890-E904 HydrophobicContact CB-CG 4.45Å; E904-Q906 PolarHBondContact O-N 3.28Å; E904-S1121 PolarHBondContact N-O 3.03Å; E904-P1124 WeakPolarHBondContact OE2-CG 3.47Å
905	D	61.7	Low	62.8	Low	95.75 Å²	95.75	54.6 Å²	54.6	51%	0.512	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	7.8	174.1	-62.2	-50.2	0	0	0	113.7	N903 V907 L1125	N903-D905 VanDerWaalsContact C-N 3.28Å; N903-D905 PolarHBondContact ND2-OD2 2.95Å; N903-D905 PolarHBondContact O-N 3.21Å; N903-D905 VanDerWaalsContact O-N 3.14Å; N903-D905 WeakPolarHBondContact OD1-CA 3.44Å; N903-D905 WeakPolarHBondContact OD1-CB 3.24Å; N903-D905 PolarHBondContact OD1-N 3Å; N903-D905 VanDerWaalsContact OD1-N 3.17Å; D905-V907 HydrophobicContact CB-CG2 4.27Å; D905-V907 PolarHBondContact O-N 3.04Å; D905-V907 VanDerWaalsContact O-N 3.17Å; D905-L1125 HydrophobicContact CB-CD1 4.16Å; D905-L1125 VanDerWaalsContact OD2-CB 3.29Å; D905-L1125 WeakPolarHBondContact OD2-CB 3.38Å; D905-L1125 WeakPolarHBondContact OD2-CD1 3.43Å; D905-L1125 WeakPolarHBondContact OD2-CG 3.42Å; D905-L1125 PolarHBondContact OD2-N 3.08Å
906	Q	60.5	Low	62.5	Low	124 Å²	124	56.2 Å²	56.2	58%	0.579	29%	0.288	S	S	*	.			trans	61.7	17.7	-176.3	-54.5	-176.5	2.6	0	0	115.1	P884 N903 E904 I908	P884-Q906 PolarHBondContact O-NE2 3.35Å; N903-Q906 WeakPolarHBondContact O-CA 3.31Å; N903-Q906 PolarHBondContact O-N 3.08Å; N903-Q906 PolarHBondContact OD1-N 3.45Å; E904-Q906 PolarHBondContact O-N 3.28Å; Q906-I908 PolarHBondContact O-N 2.97Å
907	V	62	Low	62.2	Low	66.5 Å²	66.5	58.4 Å²	58.4	40%	0.403	30%	0.304	S	S	.	.			trans	-81.1	113.8	173.1	-178.9	0	0	0	0	109	A902 N903 D905 T909 L1125	A902-V907 CarbonylContact C-O 3.45Å; A902-V907 WeakPolarHBondContact CA-O 3.43Å; N903-V907 PolarHBondContact N-O 3.1Å; N903-V907 VanDerWaalsContact N-O 3.13Å; N903-V907 WeakPolarHBondContact OD1-CA 3.26Å; N903-V907 WeakPolarHBondContact OD1-CB 3.39Å; N903-V907 PolarHBondContact OD1-N 2.91Å; N903-V907 PolarHBondContact OD1-O 3.06Å; D905-V907 HydrophobicContact CB-CG2 4.27Å; D905-V907 PolarHBondContact O-N 3.04Å; D905-V907 VanDerWaalsContact O-N 3.17Å; V907-T909 PolarHBondContact O-N 3.25Å; V907-L1125 HydrophobicContact CG2-CD1 4.44Å
908	I	66.2	Low	61.6	Low	29.25 Å²	29.25	63.3 Å²	63.3	15%	0.15	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	125.1	174.7	-62.7	162.4	0	0	0	109.5	P877 L880 N881 I900 V901 A902 Q906 L1057 M1061	P877-I908 HydrophobicContact CB-CG2 4.27Å; L880-I908 VanDerWaalsContact C-CD1 3.48Å; L880-I908 HydrophobicContact CB-CD1 3.52Å; L880-I908 VanDerWaalsContact CB-CD1 3.42Å; L880-I908 HydrophobicContact CB-CG1 4.29Å; N881-I908 HydrophobicContact CB-CD1 4.4Å; N881-I908 VanDerWaalsContact OD1-CD1 3.3Å; N881-I908 WeakPolarHBondContact OD1-CD1 3.34Å; I900-I908 HydrophobicContact CG2-CD1 4.23Å; I900-I908 HydrophobicContact CG2-CG1 4.24Å; I900-I908 HydrophobicContact CG2-CG2 3.78Å; V901-I908 CarbonylContact O-C 3.53Å; V901-I908 WeakPolarHBondContact O-CA 3.39Å; A902-I908 HydrophobicContact CB-CG1 3.9Å; Q906-I908 PolarHBondContact O-N 2.97Å; I908-L1057 HydrophobicContact CB-CD2 4.48Å; I908-L1057 HydrophobicContact CG2-CD1 4.05Å; I908-L1057 HydrophobicContact CG2-CD2 4.24Å; I908-M1061 HydrophobicContact CD1-SD 3.52Å; I908-M1061 VanDerWaalsContact CD1-SD 3.52Å
909	T	67.6	Low	60.6	Low	29.5 Å²	29.5	67 Å²	67	18%	0.181	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	109.6	177.9	-31.7	0	0	0	0	109.8	I900 V901 N903 V907 M911 R1136 I1140	I900-T909 CarbonylContact C-O 3.55Å; I900-T909 WeakPolarHBondContact CA-O 3.3Å; V901-T909 PolarHBondContact N-O 3.04Å; V901-T909 PolarHBondContact O-N 2.85Å; V901-T909 PolarHBondContact O-OG1 2.57Å; N903-T909 HydrophobicContact CB-CG2 3.82Å; V907-T909 PolarHBondContact O-N 3.25Å; T909-M911 HydrophobicContact CG2-CE 3.93Å; T909-M911 HydrophobicContact CG2-CG 4.26Å; T909-M911 HydrophobicContact CG2-SD 4.06Å; T909-R1136 PolarHBondContact OG1-NH1 2.98Å; T909-I1140 HydrophobicContact CG2-CD1 4.16Å
910	H	70.6	Confident	59.3	Low	57.5 Å²	57.5	72.3 Å²	72.3	27%	0.266	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140	175.8	159.9	-120.4	0	0	0	110.4	P877 S898 C899 I900 V901 I912	P877-H910 HydrophobicContact CB-CB 4.2Å; P877-H910 HydrophobicContact CG-CB 3.62Å; P877-H910 VanDerWaalsContact CG-CB 3.41Å; S898-H910 WeakPolarHBondContact CB-NE2 3.38Å; C899-H910 CarbonylContact O-C 3.57Å; C899-H910 WeakPolarHBondContact O-CA 3.39Å; C899-H910 PolarHBondContact O-CD2 3.21Å; I900-H910 HydrophobicContact CG1-CB 4.21Å; I900-H910 VanDerWaalsContact CG1-CD2 3.41Å; I900-H910 WeakPolarHBondContact CG1-CD2 3.29Å; V901-H910 VanDerWaalsContact CB-CE1 3.45Å; V901-H910 WeakPolarHBondContact CB-CE1 3.35Å; V901-H910 WeakPolarHBondContact CG1-CE1 3.08Å; V901-H910 PolarHBondContact N-O 3.34Å; V901-H910 PolarHBondContact O-N 3.18Å; H910-I912 VanDerWaalsContact CE1-CG1 3.42Å; H910-I912 WeakPolarHBondContact CE1-CG1 3.32Å
911	M	68.5	Low	57.8	Low	26 Å²	26	74.7 Å²	74.7	13%	0.128	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.2	179.3	-82.3	-83.2	-102.2	0	0	108.5	S898 C899 I900 T909 D1060 T1137 I1140 K1141 I1144	S898-M911 CarbonylContact C-O 3.54Å; S898-M911 WeakPolarHBondContact CA-O 3.37Å; S898-M911 WeakPolarHBondContact CB-O 3.45Å; C899-M911 PolarHBondContact N-O 2.89Å; C899-M911 CarbonylContact O-C 3.56Å; C899-M911 WeakPolarHBondContact O-CA 2.99Å; C899-M911 PolarHBondContact O-N 3.44Å; I900-M911 HydrophobicContact CG1-CG 4.21Å; T909-M911 HydrophobicContact CG2-CE 3.93Å; T909-M911 HydrophobicContact CG2-CG 4.26Å; T909-M911 HydrophobicContact CG2-SD 4.06Å; M911-D1060 HydrophobicContact CE-CB 3.8Å; M911-D1060 HydrophobicContact SD-CB 4.23Å; M911-T1137 HydrophobicContact CE-CG2 4.42Å; M911-T1137 WeakPolarHBondContact CE-O 3.43Å; M911-T1137 HydrophobicContact SD-CG2 4.01Å; M911-I1140 HydrophobicContact CB-CG2 4.42Å; M911-I1140 HydrophobicContact CE-CB 4Å; M911-I1140 HydrophobicContact CE-CG2 4.04Å; M911-I1140 HydrophobicContact CG-CB 4.37Å; M911-I1140 HydrophobicContact CG-CG2 3.75Å; M911-I1140 HydrophobicContact SD-CG2 4.31Å; M911-K1141 VanDerWaalsContact CE-CA 3.49Å; M911-K1141 HydrophobicContact CE-CB 3.49Å; M911-K1141 HydrophobicContact CE-CD 4.15Å; M911-K1141 HydrophobicContact CE-CG 3.36Å; M911-K1141 VanDerWaalsContact CE-CG 3.43Å; M911-K1141 HydrophobicContact CG-CG 4.33Å; M911-K1141 HydrophobicContact SD-CD 4.08Å; M911-K1141 WeakPolarHBondContact SD-CE 3.37Å; M911-K1141 HydrophobicContact SD-CG 3.84Å; M911-K1141 WeakPolarHBondContact SD-CG 3.37Å; M911-I1144 HydrophobicContact CB-CD1 3.35Å; M911-I1144 VanDerWaalsContact CB-CD1 3.43Å; M911-I1144 HydrophobicContact CE-CD1 3.9Å; M911-I1144 HydrophobicContact CG-CD1 4Å
912	I	66.2	Low	56.4	Low	84.25 Å²	84.25	80 Å²	80	43%	0.432	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.6	175.7	-54.2	174.5	0	0	0	107.2	E874 L879 N897 S898 C899 H910 E914	E874-I912 HydrophobicContact CG-CD1 4.44Å; L879-I912 HydrophobicContact CD1-CD1 4.1Å; N897-I912 CarbonylContact O-C 3.29Å; N897-I912 VanDerWaalsContact O-CA 3.3Å; N897-I912 WeakPolarHBondContact O-CA 3.42Å; N897-I912 WeakPolarHBondContact O-CG2 3.32Å; S898-I912 CarbonylContact C-O 3.58Å; S898-I912 VanDerWaalsContact CA-O 3.22Å; S898-I912 WeakPolarHBondContact CA-O 3.4Å; S898-I912 VanDerWaalsContact CB-O 3.32Å; S898-I912 WeakPolarHBondContact CB-O 3.3Å; C899-I912 PolarHBondContact N-O 2.91Å; C899-I912 PolarHBondContact O-N 2.75Å; H910-I912 VanDerWaalsContact CE1-CG1 3.42Å; H910-I912 WeakPolarHBondContact CE1-CG1 3.32Å; I912-E914 PolarHBondContact O-N 3.44Å
913	K	62.3	Low	55	Low	65.5 Å²	65.5	85.9 Å²	85.9	29%	0.285	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-80.9	123.3	168.1	-171.6	-174	174.4	-162.2	0	106.9	N897 N915 D919 I1144	N897-K913 HydrophobicContact CB-CB 4.28Å; N897-K913 WeakPolarHBondContact O-CB 3.45Å; N897-K913 PolarHBondContact O-N 3.15Å; K913-N915 PolarHBondContact O-N 3.17Å; K913-D919 IonicContact NZ-OD2 3.25Å; K913-D919 PolarHBondContact NZ-OD2 2.88Å; K913-I1144 HydrophobicContact CB-CG2 4.11Å; K913-I1144 HydrophobicContact CG-CG2 4.37Å
914	E	57.2	Low	53.7	Low	131.5 Å²	131.5	89.5 Å²	89.5	61%	0.614	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-69.5	115.8	171.6	-69.6	174.9	169.8	0	0	108	P873 N897 I912 S916 R1145	P873-E914 VanDerWaalsContact CA-OE1 3.23Å; P873-E914 WeakPolarHBondContact CA-OE1 3.4Å; P873-E914 HydrophobicContact CB-CG 4.27Å; P873-E914 WeakPolarHBondContact CB-OE1 3.37Å; P873-E914 HydrophobicContact CG-CG 4.39Å; N897-E914 PolarHBondContact O-N 3.38Å; I912-E914 PolarHBondContact O-N 3.44Å; E914-S916 PolarHBondContact O-N 3.11Å; E914-S916 VanDerWaalsContact O-N 3.14Å; E914-R1145 IonicContact OE1-NH2 2.81Å; E914-R1145 PolarHBondContact OE1-NH2 3.46Å; E914-R1145 IonicContact OE2-CZ 3.32Å; E914-R1145 IonicContact OE2-NH2 3.56Å; E914-R1145 PolarHBondContact OE2-NH2 2.85Å
915	N	50.9	Low	52.5	Low	110.75 Å²	110.75	88 Å²	88	59%	0.592	48%	0.48	S	S	*	.			trans	-63.2	117	173.9	-76.8	9.3	0	0	0	108.9	N897 K913 D917	N897-N915 PolarHBondContact ND2-OD1 3.13Å; N897-N915 VanDerWaalsContact ND2-OD1 3.14Å; N897-N915 PolarHBondContact OD1-OD1 3.35Å; N897-N915 VanDerWaalsContact OD1-OD1 3.14Å; K913-N915 PolarHBondContact O-N 3.17Å; N915-D917 WeakPolarHBondContact CB-OD2 3.45Å; N915-D917 PolarHBondContact ND2-OD2 3.37Å; N915-D917 PolarHBondContact O-N 2.88Å
916	S	49.3	Very low	51.6	Low	58.25 Å²	58.25	86.6 Å²	86.6	41%	0.407	47%	0.474	S	S	.	.			trans	-93.8	112.5	161.6	56.9	0	0	0	0	108.2	E914 D918 D919 A921 K1147	E914-S916 PolarHBondContact O-N 3.11Å; E914-S916 VanDerWaalsContact O-N 3.14Å; S916-D918 PolarHBondContact O-N 2.72Å; S916-D919 PolarHBondContact O-N 3.05Å; S916-D919 VanDerWaalsContact O-N 3.14Å; S916-D919 PolarHBondContact OG-OD1 3.04Å; S916-A921 VanDerWaalsContact OG-CB 3.23Å; S916-A921 WeakPolarHBondContact OG-CB 3.44Å; S916-K1147 PolarHBondContact OG-NZ 3.46Å
917	D	44.6	Very low	50.9	Low	151.5 Å²	151.5	84.4 Å²	84.4	81%	0.81	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-6.9	-176.9	-74	-31.7	0	0	0	114.3	N915	N915-D917 WeakPolarHBondContact CB-OD2 3.45Å; N915-D917 PolarHBondContact ND2-OD2 3.37Å; N915-D917 PolarHBondContact O-N 2.88Å
918	D	45.5	Very low	50.2	Low	153.25 Å²	153.25	82.3 Å²	82.3	82%	0.82	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	1.4	-174.9	-73.9	-35	0	0	0	115.4	S916 V920	S916-D918 PolarHBondContact O-N 2.72Å; D918-V920 PolarHBondContact O-N 2.82Å
919	D	42.2	Very low	49.4	Very low	87.25 Å²	87.25	85.9 Å²	85.9	47%	0.467	47%	0.468	S	S	.	.			trans	-99	48.2	-177.6	-99.6	-9.8	0	0	0	113.3	K913 S916 A921 K1147	K913-D919 IonicContact NZ-OD2 3.25Å; K913-D919 PolarHBondContact NZ-OD2 2.88Å; S916-D919 PolarHBondContact O-N 3.05Å; S916-D919 VanDerWaalsContact O-N 3.14Å; S916-D919 PolarHBondContact OG-OD1 3.04Å; D919-A921 VanDerWaalsContact C-N 3.29Å; D919-A921 PolarHBondContact O-N 3.01Å; D919-K1147 IonicContact OD1-NZ 3.28Å; D919-K1147 PolarHBondContact OD1-NZ 3.33Å; D919-K1147 IonicContact OD2-NZ 3.83Å; D919-K1147 PolarHBondContact OD2-NZ 2.83Å
920	V	39.5	Very low	48.5	Very low	115.25 Å²	115.25	88.9 Å²	88.9	70%	0.698	49%	0.488	S	S	*	.			trans	-76.6	88.6	176.8	-173.5	0	0	0	0	109.7	P862 D918 T922	P862-V920 HydrophobicContact CB-CG1 4.49Å; D918-V920 PolarHBondContact O-N 2.82Å; V920-T922 PolarHBondContact O-N 3.12Å; V920-T922 PolarHBondContact O-OG1 3.03Å
921	A	37.2	Very low	47.5	Very low	53 Å²	53	92.8 Å²	92.8	44%	0.438	51%	0.507	S	S	.	.			trans	-65.5	93	173.2	0	0	0	0	0	110.3	S916 D919 Y923	S916-A921 VanDerWaalsContact OG-CB 3.23Å; S916-A921 WeakPolarHBondContact OG-CB 3.44Å; D919-A921 VanDerWaalsContact C-N 3.29Å; D919-A921 PolarHBondContact O-N 3.01Å; A921-Y923 VanDerWaalsContact C-N 3.26Å; A921-Y923 HydrophobicContact CB-CD2 4.05Å; A921-Y923 HydrophobicContact CB-CE2 3.59Å; A921-Y923 PolarHBondContact O-N 3.2Å
922	T	37.1	Very low	46.6	Very low	114.5 Å²	114.5	93.3 Å²	93.3	70%	0.702	51%	0.509	S	S	*	.			trans	-74.9	85.4	170.4	-51.5	0	0	0	0	107.9	V920 P924	V920-T922 PolarHBondContact O-N 3.12Å; V920-T922 PolarHBondContact O-OG1 3.03Å; T922-P924 WeakPolarHBondContact O-CD 3.45Å
923	Y	38.2	Very low	45.8	Very low	129 Å²	129	90.5 Å²	90.5	51%	0.506	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-75.7	130.1	163.9	-73.5	-82.4	0	0	0	108.2	S863 A921 P925 P1102 S1104 P1105 H1106 Q1107	S863-Y923 WeakPolarHBondContact OG-CD2 3.33Å; A921-Y923 VanDerWaalsContact C-N 3.26Å; A921-Y923 HydrophobicContact CB-CD2 4.05Å; A921-Y923 HydrophobicContact CB-CE2 3.59Å; A921-Y923 PolarHBondContact O-N 3.2Å; Y923-P925 WeakPolarHBondContact O-CD 3.48Å; Y923-P1102 HydrophobicContact CE1-CB 4.38Å; Y923-S1104 PolarHBondContact OH-OG 3.34Å; Y923-P1105 HydrophobicContact CE1-CB 3.89Å; Y923-P1105 HydrophobicContact CE1-CG 4.31Å; Y923-H1106 AromaticContact CD2-NE2 3.76Å; Y923-Q1107 PolarHBondContact OH-NE2 3.08Å; Y923-Q1107 PolarHBondContact OH-OE1 3.37Å
924	P	36.5	Very low	45.1	Very low	90 Å²	90	90.4 Å²	90.4	58%	0.584	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-60.1	128.1	176.5	24	-30.7	0	0	0	107.8	T922 T926 I927	T922-P924 WeakPolarHBondContact O-CD 3.45Å; P924-T926 PolarHBondContact O-N 3.2Å; P924-I927 HydrophobicContact CB-CD1 4.48Å
925	P	39	Very low	44.6	Very low	76.5 Å²	76.5	86.7 Å²	86.7	50%	0.497	49%	0.488	S	S	.	.	S	Bend	trans	-59.5	134	171.6	21.7	-24.5	0	0	0	108.7	L861 Y923 I927	L861-P925 HydrophobicContact CB-CG 3.82Å; L861-P925 HydrophobicContact CD1-CB 4.36Å; L861-P925 HydrophobicContact CD1-CG 3.89Å; L861-P925 HydrophobicContact CD2-CB 4.14Å; L861-P925 HydrophobicContact CD2-CG 3.75Å; L861-P925 HydrophobicContact CG-CG 4.03Å; Y923-P925 WeakPolarHBondContact O-CD 3.48Å; P925-I927 HydrophobicContact CB-CG1 4.46Å; P925-I927 HydrophobicContact CG-CD1 3.8Å; P925-I927 HydrophobicContact CG-CG1 4.1Å; P925-I927 WeakPolarHBondContact O-CG1 3.36Å; P925-I927 PolarHBondContact O-N 3.1Å
926	T	41.8	Very low	44.5	Very low	65.25 Å²	65.25	82.4 Å²	82.4	40%	0.4	47%	0.465	S	S	.	.			trans	-58.7	101.1	175.3	19	0	0	0	0	111.9	L861 P924 L928 I933 R957 D960	L861-T926 HydrophobicContact CD2-CG2 3.21Å; P924-T926 PolarHBondContact O-N 3.2Å; T926-L928 VanDerWaalsContact C-N 3.33Å; T926-L928 WeakPolarHBondContact CB-O 3.42Å; T926-L928 CarbonylContact O-C 3.58Å; T926-L928 VanDerWaalsContact O-C 3.29Å; T926-L928 PolarHBondContact O-N 3.16Å; T926-L928 PolarHBondContact OG1-O 3.27Å; T926-I933 HydrophobicContact CG2-CD1 4.47Å; T926-R957 PolarHBondContact O-NH2 2.86Å; T926-D960 PolarHBondContact OG1-OD1 2.83Å
927	I	47.3	Very low	44.3	Very low	77.25 Å²	77.25	83.1 Å²	83.1	40%	0.396	46%	0.462	S	S	.	.	S	Bend	trans	-68.4	48.1	176.2	-61.8	167	0	0	0	109.5	S389 D390 P504 I505 A858 P924 P925 E929	S389-I927 VanDerWaalsContact O-CD1 3.3Å; S389-I927 WeakPolarHBondContact O-CD1 3.13Å; D390-I927 HydrophobicContact CB-CD1 3.69Å; D390-I927 HydrophobicContact CB-CG1 4.19Å; D390-I927 WeakPolarHBondContact OD1-CD1 3.27Å; P504-I927 WeakPolarHBondContact CA-O 3.15Å; I505-I927 HydrophobicContact CB-CG2 3.94Å; I505-I927 PolarHBondContact N-O 2.75Å; A858-I927 HydrophobicContact CB-CG1 4.11Å; A858-I927 HydrophobicContact CB-CG2 4.36Å; P924-I927 HydrophobicContact CB-CD1 4.48Å; P925-I927 HydrophobicContact CB-CG1 4.46Å; P925-I927 HydrophobicContact CG-CD1 3.8Å; P925-I927 HydrophobicContact CG-CG1 4.1Å; P925-I927 WeakPolarHBondContact O-CG1 3.36Å; P925-I927 PolarHBondContact O-N 3.1Å; I927-E929 PolarHBondContact O-N 3.43Å
928	L	47.5	Very low	44.3	Very low	22 Å²	22	78.7 Å²	78.7	12%	0.115	44%	0.437	C	S	.	.	S	Bend	trans	-78.9	134.8	172.6	-64.3	163.6	0	0	0	109.9	P352 I388 I505 A858 T926 E932 I933 L936 A955	P352-L928 HydrophobicContact CG-CD2 3.82Å; I388-L928 HydrophobicContact CG2-CD1 3.61Å; I388-L928 HydrophobicContact CG2-CD2 4.22Å; I388-L928 HydrophobicContact CG2-CG 3.97Å; I505-L928 HydrophobicContact CB-CD2 4.31Å; I505-L928 HydrophobicContact CD1-CD2 4.49Å; I505-L928 HydrophobicContact CG2-CD2 3.86Å; A858-L928 HydrophobicContact CB-CD1 3.94Å; T926-L928 VanDerWaalsContact C-N 3.33Å; T926-L928 WeakPolarHBondContact CB-O 3.42Å; T926-L928 CarbonylContact O-C 3.58Å; T926-L928 VanDerWaalsContact O-C 3.29Å; T926-L928 PolarHBondContact O-N 3.16Å; T926-L928 PolarHBondContact OG1-O 3.27Å; L928-E932 VanDerWaalsContact CA-OE2 3.23Å; L928-E932 WeakPolarHBondContact CA-OE2 3.38Å; L928-E932 HydrophobicContact CB-CB 4.2Å; L928-E932 HydrophobicContact CD2-CB 4.2Å; L928-E932 WeakPolarHBondContact CD2-OE2 3.49Å; L928-I933 HydrophobicContact CB-CB 4.4Å; L928-I933 HydrophobicContact CB-CD1 4.25Å; L928-I933 HydrophobicContact CB-CG1 3.7Å; L928-I933 HydrophobicContact CD1-CG1 4.24Å; L928-I933 HydrophobicContact CG-CG1 4.33Å; L928-I933 WeakPolarHBondContact O-CD1 3.2Å; L928-L936 HydrophobicContact CD1-CD1 3.47Å; L928-L936 VanDerWaalsContact CD1-CD1 3.43Å; L928-L936 HydrophobicContact CD2-CD1 4.16Å; L928-A955 HydrophobicContact CD1-CB 3.81Å
929	E	49.1	Very low	44.3	Very low	106.25 Å²	106.25	76.7 Å²	76.7	50%	0.496	43%	0.426	S	S	.	.			trans	-62.7	156.3	175.2	-71.6	-158.3	162.2	0	0	111.3	I927 Q931 E932 I933	I927-E929 PolarHBondContact O-N 3.43Å; E929-Q931 PolarHBondContact O-N 3.01Å; E929-Q931 VanDerWaalsContact O-N 3.09Å; E929-E932 HydrophobicContact CB-CB 4.33Å; E929-E932 HydrophobicContact CB-CG 4.12Å; E929-E932 PolarHBondContact N-OE2 3.21Å; E929-E932 CarbonylContact O-C 3.58Å; E929-E932 WeakPolarHBondContact O-CA 3.3Å; E929-E932 WeakPolarHBondContact O-CB 3.39Å; E929-E932 PolarHBondContact O-N 3.29Å; E929-I933 WeakPolarHBondContact O-CB 3.32Å; E929-I933 WeakPolarHBondContact O-CG1 3.36Å; E929-I933 PolarHBondContact O-N 3.29Å
930	P	47.7	Very low	44.5	Very low	91.5 Å²	91.5	74.1 Å²	74.1	59%	0.594	41%	0.412	S	S	*	.	H	α-helix	trans	-52.4	-32.7	175.6	-26.9	35.1	0	0	0	114.1	I933 S934	P930-I933 PolarHBondContact O-N 3.09Å; P930-S934 VanDerWaalsContact O-CB 3.31Å; P930-S934 WeakPolarHBondContact O-CB 3.29Å; P930-S934 PolarHBondContact O-N 3.22Å; P930-S934 VanDerWaalsContact O-N 3.08Å; P930-S934 PolarHBondContact O-OG 3.08Å
931	Q	49.4	Very low	44.8	Very low	140.75 Å²	140.75	73.1 Å²	73.1	66%	0.658	40%	0.402	S	S	*	.	H	α-helix	trans	-72.1	-44.3	175.4	-62.5	165.3	-9.8	0	0	111.9	E929 I933 S934 T935	E929-Q931 PolarHBondContact O-N 3.01Å; E929-Q931 VanDerWaalsContact O-N 3.09Å; Q931-I933 VanDerWaalsContact C-N 3.32Å; Q931-I933 PolarHBondContact O-N 2.71Å; Q931-S934 WeakPolarHBondContact O-CA 3.46Å; Q931-S934 WeakPolarHBondContact O-CB 3.36Å; Q931-S934 PolarHBondContact O-N 2.85Å; Q931-S934 PolarHBondContact O-OG 3.21Å; Q931-T935 WeakPolarHBondContact O-CG2 3.46Å; Q931-T935 PolarHBondContact O-N 3.11Å
932	E	50.1	Low	45.2	Very low	35.75 Å²	35.75	74.2 Å²	74.2	17%	0.167	41%	0.407	C	S	.	.	H	α-helix	trans	-63.8	-43.6	176.9	-62.5	176.2	142	0	0	110.7	P352 Y355 L928 E929 S934 T935 L936	P352-E932 HydrophobicContact CB-CB 4.45Å; P352-E932 HydrophobicContact CG-CB 4.12Å; Y355-E932 WeakPolarHBondContact CE2-OE1 3.07Å; Y355-E932 PolarHBondContact OH-OE1 3.47Å; L928-E932 VanDerWaalsContact CA-OE2 3.23Å; L928-E932 WeakPolarHBondContact CA-OE2 3.38Å; L928-E932 HydrophobicContact CB-CB 4.2Å; L928-E932 HydrophobicContact CD2-CB 4.2Å; L928-E932 WeakPolarHBondContact CD2-OE2 3.49Å; E929-E932 HydrophobicContact CB-CB 4.33Å; E929-E932 HydrophobicContact CB-CG 4.12Å; E929-E932 PolarHBondContact N-OE2 3.21Å; E929-E932 CarbonylContact O-C 3.58Å; E929-E932 WeakPolarHBondContact O-CA 3.3Å; E929-E932 WeakPolarHBondContact O-CB 3.39Å; E929-E932 PolarHBondContact O-N 3.29Å; E932-S934 VanDerWaalsContact C-N 3.27Å; E932-S934 PolarHBondContact O-N 3.04Å; E932-T935 WeakPolarHBondContact O-CA 3.09Å; E932-T935 WeakPolarHBondContact O-CB 3.47Å; E932-T935 PolarHBondContact O-N 3.23Å; E932-T935 VanDerWaalsContact O-N 3.08Å; E932-T935 PolarHBondContact O-OG1 3.05Å; E932-L936 VanDerWaalsContact O-CG 3.23Å; E932-L936 WeakPolarHBondContact O-CG 3.19Å; E932-L936 PolarHBondContact O-N 3.41Å
933	I	49	Very low	45.7	Very low	26.25 Å²	26.25	75.5 Å²	75.5	14%	0.135	41%	0.41	C	S	.	.	H	α-helix	trans	-54.7	-40.9	174.5	-70.5	-178	0	0	0	111.4	I856 T926 L928 E929 P930 Q931 T935 L936 H937 L954 Y956	I856-I933 HydrophobicContact CD1-CG2 4.11Å; T926-I933 HydrophobicContact CG2-CD1 4.47Å; L928-I933 HydrophobicContact CB-CB 4.4Å; L928-I933 HydrophobicContact CB-CD1 4.25Å; L928-I933 HydrophobicContact CB-CG1 3.7Å; L928-I933 HydrophobicContact CD1-CG1 4.24Å; L928-I933 HydrophobicContact CG-CG1 4.33Å; L928-I933 WeakPolarHBondContact O-CD1 3.2Å; E929-I933 WeakPolarHBondContact O-CB 3.32Å; E929-I933 WeakPolarHBondContact O-CG1 3.36Å; E929-I933 PolarHBondContact O-N 3.29Å; P930-I933 PolarHBondContact O-N 3.09Å; Q931-I933 VanDerWaalsContact C-N 3.32Å; Q931-I933 PolarHBondContact O-N 2.71Å; I933-T935 PolarHBondContact O-N 3.07Å; I933-T935 VanDerWaalsContact O-N 3.15Å; I933-L936 WeakPolarHBondContact O-CB 3.45Å; I933-L936 PolarHBondContact O-N 3.22Å; I933-L936 VanDerWaalsContact O-N 3.09Å; I933-H937 VanDerWaalsContact CG2-CD2 3.41Å; I933-H937 WeakPolarHBondContact CG2-CD2 3.43Å; I933-H937 WeakPolarHBondContact CG2-NE2 3.21Å; I933-H937 PolarHBondContact O-CD2 3.06Å; I933-H937 VanDerWaalsContact O-CD2 3.29Å; I933-H937 VanDerWaalsContact O-CG 3.3Å; I933-H937 PolarHBondContact O-N 2.73Å; I933-L954 WeakPolarHBondContact O-CD2 3.48Å; I933-Y956 HydrophobicContact CD1-CE1 4.19Å; I933-Y956 HydrophobicContact CG2-CE1 3.76Å; I933-Y956 WeakPolarHBondContact CG2-OH 3.34Å; I933-Y956 PolarHBondContact O-OH 2.88Å
934	S	47.6	Very low	46.3	Very low	63 Å²	63	72.7 Å²	72.7	44%	0.441	40%	0.403	S	S	.	.	H	α-helix	trans	-62.9	-26.3	179.5	-63.9	0	0	0	0	113.3	R853 P930 Q931 E932 L936 H937	R853-S934 PolarHBondContact NH1-OG 3.35Å; R853-S934 PolarHBondContact NH2-O 3.36Å; R853-S934 VanDerWaalsContact NH2-O 3.08Å; R853-S934 PolarHBondContact NH2-OG 3.47Å; P930-S934 VanDerWaalsContact O-CB 3.31Å; P930-S934 WeakPolarHBondContact O-CB 3.29Å; P930-S934 PolarHBondContact O-N 3.22Å; P930-S934 VanDerWaalsContact O-N 3.08Å; P930-S934 PolarHBondContact O-OG 3.08Å; Q931-S934 WeakPolarHBondContact O-CA 3.46Å; Q931-S934 WeakPolarHBondContact O-CB 3.36Å; Q931-S934 PolarHBondContact O-N 2.85Å; Q931-S934 PolarHBondContact O-OG 3.21Å; E932-S934 VanDerWaalsContact C-N 3.27Å; E932-S934 PolarHBondContact O-N 3.04Å; S934-L936 VanDerWaalsContact C-N 3.33Å; S934-H937 PolarHBondContact O-CE1 3.28Å; S934-H937 PolarHBondContact O-NE2 3.21Å
935	T	47.6	Very low	46.7	Very low	53 Å²	53	70.6 Å²	70.6	33%	0.325	39%	0.387	S	S	.	.	H	α-helix	trans	-79	-24.8	175.7	64.9	0	0	0	0	112.8	A855 Q931 E932 I933 H937	A855-T935 WeakPolarHBondContact CB-O 3.5Å; Q931-T935 WeakPolarHBondContact O-CG2 3.46Å; Q931-T935 PolarHBondContact O-N 3.11Å; E932-T935 WeakPolarHBondContact O-CA 3.09Å; E932-T935 WeakPolarHBondContact O-CB 3.47Å; E932-T935 PolarHBondContact O-N 3.23Å; E932-T935 VanDerWaalsContact O-N 3.08Å; E932-T935 PolarHBondContact O-OG1 3.05Å; I933-T935 PolarHBondContact O-N 3.07Å; I933-T935 VanDerWaalsContact O-N 3.15Å; T935-H937 PolarHBondContact O-CD2 2.96Å; T935-H937 PolarHBondContact O-N 3.24Å
936	L	47.4	Very low	46.8	Very low	21.25 Å²	21.25	69.7 Å²	69.7	11%	0.111	38%	0.38	C	S	.	.	H	α-helix	trans	-75.3	-7.9	179.2	-61.8	174.1	0	0	0	112.8	A350 P352 V825 V828 I856 A857 A858 L928 E932 I933 S934 M938 L954 A955 Y956	A350-L936 WeakPolarHBondContact O-CD2 3.45Å; P352-L936 HydrophobicContact CG-CD2 4.25Å; V825-L936 HydrophobicContact CG1-CD2 4.22Å; V825-L936 HydrophobicContact CG2-CD1 4.37Å; V828-L936 HydrophobicContact CG1-CD2 4.13Å; I856-L936 HydrophobicContact CD1-CB 3.13Å; I856-L936 HydrophobicContact CD1-CG 4.47Å; I856-L936 WeakPolarHBondContact CD1-O 3.35Å; I856-L936 WeakPolarHBondContact O-CB 3.32Å; I856-L936 WeakPolarHBondContact O-CD2 3.43Å; I856-L936 WeakPolarHBondContact O-CG 3.47Å; A857-L936 WeakPolarHBondContact CA-O 3.22Å; A857-L936 WeakPolarHBondContact CB-O 2.73Å; A858-L936 VanDerWaalsContact C-CD1 3.45Å; A858-L936 HydrophobicContact CB-CD1 4.04Å; A858-L936 WeakPolarHBondContact O-CD1 3.31Å; L928-L936 HydrophobicContact CD1-CD1 3.47Å; L928-L936 VanDerWaalsContact CD1-CD1 3.43Å; L928-L936 HydrophobicContact CD2-CD1 4.16Å; E932-L936 VanDerWaalsContact O-CG 3.23Å; E932-L936 WeakPolarHBondContact O-CG 3.19Å; E932-L936 PolarHBondContact O-N 3.41Å; I933-L936 WeakPolarHBondContact O-CB 3.45Å; I933-L936 PolarHBondContact O-N 3.22Å; I933-L936 VanDerWaalsContact O-N 3.09Å; S934-L936 VanDerWaalsContact C-N 3.33Å; L936-M938 PolarHBondContact O-N 3Å; L936-M938 VanDerWaalsContact O-N 3.09Å; L936-L954 HydrophobicContact CB-CD2 4.41Å; L936-A955 HydrophobicContact CD1-CB 4.45Å; L936-Y956 HydrophobicContact CD1-CE1 4.46Å
937	H	45	Very low	46.8	Very low	72.25 Å²	72.25	73.1 Å²	73.1	33%	0.334	40%	0.396	S	S	.	.			trans	-70.2	99.3	-177.4	-72.7	-66.5	0	0	0	112.8	R853 L854 S859 S860 I933 S934 T935 L939 C952	R853-H937 HydrophobicContact CG-CB 3.98Å; L854-H937 VanDerWaalsContact CB-CE1 3.44Å; L854-H937 WeakPolarHBondContact CB-CE1 3.49Å; L854-H937 WeakPolarHBondContact CB-ND1 3.29Å; L854-H937 PolarHBondContact O-CE1 2.8Å; L854-H937 PolarHBondContact O-ND1 2.88Å; L854-H937 PolarHBondContact O-NE2 2.79Å; S859-H937 VanDerWaalsContact CB-CE1 3.45Å; S859-H937 WeakPolarHBondContact CB-CE1 3.48Å; S860-H937 PolarHBondContact OG-CE1 3.4Å; S860-H937 PolarHBondContact OG-NE2 3.09Å; S860-H937 VanDerWaalsContact OG-NE2 3.07Å; I933-H937 VanDerWaalsContact CG2-CD2 3.41Å; I933-H937 WeakPolarHBondContact CG2-CD2 3.43Å; I933-H937 WeakPolarHBondContact CG2-NE2 3.21Å; I933-H937 PolarHBondContact O-CD2 3.06Å; I933-H937 VanDerWaalsContact O-CD2 3.29Å; I933-H937 VanDerWaalsContact O-CG 3.3Å; I933-H937 PolarHBondContact O-N 2.73Å; S934-H937 PolarHBondContact O-CE1 3.28Å; S934-H937 PolarHBondContact O-NE2 3.21Å; T935-H937 PolarHBondContact O-CD2 2.96Å; T935-H937 PolarHBondContact O-N 3.24Å; H937-L939 VanDerWaalsContact C-N 3.29Å; H937-L939 PolarHBondContact O-N 3.14Å; H937-C952 PolarHBondContact CE1-SG 2.91Å; H937-C952 PolarHBondContact ND1-SG 2.93Å
938	M	45	Very low	46.5	Very low	58.5 Å²	58.5	74.3 Å²	74.3	29%	0.288	41%	0.412	S	S	.	.			trans	-79.2	93.2	166.6	-91.4	-156.1	65.2	0	0	110.9	N347 V825 V828 E829 Y849 L854 L936 I940 A955	N347-M938 HydrophobicContact CB-CG 3.68Å; N347-M938 HydrophobicContact CB-SD 4.02Å; V825-M938 HydrophobicContact CB-SD 4.01Å; V825-M938 HydrophobicContact CG1-CE 4.4Å; V825-M938 HydrophobicContact CG1-SD 3.44Å; V825-M938 WeakPolarHBondContact CG1-SD 3.45Å; V825-M938 HydrophobicContact CG2-SD 3.73Å; V828-M938 HydrophobicContact CG1-CE 3.89Å; V828-M938 HydrophobicContact CG1-SD 3.77Å; V828-M938 WeakPolarHBondContact CG1-SD 3.31Å; E829-M938 HydrophobicContact CG-CE 3.84Å; Y849-M938 HydrophobicContact CD1-CE 3.17Å; Y849-M938 HydrophobicContact CD2-CE 3.6Å; Y849-M938 HydrophobicContact CE1-CE 3.29Å; Y849-M938 HydrophobicContact CE2-CE 3.72Å; Y849-M938 HydrophobicContact CG-CE 3.32Å; L854-M938 HydrophobicContact CD1-CE 3.48Å; L854-M938 VanDerWaalsContact CD1-CE 3.48Å; L854-M938 HydrophobicContact CD1-SD 3.69Å; L854-M938 PolarHBondContact N-O 3.14Å; L936-M938 PolarHBondContact O-N 3Å; L936-M938 VanDerWaalsContact O-N 3.09Å; M938-I940 VanDerWaalsContact C-N 3.32Å; M938-I940 HydrophobicContact CB-CG1 4.4Å; M938-I940 HydrophobicContact CE-CD1 4.29Å; M938-I940 HydrophobicContact CE-CG1 4.03Å; M938-I940 PolarHBondContact O-N 3.22Å; M938-A955 HydrophobicContact CB-CB 4.04Å; M938-A955 HydrophobicContact CG-CB 4.48Å; M938-A955 HydrophobicContact SD-CB 4.03Å
939	L	46.5	Very low	46.3	Very low	113 Å²	113	80.1 Å²	80.1	59%	0.592	44%	0.443	S	S	*	.			trans	-83.6	86.3	171.1	-86.2	129.7	0	0	0	110.4	V828 A831 A832 K851 R853 H937	V828-L939 HydrophobicContact CG1-CB 4.03Å; V828-L939 HydrophobicContact CG1-CD1 3.96Å; V828-L939 HydrophobicContact CG1-CD2 4.27Å; V828-L939 HydrophobicContact CG1-CG 4.29Å; A831-L939 HydrophobicContact CB-CD2 4.07Å; A832-L939 HydrophobicContact CB-CD1 3.51Å; A832-L939 HydrophobicContact CB-CD2 3.81Å; A832-L939 HydrophobicContact CB-CG 4.2Å; K851-L939 HydrophobicContact CB-CD2 3.84Å; K851-L939 HydrophobicContact CD-CB 4.42Å; R853-L939 HydrophobicContact CB-CD2 4.48Å; R853-L939 HydrophobicContact CG-CD2 4.45Å; H937-L939 VanDerWaalsContact C-N 3.29Å; H937-L939 PolarHBondContact O-N 3.14Å
940	I	46.9	Very low	46	Very low	32.5 Å²	32.5	78.8 Å²	78.8	17%	0.167	46%	0.458	C	S	.	.			trans	-89.5	128	170.1	-59.3	176.9	0	0	0	107.4	Y823 V828 T852 L854 M938 S942 L944 L945 L953	Y823-I940 HydrophobicContact CE1-CD1 4.43Å; Y823-I940 HydrophobicContact CE2-CD1 3.66Å; Y823-I940 WeakPolarHBondContact OH-CD1 3.33Å; V828-I940 HydrophobicContact CB-CD1 4.22Å; V828-I940 HydrophobicContact CG1-CD1 3.43Å; V828-I940 VanDerWaalsContact CG1-CD1 3.43Å; V828-I940 HydrophobicContact CG1-CG1 3.9Å; V828-I940 HydrophobicContact CG1-CG2 4.46Å; V828-I940 HydrophobicContact CG2-CD1 3.82Å; T852-I940 PolarHBondContact N-O 2.97Å; L854-I940 HydrophobicContact CD1-CB 3.9Å; L854-I940 HydrophobicContact CD1-CD1 3.45Å; L854-I940 VanDerWaalsContact CD1-CD1 3.45Å; L854-I940 HydrophobicContact CD1-CG1 3.69Å; M938-I940 VanDerWaalsContact C-N 3.32Å; M938-I940 HydrophobicContact CB-CG1 4.4Å; M938-I940 HydrophobicContact CE-CD1 4.29Å; M938-I940 HydrophobicContact CE-CG1 4.03Å; M938-I940 PolarHBondContact O-N 3.22Å; I940-S942 PolarHBondContact O-N 3.01Å; I940-L944 HydrophobicContact CG2-CB 3.98Å; I940-L944 HydrophobicContact CG2-CD1 3.66Å; I940-L944 VanDerWaalsContact CG2-CD1 3.45Å; I940-L944 HydrophobicContact CG2-CG 4.22Å; I940-L945 HydrophobicContact CB-CD1 3.85Å; I940-L945 HydrophobicContact CD1-CD1 3.83Å; I940-L945 HydrophobicContact CG1-CD1 4.44Å; I940-L945 HydrophobicContact CG2-CD1 3.61Å; I940-L945 VanDerWaalsContact CG2-CD1 3.41Å; I940-L953 HydrophobicContact CD1-CD1 4.36Å
941	D	45.8	Very low	45.8	Very low	93.25 Å²	93.25	76.7 Å²	76.7	50%	0.499	44%	0.444	S	S	.	.			trans	-53.7	130	177	-105.6	-35.8	0	0	0	110.9	T852 D943 L944	T852-D941 WeakPolarHBondContact CG2-OD2 3.18Å; D941-D943 PolarHBondContact O-N 3.22Å; D941-D943 VanDerWaalsContact O-N 3.08Å; D941-L944 HydrophobicContact CB-CD1 3.78Å; D941-L944 HydrophobicContact CB-CG 4.26Å; D941-L944 WeakPolarHBondContact O-CB 3.45Å; D941-L944 PolarHBondContact O-N 3.31Å; D941-L944 VanDerWaalsContact O-N 3.09Å
942	S	45.3	Very low	45.7	Very low	76.5 Å²	76.5	72.6 Å²	72.6	54%	0.535	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-58	-21.8	-177.6	-98.6	0	0	0	0	112.9	P850 T852 I940 L944 L945	P850-S942 PolarHBondContact O-OG 3.46Å; T852-S942 VanDerWaalsContact CG2-CB 3.41Å; T852-S942 WeakPolarHBondContact CG2-OG 3.45Å; T852-S942 PolarHBondContact OG1-OG 3.46Å; I940-S942 PolarHBondContact O-N 3.01Å; S942-L944 VanDerWaalsContact C-N 3.28Å; S942-L944 PolarHBondContact O-N 3.35Å; S942-L944 VanDerWaalsContact O-N 3.11Å; S942-L945 PolarHBondContact O-N 2.85Å; S942-L945 VanDerWaalsContact O-N 3.16Å
943	D	47.1	Very low	45.8	Very low	142.75 Å²	142.75	72.1 Å²	72.1	76%	0.763	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-67	-15	177.4	-67.7	-10.9	0	0	0	114.2	D941	D941-D943 PolarHBondContact O-N 3.22Å; D941-D943 VanDerWaalsContact O-N 3.08Å
944	L	50	Low	46.2	Very low	68.25 Å²	68.25	71.8 Å²	71.8	36%	0.357	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-87.4	-13.8	176.8	-74.8	160.3	0	0	0	113.3	L802 C810 L812 A831 A832 K835 I940 D941 S942	L802-L944 WeakPolarHBondContact CD2-O 3.38Å; C810-L944 VanDerWaalsContact SG-CD2 3.55Å; L812-L944 WeakPolarHBondContact CD1-O 3.2Å; A831-L944 HydrophobicContact CB-CD2 4.19Å; A832-L944 HydrophobicContact CB-CD1 4.19Å; K835-L944 HydrophobicContact CD-CD2 3.95Å; K835-L944 HydrophobicContact CD-CG 4.44Å; I940-L944 HydrophobicContact CG2-CB 3.98Å; I940-L944 HydrophobicContact CG2-CD1 3.66Å; I940-L944 VanDerWaalsContact CG2-CD1 3.45Å; I940-L944 HydrophobicContact CG2-CG 4.22Å; D941-L944 HydrophobicContact CB-CD1 3.78Å; D941-L944 HydrophobicContact CB-CG 4.26Å; D941-L944 WeakPolarHBondContact O-CB 3.45Å; D941-L944 PolarHBondContact O-N 3.31Å; D941-L944 VanDerWaalsContact O-N 3.09Å; S942-L944 VanDerWaalsContact C-N 3.28Å; S942-L944 PolarHBondContact O-N 3.35Å; S942-L944 VanDerWaalsContact O-N 3.11Å
945	L	44.8	Very low	46.7	Very low	47 Å²	47	69.3 Å²	69.3	25%	0.246	41%	0.411	C	S	.	.	S	Bend	trans	-105.6	122.4	179.3	-95.9	79.3	0	0	0	111.8	L812 L854 I940 S942 N947 C951 L953	L812-L945 HydrophobicContact CD1-CD2 3.66Å; L854-L945 HydrophobicContact CD1-CD1 3.81Å; L854-L945 HydrophobicContact CD1-CD2 3.56Å; L854-L945 HydrophobicContact CD1-CG 4.35Å; L854-L945 HydrophobicContact CD2-CD1 4Å; L854-L945 HydrophobicContact CD2-CD2 3.73Å; L854-L945 HydrophobicContact CG-CD2 4.13Å; I940-L945 HydrophobicContact CB-CD1 3.85Å; I940-L945 HydrophobicContact CD1-CD1 3.83Å; I940-L945 HydrophobicContact CG1-CD1 4.44Å; I940-L945 HydrophobicContact CG2-CD1 3.61Å; I940-L945 VanDerWaalsContact CG2-CD1 3.41Å; S942-L945 PolarHBondContact O-N 2.85Å; S942-L945 VanDerWaalsContact O-N 3.16Å; L945-N947 PolarHBondContact O-N 3.29Å; L945-N947 VanDerWaalsContact O-N 3.09Å; L945-C951 HydrophobicContact CD2-CB 4.42Å; L945-L953 HydrophobicContact CD1-CD1 4.13Å; L945-L953 HydrophobicContact CD2-CD1 3.78Å; L945-L953 HydrophobicContact CD2-CD2 4.24Å; L945-L953 HydrophobicContact CD2-CG 4.39Å; L945-L953 HydrophobicContact CG-CD1 4.38Å
946	P	41.3	Very low	47.4	Very low	56.75 Å²	56.75	67.5 Å²	67.5	37%	0.369	40%	0.398	S	S	.	.			trans	-67.4	115.8	173.6	15.8	-17.3	0	0	0	111.9	C810 L812 S948	C810-P946 WeakPolarHBondContact O-CB 3.47Å; C810-P946 VanDerWaalsContact SG-CG 3.59Å; L812-P946 HydrophobicContact CB-CG 4.15Å; L812-P946 HydrophobicContact CD1-CB 4.29Å; L812-P946 HydrophobicContact CD1-CG 3.62Å; L812-P946 HydrophobicContact CD2-CG 4.31Å; L812-P946 HydrophobicContact CG-CB 4.02Å; L812-P946 HydrophobicContact CG-CG 3.7Å; P946-S948 PolarHBondContact O-N 3.08Å; P946-S948 VanDerWaalsContact O-N 3.13Å
947	N	43.7	Very low	48.2	Very low	137 Å²	137	69.6 Å²	69.6	73%	0.733	41%	0.405	S	S	*	.	S	Bend	trans	-2.7	99.2	178.6	-66.2	-32.9	0	0	0	113.7	L945 N949	L945-N947 PolarHBondContact O-N 3.29Å; L945-N947 VanDerWaalsContact O-N 3.09Å; N947-N949 VanDerWaalsContact C-N 3.35Å; N947-N949 PolarHBondContact O-N 3.09Å; N947-N949 VanDerWaalsContact O-N 3.09Å
948	S	40.6	Very low	49	Very low	103.25 Å²	103.25	67.4 Å²	67.4	72%	0.722	39%	0.394	S	S	*	.			trans	-52.7	51.8	172	60.1	0	0	0	0	115.1	P946 G950	P946-S948 PolarHBondContact O-N 3.08Å; P946-S948 VanDerWaalsContact O-N 3.13Å; S948-G950 VanDerWaalsContact C-N 3.31Å; S948-G950 PolarHBondContact O-N 3.12Å
949	N	42	Very low	49.8	Very low	144.25 Å²	144.25	65.9 Å²	65.9	77%	0.771	39%	0.389	S	S	*	.	S	Bend	trans	-100.7	76	173	-83.2	-7.7	0	0	0	109.5	N947 C951	N947-N949 VanDerWaalsContact C-N 3.35Å; N947-N949 PolarHBondContact O-N 3.09Å; N947-N949 VanDerWaalsContact O-N 3.09Å; N949-C951 PolarHBondContact O-N 2.91Å; N949-C951 VanDerWaalsContact O-N 3.16Å
950	G	43.7	Very low	50.3	Low	78.5 Å²	78.5	62.2 Å²	62.2	81%	0.809	37%	0.37	S	S	*	.			trans	63.1	13.2	158.8	0	0	0	0	0	118.8	S948 C952	S948-G950 VanDerWaalsContact C-N 3.31Å; S948-G950 PolarHBondContact O-N 3.12Å; G950-C952 PolarHBondContact O-N 3.01Å; G950-C952 VanDerWaalsContact O-N 3.13Å
951	C	42.8	Very low	50.6	Low	46.25 Å²	46.25	62.1 Å²	62.1	31%	0.313	37%	0.369	S	S	.	.			trans	-72.2	119.4	178.9	-72.8	0	0	0	0	111	L812 Y821 L945 N949 L953	L812-C951 HydrophobicContact CD1-CB 4.47Å; Y821-C951 HydrophobicContact CD2-CB 3.85Å; Y821-C951 HydrophobicContact CE2-CB 4.01Å; L945-C951 HydrophobicContact CD2-CB 4.42Å; N949-C951 PolarHBondContact O-N 2.91Å; N949-C951 VanDerWaalsContact O-N 3.16Å; C951-L953 PolarHBondContact O-N 3.17Å
952	C	47.9	Very low	50.9	Low	55 Å²	55	59.1 Å²	59.1	37%	0.372	36%	0.36	S	S	.	.			trans	-77.6	121.1	173	-171.9	0	0	0	0	109.9	V820 Y821 H937 G950 L954	V820-C952 HydrophobicContact CG1-CB 4.46Å; V820-C952 HydrophobicContact CG2-CB 4.34Å; Y821-C952 PolarHBondContact N-O 2.99Å; H937-C952 PolarHBondContact CE1-SG 2.91Å; H937-C952 PolarHBondContact ND1-SG 2.93Å; G950-C952 PolarHBondContact O-N 3.01Å; G950-C952 VanDerWaalsContact O-N 3.13Å; C952-L954 HydrophobicContact CB-CD1 4.45Å; C952-L954 WeakPolarHBondContact SG-CD1 3.32Å
953	L	52	Low	51.3	Low	26 Å²	26	58.7 Å²	58.7	14%	0.136	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.9	174.7	-72.6	164.9	0	0	0	109.5	L812 Y821 Y823 L854 I940 L945 C951	L812-L953 HydrophobicContact CD1-CD2 4.47Å; Y821-L953 CarbonylContact O-C 3.58Å; Y821-L953 VanDerWaalsContact O-CA 3.3Å; Y821-L953 WeakPolarHBondContact O-CA 3.19Å; Y823-L953 HydrophobicContact CD1-CD2 4.26Å; Y823-L953 HydrophobicContact CE1-CB 4.31Å; Y823-L953 HydrophobicContact CE2-CB 4.15Å; Y823-L953 HydrophobicContact CE2-CD1 4.16Å; Y823-L953 HydrophobicContact CE2-CD2 4.1Å; Y823-L953 HydrophobicContact CE2-CG 4.35Å; L854-L953 HydrophobicContact CD2-CB 3.57Å; L854-L953 HydrophobicContact CD2-CD1 3.74Å; L854-L953 VanDerWaalsContact CD2-CD1 3.49Å; L854-L953 HydrophobicContact CD2-CG 4.37Å; I940-L953 HydrophobicContact CD1-CD1 4.36Å; L945-L953 HydrophobicContact CD1-CD1 4.13Å; L945-L953 HydrophobicContact CD2-CD1 3.78Å; L945-L953 HydrophobicContact CD2-CD2 4.24Å; L945-L953 HydrophobicContact CD2-CG 4.39Å; L945-L953 HydrophobicContact CG-CD1 4.38Å; C951-L953 PolarHBondContact O-N 3.17Å
954	L	57.8	Low	51.7	Low	20.25 Å²	20.25	56.2 Å²	56.2	11%	0.106	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.8	-177.3	-117.8	104.8	0	0	0	111	F790 V820 Y821 V822 Y823 A855 A857 P862 I933 L936 C952 Y956	F790-L954 HydrophobicContact CE1-CD2 4.12Å; F790-L954 HydrophobicContact CZ-CD2 3.8Å; V820-L954 HydrophobicContact CG1-CB 3.94Å; V820-L954 HydrophobicContact CG1-CD1 3.66Å; Y821-L954 PolarHBondContact O-N 3.2Å; Y821-L954 VanDerWaalsContact O-N 3.09Å; V822-L954 VanDerWaalsContact CA-O 3.31Å; V822-L954 WeakPolarHBondContact CA-O 3.35Å; V822-L954 HydrophobicContact CG1-CB 4.28Å; V822-L954 HydrophobicContact CG1-CD2 4.3Å; V822-L954 HydrophobicContact CG1-CG 4.39Å; V822-L954 WeakPolarHBondContact CG1-O 3.31Å; V822-L954 HydrophobicContact CG2-CB 4.3Å; V822-L954 HydrophobicContact CG2-CD2 4.32Å; Y823-L954 WeakPolarHBondContact CD1-O 3.32Å; Y823-L954 PolarHBondContact N-O 3.19Å; A855-L954 WeakPolarHBondContact O-CA 3.45Å; A857-L954 HydrophobicContact CB-CD1 4.22Å; A857-L954 HydrophobicContact CB-CD2 3.24Å; A857-L954 HydrophobicContact CB-CG 3.39Å; P862-L954 HydrophobicContact CG-CD1 3.67Å; P862-L954 HydrophobicContact CG-CD2 4.11Å; P862-L954 HydrophobicContact CG-CG 4.45Å; I933-L954 WeakPolarHBondContact O-CD2 3.48Å; L936-L954 HydrophobicContact CB-CD2 4.41Å; C952-L954 HydrophobicContact CB-CD1 4.45Å; C952-L954 WeakPolarHBondContact SG-CD1 3.32Å; L954-Y956 HydrophobicContact CB-CD2 4.24Å; L954-Y956 HydrophobicContact CB-CE2 3.62Å; L954-Y956 VanDerWaalsContact CB-OH 3.23Å; L954-Y956 WeakPolarHBondContact CB-OH 3.3Å; L954-Y956 WeakPolarHBondContact CD2-OH 3.41Å
955	A	58.4	Low	52	Low	10 Å²	10	57.4 Å²	57.4	8%	0.083	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	120.4	176.3	0	0	0	0	0	110.4	Y823 V825 V828 A855 I856 A857 L928 L936 M938	Y823-A955 HydrophobicContact CD2-CB 4.19Å; Y823-A955 HydrophobicContact CE1-CB 4.11Å; Y823-A955 HydrophobicContact CE2-CB 3.53Å; Y823-A955 VanDerWaalsContact CZ-CB 3.49Å; Y823-A955 WeakPolarHBondContact O-CA 3.43Å; Y823-A955 WeakPolarHBondContact OH-CB 3.25Å; V825-A955 HydrophobicContact CG2-CB 3.84Å; V828-A955 HydrophobicContact CG2-CB 4.44Å; A855-A955 PolarHBondContact O-N 3.01Å; A855-A955 VanDerWaalsContact O-N 3.15Å; I856-A955 HydrophobicContact CG2-CB 4.3Å; I856-A955 WeakPolarHBondContact CG2-O 3.45Å; A857-A955 WeakPolarHBondContact CA-O 3.39Å; A857-A955 HydrophobicContact CB-CB 3.49Å; A857-A955 VanDerWaalsContact CB-CB 3.49Å; A857-A955 WeakPolarHBondContact CB-O 2.96Å; A857-A955 PolarHBondContact N-O 3.48Å; L928-A955 HydrophobicContact CD1-CB 3.81Å; L936-A955 HydrophobicContact CD1-CB 4.45Å; M938-A955 HydrophobicContact CB-CB 4.04Å; M938-A955 HydrophobicContact CG-CB 4.48Å; M938-A955 HydrophobicContact SD-CB 4.03Å
956	Y	62	Low	52.5	Low	15 Å²	15	57.8 Å²	57.8	6%	0.059	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	129.8	177.3	-126.7	-93.9	0	0	0	111.4	T783 G786 F787 F790 V822 Y823 V825 I933 L936 L954 F958 D960 E961	T783-Y956 HydrophobicContact CG2-CD1 4.48Å; T783-Y956 HydrophobicContact CG2-CE1 4.18Å; T783-Y956 WeakPolarHBondContact O-CE1 3.29Å; G786-Y956 VanDerWaalsContact C-CZ 3.41Å; G786-Y956 VanDerWaalsContact CA-OH 3.24Å; G786-Y956 WeakPolarHBondContact CA-OH 3.29Å; G786-Y956 PolarHBondContact O-OH 3Å; F787-Y956 VanDerWaalsContact CA-CE1 3.45Å; F787-Y956 HydrophobicContact CB-CD1 3.63Å; F787-Y956 HydrophobicContact CB-CE1 3.54Å; F787-Y956 HydrophobicContact CB-CG 4.36Å; F787-Y956 AromaticContact CD2-CD1 3.65Å; F787-Y956 HydrophobicContact CD2-CD1 3.65Å; F787-Y956 HydrophobicContact CD2-CD2 4.33Å; F787-Y956 HydrophobicContact CD2-CE1 4.37Å; F787-Y956 AromaticContact CD2-CG 3.64Å; F787-Y956 HydrophobicContact CD2-CG 3.64Å; F787-Y956 HydrophobicContact CE2-CG 4.46Å; F787-Y956 HydrophobicContact CG-CD1 4.01Å; F787-Y956 HydrophobicContact CG-CE1 4.41Å; F787-Y956 HydrophobicContact CG-CG 4.44Å; F787-Y956 VanDerWaalsContact N-CE1 3.31Å; F787-Y956 PolarHBondContact N-OH 2.86Å; F790-Y956 HydrophobicContact CB-CD2 3.94Å; F790-Y956 HydrophobicContact CB-CE2 3.64Å; F790-Y956 HydrophobicContact CD1-CD2 4.13Å; F790-Y956 AromaticContact CD2-CD2 3.6Å; F790-Y956 HydrophobicContact CD2-CD2 3.6Å; F790-Y956 AromaticContact CD2-CE2 3.61Å; F790-Y956 HydrophobicContact CD2-CE2 3.61Å; F790-Y956 HydrophobicContact CE1-CD1 4.39Å; F790-Y956 HydrophobicContact CE1-CE1 4.33Å; F790-Y956 HydrophobicContact CE2-CD1 4.36Å; F790-Y956 AromaticContact CE2-CD2 4Å; F790-Y956 HydrophobicContact CE2-CD2 4.1Å; F790-Y956 HydrophobicContact CE2-CE1 4.14Å; F790-Y956 HydrophobicContact CE2-CE2 4.32Å; F790-Y956 AromaticContact CG-CD2 3.63Å; F790-Y956 HydrophobicContact CG-CD2 3.63Å; F790-Y956 AromaticContact CG-CE2 3.74Å; F790-Y956 HydrophobicContact CG-CE2 3.74Å; F790-Y956 AromaticContact CZ-CD1 3.9Å; F790-Y956 HydrophobicContact CZ-CD1 3.9Å; F790-Y956 AromaticContact CZ-CE1 3.56Å; F790-Y956 HydrophobicContact CZ-CE1 3.56Å; F790-Y956 HydrophobicContact CZ-CE2 4.39Å; F790-Y956 HydrophobicContact CZ-CG 4.47Å; F790-Y956 AromaticContact CZ-CZ 3.81Å; V822-Y956 HydrophobicContact CB-CD2 4.21Å; V822-Y956 HydrophobicContact CB-CE2 4.34Å; V822-Y956 HydrophobicContact CG1-CD2 3.35Å; V822-Y956 HydrophobicContact CG1-CE2 3.62Å; V822-Y956 HydrophobicContact CG1-CG 3.85Å; V822-Y956 HydrophobicContact CG2-CD2 4.2Å; V822-Y956 HydrophobicContact CG2-CE2 3.92Å; Y823-Y956 WeakPolarHBondContact O-CB 3.27Å; Y823-Y956 PolarHBondContact O-N 3.16Å; Y823-Y956 VanDerWaalsContact O-N 3.08Å; V825-Y956 WeakPolarHBondContact CG2-O 3.45Å; V825-Y956 PolarHBondContact N-O 2.98Å; I933-Y956 HydrophobicContact CD1-CE1 4.19Å; I933-Y956 HydrophobicContact CG2-CE1 3.76Å; I933-Y956 WeakPolarHBondContact CG2-OH 3.34Å; I933-Y956 PolarHBondContact O-OH 2.88Å; L936-Y956 HydrophobicContact CD1-CE1 4.46Å; L954-Y956 HydrophobicContact CB-CD2 4.24Å; L954-Y956 HydrophobicContact CB-CE2 3.62Å; L954-Y956 VanDerWaalsContact CB-OH 3.23Å; L954-Y956 WeakPolarHBondContact CB-OH 3.3Å; L954-Y956 WeakPolarHBondContact CD2-OH 3.41Å; Y956-F958 HydrophobicContact CD1-CE1 4.44Å; Y956-F958 HydrophobicContact CD1-CE2 4.49Å; Y956-F958 AromaticContact CD1-CZ 3.84Å; Y956-F958 HydrophobicContact CD1-CZ 4.14Å; Y956-F958 HydrophobicContact CD2-CE2 4.27Å; Y956-F958 HydrophobicContact CD2-CZ 4.5Å; Y956-F958 AromaticContact CG-CE2 3.89Å; Y956-F958 HydrophobicContact CG-CE2 4.07Å; Y956-F958 AromaticContact CG-CZ 3.94Å; Y956-F958 HydrophobicContact CG-CZ 3.99Å; Y956-F958 PolarHBondContact O-N 3.07Å; Y956-D960 HydrophobicContact CD2-CB 3.96Å; Y956-D960 HydrophobicContact CE2-CB 3.93Å; Y956-E961 PolarHBondContact OH-OE2 3.01Å
957	R	63.9	Low	53.3	Low	65 Å²	65	59.1 Å²	59.1	25%	0.245	34%	0.336	C	S	.	.			trans	-104.2	114.8	167.7	-115.3	177.4	-131.9	175	-4.1	109.4	D348 L349 Y739 V825 I856 T926 S959 D960	D348-R957 WeakPolarHBondContact O-CB 3.3Å; D348-R957 WeakPolarHBondContact O-CD 3.43Å; D348-R957 WeakPolarHBondContact O-CG 3.17Å; L349-R957 PolarHBondContact O-NH1 2.79Å; Y739-R957 PolarHBondContact OH-NH2 3.23Å; V825-R957 HydrophobicContact CB-CB 4.24Å; V825-R957 HydrophobicContact CB-CG 4.33Å; V825-R957 HydrophobicContact CG1-CG 4.5Å; V825-R957 HydrophobicContact CG2-CB 3.89Å; V825-R957 HydrophobicContact CG2-CG 3.96Å; I856-R957 VanDerWaalsContact CG2-NE 3.32Å; T926-R957 PolarHBondContact O-NH2 2.86Å; R957-S959 PolarHBondContact O-N 3.17Å; R957-S959 PolarHBondContact O-OG 3.24Å; R957-D960 WeakPolarHBondContact CA-OD2 3.2Å; R957-D960 WeakPolarHBondContact CB-OD2 3.32Å; R957-D960 PolarHBondContact N-OD2 3.25Å; R957-D960 IonicContact NE-OD2 3.53Å; R957-D960 VanDerWaalsContact O-CB 3.31Å; R957-D960 WeakPolarHBondContact O-CB 3.3Å; R957-D960 VanDerWaalsContact O-CG 3.28Å; R957-D960 PolarHBondContact O-N 2.75Å; R957-D960 VanDerWaalsContact O-N 3.11Å
958	F	62.6	Low	53.8	Low	27 Å²	27	56.3 Å²	56.3	12%	0.118	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	123.3	169.2	-120.1	-91.6	0	0	0	108.6	E381 L782 T783 F787 F790 Y956 D960	E381-F958 HydrophobicContact CB-CD1 3.59Å; E381-F958 HydrophobicContact CB-CE1 4.15Å; E381-F958 HydrophobicContact CG-CD1 3.86Å; L782-F958 HydrophobicContact CB-CD2 4.19Å; L782-F958 HydrophobicContact CB-CE1 4.24Å; L782-F958 HydrophobicContact CB-CE2 4.06Å; L782-F958 HydrophobicContact CB-CZ 3.57Å; L782-F958 HydrophobicContact CD1-CZ 4.34Å; L782-F958 HydrophobicContact CG-CZ 4.47Å; L782-F958 WeakPolarHBondContact O-CD2 3.28Å; L782-F958 WeakPolarHBondContact O-CE2 3.35Å; T783-F958 HydrophobicContact CG2-CB 4.25Å; F787-F958 HydrophobicContact CB-CD2 3.97Å; F787-F958 HydrophobicContact CB-CE2 4.31Å; F787-F958 AromaticContact CD2-CD2 3.66Å; F787-F958 HydrophobicContact CD2-CD2 3.66Å; F787-F958 AromaticContact CD2-CE2 3.44Å; F787-F958 HydrophobicContact CD2-CE2 3.44Å; F787-F958 VanDerWaalsContact CD2-CE2 3.44Å; F787-F958 HydrophobicContact CE2-CE2 4.12Å; F787-F958 HydrophobicContact CG-CD2 4.29Å; F787-F958 HydrophobicContact CG-CE2 4.24Å; F790-F958 HydrophobicContact CB-CE1 3.79Å; F790-F958 HydrophobicContact CB-CE2 3.82Å; F790-F958 HydrophobicContact CB-CZ 3.43Å; F790-F958 VanDerWaalsContact CB-CZ 3.43Å; F790-F958 HydrophobicContact CD1-CE1 4.32Å; F790-F958 AromaticContact CD1-CE2 3.79Å; F790-F958 HydrophobicContact CD1-CE2 3.79Å; F790-F958 AromaticContact CD1-CZ 3.34Å; F790-F958 HydrophobicContact CD1-CZ 3.34Å; F790-F958 AromaticContact CD2-CE1 3.35Å; F790-F958 HydrophobicContact CD2-CE1 3.35Å; F790-F958 HydrophobicContact CD2-CE2 4.3Å; F790-F958 AromaticContact CD2-CZ 3.18Å; F790-F958 HydrophobicContact CD2-CZ 3.18Å; F790-F958 HydrophobicContact CE1-CE2 4.36Å; F790-F958 AromaticContact CE1-CZ 3.75Å; F790-F958 HydrophobicContact CE1-CZ 3.75Å; F790-F958 AromaticContact CE2-CE1 3.88Å; F790-F958 HydrophobicContact CE2-CE1 3.88Å; F790-F958 AromaticContact CE2-CZ 3.59Å; F790-F958 HydrophobicContact CE2-CZ 3.59Å; F790-F958 AromaticContact CG-CE1 3.58Å; F790-F958 HydrophobicContact CG-CE1 3.58Å; F790-F958 AromaticContact CG-CE2 3.73Å; F790-F958 HydrophobicContact CG-CE2 3.73Å; F790-F958 AromaticContact CG-CZ 3.01Å; F790-F958 HydrophobicContact CG-CZ 3.01Å; F790-F958 AromaticContact CZ-CZ 3.86Å; F790-F958 HydrophobicContact CZ-CZ 3.86Å; Y956-F958 HydrophobicContact CD1-CE1 4.44Å; Y956-F958 HydrophobicContact CD1-CE2 4.49Å; Y956-F958 AromaticContact CD1-CZ 3.84Å; Y956-F958 HydrophobicContact CD1-CZ 4.14Å; Y956-F958 HydrophobicContact CD2-CE2 4.27Å; Y956-F958 HydrophobicContact CD2-CZ 4.5Å; Y956-F958 AromaticContact CG-CE2 3.89Å; Y956-F958 HydrophobicContact CG-CE2 4.07Å; Y956-F958 AromaticContact CG-CZ 3.94Å; Y956-F958 HydrophobicContact CG-CZ 3.99Å; Y956-F958 PolarHBondContact O-N 3.07Å; F958-D960 PolarHBondContact O-N 3.14Å
959	S	61.3	Low	54.7	Low	25.75 Å²	25.75	53 Å²	53	18%	0.18	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	40.3	59.7	-179.8	-31.4	0	0	0	0	111.6	E381 D382 R957 E961 G962 W964	E381-S959 VanDerWaalsContact C-OG 3.27Å; E381-S959 WeakPolarHBondContact CB-OG 3.23Å; D382-S959 PolarHBondContact N-OG 3.29Å; D382-S959 PolarHBondContact OD1-OG 3.45Å; R957-S959 PolarHBondContact O-N 3.17Å; R957-S959 PolarHBondContact O-OG 3.24Å; S959-E961 VanDerWaalsContact CA-OE2 3.29Å; S959-E961 WeakPolarHBondContact CA-OE2 3.32Å; S959-E961 PolarHBondContact N-OE2 3.23Å; S959-E961 PolarHBondContact O-N 3.34Å; S959-E961 VanDerWaalsContact O-N 3.16Å; S959-G962 PolarHBondContact O-N 3.3Å; S959-G962 VanDerWaalsContact O-N 3.15Å; S959-W964 PolarHBondContact O-NE1 3.06Å
960	D	56	Low	55.4	Low	35 Å²	35	48 Å²	48	19%	0.187	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	5.1	176.4	-11.8	-34.9	0	0	0	113.3	R623 R624 F790 A857 T926 Y956 R957 F958 G962	R623-D960 IonicContact CZ-OD2 3.08Å; R623-D960 IonicContact NH2-OD2 3Å; R623-D960 PolarHBondContact NH2-OD2 2.81Å; R624-D960 IonicContact CZ-OD2 3.61Å; R624-D960 IonicContact NH2-OD2 3.08Å; R624-D960 PolarHBondContact NH2-OD2 3.22Å; F790-D960 HydrophobicContact CD2-CB 4.36Å; F790-D960 HydrophobicContact CE2-CB 4.13Å; A857-D960 HydrophobicContact CB-CB 4.49Å; A857-D960 VanDerWaalsContact O-CG 3.26Å; T926-D960 PolarHBondContact OG1-OD1 2.83Å; Y956-D960 HydrophobicContact CD2-CB 3.96Å; Y956-D960 HydrophobicContact CE2-CB 3.93Å; R957-D960 WeakPolarHBondContact CA-OD2 3.2Å; R957-D960 WeakPolarHBondContact CB-OD2 3.32Å; R957-D960 PolarHBondContact N-OD2 3.25Å; R957-D960 IonicContact NE-OD2 3.53Å; R957-D960 VanDerWaalsContact O-CB 3.31Å; R957-D960 WeakPolarHBondContact O-CB 3.3Å; R957-D960 VanDerWaalsContact O-CG 3.28Å; R957-D960 PolarHBondContact O-N 2.75Å; R957-D960 VanDerWaalsContact O-N 3.11Å; F958-D960 PolarHBondContact O-N 3.14Å; D960-G962 PolarHBondContact O-N 2.88Å
961	E	53.4	Low	56	Low	32.25 Å²	32.25	48.6 Å²	48.6	15%	0.151	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	38.3	-178.4	12.7	-113.5	178.9	0	0	110.7	F790 Y956 S959 N963 R965	F790-E961 HydrophobicContact CB-CB 4.19Å; F790-E961 HydrophobicContact CD2-CB 4.4Å; Y956-E961 PolarHBondContact OH-OE2 3.01Å; S959-E961 VanDerWaalsContact CA-OE2 3.29Å; S959-E961 WeakPolarHBondContact CA-OE2 3.32Å; S959-E961 PolarHBondContact N-OE2 3.23Å; S959-E961 PolarHBondContact O-N 3.34Å; S959-E961 VanDerWaalsContact O-N 3.16Å; E961-N963 HydrophobicContact CG-CB 4.01Å; E961-N963 VanDerWaalsContact CG-CG 3.5Å; E961-N963 VanDerWaalsContact CG-ND2 3.26Å; E961-N963 WeakPolarHBondContact CG-ND2 3.33Å; E961-N963 CarbonylContact O-C 3.49Å; E961-N963 PolarHBondContact O-N 3.02Å; E961-N963 WeakPolarHBondContact OE1-CB 3.27Å; E961-N963 PolarHBondContact OE1-ND2 3.16Å; E961-R965 IonicContact OE1-CZ 2.73Å; E961-R965 IonicContact OE1-NE 3.79Å; E961-R965 IonicContact OE1-NH2 2.68Å; E961-R965 PolarHBondContact OE1-NH2 3.02Å; E961-R965 IonicContact OE2-CZ 3.8Å; E961-R965 IonicContact OE2-NE 2.7Å; E961-R965 PolarHBondContact OE2-NE 3.44Å; E961-R965 IonicContact OE2-NH2 3.51Å; E961-R965 PolarHBondContact OE2-NH2 2.87Å
962	G	53	Low	56.6	Low	29 Å²	29	49.4 Å²	49.4	30%	0.299	25%	0.253	S	S	.	.			trans	15.2	73.1	178.7	0	0	0	0	0	113.6	S959 D960 W964 R965	S959-G962 PolarHBondContact O-N 3.3Å; S959-G962 VanDerWaalsContact O-N 3.15Å; D960-G962 PolarHBondContact O-N 2.88Å; G962-W964 VanDerWaalsContact C-N 3.26Å; G962-W964 PolarHBondContact O-N 3.08Å; G962-W964 VanDerWaalsContact O-N 3.1Å; G962-W964 PolarHBondContact O-NE1 2.91Å; G962-R965 WeakPolarHBondContact O-CB 3.47Å; G962-R965 WeakPolarHBondContact O-CD 3.39Å; G962-R965 VanDerWaalsContact O-CG 3.28Å; G962-R965 WeakPolarHBondContact O-CG 3.02Å; G962-R965 PolarHBondContact O-N 2.99Å
963	N	53.7	Low	57	Low	69 Å²	69	49.5 Å²	49.5	37%	0.369	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	1.3	-0.7	179.7	-70.3	1.7	0	0	0	114.1	E789 E961 R965 S966 W967 W976 G978 R1097	E789-N963 PolarHBondContact OE2-ND2 2.92Å; E961-N963 HydrophobicContact CG-CB 4.01Å; E961-N963 VanDerWaalsContact CG-CG 3.5Å; E961-N963 VanDerWaalsContact CG-ND2 3.26Å; E961-N963 WeakPolarHBondContact CG-ND2 3.33Å; E961-N963 CarbonylContact O-C 3.49Å; E961-N963 PolarHBondContact O-N 3.02Å; E961-N963 WeakPolarHBondContact OE1-CB 3.27Å; E961-N963 PolarHBondContact OE1-ND2 3.16Å; N963-R965 VanDerWaalsContact C-N 3.29Å; N963-R965 WeakPolarHBondContact O-CA 3.24Å; N963-R965 PolarHBondContact O-N 3.32Å; N963-R965 VanDerWaalsContact O-N 3.12Å; N963-S966 PolarHBondContact O-N 3.43Å; N963-S966 PolarHBondContact O-OG 3.38Å; N963-W967 PolarHBondContact O-N 2.84Å; N963-W976 CarbonylContact O-C 3.3Å; N963-W976 WeakPolarHBondContact O-CB 3.49Å; N963-W976 VanDerWaalsContact O-O 3.12Å; N963-G978 WeakPolarHBondContact ND2-CA 3.41Å; N963-R1097 PolarHBondContact OD1-NH1 2.89Å
964	W	55.4	Low	57.4	Low	89 Å²	89	48.6 Å²	48.6	34%	0.337	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-57.1	38.1	169.7	-7	-5.6	0	0	0	111.9	D382 A385 S389 E391 S393 S959 G962 S966 W967 V975 W976 T977	D382-W964 HydrophobicContact CB-CB 3.66Å; D382-W964 WeakPolarHBondContact O-CB 3.35Å; A385-W964 HydrophobicContact CB-CD2 4.21Å; A385-W964 HydrophobicContact CB-CG 4.03Å; S389-W964 VanDerWaalsContact OG-CH2 3.28Å; S389-W964 WeakPolarHBondContact OG-CH2 3.36Å; S389-W964 VanDerWaalsContact OG-CZ3 3.3Å; S389-W964 WeakPolarHBondContact OG-CZ3 3.35Å; E391-W964 HydrophobicContact CG-CH2 4.23Å; E391-W964 HydrophobicContact CG-CZ3 4.3Å; E391-W964 WeakPolarHBondContact OE1-CH2 2.89Å; E391-W964 WeakPolarHBondContact OE1-CZ3 3.46Å; S393-W964 VanDerWaalsContact CB-CZ3 3.43Å; S959-W964 PolarHBondContact O-NE1 3.06Å; G962-W964 VanDerWaalsContact C-N 3.26Å; G962-W964 PolarHBondContact O-N 3.08Å; G962-W964 VanDerWaalsContact O-N 3.1Å; G962-W964 PolarHBondContact O-NE1 2.91Å; W964-S966 VanDerWaalsContact C-N 3.29Å; W964-S966 PolarHBondContact O-N 3.28Å; W964-W967 WeakPolarHBondContact O-CB 3.38Å; W964-W967 PolarHBondContact O-N 3.17Å; W964-V975 HydrophobicContact CB-CG1 4.49Å; W964-V975 HydrophobicContact CE3-CG1 3.76Å; W964-W976 WeakPolarHBondContact CA-O 3.34Å; W964-T977 HydrophobicContact CD2-CG2 3.83Å; W964-T977 HydrophobicContact CE3-CG2 3.69Å; W964-T977 HydrophobicContact CH2-CG2 3.49Å; W964-T977 VanDerWaalsContact CH2-CG2 3.49Å; W964-T977 HydrophobicContact CZ2-CG2 3.62Å; W964-T977 HydrophobicContact CZ3-CG2 3.53Å
965	R	56.8	Low	57.6	Low	94.5 Å²	94.5	48.9 Å²	48.9	36%	0.357	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-74.3	40.1	178.4	-63.8	173.4	175.5	-86.8	0.5	110	E391 N394 S860 E961 G962 N963 W967 V975 W976 C1100 P1102	E391-R965 IonicContact OE1-CZ 3.88Å; E391-R965 IonicContact OE1-NE 3.75Å; E391-R965 IonicContact OE1-NH1 3.03Å; E391-R965 PolarHBondContact OE1-NH1 2.82Å; E391-R965 IonicContact OE1-NH2 2.72Å; E391-R965 IonicContact OE2-CZ 3.14Å; E391-R965 IonicContact OE2-NH1 3.06Å; E391-R965 PolarHBondContact OE2-NH1 2.85Å; E391-R965 IonicContact OE2-NH2 3.8Å; N394-R965 PolarHBondContact ND2-O 3.48Å; S860-R965 PolarHBondContact OG-NH2 3.02Å; E961-R965 IonicContact OE1-CZ 2.73Å; E961-R965 IonicContact OE1-NE 3.79Å; E961-R965 IonicContact OE1-NH2 2.68Å; E961-R965 PolarHBondContact OE1-NH2 3.02Å; E961-R965 IonicContact OE2-CZ 3.8Å; E961-R965 IonicContact OE2-NE 2.7Å; E961-R965 PolarHBondContact OE2-NE 3.44Å; E961-R965 IonicContact OE2-NH2 3.51Å; E961-R965 PolarHBondContact OE2-NH2 2.87Å; G962-R965 WeakPolarHBondContact O-CB 3.47Å; G962-R965 WeakPolarHBondContact O-CD 3.39Å; G962-R965 VanDerWaalsContact O-CG 3.28Å; G962-R965 WeakPolarHBondContact O-CG 3.02Å; G962-R965 PolarHBondContact O-N 2.99Å; N963-R965 VanDerWaalsContact C-N 3.29Å; N963-R965 WeakPolarHBondContact O-CA 3.24Å; N963-R965 PolarHBondContact O-N 3.32Å; N963-R965 VanDerWaalsContact O-N 3.12Å; R965-W967 VanDerWaalsContact C-N 3.3Å; R965-W967 PolarHBondContact O-N 3.26Å; R965-W967 VanDerWaalsContact O-N 3.08Å; R965-V975 WeakPolarHBondContact O-CA 3.34Å; R965-W976 HydrophobicContact CB-CB 4.28Å; R965-W976 PolarHBondContact O-N 2.93Å; R965-C1100 HydrophobicContact CB-CB 4.23Å; R965-P1102 VanDerWaalsContact NH1-CB 3.3Å
966	S	53.9	Low	57.9	Low	55 Å²	55	53.8 Å²	53.8	39%	0.385	27%	0.27	S	S	.	.	S	Bend	trans	-74	66.2	174.6	57.4	0	0	0	0	111.2	N963 W964 T968 G974	N963-S966 PolarHBondContact O-N 3.43Å; N963-S966 PolarHBondContact O-OG 3.38Å; W964-S966 VanDerWaalsContact C-N 3.29Å; W964-S966 PolarHBondContact O-N 3.28Å; S966-T968 WeakPolarHBondContact CB-OG1 3.32Å; S966-T968 CarbonylContact O-C 3.52Å; S966-T968 PolarHBondContact O-N 3.15Å; S966-T968 VanDerWaalsContact O-N 3.1Å; S966-T968 VanDerWaalsContact O-O 3.09Å; S966-T968 PolarHBondContact OG-O 3.47Å; S966-T968 PolarHBondContact OG-OG1 2.89Å; S966-G974 CarbonylContact C-O 3.48Å; S966-G974 VanDerWaalsContact CA-O 3.32Å; S966-G974 WeakPolarHBondContact CA-O 3.43Å
967	W	58.2	Low	57.6	Low	85 Å²	85	55 Å²	55	32%	0.322	28%	0.279	S	S	.	.			trans	-75.9	118.3	178.6	-101.8	82.4	0	0	0	111.3	P377 F378 D382 N394 L395 T587 N963 W964 R965 N969 T972 S973 G974 W976	P377-W967 WeakPolarHBondContact O-CH2 3.43Å; P377-W967 WeakPolarHBondContact O-CZ3 3.19Å; F378-W967 VanDerWaalsContact CA-CH2 3.43Å; F378-W967 VanDerWaalsContact CA-CZ3 3.46Å; F378-W967 HydrophobicContact CB-CD2 3.91Å; F378-W967 HydrophobicContact CB-CE3 3.5Å; F378-W967 HydrophobicContact CB-CH2 3.7Å; F378-W967 HydrophobicContact CB-CZ2 4.03Å; F378-W967 HydrophobicContact CB-CZ3 3.42Å; F378-W967 VanDerWaalsContact CB-CZ3 3.42Å; D382-W967 WeakPolarHBondContact OD2-CZ2 3.3Å; D382-W967 PolarHBondContact OD2-NE1 3.12Å; N394-W967 WeakPolarHBondContact CB-O 3.33Å; L395-W967 HydrophobicContact CB-CB 4.12Å; T587-W967 HydrophobicContact CG2-CH2 3.69Å; T587-W967 HydrophobicContact CG2-CZ2 4.46Å; N963-W967 PolarHBondContact O-N 2.84Å; W964-W967 WeakPolarHBondContact O-CB 3.38Å; W964-W967 PolarHBondContact O-N 3.17Å; R965-W967 VanDerWaalsContact C-N 3.3Å; R965-W967 PolarHBondContact O-N 3.26Å; R965-W967 VanDerWaalsContact O-N 3.08Å; W967-N969 HydrophobicContact CH2-CB 3.58Å; W967-N969 HydrophobicContact CZ2-CB 4.48Å; W967-N969 HydrophobicContact CZ3-CB 3.76Å; W967-N969 PolarHBondContact O-N 3.01Å; W967-T972 PolarHBondContact NE1-OG1 2.82Å; W967-S973 CarbonylContact O-C 3.56Å; W967-S973 WeakPolarHBondContact O-CA 3.46Å; W967-G974 PolarHBondContact N-O 3.02Å; W967-G974 PolarHBondContact O-N 3.13Å; W967-W976 AromaticContact CE3-CD1 3.47Å; W967-W976 VanDerWaalsContact CE3-CD1 3.47Å; W967-W976 HydrophobicContact CE3-CG 4.38Å; W967-W976 AromaticContact CE3-NE1 3.93Å; W967-W976 HydrophobicContact CZ3-CB 4.47Å; W967-W976 AromaticContact CZ3-CD1 3.33Å; W967-W976 AromaticContact CZ3-CG 3.91Å; W967-W976 HydrophobicContact CZ3-CG 3.91Å; W967-W976 AromaticContact CZ3-NE1 3.71Å
968	T	55.1	Low	56.8	Low	76.25 Å²	76.25	53.7 Å²	53.7	47%	0.468	29%	0.286	S	S	.	.			trans	-109.9	130.1	171.6	49.6	0	0	0	0	110.1	S966 L970 T972	S966-T968 WeakPolarHBondContact CB-OG1 3.32Å; S966-T968 CarbonylContact O-C 3.52Å; S966-T968 PolarHBondContact O-N 3.15Å; S966-T968 VanDerWaalsContact O-N 3.1Å; S966-T968 VanDerWaalsContact O-O 3.09Å; S966-T968 PolarHBondContact OG-O 3.47Å; S966-T968 PolarHBondContact OG-OG1 2.89Å; T968-L970 PolarHBondContact O-N 2.87Å; T968-T972 WeakPolarHBondContact CA-O 3.42Å
969	N	59.4	Low	55.6	Low	34 Å²	34	60.9 Å²	60.9	18%	0.182	32%	0.32	C	S	.	.			trans	-94.5	146.4	172.5	126.8	4.2	0	0	0	110.2	R374 L375 E398 V402 W967 Y971 T972 S973	R374-N969 PolarHBondContact O-ND2 3.21Å; R374-N969 PolarHBondContact O-OD1 2.74Å; L375-N969 HydrophobicContact CD1-CB 4.4Å; E398-N969 HydrophobicContact CB-CB 4.38Å; E398-N969 VanDerWaalsContact CD-CB 3.5Å; E398-N969 HydrophobicContact CG-CB 3.93Å; E398-N969 VanDerWaalsContact OE2-CB 3.24Å; E398-N969 WeakPolarHBondContact OE2-CB 3.08Å; E398-N969 PolarHBondContact OE2-ND2 3.41Å; E398-N969 VanDerWaalsContact OE2-ND2 3.14Å; V402-N969 WeakPolarHBondContact CG1-ND2 3.39Å; W967-N969 HydrophobicContact CH2-CB 3.58Å; W967-N969 HydrophobicContact CZ2-CB 4.48Å; W967-N969 HydrophobicContact CZ3-CB 3.76Å; W967-N969 PolarHBondContact O-N 3.01Å; N969-Y971 PolarHBondContact O-N 3.01Å; N969-Y971 PolarHBondContact OD1-N 2.79Å; N969-T972 HydrophobicContact CB-CG2 4.43Å; N969-T972 WeakPolarHBondContact CB-OG1 3.36Å; N969-T972 PolarHBondContact N-O 2.77Å; N969-T972 PolarHBondContact N-OG1 3.46Å; N969-T972 VanDerWaalsContact N-OG1 3.08Å; N969-T972 PolarHBondContact O-N 3.22Å; N969-T972 VanDerWaalsContact O-N 3.11Å; N969-T972 PolarHBondContact O-OG1 3.22Å; N969-T972 PolarHBondContact OD1-N 3.04Å; N969-T972 PolarHBondContact OD1-O 2.96Å; N969-T972 PolarHBondContact OD1-OG1 3.4Å; N969-S973 VanDerWaalsContact C-OG 3.29Å; N969-S973 WeakPolarHBondContact O-CB 3.41Å; N969-S973 PolarHBondContact O-N 3.27Å; N969-S973 PolarHBondContact O-OG 3Å
970	L	56.9	Low	54.4	Low	40.75 Å²	40.75	65.9 Å²	65.9	21%	0.213	34%	0.34	C	S	.	.	H	α-helix	trans	-56.9	-21.8	179.9	-127.9	86.4	0	0	0	114.6	V581 R584 K585 T968 S973 G974 V975	V581-L970 HydrophobicContact CG1-CD2 4.15Å; R584-L970 HydrophobicContact CB-CD1 4.49Å; R584-L970 HydrophobicContact CB-CD2 4.05Å; R584-L970 HydrophobicContact CG-CD1 3.84Å; R584-L970 HydrophobicContact CG-CD2 4.2Å; K585-L970 HydrophobicContact CD-CD2 4.43Å; K585-L970 HydrophobicContact CG-CD2 3.58Å; T968-L970 PolarHBondContact O-N 2.87Å; L970-S973 WeakPolarHBondContact CA-OG 3.18Å; L970-G974 CarbonylContact O-C 3.32Å; L970-G974 WeakPolarHBondContact O-CA 3.34Å; L970-G974 PolarHBondContact O-N 2.95Å; L970-V975 HydrophobicContact CB-CG2 4.41Å; L970-V975 HydrophobicContact CD1-CG2 3.53Å; L970-V975 HydrophobicContact CD2-CG2 3.35Å; L970-V975 HydrophobicContact CG-CG2 3.45Å; L970-V975 VanDerWaalsContact CG-CG2 3.45Å
971	Y	56	Low	53	Low	90.5 Å²	90.5	69.3 Å²	69.3	36%	0.355	37%	0.366	S	S	.	.	H	α-helix	trans	-91.5	-24.3	179.1	-68.2	-81.6	0	0	0	113.5	R374 K585 N969 A1032 L1033	R374-Y971 VanDerWaalsContact C-CE2 3.48Å; R374-Y971 VanDerWaalsContact CA-CD2 3.41Å; R374-Y971 VanDerWaalsContact CA-CE2 3.43Å; R374-Y971 HydrophobicContact CB-CD1 3.98Å; R374-Y971 HydrophobicContact CB-CD2 3.7Å; R374-Y971 HydrophobicContact CB-CE1 4.34Å; R374-Y971 HydrophobicContact CB-CE2 4.04Å; R374-Y971 HydrophobicContact CB-CG 3.58Å; R374-Y971 HydrophobicContact CG-CD1 4.43Å; R374-Y971 HydrophobicContact CG-CG 4.5Å; R374-Y971 WeakPolarHBondContact O-CB 3.45Å; R374-Y971 WeakPolarHBondContact O-CD2 3.36Å; K585-Y971 VanDerWaalsContact NZ-CE2 3.34Å; K585-Y971 PolarHBondContact NZ-OH 3.21Å; N969-Y971 PolarHBondContact O-N 3.01Å; N969-Y971 PolarHBondContact OD1-N 2.79Å; Y971-A1032 HydrophobicContact CD1-CB 4.17Å; Y971-L1033 HydrophobicContact CD1-CD2 3.91Å; Y971-L1033 HydrophobicContact CE1-CD2 4.14Å
972	T	56	Low	51.8	Low	63.5 Å²	63.5	73.1 Å²	73.1	39%	0.39	39%	0.391	S	S	.	.	H	α-helix	trans	-102.9	-47.1	177.7	53	0	0	0	0	111.6	E398 W967 T968 N969	E398-T972 PolarHBondContact OE1-OG1 2.94Å; W967-T972 PolarHBondContact NE1-OG1 2.82Å; T968-T972 WeakPolarHBondContact CA-O 3.42Å; N969-T972 HydrophobicContact CB-CG2 4.43Å; N969-T972 WeakPolarHBondContact CB-OG1 3.36Å; N969-T972 PolarHBondContact N-O 2.77Å; N969-T972 PolarHBondContact N-OG1 3.46Å; N969-T972 VanDerWaalsContact N-OG1 3.08Å; N969-T972 PolarHBondContact O-N 3.22Å; N969-T972 VanDerWaalsContact O-N 3.11Å; N969-T972 PolarHBondContact O-OG1 3.22Å; N969-T972 PolarHBondContact OD1-N 3.04Å; N969-T972 PolarHBondContact OD1-O 2.96Å; N969-T972 PolarHBondContact OD1-OG1 3.4Å
973	S	56.3	Low	50.6	Low	56 Å²	56	77.4 Å²	77.4	39%	0.392	41%	0.412	S	S	.	.	H	α-helix	trans	-82.1	-14.4	171.3	57.1	0	0	0	0	112.3	W967 N969 L970 W976	W967-S973 CarbonylContact O-C 3.56Å; W967-S973 WeakPolarHBondContact O-CA 3.46Å; N969-S973 VanDerWaalsContact C-OG 3.29Å; N969-S973 WeakPolarHBondContact O-CB 3.41Å; N969-S973 PolarHBondContact O-N 3.27Å; N969-S973 PolarHBondContact O-OG 3Å; L970-S973 WeakPolarHBondContact CA-OG 3.18Å; S973-W976 PolarHBondContact O-NE1 3.09Å
974	G	58.5	Low	49.3	Very low	7.75 Å²	7.75	82 Å²	82	8%	0.08	43%	0.433	C	S	.	.			trans	95.3	163.6	-178.6	0	0	0	0	0	114	S966 W967 L970 N1030	S966-G974 CarbonylContact C-O 3.48Å; S966-G974 VanDerWaalsContact CA-O 3.32Å; S966-G974 WeakPolarHBondContact CA-O 3.43Å; W967-G974 PolarHBondContact N-O 3.02Å; W967-G974 PolarHBondContact O-N 3.13Å; L970-G974 CarbonylContact O-C 3.32Å; L970-G974 WeakPolarHBondContact O-CA 3.34Å; L970-G974 PolarHBondContact O-N 2.95Å; G974-N1030 VanDerWaalsContact CA-CG 3.42Å; G974-N1030 VanDerWaalsContact CA-ND2 3.34Å; G974-N1030 WeakPolarHBondContact CA-ND2 3.37Å; G974-N1030 VanDerWaalsContact CA-OD1 3.26Å; G974-N1030 WeakPolarHBondContact CA-OD1 3.26Å
975	V	63.4	Low	48.2	Very low	26 Å²	26	83.5 Å²	83.5	16%	0.158	45%	0.454	C	S	.	.			trans	-120.6	111.7	162.8	-174.2	0	0	0	0	106.6	V581 W964 R965 L970 N1030 V1031 A1032	V581-V975 HydrophobicContact CG1-CG2 4.43Å; V581-V975 HydrophobicContact CG2-CB 4.29Å; V581-V975 HydrophobicContact CG2-CG1 4.49Å; V581-V975 HydrophobicContact CG2-CG2 4.22Å; W964-V975 HydrophobicContact CB-CG1 4.49Å; W964-V975 HydrophobicContact CE3-CG1 3.76Å; R965-V975 WeakPolarHBondContact O-CA 3.34Å; L970-V975 HydrophobicContact CB-CG2 4.41Å; L970-V975 HydrophobicContact CD1-CG2 3.53Å; L970-V975 HydrophobicContact CD2-CG2 3.35Å; L970-V975 HydrophobicContact CG-CG2 3.45Å; L970-V975 VanDerWaalsContact CG-CG2 3.45Å; V975-N1030 PolarHBondContact N-OD1 2.9Å; V975-N1030 CarbonylContact O-C 3.58Å; V975-N1030 WeakPolarHBondContact O-CA 3.28Å; V975-V1031 HydrophobicContact CB-CG2 3.78Å; V975-V1031 HydrophobicContact CG1-CG2 3.65Å; V975-V1031 VanDerWaalsContact O-CG2 3.29Å; V975-V1031 WeakPolarHBondContact O-CG2 3.39Å; V975-V1031 PolarHBondContact O-N 3.15Å; V975-A1032 HydrophobicContact CB-CB 4.45Å; V975-A1032 HydrophobicContact CG2-CB 4.3Å
976	W	63.5	Low	46.8	Very low	113.75 Å²	113.75	86.7 Å²	86.7	43%	0.431	48%	0.479	S	S	.	.	B	Isolated β-bridge	trans	-89.3	138.5	-175.4	-66.6	92.6	0	0	0	110.6	N963 W964 R965 W967 S973 N1005 S1028 V1029 N1030	N963-W976 CarbonylContact O-C 3.3Å; N963-W976 WeakPolarHBondContact O-CB 3.49Å; N963-W976 VanDerWaalsContact O-O 3.12Å; W964-W976 WeakPolarHBondContact CA-O 3.34Å; R965-W976 HydrophobicContact CB-CB 4.28Å; R965-W976 PolarHBondContact O-N 2.93Å; W967-W976 AromaticContact CE3-CD1 3.47Å; W967-W976 VanDerWaalsContact CE3-CD1 3.47Å; W967-W976 HydrophobicContact CE3-CG 4.38Å; W967-W976 AromaticContact CE3-NE1 3.93Å; W967-W976 HydrophobicContact CZ3-CB 4.47Å; W967-W976 AromaticContact CZ3-CD1 3.33Å; W967-W976 AromaticContact CZ3-CG 3.91Å; W967-W976 HydrophobicContact CZ3-CG 3.91Å; W967-W976 AromaticContact CZ3-NE1 3.71Å; S973-W976 PolarHBondContact O-NE1 3.09Å; W976-N1005 WeakPolarHBondContact CH2-OD1 3.45Å; W976-S1028 VanDerWaalsContact CE3-O 3.24Å; W976-S1028 VanDerWaalsContact CZ3-O 3.24Å; W976-S1028 WeakPolarHBondContact CZ3-O 3.38Å; W976-V1029 WeakPolarHBondContact CA-O 3.23Å; W976-N1030 HydrophobicContact CD2-CB 4.23Å; W976-N1030 HydrophobicContact CE3-CB 4.01Å; W976-N1030 HydrophobicContact CH2-CB 3.83Å; W976-N1030 HydrophobicContact CZ2-CB 4.03Å; W976-N1030 HydrophobicContact CZ3-CB 3.82Å
977	T	56.3	Low	45.7	Very low	40.25 Å²	40.25	89.2 Å²	89.2	25%	0.247	50%	0.496	C	S	.	.			trans	-103.6	118.6	165.5	53.4	0	0	0	0	108.9	V543 W964 S1028 V1029 V1031 A1032	V543-T977 HydrophobicContact CB-CG2 4.48Å; V543-T977 HydrophobicContact CG1-CG2 3.95Å; V543-T977 HydrophobicContact CG2-CG2 3.87Å; W964-T977 HydrophobicContact CD2-CG2 3.83Å; W964-T977 HydrophobicContact CE3-CG2 3.69Å; W964-T977 HydrophobicContact CH2-CG2 3.49Å; W964-T977 VanDerWaalsContact CH2-CG2 3.49Å; W964-T977 HydrophobicContact CZ2-CG2 3.62Å; W964-T977 HydrophobicContact CZ3-CG2 3.53Å; T977-S1028 WeakPolarHBondContact O-CA 3.38Å; T977-S1028 WeakPolarHBondContact O-CB 3.31Å; T977-V1029 PolarHBondContact N-O 3.05Å; T977-V1029 VanDerWaalsContact N-O 3.11Å; T977-V1029 PolarHBondContact O-N 3.14Å; T977-V1029 PolarHBondContact OG1-N 3.39Å; T977-V1029 PolarHBondContact OG1-O 2.9Å; T977-V1031 HydrophobicContact CG2-CG1 3.79Å; T977-V1031 HydrophobicContact CG2-CG2 4.09Å; T977-V1031 WeakPolarHBondContact OG1-CG1 3.35Å; T977-A1032 WeakPolarHBondContact OG1-CB 3.38Å
978	G	47.5	Very low	44.5	Very low	37.25 Å²	37.25	94.1 Å²	94.1	38%	0.384	52%	0.523	S	S	.	.	S	Bend	trans	-175.5	165.4	178	0	0	0	0	0	111	N963 E980	N963-G978 WeakPolarHBondContact ND2-CA 3.41Å; G978-E980 VanDerWaalsContact C-N 3.34Å; G978-E980 PolarHBondContact O-N 2.8Å; G978-E980 VanDerWaalsContact O-N 3.1Å
979	E	38.2	Very low	43.2	Very low	177.5 Å²	177.5	102.1 Å²	102.1	83%	0.829	54%	0.544	S	S	*	.			trans	-68.2	108	-176	-96	179.4	156.9	0	0	111.7	C981 V1031	E979-C981 PolarHBondContact O-N 3.2Å; E979-C981 VanDerWaalsContact O-N 3.08Å; E979-V1031 HydrophobicContact CG-CG2 4.12Å; E979-V1031 WeakPolarHBondContact OE1-CG2 3.48Å
980	E	34.2	Very low	41.8	Very low	131.75 Å²	131.75	107.7 Å²	107.7	62%	0.616	57%	0.574	S	S	*	*			trans	-73.4	100.9	162.6	-72.7	-174.8	153.5	0	0	107.7	R584 G978 T982	R584-E980 IonicContact CZ-OE1 2.61Å; R584-E980 IonicContact NH1-OE1 3.43Å; R584-E980 PolarHBondContact NH1-OE1 3.35Å; R584-E980 IonicContact NH1-OE2 3.07Å; G978-E980 VanDerWaalsContact C-N 3.34Å; G978-E980 PolarHBondContact O-N 2.8Å; G978-E980 VanDerWaalsContact O-N 3.1Å; E980-T982 VanDerWaalsContact C-N 3.29Å; E980-T982 HydrophobicContact CB-CG2 4.28Å; E980-T982 PolarHBondContact O-N 3.04Å; E980-T982 PolarHBondContact O-OG1 3.09Å
981	C	28.1	Very low	40.5	Very low	106 Å²	106	112.9 Å²	112.9	72%	0.716	60%	0.602	S	S	*	*			trans	-65.6	85.1	177.1	-157.7	0	0	0	0	110.1	E979 T983	E979-C981 PolarHBondContact O-N 3.2Å; E979-C981 VanDerWaalsContact O-N 3.08Å; C981-T983 VanDerWaalsContact C-N 3.25Å; C981-T983 PolarHBondContact O-N 3.15Å; C981-T983 PolarHBondContact SG-OG1 2.66Å; C981-T983 VanDerWaalsContact SG-OG1 3.34Å
982	T	27.5	Very low	39.3	Very low	112.25 Å²	112.25	116.1 Å²	116.1	69%	0.689	63%	0.626	S	S	*	*			trans	-87.9	79.7	179.7	40.7	0	0	0	0	109.5	E980 M984	E980-T982 VanDerWaalsContact C-N 3.29Å; E980-T982 HydrophobicContact CB-CG2 4.28Å; E980-T982 PolarHBondContact O-N 3.04Å; E980-T982 PolarHBondContact O-OG1 3.09Å; T982-M984 VanDerWaalsContact C-N 3.33Å; T982-M984 PolarHBondContact O-N 3.37Å
983	T	27.9	Very low	38	Very low	119.5 Å²	119.5	118.3 Å²	118.3	73%	0.733	64%	0.643	S	S	*	*			trans	-87.3	89.8	169.2	48.9	0	0	0	0	109.3	C981	C981-T983 VanDerWaalsContact C-N 3.25Å; C981-T983 PolarHBondContact O-N 3.15Å; C981-T983 PolarHBondContact SG-OG1 2.66Å; C981-T983 VanDerWaalsContact SG-OG1 3.34Å
984	M	26.5	Very low	36.6	Very low	165 Å²	165	120.9 Å²	120.9	81%	0.813	66%	0.661	S	S	*	*			trans	-68.6	131.9	166.3	-69.5	-69.9	-113	0	0	109.3	T982 D986	T982-M984 VanDerWaalsContact C-N 3.33Å; T982-M984 PolarHBondContact O-N 3.37Å; M984-D986 PolarHBondContact O-N 3.24Å; M984-D986 VanDerWaalsContact O-N 3.12Å
985	P	31.1	Very low	35.1	Very low	120 Å²	120	128.8 Å²	128.8	78%	0.779	70%	0.696	S	S	*	*			trans	-81.6	102.2	176.5	27.2	-23	0	0	0	109.8	S987	P985-S987 PolarHBondContact O-N 3.23Å; P985-S987 VanDerWaalsContact O-N 3.14Å
986	D	28.7	Very low	33.3	Very low	162.5 Å²	162.5	134.6 Å²	134.6	87%	0.869	73%	0.726	S	S	*	*			trans	-78.8	113.4	171	-97.6	-26	0	0	0	111.1	M984 Q988	M984-D986 PolarHBondContact O-N 3.24Å; M984-D986 VanDerWaalsContact O-N 3.12Å; D986-Q988 PolarHBondContact O-N 3.34Å
987	S	30.5	Very low	31.4	Very low	106.75 Å²	106.75	137.5 Å²	137.5	75%	0.747	74%	0.741	S	S	*	*			trans	-109.8	106.1	169.7	38	0	0	0	0	113.3	P985	P985-S987 PolarHBondContact O-N 3.23Å; P985-S987 VanDerWaalsContact O-N 3.14Å
988	Q	32.4	Very low	29.9	Very low	189.5 Å²	189.5	145.1 Å²	145.1	89%	0.886	77%	0.765	S	S	*	*			trans	171	115.4	153.2	-86	169.4	2.1	0	0	113.7	D986	D986-Q988 PolarHBondContact O-N 3.34Å
989	R	29	Very low	28.9	Very low	243.25 Å²	243.25	149.5 Å²	149.5	92%	0.918	78%	0.779	S	S	*	*			trans	-155.6	135.3	140.7	-89.1	163.8	-170.2	-154.5	2.7	111.3
990	N	29.3	Very low	28.4	Very low	152.25 Å²	152.25	145.4 Å²	145.4	81%	0.814	77%	0.768	S	S	*	*			trans	-75.6	149.1	162.1	-63.4	-28.7	0	0	0	112.6
991	D	29.8	Very low	28.1	Very low	149 Å²	149	143 Å²	143	80%	0.797	77%	0.766	S	S	*	*			trans	-12.1	127.8	156	-72.5	-38.4	0	0	0	115.1	S993	D991-S993 PolarHBondContact O-N 2.84Å
992	D	30.1	Very low	28.1	Very low	159 Å²	159	141.3 Å²	141.3	85%	0.85	77%	0.765	S	S	*	*			trans	174.1	109	139.2	-82.8	-29.5	0	0	0	113.1	S994	D992-S994 PolarHBondContact O-N 2.96Å
993	S	28.7	Very low	28.2	Very low	108.5 Å²	108.5	141 Å²	141	76%	0.759	76%	0.764	S	S	*	*			trans	-43.2	121.3	156.5	59.9	0	0	0	0	115.7	D991 E995	D991-S993 PolarHBondContact O-N 2.84Å; S993-E995 PolarHBondContact O-N 3.44Å
994	S	27.9	Very low	28.2	Very low	110.75 Å²	110.75	144.3 Å²	144.3	77%	0.774	76%	0.763	S	S	*	*			trans	-174.4	106	152	59.9	0	0	0	0	113.3	D992 L996	D992-S994 PolarHBondContact O-N 2.96Å; S994-L996 PolarHBondContact O-N 3.37Å; S994-L996 VanDerWaalsContact O-N 3.15Å
995	E	25.9	Very low	28.2	Very low	173.5 Å²	173.5	142.1 Å²	142.1	81%	0.811	75%	0.754	S	S	*	*			trans	2.2	100.5	160.8	-77.7	-172.6	140.4	0	0	115.2	S993 K997	S993-E995 PolarHBondContact O-N 3.44Å; E995-K997 PolarHBondContact O-N 3.2Å; E995-K997 VanDerWaalsContact O-N 3.09Å
996	L	25.7	Very low	28	Very low	148.5 Å²	148.5	141.1 Å²	141.1	78%	0.777	75%	0.751	S	S	*	*			trans	-75.3	106.5	146.7	-83.3	140.3	0	0	0	111.6	S994 R998	S994-L996 PolarHBondContact O-N 3.37Å; S994-L996 VanDerWaalsContact O-N 3.15Å; L996-R998 PolarHBondContact O-N 3.24Å
997	K	24.2	Very low	27.9	Very low	174 Å²	174	140.1 Å²	140.1	76%	0.757	75%	0.745	S	S	*	*			trans	-51.4	106.8	164	-77.6	174	178.8	170.4	0	113.2	E995	E995-K997 PolarHBondContact O-N 3.2Å; E995-K997 VanDerWaalsContact O-N 3.09Å
998	R	24	Very low	27.7	Very low	199.5 Å²	199.5	139.4 Å²	139.4	75%	0.753	75%	0.746	S	S	*	*			trans	-71.3	108.4	168.2	-85.6	-179.5	-101.7	-160.9	-0.7	113.8	L996 E1099	L996-R998 PolarHBondContact O-N 3.24Å; R998-E1099 VanDerWaalsContact CD-CD 3.44Å; R998-E1099 WeakPolarHBondContact CD-OE1 3.47Å; R998-E1099 WeakPolarHBondContact CD-OE2 3.41Å; R998-E1099 IonicContact CZ-OE2 3.07Å; R998-E1099 IonicContact NE-OE2 2.69Å; R998-E1099 PolarHBondContact NE-OE2 2.85Å; R998-E1099 IonicContact NH1-OE2 2.89Å; R998-E1099 PolarHBondContact NH1-OE2 3.09Å
999	I	26.5	Very low	27.5	Very low	130 Å²	130	136.9 Å²	136.9	67%	0.667	74%	0.743	S	S	*	*			trans	-82	136.9	143.8	-49.6	172.2	0	0	0	110.2	S1001	I999-S1001 PolarHBondContact O-N 2.95Å; I999-S1001 VanDerWaalsContact O-N 3.09Å
1000	P	27.9	Very low	27.4	Very low	91.75 Å²	91.75	132.7 Å²	132.7	60%	0.596	74%	0.739	S	S	*	*			trans	-96.2	132.3	158.9	14.6	0.2	0	0	0	112.5	G1002	P1000-G1002 PolarHBondContact O-N 3.33Å
1001	S	27.3	Very low	27.2	Very low	82 Å²	82	130.4 Å²	130.4	57%	0.573	74%	0.735	S	S	*	*			trans	-68.9	142.1	164.8	-38.7	0	0	0	0	111.3	I999 T1003 D1066	I999-S1001 PolarHBondContact O-N 2.95Å; I999-S1001 VanDerWaalsContact O-N 3.09Å; S1001-T1003 PolarHBondContact O-N 3.38Å; S1001-D1066 WeakPolarHBondContact CB-OD2 3.41Å
1002	G	29	Very low	27.1	Very low	69 Å²	69	130.3 Å²	130.3	71%	0.711	73%	0.734	S	S	*	*			trans	-90.8	96.7	173	0	0	0	0	0	113.1	P1000 R1004	P1000-G1002 PolarHBondContact O-N 3.33Å; G1002-R1004 VanDerWaalsContact C-N 3.35Å; G1002-R1004 PolarHBondContact O-N 3.09Å
1003	T	29.5	Very low	27	Very low	107.4 Å²	107.4	130.6 Å²	130.6	66%	0.659	74%	0.736	S	S	*	*			trans	-148.8	125.2	167.5	30.7	0	0	0	0	111.2	S1001 N1005 E1069	S1001-T1003 PolarHBondContact O-N 3.38Å; T1003-N1005 PolarHBondContact O-N 2.9Å; T1003-E1069 WeakPolarHBondContact CB-OE1 3.37Å; T1003-E1069 PolarHBondContact OG1-OE1 3.19Å
1004	R	27.9	Very low	27	Very low	188 Å²	188	128.6 Å²	128.6	71%	0.709	73%	0.732	S	S	*	*			trans	-96.4	116.1	168.9	-83.2	170.5	101.5	178.2	0.6	109.7	G1002 S1006 D1027 E1056	G1002-R1004 VanDerWaalsContact C-N 3.35Å; G1002-R1004 PolarHBondContact O-N 3.09Å; R1004-S1006 VanDerWaalsContact C-N 3.33Å; R1004-S1006 PolarHBondContact O-N 3.09Å; R1004-S1006 VanDerWaalsContact O-N 3.16Å; R1004-D1027 IonicContact NH2-OD1 3.43Å; R1004-E1056 IonicContact CZ-OE2 3.39Å; R1004-E1056 IonicContact NH1-OE1 3.61Å; R1004-E1056 IonicContact NH1-OE2 2.98Å; R1004-E1056 PolarHBondContact NH1-OE2 3.47Å
1005	N	27	Very low	27.1	Very low	118 Å²	118	130.6 Å²	130.6	63%	0.631	73%	0.734	S	S	*	*				-68.6	123.5	128	-78.6	-2.9	0	0	0	110.6	W976 T1003 R1045 E1056	W976-N1005 WeakPolarHBondContact CH2-OD1 3.45Å; T1003-N1005 PolarHBondContact O-N 2.9Å; N1005-R1045 PolarHBondContact ND2-NH1 3.02Å; N1005-E1056 HydrophobicContact CB-CG 4.46Å; N1005-E1056 WeakPolarHBondContact CB-OE1 3.2Å; N1005-E1056 PolarHBondContact ND2-OE1 2.93Å
1006	S	26.6	Very low	27.3	Very low	100.8 Å²	100.8	129.7 Å²	129.7	71%	0.705	74%	0.735	S	S	*	*			trans	-90.1	138.4	156.8	50.5	0	0	0	0	110.6	R1004 A1008	R1004-S1006 VanDerWaalsContact C-N 3.33Å; R1004-S1006 PolarHBondContact O-N 3.09Å; R1004-S1006 VanDerWaalsContact O-N 3.16Å; S1006-A1008 PolarHBondContact O-N 3.28Å
1007	N	27	Very low	27.6	Very low	141 Å²	141	129.8 Å²	129.8	75%	0.754	74%	0.736	S	S	*	*			trans	-99.4	135.7	146.7	-83.8	-33.6	0	0	0	110.8	V1009 D1027	N1007-V1009 PolarHBondContact O-N 3.32Å; N1007-D1027 PolarHBondContact ND2-OD1 3.37Å
1008	A	25.6	Very low	27.9	Very low	91.6 Å²	91.6	127.9 Å²	127.9	76%	0.757	74%	0.739	S	S	*	*			trans	-84.9	127.3	167.7	0	0	0	0	0	110.2	S1006 N1010	S1006-A1008 PolarHBondContact O-N 3.28Å; A1008-N1010 VanDerWaalsContact C-N 3.31Å; A1008-N1010 PolarHBondContact O-N 3.17Å
1009	V	27.6	Very low	28.4	Very low	136.2 Å²	136.2	124.7 Å²	124.7	83%	0.825	74%	0.742	S	S	*	*			trans	-92.8	109.1	169.5	177	0	0	0	0	108.3	N1007 S1011	N1007-V1009 PolarHBondContact O-N 3.32Å; V1009-S1011 VanDerWaalsContact C-N 3.29Å; V1009-S1011 PolarHBondContact O-N 3.24Å
1010	N	26.9	Very low	28.6	Very low	155.2 Å²	155.2	124.7 Å²	124.7	83%	0.83	74%	0.743	S	S	*	*			trans	-72.4	107.4	170.2	-84.2	-19	0	0	0	109.9	A1008 N1012	A1008-N1010 VanDerWaalsContact C-N 3.31Å; A1008-N1010 PolarHBondContact O-N 3.17Å; N1010-N1012 PolarHBondContact O-N 3.09Å
1011	S	26.5	Very low	28.9	Very low	104.4 Å²	104.4	125.2 Å²	125.2	73%	0.73	76%	0.755	S	S	*	*			trans	-114.4	103.5	146.8	-138.7	0	0	0	0	110.1	V1009	V1009-S1011 VanDerWaalsContact C-N 3.29Å; V1009-S1011 PolarHBondContact O-N 3.24Å
1012	N	27.9	Very low	29.2	Very low	147.8 Å²	147.8	128.1 Å²	128.1	79%	0.79	76%	0.764	S	S	*	*			trans	150.9	112.5	144.2	-78.9	-14.8	0	0	0	115.4	N1010	N1010-N1012 PolarHBondContact O-N 3.09Å
1013	N	28.2	Very low	29.3	Very low	165 Å²	165	131.5 Å²	131.5	88%	0.882	77%	0.766	S	S	*	*			trans	127.7	130.2	141.5	-91.5	-19.8	0	0	0	113	N1015	N1013-N1015 PolarHBondContact O-N 2.77Å
1014	G	28.4	Very low	29.6	Very low	65.4 Å²	65.4	131.8 Å²	131.8	67%	0.674	77%	0.77	S	S	*	*			trans	-176.4	92.9	156.8	0	0	0	0	0	115.1
1015	N	30	Very low	29.9	Very low	154.4 Å²	154.4	130.2 Å²	130.2	83%	0.826	77%	0.773	S	S	*	*			trans	104.4	130.3	147.5	-72.7	-14.2	0	0	0	115	N1013 N1017	N1013-N1015 PolarHBondContact O-N 2.77Å; N1015-N1017 PolarHBondContact O-N 2.87Å
1016	N	30.3	Very low	30.4	Very low	153.6 Å²	153.6	129.6 Å²	129.6	82%	0.821	78%	0.778	S	S	*	*			trans	17.8	96.3	163.6	-61.4	-18.7	0	0	0	114.9	T1018	N1016-T1018 PolarHBondContact O-N 3.11Å
1017	N	31.5	Very low	31.4	Very low	151 Å²	151	129.7 Å²	129.7	81%	0.807	77%	0.771	S	S	*	*			trans	-103	112.4	149.7	-72	-13	0	0	0	110.5	N1015 V1019	N1015-N1017 PolarHBondContact O-N 2.87Å; N1017-V1019 VanDerWaalsContact C-N 3.34Å; N1017-V1019 PolarHBondContact O-N 3.12Å
1018	T	30.7	Very low	32.7	Very low	134.6 Å²	134.6	126.5 Å²	126.5	83%	0.826	76%	0.759	S	S	*	*			trans	-94.8	101	158	36.6	0	0	0	0	108.9	N1016 N1020	N1016-T1018 PolarHBondContact O-N 3.11Å; T1018-N1020 PolarHBondContact O-N 2.84Å
1019	V	33.4	Very low	34.3	Very low	132.2 Å²	132.2	124.6 Å²	124.6	80%	0.801	74%	0.739	S	S	*	*			trans	-88.1	121.8	169	179.7	0	0	0	0	107	N1017 A1021	N1017-V1019 VanDerWaalsContact C-N 3.34Å; N1017-V1019 PolarHBondContact O-N 3.12Å; V1019-A1021 PolarHBondContact O-N 3.31Å
1020	N	31	Very low	36.1	Very low	130 Å²	130	119.4 Å²	119.4	70%	0.695	71%	0.706	S	S	*	*			trans	-67.5	135.9	-178.4	-68.8	-42.4	0	0	0	110.4	T1018 D1022	T1018-N1020 PolarHBondContact O-N 2.84Å; N1020-D1022 PolarHBondContact O-N 3.16Å; N1020-D1022 VanDerWaalsContact O-N 3.13Å
1021	A	35.4	Very low	38.1	Very low	101.8 Å²	101.8	113.9 Å²	113.9	84%	0.841	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	24.5	-173.2	0	0	0	0	0	114.6	V1019	V1019-A1021 PolarHBondContact O-N 3.31Å
1022	D	33.1	Very low	39.9	Very low	143.6 Å²	143.6	110 Å²	110	77%	0.768	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.6	3.8	-172.5	-69.4	-49.2	0	0	0	114.4	N1020 P1024	N1020-D1022 PolarHBondContact O-N 3.16Å; N1020-D1022 VanDerWaalsContact O-N 3.13Å; D1022-P1024 WeakPolarHBondContact O-CD 3.42Å
1023	D	30.8	Very low	41.9	Very low	140.2 Å²	140.2	104.1 Å²	104.1	75%	0.75	62%	0.62	S	S	*	*			trans	-77.3	116.2	168.4	-85.2	-36.5	0	0	0	109.5	I1025	D1023-I1025 PolarHBondContact O-N 3.23Å
1024	P	35.2	Very low	44.2	Very low	113.6 Å²	113.6	98.1 Å²	98.1	74%	0.738	59%	0.59	S	S	*	*			trans	-67.5	113.8	177.8	28.4	-32.3	0	0	0	108.3	D1022 S1026	D1022-P1024 WeakPolarHBondContact O-CD 3.42Å; P1024-S1026 VanDerWaalsContact C-N 3.34Å; P1024-S1026 PolarHBondContact O-N 2.91Å; P1024-S1026 VanDerWaalsContact O-N 3.08Å
1025	I	34.4	Very low	46.5	Very low	154.2 Å²	154.2	102 Å²	102	79%	0.791	58%	0.584	S	S	*	*			trans	-44.8	117.3	169.3	-63.2	165.4	0	0	0	107.4	D1023 D1027	D1023-I1025 PolarHBondContact O-N 3.23Å; I1025-D1027 VanDerWaalsContact C-N 3.3Å; I1025-D1027 PolarHBondContact O-N 3.01Å
1026	S	38.2	Very low	48.7	Very low	104 Å²	104	97.9 Å²	97.9	73%	0.727	57%	0.572	S	S	*	*			trans	-64.2	101.8	-173.3	19.5	0	0	0	0	109.4	P1024 S1028	P1024-S1026 VanDerWaalsContact C-N 3.34Å; P1024-S1026 PolarHBondContact O-N 2.91Å; P1024-S1026 VanDerWaalsContact O-N 3.08Å; S1026-S1028 PolarHBondContact O-N 2.91Å; S1026-S1028 VanDerWaalsContact O-N 3.13Å
1027	D	47.3	Very low	50.8	Low	103.6 Å²	103.6	93 Å²	93	55%	0.554	54%	0.544	S	S	*	.			trans	-48.7	117.5	170.1	-98.9	-22.2	0	0	0	108	R1004 N1007 I1025 V1029 K1042 R1045	R1004-D1027 IonicContact NH2-OD1 3.43Å; N1007-D1027 PolarHBondContact ND2-OD1 3.37Å; I1025-D1027 VanDerWaalsContact C-N 3.3Å; I1025-D1027 PolarHBondContact O-N 3.01Å; D1027-V1029 WeakPolarHBondContact O-CG2 3.33Å; D1027-V1029 PolarHBondContact O-N 3.1Å; D1027-K1042 IonicContact OD2-NZ 3.82Å; D1027-K1042 PolarHBondContact OD2-NZ 3.33Å; D1027-R1045 IonicContact OD1-NH1 2.65Å; D1027-R1045 IonicContact OD1-NH2 3.21Å; D1027-R1045 IonicContact OD2-NH1 2.78Å; D1027-R1045 PolarHBondContact OD2-NH1 3.23Å; D1027-R1045 IonicContact OD2-NH2 2.75Å
1028	S	54.1	Low	52.9	Low	73.4 Å²	73.4	88.3 Å²	88.3	51%	0.513	52%	0.517	S	S	.	.			trans	-61.3	117.9	-177.2	58.8	0	0	0	0	109.4	W976 T977 S1026 N1030	W976-S1028 VanDerWaalsContact CE3-O 3.24Å; W976-S1028 VanDerWaalsContact CZ3-O 3.24Å; W976-S1028 WeakPolarHBondContact CZ3-O 3.38Å; T977-S1028 WeakPolarHBondContact O-CA 3.38Å; T977-S1028 WeakPolarHBondContact O-CB 3.31Å; S1026-S1028 PolarHBondContact O-N 2.91Å; S1026-S1028 VanDerWaalsContact O-N 3.13Å; S1028-N1030 PolarHBondContact O-N 3.41Å
1029	V	59.8	Low	55.1	Low	53.2 Å²	53.2	87.1 Å²	87.1	32%	0.322	50%	0.504	S	S	.	.			trans	-89.8	120.4	-174.4	-178.6	0	0	0	0	109.8	W976 T977 D1027 V1031	W976-V1029 WeakPolarHBondContact CA-O 3.23Å; T977-V1029 PolarHBondContact N-O 3.05Å; T977-V1029 VanDerWaalsContact N-O 3.11Å; T977-V1029 PolarHBondContact O-N 3.14Å; T977-V1029 PolarHBondContact OG1-N 3.39Å; T977-V1029 PolarHBondContact OG1-O 2.9Å; D1027-V1029 WeakPolarHBondContact O-CG2 3.33Å; D1027-V1029 PolarHBondContact O-N 3.1Å; V1029-V1031 VanDerWaalsContact C-N 3.3Å; V1029-V1031 WeakPolarHBondContact O-CG2 3.32Å; V1029-V1031 PolarHBondContact O-N 3.19Å; V1029-V1031 VanDerWaalsContact O-N 3.16Å
1030	N	65.1	Low	57.1	Low	25.8 Å²	25.8	84.6 Å²	84.6	14%	0.138	48%	0.483	C	S	.	.	B	Isolated β-bridge	trans	-73.9	92.5	173.3	-169.3	-9.2	0	0	0	109.7	G974 V975 W976 S1028 A1032 L1033	G974-N1030 VanDerWaalsContact CA-CG 3.42Å; G974-N1030 VanDerWaalsContact CA-ND2 3.34Å; G974-N1030 WeakPolarHBondContact CA-ND2 3.37Å; G974-N1030 VanDerWaalsContact CA-OD1 3.26Å; G974-N1030 WeakPolarHBondContact CA-OD1 3.26Å; V975-N1030 PolarHBondContact N-OD1 2.9Å; V975-N1030 CarbonylContact O-C 3.58Å; V975-N1030 WeakPolarHBondContact O-CA 3.28Å; W976-N1030 HydrophobicContact CD2-CB 4.23Å; W976-N1030 HydrophobicContact CE3-CB 4.01Å; W976-N1030 HydrophobicContact CH2-CB 3.83Å; W976-N1030 HydrophobicContact CZ2-CB 4.03Å; W976-N1030 HydrophobicContact CZ3-CB 3.82Å; S1028-N1030 PolarHBondContact O-N 3.41Å; N1030-A1032 PolarHBondContact O-N 3.22Å; N1030-A1032 VanDerWaalsContact O-N 3.15Å; N1030-A1032 VanDerWaalsContact OD1-CB 3.27Å; N1030-A1032 WeakPolarHBondContact OD1-CB 3.32Å; N1030-A1032 PolarHBondContact OD1-N 3.34Å; N1030-A1032 VanDerWaalsContact OD1-N 3.13Å; N1030-L1033 HydrophobicContact CB-CD1 4.19Å; N1030-L1033 HydrophobicContact CB-CG 4.21Å; N1030-L1033 WeakPolarHBondContact O-CA 3.37Å; N1030-L1033 WeakPolarHBondContact O-CB 3.36Å; N1030-L1033 PolarHBondContact O-N 3.1Å
1031	V	67.9	Low	59.1	Low	41 Å²	41	81.2 Å²	81.2	25%	0.248	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-13.7	-172.5	-106.1	0	0	0	0	113.6	R542 V543 F560 V581 V975 T977 E979 V1029 L1033	R542-V1031 HydrophobicContact CB-CB 4.17Å; R542-V1031 HydrophobicContact CB-CG1 4.48Å; R542-V1031 PolarHBondContact NH1-O 2.88Å; V543-V1031 HydrophobicContact CB-CG1 4.48Å; V543-V1031 HydrophobicContact CG2-CG1 3.63Å; F560-V1031 HydrophobicContact CE1-CB 4.17Å; F560-V1031 HydrophobicContact CE1-CG1 4.33Å; F560-V1031 HydrophobicContact CZ-CB 4.39Å; V581-V1031 HydrophobicContact CG2-CB 4.35Å; V581-V1031 HydrophobicContact CG2-CG2 3.67Å; V581-V1031 WeakPolarHBondContact CG2-O 3.5Å; V975-V1031 HydrophobicContact CB-CG2 3.78Å; V975-V1031 HydrophobicContact CG1-CG2 3.65Å; V975-V1031 VanDerWaalsContact O-CG2 3.29Å; V975-V1031 WeakPolarHBondContact O-CG2 3.39Å; V975-V1031 PolarHBondContact O-N 3.15Å; T977-V1031 HydrophobicContact CG2-CG1 3.79Å; T977-V1031 HydrophobicContact CG2-CG2 4.09Å; T977-V1031 WeakPolarHBondContact OG1-CG1 3.35Å; E979-V1031 HydrophobicContact CG-CG2 4.12Å; E979-V1031 WeakPolarHBondContact OE1-CG2 3.48Å; V1029-V1031 VanDerWaalsContact C-N 3.3Å; V1029-V1031 WeakPolarHBondContact O-CG2 3.32Å; V1029-V1031 PolarHBondContact O-N 3.19Å; V1029-V1031 VanDerWaalsContact O-N 3.16Å; V1031-L1033 VanDerWaalsContact C-N 3.28Å; V1031-L1033 PolarHBondContact O-N 3.1Å
1032	A	66.2	Low	60.9	Low	21.6 Å²	21.6	82.7 Å²	82.7	18%	0.179	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-25	172	0	0	0	0	0	113.1	R542 V581 Y971 V975 T977 N1030 T1034	R542-A1032 PolarHBondContact NH1-O 2.79Å; V581-A1032 HydrophobicContact CG1-CB 4.16Å; V581-A1032 HydrophobicContact CG2-CB 4.47Å; Y971-A1032 HydrophobicContact CD1-CB 4.17Å; V975-A1032 HydrophobicContact CB-CB 4.45Å; V975-A1032 HydrophobicContact CG2-CB 4.3Å; T977-A1032 WeakPolarHBondContact OG1-CB 3.38Å; N1030-A1032 PolarHBondContact O-N 3.22Å; N1030-A1032 VanDerWaalsContact O-N 3.15Å; N1030-A1032 VanDerWaalsContact OD1-CB 3.27Å; N1030-A1032 WeakPolarHBondContact OD1-CB 3.32Å; N1030-A1032 PolarHBondContact OD1-N 3.34Å; N1030-A1032 VanDerWaalsContact OD1-N 3.13Å; A1032-T1034 PolarHBondContact O-N 2.92Å
1033	L	68.4	Low	63	Low	23.4 Å²	23.4	79.7 Å²	79.7	12%	0.123	43%	0.432	C	S	.	.	S	Bend	trans	-89.4	132	179.2	-59.3	179.8	0	0	0	111	R542 Y971 N1030 V1031 Q1037 H1038 E1041	R542-L1033 WeakPolarHBondContact CD-O 3.43Å; R542-L1033 PolarHBondContact NH1-O 3.23Å; Y971-L1033 HydrophobicContact CD1-CD2 3.91Å; Y971-L1033 HydrophobicContact CE1-CD2 4.14Å; N1030-L1033 HydrophobicContact CB-CD1 4.19Å; N1030-L1033 HydrophobicContact CB-CG 4.21Å; N1030-L1033 WeakPolarHBondContact O-CA 3.37Å; N1030-L1033 WeakPolarHBondContact O-CB 3.36Å; N1030-L1033 PolarHBondContact O-N 3.1Å; V1031-L1033 VanDerWaalsContact C-N 3.28Å; V1031-L1033 PolarHBondContact O-N 3.1Å; L1033-Q1037 HydrophobicContact CB-CB 4.1Å; L1033-Q1037 HydrophobicContact CD2-CB 4.23Å; L1033-Q1037 HydrophobicContact CG-CB 4.49Å; L1033-H1038 HydrophobicContact CB-CB 4.42Å; L1033-E1041 WeakPolarHBondContact CD1-OE2 3.29Å
1034	T	76.3	Confident	65	Low	39.4 Å²	39.4	76.8 Å²	76.8	24%	0.242	41%	0.41	C	S	.	.			trans	-63.6	159.5	169.6	71.6	0	0	0	0	110.2	E538 R542 A1032 A1036 Q1037 H1038	E538-T1034 VanDerWaalsContact OE1-CG2 3.29Å; E538-T1034 WeakPolarHBondContact OE1-CG2 3.35Å; E538-T1034 WeakPolarHBondContact OE2-CB 3.28Å; R542-T1034 VanDerWaalsContact NH1-N 3.16Å; A1032-T1034 PolarHBondContact O-N 2.92Å; T1034-A1036 VanDerWaalsContact C-N 3.25Å; T1034-A1036 CarbonylContact O-C 3.57Å; T1034-A1036 PolarHBondContact O-N 3.17Å; T1034-A1036 PolarHBondContact OG1-N 3.15Å; T1034-Q1037 HydrophobicContact CG2-CG 4.24Å; T1034-Q1037 CarbonylContact O-C 3.57Å; T1034-Q1037 WeakPolarHBondContact O-CA 3.38Å; T1034-Q1037 WeakPolarHBondContact O-CB 3.4Å; T1034-Q1037 PolarHBondContact O-N 3.19Å; T1034-Q1037 VanDerWaalsContact O-N 3.14Å; T1034-Q1037 WeakPolarHBondContact OG1-CB 3.33Å; T1034-Q1037 VanDerWaalsContact OG1-CG 3.28Å; T1034-Q1037 WeakPolarHBondContact OG1-CG 3.31Å; T1034-Q1037 PolarHBondContact OG1-N 3.2Å; T1034-Q1037 VanDerWaalsContact OG1-N 3.11Å; T1034-Q1037 PolarHBondContact OG1-OE1 3.23Å; T1034-H1038 WeakPolarHBondContact O-CB 3.32Å; T1034-H1038 PolarHBondContact O-N 3.1Å
1035	R	76.8	Confident	66.7	Low	146.6 Å²	146.6	76.3 Å²	76.3	55%	0.553	39%	0.394	S	S	*	.	H	α-helix	trans	-53.6	-38.4	174.7	-175.3	179.7	179.9	-175	-1.7	112.3	H545 Q1037 H1038 M1039	H545-R1035 HydrophobicContact CB-CG 4.05Å; H545-R1035 WeakPolarHBondContact O-CD 3.26Å; H545-R1035 PolarHBondContact O-NH1 2.99Å; R1035-Q1037 VanDerWaalsContact C-N 3.33Å; R1035-Q1037 PolarHBondContact O-N 3.38Å; R1035-H1038 PolarHBondContact O-N 3Å; R1035-M1039 HydrophobicContact CG-CG 4.48Å; R1035-M1039 VanDerWaalsContact O-CB 3.31Å; R1035-M1039 WeakPolarHBondContact O-CB 3.19Å; R1035-M1039 VanDerWaalsContact O-CG 3.28Å; R1035-M1039 WeakPolarHBondContact O-CG 3.39Å; R1035-M1039 PolarHBondContact O-N 3.01Å; R1035-M1039 VanDerWaalsContact O-N 3.12Å
1036	A	77.1	Confident	68.6	Low	69.8 Å²	69.8	75.1 Å²	75.1	58%	0.577	38%	0.38	S	S	*	.	H	α-helix	trans	-65.5	-42.9	176.3	0	0	0	0	0	112.2	T1034 H1038 M1039 E1040	T1034-A1036 VanDerWaalsContact C-N 3.25Å; T1034-A1036 CarbonylContact O-C 3.57Å; T1034-A1036 PolarHBondContact O-N 3.17Å; T1034-A1036 PolarHBondContact OG1-N 3.15Å; A1036-H1038 PolarHBondContact O-N 3.17Å; A1036-M1039 WeakPolarHBondContact O-CB 3.44Å; A1036-M1039 PolarHBondContact O-N 3.1Å; A1036-E1040 VanDerWaalsContact O-CB 3.27Å; A1036-E1040 WeakPolarHBondContact O-CB 3.4Å; A1036-E1040 PolarHBondContact O-N 3.27Å
1037	Q	74.2	Confident	70.2	Confident	49 Å²	49	73.7 Å²	73.7	23%	0.229	36%	0.363	C	S	.	.	H	α-helix	trans	-67.4	-38.8	176.5	-70.8	167.4	-31.7	0	0	112.3	L1033 T1034 R1035 M1039 E1040 E1041	L1033-Q1037 HydrophobicContact CB-CB 4.1Å; L1033-Q1037 HydrophobicContact CD2-CB 4.23Å; L1033-Q1037 HydrophobicContact CG-CB 4.49Å; T1034-Q1037 HydrophobicContact CG2-CG 4.24Å; T1034-Q1037 CarbonylContact O-C 3.57Å; T1034-Q1037 WeakPolarHBondContact O-CA 3.38Å; T1034-Q1037 WeakPolarHBondContact O-CB 3.4Å; T1034-Q1037 PolarHBondContact O-N 3.19Å; T1034-Q1037 VanDerWaalsContact O-N 3.14Å; T1034-Q1037 WeakPolarHBondContact OG1-CB 3.33Å; T1034-Q1037 VanDerWaalsContact OG1-CG 3.28Å; T1034-Q1037 WeakPolarHBondContact OG1-CG 3.31Å; T1034-Q1037 PolarHBondContact OG1-N 3.2Å; T1034-Q1037 VanDerWaalsContact OG1-N 3.11Å; T1034-Q1037 PolarHBondContact OG1-OE1 3.23Å; R1035-Q1037 VanDerWaalsContact C-N 3.33Å; R1035-Q1037 PolarHBondContact O-N 3.38Å; Q1037-M1039 VanDerWaalsContact C-N 3.32Å; Q1037-M1039 PolarHBondContact O-N 3.01Å; Q1037-E1040 CarbonylContact O-C 3.57Å; Q1037-E1040 PolarHBondContact O-N 3.07Å; Q1037-E1040 VanDerWaalsContact O-N 3.17Å; Q1037-E1041 WeakPolarHBondContact O-CB 3.25Å; Q1037-E1041 PolarHBondContact O-N 3Å
1038	H	75.1	Confident	71.2	Confident	53.2 Å²	53.2	69.4 Å²	69.4	25%	0.246	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-40.2	174.5	-171.5	-83.4	0	0	0	111.5	H545 L1033 T1034 R1035 A1036 E1041 K1042	H545-H1038 AromaticContact NE2-CG 3.96Å; H545-H1038 AromaticContact NE2-ND1 3.84Å; L1033-H1038 HydrophobicContact CB-CB 4.42Å; T1034-H1038 WeakPolarHBondContact O-CB 3.32Å; T1034-H1038 PolarHBondContact O-N 3.1Å; R1035-H1038 PolarHBondContact O-N 3Å; A1036-H1038 PolarHBondContact O-N 3.17Å; H1038-E1041 PolarHBondContact O-N 3.09Å; H1038-K1042 VanDerWaalsContact O-CB 3.27Å; H1038-K1042 WeakPolarHBondContact O-CB 3.28Å; H1038-K1042 PolarHBondContact O-N 3.11Å
1039	M	77.7	Confident	71.9	Confident	109.4 Å²	109.4	68.1 Å²	68.1	54%	0.539	33%	0.331	S	S	.	.	H	α-helix	trans	-65	-41.8	172.6	-72.9	-69.2	-66.5	0	0	112	R1035 A1036 Q1037 K1042 E1043	R1035-M1039 HydrophobicContact CG-CG 4.48Å; R1035-M1039 VanDerWaalsContact O-CB 3.31Å; R1035-M1039 WeakPolarHBondContact O-CB 3.19Å; R1035-M1039 VanDerWaalsContact O-CG 3.28Å; R1035-M1039 WeakPolarHBondContact O-CG 3.39Å; R1035-M1039 PolarHBondContact O-N 3.01Å; R1035-M1039 VanDerWaalsContact O-N 3.12Å; A1036-M1039 WeakPolarHBondContact O-CB 3.44Å; A1036-M1039 PolarHBondContact O-N 3.1Å; Q1037-M1039 VanDerWaalsContact C-N 3.32Å; Q1037-M1039 PolarHBondContact O-N 3.01Å; M1039-K1042 PolarHBondContact O-N 3.18Å; M1039-E1043 VanDerWaalsContact O-CB 3.26Å; M1039-E1043 WeakPolarHBondContact O-CB 3.34Å; M1039-E1043 PolarHBondContact O-N 2.97Å
1040	E	75.9	Confident	72.1	Confident	80.2 Å²	80.2	71.2 Å²	71.2	38%	0.375	35%	0.346	S	S	.	.	H	α-helix	trans	-63	-42.5	177.1	-171.1	-171.1	165.3	0	0	111.8	A1036 Q1037 E1043 R1044 R1183	A1036-E1040 VanDerWaalsContact O-CB 3.27Å; A1036-E1040 WeakPolarHBondContact O-CB 3.4Å; A1036-E1040 PolarHBondContact O-N 3.27Å; Q1037-E1040 CarbonylContact O-C 3.57Å; Q1037-E1040 PolarHBondContact O-N 3.07Å; Q1037-E1040 VanDerWaalsContact O-N 3.17Å; E1040-E1043 PolarHBondContact O-N 3.27Å; E1040-R1044 WeakPolarHBondContact O-CB 3.36Å; E1040-R1044 PolarHBondContact O-N 3.21Å; E1040-R1044 IonicContact OE1-CZ 3.33Å; E1040-R1044 IonicContact OE1-NH1 3.45Å; E1040-R1044 PolarHBondContact OE1-NH1 3.19Å; E1040-R1044 IonicContact OE1-NH2 2.66Å; E1040-R1044 PolarHBondContact OE1-NH2 3.29Å; E1040-R1183 IonicContact OE1-CZ 3.11Å; E1040-R1183 IonicContact OE1-NE 2.73Å; E1040-R1183 PolarHBondContact OE1-NE 2.92Å; E1040-R1183 IonicContact OE1-NH2 2.93Å; E1040-R1183 PolarHBondContact OE1-NH2 3.2Å; E1040-R1183 IonicContact OE2-CZ 3.13Å; E1040-R1183 IonicContact OE2-NH2 2.75Å; E1040-R1183 PolarHBondContact OE2-NH2 2.96Å
1041	E	71.2	Confident	72.1	Confident	59.2 Å²	59.2	74.9 Å²	74.9	28%	0.277	36%	0.361	S	S	.	.	H	α-helix	trans	-68.8	-41.6	176.4	-174.9	130.7	-171.1	0	0	111.7	L1033 Q1037 H1038 E1043 R1044 R1045	L1033-E1041 WeakPolarHBondContact CD1-OE2 3.29Å; Q1037-E1041 WeakPolarHBondContact O-CB 3.25Å; Q1037-E1041 PolarHBondContact O-N 3Å; H1038-E1041 PolarHBondContact O-N 3.09Å; E1041-E1043 VanDerWaalsContact C-N 3.32Å; E1041-E1043 PolarHBondContact O-N 3.38Å; E1041-R1044 VanDerWaalsContact CD-NE 3.27Å; E1041-R1044 CarbonylContact O-C 3.58Å; E1041-R1044 WeakPolarHBondContact O-CB 3.45Å; E1041-R1044 PolarHBondContact O-N 3.14Å; E1041-R1044 VanDerWaalsContact O-N 3.14Å; E1041-R1044 IonicContact OE1-CZ 3.62Å; E1041-R1044 VanDerWaalsContact OE1-CZ 3.26Å; E1041-R1044 IonicContact OE1-NE 3.47Å; E1041-R1044 PolarHBondContact OE1-NE 3.2Å; E1041-R1044 IonicContact OE1-NH2 3.3Å; E1041-R1044 PolarHBondContact OE1-NH2 3.24Å; E1041-R1044 WeakPolarHBondContact OE2-CD 3.37Å; E1041-R1044 IonicContact OE2-CZ 3.62Å; E1041-R1044 IonicContact OE2-NE 2.78Å; E1041-R1044 PolarHBondContact OE2-NE 2.97Å; E1041-R1044 IonicContact OE2-NH2 3.73Å; E1041-R1045 WeakPolarHBondContact O-CB 3.49Å; E1041-R1045 WeakPolarHBondContact O-CG 3.38Å; E1041-R1045 PolarHBondContact O-N 3.12Å; E1041-R1045 WeakPolarHBondContact OE1-CG 3.42Å; E1041-R1045 IonicContact OE1-CZ 3.34Å; E1041-R1045 IonicContact OE1-NE 3.24Å; E1041-R1045 PolarHBondContact OE1-NE 3.14Å; E1041-R1045 IonicContact OE1-NH2 3.31Å; E1041-R1045 PolarHBondContact OE1-NH2 2.75Å
1042	K	75.2	Confident	71.9	Confident	131.6 Å²	131.6	76.7 Å²	76.7	57%	0.572	37%	0.365	S	S	*	.	H	α-helix	trans	-60.7	-42.6	173.8	-174.7	169	-176.3	165.4	0	111.7	D1027 H1038 M1039 R1045 R1046	D1027-K1042 IonicContact OD2-NZ 3.82Å; D1027-K1042 PolarHBondContact OD2-NZ 3.33Å; H1038-K1042 VanDerWaalsContact O-CB 3.27Å; H1038-K1042 WeakPolarHBondContact O-CB 3.28Å; H1038-K1042 PolarHBondContact O-N 3.11Å; M1039-K1042 PolarHBondContact O-N 3.18Å; K1042-R1045 PolarHBondContact O-N 3.22Å; K1042-R1046 VanDerWaalsContact O-CB 3.25Å; K1042-R1046 WeakPolarHBondContact O-CB 3.33Å; K1042-R1046 PolarHBondContact O-N 2.99Å; K1042-R1046 VanDerWaalsContact O-N 3.08Å
1043	E	75.5	Confident	71.8	Confident	81.2 Å²	81.2	80.8 Å²	80.8	38%	0.379	39%	0.385	S	S	.	.	H	α-helix	trans	-66.8	-43.1	175.7	-172.6	79.5	-137.5	0	0	111.4	M1039 E1040 E1041 R1045 R1046 L1047	M1039-E1043 VanDerWaalsContact O-CB 3.26Å; M1039-E1043 WeakPolarHBondContact O-CB 3.34Å; M1039-E1043 PolarHBondContact O-N 2.97Å; E1040-E1043 PolarHBondContact O-N 3.27Å; E1041-E1043 VanDerWaalsContact C-N 3.32Å; E1041-E1043 PolarHBondContact O-N 3.38Å; E1043-R1045 VanDerWaalsContact C-N 3.32Å; E1043-R1045 PolarHBondContact O-N 3.09Å; E1043-R1046 CarbonylContact O-C 3.55Å; E1043-R1046 WeakPolarHBondContact O-CB 3.36Å; E1043-R1046 PolarHBondContact O-N 3Å; E1043-R1046 VanDerWaalsContact O-N 3.15Å; E1043-R1046 IonicContact OE1-CZ 3.21Å; E1043-R1046 IonicContact OE1-NE 2.75Å; E1043-R1046 PolarHBondContact OE1-NE 3.03Å; E1043-R1046 IonicContact OE1-NH2 3.28Å; E1043-R1046 PolarHBondContact OE1-NH2 3.18Å; E1043-R1046 VanDerWaalsContact OE1-NH2 3.09Å; E1043-R1046 IonicContact OE2-CZ 3.31Å; E1043-R1046 IonicContact OE2-NE 3.25Å; E1043-R1046 PolarHBondContact OE2-NE 3Å; E1043-R1046 IonicContact OE2-NH2 3.14Å; E1043-R1046 PolarHBondContact OE2-NH2 2.9Å; E1043-L1047 HydrophobicContact CG-CD1 4.09Å; E1043-L1047 HydrophobicContact CG-CG 4.35Å; E1043-L1047 WeakPolarHBondContact O-CB 3.29Å; E1043-L1047 VanDerWaalsContact O-CG 3.23Å; E1043-L1047 WeakPolarHBondContact O-CG 3.36Å; E1043-L1047 PolarHBondContact O-N 3.12Å
1044	R	72.6	Confident	71.6	Confident	79 Å²	79	81.4 Å²	81.4	30%	0.298	39%	0.389	S	S	.	.	H	α-helix	trans	-60.1	-45.2	175.4	-173.6	-179.7	-101.5	100.1	-1	111.4	E412 Y432 E1040 E1041 R1046 L1047 L1048	E412-R1044 IonicContact OE2-NH2 3.57Å; E412-R1044 PolarHBondContact OE2-NH2 3.27Å; Y432-R1044 HydrophobicContact CD2-CG 4.13Å; E1040-R1044 WeakPolarHBondContact O-CB 3.36Å; E1040-R1044 PolarHBondContact O-N 3.21Å; E1040-R1044 IonicContact OE1-CZ 3.33Å; E1040-R1044 IonicContact OE1-NH1 3.45Å; E1040-R1044 PolarHBondContact OE1-NH1 3.19Å; E1040-R1044 IonicContact OE1-NH2 2.66Å; E1040-R1044 PolarHBondContact OE1-NH2 3.29Å; E1041-R1044 VanDerWaalsContact CD-NE 3.27Å; E1041-R1044 CarbonylContact O-C 3.58Å; E1041-R1044 WeakPolarHBondContact O-CB 3.45Å; E1041-R1044 PolarHBondContact O-N 3.14Å; E1041-R1044 VanDerWaalsContact O-N 3.14Å; E1041-R1044 IonicContact OE1-CZ 3.62Å; E1041-R1044 VanDerWaalsContact OE1-CZ 3.26Å; E1041-R1044 IonicContact OE1-NE 3.47Å; E1041-R1044 PolarHBondContact OE1-NE 3.2Å; E1041-R1044 IonicContact OE1-NH2 3.3Å; E1041-R1044 PolarHBondContact OE1-NH2 3.24Å; E1041-R1044 WeakPolarHBondContact OE2-CD 3.37Å; E1041-R1044 IonicContact OE2-CZ 3.62Å; E1041-R1044 IonicContact OE2-NE 2.78Å; E1041-R1044 PolarHBondContact OE2-NE 2.97Å; E1041-R1044 IonicContact OE2-NH2 3.73Å; R1044-R1046 VanDerWaalsContact C-N 3.34Å; R1044-R1046 PolarHBondContact O-N 3.18Å; R1044-L1047 PolarHBondContact O-N 2.91Å; R1044-L1048 HydrophobicContact CG-CD1 3.87Å; R1044-L1048 HydrophobicContact CG-CG 4.32Å; R1044-L1048 VanDerWaalsContact NH1-CD1 3.35Å; R1044-L1048 VanDerWaalsContact O-CB 3.3Å; R1044-L1048 WeakPolarHBondContact O-CB 3.33Å; R1044-L1048 VanDerWaalsContact O-CG 3.27Å; R1044-L1048 WeakPolarHBondContact O-CG 3.43Å; R1044-L1048 PolarHBondContact O-N 3.23Å
1045	R	70.9	Confident	71.1	Confident	103.2 Å²	103.2	81.5 Å²	81.5	39%	0.389	39%	0.391	S	S	.	.	H	α-helix	trans	-58.7	-46.3	173.2	-84.7	-178.6	-162.7	173.3	5.1	111.1	Y432 N1005 D1027 E1041 K1042 E1043 L1047 L1048 S1049	Y432-R1045 HydrophobicContact CE2-CG 3.85Å; Y432-R1045 WeakPolarHBondContact OH-CG 3.31Å; N1005-R1045 PolarHBondContact ND2-NH1 3.02Å; D1027-R1045 IonicContact OD1-NH1 2.65Å; D1027-R1045 IonicContact OD1-NH2 3.21Å; D1027-R1045 IonicContact OD2-NH1 2.78Å; D1027-R1045 PolarHBondContact OD2-NH1 3.23Å; D1027-R1045 IonicContact OD2-NH2 2.75Å; E1041-R1045 WeakPolarHBondContact O-CB 3.49Å; E1041-R1045 WeakPolarHBondContact O-CG 3.38Å; E1041-R1045 PolarHBondContact O-N 3.12Å; E1041-R1045 WeakPolarHBondContact OE1-CG 3.42Å; E1041-R1045 IonicContact OE1-CZ 3.34Å; E1041-R1045 IonicContact OE1-NE 3.24Å; E1041-R1045 PolarHBondContact OE1-NE 3.14Å; E1041-R1045 IonicContact OE1-NH2 3.31Å; E1041-R1045 PolarHBondContact OE1-NH2 2.75Å; K1042-R1045 PolarHBondContact O-N 3.22Å; E1043-R1045 VanDerWaalsContact C-N 3.32Å; E1043-R1045 PolarHBondContact O-N 3.09Å; R1045-L1047 VanDerWaalsContact C-N 3.31Å; R1045-L1047 PolarHBondContact O-N 3.06Å; R1045-L1048 PolarHBondContact O-N 3.03Å; R1045-S1049 WeakPolarHBondContact O-CB 3.41Å; R1045-S1049 PolarHBondContact O-N 3.11Å; R1045-S1049 PolarHBondContact O-OG 2.81Å
1046	R	74.7	Confident	70.4	Confident	129.6 Å²	129.6	80.4 Å²	80.4	49%	0.489	39%	0.393	S	S	.	.	H	α-helix	trans	-60.4	-40.1	177.6	-168.4	-174.3	74.3	88.5	-2.3	112.9	K1042 E1043 R1044 S1049 N1050 K1238 T1239	K1042-R1046 VanDerWaalsContact O-CB 3.25Å; K1042-R1046 WeakPolarHBondContact O-CB 3.33Å; K1042-R1046 PolarHBondContact O-N 2.99Å; K1042-R1046 VanDerWaalsContact O-N 3.08Å; E1043-R1046 CarbonylContact O-C 3.55Å; E1043-R1046 WeakPolarHBondContact O-CB 3.36Å; E1043-R1046 PolarHBondContact O-N 3Å; E1043-R1046 VanDerWaalsContact O-N 3.15Å; E1043-R1046 IonicContact OE1-CZ 3.21Å; E1043-R1046 IonicContact OE1-NE 2.75Å; E1043-R1046 PolarHBondContact OE1-NE 3.03Å; E1043-R1046 IonicContact OE1-NH2 3.28Å; E1043-R1046 PolarHBondContact OE1-NH2 3.18Å; E1043-R1046 VanDerWaalsContact OE1-NH2 3.09Å; E1043-R1046 IonicContact OE2-CZ 3.31Å; E1043-R1046 IonicContact OE2-NE 3.25Å; E1043-R1046 PolarHBondContact OE2-NE 3Å; E1043-R1046 IonicContact OE2-NH2 3.14Å; E1043-R1046 PolarHBondContact OE2-NH2 2.9Å; R1044-R1046 VanDerWaalsContact C-N 3.34Å; R1044-R1046 PolarHBondContact O-N 3.18Å; R1046-S1049 PolarHBondContact O-OG 3.35Å; R1046-N1050 PolarHBondContact O-ND2 3.14Å; R1046-K1238 PolarHBondContact NH1-O 2.79Å; R1046-T1239 PolarHBondContact NH1-O 2.88Å
1047	L	72	Confident	69.6	Low	73.4 Å²	73.4	81.5 Å²	81.5	38%	0.384	39%	0.388	S	S	.	.	H	α-helix	trans	-72.3	-38.7	179.1	-70.8	170.5	0	0	0	112.4	E1043 R1044 R1045 W1252	E1043-L1047 HydrophobicContact CG-CD1 4.09Å; E1043-L1047 HydrophobicContact CG-CG 4.35Å; E1043-L1047 WeakPolarHBondContact O-CB 3.29Å; E1043-L1047 VanDerWaalsContact O-CG 3.23Å; E1043-L1047 WeakPolarHBondContact O-CG 3.36Å; E1043-L1047 PolarHBondContact O-N 3.12Å; R1044-L1047 PolarHBondContact O-N 2.91Å; R1045-L1047 VanDerWaalsContact C-N 3.31Å; R1045-L1047 PolarHBondContact O-N 3.06Å; L1047-W1252 HydrophobicContact CD1-CB 4.39Å; L1047-W1252 HydrophobicContact CD1-CG 4.49Å
1048	L	68.1	Low	68.9	Low	15.2 Å²	15.2	80.7 Å²	80.7	8%	0.08	39%	0.388	C	S	.	.	H	α-helix	trans	-81.3	-35.4	-178.7	-67	175.2	0	0	0	113	N428 L429 Y432 R1044 R1045 N1050 K1051 F1052 V1054	N428-L1048 HydrophobicContact CB-CD2 4.12Å; L429-L1048 HydrophobicContact CB-CD2 4.23Å; L429-L1048 HydrophobicContact CD1-CD2 4.48Å; Y432-L1048 HydrophobicContact CD1-CD1 4.18Å; Y432-L1048 HydrophobicContact CD2-CD1 3.61Å; Y432-L1048 HydrophobicContact CE2-CD1 4.42Å; Y432-L1048 HydrophobicContact CG-CD1 3.46Å; R1044-L1048 HydrophobicContact CG-CD1 3.87Å; R1044-L1048 HydrophobicContact CG-CG 4.32Å; R1044-L1048 VanDerWaalsContact NH1-CD1 3.35Å; R1044-L1048 VanDerWaalsContact O-CB 3.3Å; R1044-L1048 WeakPolarHBondContact O-CB 3.33Å; R1044-L1048 VanDerWaalsContact O-CG 3.27Å; R1044-L1048 WeakPolarHBondContact O-CG 3.43Å; R1044-L1048 PolarHBondContact O-N 3.23Å; R1045-L1048 PolarHBondContact O-N 3.03Å; L1048-N1050 VanDerWaalsContact C-N 3.29Å; L1048-N1050 PolarHBondContact O-N 3.13Å; L1048-K1051 PolarHBondContact O-N 2.83Å; L1048-K1051 VanDerWaalsContact O-N 3.14Å; L1048-F1052 HydrophobicContact CB-CD2 4.4Å; L1048-F1052 HydrophobicContact CD2-CD2 3.9Å; L1048-F1052 HydrophobicContact CD2-CE2 3.99Å; L1048-F1052 PolarHBondContact O-N 3.09Å; L1048-V1054 HydrophobicContact CB-CG2 3.89Å
1049	S	69.5	Low	68.2	Low	45 Å²	45	81.2 Å²	81.2	32%	0.315	39%	0.394	S	S	.	.	H	α-helix	trans	-56.9	-42.5	179.1	142.9	0	0	0	0	111.9	R1045 R1046 K1051 N1053 V1054	R1045-S1049 WeakPolarHBondContact O-CB 3.41Å; R1045-S1049 PolarHBondContact O-N 3.11Å; R1045-S1049 PolarHBondContact O-OG 2.81Å; R1046-S1049 PolarHBondContact O-OG 3.35Å; S1049-K1051 VanDerWaalsContact C-N 3.26Å; S1049-K1051 PolarHBondContact O-N 2.97Å; S1049-K1051 VanDerWaalsContact O-N 3.1Å; S1049-N1053 WeakPolarHBondContact O-CA 3.33Å; S1049-N1053 PolarHBondContact O-N 3.24Å; S1049-N1053 VanDerWaalsContact O-N 3.14Å; S1049-V1054 VanDerWaalsContact CB-O 3.28Å; S1049-V1054 WeakPolarHBondContact CB-O 3.49Å; S1049-V1054 PolarHBondContact OG-O 3.42Å
1050	N	63.3	Low	67.4	Low	119.4 Å²	119.4	80 Å²	80	64%	0.639	39%	0.39	S	S	*	.	H	α-helix	trans	-62.4	-19.6	176.9	-78.5	-33.1	0	0	0	114.7	R1046 L1048	R1046-N1050 PolarHBondContact O-ND2 3.14Å; L1048-N1050 VanDerWaalsContact C-N 3.29Å; L1048-N1050 PolarHBondContact O-N 3.13Å
1051	K	65.5	Low	66.5	Low	102.2 Å²	102.2	78 Å²	78	44%	0.444	38%	0.381	S	S	.	.	H	α-helix	trans	-112.2	-35.3	-177.7	-72.3	-170.1	176.7	-159	0	113.9	D425 L1048 S1049 Q1169 V1171 E1242	D425-K1051 HydrophobicContact CB-CD 3.88Å; D425-K1051 VanDerWaalsContact OD2-CD 3.24Å; D425-K1051 WeakPolarHBondContact OD2-CD 3.29Å; D425-K1051 WeakPolarHBondContact OD2-CE 3.31Å; D425-K1051 IonicContact OD2-NZ 3.96Å; D425-K1051 PolarHBondContact OD2-NZ 2.96Å; L1048-K1051 PolarHBondContact O-N 2.83Å; L1048-K1051 VanDerWaalsContact O-N 3.14Å; S1049-K1051 VanDerWaalsContact C-N 3.26Å; S1049-K1051 PolarHBondContact O-N 2.97Å; S1049-K1051 VanDerWaalsContact O-N 3.1Å; K1051-Q1169 VanDerWaalsContact O-CD 3.28Å; K1051-Q1169 PolarHBondContact O-NE2 2.86Å; K1051-Q1169 PolarHBondContact O-OE1 3.26Å; K1051-Q1169 VanDerWaalsContact O-OE1 3.06Å; K1051-V1171 HydrophobicContact CB-CG1 4.45Å; K1051-V1171 HydrophobicContact CB-CG2 4.43Å; K1051-V1171 VanDerWaalsContact O-CG1 3.27Å; K1051-V1171 WeakPolarHBondContact O-CG1 3.38Å; K1051-E1242 IonicContact NZ-OE1 2.7Å; K1051-E1242 PolarHBondContact NZ-OE1 3Å
1052	F	63.2	Low	65.8	Low	78.2 Å²	78.2	81.8 Å²	81.8	34%	0.343	39%	0.393	S	S	.	.	H	α-helix	trans	-119.2	4.8	-170.8	-60.8	-74.2	0	0	0	113.9	D425 L429 L1048 V1054 V1171 W1254	D425-F1052 HydrophobicContact CB-CE2 3.94Å; D425-F1052 HydrophobicContact CB-CZ 4.29Å; D425-F1052 VanDerWaalsContact O-CE2 3.28Å; D425-F1052 WeakPolarHBondContact O-CE2 3.45Å; D425-F1052 WeakPolarHBondContact O-CZ 3.36Å; L429-F1052 HydrophobicContact CB-CD2 4.13Å; L429-F1052 HydrophobicContact CB-CE2 4Å; L429-F1052 HydrophobicContact CB-CZ 4.3Å; L429-F1052 HydrophobicContact CD1-CB 3.99Å; L429-F1052 HydrophobicContact CD1-CD2 4.05Å; L429-F1052 HydrophobicContact CD1-CG 4.02Å; L429-F1052 HydrophobicContact CD2-CB 4.2Å; L429-F1052 HydrophobicContact CD2-CD1 3.54Å; L429-F1052 HydrophobicContact CD2-CD2 4.1Å; L429-F1052 HydrophobicContact CD2-CE1 3.78Å; L429-F1052 HydrophobicContact CD2-CE2 4.34Å; L429-F1052 HydrophobicContact CD2-CG 3.69Å; L429-F1052 HydrophobicContact CD2-CZ 4.2Å; L429-F1052 HydrophobicContact CG-CD2 4.32Å; L429-F1052 HydrophobicContact CG-CG 4.3Å; L1048-F1052 HydrophobicContact CB-CD2 4.4Å; L1048-F1052 HydrophobicContact CD2-CD2 3.9Å; L1048-F1052 HydrophobicContact CD2-CE2 3.99Å; L1048-F1052 PolarHBondContact O-N 3.09Å; F1052-V1054 HydrophobicContact CB-CG2 3.99Å; F1052-V1054 PolarHBondContact O-N 3.08Å; F1052-V1054 VanDerWaalsContact O-N 3.17Å; F1052-V1171 HydrophobicContact CD1-CG1 3.96Å; F1052-V1171 HydrophobicContact CD1-CG2 4.33Å; F1052-V1171 HydrophobicContact CE1-CB 4.35Å; F1052-V1171 HydrophobicContact CE1-CG1 3.83Å; F1052-V1171 HydrophobicContact CE1-CG2 3.52Å; F1052-V1171 HydrophobicContact CZ-CG2 3.69Å; F1052-W1254 HydrophobicContact CE2-CH2 4.06Å; F1052-W1254 AromaticContact CE2-CZ2 3.98Å; F1052-W1254 HydrophobicContact CE2-CZ2 3.98Å; F1052-W1254 AromaticContact CZ-CH2 3.97Å; F1052-W1254 HydrophobicContact CZ-CH2 3.97Å; F1052-W1254 HydrophobicContact CZ-CZ2 4.3Å
1053	N	64.3	Low	64.9	Low	109.2 Å²	109.2	77.3 Å²	77.3	58%	0.584	39%	0.385	S	S	*	.			trans	52	44.6	-180	-156.2	14.3	0	0	0	113.2	S1049 S1055 C1058	S1049-N1053 WeakPolarHBondContact O-CA 3.33Å; S1049-N1053 PolarHBondContact O-N 3.24Å; S1049-N1053 VanDerWaalsContact O-N 3.14Å; N1053-S1055 VanDerWaalsContact C-N 3.32Å; N1053-S1055 PolarHBondContact O-N 2.93Å; N1053-S1055 PolarHBondContact OD1-OG 3.33Å; N1053-C1058 PolarHBondContact ND2-SG 2.78Å; N1053-C1058 VanDerWaalsContact ND2-SG 3.39Å; N1053-C1058 VanDerWaalsContact O-CB 3.27Å; N1053-C1058 WeakPolarHBondContact O-CB 3.42Å; N1053-C1058 PolarHBondContact O-SG 3.39Å
1054	V	64.5	Low	63.9	Low	36.4 Å²	36.4	77.2 Å²	77.2	22%	0.221	38%	0.381	C	S	.	.			trans	-75.8	66.2	174.9	-169.6	0	0	0	0	109.2	L429 Y432 L1048 S1049 F1052 T1059	L429-V1054 HydrophobicContact CD1-CG2 4.13Å; Y432-V1054 HydrophobicContact CD1-CG1 4.23Å; Y432-V1054 HydrophobicContact CE1-CG1 3.39Å; Y432-V1054 VanDerWaalsContact CE1-CG1 3.48Å; L1048-V1054 HydrophobicContact CB-CG2 3.89Å; S1049-V1054 VanDerWaalsContact CB-O 3.28Å; S1049-V1054 WeakPolarHBondContact CB-O 3.49Å; S1049-V1054 PolarHBondContact OG-O 3.42Å; F1052-V1054 HydrophobicContact CB-CG2 3.99Å; F1052-V1054 PolarHBondContact O-N 3.08Å; F1052-V1054 VanDerWaalsContact O-N 3.17Å; V1054-T1059 HydrophobicContact CG1-CG2 3.66Å; V1054-T1059 WeakPolarHBondContact CG1-OG1 3.4Å
1055	S	64.9	Low	63.1	Low	41.2 Å²	41.2	74.3 Å²	74.3	29%	0.288	37%	0.372	S	S	.	.			trans	-74.7	158	169.5	62.2	0	0	0	0	110.3	N1053 L1057 C1058 T1059	N1053-S1055 VanDerWaalsContact C-N 3.32Å; N1053-S1055 PolarHBondContact O-N 2.93Å; N1053-S1055 PolarHBondContact OD1-OG 3.33Å; S1055-L1057 VanDerWaalsContact C-N 3.3Å; S1055-L1057 PolarHBondContact O-N 2.98Å; S1055-C1058 WeakPolarHBondContact O-CA 3.5Å; S1055-C1058 VanDerWaalsContact O-CB 3.27Å; S1055-C1058 WeakPolarHBondContact O-CB 3.17Å; S1055-C1058 PolarHBondContact O-N 2.9Å; S1055-C1058 VanDerWaalsContact O-N 3.13Å; S1055-C1058 WeakPolarHBondContact OG-CB 3.34Å; S1055-C1058 PolarHBondContact OG-N 3.13Å; S1055-C1058 VanDerWaalsContact OG-N 3.12Å; S1055-C1058 PolarHBondContact OG-SG 3.16Å; S1055-C1058 VanDerWaalsContact OG-SG 3.32Å; S1055-T1059 PolarHBondContact O-N 3.08Å; S1055-T1059 PolarHBondContact O-OG1 2.89Å; S1055-T1059 VanDerWaalsContact O-OG1 3.1Å
1056	E	62.2	Low	62.4	Low	123.2 Å²	123.2	72.1 Å²	72.1	58%	0.576	37%	0.367	S	S	*	.	H	α-helix	trans	-53.2	-47	173	-83.1	165.4	177	0	0	110.7	R1004 N1005 C1058 T1059 D1060	R1004-E1056 IonicContact CZ-OE2 3.39Å; R1004-E1056 IonicContact NH1-OE1 3.61Å; R1004-E1056 IonicContact NH1-OE2 2.98Å; R1004-E1056 PolarHBondContact NH1-OE2 3.47Å; N1005-E1056 HydrophobicContact CB-CG 4.46Å; N1005-E1056 WeakPolarHBondContact CB-OE1 3.2Å; N1005-E1056 PolarHBondContact ND2-OE1 2.93Å; E1056-C1058 VanDerWaalsContact C-N 3.29Å; E1056-C1058 CarbonylContact O-C 3.54Å; E1056-C1058 PolarHBondContact O-N 3.33Å; E1056-T1059 VanDerWaalsContact CA-OG1 3.29Å; E1056-T1059 WeakPolarHBondContact CA-OG1 3.4Å; E1056-T1059 CarbonylContact O-C 3.58Å; E1056-T1059 VanDerWaalsContact O-CA 3.29Å; E1056-T1059 WeakPolarHBondContact O-CA 3.39Å; E1056-T1059 VanDerWaalsContact O-CB 3.23Å; E1056-T1059 WeakPolarHBondContact O-CB 3.48Å; E1056-T1059 PolarHBondContact O-N 2.83Å; E1056-T1059 VanDerWaalsContact O-N 3.16Å; E1056-T1059 PolarHBondContact O-OG1 3.31Å; E1056-D1060 WeakPolarHBondContact O-CB 3.43Å; E1056-D1060 VanDerWaalsContact O-CG 3.25Å; E1056-D1060 PolarHBondContact O-N 3.21Å; E1056-D1060 VanDerWaalsContact O-OD2 3.06Å
1057	L	60.4	Low	61.4	Low	92.4 Å²	92.4	67.7 Å²	67.7	48%	0.484	36%	0.356	S	S	.	.	H	α-helix	trans	-52.8	-39.1	173.8	-177.6	68.1	0	0	0	113.9	I908 S1055 D1060 M1061 K1122	I908-L1057 HydrophobicContact CB-CD2 4.48Å; I908-L1057 HydrophobicContact CG2-CD1 4.05Å; I908-L1057 HydrophobicContact CG2-CD2 4.24Å; S1055-L1057 VanDerWaalsContact C-N 3.3Å; S1055-L1057 PolarHBondContact O-N 2.98Å; L1057-D1060 WeakPolarHBondContact CA-OD2 3.43Å; L1057-D1060 PolarHBondContact N-OD2 2.88Å; L1057-D1060 PolarHBondContact O-N 3.13Å; L1057-M1061 WeakPolarHBondContact O-CB 3.42Å; L1057-M1061 VanDerWaalsContact O-CG 3.23Å; L1057-M1061 WeakPolarHBondContact O-CG 3.36Å; L1057-M1061 PolarHBondContact O-N 3.24Å; L1057-K1122 VanDerWaalsContact CD1-NZ 3.25Å; L1057-K1122 HydrophobicContact CD2-CD 3.65Å; L1057-K1122 HydrophobicContact CD2-CG 4.06Å
1058	C	60.6	Low	60.5	Low	32.4 Å²	32.4	67.8 Å²	67.8	22%	0.219	36%	0.356	C	S	.	.	H	α-helix	trans	-71.7	-40.9	177	-109.4	0	0	0	0	111.4	N1053 S1055 E1056 D1060 M1061 W1062	N1053-C1058 PolarHBondContact ND2-SG 2.78Å; N1053-C1058 VanDerWaalsContact ND2-SG 3.39Å; N1053-C1058 VanDerWaalsContact O-CB 3.27Å; N1053-C1058 WeakPolarHBondContact O-CB 3.42Å; N1053-C1058 PolarHBondContact O-SG 3.39Å; S1055-C1058 WeakPolarHBondContact O-CA 3.5Å; S1055-C1058 VanDerWaalsContact O-CB 3.27Å; S1055-C1058 WeakPolarHBondContact O-CB 3.17Å; S1055-C1058 PolarHBondContact O-N 2.9Å; S1055-C1058 VanDerWaalsContact O-N 3.13Å; S1055-C1058 WeakPolarHBondContact OG-CB 3.34Å; S1055-C1058 PolarHBondContact OG-N 3.13Å; S1055-C1058 VanDerWaalsContact OG-N 3.12Å; S1055-C1058 PolarHBondContact OG-SG 3.16Å; S1055-C1058 VanDerWaalsContact OG-SG 3.32Å; E1056-C1058 VanDerWaalsContact C-N 3.29Å; E1056-C1058 CarbonylContact O-C 3.54Å; E1056-C1058 PolarHBondContact O-N 3.33Å; C1058-D1060 VanDerWaalsContact C-N 3.3Å; C1058-D1060 PolarHBondContact O-N 3.36Å; C1058-M1061 WeakPolarHBondContact O-CB 3.47Å; C1058-M1061 PolarHBondContact O-N 3.19Å; C1058-W1062 VanDerWaalsContact O-CD1 3.23Å; C1058-W1062 PolarHBondContact O-N 2.99Å; C1058-W1062 VanDerWaalsContact O-N 3.13Å
1059	T	60.8	Low	60	Low	63.6 Å²	63.6	71.1 Å²	71.1	39%	0.39	37%	0.371	S	S	.	.	H	α-helix	trans	-61.8	-41.7	174.6	-12.2	0	0	0	0	111.1	Y432 V1054 S1055 E1056 M1061 W1062 G1063	Y432-T1059 HydrophobicContact CE1-CG2 4.25Å; V1054-T1059 HydrophobicContact CG1-CG2 3.66Å; V1054-T1059 WeakPolarHBondContact CG1-OG1 3.4Å; S1055-T1059 PolarHBondContact O-N 3.08Å; S1055-T1059 PolarHBondContact O-OG1 2.89Å; S1055-T1059 VanDerWaalsContact O-OG1 3.1Å; E1056-T1059 VanDerWaalsContact CA-OG1 3.29Å; E1056-T1059 WeakPolarHBondContact CA-OG1 3.4Å; E1056-T1059 CarbonylContact O-C 3.58Å; E1056-T1059 VanDerWaalsContact O-CA 3.29Å; E1056-T1059 WeakPolarHBondContact O-CA 3.39Å; E1056-T1059 VanDerWaalsContact O-CB 3.23Å; E1056-T1059 WeakPolarHBondContact O-CB 3.48Å; E1056-T1059 PolarHBondContact O-N 2.83Å; E1056-T1059 VanDerWaalsContact O-N 3.16Å; E1056-T1059 PolarHBondContact O-OG1 3.31Å; T1059-M1061 VanDerWaalsContact C-N 3.32Å; T1059-M1061 PolarHBondContact O-N 3.2Å; T1059-W1062 CarbonylContact O-C 3.55Å; T1059-W1062 PolarHBondContact O-N 3.02Å; T1059-W1062 VanDerWaalsContact O-N 3.12Å; T1059-G1063 PolarHBondContact O-N 3.12Å
1060	D	59.2	Low	59.3	Low	83.2 Å²	83.2	70.2 Å²	70.2	45%	0.445	36%	0.363	S	S	.	.	H	α-helix	trans	-64	-40.2	176.7	-61	-18.1	0	0	0	111.7	M911 E1056 L1057 C1058 W1062 G1063 Y1064	M911-D1060 HydrophobicContact CE-CB 3.8Å; M911-D1060 HydrophobicContact SD-CB 4.23Å; E1056-D1060 WeakPolarHBondContact O-CB 3.43Å; E1056-D1060 VanDerWaalsContact O-CG 3.25Å; E1056-D1060 PolarHBondContact O-N 3.21Å; E1056-D1060 VanDerWaalsContact O-OD2 3.06Å; L1057-D1060 WeakPolarHBondContact CA-OD2 3.43Å; L1057-D1060 PolarHBondContact N-OD2 2.88Å; L1057-D1060 PolarHBondContact O-N 3.13Å; C1058-D1060 VanDerWaalsContact C-N 3.3Å; C1058-D1060 PolarHBondContact O-N 3.36Å; D1060-W1062 VanDerWaalsContact C-N 3.26Å; D1060-W1062 PolarHBondContact O-N 3.05Å; D1060-G1063 CarbonylContact O-C 3.51Å; D1060-G1063 WeakPolarHBondContact O-CA 3.42Å; D1060-G1063 PolarHBondContact O-N 3.11Å; D1060-Y1064 PolarHBondContact O-N 2.96Å
1061	M	58.5	Low	58.8	Low	39 Å²	39	66.1 Å²	66.1	19%	0.192	34%	0.343	C	S	.	.	H	α-helix	trans	-64.5	-27.1	176.1	-113.3	174.6	62.6	0	0	113.3	I908 L1057 C1058 T1059 G1063 Y1064 L1111 T1115 H1118 F1119 K1122 I1123	I908-M1061 HydrophobicContact CD1-SD 3.52Å; I908-M1061 VanDerWaalsContact CD1-SD 3.52Å; L1057-M1061 WeakPolarHBondContact O-CB 3.42Å; L1057-M1061 VanDerWaalsContact O-CG 3.23Å; L1057-M1061 WeakPolarHBondContact O-CG 3.36Å; L1057-M1061 PolarHBondContact O-N 3.24Å; C1058-M1061 WeakPolarHBondContact O-CB 3.47Å; C1058-M1061 PolarHBondContact O-N 3.19Å; T1059-M1061 VanDerWaalsContact C-N 3.32Å; T1059-M1061 PolarHBondContact O-N 3.2Å; M1061-G1063 VanDerWaalsContact C-N 3.29Å; M1061-Y1064 WeakPolarHBondContact O-CB 3.5Å; M1061-L1111 HydrophobicContact CG-CD1 3.92Å; M1061-L1111 HydrophobicContact SD-CD1 4.1Å; M1061-T1115 HydrophobicContact CE-CG2 3.77Å; M1061-T1115 HydrophobicContact CG-CG2 4.15Å; M1061-T1115 HydrophobicContact SD-CG2 3.84Å; M1061-H1118 PolarHBondContact O-CD2 3.44Å; M1061-H1118 HydrophobicContact SD-CB 3.69Å; M1061-H1118 VanDerWaalsContact SD-CD2 3.58Å; M1061-H1118 VanDerWaalsContact SD-CG 3.55Å; M1061-F1119 HydrophobicContact CE-CD2 3.62Å; M1061-F1119 HydrophobicContact CE-CE2 3.55Å; M1061-F1119 HydrophobicContact CE-CG 4.45Å; M1061-F1119 HydrophobicContact CE-CZ 4.35Å; M1061-K1122 HydrophobicContact CE-CB 3.85Å; M1061-K1122 HydrophobicContact CE-CD 4.28Å; M1061-K1122 HydrophobicContact CE-CG 3.94Å; M1061-K1122 HydrophobicContact CG-CB 4.42Å; M1061-I1123 HydrophobicContact CE-CG1 4.15Å
1062	W	56.9	Low	58.4	Low	138.4 Å²	138.4	65 Å²	65	52%	0.524	34%	0.342	S	S	.	.	H	α-helix	trans	-90.2	-11.7	173.5	-72.5	103.1	0	0	0	113	C1058 T1059 D1060 Y1064 I1065 L1111 T1115 F1119 W1172	C1058-W1062 VanDerWaalsContact O-CD1 3.23Å; C1058-W1062 PolarHBondContact O-N 2.99Å; C1058-W1062 VanDerWaalsContact O-N 3.13Å; T1059-W1062 CarbonylContact O-C 3.55Å; T1059-W1062 PolarHBondContact O-N 3.02Å; T1059-W1062 VanDerWaalsContact O-N 3.12Å; D1060-W1062 VanDerWaalsContact C-N 3.26Å; D1060-W1062 PolarHBondContact O-N 3.05Å; W1062-Y1064 VanDerWaalsContact C-N 3.3Å; W1062-Y1064 PolarHBondContact O-N 3.22Å; W1062-Y1064 VanDerWaalsContact O-N 3.08Å; W1062-I1065 HydrophobicContact CD2-CD1 4.38Å; W1062-I1065 HydrophobicContact CE3-CD1 3.57Å; W1062-I1065 HydrophobicContact CE3-CG1 4.12Å; W1062-I1065 HydrophobicContact CZ3-CD1 3.73Å; W1062-I1065 WeakPolarHBondContact O-CB 3.43Å; W1062-I1065 WeakPolarHBondContact O-CG1 3.33Å; W1062-I1065 PolarHBondContact O-N 3.18Å; W1062-I1065 VanDerWaalsContact O-O 3.1Å; W1062-L1111 HydrophobicContact CZ3-CD2 4.27Å; W1062-T1115 HydrophobicContact CE3-CG2 4.26Å; W1062-T1115 HydrophobicContact CZ3-CG2 4.39Å; W1062-F1119 HydrophobicContact CD2-CD2 4.28Å; W1062-F1119 AromaticContact CD2-CE2 3.79Å; W1062-F1119 HydrophobicContact CD2-CE2 3.79Å; W1062-F1119 AromaticContact CE2-CE2 3.53Å; W1062-F1119 AromaticContact CE2-CZ 4Å; W1062-F1119 HydrophobicContact CE3-CD2 4.31Å; W1062-F1119 HydrophobicContact CE3-CE2 4.06Å; W1062-F1119 HydrophobicContact CG-CE2 4.43Å; W1062-F1119 HydrophobicContact CH2-CD2 4.09Å; W1062-F1119 HydrophobicContact CH2-CE1 4.33Å; W1062-F1119 AromaticContact CH2-CE2 3.93Å; W1062-F1119 HydrophobicContact CH2-CE2 3.93Å; W1062-F1119 AromaticContact CH2-CZ 3.66Å; W1062-F1119 HydrophobicContact CH2-CZ 3.66Å; W1062-F1119 AromaticContact CZ2-CE2 3.59Å; W1062-F1119 HydrophobicContact CZ2-CE2 3.9Å; W1062-F1119 AromaticContact CZ2-CZ 3.54Å; W1062-F1119 HydrophobicContact CZ2-CZ 3.54Å; W1062-F1119 HydrophobicContact CZ3-CE2 4.1Å; W1062-F1119 HydrophobicContact CZ3-CZ 4.21Å; W1062-W1172 HydrophobicContact CZ2-CH2 4.16Å
1063	G	54.9	Low	58	Low	38.6 Å²	38.6	62.4 Å²	62.4	40%	0.398	33%	0.332	S	S	.	.	H	α-helix	trans	-64.9	-7.5	178.2	0	0	0	0	0	113.9	T1059 D1060 M1061 I1065 D1066 E1069	T1059-G1063 PolarHBondContact O-N 3.12Å; D1060-G1063 CarbonylContact O-C 3.51Å; D1060-G1063 WeakPolarHBondContact O-CA 3.42Å; D1060-G1063 PolarHBondContact O-N 3.11Å; M1061-G1063 VanDerWaalsContact C-N 3.29Å; G1063-I1065 VanDerWaalsContact C-N 3.34Å; G1063-I1065 PolarHBondContact O-N 2.93Å; G1063-I1065 VanDerWaalsContact O-N 3.1Å; G1063-D1066 WeakPolarHBondContact O-CA 3.47Å; G1063-D1066 WeakPolarHBondContact O-CB 3.39Å; G1063-D1066 PolarHBondContact O-N 3.09Å; G1063-E1069 VanDerWaalsContact CA-CD 3.48Å; G1063-E1069 WeakPolarHBondContact CA-OE2 3.29Å; G1063-E1069 WeakPolarHBondContact O-CB 3.48Å
1064	Y	55.4	Low	57.6	Low	77.8 Å²	77.8	60.2 Å²	60.2	31%	0.305	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	0	176	-108	-92.2	0	0	0	113.7	D435 F437 C890 V892 V893 D895 D1060 M1061 W1062 D1066 E1069 L1070 T1073 L1111 L1112 T1115 H1118	D435-Y1064 WeakPolarHBondContact OD2-CE2 3.49Å; F437-Y1064 HydrophobicContact CB-CE2 4.32Å; F437-Y1064 HydrophobicContact CD2-CD1 4.14Å; F437-Y1064 AromaticContact CD2-CD2 3.49Å; F437-Y1064 HydrophobicContact CD2-CD2 3.49Å; F437-Y1064 VanDerWaalsContact CD2-CD2 3.49Å; F437-Y1064 HydrophobicContact CD2-CE1 4.36Å; F437-Y1064 AromaticContact CD2-CE2 3.75Å; F437-Y1064 HydrophobicContact CD2-CE2 3.75Å; F437-Y1064 AromaticContact CD2-CG 3.7Å; F437-Y1064 HydrophobicContact CD2-CG 3.7Å; F437-Y1064 HydrophobicContact CE2-CD1 4.48Å; F437-Y1064 AromaticContact CE2-CD2 3.94Å; F437-Y1064 HydrophobicContact CE2-CD2 3.94Å; F437-Y1064 AromaticContact CE2-CG 3.86Å; F437-Y1064 HydrophobicContact CE2-CG 3.86Å; F437-Y1064 HydrophobicContact CG-CE2 4.44Å; C890-Y1064 HydrophobicContact CB-CE1 4.39Å; C890-Y1064 PolarHBondContact O-OH 3.04Å; V892-Y1064 HydrophobicContact CB-CE1 4.15Å; V892-Y1064 HydrophobicContact CG2-CE1 4.23Å; V892-Y1064 PolarHBondContact N-OH 2.78Å; V892-Y1064 VanDerWaalsContact N-OH 3.14Å; V892-Y1064 WeakPolarHBondContact O-CE1 3.44Å; V892-Y1064 PolarHBondContact O-OH 3.36Å; V893-Y1064 HydrophobicContact CG1-CE1 4.34Å; V893-Y1064 WeakPolarHBondContact CG1-OH 3.32Å; D895-Y1064 WeakPolarHBondContact OD2-CE2 3.48Å; D1060-Y1064 PolarHBondContact O-N 2.96Å; M1061-Y1064 WeakPolarHBondContact O-CB 3.5Å; W1062-Y1064 VanDerWaalsContact C-N 3.3Å; W1062-Y1064 PolarHBondContact O-N 3.22Å; W1062-Y1064 VanDerWaalsContact O-N 3.08Å; Y1064-D1066 PolarHBondContact O-N 2.97Å; Y1064-E1069 WeakPolarHBondContact CA-OE2 3.22Å; Y1064-L1070 HydrophobicContact CD1-CD1 3.89Å; Y1064-L1070 HydrophobicContact CE1-CD1 3.75Å; Y1064-T1073 HydrophobicContact CE2-CG2 4.17Å; Y1064-T1073 WeakPolarHBondContact OH-CG2 3.39Å; Y1064-L1111 HydrophobicContact CD1-CD2 4.5Å; Y1064-L1111 WeakPolarHBondContact O-CD1 3.3Å; Y1064-L1112 HydrophobicContact CE1-CD2 4.05Å; Y1064-T1115 HydrophobicContact CD1-CG2 3.78Å; Y1064-T1115 HydrophobicContact CE1-CG2 4.42Å; Y1064-T1115 HydrophobicContact CG-CG2 4.39Å; Y1064-H1118 HydrophobicContact CD1-CB 4.48Å; Y1064-H1118 AromaticContact CD1-CE1 3.1Å; Y1064-H1118 WeakPolarHBondContact CD1-CE1 3.38Å; Y1064-H1118 AromaticContact CD1-ND1 3.09Å; Y1064-H1118 WeakPolarHBondContact CD1-ND1 3.37Å; Y1064-H1118 HydrophobicContact CD2-CB 4.15Å; Y1064-H1118 AromaticContact CD2-CD2 3.8Å; Y1064-H1118 AromaticContact CD2-CE1 3.48Å; Y1064-H1118 WeakPolarHBondContact CD2-CE1 3.39Å; Y1064-H1118 AromaticContact CD2-CG 3.46Å; Y1064-H1118 VanDerWaalsContact CD2-CG 3.46Å; Y1064-H1118 AromaticContact CD2-ND1 3.22Å; Y1064-H1118 WeakPolarHBondContact CD2-ND1 3.4Å; Y1064-H1118 AromaticContact CD2-NE2 3.78Å; Y1064-H1118 AromaticContact CE1-CE1 3.53Å; Y1064-H1118 AromaticContact CE1-ND1 3.53Å; Y1064-H1118 AromaticContact CE2-CE1 3.72Å; Y1064-H1118 VanDerWaalsContact CE2-CE1 3.48Å; Y1064-H1118 WeakPolarHBondContact CE2-CE1 3.25Å; Y1064-H1118 AromaticContact CE2-CG 3.96Å; Y1064-H1118 AromaticContact CE2-ND1 3.25Å; Y1064-H1118 VanDerWaalsContact CE2-ND1 3.25Å; Y1064-H1118 WeakPolarHBondContact CE2-ND1 3.44Å; Y1064-H1118 HydrophobicContact CG-CB 4.04Å; Y1064-H1118 AromaticContact CG-CE1 3.09Å; Y1064-H1118 AromaticContact CG-CG 3.83Å; Y1064-H1118 AromaticContact CG-ND1 3.78Å; Y1064-H1118 AromaticContact CG-NE2 3.68Å; Y1064-H1118 AromaticContact CZ-CE1 3.94Å
1065	I	56.1	Low	57.3	Low	18.2 Å²	18.2	63.7 Å²	63.7	9%	0.093	33%	0.329	C	S	.	.	S	Bend	trans	-96.3	79.3	172.2	-57	-178.7	0	0	0	109.1	V892 W1062 G1063 P1067 L1070 W1101 L1111 L1114 T1115 H1118	V892-I1065 HydrophobicContact CB-CD1 3.82Å; V892-I1065 HydrophobicContact CG1-CD1 3.69Å; V892-I1065 HydrophobicContact CG2-CD1 4.18Å; W1062-I1065 HydrophobicContact CD2-CD1 4.38Å; W1062-I1065 HydrophobicContact CE3-CD1 3.57Å; W1062-I1065 HydrophobicContact CE3-CG1 4.12Å; W1062-I1065 HydrophobicContact CZ3-CD1 3.73Å; W1062-I1065 WeakPolarHBondContact O-CB 3.43Å; W1062-I1065 WeakPolarHBondContact O-CG1 3.33Å; W1062-I1065 PolarHBondContact O-N 3.18Å; W1062-I1065 VanDerWaalsContact O-O 3.1Å; G1063-I1065 VanDerWaalsContact C-N 3.34Å; G1063-I1065 PolarHBondContact O-N 2.93Å; G1063-I1065 VanDerWaalsContact O-N 3.1Å; I1065-P1067 WeakPolarHBondContact O-CD 3.41Å; I1065-L1070 HydrophobicContact CG2-CB 4.27Å; I1065-L1070 HydrophobicContact CG2-CD1 4.43Å; I1065-L1070 HydrophobicContact CG2-CD2 4.31Å; I1065-W1101 HydrophobicContact CD1-CZ3 4.05Å; I1065-L1111 HydrophobicContact CB-CD1 3.89Å; I1065-L1111 HydrophobicContact CB-CD2 4.17Å; I1065-L1111 HydrophobicContact CB-CG 4.36Å; I1065-L1111 HydrophobicContact CD1-CD1 4.03Å; I1065-L1111 HydrophobicContact CD1-CD2 3.47Å; I1065-L1111 HydrophobicContact CG1-CD1 4.22Å; I1065-L1111 HydrophobicContact CG1-CD2 3.92Å; I1065-L1111 HydrophobicContact CG2-CB 3.88Å; I1065-L1111 HydrophobicContact CG2-CD1 3.8Å; I1065-L1111 HydrophobicContact CG2-CD2 3.69Å; I1065-L1111 HydrophobicContact CG2-CG 3.97Å; I1065-L1111 WeakPolarHBondContact O-CD1 3.19Å; I1065-L1114 HydrophobicContact CD1-CB 3.63Å; I1065-L1114 WeakPolarHBondContact CD1-O 3.29Å; I1065-T1115 HydrophobicContact CD1-CG2 4.14Å; I1065-T1115 VanDerWaalsContact CD1-OG1 3.28Å; I1065-T1115 WeakPolarHBondContact CD1-OG1 3.35Å; I1065-T1115 HydrophobicContact CG1-CG2 3.73Å; I1065-T1115 PolarHBondContact N-OG1 3.36Å; I1065-H1118 HydrophobicContact CD1-CB 3.68Å; I1065-H1118 HydrophobicContact CG1-CB 3.89Å
1066	D	55.6	Low	57.1	Low	57 Å²	57	65.7 Å²	65.7	31%	0.305	34%	0.336	S	S	.	.			trans	-69.4	121.2	169.8	-165.6	-29.3	0	0	0	110	S1001 G1063 Y1064 I1068 E1069 L1070	S1001-D1066 WeakPolarHBondContact CB-OD2 3.41Å; G1063-D1066 WeakPolarHBondContact O-CA 3.47Å; G1063-D1066 WeakPolarHBondContact O-CB 3.39Å; G1063-D1066 PolarHBondContact O-N 3.09Å; Y1064-D1066 PolarHBondContact O-N 2.97Å; D1066-I1068 PolarHBondContact O-N 3.26Å; D1066-I1068 VanDerWaalsContact O-N 3.11Å; D1066-I1068 WeakPolarHBondContact OD1-CA 3.41Å; D1066-I1068 VanDerWaalsContact OD1-CB 3.24Å; D1066-I1068 WeakPolarHBondContact OD1-CB 3.44Å; D1066-I1068 WeakPolarHBondContact OD1-CG1 3.4Å; D1066-I1068 PolarHBondContact OD1-N 3.3Å; D1066-I1068 VanDerWaalsContact OD1-N 3.11Å; D1066-E1069 HydrophobicContact CB-CB 4.16Å; D1066-E1069 HydrophobicContact CB-CG 4.14Å; D1066-E1069 PolarHBondContact O-N 2.98Å; D1066-L1070 WeakPolarHBondContact O-CB 3.35Å; D1066-L1070 PolarHBondContact O-N 3.16Å; D1066-L1070 VanDerWaalsContact O-N 3.09Å
1067	P	52.9	Low	56.8	Low	38.4 Å²	38.4	60.9 Å²	60.9	25%	0.249	32%	0.315	C	S	.	.	H	α-helix	trans	-56	-27.9	175.2	-25.3	35.7	0	0	0	113.5	I1065 S1071 W1101	I1065-P1067 WeakPolarHBondContact O-CD 3.41Å; P1067-S1071 VanDerWaalsContact O-CB 3.29Å; P1067-S1071 WeakPolarHBondContact O-CB 3.19Å; P1067-S1071 PolarHBondContact O-N 3.18Å; P1067-S1071 PolarHBondContact O-OG 2.98Å; P1067-W1101 HydrophobicContact CB-CB 3.83Å; P1067-W1101 HydrophobicContact CB-CD2 4.25Å; P1067-W1101 HydrophobicContact CB-CE3 4.24Å; P1067-W1101 HydrophobicContact CB-CG 4.07Å; P1067-W1101 HydrophobicContact CG-CB 3.98Å; P1067-W1101 HydrophobicContact CG-CD2 3.71Å; P1067-W1101 HydrophobicContact CG-CE3 3.58Å; P1067-W1101 HydrophobicContact CG-CG 3.84Å; P1067-W1101 HydrophobicContact CG-CZ3 4.09Å
1068	I	54.3	Low	56.7	Low	74 Å²	74	62.4 Å²	62.4	38%	0.379	31%	0.314	S	S	.	.	H	α-helix	trans	-70.1	-46.2	177.5	-59.3	174.2	0	0	0	110.2	D1066 L1070 S1071 N1072 E1099	D1066-I1068 PolarHBondContact O-N 3.26Å; D1066-I1068 VanDerWaalsContact O-N 3.11Å; D1066-I1068 WeakPolarHBondContact OD1-CA 3.41Å; D1066-I1068 VanDerWaalsContact OD1-CB 3.24Å; D1066-I1068 WeakPolarHBondContact OD1-CB 3.44Å; D1066-I1068 WeakPolarHBondContact OD1-CG1 3.4Å; D1066-I1068 PolarHBondContact OD1-N 3.3Å; D1066-I1068 VanDerWaalsContact OD1-N 3.11Å; I1068-L1070 VanDerWaalsContact C-N 3.32Å; I1068-L1070 PolarHBondContact O-N 2.87Å; I1068-S1071 VanDerWaalsContact O-CB 3.27Å; I1068-S1071 WeakPolarHBondContact O-CB 3.37Å; I1068-S1071 PolarHBondContact O-N 3.18Å; I1068-S1071 PolarHBondContact O-OG 3.02Å; I1068-N1072 WeakPolarHBondContact O-CB 3.5Å; I1068-N1072 VanDerWaalsContact O-CG 3.3Å; I1068-N1072 PolarHBondContact O-N 3.07Å; I1068-N1072 PolarHBondContact O-ND2 3.03Å; I1068-E1099 HydrophobicContact CG1-CG 4.23Å
1069	E	56.8	Low	56.6	Low	86 Å²	86	64.6 Å²	64.6	40%	0.402	32%	0.324	S	S	.	.	H	α-helix	trans	-65	-41.8	176.7	-83.2	-169.1	169.1	0	0	111.8	T1003 G1063 Y1064 D1066 S1071 N1072 T1073 P1102	T1003-E1069 WeakPolarHBondContact CB-OE1 3.37Å; T1003-E1069 PolarHBondContact OG1-OE1 3.19Å; G1063-E1069 VanDerWaalsContact CA-CD 3.48Å; G1063-E1069 WeakPolarHBondContact CA-OE2 3.29Å; G1063-E1069 WeakPolarHBondContact O-CB 3.48Å; Y1064-E1069 WeakPolarHBondContact CA-OE2 3.22Å; D1066-E1069 HydrophobicContact CB-CB 4.16Å; D1066-E1069 HydrophobicContact CB-CG 4.14Å; D1066-E1069 PolarHBondContact O-N 2.98Å; E1069-S1071 VanDerWaalsContact C-N 3.3Å; E1069-S1071 PolarHBondContact O-N 3Å; E1069-N1072 WeakPolarHBondContact O-CB 3.41Å; E1069-N1072 PolarHBondContact O-N 3.25Å; E1069-N1072 VanDerWaalsContact O-N 3.08Å; E1069-T1073 WeakPolarHBondContact O-CB 3.28Å; E1069-T1073 VanDerWaalsContact O-CG2 3.25Å; E1069-T1073 WeakPolarHBondContact O-CG2 3.21Å; E1069-T1073 PolarHBondContact O-N 3.04Å; E1069-T1073 PolarHBondContact O-OG1 3.07Å; E1069-P1102 HydrophobicContact CB-CB 4.48Å; E1069-P1102 HydrophobicContact CB-CG 4.49Å
1070	L	55.2	Low	56.3	Low	26.2 Å²	26.2	65 Å²	65	14%	0.137	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-40.2	174.3	-173.1	63.6	0	0	0	111.1	F869 V892 T894 Y1064 I1065 D1066 I1068 N1072 T1073 Y1074 W1101 P1102 L1108 L1111 L1114	F869-L1070 HydrophobicContact CD2-CD2 4.14Å; F869-L1070 HydrophobicContact CE1-CB 4.48Å; F869-L1070 HydrophobicContact CE1-CD2 4.07Å; F869-L1070 HydrophobicContact CE1-CG 3.87Å; F869-L1070 HydrophobicContact CE2-CD2 3.42Å; F869-L1070 VanDerWaalsContact CE2-CD2 3.42Å; F869-L1070 HydrophobicContact CE2-CG 4.2Å; F869-L1070 HydrophobicContact CZ-CB 4.24Å; F869-L1070 HydrophobicContact CZ-CD2 3.37Å; F869-L1070 HydrophobicContact CZ-CG 3.71Å; V892-L1070 WeakPolarHBondContact O-CD1 3.5Å; T894-L1070 HydrophobicContact CG2-CD1 4.38Å; T894-L1070 HydrophobicContact CG2-CD2 3.86Å; Y1064-L1070 HydrophobicContact CD1-CD1 3.89Å; Y1064-L1070 HydrophobicContact CE1-CD1 3.75Å; I1065-L1070 HydrophobicContact CG2-CB 4.27Å; I1065-L1070 HydrophobicContact CG2-CD1 4.43Å; I1065-L1070 HydrophobicContact CG2-CD2 4.31Å; D1066-L1070 WeakPolarHBondContact O-CB 3.35Å; D1066-L1070 PolarHBondContact O-N 3.16Å; D1066-L1070 VanDerWaalsContact O-N 3.09Å; I1068-L1070 VanDerWaalsContact C-N 3.32Å; I1068-L1070 PolarHBondContact O-N 2.87Å; L1070-N1072 VanDerWaalsContact C-N 3.34Å; L1070-N1072 PolarHBondContact O-N 3.33Å; L1070-T1073 WeakPolarHBondContact CA-OG1 3.43Å; L1070-T1073 CarbonylContact O-C 3.51Å; L1070-T1073 WeakPolarHBondContact O-CA 3.48Å; L1070-T1073 VanDerWaalsContact O-CB 3.25Å; L1070-T1073 WeakPolarHBondContact O-CB 3.26Å; L1070-T1073 PolarHBondContact O-N 3.23Å; L1070-T1073 VanDerWaalsContact O-N 3.17Å; L1070-T1073 PolarHBondContact O-OG1 3.36Å; L1070-Y1074 HydrophobicContact CD1-CD2 4.25Å; L1070-Y1074 HydrophobicContact CD1-CE2 3.91Å; L1070-Y1074 HydrophobicContact CD2-CE2 4.29Å; L1070-Y1074 HydrophobicContact CG-CD2 4.03Å; L1070-Y1074 HydrophobicContact CG-CE2 3.88Å; L1070-Y1074 WeakPolarHBondContact O-CB 3.46Å; L1070-Y1074 VanDerWaalsContact O-CD2 3.29Å; L1070-Y1074 WeakPolarHBondContact O-CD2 3.35Å; L1070-Y1074 PolarHBondContact O-N 3.2Å; L1070-Y1074 VanDerWaalsContact O-N 3.09Å; L1070-W1101 HydrophobicContact CD1-CD2 4.39Å; L1070-W1101 HydrophobicContact CD1-CE3 4.24Å; L1070-W1101 HydrophobicContact CD1-CH2 3.86Å; L1070-W1101 HydrophobicContact CD1-CZ2 4.29Å; L1070-W1101 HydrophobicContact CD2-CZ2 4.32Å; L1070-P1102 HydrophobicContact CB-CG 4.44Å; L1070-P1102 VanDerWaalsContact CD1-CD 3.48Å; L1070-P1102 HydrophobicContact CD1-CG 4.18Å; L1070-L1108 HydrophobicContact CD1-CD1 4.45Å; L1070-L1108 HydrophobicContact CD1-CD2 4.32Å; L1070-L1111 HydrophobicContact CD2-CD1 4.04Å; L1070-L1114 HydrophobicContact CD1-CD1 4.11Å; L1070-L1114 HydrophobicContact CD2-CD1 4.44Å
1071	S	53.5	Low	56.1	Low	31.6 Å²	31.6	63.6 Å²	63.6	22%	0.221	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-42.1	176.1	94.6	0	0	0	0	113.1	P1067 I1068 E1069 T1073 Y1074 K1075 Y1098	P1067-S1071 VanDerWaalsContact O-CB 3.29Å; P1067-S1071 WeakPolarHBondContact O-CB 3.19Å; P1067-S1071 PolarHBondContact O-N 3.18Å; P1067-S1071 PolarHBondContact O-OG 2.98Å; I1068-S1071 VanDerWaalsContact O-CB 3.27Å; I1068-S1071 WeakPolarHBondContact O-CB 3.37Å; I1068-S1071 PolarHBondContact O-N 3.18Å; I1068-S1071 PolarHBondContact O-OG 3.02Å; E1069-S1071 VanDerWaalsContact C-N 3.3Å; E1069-S1071 PolarHBondContact O-N 3Å; S1071-T1073 VanDerWaalsContact C-N 3.33Å; S1071-T1073 PolarHBondContact O-N 2.82Å; S1071-Y1074 CarbonylContact O-C 3.55Å; S1071-Y1074 WeakPolarHBondContact O-CA 3.17Å; S1071-Y1074 VanDerWaalsContact O-CB 3.27Å; S1071-Y1074 WeakPolarHBondContact O-CB 3.44Å; S1071-Y1074 PolarHBondContact O-N 3.18Å; S1071-K1075 VanDerWaalsContact O-CB 3.28Å; S1071-K1075 WeakPolarHBondContact O-CB 3.42Å; S1071-K1075 WeakPolarHBondContact O-CG 3.24Å; S1071-K1075 PolarHBondContact O-N 3.16Å; S1071-Y1098 WeakPolarHBondContact OG-CB 3.11Å; S1071-Y1098 WeakPolarHBondContact OG-CD2 3.09Å
1072	N	55.7	Low	56	Low	79.2 Å²	79.2	65 Å²	65	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-67.8	-37.9	179.4	-71.1	-31.2	0	0	0	111	I1068 E1069 L1070 Y1074 K1075 L1076	I1068-N1072 WeakPolarHBondContact O-CB 3.5Å; I1068-N1072 VanDerWaalsContact O-CG 3.3Å; I1068-N1072 PolarHBondContact O-N 3.07Å; I1068-N1072 PolarHBondContact O-ND2 3.03Å; E1069-N1072 WeakPolarHBondContact O-CB 3.41Å; E1069-N1072 PolarHBondContact O-N 3.25Å; E1069-N1072 VanDerWaalsContact O-N 3.08Å; L1070-N1072 VanDerWaalsContact C-N 3.34Å; L1070-N1072 PolarHBondContact O-N 3.33Å; N1072-Y1074 VanDerWaalsContact C-N 3.34Å; N1072-K1075 WeakPolarHBondContact O-CB 3.48Å; N1072-K1075 PolarHBondContact O-N 3.34Å; N1072-L1076 VanDerWaalsContact O-CB 3.3Å; N1072-L1076 WeakPolarHBondContact O-CB 3.38Å; N1072-L1076 PolarHBondContact O-N 3.03Å
1073	T	55.1	Low	55.8	Low	23.8 Å²	23.8	63 Å²	63	15%	0.146	34%	0.339	C	S	.	.	H	α-helix	trans	-69.4	-38.9	176.1	15.9	0	0	0	0	111.8	L891 V893 Y1064 E1069 L1070 S1071 K1075 L1076 V1077 W1101 P1102	L891-T1073 HydrophobicContact CD1-CG2 3.71Å; L891-T1073 HydrophobicContact CG-CG2 3.97Å; V893-T1073 HydrophobicContact CG2-CG2 3.42Å; V893-T1073 VanDerWaalsContact CG2-CG2 3.42Å; Y1064-T1073 HydrophobicContact CE2-CG2 4.17Å; Y1064-T1073 WeakPolarHBondContact OH-CG2 3.39Å; E1069-T1073 WeakPolarHBondContact O-CB 3.28Å; E1069-T1073 VanDerWaalsContact O-CG2 3.25Å; E1069-T1073 WeakPolarHBondContact O-CG2 3.21Å; E1069-T1073 PolarHBondContact O-N 3.04Å; E1069-T1073 PolarHBondContact O-OG1 3.07Å; L1070-T1073 WeakPolarHBondContact CA-OG1 3.43Å; L1070-T1073 CarbonylContact O-C 3.51Å; L1070-T1073 WeakPolarHBondContact O-CA 3.48Å; L1070-T1073 VanDerWaalsContact O-CB 3.25Å; L1070-T1073 WeakPolarHBondContact O-CB 3.26Å; L1070-T1073 PolarHBondContact O-N 3.23Å; L1070-T1073 VanDerWaalsContact O-N 3.17Å; L1070-T1073 PolarHBondContact O-OG1 3.36Å; S1071-T1073 VanDerWaalsContact C-N 3.33Å; S1071-T1073 PolarHBondContact O-N 2.82Å; T1073-K1075 VanDerWaalsContact C-N 3.27Å; T1073-K1075 PolarHBondContact O-N 3.27Å; T1073-L1076 PolarHBondContact O-N 3.2Å; T1073-V1077 WeakPolarHBondContact O-CB 3.28Å; T1073-V1077 VanDerWaalsContact O-CG2 3.29Å; T1073-V1077 WeakPolarHBondContact O-CG2 3.34Å; T1073-V1077 PolarHBondContact O-N 2.97Å; T1073-W1101 WeakPolarHBondContact OG1-CZ2 3.2Å; T1073-P1102 HydrophobicContact CG2-CB 3.86Å; T1073-P1102 WeakPolarHBondContact OG1-CD 3.45Å
1074	Y	56.7	Low	55.7	Low	64.4 Å²	64.4	65.5 Å²	65.5	25%	0.253	35%	0.346	S	S	.	.	H	α-helix	trans	-61.7	-40.2	171.7	-119.9	-80.5	0	0	0	112.7	F869 P870 L872 V893 T894 D895 L1070 S1071 N1072 L1076 V1077 R1078 F1093 Y1098 C1100	F869-Y1074 HydrophobicContact CB-CE1 4.09Å; F869-Y1074 HydrophobicContact CB-CE2 3.81Å; F869-Y1074 AromaticContact CD1-CD2 3.39Å; F869-Y1074 HydrophobicContact CD1-CD2 3.39Å; F869-Y1074 HydrophobicContact CD1-CE1 4.5Å; F869-Y1074 AromaticContact CD1-CE2 3.47Å; F869-Y1074 HydrophobicContact CD1-CE2 3.79Å; F869-Y1074 HydrophobicContact CD1-CG 4.06Å; F869-Y1074 AromaticContact CD1-CZ 3.83Å; F869-Y1074 VanDerWaalsContact CD1-OH 3.29Å; F869-Y1074 WeakPolarHBondContact CD1-OH 3.12Å; F869-Y1074 HydrophobicContact CD2-CE2 4.49Å; F869-Y1074 AromaticContact CE1-CD2 3.85Å; F869-Y1074 HydrophobicContact CE1-CD2 3.85Å; F869-Y1074 AromaticContact CE1-CE2 3.87Å; F869-Y1074 HydrophobicContact CE1-CE2 3.96Å; F869-Y1074 HydrophobicContact CG-CD2 4.17Å; F869-Y1074 AromaticContact CG-CE2 3.63Å; F869-Y1074 HydrophobicContact CG-CE2 3.63Å; F869-Y1074 AromaticContact CG-CZ 3.95Å; P870-Y1074 HydrophobicContact CG-CD1 4.23Å; P870-Y1074 HydrophobicContact CG-CE1 4.07Å; L872-Y1074 HydrophobicContact CD2-CE1 3.75Å; V893-Y1074 HydrophobicContact CG1-CD1 4.09Å; V893-Y1074 HydrophobicContact CG1-CD2 4.3Å; V893-Y1074 HydrophobicContact CG1-CE1 3.6Å; V893-Y1074 HydrophobicContact CG1-CE2 4.07Å; V893-Y1074 VanDerWaalsContact CG1-CZ 3.45Å; V893-Y1074 WeakPolarHBondContact CG1-OH 3.32Å; T894-Y1074 WeakPolarHBondContact CA-OH 3.27Å; T894-Y1074 PolarHBondContact N-OH 3.38Å; T894-Y1074 PolarHBondContact O-OH 3.26Å; T894-Y1074 PolarHBondContact OG1-OH 3.23Å; T894-Y1074 VanDerWaalsContact OG1-OH 3.12Å; D895-Y1074 PolarHBondContact N-OH 3.07Å; D895-Y1074 VanDerWaalsContact N-OH 3.15Å; L1070-Y1074 HydrophobicContact CD1-CD2 4.25Å; L1070-Y1074 HydrophobicContact CD1-CE2 3.91Å; L1070-Y1074 HydrophobicContact CD2-CE2 4.29Å; L1070-Y1074 HydrophobicContact CG-CD2 4.03Å; L1070-Y1074 HydrophobicContact CG-CE2 3.88Å; L1070-Y1074 WeakPolarHBondContact O-CB 3.46Å; L1070-Y1074 VanDerWaalsContact O-CD2 3.29Å; L1070-Y1074 WeakPolarHBondContact O-CD2 3.35Å; L1070-Y1074 PolarHBondContact O-N 3.2Å; L1070-Y1074 VanDerWaalsContact O-N 3.09Å; S1071-Y1074 CarbonylContact O-C 3.55Å; S1071-Y1074 WeakPolarHBondContact O-CA 3.17Å; S1071-Y1074 VanDerWaalsContact O-CB 3.27Å; S1071-Y1074 WeakPolarHBondContact O-CB 3.44Å; S1071-Y1074 PolarHBondContact O-N 3.18Å; N1072-Y1074 VanDerWaalsContact C-N 3.34Å; Y1074-L1076 VanDerWaalsContact C-N 3.34Å; Y1074-L1076 PolarHBondContact O-N 3.39Å; Y1074-V1077 PolarHBondContact O-N 3.27Å; Y1074-R1078 VanDerWaalsContact O-CB 3.23Å; Y1074-R1078 WeakPolarHBondContact O-CB 3.33Å; Y1074-R1078 PolarHBondContact O-N 3.06Å; Y1074-F1093 HydrophobicContact CD1-CE1 4.05Å; Y1074-Y1098 VanDerWaalsContact CB-OH 3.3Å; Y1074-Y1098 WeakPolarHBondContact CB-OH 3.17Å; Y1074-Y1098 HydrophobicContact CD1-CE1 4.28Å; Y1074-Y1098 AromaticContact CD2-CD1 3.8Å; Y1074-Y1098 HydrophobicContact CD2-CD1 3.8Å; Y1074-Y1098 AromaticContact CD2-CE1 3.29Å; Y1074-Y1098 HydrophobicContact CD2-CE1 3.29Å; Y1074-Y1098 AromaticContact CD2-CZ 3.91Å; Y1074-Y1098 HydrophobicContact CE2-CE1 4.05Å; Y1074-Y1098 HydrophobicContact CG-CD1 4.34Å; Y1074-Y1098 AromaticContact CG-CE1 3.49Å; Y1074-Y1098 HydrophobicContact CG-CE1 3.49Å; Y1074-Y1098 VanDerWaalsContact CG-CE1 3.49Å; Y1074-Y1098 HydrophobicContact CG-CE2 4.5Å; Y1074-Y1098 AromaticContact CG-CZ 3.6Å; Y1074-C1100 HydrophobicContact CD2-CB 4.37Å
1075	K	58.4	Low	55.4	Low	108.6 Å²	108.6	66 Å²	66	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-64.4	-48.5	175.1	-133.3	177.6	-179.1	-179.7	0	111.2	S1071 N1072 T1073 V1077 R1078 D1079	S1071-K1075 VanDerWaalsContact O-CB 3.28Å; S1071-K1075 WeakPolarHBondContact O-CB 3.42Å; S1071-K1075 WeakPolarHBondContact O-CG 3.24Å; S1071-K1075 PolarHBondContact O-N 3.16Å; N1072-K1075 WeakPolarHBondContact O-CB 3.48Å; N1072-K1075 PolarHBondContact O-N 3.34Å; T1073-K1075 VanDerWaalsContact C-N 3.27Å; T1073-K1075 PolarHBondContact O-N 3.27Å; K1075-V1077 VanDerWaalsContact C-N 3.31Å; K1075-V1077 PolarHBondContact O-N 3.04Å; K1075-R1078 CarbonylContact O-C 3.6Å; K1075-R1078 WeakPolarHBondContact O-CA 3.47Å; K1075-R1078 WeakPolarHBondContact O-CB 3.2Å; K1075-R1078 PolarHBondContact O-N 2.91Å; K1075-D1079 WeakPolarHBondContact O-CB 3.35Å; K1075-D1079 VanDerWaalsContact O-CG 3.23Å; K1075-D1079 PolarHBondContact O-N 3.16Å
1076	L	59.5	Low	54.8	Low	84.6 Å²	84.6	73.8 Å²	73.8	44%	0.443	39%	0.389	S	S	.	.	H	α-helix	trans	-57.6	-45.2	176.6	-176.3	69	0	0	0	111.8	P888 N1072 T1073 Y1074 R1078 D1079 M1080	P888-L1076 HydrophobicContact CG-CD2 4.13Å; N1072-L1076 VanDerWaalsContact O-CB 3.3Å; N1072-L1076 WeakPolarHBondContact O-CB 3.38Å; N1072-L1076 PolarHBondContact O-N 3.03Å; T1073-L1076 PolarHBondContact O-N 3.2Å; Y1074-L1076 VanDerWaalsContact C-N 3.34Å; Y1074-L1076 PolarHBondContact O-N 3.39Å; L1076-R1078 VanDerWaalsContact C-N 3.33Å; L1076-R1078 PolarHBondContact O-N 2.99Å; L1076-D1079 PolarHBondContact O-N 3.14Å; L1076-M1080 HydrophobicContact CG-CG 4.5Å; L1076-M1080 HydrophobicContact CG-SD 4.38Å; L1076-M1080 WeakPolarHBondContact O-CB 3.37Å; L1076-M1080 VanDerWaalsContact O-CG 3.25Å; L1076-M1080 WeakPolarHBondContact O-CG 3.3Å; L1076-M1080 PolarHBondContact O-N 3.18Å; L1076-M1080 VanDerWaalsContact O-N 3.07Å
1077	V	56.5	Low	54.1	Low	21.6 Å²	21.6	76.7 Å²	76.7	13%	0.131	40%	0.404	C	S	.	.	H	α-helix	trans	-65.3	-39.5	177.7	171.9	0	0	0	0	111.6	L876 L891 V893 T1073 Y1074 K1075 D1079 M1080 M1081 E1099 C1100	L876-V1077 HydrophobicContact CD1-CG1 4.07Å; L876-V1077 HydrophobicContact CD2-CG1 4.06Å; L891-V1077 HydrophobicContact CD1-CG2 3.89Å; L891-V1077 HydrophobicContact CD2-CG2 4.3Å; L891-V1077 HydrophobicContact CG-CG2 4.44Å; V893-V1077 HydrophobicContact CG1-CG1 4.45Å; V893-V1077 HydrophobicContact CG1-CG2 4.18Å; V893-V1077 HydrophobicContact CG2-CG1 4.49Å; V893-V1077 HydrophobicContact CG2-CG2 3.82Å; T1073-V1077 WeakPolarHBondContact O-CB 3.28Å; T1073-V1077 VanDerWaalsContact O-CG2 3.29Å; T1073-V1077 WeakPolarHBondContact O-CG2 3.34Å; T1073-V1077 PolarHBondContact O-N 2.97Å; Y1074-V1077 PolarHBondContact O-N 3.27Å; K1075-V1077 VanDerWaalsContact C-N 3.31Å; K1075-V1077 PolarHBondContact O-N 3.04Å; V1077-D1079 VanDerWaalsContact C-N 3.31Å; V1077-M1080 WeakPolarHBondContact O-CB 3.42Å; V1077-M1080 PolarHBondContact O-N 3.27Å; V1077-M1081 HydrophobicContact CG1-CE 3.72Å; V1077-M1081 HydrophobicContact CG1-CG 4.42Å; V1077-M1081 HydrophobicContact CG1-SD 4.21Å; V1077-M1081 VanDerWaalsContact O-CB 3.3Å; V1077-M1081 WeakPolarHBondContact O-CB 3.31Å; V1077-M1081 VanDerWaalsContact O-CG 3.28Å; V1077-M1081 WeakPolarHBondContact O-CG 3.27Å; V1077-M1081 PolarHBondContact O-N 3.03Å; V1077-M1081 VanDerWaalsContact O-N 3.16Å; V1077-E1099 WeakPolarHBondContact CG2-O 3.36Å; V1077-C1100 HydrophobicContact CB-CB 3.95Å; V1077-C1100 HydrophobicContact CG1-CB 3.69Å; V1077-C1100 HydrophobicContact CG2-CB 4.32Å
1078	R	57.7	Low	53.4	Low	122.8 Å²	122.8	79.7 Å²	79.7	46%	0.463	42%	0.423	S	S	.	.	H	α-helix	trans	-62	-45.8	174.1	-176.3	-170.9	110.2	166.7	2	111.2	Y1074 K1075 L1076 M1080 M1081 A1082 F1093	Y1074-R1078 VanDerWaalsContact O-CB 3.23Å; Y1074-R1078 WeakPolarHBondContact O-CB 3.33Å; Y1074-R1078 PolarHBondContact O-N 3.06Å; K1075-R1078 CarbonylContact O-C 3.6Å; K1075-R1078 WeakPolarHBondContact O-CA 3.47Å; K1075-R1078 WeakPolarHBondContact O-CB 3.2Å; K1075-R1078 PolarHBondContact O-N 2.91Å; L1076-R1078 VanDerWaalsContact C-N 3.33Å; L1076-R1078 PolarHBondContact O-N 2.99Å; R1078-M1080 VanDerWaalsContact C-N 3.3Å; R1078-M1080 PolarHBondContact O-N 3.15Å; R1078-M1081 PolarHBondContact O-N 3.21Å; R1078-A1082 WeakPolarHBondContact O-CB 3.34Å; R1078-A1082 PolarHBondContact O-N 3.1Å; R1078-F1093 HydrophobicContact CB-CD1 4.29Å; R1078-F1093 HydrophobicContact CB-CE1 4.33Å; R1078-F1093 HydrophobicContact CG-CB 4.32Å; R1078-F1093 HydrophobicContact CG-CD1 4.26Å; R1078-F1093 HydrophobicContact CG-CG 4.5Å
1079	D	58.9	Low	52.7	Low	78.8 Å²	78.8	85 Å²	85	42%	0.421	45%	0.446	S	S	.	.	H	α-helix	trans	-68.4	-35.6	-178.7	-62.5	-13.5	0	0	0	111.1	K1075 L1076 V1077 A1082 S1083	K1075-D1079 WeakPolarHBondContact O-CB 3.35Å; K1075-D1079 VanDerWaalsContact O-CG 3.23Å; K1075-D1079 PolarHBondContact O-N 3.16Å; L1076-D1079 PolarHBondContact O-N 3.14Å; V1077-D1079 VanDerWaalsContact C-N 3.31Å; D1079-A1082 PolarHBondContact O-N 3.05Å; D1079-S1083 WeakPolarHBondContact O-CB 3.13Å; D1079-S1083 PolarHBondContact O-N 3.19Å; D1079-S1083 VanDerWaalsContact O-N 3.08Å; D1079-S1083 PolarHBondContact O-OG 3.05Å
1080	M	55.3	Low	51.8	Low	73.8 Å²	73.8	86.9 Å²	86.9	36%	0.364	45%	0.453	S	S	.	.	H	α-helix	trans	-64.4	-40.2	169.4	-75.1	-173.5	76.2	0	0	112.6	L880 Q883 L887 L1076 V1077 R1078 A1082 S1083 V1084	L880-M1080 HydrophobicContact CD2-CE 4.45Å; Q883-M1080 HydrophobicContact CB-CE 4.28Å; L887-M1080 HydrophobicContact CD1-CE 3.41Å; L887-M1080 HydrophobicContact CD1-SD 3.73Å; L887-M1080 WeakPolarHBondContact CD1-SD 3.05Å; L887-M1080 HydrophobicContact CG-CE 4.46Å; L1076-M1080 HydrophobicContact CG-CG 4.5Å; L1076-M1080 HydrophobicContact CG-SD 4.38Å; L1076-M1080 WeakPolarHBondContact O-CB 3.37Å; L1076-M1080 VanDerWaalsContact O-CG 3.25Å; L1076-M1080 WeakPolarHBondContact O-CG 3.3Å; L1076-M1080 PolarHBondContact O-N 3.18Å; L1076-M1080 VanDerWaalsContact O-N 3.07Å; V1077-M1080 WeakPolarHBondContact O-CB 3.42Å; V1077-M1080 PolarHBondContact O-N 3.27Å; R1078-M1080 VanDerWaalsContact C-N 3.3Å; R1078-M1080 PolarHBondContact O-N 3.15Å; M1080-A1082 VanDerWaalsContact C-N 3.25Å; M1080-A1082 PolarHBondContact O-N 3.28Å; M1080-S1083 WeakPolarHBondContact CA-OG 3.46Å; M1080-S1083 PolarHBondContact O-N 3.07Å; M1080-S1083 PolarHBondContact O-OG 3.27Å; M1080-V1084 WeakPolarHBondContact O-CG2 3.31Å; M1080-V1084 PolarHBondContact O-N 3.43Å
1081	M	54.1	Low	51.1	Low	51.8 Å²	51.8	90 Å²	90	26%	0.255	48%	0.478	S	S	.	.	H	α-helix	trans	-72.6	-34.2	178.2	-73.8	-175.6	-174.1	0	0	112.8	L872 P873 L876 V1077 R1078 S1083 V1084 I1085 L1087 F1090 R1097	L872-M1081 HydrophobicContact CD2-CE 3.98Å; P873-M1081 HydrophobicContact CB-CE 4.12Å; P873-M1081 VanDerWaalsContact CD-CE 3.43Å; P873-M1081 HydrophobicContact CG-CE 3.75Å; P873-M1081 VanDerWaalsContact CG-CE 3.41Å; P873-M1081 HydrophobicContact CG-SD 3.81Å; L876-M1081 HydrophobicContact CB-CE 3.92Å; L876-M1081 HydrophobicContact CD1-CE 3.43Å; L876-M1081 VanDerWaalsContact CD1-CE 3.44Å; L876-M1081 HydrophobicContact CD1-CG 4.29Å; L876-M1081 HydrophobicContact CD1-SD 4.33Å; L876-M1081 HydrophobicContact CD2-CE 3.59Å; L876-M1081 HydrophobicContact CG-CE 3.8Å; V1077-M1081 HydrophobicContact CG1-CE 3.72Å; V1077-M1081 HydrophobicContact CG1-CG 4.42Å; V1077-M1081 HydrophobicContact CG1-SD 4.21Å; V1077-M1081 VanDerWaalsContact O-CB 3.3Å; V1077-M1081 WeakPolarHBondContact O-CB 3.31Å; V1077-M1081 VanDerWaalsContact O-CG 3.28Å; V1077-M1081 WeakPolarHBondContact O-CG 3.27Å; V1077-M1081 PolarHBondContact O-N 3.03Å; V1077-M1081 VanDerWaalsContact O-N 3.16Å; R1078-M1081 PolarHBondContact O-N 3.21Å; M1081-S1083 PolarHBondContact O-N 3.29Å; M1081-S1083 VanDerWaalsContact O-N 3.16Å; M1081-V1084 WeakPolarHBondContact O-CG2 3.46Å; M1081-V1084 PolarHBondContact O-N 2.9Å; M1081-I1085 PolarHBondContact O-N 3.18Å; M1081-L1087 HydrophobicContact CB-CD1 3.61Å; M1081-L1087 HydrophobicContact SD-CD1 4.29Å; M1081-F1090 HydrophobicContact SD-CE1 4.34Å; M1081-F1090 HydrophobicContact SD-CZ 4.03Å; M1081-R1097 WeakPolarHBondContact CE-O 3.19Å
1082	A	56.7	Low	50.6	Low	69.6 Å²	69.6	94.3 Å²	94.3	58%	0.575	50%	0.498	S	S	*	.	H	α-helix	trans	-64.7	-29.8	176.6	0	0	0	0	0	112.4	R1078 D1079 M1080 V1084	R1078-A1082 WeakPolarHBondContact O-CB 3.34Å; R1078-A1082 PolarHBondContact O-N 3.1Å; D1079-A1082 PolarHBondContact O-N 3.05Å; M1080-A1082 VanDerWaalsContact C-N 3.25Å; M1080-A1082 PolarHBondContact O-N 3.28Å; A1082-V1084 VanDerWaalsContact C-N 3.34Å; A1082-V1084 PolarHBondContact O-N 3.39Å
1083	S	53.1	Low	49.8	Very low	96.2 Å²	96.2	94.6 Å²	94.6	67%	0.673	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.6	178.4	64.4	0	0	0	0	114.8	D1079 M1080 M1081	D1079-S1083 WeakPolarHBondContact O-CB 3.13Å; D1079-S1083 PolarHBondContact O-N 3.19Å; D1079-S1083 VanDerWaalsContact O-N 3.08Å; D1079-S1083 PolarHBondContact O-OG 3.05Å; M1080-S1083 WeakPolarHBondContact CA-OG 3.46Å; M1080-S1083 PolarHBondContact O-N 3.07Å; M1080-S1083 PolarHBondContact O-OG 3.27Å; M1081-S1083 PolarHBondContact O-N 3.29Å; M1081-S1083 VanDerWaalsContact O-N 3.16Å
1084	V	53	Low	49	Very low	90.4 Å²	90.4	96.5 Å²	96.5	55%	0.548	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-18.4	-174	179.4	0	0	0	0	112.8	L879 M1080 M1081 A1082 F1093	L879-V1084 HydrophobicContact CD1-CG1 4.13Å; L879-V1084 HydrophobicContact CD2-CB 4.34Å; L879-V1084 HydrophobicContact CD2-CG1 3.78Å; L879-V1084 HydrophobicContact CD2-CG2 4.43Å; M1080-V1084 WeakPolarHBondContact O-CG2 3.31Å; M1080-V1084 PolarHBondContact O-N 3.43Å; M1081-V1084 WeakPolarHBondContact O-CG2 3.46Å; M1081-V1084 PolarHBondContact O-N 2.9Å; A1082-V1084 VanDerWaalsContact C-N 3.34Å; A1082-V1084 PolarHBondContact O-N 3.39Å; V1084-F1093 HydrophobicContact CG1-CZ 4.24Å
1085	I	48.9	Very low	48.2	Very low	88.6 Å²	88.6	99.4 Å²	99.4	45%	0.454	53%	0.534	S	S	.	.			trans	-120.9	106.7	-173.4	-54.6	179.1	0	0	0	110	L879 M1081 L1087	L879-I1085 HydrophobicContact CD1-CD1 4.2Å; L879-I1085 HydrophobicContact CD1-CG1 4.47Å; M1081-I1085 PolarHBondContact O-N 3.18Å; I1085-L1087 HydrophobicContact CB-CG 4.35Å; I1085-L1087 HydrophobicContact CG2-CB 3.71Å; I1085-L1087 VanDerWaalsContact CG2-CB 3.45Å; I1085-L1087 HydrophobicContact CG2-CD1 3.31Å; I1085-L1087 HydrophobicContact CG2-CG 4.08Å; I1085-L1087 PolarHBondContact O-N 3.11Å
1086	E	43.1	Very low	47.3	Very low	183.4 Å²	183.4	97.4 Å²	97.4	86%	0.857	53%	0.531	S	S	*	.			trans	-73.3	81.6	166.6	-72.5	-171.1	174.3	0	0	111.2
1087	L	40.7	Very low	46.4	Very low	117.8 Å²	117.8	99.2 Å²	99.2	62%	0.617	53%	0.532	S	S	*	.			trans	-132.1	140.7	160.9	-93.4	147.2	0	0	0	110.9	M1081 I1085 Q1089	M1081-L1087 HydrophobicContact CB-CD1 3.61Å; M1081-L1087 HydrophobicContact SD-CD1 4.29Å; I1085-L1087 HydrophobicContact CB-CG 4.35Å; I1085-L1087 HydrophobicContact CG2-CB 3.71Å; I1085-L1087 VanDerWaalsContact CG2-CB 3.45Å; I1085-L1087 HydrophobicContact CG2-CD1 3.31Å; I1085-L1087 HydrophobicContact CG2-CG 4.08Å; I1085-L1087 PolarHBondContact O-N 3.11Å; L1087-Q1089 VanDerWaalsContact C-N 3.25Å; L1087-Q1089 HydrophobicContact CD2-CG 4.34Å; L1087-Q1089 PolarHBondContact O-N 3.17Å
1088	P	37.5	Very low	45.9	Very low	101 Å²	101	102.6 Å²	102.6	66%	0.656	54%	0.543	S	S	*	.			trans	-76.6	132.8	-175.1	10.8	-3.5	0	0	0	112.9	F1090	P1088-F1090 HydrophobicContact CB-CE2 4.38Å; P1088-F1090 HydrophobicContact CG-CE2 4.42Å; P1088-F1090 VanDerWaalsContact O-CD2 3.24Å; P1088-F1090 WeakPolarHBondContact O-CD2 3.39Å; P1088-F1090 PolarHBondContact O-N 3.15Å
1089	Q	39.4	Very low	45.1	Very low	184 Å²	184	101.7 Å²	101.7	86%	0.86	54%	0.544	S	S	*	.			trans	2.6	58.6	164.5	-63.2	-178.3	6.4	0	0	114.8	L1087 S1091	L1087-Q1089 VanDerWaalsContact C-N 3.25Å; L1087-Q1089 HydrophobicContact CD2-CG 4.34Å; L1087-Q1089 PolarHBondContact O-N 3.17Å; Q1089-S1091 PolarHBondContact O-N 3.29Å
1090	F	39.2	Very low	44.5	Very low	126 Å²	126	99.8 Å²	99.8	55%	0.553	54%	0.537	S	S	*	.			trans	-92.2	82.7	163.3	-78.8	-83.6	0	0	0	110.3	P873 M1081 P1088 D1092 F1093	P873-F1090 HydrophobicContact CG-CZ 4.2Å; M1081-F1090 HydrophobicContact SD-CE1 4.34Å; M1081-F1090 HydrophobicContact SD-CZ 4.03Å; P1088-F1090 HydrophobicContact CB-CE2 4.38Å; P1088-F1090 HydrophobicContact CG-CE2 4.42Å; P1088-F1090 VanDerWaalsContact O-CD2 3.24Å; P1088-F1090 WeakPolarHBondContact O-CD2 3.39Å; P1088-F1090 PolarHBondContact O-N 3.15Å; F1090-D1092 VanDerWaalsContact C-N 3.34Å; F1090-D1092 PolarHBondContact O-N 3.2Å; F1090-D1092 VanDerWaalsContact O-N 3.09Å; F1090-F1093 HydrophobicContact CB-CD2 4.2Å; F1090-F1093 HydrophobicContact CB-CE2 4.29Å; F1090-F1093 AromaticContact CD1-CD2 3.25Å; F1090-F1093 HydrophobicContact CD1-CD2 3.66Å; F1090-F1093 AromaticContact CD1-CE2 3.27Å; F1090-F1093 HydrophobicContact CD1-CE2 3.75Å; F1090-F1093 AromaticContact CD1-CG 3.94Å; F1090-F1093 HydrophobicContact CD1-CG 3.94Å; F1090-F1093 AromaticContact CD1-CZ 3.98Å; F1090-F1093 HydrophobicContact CD1-CZ 3.98Å; F1090-F1093 AromaticContact CE1-CD2 3.81Å; F1090-F1093 HydrophobicContact CE1-CD2 3.81Å; F1090-F1093 HydrophobicContact CE1-CE1 4.47Å; F1090-F1093 AromaticContact CE1-CE2 3.28Å; F1090-F1093 HydrophobicContact CE1-CE2 3.28Å; F1090-F1093 AromaticContact CE1-CZ 3.66Å; F1090-F1093 HydrophobicContact CE1-CZ 3.66Å; F1090-F1093 HydrophobicContact CG-CD2 4.39Å; F1090-F1093 HydrophobicContact CG-CE2 4.47Å; F1090-F1093 PolarHBondContact O-N 3.26Å; F1090-F1093 VanDerWaalsContact O-N 3.17Å
1091	S	40.9	Very low	44.1	Very low	92.6 Å²	92.6	99.1 Å²	99.1	65%	0.648	53%	0.53	S	S	*	.			trans	-65.3	-9.3	178.2	49.1	0	0	0	0	112.6	Q1089 F1093 G1094 F1095	Q1089-S1091 PolarHBondContact O-N 3.29Å; S1091-F1093 VanDerWaalsContact C-N 3.3Å; S1091-F1093 PolarHBondContact O-N 3.16Å; S1091-G1094 PolarHBondContact O-N 3Å; S1091-F1095 VanDerWaalsContact O-CD2 3.26Å; S1091-F1095 WeakPolarHBondContact O-CD2 3.46Å
1092	D	41.1	Very low	43.9	Very low	121.2 Å²	121.2	98.9 Å²	98.9	65%	0.648	53%	0.533	S	S	*	.			trans	-90.6	-4.2	-170.6	-67.3	-14.7	0	0	0	113.1	F1090 G1094 F1095	F1090-D1092 VanDerWaalsContact C-N 3.34Å; F1090-D1092 PolarHBondContact O-N 3.2Å; F1090-D1092 VanDerWaalsContact O-N 3.09Å; D1092-G1094 VanDerWaalsContact C-N 3.27Å; D1092-G1094 PolarHBondContact O-N 3.2Å; D1092-F1095 PolarHBondContact O-N 2.92Å
1093	F	39.1	Very low	43.8	Very low	86.4 Å²	86.4	96.6 Å²	96.6	38%	0.379	51%	0.514	S	S	.	.			trans	-70.3	10.9	176.2	-92	-86.3	0	0	0	113	P870 Y1074 R1078 V1084 F1090 S1091 F1095 T1096 Y1098	P870-F1093 HydrophobicContact CB-CD1 3.48Å; P870-F1093 VanDerWaalsContact CB-CD1 3.48Å; P870-F1093 HydrophobicContact CB-CD2 3.78Å; P870-F1093 HydrophobicContact CB-CE1 3.89Å; P870-F1093 HydrophobicContact CB-CE2 3.62Å; P870-F1093 VanDerWaalsContact CB-CE2 3.48Å; P870-F1093 HydrophobicContact CB-CG 4.08Å; P870-F1093 HydrophobicContact CB-CZ 3.44Å; P870-F1093 VanDerWaalsContact CD-CZ 3.48Å; P870-F1093 HydrophobicContact CG-CD1 3.5Å; P870-F1093 HydrophobicContact CG-CD2 4.1Å; P870-F1093 HydrophobicContact CG-CE1 3.28Å; P870-F1093 VanDerWaalsContact CG-CE1 3.48Å; P870-F1093 HydrophobicContact CG-CE2 3.95Å; P870-F1093 VanDerWaalsContact CG-CE2 3.45Å; P870-F1093 HydrophobicContact CG-CG 3.98Å; P870-F1093 HydrophobicContact CG-CZ 3.33Å; P870-F1093 VanDerWaalsContact CG-CZ 3.49Å; Y1074-F1093 HydrophobicContact CD1-CE1 4.05Å; R1078-F1093 HydrophobicContact CB-CD1 4.29Å; R1078-F1093 HydrophobicContact CB-CE1 4.33Å; R1078-F1093 HydrophobicContact CG-CB 4.32Å; R1078-F1093 HydrophobicContact CG-CD1 4.26Å; R1078-F1093 HydrophobicContact CG-CG 4.5Å; V1084-F1093 HydrophobicContact CG1-CZ 4.24Å; F1090-F1093 HydrophobicContact CB-CD2 4.2Å; F1090-F1093 HydrophobicContact CB-CE2 4.29Å; F1090-F1093 AromaticContact CD1-CD2 3.25Å; F1090-F1093 HydrophobicContact CD1-CD2 3.66Å; F1090-F1093 AromaticContact CD1-CE2 3.27Å; F1090-F1093 HydrophobicContact CD1-CE2 3.75Å; F1090-F1093 AromaticContact CD1-CG 3.94Å; F1090-F1093 HydrophobicContact CD1-CG 3.94Å; F1090-F1093 AromaticContact CD1-CZ 3.98Å; F1090-F1093 HydrophobicContact CD1-CZ 3.98Å; F1090-F1093 AromaticContact CE1-CD2 3.81Å; F1090-F1093 HydrophobicContact CE1-CD2 3.81Å; F1090-F1093 HydrophobicContact CE1-CE1 4.47Å; F1090-F1093 AromaticContact CE1-CE2 3.28Å; F1090-F1093 HydrophobicContact CE1-CE2 3.28Å; F1090-F1093 AromaticContact CE1-CZ 3.66Å; F1090-F1093 HydrophobicContact CE1-CZ 3.66Å; F1090-F1093 HydrophobicContact CG-CD2 4.39Å; F1090-F1093 HydrophobicContact CG-CE2 4.47Å; F1090-F1093 PolarHBondContact O-N 3.26Å; F1090-F1093 VanDerWaalsContact O-N 3.17Å; S1091-F1093 VanDerWaalsContact C-N 3.3Å; S1091-F1093 PolarHBondContact O-N 3.16Å; F1093-F1095 VanDerWaalsContact C-N 3.33Å; F1093-F1095 PolarHBondContact O-N 3.19Å; F1093-F1095 VanDerWaalsContact O-N 3.13Å; F1093-T1096 HydrophobicContact CD1-CG2 3.85Å; F1093-T1096 HydrophobicContact CE1-CG2 3.81Å; F1093-T1096 PolarHBondContact O-N 3.32Å; F1093-T1096 PolarHBondContact O-OG1 3.13Å; F1093-Y1098 WeakPolarHBondContact CE1-OH 3.33Å
1094	G	38.6	Very low	44.2	Very low	63 Å²	63	93.3 Å²	93.3	65%	0.649	49%	0.49	S	S	*	.			trans	-84.5	-9	178.9	0	0	0	0	0	114.3	S1091 D1092	S1091-G1094 PolarHBondContact O-N 3Å; D1092-G1094 VanDerWaalsContact C-N 3.27Å; D1092-G1094 PolarHBondContact O-N 3.2Å
1095	F	39.7	Very low	44.8	Very low	125 Å²	125	91.9 Å²	91.9	55%	0.548	48%	0.483	S	S	.	.			trans	-108.4	11	179.6	-100.9	-81.7	0	0	0	115.5	S792 P795 N796 S1091 D1092 F1093 R1097 K1498	S792-F1095 VanDerWaalsContact O-CE1 3.3Å; S792-F1095 WeakPolarHBondContact O-CE1 3.47Å; P795-F1095 VanDerWaalsContact CD-CE1 3.43Å; P795-F1095 HydrophobicContact CG-CE1 3.78Å; P795-F1095 HydrophobicContact CG-CZ 3.93Å; N796-F1095 HydrophobicContact CB-CE1 4.17Å; N796-F1095 HydrophobicContact CB-CZ 4.35Å; N796-F1095 VanDerWaalsContact CG-CZ 3.49Å; N796-F1095 WeakPolarHBondContact ND2-CZ 3.39Å; N796-F1095 WeakPolarHBondContact OD1-CZ 3.19Å; S1091-F1095 VanDerWaalsContact O-CD2 3.26Å; S1091-F1095 WeakPolarHBondContact O-CD2 3.46Å; D1092-F1095 PolarHBondContact O-N 2.92Å; F1093-F1095 VanDerWaalsContact C-N 3.33Å; F1093-F1095 PolarHBondContact O-N 3.19Å; F1093-F1095 VanDerWaalsContact O-N 3.13Å; F1095-R1097 HydrophobicContact CD1-CG 3.59Å; F1095-R1097 HydrophobicContact CE1-CG 4.12Å; F1095-R1097 WeakPolarHBondContact O-CG 3.46Å; F1095-R1097 PolarHBondContact O-N 3.09Å; F1095-R1097 VanDerWaalsContact O-N 3.09Å; F1095-K1498 VanDerWaalsContact CZ-NZ 3.32Å
1096	T	40.8	Very low	45.6	Very low	67.8 Å²	67.8	93 Å²	93	42%	0.416	49%	0.486	S	S	.	.			trans	-77.8	104.3	174.5	43.6	0	0	0	0	110.9	F1093 Y1098	F1093-T1096 HydrophobicContact CD1-CG2 3.85Å; F1093-T1096 HydrophobicContact CE1-CG2 3.81Å; F1093-T1096 PolarHBondContact O-N 3.32Å; F1093-T1096 PolarHBondContact O-OG1 3.13Å; T1096-Y1098 VanDerWaalsContact C-N 3.3Å; T1096-Y1098 HydrophobicContact CG2-CE1 4.46Å; T1096-Y1098 VanDerWaalsContact O-CD2 3.26Å; T1096-Y1098 WeakPolarHBondContact O-CD2 3.31Å; T1096-Y1098 PolarHBondContact O-N 2.9Å; T1096-Y1098 VanDerWaalsContact O-N 3.16Å; T1096-Y1098 VanDerWaalsContact OG1-CE2 3.25Å; T1096-Y1098 WeakPolarHBondContact OG1-CE2 3.41Å; T1096-Y1098 VanDerWaalsContact OG1-CZ 3.31Å; T1096-Y1098 PolarHBondContact OG1-OH 3.12Å; T1096-Y1098 VanDerWaalsContact OG1-OH 3.11Å
1097	R	41	Very low	46.8	Very low	120.8 Å²	120.8	86.4 Å²	86.4	46%	0.456	46%	0.456	S	S	.	.			trans	-84.3	107.3	175.7	-69	-170.5	-179.3	-161.4	1.8	110.8	E789 S793 N963 M1081 F1095 E1099 C1100	E789-R1097 PolarHBondContact O-NH2 3.12Å; E789-R1097 IonicContact OE1-CZ 3.27Å; E789-R1097 IonicContact OE1-NH1 2.98Å; E789-R1097 PolarHBondContact OE1-NH1 2.81Å; E789-R1097 IonicContact OE1-NH2 3.21Å; E789-R1097 PolarHBondContact OE1-NH2 3.23Å; S793-R1097 PolarHBondContact OG-NE 3.06Å; S793-R1097 PolarHBondContact OG-NH2 3.49Å; N963-R1097 PolarHBondContact OD1-NH1 2.89Å; M1081-R1097 WeakPolarHBondContact CE-O 3.19Å; F1095-R1097 HydrophobicContact CD1-CG 3.59Å; F1095-R1097 HydrophobicContact CE1-CG 4.12Å; F1095-R1097 WeakPolarHBondContact O-CG 3.46Å; F1095-R1097 PolarHBondContact O-N 3.09Å; F1095-R1097 VanDerWaalsContact O-N 3.09Å; R1097-E1099 VanDerWaalsContact C-N 3.34Å; R1097-E1099 HydrophobicContact CB-CG 3.92Å; R1097-E1099 WeakPolarHBondContact CD-OE1 3.4Å; R1097-E1099 WeakPolarHBondContact CD-OE2 3.49Å; R1097-E1099 IonicContact CZ-OE1 3.27Å; R1097-E1099 IonicContact NE-OE1 3.13Å; R1097-E1099 IonicContact NH1-OE1 3.06Å; R1097-E1099 PolarHBondContact NH1-OE1 3.32Å; R1097-E1099 IonicContact NH1-OE2 3.96Å; R1097-E1099 PolarHBondContact O-N 3.11Å; R1097-E1099 VanDerWaalsContact O-N 3.14Å; R1097-C1100 HydrophobicContact CB-CB 4.38Å; R1097-C1100 WeakPolarHBondContact O-CB 3.31Å; R1097-C1100 PolarHBondContact O-N 3.12Å; R1097-C1100 VanDerWaalsContact O-N 3.12Å
1098	Y	44.9	Very low	48.2	Very low	94.2 Å²	94.2	82.7 Å²	82.7	37%	0.369	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-70	10.8	176.4	-65.4	-86.2	0	0	0	112.9	F869 S1071 Y1074 F1093 T1096 C1100 W1101 P1105	F869-Y1098 AromaticContact CD1-CD1 3.74Å; F869-Y1098 HydrophobicContact CD1-CD1 3.74Å; F869-Y1098 AromaticContact CD1-CE1 3.56Å; F869-Y1098 HydrophobicContact CD1-CE1 3.56Å; F869-Y1098 AromaticContact CE1-CD1 3.54Å; F869-Y1098 HydrophobicContact CE1-CD1 3.54Å; F869-Y1098 AromaticContact CE1-CE1 3.86Å; F869-Y1098 HydrophobicContact CE1-CE1 3.86Å; S1071-Y1098 WeakPolarHBondContact OG-CB 3.11Å; S1071-Y1098 WeakPolarHBondContact OG-CD2 3.09Å; Y1074-Y1098 VanDerWaalsContact CB-OH 3.3Å; Y1074-Y1098 WeakPolarHBondContact CB-OH 3.17Å; Y1074-Y1098 HydrophobicContact CD1-CE1 4.28Å; Y1074-Y1098 AromaticContact CD2-CD1 3.8Å; Y1074-Y1098 HydrophobicContact CD2-CD1 3.8Å; Y1074-Y1098 AromaticContact CD2-CE1 3.29Å; Y1074-Y1098 HydrophobicContact CD2-CE1 3.29Å; Y1074-Y1098 AromaticContact CD2-CZ 3.91Å; Y1074-Y1098 HydrophobicContact CE2-CE1 4.05Å; Y1074-Y1098 HydrophobicContact CG-CD1 4.34Å; Y1074-Y1098 AromaticContact CG-CE1 3.49Å; Y1074-Y1098 HydrophobicContact CG-CE1 3.49Å; Y1074-Y1098 VanDerWaalsContact CG-CE1 3.49Å; Y1074-Y1098 HydrophobicContact CG-CE2 4.5Å; Y1074-Y1098 AromaticContact CG-CZ 3.6Å; F1093-Y1098 WeakPolarHBondContact CE1-OH 3.33Å; T1096-Y1098 VanDerWaalsContact C-N 3.3Å; T1096-Y1098 HydrophobicContact CG2-CE1 4.46Å; T1096-Y1098 VanDerWaalsContact O-CD2 3.26Å; T1096-Y1098 WeakPolarHBondContact O-CD2 3.31Å; T1096-Y1098 PolarHBondContact O-N 2.9Å; T1096-Y1098 VanDerWaalsContact O-N 3.16Å; T1096-Y1098 VanDerWaalsContact OG1-CE2 3.25Å; T1096-Y1098 WeakPolarHBondContact OG1-CE2 3.41Å; T1096-Y1098 VanDerWaalsContact OG1-CZ 3.31Å; T1096-Y1098 PolarHBondContact OG1-OH 3.12Å; T1096-Y1098 VanDerWaalsContact OG1-OH 3.11Å; Y1098-C1100 PolarHBondContact O-N 3.18Å; Y1098-W1101 PolarHBondContact O-N 2.78Å; Y1098-P1105 HydrophobicContact CD1-CG 4.29Å; Y1098-P1105 HydrophobicContact CE1-CG 4.12Å
1099	E	42	Very low	50	Low	103.8 Å²	103.8	78.8 Å²	78.8	49%	0.485	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-81	6.9	179	-68	170.4	-175.5	0	0	112.2	R998 I1068 V1077 R1097 W1101	R998-E1099 VanDerWaalsContact CD-CD 3.44Å; R998-E1099 WeakPolarHBondContact CD-OE1 3.47Å; R998-E1099 WeakPolarHBondContact CD-OE2 3.41Å; R998-E1099 IonicContact CZ-OE2 3.07Å; R998-E1099 IonicContact NE-OE2 2.69Å; R998-E1099 PolarHBondContact NE-OE2 2.85Å; R998-E1099 IonicContact NH1-OE2 2.89Å; R998-E1099 PolarHBondContact NH1-OE2 3.09Å; I1068-E1099 HydrophobicContact CG1-CG 4.23Å; V1077-E1099 WeakPolarHBondContact CG2-O 3.36Å; R1097-E1099 VanDerWaalsContact C-N 3.34Å; R1097-E1099 HydrophobicContact CB-CG 3.92Å; R1097-E1099 WeakPolarHBondContact CD-OE1 3.4Å; R1097-E1099 WeakPolarHBondContact CD-OE2 3.49Å; R1097-E1099 IonicContact CZ-OE1 3.27Å; R1097-E1099 IonicContact NE-OE1 3.13Å; R1097-E1099 IonicContact NH1-OE1 3.06Å; R1097-E1099 PolarHBondContact NH1-OE1 3.32Å; R1097-E1099 IonicContact NH1-OE2 3.96Å; R1097-E1099 PolarHBondContact O-N 3.11Å; R1097-E1099 VanDerWaalsContact O-N 3.14Å; E1099-W1101 VanDerWaalsContact C-N 3.26Å; E1099-W1101 PolarHBondContact O-N 2.99Å
1100	C	45.2	Very low	51.7	Low	39.4 Å²	39.4	72.7 Å²	72.7	27%	0.266	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-114.1	34.3	-179	-33.9	0	0	0	0	112.6	L861 R965 Y1074 V1077 R1097 Y1098 P1102	L861-C1100 HydrophobicContact CD2-CB 4.38Å; R965-C1100 HydrophobicContact CB-CB 4.23Å; Y1074-C1100 HydrophobicContact CD2-CB 4.37Å; V1077-C1100 HydrophobicContact CB-CB 3.95Å; V1077-C1100 HydrophobicContact CG1-CB 3.69Å; V1077-C1100 HydrophobicContact CG2-CB 4.32Å; R1097-C1100 HydrophobicContact CB-CB 4.38Å; R1097-C1100 WeakPolarHBondContact O-CB 3.31Å; R1097-C1100 PolarHBondContact O-N 3.12Å; R1097-C1100 VanDerWaalsContact O-N 3.12Å; Y1098-C1100 PolarHBondContact O-N 3.18Å; C1100-P1102 VanDerWaalsContact O-CD 3.24Å; C1100-P1102 WeakPolarHBondContact O-CD 3.28Å; C1100-P1102 VanDerWaalsContact O-N 3.11Å
1101	W	47.6	Very low	53.4	Low	57.4 Å²	57.4	67.4 Å²	67.4	22%	0.217	36%	0.36	C	S	.	.			trans	-85	120.7	177.3	-125.4	72.7	0	0	0	110	V868 F869 I1065 P1067 L1070 T1073 Y1098 E1099 A1103 Q1107 L1108 L1111	V868-W1101 VanDerWaalsContact CG1-CD1 3.42Å; F869-W1101 HydrophobicContact CE1-CZ2 4.31Å; F869-W1101 HydrophobicContact CZ-CH2 4.36Å; F869-W1101 AromaticContact CZ-CZ2 3.8Å; F869-W1101 HydrophobicContact CZ-CZ2 3.8Å; F869-W1101 AromaticContact CZ-NE1 3.84Å; I1065-W1101 HydrophobicContact CD1-CZ3 4.05Å; P1067-W1101 HydrophobicContact CB-CB 3.83Å; P1067-W1101 HydrophobicContact CB-CD2 4.25Å; P1067-W1101 HydrophobicContact CB-CE3 4.24Å; P1067-W1101 HydrophobicContact CB-CG 4.07Å; P1067-W1101 HydrophobicContact CG-CB 3.98Å; P1067-W1101 HydrophobicContact CG-CD2 3.71Å; P1067-W1101 HydrophobicContact CG-CE3 3.58Å; P1067-W1101 HydrophobicContact CG-CG 3.84Å; P1067-W1101 HydrophobicContact CG-CZ3 4.09Å; L1070-W1101 HydrophobicContact CD1-CD2 4.39Å; L1070-W1101 HydrophobicContact CD1-CE3 4.24Å; L1070-W1101 HydrophobicContact CD1-CH2 3.86Å; L1070-W1101 HydrophobicContact CD1-CZ2 4.29Å; L1070-W1101 HydrophobicContact CD2-CZ2 4.32Å; T1073-W1101 WeakPolarHBondContact OG1-CZ2 3.2Å; Y1098-W1101 PolarHBondContact O-N 2.78Å; E1099-W1101 VanDerWaalsContact C-N 3.26Å; E1099-W1101 PolarHBondContact O-N 2.99Å; W1101-A1103 VanDerWaalsContact C-N 3.27Å; W1101-A1103 WeakPolarHBondContact CB-O 3.43Å; W1101-A1103 HydrophobicContact CE3-CB 3.9Å; W1101-A1103 HydrophobicContact CZ3-CB 3.85Å; W1101-A1103 PolarHBondContact O-N 2.94Å; W1101-Q1107 HydrophobicContact CE3-CB 4.14Å; W1101-Q1107 HydrophobicContact CH2-CB 4.02Å; W1101-Q1107 VanDerWaalsContact CH2-O 3.24Å; W1101-Q1107 WeakPolarHBondContact CH2-O 3.47Å; W1101-Q1107 HydrophobicContact CZ2-CB 3.75Å; W1101-Q1107 HydrophobicContact CZ2-CG 4.41Å; W1101-Q1107 WeakPolarHBondContact CZ2-O 3.48Å; W1101-Q1107 HydrophobicContact CZ3-CB 3.57Å; W1101-Q1107 VanDerWaalsContact CZ3-O 3.26Å; W1101-Q1107 WeakPolarHBondContact CZ3-O 3.47Å; W1101-L1108 HydrophobicContact CD2-CD1 4.41Å; W1101-L1108 HydrophobicContact CD2-CD2 4.13Å; W1101-L1108 HydrophobicContact CE3-CD1 4.02Å; W1101-L1108 HydrophobicContact CG-CD2 4.3Å; W1101-L1108 HydrophobicContact CH2-CD1 4.35Å; W1101-L1108 HydrophobicContact CH2-CD2 4Å; W1101-L1108 HydrophobicContact CZ2-CD2 4.47Å; W1101-L1108 HydrophobicContact CZ3-CD1 3.95Å; W1101-L1111 HydrophobicContact CH2-CB 4Å; W1101-L1111 HydrophobicContact CH2-CD2 3.83Å; W1101-L1111 HydrophobicContact CH2-CG 4.3Å; W1101-L1111 HydrophobicContact CZ2-CB 4.23Å; W1101-L1111 HydrophobicContact CZ3-CB 4.11Å; W1101-L1111 HydrophobicContact CZ3-CD2 3.87Å; W1101-L1111 VanDerWaalsContact CZ3-CD2 3.41Å; W1101-L1111 HydrophobicContact CZ3-CG 4.45Å
1102	P	49.1	Very low	55.3	Low	47.8 Å²	47.8	66.1 Å²	66.1	31%	0.31	35%	0.346	S	S	.	.			trans	-64.9	127.1	169.9	14.7	-12.5	0	0	0	109.3	E391 S863 Y923 R965 E1069 L1070 T1073 C1100 S1104 Q1107	E391-P1102 WeakPolarHBondContact OE2-CA 3.39Å; E391-P1102 WeakPolarHBondContact OE2-CB 3.29Å; S863-P1102 WeakPolarHBondContact OG-CB 3.26Å; Y923-P1102 HydrophobicContact CE1-CB 4.38Å; R965-P1102 VanDerWaalsContact NH1-CB 3.3Å; E1069-P1102 HydrophobicContact CB-CB 4.48Å; E1069-P1102 HydrophobicContact CB-CG 4.49Å; L1070-P1102 HydrophobicContact CB-CG 4.44Å; L1070-P1102 VanDerWaalsContact CD1-CD 3.48Å; L1070-P1102 HydrophobicContact CD1-CG 4.18Å; T1073-P1102 HydrophobicContact CG2-CB 3.86Å; T1073-P1102 WeakPolarHBondContact OG1-CD 3.45Å; C1100-P1102 VanDerWaalsContact O-CD 3.24Å; C1100-P1102 WeakPolarHBondContact O-CD 3.28Å; C1100-P1102 VanDerWaalsContact O-N 3.11Å; P1102-S1104 PolarHBondContact O-N 3.16Å; P1102-Q1107 VanDerWaalsContact C-OE1 3.26Å; P1102-Q1107 VanDerWaalsContact O-CD 3.26Å; P1102-Q1107 PolarHBondContact O-NE2 2.88Å; P1102-Q1107 VanDerWaalsContact O-NE2 3.07Å; P1102-Q1107 PolarHBondContact O-OE1 3.26Å
1103	A	55.4	Low	57.3	Low	21.2 Å²	21.2	61.7 Å²	61.7	18%	0.175	32%	0.32	C	S	.	.			trans	-94.2	88.2	172.6	0	0	0	0	0	109.6	E391 N392 F502 W1101 Q1107 L1108	E391-A1103 PolarHBondContact OE2-N 2.92Å; N392-A1103 HydrophobicContact CB-CB 3.99Å; N392-A1103 PolarHBondContact N-O 3.21Å; N392-A1103 VanDerWaalsContact N-O 3.08Å; N392-A1103 VanDerWaalsContact O-CB 3.3Å; N392-A1103 WeakPolarHBondContact O-CB 3.42Å; F502-A1103 WeakPolarHBondContact CE1-O 3.41Å; F502-A1103 WeakPolarHBondContact CZ-O 3.29Å; W1101-A1103 VanDerWaalsContact C-N 3.27Å; W1101-A1103 WeakPolarHBondContact CB-O 3.43Å; W1101-A1103 HydrophobicContact CE3-CB 3.9Å; W1101-A1103 HydrophobicContact CZ3-CB 3.85Å; W1101-A1103 PolarHBondContact O-N 2.94Å; A1103-Q1107 HydrophobicContact CB-CB 3.75Å; A1103-L1108 HydrophobicContact CB-CB 4.38Å
1104	S	60.4	Low	59.2	Low	26.8 Å²	26.8	59.4 Å²	59.4	19%	0.187	31%	0.312	C	S	.	.			trans	-67.1	159.4	168.1	73	0	0	0	0	110.9	Y923 P1102 H1106 Q1107 L1108	Y923-S1104 PolarHBondContact OH-OG 3.34Å; P1102-S1104 PolarHBondContact O-N 3.16Å; S1104-H1106 VanDerWaalsContact C-N 3.29Å; S1104-H1106 PolarHBondContact O-N 3.28Å; S1104-Q1107 VanDerWaalsContact CB-OE1 3.26Å; S1104-Q1107 WeakPolarHBondContact O-CA 3.45Å; S1104-Q1107 WeakPolarHBondContact O-CB 3.29Å; S1104-Q1107 PolarHBondContact O-N 3.17Å; S1104-Q1107 VanDerWaalsContact O-N 3.16Å; S1104-Q1107 WeakPolarHBondContact OG-CB 3.24Å; S1104-Q1107 VanDerWaalsContact OG-CG 3.3Å; S1104-Q1107 WeakPolarHBondContact OG-CG 3.29Å; S1104-Q1107 PolarHBondContact OG-N 3.22Å; S1104-Q1107 PolarHBondContact OG-OE1 3.22Å; S1104-L1108 WeakPolarHBondContact O-CB 3.26Å; S1104-L1108 PolarHBondContact O-N 2.87Å
1105	P	66.3	Low	61.1	Low	61 Å²	61	57.5 Å²	57.5	40%	0.396	29%	0.287	S	S	.	.	H	α-helix	trans	-54.6	-34.6	177.6	-27.2	35.1	0	0	0	113.6	F502 Y923 Y1098 L1108 L1109	F502-P1105 HydrophobicContact CB-CG 4.28Å; F502-P1105 HydrophobicContact CD1-CG 3.58Å; F502-P1105 HydrophobicContact CD2-CG 3.96Å; F502-P1105 VanDerWaalsContact CE1-CD 3.48Å; F502-P1105 HydrophobicContact CE1-CG 3.7Å; F502-P1105 HydrophobicContact CE2-CG 4.08Å; F502-P1105 HydrophobicContact CG-CG 3.71Å; F502-P1105 HydrophobicContact CZ-CG 3.95Å; Y923-P1105 HydrophobicContact CE1-CB 3.89Å; Y923-P1105 HydrophobicContact CE1-CG 4.31Å; Y1098-P1105 HydrophobicContact CD1-CG 4.29Å; Y1098-P1105 HydrophobicContact CE1-CG 4.12Å; P1105-L1108 PolarHBondContact O-N 3.03Å; P1105-L1109 WeakPolarHBondContact O-CB 3.42Å; P1105-L1109 WeakPolarHBondContact O-CD1 3.2Å; P1105-L1109 VanDerWaalsContact O-CG 3.29Å; P1105-L1109 WeakPolarHBondContact O-CG 3.37Å; P1105-L1109 PolarHBondContact O-N 3.16Å; P1105-L1109 VanDerWaalsContact O-N 3.07Å
1106	H	66	Low	63.3	Low	112.2 Å²	112.2	52.4 Å²	52.4	52%	0.519	27%	0.266	S	S	.	.	H	α-helix	trans	-70.6	-41.1	176.1	-78.6	-70.8	0	0	0	112.7	Y923 S1104 L1108 L1109 N1110	Y923-H1106 AromaticContact CD2-NE2 3.76Å; S1104-H1106 VanDerWaalsContact C-N 3.29Å; S1104-H1106 PolarHBondContact O-N 3.28Å; H1106-L1108 VanDerWaalsContact C-N 3.33Å; H1106-L1109 WeakPolarHBondContact O-CB 3.17Å; H1106-L1109 PolarHBondContact O-N 3.04Å; H1106-N1110 PolarHBondContact CE1-ND2 2.87Å; H1106-N1110 VanDerWaalsContact CE1-ND2 3.26Å; H1106-N1110 WeakPolarHBondContact O-CB 3.05Å; H1106-N1110 PolarHBondContact O-N 3.1Å; H1106-N1110 PolarHBondContact O-ND2 2.99Å; H1106-N1110 PolarHBondContact O-OD1 3.24Å; H1106-N1110 VanDerWaalsContact O-OD1 3.08Å
1107	Q	67.1	Low	65.3	Low	45.4 Å²	45.4	49.7 Å²	49.7	21%	0.212	25%	0.249	C	C	.	.	H	α-helix	trans	-66.3	-39.8	175	-74.5	165.4	-20.7	0	0	111.5	V868 Y923 W1101 P1102 A1103 S1104 L1109 N1110 L1111	V868-Q1107 HydrophobicContact CG2-CG 4.43Å; Y923-Q1107 PolarHBondContact OH-NE2 3.08Å; Y923-Q1107 PolarHBondContact OH-OE1 3.37Å; W1101-Q1107 HydrophobicContact CE3-CB 4.14Å; W1101-Q1107 HydrophobicContact CH2-CB 4.02Å; W1101-Q1107 VanDerWaalsContact CH2-O 3.24Å; W1101-Q1107 WeakPolarHBondContact CH2-O 3.47Å; W1101-Q1107 HydrophobicContact CZ2-CB 3.75Å; W1101-Q1107 HydrophobicContact CZ2-CG 4.41Å; W1101-Q1107 WeakPolarHBondContact CZ2-O 3.48Å; W1101-Q1107 HydrophobicContact CZ3-CB 3.57Å; W1101-Q1107 VanDerWaalsContact CZ3-O 3.26Å; W1101-Q1107 WeakPolarHBondContact CZ3-O 3.47Å; P1102-Q1107 VanDerWaalsContact C-OE1 3.26Å; P1102-Q1107 VanDerWaalsContact O-CD 3.26Å; P1102-Q1107 PolarHBondContact O-NE2 2.88Å; P1102-Q1107 VanDerWaalsContact O-NE2 3.07Å; P1102-Q1107 PolarHBondContact O-OE1 3.26Å; A1103-Q1107 HydrophobicContact CB-CB 3.75Å; S1104-Q1107 VanDerWaalsContact CB-OE1 3.26Å; S1104-Q1107 WeakPolarHBondContact O-CA 3.45Å; S1104-Q1107 WeakPolarHBondContact O-CB 3.29Å; S1104-Q1107 PolarHBondContact O-N 3.17Å; S1104-Q1107 VanDerWaalsContact O-N 3.16Å; S1104-Q1107 WeakPolarHBondContact OG-CB 3.24Å; S1104-Q1107 VanDerWaalsContact OG-CG 3.3Å; S1104-Q1107 WeakPolarHBondContact OG-CG 3.29Å; S1104-Q1107 PolarHBondContact OG-N 3.22Å; S1104-Q1107 PolarHBondContact OG-OE1 3.22Å; Q1107-L1109 VanDerWaalsContact C-N 3.31Å; Q1107-L1109 PolarHBondContact O-N 2.88Å; Q1107-N1110 WeakPolarHBondContact O-CB 3.27Å; Q1107-N1110 PolarHBondContact O-N 3.28Å; Q1107-N1110 VanDerWaalsContact O-N 3.14Å; Q1107-L1111 WeakPolarHBondContact O-CB 3.5Å; Q1107-L1111 PolarHBondContact O-N 3.14Å
1108	L	70.9	Confident	67.1	Low	40.4 Å²	40.4	45 Å²	45	21%	0.212	23%	0.233	C	C	.	.	H	α-helix	trans	-61.4	-41.3	173	-179.9	58.9	0	0	0	111.4	F437 F502 L1070 W1101 A1103 S1104 P1105 H1106 N1110 L1111 L1112	F437-L1108 HydrophobicContact CD1-CD1 3.37Å; F437-L1108 VanDerWaalsContact CD1-CD1 3.42Å; F437-L1108 HydrophobicContact CE1-CD1 3.82Å; F437-L1108 HydrophobicContact CG-CD1 4.3Å; F502-L1108 HydrophobicContact CE2-CD2 4.5Å; L1070-L1108 HydrophobicContact CD1-CD1 4.45Å; L1070-L1108 HydrophobicContact CD1-CD2 4.32Å; W1101-L1108 HydrophobicContact CD2-CD1 4.41Å; W1101-L1108 HydrophobicContact CD2-CD2 4.13Å; W1101-L1108 HydrophobicContact CE3-CD1 4.02Å; W1101-L1108 HydrophobicContact CG-CD2 4.3Å; W1101-L1108 HydrophobicContact CH2-CD1 4.35Å; W1101-L1108 HydrophobicContact CH2-CD2 4Å; W1101-L1108 HydrophobicContact CZ2-CD2 4.47Å; W1101-L1108 HydrophobicContact CZ3-CD1 3.95Å; A1103-L1108 HydrophobicContact CB-CB 4.38Å; S1104-L1108 WeakPolarHBondContact O-CB 3.26Å; S1104-L1108 PolarHBondContact O-N 2.87Å; P1105-L1108 PolarHBondContact O-N 3.03Å; H1106-L1108 VanDerWaalsContact C-N 3.33Å; L1108-N1110 VanDerWaalsContact C-N 3.35Å; L1108-N1110 PolarHBondContact O-N 3.23Å; L1108-L1111 HydrophobicContact CD1-CD2 4.29Å; L1108-L1111 CarbonylContact O-C 3.55Å; L1108-L1111 WeakPolarHBondContact O-CA 3.35Å; L1108-L1111 WeakPolarHBondContact O-CB 3.45Å; L1108-L1111 PolarHBondContact O-N 3.08Å; L1108-L1112 HydrophobicContact CD1-CD1 4.34Å; L1108-L1112 HydrophobicContact CD1-CG 4.4Å; L1108-L1112 HydrophobicContact CG-CD1 4.24Å; L1108-L1112 WeakPolarHBondContact O-CB 3.39Å; L1108-L1112 VanDerWaalsContact O-CG 3.28Å; L1108-L1112 WeakPolarHBondContact O-CG 3.4Å; L1108-L1112 PolarHBondContact O-N 3.11Å
1109	L	76	Confident	68.9	Low	17.4 Å²	17.4	44.1 Å²	44.1	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-39.9	174.3	-136.6	101.4	0	0	0	112.2	P1105 H1106 Q1107 L1111 L1112 R1113 K1147 P1149 L1152	P1105-L1109 WeakPolarHBondContact O-CB 3.42Å; P1105-L1109 WeakPolarHBondContact O-CD1 3.2Å; P1105-L1109 VanDerWaalsContact O-CG 3.29Å; P1105-L1109 WeakPolarHBondContact O-CG 3.37Å; P1105-L1109 PolarHBondContact O-N 3.16Å; P1105-L1109 VanDerWaalsContact O-N 3.07Å; H1106-L1109 WeakPolarHBondContact O-CB 3.17Å; H1106-L1109 PolarHBondContact O-N 3.04Å; Q1107-L1109 VanDerWaalsContact C-N 3.31Å; Q1107-L1109 PolarHBondContact O-N 2.88Å; L1109-L1111 VanDerWaalsContact C-N 3.34Å; L1109-L1112 HydrophobicContact CD1-CD1 4.48Å; L1109-L1112 PolarHBondContact O-N 3.06Å; L1109-R1113 VanDerWaalsContact O-CG 3.27Å; L1109-R1113 WeakPolarHBondContact O-CG 3.26Å; L1109-R1113 PolarHBondContact O-N 3.02Å; L1109-R1113 VanDerWaalsContact O-N 3.1Å; L1109-R1113 PolarHBondContact O-NH1 2.84Å; L1109-K1147 VanDerWaalsContact CD2-O 3.22Å; L1109-K1147 WeakPolarHBondContact CD2-O 3.36Å; L1109-P1149 HydrophobicContact CD1-CG 4.38Å; L1109-P1149 HydrophobicContact CD2-CB 4.16Å; L1109-L1152 HydrophobicContact CD1-CD1 3.47Å; L1109-L1152 VanDerWaalsContact CD1-CD1 3.47Å; L1109-L1152 HydrophobicContact CD1-CG 4.38Å; L1109-L1152 HydrophobicContact CG-CD1 4.43Å
1110	N	74.5	Confident	71.1	Confident	56.2 Å²	56.2	39.2 Å²	39.2	30%	0.301	21%	0.208	S	C	.	.	H	α-helix	trans	-58.9	-48.7	172.5	-70.1	-15.1	0	0	0	110.8	F869 H1106 Q1107 L1108 L1112 R1113 L1114	F869-N1110 HydrophobicContact CZ-CB 4.36Å; H1106-N1110 PolarHBondContact CE1-ND2 2.87Å; H1106-N1110 VanDerWaalsContact CE1-ND2 3.26Å; H1106-N1110 WeakPolarHBondContact O-CB 3.05Å; H1106-N1110 PolarHBondContact O-N 3.1Å; H1106-N1110 PolarHBondContact O-ND2 2.99Å; H1106-N1110 PolarHBondContact O-OD1 3.24Å; H1106-N1110 VanDerWaalsContact O-OD1 3.08Å; Q1107-N1110 WeakPolarHBondContact O-CB 3.27Å; Q1107-N1110 PolarHBondContact O-N 3.28Å; Q1107-N1110 VanDerWaalsContact O-N 3.14Å; L1108-N1110 VanDerWaalsContact C-N 3.35Å; L1108-N1110 PolarHBondContact O-N 3.23Å; N1110-L1112 VanDerWaalsContact C-N 3.32Å; N1110-L1112 PolarHBondContact O-N 2.96Å; N1110-R1113 WeakPolarHBondContact O-CB 3.3Å; N1110-R1113 PolarHBondContact O-N 3.12Å; N1110-R1113 VanDerWaalsContact O-N 3.1Å; N1110-R1113 PolarHBondContact OD1-NH1 3.32Å; N1110-L1114 WeakPolarHBondContact O-CD1 3.35Å; N1110-L1114 VanDerWaalsContact O-CG 3.25Å; N1110-L1114 WeakPolarHBondContact O-CG 3.38Å; N1110-L1114 PolarHBondContact O-N 3.14Å
1111	L	74.5	Confident	72.9	Confident	14.8 Å²	14.8	38.4 Å²	38.4	8%	0.077	20%	0.203	C	C	.	.	H	α-helix	trans	-51.6	-48.3	172.7	175.6	69.1	0	0	0	112.9	F437 M1061 W1062 Y1064 I1065 L1070 W1101 Q1107 L1108 L1109 R1113 L1114 T1115	F437-L1111 HydrophobicContact CD1-CD2 4.37Å; F437-L1111 HydrophobicContact CE1-CD2 3.47Å; F437-L1111 HydrophobicContact CE1-CG 4.41Å; F437-L1111 HydrophobicContact CE2-CD2 3.94Å; F437-L1111 HydrophobicContact CZ-CD2 3.22Å; F437-L1111 HydrophobicContact CZ-CG 4.28Å; M1061-L1111 HydrophobicContact CG-CD1 3.92Å; M1061-L1111 HydrophobicContact SD-CD1 4.1Å; W1062-L1111 HydrophobicContact CZ3-CD2 4.27Å; Y1064-L1111 HydrophobicContact CD1-CD2 4.5Å; Y1064-L1111 WeakPolarHBondContact O-CD1 3.3Å; I1065-L1111 HydrophobicContact CB-CD1 3.89Å; I1065-L1111 HydrophobicContact CB-CD2 4.17Å; I1065-L1111 HydrophobicContact CB-CG 4.36Å; I1065-L1111 HydrophobicContact CD1-CD1 4.03Å; I1065-L1111 HydrophobicContact CD1-CD2 3.47Å; I1065-L1111 HydrophobicContact CG1-CD1 4.22Å; I1065-L1111 HydrophobicContact CG1-CD2 3.92Å; I1065-L1111 HydrophobicContact CG2-CB 3.88Å; I1065-L1111 HydrophobicContact CG2-CD1 3.8Å; I1065-L1111 HydrophobicContact CG2-CD2 3.69Å; I1065-L1111 HydrophobicContact CG2-CG 3.97Å; I1065-L1111 WeakPolarHBondContact O-CD1 3.19Å; L1070-L1111 HydrophobicContact CD2-CD1 4.04Å; W1101-L1111 HydrophobicContact CH2-CB 4Å; W1101-L1111 HydrophobicContact CH2-CD2 3.83Å; W1101-L1111 HydrophobicContact CH2-CG 4.3Å; W1101-L1111 HydrophobicContact CZ2-CB 4.23Å; W1101-L1111 HydrophobicContact CZ3-CB 4.11Å; W1101-L1111 HydrophobicContact CZ3-CD2 3.87Å; W1101-L1111 VanDerWaalsContact CZ3-CD2 3.41Å; W1101-L1111 HydrophobicContact CZ3-CG 4.45Å; Q1107-L1111 WeakPolarHBondContact O-CB 3.5Å; Q1107-L1111 PolarHBondContact O-N 3.14Å; L1108-L1111 HydrophobicContact CD1-CD2 4.29Å; L1108-L1111 CarbonylContact O-C 3.55Å; L1108-L1111 WeakPolarHBondContact O-CA 3.35Å; L1108-L1111 WeakPolarHBondContact O-CB 3.45Å; L1108-L1111 PolarHBondContact O-N 3.08Å; L1109-L1111 VanDerWaalsContact C-N 3.34Å; L1111-R1113 VanDerWaalsContact C-N 3.29Å; L1111-R1113 PolarHBondContact O-N 3.07Å; L1111-L1114 PolarHBondContact O-N 3.32Å; L1111-T1115 HydrophobicContact CD1-CG2 4.14Å; L1111-T1115 WeakPolarHBondContact CD1-OG1 3.42Å; L1111-T1115 HydrophobicContact CG-CG2 4.22Å; L1111-T1115 VanDerWaalsContact O-CB 3.25Å; L1111-T1115 WeakPolarHBondContact O-CB 3.41Å; L1111-T1115 VanDerWaalsContact O-CG2 3.31Å; L1111-T1115 WeakPolarHBondContact O-CG2 3.35Å; L1111-T1115 PolarHBondContact O-N 3.07Å; L1111-T1115 PolarHBondContact O-OG1 3.23Å
1112	L	80.6	Confident	74.5	Confident	65.6 Å²	65.6	39 Å²	39	34%	0.343	21%	0.207	S	C	.	.	H	α-helix	trans	-64	-37.7	177.7	-70.7	171.8	0	0	0	112.4	Y1064 L1108 L1109 N1110 L1114 T1115 L1116 L1152	Y1064-L1112 HydrophobicContact CE1-CD2 4.05Å; L1108-L1112 HydrophobicContact CD1-CD1 4.34Å; L1108-L1112 HydrophobicContact CD1-CG 4.4Å; L1108-L1112 HydrophobicContact CG-CD1 4.24Å; L1108-L1112 WeakPolarHBondContact O-CB 3.39Å; L1108-L1112 VanDerWaalsContact O-CG 3.28Å; L1108-L1112 WeakPolarHBondContact O-CG 3.4Å; L1108-L1112 PolarHBondContact O-N 3.11Å; L1109-L1112 HydrophobicContact CD1-CD1 4.48Å; L1109-L1112 PolarHBondContact O-N 3.06Å; N1110-L1112 VanDerWaalsContact C-N 3.32Å; N1110-L1112 PolarHBondContact O-N 2.96Å; L1112-L1114 VanDerWaalsContact C-N 3.32Å; L1112-L1114 PolarHBondContact O-N 3.19Å; L1112-T1115 WeakPolarHBondContact CA-OG1 3.4Å; L1112-T1115 PolarHBondContact O-N 3.04Å; L1112-T1115 PolarHBondContact O-OG1 3.09Å; L1112-L1116 VanDerWaalsContact O-CB 3.25Å; L1112-L1116 WeakPolarHBondContact O-CB 3.29Å; L1112-L1116 WeakPolarHBondContact O-CD1 3.46Å; L1112-L1116 VanDerWaalsContact O-CG 3.26Å; L1112-L1116 WeakPolarHBondContact O-CG 3.17Å; L1112-L1116 PolarHBondContact O-N 2.94Å; L1112-L1152 HydrophobicContact CB-CD1 3.85Å; L1112-L1152 HydrophobicContact CB-CD2 3.68Å; L1112-L1152 HydrophobicContact CD1-CD1 4.47Å; L1112-L1152 HydrophobicContact CD1-CD2 4.49Å
1113	R	83.8	Confident	76.1	Confident	28.2 Å²	28.2	38.1 Å²	38.1	11%	0.106	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-45.6	173.3	-67.3	173.6	-164.9	126	2	111.4	L1109 N1110 L1111 L1116 C1117 V1143 I1144 S1146 L1152	L1109-R1113 VanDerWaalsContact O-CG 3.27Å; L1109-R1113 WeakPolarHBondContact O-CG 3.26Å; L1109-R1113 PolarHBondContact O-N 3.02Å; L1109-R1113 VanDerWaalsContact O-N 3.1Å; L1109-R1113 PolarHBondContact O-NH1 2.84Å; N1110-R1113 WeakPolarHBondContact O-CB 3.3Å; N1110-R1113 PolarHBondContact O-N 3.12Å; N1110-R1113 VanDerWaalsContact O-N 3.1Å; N1110-R1113 PolarHBondContact OD1-NH1 3.32Å; L1111-R1113 VanDerWaalsContact C-N 3.29Å; L1111-R1113 PolarHBondContact O-N 3.07Å; R1113-L1116 PolarHBondContact O-N 3.14Å; R1113-C1117 PolarHBondContact O-N 2.91Å; R1113-C1117 VanDerWaalsContact O-N 3.1Å; R1113-C1117 PolarHBondContact O-SG 3.11Å; R1113-C1117 VanDerWaalsContact O-SG 3.41Å; R1113-V1143 HydrophobicContact CB-CG1 3.93Å; R1113-V1143 WeakPolarHBondContact CD-O 3.32Å; R1113-V1143 HydrophobicContact CG-CG1 4.21Å; R1113-V1143 VanDerWaalsContact CG-O 3.27Å; R1113-V1143 WeakPolarHBondContact CG-O 3.42Å; R1113-V1143 WeakPolarHBondContact O-CG1 3.29Å; R1113-I1144 WeakPolarHBondContact CD-O 3.5Å; R1113-S1146 WeakPolarHBondContact CG-OG 3.34Å; R1113-S1146 PolarHBondContact NE-O 3.16Å; R1113-S1146 PolarHBondContact NE-OG 3.19Å; R1113-S1146 VanDerWaalsContact NE-OG 3.08Å; R1113-S1146 PolarHBondContact NH2-O 3.36Å; R1113-L1152 HydrophobicContact CG-CD1 4.2Å; R1113-L1152 HydrophobicContact CG-CD2 4Å
1114	L	78.3	Confident	77.4	Confident	39.2 Å²	39.2	39.8 Å²	39.8	21%	0.205	21%	0.208	C	C	.	.	H	α-helix	trans	-66.6	-45.2	-179	-64.2	173.8	0	0	0	111.6	F869 V892 T894 C899 I1065 L1070 N1110 L1111 L1112 L1116 C1117 H1118	F869-L1114 HydrophobicContact CE1-CD1 4.5Å; V892-L1114 HydrophobicContact CG1-CB 4.39Å; V892-L1114 HydrophobicContact CG1-CD1 3.57Å; V892-L1114 HydrophobicContact CG1-CD2 4.08Å; T894-L1114 VanDerWaalsContact CB-CD1 3.43Å; T894-L1114 HydrophobicContact CG2-CD1 3.77Å; T894-L1114 VanDerWaalsContact CG2-CD1 3.5Å; T894-L1114 HydrophobicContact CG2-CD2 3.33Å; T894-L1114 HydrophobicContact CG2-CG 4.1Å; T894-L1114 VanDerWaalsContact OG1-CD1 3.27Å; T894-L1114 WeakPolarHBondContact OG1-CD1 3.21Å; T894-L1114 VanDerWaalsContact OG1-CD2 3.25Å; T894-L1114 WeakPolarHBondContact OG1-CD2 3.35Å; C899-L1114 HydrophobicContact CB-CD2 4.27Å; I1065-L1114 HydrophobicContact CD1-CB 3.63Å; I1065-L1114 WeakPolarHBondContact CD1-O 3.29Å; L1070-L1114 HydrophobicContact CD1-CD1 4.11Å; L1070-L1114 HydrophobicContact CD2-CD1 4.44Å; N1110-L1114 WeakPolarHBondContact O-CD1 3.35Å; N1110-L1114 VanDerWaalsContact O-CG 3.25Å; N1110-L1114 WeakPolarHBondContact O-CG 3.38Å; N1110-L1114 PolarHBondContact O-N 3.14Å; L1111-L1114 PolarHBondContact O-N 3.32Å; L1112-L1114 VanDerWaalsContact C-N 3.32Å; L1112-L1114 PolarHBondContact O-N 3.19Å; L1114-L1116 VanDerWaalsContact C-N 3.29Å; L1114-L1116 PolarHBondContact O-N 3.07Å; L1114-C1117 WeakPolarHBondContact O-CB 2.98Å; L1114-C1117 PolarHBondContact O-N 3.02Å; L1114-H1118 WeakPolarHBondContact O-CB 3.35Å; L1114-H1118 PolarHBondContact O-N 3.18Å
1115	T	79.4	Confident	78.4	Confident	22.4 Å²	22.4	41.3 Å²	41.3	14%	0.137	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-39.2	176.7	-18.4	0	0	0	0	111.2	M1061 W1062 Y1064 I1065 L1111 L1112 H1118 F1119	M1061-T1115 HydrophobicContact CE-CG2 3.77Å; M1061-T1115 HydrophobicContact CG-CG2 4.15Å; M1061-T1115 HydrophobicContact SD-CG2 3.84Å; W1062-T1115 HydrophobicContact CE3-CG2 4.26Å; W1062-T1115 HydrophobicContact CZ3-CG2 4.39Å; Y1064-T1115 HydrophobicContact CD1-CG2 3.78Å; Y1064-T1115 HydrophobicContact CE1-CG2 4.42Å; Y1064-T1115 HydrophobicContact CG-CG2 4.39Å; I1065-T1115 HydrophobicContact CD1-CG2 4.14Å; I1065-T1115 VanDerWaalsContact CD1-OG1 3.28Å; I1065-T1115 WeakPolarHBondContact CD1-OG1 3.35Å; I1065-T1115 HydrophobicContact CG1-CG2 3.73Å; I1065-T1115 PolarHBondContact N-OG1 3.36Å; L1111-T1115 HydrophobicContact CD1-CG2 4.14Å; L1111-T1115 WeakPolarHBondContact CD1-OG1 3.42Å; L1111-T1115 HydrophobicContact CG-CG2 4.22Å; L1111-T1115 VanDerWaalsContact O-CB 3.25Å; L1111-T1115 WeakPolarHBondContact O-CB 3.41Å; L1111-T1115 VanDerWaalsContact O-CG2 3.31Å; L1111-T1115 WeakPolarHBondContact O-CG2 3.35Å; L1111-T1115 PolarHBondContact O-N 3.07Å; L1111-T1115 PolarHBondContact O-OG1 3.23Å; L1112-T1115 WeakPolarHBondContact CA-OG1 3.4Å; L1112-T1115 PolarHBondContact O-N 3.04Å; L1112-T1115 PolarHBondContact O-OG1 3.09Å; T1115-H1118 WeakPolarHBondContact O-CB 3.46Å; T1115-H1118 PolarHBondContact O-N 3.12Å; T1115-F1119 VanDerWaalsContact O-CB 3.26Å; T1115-F1119 WeakPolarHBondContact O-CB 3.29Å; T1115-F1119 PolarHBondContact O-N 3.02Å
1116	L	85	Confident	79.2	Confident	19 Å²	19	41.7 Å²	41.7	10%	0.099	22%	0.222	C	C	.	.	H	α-helix	trans	-66.9	-40.7	176.3	-138.4	97.9	0	0	0	112.6	L1112 R1113 L1114 H1118 F1119 E1120 W1139 V1143 L1152 L1156 L1159	L1112-L1116 VanDerWaalsContact O-CB 3.25Å; L1112-L1116 WeakPolarHBondContact O-CB 3.29Å; L1112-L1116 WeakPolarHBondContact O-CD1 3.46Å; L1112-L1116 VanDerWaalsContact O-CG 3.26Å; L1112-L1116 WeakPolarHBondContact O-CG 3.17Å; L1112-L1116 PolarHBondContact O-N 2.94Å; R1113-L1116 PolarHBondContact O-N 3.14Å; L1114-L1116 VanDerWaalsContact C-N 3.29Å; L1114-L1116 PolarHBondContact O-N 3.07Å; L1116-H1118 VanDerWaalsContact C-N 3.33Å; L1116-F1119 PolarHBondContact O-N 3.05Å; L1116-E1120 WeakPolarHBondContact O-CB 3.48Å; L1116-E1120 PolarHBondContact O-N 3.19Å; L1116-E1120 VanDerWaalsContact O-N 3.09Å; L1116-W1139 HydrophobicContact CB-CH2 4.4Å; L1116-W1139 HydrophobicContact CD1-CH2 4.12Å; L1116-W1139 HydrophobicContact CD1-CZ2 4.08Å; L1116-W1139 HydrophobicContact CD2-CH2 4.28Å; L1116-W1139 HydrophobicContact CD2-CZ2 3.94Å; L1116-W1139 HydrophobicContact CG-CH2 3.7Å; L1116-W1139 HydrophobicContact CG-CZ2 3.8Å; L1116-V1143 HydrophobicContact CB-CG1 4.45Å; L1116-V1143 HydrophobicContact CD2-CG1 4.12Å; L1116-V1143 HydrophobicContact CD2-CG2 3.87Å; L1116-V1143 HydrophobicContact CG-CG1 4.42Å; L1116-V1143 HydrophobicContact CG-CG2 4.48Å; L1116-L1152 HydrophobicContact CD1-CB 4.24Å; L1116-L1152 HydrophobicContact CD1-CD1 4.12Å; L1116-L1152 HydrophobicContact CD1-CD2 3.75Å; L1116-L1152 HydrophobicContact CD1-CG 4Å; L1116-L1152 HydrophobicContact CD2-CD1 3.55Å; L1116-L1152 HydrophobicContact CD2-CD2 4.07Å; L1116-L1152 HydrophobicContact CD2-CG 4.12Å; L1116-L1156 HydrophobicContact CD1-CD1 3.81Å; L1116-L1156 HydrophobicContact CD1-CD2 3.56Å; L1116-L1156 HydrophobicContact CD1-CG 4.04Å; L1116-L1156 HydrophobicContact CD2-CB 4.42Å; L1116-L1156 HydrophobicContact CD2-CD1 4.01Å; L1116-L1156 HydrophobicContact CD2-CD2 3.98Å; L1116-L1156 HydrophobicContact CD2-CG 3.96Å; L1116-L1159 HydrophobicContact CD1-CD2 3.92Å
1117	C	84.1	Confident	80.2	Confident	10.4 Å²	10.4	40.4 Å²	40.4	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-65.2	-42.1	173.2	-69.7	0	0	0	0	111.8	V892 V901 R1113 L1114 F1119 E1120 S1121	V892-C1117 HydrophobicContact CG1-CB 4.16Å; V901-C1117 HydrophobicContact CG2-CB 4.03Å; R1113-C1117 PolarHBondContact O-N 2.91Å; R1113-C1117 VanDerWaalsContact O-N 3.1Å; R1113-C1117 PolarHBondContact O-SG 3.11Å; R1113-C1117 VanDerWaalsContact O-SG 3.41Å; L1114-C1117 WeakPolarHBondContact O-CB 2.98Å; L1114-C1117 PolarHBondContact O-N 3.02Å; C1117-F1119 PolarHBondContact O-N 2.94Å; C1117-E1120 WeakPolarHBondContact O-CB 3.35Å; C1117-E1120 PolarHBondContact O-N 3.14Å; C1117-S1121 WeakPolarHBondContact O-CB 3.44Å; C1117-S1121 PolarHBondContact O-N 3.27Å; C1117-S1121 VanDerWaalsContact O-N 3.12Å; C1117-S1121 PolarHBondContact O-OG 3.39Å; C1117-S1121 VanDerWaalsContact O-OG 3.09Å
1118	H	79.3	Confident	81.2	Confident	23 Å²	23	38.5 Å²	38.5	11%	0.106	21%	0.206	C	C	.	.	H	α-helix	trans	-61	-48.6	175.4	-173.5	92.8	0	0	0	111.1	C890 V892 M1061 Y1064 I1065 L1114 T1115 L1116 E1120 S1121 K1122	C890-H1118 PolarHBondContact SG-CE1 3.16Å; C890-H1118 VanDerWaalsContact SG-CE1 3.57Å; C890-H1118 PolarHBondContact SG-ND1 3.23Å; V892-H1118 HydrophobicContact CG2-CB 4.21Å; M1061-H1118 PolarHBondContact O-CD2 3.44Å; M1061-H1118 HydrophobicContact SD-CB 3.69Å; M1061-H1118 VanDerWaalsContact SD-CD2 3.58Å; M1061-H1118 VanDerWaalsContact SD-CG 3.55Å; Y1064-H1118 HydrophobicContact CD1-CB 4.48Å; Y1064-H1118 AromaticContact CD1-CE1 3.1Å; Y1064-H1118 WeakPolarHBondContact CD1-CE1 3.38Å; Y1064-H1118 AromaticContact CD1-ND1 3.09Å; Y1064-H1118 WeakPolarHBondContact CD1-ND1 3.37Å; Y1064-H1118 HydrophobicContact CD2-CB 4.15Å; Y1064-H1118 AromaticContact CD2-CD2 3.8Å; Y1064-H1118 AromaticContact CD2-CE1 3.48Å; Y1064-H1118 WeakPolarHBondContact CD2-CE1 3.39Å; Y1064-H1118 AromaticContact CD2-CG 3.46Å; Y1064-H1118 VanDerWaalsContact CD2-CG 3.46Å; Y1064-H1118 AromaticContact CD2-ND1 3.22Å; Y1064-H1118 WeakPolarHBondContact CD2-ND1 3.4Å; Y1064-H1118 AromaticContact CD2-NE2 3.78Å; Y1064-H1118 AromaticContact CE1-CE1 3.53Å; Y1064-H1118 AromaticContact CE1-ND1 3.53Å; Y1064-H1118 AromaticContact CE2-CE1 3.72Å; Y1064-H1118 VanDerWaalsContact CE2-CE1 3.48Å; Y1064-H1118 WeakPolarHBondContact CE2-CE1 3.25Å; Y1064-H1118 AromaticContact CE2-CG 3.96Å; Y1064-H1118 AromaticContact CE2-ND1 3.25Å; Y1064-H1118 VanDerWaalsContact CE2-ND1 3.25Å; Y1064-H1118 WeakPolarHBondContact CE2-ND1 3.44Å; Y1064-H1118 HydrophobicContact CG-CB 4.04Å; Y1064-H1118 AromaticContact CG-CE1 3.09Å; Y1064-H1118 AromaticContact CG-CG 3.83Å; Y1064-H1118 AromaticContact CG-ND1 3.78Å; Y1064-H1118 AromaticContact CG-NE2 3.68Å; Y1064-H1118 AromaticContact CZ-CE1 3.94Å; I1065-H1118 HydrophobicContact CD1-CB 3.68Å; I1065-H1118 HydrophobicContact CG1-CB 3.89Å; L1114-H1118 WeakPolarHBondContact O-CB 3.35Å; L1114-H1118 PolarHBondContact O-N 3.18Å; T1115-H1118 WeakPolarHBondContact O-CB 3.46Å; T1115-H1118 PolarHBondContact O-N 3.12Å; L1116-H1118 VanDerWaalsContact C-N 3.33Å; H1118-E1120 VanDerWaalsContact C-N 3.31Å; H1118-E1120 PolarHBondContact O-N 3.15Å; H1118-S1121 VanDerWaalsContact C-OG 3.3Å; H1118-S1121 VanDerWaalsContact CA-OG 3.24Å; H1118-S1121 WeakPolarHBondContact CA-OG 3.36Å; H1118-S1121 WeakPolarHBondContact O-CB 3.36Å; H1118-S1121 PolarHBondContact O-N 3.03Å; H1118-S1121 VanDerWaalsContact O-N 3.11Å; H1118-S1121 PolarHBondContact O-OG 3.13Å; H1118-K1122 WeakPolarHBondContact CE1-CE 3.41Å; H1118-K1122 WeakPolarHBondContact NE2-CE 3.35Å; H1118-K1122 WeakPolarHBondContact O-CG 3.28Å; H1118-K1122 PolarHBondContact O-N 2.99Å; H1118-K1122 VanDerWaalsContact O-N 3.09Å
1119	F	82.4	Confident	82.1	Confident	74.2 Å²	74.2	38.7 Å²	38.7	33%	0.325	21%	0.209	S	C	.	.	H	α-helix	trans	-57.8	-44	177.9	179.2	-102.9	0	0	0	112.3	M1061 W1062 T1115 L1116 C1117 S1121 K1122 I1123 L1159	M1061-F1119 HydrophobicContact CE-CD2 3.62Å; M1061-F1119 HydrophobicContact CE-CE2 3.55Å; M1061-F1119 HydrophobicContact CE-CG 4.45Å; M1061-F1119 HydrophobicContact CE-CZ 4.35Å; W1062-F1119 HydrophobicContact CD2-CD2 4.28Å; W1062-F1119 AromaticContact CD2-CE2 3.79Å; W1062-F1119 HydrophobicContact CD2-CE2 3.79Å; W1062-F1119 AromaticContact CE2-CE2 3.53Å; W1062-F1119 AromaticContact CE2-CZ 4Å; W1062-F1119 HydrophobicContact CE3-CD2 4.31Å; W1062-F1119 HydrophobicContact CE3-CE2 4.06Å; W1062-F1119 HydrophobicContact CG-CE2 4.43Å; W1062-F1119 HydrophobicContact CH2-CD2 4.09Å; W1062-F1119 HydrophobicContact CH2-CE1 4.33Å; W1062-F1119 AromaticContact CH2-CE2 3.93Å; W1062-F1119 HydrophobicContact CH2-CE2 3.93Å; W1062-F1119 AromaticContact CH2-CZ 3.66Å; W1062-F1119 HydrophobicContact CH2-CZ 3.66Å; W1062-F1119 AromaticContact CZ2-CE2 3.59Å; W1062-F1119 HydrophobicContact CZ2-CE2 3.9Å; W1062-F1119 AromaticContact CZ2-CZ 3.54Å; W1062-F1119 HydrophobicContact CZ2-CZ 3.54Å; W1062-F1119 HydrophobicContact CZ3-CE2 4.1Å; W1062-F1119 HydrophobicContact CZ3-CZ 4.21Å; T1115-F1119 VanDerWaalsContact O-CB 3.26Å; T1115-F1119 WeakPolarHBondContact O-CB 3.29Å; T1115-F1119 PolarHBondContact O-N 3.02Å; L1116-F1119 PolarHBondContact O-N 3.05Å; C1117-F1119 PolarHBondContact O-N 2.94Å; F1119-S1121 VanDerWaalsContact C-N 3.31Å; F1119-S1121 PolarHBondContact O-N 2.95Å; F1119-K1122 PolarHBondContact O-N 3.1Å; F1119-I1123 HydrophobicContact CD1-CD1 4.21Å; F1119-I1123 HydrophobicContact CE1-CD1 3.78Å; F1119-I1123 HydrophobicContact CE2-CD1 4.42Å; F1119-I1123 HydrophobicContact CZ-CD1 3.94Å; F1119-I1123 WeakPolarHBondContact O-CG1 3.47Å; F1119-I1123 PolarHBondContact O-N 3.09Å; F1119-L1159 HydrophobicContact CD1-CD2 3.98Å; F1119-L1159 HydrophobicContact CE1-CD2 4.08Å
1120	E	87.4	Confident	82.5	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.009	24%	0.236	C	C	.	.	H	α-helix	trans	-58.5	-45.1	173.8	-171.4	-80.7	160.5	0	0	112	L1116 C1117 H1118 K1122 I1123 Y1128 W1132 R1136 W1139 L1159	L1116-E1120 WeakPolarHBondContact O-CB 3.48Å; L1116-E1120 PolarHBondContact O-N 3.19Å; L1116-E1120 VanDerWaalsContact O-N 3.09Å; C1117-E1120 WeakPolarHBondContact O-CB 3.35Å; C1117-E1120 PolarHBondContact O-N 3.14Å; H1118-E1120 VanDerWaalsContact C-N 3.31Å; H1118-E1120 PolarHBondContact O-N 3.15Å; E1120-K1122 VanDerWaalsContact C-N 3.27Å; E1120-K1122 PolarHBondContact O-N 3.19Å; E1120-I1123 PolarHBondContact O-N 3.29Å; E1120-Y1128 WeakPolarHBondContact CA-OH 3.4Å; E1120-Y1128 WeakPolarHBondContact CG-OH 3.38Å; E1120-Y1128 PolarHBondContact O-OH 3.03Å; E1120-W1132 HydrophobicContact CG-CZ2 3.79Å; E1120-W1132 PolarHBondContact OE1-NE1 3.04Å; E1120-R1136 VanDerWaalsContact CD-NE 3.3Å; E1120-R1136 VanDerWaalsContact OE1-CD 3.28Å; E1120-R1136 WeakPolarHBondContact OE1-CD 3.34Å; E1120-R1136 WeakPolarHBondContact OE1-CG 3.24Å; E1120-R1136 IonicContact OE1-CZ 3.1Å; E1120-R1136 IonicContact OE1-NE 3.7Å; E1120-R1136 PolarHBondContact OE1-NE 3.06Å; E1120-R1136 IonicContact OE1-NH2 3.07Å; E1120-R1136 IonicContact OE2-CZ 3.2Å; E1120-R1136 VanDerWaalsContact OE2-CZ 3.25Å; E1120-R1136 IonicContact OE2-NE 3.15Å; E1120-R1136 PolarHBondContact OE2-NE 3.13Å; E1120-R1136 VanDerWaalsContact OE2-NE 3.11Å; E1120-R1136 IonicContact OE2-NH2 3.27Å; E1120-R1136 PolarHBondContact OE2-NH2 3.03Å; E1120-W1139 HydrophobicContact CB-CH2 3.93Å; E1120-W1139 HydrophobicContact CB-CZ3 3.75Å; E1120-W1139 HydrophobicContact CG-CE3 4.33Å; E1120-W1139 HydrophobicContact CG-CH2 4.18Å; E1120-W1139 HydrophobicContact CG-CZ3 3.71Å; E1120-L1159 HydrophobicContact CB-CD1 4.4Å; E1120-L1159 HydrophobicContact CG-CD1 3.92Å
1121	S	83.2	Confident	83.1	Confident	22.6 Å²	22.6	42.6 Å²	42.6	16%	0.158	24%	0.243	C	C	.	.	H	α-helix	trans	-68.3	-22.1	-176	71.6	0	0	0	0	114.5	C890 V901 N903 E904 C1117 H1118 F1119 I1123	C890-S1121 PolarHBondContact SG-OG 3.33Å; V901-S1121 VanDerWaalsContact CG1-CB 3.42Å; N903-S1121 VanDerWaalsContact OD1-CA 3.28Å; N903-S1121 WeakPolarHBondContact OD1-CA 3.43Å; N903-S1121 WeakPolarHBondContact OD1-CB 3.3Å; E904-S1121 PolarHBondContact N-O 3.03Å; C1117-S1121 WeakPolarHBondContact O-CB 3.44Å; C1117-S1121 PolarHBondContact O-N 3.27Å; C1117-S1121 VanDerWaalsContact O-N 3.12Å; C1117-S1121 PolarHBondContact O-OG 3.39Å; C1117-S1121 VanDerWaalsContact O-OG 3.09Å; H1118-S1121 VanDerWaalsContact C-OG 3.3Å; H1118-S1121 VanDerWaalsContact CA-OG 3.24Å; H1118-S1121 WeakPolarHBondContact CA-OG 3.36Å; H1118-S1121 WeakPolarHBondContact O-CB 3.36Å; H1118-S1121 PolarHBondContact O-N 3.03Å; H1118-S1121 VanDerWaalsContact O-N 3.11Å; H1118-S1121 PolarHBondContact O-OG 3.13Å; F1119-S1121 VanDerWaalsContact C-N 3.31Å; F1119-S1121 PolarHBondContact O-N 2.95Å; S1121-I1123 VanDerWaalsContact C-N 3.35Å
1122	K	80.8	Confident	83.8	Confident	70 Å²	70	42.1 Å²	42.1	30%	0.304	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-11	178.1	-67.8	-66.6	-175.6	176.1	0	113.7	S889 C890 L1057 M1061 H1118 F1119 E1120 P1124	S889-K1122 PolarHBondContact OG-NZ 2.79Å; C890-K1122 HydrophobicContact CB-CD 3.95Å; C890-K1122 HydrophobicContact CB-CG 4.47Å; L1057-K1122 VanDerWaalsContact CD1-NZ 3.25Å; L1057-K1122 HydrophobicContact CD2-CD 3.65Å; L1057-K1122 HydrophobicContact CD2-CG 4.06Å; M1061-K1122 HydrophobicContact CE-CB 3.85Å; M1061-K1122 HydrophobicContact CE-CD 4.28Å; M1061-K1122 HydrophobicContact CE-CG 3.94Å; M1061-K1122 HydrophobicContact CG-CB 4.42Å; H1118-K1122 WeakPolarHBondContact CE1-CE 3.41Å; H1118-K1122 WeakPolarHBondContact NE2-CE 3.35Å; H1118-K1122 WeakPolarHBondContact O-CG 3.28Å; H1118-K1122 PolarHBondContact O-N 2.99Å; H1118-K1122 VanDerWaalsContact O-N 3.09Å; F1119-K1122 PolarHBondContact O-N 3.1Å; E1120-K1122 VanDerWaalsContact C-N 3.27Å; E1120-K1122 PolarHBondContact O-N 3.19Å; K1122-P1124 WeakPolarHBondContact O-CD 3.35Å
1123	I	83.1	Confident	83.9	Confident	28.8 Å²	28.8	47.7 Å²	47.7	15%	0.148	26%	0.257	C	S	.	.	S	Bend	trans	-91.3	119.9	176.7	-62.2	170.1	0	0	0	108.6	M1061 F1119 E1120 S1121 L1125 F1127 Y1128 I1163	M1061-I1123 HydrophobicContact CE-CG1 4.15Å; F1119-I1123 HydrophobicContact CD1-CD1 4.21Å; F1119-I1123 HydrophobicContact CE1-CD1 3.78Å; F1119-I1123 HydrophobicContact CE2-CD1 4.42Å; F1119-I1123 HydrophobicContact CZ-CD1 3.94Å; F1119-I1123 WeakPolarHBondContact O-CG1 3.47Å; F1119-I1123 PolarHBondContact O-N 3.09Å; E1120-I1123 PolarHBondContact O-N 3.29Å; S1121-I1123 VanDerWaalsContact C-N 3.35Å; I1123-L1125 PolarHBondContact O-N 3.11Å; I1123-F1127 HydrophobicContact CG2-CB 3.94Å; I1123-F1127 HydrophobicContact CG2-CD2 4.3Å; I1123-F1127 HydrophobicContact CG2-CG 4.49Å; I1123-Y1128 HydrophobicContact CB-CE2 3.76Å; I1123-Y1128 WeakPolarHBondContact CB-OH 3.39Å; I1123-Y1128 WeakPolarHBondContact CD1-OH 3.41Å; I1123-Y1128 HydrophobicContact CG2-CD2 4.17Å; I1123-Y1128 HydrophobicContact CG2-CE2 3.46Å; I1123-Y1128 VanDerWaalsContact CG2-CE2 3.42Å; I1123-Y1128 WeakPolarHBondContact O-CE2 3.17Å; I1123-I1163 HydrophobicContact CD1-CD1 3.95Å
1124	P	83	Confident	83.9	Confident	55.6 Å²	55.6	49.7 Å²	49.7	36%	0.361	28%	0.28	S	S	.	.			trans	-55.9	138.8	177.1	-28.9	34.4	0	0	0	113	E904 K1122 A1126 F1127	E904-P1124 WeakPolarHBondContact OE2-CG 3.47Å; K1122-P1124 WeakPolarHBondContact O-CD 3.35Å; P1124-A1126 PolarHBondContact O-N 2.86Å; P1124-F1127 HydrophobicContact CB-CD2 3.9Å; P1124-F1127 HydrophobicContact CB-CE2 4.06Å; P1124-F1127 HydrophobicContact CG-CD2 4.04Å; P1124-F1127 HydrophobicContact CG-CE2 3.9Å; P1124-F1127 PolarHBondContact O-N 3.06Å
1125	L	81.6	Confident	84.3	Confident	58.2 Å²	58.2	51.8 Å²	51.8	31%	0.305	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-57.1	-20.6	-176.7	-92.1	136.5	0	0	0	114.1	D905 V907 I1123 F1127 Y1128 R1133	D905-L1125 HydrophobicContact CB-CD1 4.16Å; D905-L1125 VanDerWaalsContact OD2-CB 3.29Å; D905-L1125 WeakPolarHBondContact OD2-CB 3.38Å; D905-L1125 WeakPolarHBondContact OD2-CD1 3.43Å; D905-L1125 WeakPolarHBondContact OD2-CG 3.42Å; D905-L1125 PolarHBondContact OD2-N 3.08Å; V907-L1125 HydrophobicContact CG2-CD1 4.44Å; I1123-L1125 PolarHBondContact O-N 3.11Å; L1125-F1127 PolarHBondContact O-N 3.13Å; L1125-Y1128 HydrophobicContact CD1-CD2 4.37Å; L1125-Y1128 HydrophobicContact CD2-CD2 4.47Å; L1125-Y1128 PolarHBondContact O-N 2.98Å; L1125-R1133 HydrophobicContact CD1-CG 4.34Å; L1125-R1133 HydrophobicContact CD2-CG 4.28Å; L1125-R1133 VanDerWaalsContact CD2-NE 3.31Å
1126	A	83.1	Confident	84.8	Confident	69.4 Å²	69.4	52.8 Å²	52.8	57%	0.574	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-66.8	-21.8	175.9	0	0	0	0	0	114.1	P1124 Y1128 R1164	P1124-A1126 PolarHBondContact O-N 2.86Å; A1126-Y1128 VanDerWaalsContact C-N 3.33Å; A1126-R1164 PolarHBondContact O-NE 3.09Å; A1126-R1164 PolarHBondContact O-NH1 3.17Å; A1126-R1164 VanDerWaalsContact O-NH1 3.15Å; A1126-R1164 PolarHBondContact O-NH2 2.98Å
1127	F	86.2	Confident	84.8	Confident	86 Å²	86	55.4 Å²	55.4	38%	0.377	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-86.2	-6.2	178.7	-66.5	-59.3	0	0	0	114	I1123 P1124 L1125 R1164 V1166 C1167 W1172	I1123-F1127 HydrophobicContact CG2-CB 3.94Å; I1123-F1127 HydrophobicContact CG2-CD2 4.3Å; I1123-F1127 HydrophobicContact CG2-CG 4.49Å; P1124-F1127 HydrophobicContact CB-CD2 3.9Å; P1124-F1127 HydrophobicContact CB-CE2 4.06Å; P1124-F1127 HydrophobicContact CG-CD2 4.04Å; P1124-F1127 HydrophobicContact CG-CE2 3.9Å; P1124-F1127 PolarHBondContact O-N 3.06Å; L1125-F1127 PolarHBondContact O-N 3.13Å; F1127-R1164 VanDerWaalsContact O-CB 3.3Å; F1127-R1164 WeakPolarHBondContact O-CB 3.22Å; F1127-R1164 WeakPolarHBondContact O-CG 3.13Å; F1127-R1164 PolarHBondContact O-N 3.15Å; F1127-V1166 WeakPolarHBondContact O-CB 3.36Å; F1127-C1167 VanDerWaalsContact CD1-SG 3.56Å; F1127-W1172 HydrophobicContact CD1-CE3 4.25Å; F1127-W1172 AromaticContact CD1-CH2 3.94Å; F1127-W1172 HydrophobicContact CD1-CH2 3.94Å; F1127-W1172 AromaticContact CD1-CZ3 3.5Å; F1127-W1172 HydrophobicContact CD1-CZ3 3.5Å; F1127-W1172 VanDerWaalsContact CD1-CZ3 3.5Å; F1127-W1172 HydrophobicContact CE1-CD2 4.31Å; F1127-W1172 HydrophobicContact CE1-CE3 4.31Å; F1127-W1172 HydrophobicContact CE1-CH2 4.02Å; F1127-W1172 AromaticContact CE1-CZ3 3.76Å; F1127-W1172 HydrophobicContact CE1-CZ3 3.76Å
1128	Y	88.9	Confident	85.1	Confident	5.2 Å²	5.2	58.8 Å²	58.8	2%	0.02	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-96	157.6	177.4	-67.2	-83.9	0	0	0	112.6	E1120 I1123 L1125 A1126 W1132 L1159 S1162 I1163 R1164	E1120-Y1128 WeakPolarHBondContact CA-OH 3.4Å; E1120-Y1128 WeakPolarHBondContact CG-OH 3.38Å; E1120-Y1128 PolarHBondContact O-OH 3.03Å; I1123-Y1128 HydrophobicContact CB-CE2 3.76Å; I1123-Y1128 WeakPolarHBondContact CB-OH 3.39Å; I1123-Y1128 WeakPolarHBondContact CD1-OH 3.41Å; I1123-Y1128 HydrophobicContact CG2-CD2 4.17Å; I1123-Y1128 HydrophobicContact CG2-CE2 3.46Å; I1123-Y1128 VanDerWaalsContact CG2-CE2 3.42Å; I1123-Y1128 WeakPolarHBondContact O-CE2 3.17Å; L1125-Y1128 HydrophobicContact CD1-CD2 4.37Å; L1125-Y1128 HydrophobicContact CD2-CD2 4.47Å; L1125-Y1128 PolarHBondContact O-N 2.98Å; A1126-Y1128 VanDerWaalsContact C-N 3.33Å; Y1128-W1132 HydrophobicContact CD1-CB 4.34Å; Y1128-W1132 AromaticContact CD1-CD1 3.66Å; Y1128-W1132 AromaticContact CD1-CD2 3.94Å; Y1128-W1132 HydrophobicContact CD1-CD2 3.95Å; Y1128-W1132 AromaticContact CD1-CE2 3.95Å; Y1128-W1132 AromaticContact CD1-CG 3.74Å; Y1128-W1132 HydrophobicContact CD1-CG 3.74Å; Y1128-W1132 AromaticContact CD1-NE1 3.85Å; Y1128-W1132 AromaticContact CD2-CD1 3.9Å; Y1128-W1132 AromaticContact CE1-CD1 3.93Å; Y1128-W1132 HydrophobicContact CE1-CD2 4.27Å; Y1128-W1132 AromaticContact CE1-CE2 3.85Å; Y1128-W1132 HydrophobicContact CE1-CG 4.39Å; Y1128-W1132 HydrophobicContact CE1-CZ2 4.34Å; Y1128-W1132 AromaticContact CE1-NE1 3.79Å; Y1128-W1132 HydrophobicContact CG-CB 4.24Å; Y1128-W1132 AromaticContact CG-CD1 3.54Å; Y1128-W1132 VanDerWaalsContact CG-CD1 3.47Å; Y1128-W1132 HydrophobicContact CG-CD2 4.49Å; Y1128-W1132 AromaticContact CG-CG 3.86Å; Y1128-W1132 HydrophobicContact CG-CG 3.86Å; Y1128-W1132 AromaticContact CZ-NE1 3.86Å; Y1128-L1159 HydrophobicContact CE1-CD1 3.82Å; Y1128-S1162 CarbonylContact C-O 3.56Å; Y1128-S1162 WeakPolarHBondContact CA-O 3.09Å; Y1128-S1162 WeakPolarHBondContact CD1-OG 3.41Å; Y1128-I1163 HydrophobicContact CD1-CD1 4.37Å; Y1128-I1163 HydrophobicContact CD1-CG1 3.82Å; Y1128-I1163 HydrophobicContact CE1-CD1 4.18Å; Y1128-I1163 HydrophobicContact CE1-CG1 3.53Å; Y1128-I1163 VanDerWaalsContact CE1-CG1 3.43Å; Y1128-I1163 HydrophobicContact CG-CG1 4.44Å; Y1128-R1164 VanDerWaalsContact O-CZ 3.26Å; Y1128-R1164 PolarHBondContact O-NE 3.04Å; Y1128-R1164 PolarHBondContact O-NH2 3.14Å; Y1128-R1164 VanDerWaalsContact O-NH2 3.14Å
1129	T	89.2	Confident	85.7	Confident	43.6 Å²	43.6	57.7 Å²	57.7	27%	0.267	32%	0.318	S	S	.	.			trans	-58.4	146	165	54.8	0	0	0	0	110.8	A1131 W1132 S1162 S1165 V1166	T1129-A1131 PolarHBondContact O-N 3.18Å; T1129-A1131 VanDerWaalsContact O-N 3.09Å; T1129-W1132 VanDerWaalsContact O-CB 3.24Å; T1129-W1132 WeakPolarHBondContact O-CB 3.42Å; T1129-W1132 PolarHBondContact O-N 3.06Å; T1129-S1162 WeakPolarHBondContact CG2-O 3.37Å; T1129-S1162 PolarHBondContact N-O 3.08Å; T1129-S1162 PolarHBondContact OG1-O 3.06Å; T1129-S1162 VanDerWaalsContact OG1-O 3.12Å; T1129-S1165 WeakPolarHBondContact CG2-OG 3.19Å; T1129-V1166 HydrophobicContact CG2-CG2 4.35Å
1130	P	85.3	Confident	86	Confident	103.2 Å²	103.2	55 Å²	55	67%	0.67	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-29.4	177.7	-27.5	35.5	0	0	0	114.2	W1132 R1133	P1130-W1132 PolarHBondContact O-N 2.94Å; P1130-W1132 VanDerWaalsContact O-N 3.17Å; P1130-R1133 PolarHBondContact O-N 3.09Å
1131	A	85.6	Confident	86	Confident	52.8 Å²	52.8	59.7 Å²	59.7	44%	0.436	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.2	176.4	0	0	0	0	0	113.7	T1129 R1133 A1134 H1135	T1129-A1131 PolarHBondContact O-N 3.18Å; T1129-A1131 VanDerWaalsContact O-N 3.09Å; A1131-R1133 VanDerWaalsContact C-N 3.26Å; A1131-R1133 PolarHBondContact O-N 3Å; A1131-A1134 PolarHBondContact O-N 3.01Å; A1131-A1134 VanDerWaalsContact O-N 3.07Å; A1131-H1135 PolarHBondContact O-CD2 3.08Å; A1131-H1135 VanDerWaalsContact O-CD2 3.31Å; A1131-H1135 PolarHBondContact O-N 3.07Å
1132	W	89.8	Confident	86.3	Confident	5.2 Å²	5.2	61.4 Å²	61.4	2%	0.02	34%	0.335	C	S	.	.	H	α-helix	trans	-57.1	-38.5	-179.4	-173.7	-118.1	0	0	0	112.4	E1120 Y1128 T1129 P1130 A1134 H1135 R1136 W1139 L1159 S1162	E1120-W1132 HydrophobicContact CG-CZ2 3.79Å; E1120-W1132 PolarHBondContact OE1-NE1 3.04Å; Y1128-W1132 HydrophobicContact CD1-CB 4.34Å; Y1128-W1132 AromaticContact CD1-CD1 3.66Å; Y1128-W1132 AromaticContact CD1-CD2 3.94Å; Y1128-W1132 HydrophobicContact CD1-CD2 3.95Å; Y1128-W1132 AromaticContact CD1-CE2 3.95Å; Y1128-W1132 AromaticContact CD1-CG 3.74Å; Y1128-W1132 HydrophobicContact CD1-CG 3.74Å; Y1128-W1132 AromaticContact CD1-NE1 3.85Å; Y1128-W1132 AromaticContact CD2-CD1 3.9Å; Y1128-W1132 AromaticContact CE1-CD1 3.93Å; Y1128-W1132 HydrophobicContact CE1-CD2 4.27Å; Y1128-W1132 AromaticContact CE1-CE2 3.85Å; Y1128-W1132 HydrophobicContact CE1-CG 4.39Å; Y1128-W1132 HydrophobicContact CE1-CZ2 4.34Å; Y1128-W1132 AromaticContact CE1-NE1 3.79Å; Y1128-W1132 HydrophobicContact CG-CB 4.24Å; Y1128-W1132 AromaticContact CG-CD1 3.54Å; Y1128-W1132 VanDerWaalsContact CG-CD1 3.47Å; Y1128-W1132 HydrophobicContact CG-CD2 4.49Å; Y1128-W1132 AromaticContact CG-CG 3.86Å; Y1128-W1132 HydrophobicContact CG-CG 3.86Å; Y1128-W1132 AromaticContact CZ-NE1 3.86Å; T1129-W1132 VanDerWaalsContact O-CB 3.24Å; T1129-W1132 WeakPolarHBondContact O-CB 3.42Å; T1129-W1132 PolarHBondContact O-N 3.06Å; P1130-W1132 PolarHBondContact O-N 2.94Å; P1130-W1132 VanDerWaalsContact O-N 3.17Å; W1132-A1134 PolarHBondContact O-N 3.13Å; W1132-A1134 VanDerWaalsContact O-N 3.11Å; W1132-H1135 PolarHBondContact O-N 3.18Å; W1132-R1136 HydrophobicContact CD2-CB 4.48Å; W1132-R1136 HydrophobicContact CZ2-CB 4.49Å; W1132-R1136 HydrophobicContact CZ2-CG 4.42Å; W1132-R1136 VanDerWaalsContact O-CB 3.3Å; W1132-R1136 WeakPolarHBondContact O-CB 3.4Å; W1132-R1136 PolarHBondContact O-N 3.15Å; W1132-W1139 HydrophobicContact CH2-CB 4.03Å; W1132-W1139 AromaticContact CH2-CD1 3.92Å; W1132-W1139 AromaticContact CH2-CD2 3.61Å; W1132-W1139 HydrophobicContact CH2-CD2 3.61Å; W1132-W1139 AromaticContact CH2-CE2 3.97Å; W1132-W1139 AromaticContact CH2-CE3 3.96Å; W1132-W1139 HydrophobicContact CH2-CE3 4.05Å; W1132-W1139 AromaticContact CH2-CG 3.58Å; W1132-W1139 HydrophobicContact CH2-CG 3.58Å; W1132-W1139 AromaticContact CH2-NE1 4Å; W1132-W1139 HydrophobicContact CZ2-CD2 4.11Å; W1132-W1139 AromaticContact CZ2-CE3 3.99Å; W1132-W1139 HydrophobicContact CZ2-CE3 4.07Å; W1132-W1139 HydrophobicContact CZ2-CG 4.39Å; W1132-W1139 HydrophobicContact CZ2-CZ3 4.48Å; W1132-W1139 HydrophobicContact CZ3-CB 4.41Å; W1132-W1139 HydrophobicContact CZ3-CG 4.28Å; W1132-L1159 HydrophobicContact CH2-CB 4.48Å; W1132-L1159 HydrophobicContact CH2-CD1 3.49Å; W1132-L1159 VanDerWaalsContact CH2-CD1 3.47Å; W1132-L1159 HydrophobicContact CZ2-CD1 3.46Å; W1132-L1159 VanDerWaalsContact CZ2-CD1 3.45Å; W1132-L1159 HydrophobicContact CZ3-CD1 4.39Å; W1132-S1162 VanDerWaalsContact CE3-OG 3.27Å; W1132-S1162 VanDerWaalsContact CZ3-OG 3.31Å; W1132-S1162 WeakPolarHBondContact CZ3-OG 3.31Å
1133	R	83	Confident	86.7	Confident	182 Å²	182	58 Å²	58	69%	0.687	32%	0.32	S	S	*	.	H	α-helix	trans	-56.1	-33.4	178	-67.1	-176.1	178.2	153.7	-1.3	113.4	L1125 P1130 A1131 H1135	L1125-R1133 HydrophobicContact CD1-CG 4.34Å; L1125-R1133 HydrophobicContact CD2-CG 4.28Å; L1125-R1133 VanDerWaalsContact CD2-NE 3.31Å; P1130-R1133 PolarHBondContact O-N 3.09Å; A1131-R1133 VanDerWaalsContact C-N 3.26Å; A1131-R1133 PolarHBondContact O-N 3Å; R1133-H1135 VanDerWaalsContact C-N 3.3Å; R1133-H1135 PolarHBondContact O-N 2.88Å
1134	A	84.4	Confident	86.8	Confident	71.2 Å²	71.2	59 Å²	59	59%	0.588	33%	0.325	S	S	*	.	H	α-helix	trans	-83.2	-21.1	179.1	0	0	0	0	0	113.3	A1131 W1132	A1131-A1134 PolarHBondContact O-N 3.01Å; A1131-A1134 VanDerWaalsContact O-N 3.07Å; W1132-A1134 PolarHBondContact O-N 3.13Å; W1132-A1134 VanDerWaalsContact O-N 3.11Å
1135	H	86.1	Confident	86.9	Confident	83 Å²	83	63.3 Å²	63.3	38%	0.384	33%	0.334	S	S	.	.	H	α-helix	trans	-105.3	-21.4	-176.4	-64.6	-43.7	0	0	0	114	A1131 W1132 R1133 T1137 N1138 W1139	A1131-H1135 PolarHBondContact O-CD2 3.08Å; A1131-H1135 VanDerWaalsContact O-CD2 3.31Å; A1131-H1135 PolarHBondContact O-N 3.07Å; W1132-H1135 PolarHBondContact O-N 3.18Å; R1133-H1135 VanDerWaalsContact C-N 3.3Å; R1133-H1135 PolarHBondContact O-N 2.88Å; H1135-T1137 VanDerWaalsContact C-N 3.32Å; H1135-T1137 PolarHBondContact O-N 3.11Å; H1135-N1138 PolarHBondContact O-N 3.11Å; H1135-N1138 VanDerWaalsContact O-N 3.13Å; H1135-W1139 WeakPolarHBondContact O-CB 3.37Å; H1135-W1139 PolarHBondContact O-N 3.14Å
1136	R	88.8	Confident	87	Confident	44.2 Å²	44.2	60.8 Å²	60.8	17%	0.167	32%	0.321	C	S	.	.	H	α-helix	trans	-51.7	-49.9	-175.5	-177.6	179.4	-176	-99.9	-9.2	112.8	N903 T909 E1120 W1132 N1138 W1139 I1140	N903-R1136 VanDerWaalsContact CG-NH2 3.3Å; N903-R1136 PolarHBondContact ND2-NE 2.88Å; N903-R1136 PolarHBondContact ND2-NH2 3Å; N903-R1136 PolarHBondContact OD1-NH2 2.84Å; T909-R1136 PolarHBondContact OG1-NH1 2.98Å; E1120-R1136 VanDerWaalsContact CD-NE 3.3Å; E1120-R1136 VanDerWaalsContact OE1-CD 3.28Å; E1120-R1136 WeakPolarHBondContact OE1-CD 3.34Å; E1120-R1136 WeakPolarHBondContact OE1-CG 3.24Å; E1120-R1136 IonicContact OE1-CZ 3.1Å; E1120-R1136 IonicContact OE1-NE 3.7Å; E1120-R1136 PolarHBondContact OE1-NE 3.06Å; E1120-R1136 IonicContact OE1-NH2 3.07Å; E1120-R1136 IonicContact OE2-CZ 3.2Å; E1120-R1136 VanDerWaalsContact OE2-CZ 3.25Å; E1120-R1136 IonicContact OE2-NE 3.15Å; E1120-R1136 PolarHBondContact OE2-NE 3.13Å; E1120-R1136 VanDerWaalsContact OE2-NE 3.11Å; E1120-R1136 IonicContact OE2-NH2 3.27Å; E1120-R1136 PolarHBondContact OE2-NH2 3.03Å; W1132-R1136 HydrophobicContact CD2-CB 4.48Å; W1132-R1136 HydrophobicContact CZ2-CB 4.49Å; W1132-R1136 HydrophobicContact CZ2-CG 4.42Å; W1132-R1136 VanDerWaalsContact O-CB 3.3Å; W1132-R1136 WeakPolarHBondContact O-CB 3.4Å; W1132-R1136 PolarHBondContact O-N 3.15Å; R1136-N1138 VanDerWaalsContact C-N 3.28Å; R1136-N1138 PolarHBondContact O-N 3.03Å; R1136-W1139 WeakPolarHBondContact O-CB 3.31Å; R1136-W1139 PolarHBondContact O-N 3.23Å; R1136-W1139 VanDerWaalsContact O-N 3.1Å; R1136-I1140 HydrophobicContact CG-CD1 3.99Å; R1136-I1140 HydrophobicContact CG-CG1 4.46Å; R1136-I1140 VanDerWaalsContact CZ-CD1 3.47Å; R1136-I1140 VanDerWaalsContact O-CG1 3.31Å; R1136-I1140 WeakPolarHBondContact O-CG1 3.42Å; R1136-I1140 PolarHBondContact O-N 3.05Å
1137	T	86.4	Confident	87	Confident	72.8 Å²	72.8	64.5 Å²	64.5	45%	0.447	32%	0.324	S	S	.	.	H	α-helix	trans	-62.4	-36.3	-179.3	14	0	0	0	0	112.6	M911 H1135 W1139 I1140 K1141	M911-T1137 HydrophobicContact CE-CG2 4.42Å; M911-T1137 WeakPolarHBondContact CE-O 3.43Å; M911-T1137 HydrophobicContact SD-CG2 4.01Å; H1135-T1137 VanDerWaalsContact C-N 3.32Å; H1135-T1137 PolarHBondContact O-N 3.11Å; T1137-W1139 VanDerWaalsContact C-N 3.31Å; T1137-W1139 PolarHBondContact O-N 2.98Å; T1137-I1140 PolarHBondContact O-N 3.09Å; T1137-K1141 VanDerWaalsContact O-CD 3.29Å; T1137-K1141 WeakPolarHBondContact O-CD 3.44Å; T1137-K1141 WeakPolarHBondContact O-CE 3.4Å; T1137-K1141 VanDerWaalsContact O-CG 3.25Å; T1137-K1141 WeakPolarHBondContact O-CG 3.37Å; T1137-K1141 PolarHBondContact O-N 3.09Å; T1137-K1141 VanDerWaalsContact O-N 3.11Å
1138	N	88.6	Confident	86.7	Confident	81.2 Å²	81.2	62.1 Å²	62.1	43%	0.434	32%	0.319	S	S	.	.	H	α-helix	trans	-75.5	-40	175.6	-67.1	-19.8	0	0	0	111.1	H1135 R1136 I1140 K1141 D1142	H1135-N1138 PolarHBondContact O-N 3.11Å; H1135-N1138 VanDerWaalsContact O-N 3.13Å; R1136-N1138 VanDerWaalsContact C-N 3.28Å; R1136-N1138 PolarHBondContact O-N 3.03Å; N1138-I1140 VanDerWaalsContact C-N 3.34Å; N1138-I1140 PolarHBondContact O-N 3.27Å; N1138-K1141 CarbonylContact O-C 3.5Å; N1138-K1141 WeakPolarHBondContact O-CA 3.48Å; N1138-K1141 VanDerWaalsContact O-CB 3.26Å; N1138-K1141 WeakPolarHBondContact O-CB 3.36Å; N1138-K1141 PolarHBondContact O-N 3.26Å; N1138-K1141 VanDerWaalsContact O-N 3.15Å; N1138-D1142 WeakPolarHBondContact O-CB 3.4Å; N1138-D1142 VanDerWaalsContact O-CG 3.24Å; N1138-D1142 PolarHBondContact O-N 3.17Å
1139	W	92.4	Very high	86.4	Confident	0.2 Å²	0.2	66 Å²	66	0%	0.001	34%	0.344	C	S	.	.	H	α-helix	trans	-60.4	-44.2	176.2	-179.3	87.9	0	0	0	112	L1116 E1120 W1132 H1135 R1136 T1137 K1141 D1142 V1143 L1155 L1159	L1116-W1139 HydrophobicContact CB-CH2 4.4Å; L1116-W1139 HydrophobicContact CD1-CH2 4.12Å; L1116-W1139 HydrophobicContact CD1-CZ2 4.08Å; L1116-W1139 HydrophobicContact CD2-CH2 4.28Å; L1116-W1139 HydrophobicContact CD2-CZ2 3.94Å; L1116-W1139 HydrophobicContact CG-CH2 3.7Å; L1116-W1139 HydrophobicContact CG-CZ2 3.8Å; E1120-W1139 HydrophobicContact CB-CH2 3.93Å; E1120-W1139 HydrophobicContact CB-CZ3 3.75Å; E1120-W1139 HydrophobicContact CG-CE3 4.33Å; E1120-W1139 HydrophobicContact CG-CH2 4.18Å; E1120-W1139 HydrophobicContact CG-CZ3 3.71Å; W1132-W1139 HydrophobicContact CH2-CB 4.03Å; W1132-W1139 AromaticContact CH2-CD1 3.92Å; W1132-W1139 AromaticContact CH2-CD2 3.61Å; W1132-W1139 HydrophobicContact CH2-CD2 3.61Å; W1132-W1139 AromaticContact CH2-CE2 3.97Å; W1132-W1139 AromaticContact CH2-CE3 3.96Å; W1132-W1139 HydrophobicContact CH2-CE3 4.05Å; W1132-W1139 AromaticContact CH2-CG 3.58Å; W1132-W1139 HydrophobicContact CH2-CG 3.58Å; W1132-W1139 AromaticContact CH2-NE1 4Å; W1132-W1139 HydrophobicContact CZ2-CD2 4.11Å; W1132-W1139 AromaticContact CZ2-CE3 3.99Å; W1132-W1139 HydrophobicContact CZ2-CE3 4.07Å; W1132-W1139 HydrophobicContact CZ2-CG 4.39Å; W1132-W1139 HydrophobicContact CZ2-CZ3 4.48Å; W1132-W1139 HydrophobicContact CZ3-CB 4.41Å; W1132-W1139 HydrophobicContact CZ3-CG 4.28Å; H1135-W1139 WeakPolarHBondContact O-CB 3.37Å; H1135-W1139 PolarHBondContact O-N 3.14Å; R1136-W1139 WeakPolarHBondContact O-CB 3.31Å; R1136-W1139 PolarHBondContact O-N 3.23Å; R1136-W1139 VanDerWaalsContact O-N 3.1Å; T1137-W1139 VanDerWaalsContact C-N 3.31Å; T1137-W1139 PolarHBondContact O-N 2.98Å; W1139-K1141 VanDerWaalsContact C-N 3.3Å; W1139-K1141 PolarHBondContact O-N 3.27Å; W1139-D1142 PolarHBondContact O-N 3.18Å; W1139-D1142 VanDerWaalsContact O-N 3.15Å; W1139-V1143 HydrophobicContact CD2-CG2 3.92Å; W1139-V1143 HydrophobicContact CE3-CG2 4.1Å; W1139-V1143 HydrophobicContact CH2-CG2 3.95Å; W1139-V1143 HydrophobicContact CZ2-CG2 3.74Å; W1139-V1143 HydrophobicContact CZ3-CG2 4.11Å; W1139-V1143 WeakPolarHBondContact O-CB 3.35Å; W1139-V1143 VanDerWaalsContact O-CG2 3.31Å; W1139-V1143 WeakPolarHBondContact O-CG2 3.34Å; W1139-V1143 PolarHBondContact O-N 3.22Å; W1139-L1155 PolarHBondContact NE1-O 3.04Å; W1139-L1159 HydrophobicContact CH2-CD1 4.19Å; W1139-L1159 HydrophobicContact CH2-CD2 4.04Å; W1139-L1159 HydrophobicContact CH2-CG 4.47Å; W1139-L1159 HydrophobicContact CZ2-CB 3.83Å; W1139-L1159 HydrophobicContact CZ2-CD1 4.04Å; W1139-L1159 HydrophobicContact CZ2-CD2 3.87Å; W1139-L1159 HydrophobicContact CZ2-CG 4.13Å
1140	I	88.8	Confident	86.1	Confident	18.2 Å²	18.2	68 Å²	68	9%	0.093	36%	0.361	C	S	.	.	H	α-helix	trans	-61.6	-41.4	175.1	-63.7	170.4	0	0	0	110.7	T909 M911 R1136 T1137 N1138 D1142 V1143 I1144	T909-I1140 HydrophobicContact CG2-CD1 4.16Å; M911-I1140 HydrophobicContact CB-CG2 4.42Å; M911-I1140 HydrophobicContact CE-CB 4Å; M911-I1140 HydrophobicContact CE-CG2 4.04Å; M911-I1140 HydrophobicContact CG-CB 4.37Å; M911-I1140 HydrophobicContact CG-CG2 3.75Å; M911-I1140 HydrophobicContact SD-CG2 4.31Å; R1136-I1140 HydrophobicContact CG-CD1 3.99Å; R1136-I1140 HydrophobicContact CG-CG1 4.46Å; R1136-I1140 VanDerWaalsContact CZ-CD1 3.47Å; R1136-I1140 VanDerWaalsContact O-CG1 3.31Å; R1136-I1140 WeakPolarHBondContact O-CG1 3.42Å; R1136-I1140 PolarHBondContact O-N 3.05Å; T1137-I1140 PolarHBondContact O-N 3.09Å; N1138-I1140 VanDerWaalsContact C-N 3.34Å; N1138-I1140 PolarHBondContact O-N 3.27Å; I1140-D1142 VanDerWaalsContact C-N 3.32Å; I1140-D1142 PolarHBondContact O-N 3.13Å; I1140-V1143 PolarHBondContact O-N 2.99Å; I1140-I1144 HydrophobicContact CG2-CD1 3.86Å; I1140-I1144 WeakPolarHBondContact O-CD1 3.21Å; I1140-I1144 VanDerWaalsContact O-CG1 3.3Å; I1140-I1144 WeakPolarHBondContact O-CG1 3.37Å; I1140-I1144 PolarHBondContact O-N 3.14Å
1141	K	87.3	Confident	86.3	Confident	101 Å²	101	66.5 Å²	66.5	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-61.3	-43.4	175.3	-84.7	174.2	-177.1	178.9	0	111.6	M911 T1137 N1138 W1139 V1143 I1144 R1145	M911-K1141 VanDerWaalsContact CE-CA 3.49Å; M911-K1141 HydrophobicContact CE-CB 3.49Å; M911-K1141 HydrophobicContact CE-CD 4.15Å; M911-K1141 HydrophobicContact CE-CG 3.36Å; M911-K1141 VanDerWaalsContact CE-CG 3.43Å; M911-K1141 HydrophobicContact CG-CG 4.33Å; M911-K1141 HydrophobicContact SD-CD 4.08Å; M911-K1141 WeakPolarHBondContact SD-CE 3.37Å; M911-K1141 HydrophobicContact SD-CG 3.84Å; M911-K1141 WeakPolarHBondContact SD-CG 3.37Å; T1137-K1141 VanDerWaalsContact O-CD 3.29Å; T1137-K1141 WeakPolarHBondContact O-CD 3.44Å; T1137-K1141 WeakPolarHBondContact O-CE 3.4Å; T1137-K1141 VanDerWaalsContact O-CG 3.25Å; T1137-K1141 WeakPolarHBondContact O-CG 3.37Å; T1137-K1141 PolarHBondContact O-N 3.09Å; T1137-K1141 VanDerWaalsContact O-N 3.11Å; N1138-K1141 CarbonylContact O-C 3.5Å; N1138-K1141 WeakPolarHBondContact O-CA 3.48Å; N1138-K1141 VanDerWaalsContact O-CB 3.26Å; N1138-K1141 WeakPolarHBondContact O-CB 3.36Å; N1138-K1141 PolarHBondContact O-N 3.26Å; N1138-K1141 VanDerWaalsContact O-N 3.15Å; W1139-K1141 VanDerWaalsContact C-N 3.3Å; W1139-K1141 PolarHBondContact O-N 3.27Å; K1141-V1143 VanDerWaalsContact C-N 3.32Å; K1141-V1143 PolarHBondContact O-N 3.26Å; K1141-I1144 PolarHBondContact O-N 3.03Å; K1141-R1145 WeakPolarHBondContact O-CB 3.42Å; K1141-R1145 WeakPolarHBondContact O-CD 3.25Å; K1141-R1145 VanDerWaalsContact O-CG 3.3Å; K1141-R1145 WeakPolarHBondContact O-CG 3.38Å; K1141-R1145 PolarHBondContact O-N 3.22Å; K1141-R1145 VanDerWaalsContact O-N 3.09Å
1142	D	90.1	Very high	86.4	Confident	57 Å²	57	64.6 Å²	64.6	31%	0.305	33%	0.329	S	S	.	.	H	α-helix	trans	-67.1	-38.8	179.2	-62.5	-23.6	0	0	0	110.9	N1138 W1139 I1140 R1145 S1146 L1155 R1158	N1138-D1142 WeakPolarHBondContact O-CB 3.4Å; N1138-D1142 VanDerWaalsContact O-CG 3.24Å; N1138-D1142 PolarHBondContact O-N 3.17Å; W1139-D1142 PolarHBondContact O-N 3.18Å; W1139-D1142 VanDerWaalsContact O-N 3.15Å; I1140-D1142 VanDerWaalsContact C-N 3.32Å; I1140-D1142 PolarHBondContact O-N 3.13Å; D1142-R1145 CarbonylContact O-C 3.51Å; D1142-R1145 PolarHBondContact O-N 3.22Å; D1142-R1145 IonicContact OD1-NH1 2.95Å; D1142-R1145 PolarHBondContact OD1-NH1 2.75Å; D1142-R1145 VanDerWaalsContact OD1-NH1 3.09Å; D1142-S1146 PolarHBondContact O-N 3.19Å; D1142-L1155 VanDerWaalsContact C-CD1 3.49Å; D1142-L1155 HydrophobicContact CB-CD1 4.06Å; D1142-L1155 HydrophobicContact CB-CD2 3.62Å; D1142-L1155 HydrophobicContact CB-CG 4.47Å; D1142-L1155 WeakPolarHBondContact O-CD1 3.23Å; D1142-R1158 IonicContact OD2-NH1 3.2Å; D1142-R1158 PolarHBondContact OD2-NH1 3.29Å
1143	V	88.8	Confident	86.4	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-50.5	174.1	171.1	0	0	0	0	110.5	R1113 L1116 W1139 I1140 K1141 R1145 S1146 L1152 L1155	R1113-V1143 HydrophobicContact CB-CG1 3.93Å; R1113-V1143 WeakPolarHBondContact CD-O 3.32Å; R1113-V1143 HydrophobicContact CG-CG1 4.21Å; R1113-V1143 VanDerWaalsContact CG-O 3.27Å; R1113-V1143 WeakPolarHBondContact CG-O 3.42Å; R1113-V1143 WeakPolarHBondContact O-CG1 3.29Å; L1116-V1143 HydrophobicContact CB-CG1 4.45Å; L1116-V1143 HydrophobicContact CD2-CG1 4.12Å; L1116-V1143 HydrophobicContact CD2-CG2 3.87Å; L1116-V1143 HydrophobicContact CG-CG1 4.42Å; L1116-V1143 HydrophobicContact CG-CG2 4.48Å; W1139-V1143 HydrophobicContact CD2-CG2 3.92Å; W1139-V1143 HydrophobicContact CE3-CG2 4.1Å; W1139-V1143 HydrophobicContact CH2-CG2 3.95Å; W1139-V1143 HydrophobicContact CZ2-CG2 3.74Å; W1139-V1143 HydrophobicContact CZ3-CG2 4.11Å; W1139-V1143 WeakPolarHBondContact O-CB 3.35Å; W1139-V1143 VanDerWaalsContact O-CG2 3.31Å; W1139-V1143 WeakPolarHBondContact O-CG2 3.34Å; W1139-V1143 PolarHBondContact O-N 3.22Å; I1140-V1143 PolarHBondContact O-N 2.99Å; K1141-V1143 VanDerWaalsContact C-N 3.32Å; K1141-V1143 PolarHBondContact O-N 3.26Å; V1143-R1145 VanDerWaalsContact C-N 3.29Å; V1143-R1145 PolarHBondContact O-N 3.11Å; V1143-R1145 VanDerWaalsContact O-N 3.16Å; V1143-S1146 WeakPolarHBondContact O-CB 3.31Å; V1143-S1146 PolarHBondContact O-N 3.11Å; V1143-S1146 VanDerWaalsContact O-N 3.1Å; V1143-S1146 PolarHBondContact O-OG 3.2Å; V1143-L1152 HydrophobicContact CG1-CD1 4.21Å; V1143-L1152 HydrophobicContact CG1-CD2 4.22Å; V1143-L1155 HydrophobicContact CB-CD1 4.39Å; V1143-L1155 HydrophobicContact CG2-CB 4.16Å; V1143-L1155 HydrophobicContact CG2-CD1 3.89Å; V1143-L1155 HydrophobicContact CG2-CG 4.46Å
1144	I	84.8	Confident	86.7	Confident	48.2 Å²	48.2	65.4 Å²	65.4	25%	0.247	35%	0.348	C	S	.	.	H	α-helix	trans	-62.7	-34.7	179.7	-64.4	161.3	0	0	0	111.5	C899 M911 K913 R1113 I1140 K1141	C899-I1144 HydrophobicContact CB-CD1 3.55Å; C899-I1144 VanDerWaalsContact CB-CD1 3.47Å; C899-I1144 HydrophobicContact CB-CG1 4.14Å; C899-I1144 WeakPolarHBondContact SG-CD1 3.09Å; M911-I1144 HydrophobicContact CB-CD1 3.35Å; M911-I1144 VanDerWaalsContact CB-CD1 3.43Å; M911-I1144 HydrophobicContact CE-CD1 3.9Å; M911-I1144 HydrophobicContact CG-CD1 4Å; K913-I1144 HydrophobicContact CB-CG2 4.11Å; K913-I1144 HydrophobicContact CG-CG2 4.37Å; R1113-I1144 WeakPolarHBondContact CD-O 3.5Å; I1140-I1144 HydrophobicContact CG2-CD1 3.86Å; I1140-I1144 WeakPolarHBondContact O-CD1 3.21Å; I1140-I1144 VanDerWaalsContact O-CG1 3.3Å; I1140-I1144 WeakPolarHBondContact O-CG1 3.37Å; I1140-I1144 PolarHBondContact O-N 3.14Å; K1141-I1144 PolarHBondContact O-N 3.03Å
1145	R	85.3	Confident	87.1	Confident	147 Å²	147	62.4 Å²	62.4	56%	0.555	32%	0.323	S	S	*	.	H	α-helix	trans	-80.3	-18.8	179.8	-136.5	177.3	-144.2	168.1	-6.2	114.4	E914 K1141 D1142 V1143 K1147	E914-R1145 IonicContact OE1-NH2 2.81Å; E914-R1145 PolarHBondContact OE1-NH2 3.46Å; E914-R1145 IonicContact OE2-CZ 3.32Å; E914-R1145 IonicContact OE2-NH2 3.56Å; E914-R1145 PolarHBondContact OE2-NH2 2.85Å; K1141-R1145 WeakPolarHBondContact O-CB 3.42Å; K1141-R1145 WeakPolarHBondContact O-CD 3.25Å; K1141-R1145 VanDerWaalsContact O-CG 3.3Å; K1141-R1145 WeakPolarHBondContact O-CG 3.38Å; K1141-R1145 PolarHBondContact O-N 3.22Å; K1141-R1145 VanDerWaalsContact O-N 3.09Å; D1142-R1145 CarbonylContact O-C 3.51Å; D1142-R1145 PolarHBondContact O-N 3.22Å; D1142-R1145 IonicContact OD1-NH1 2.95Å; D1142-R1145 PolarHBondContact OD1-NH1 2.75Å; D1142-R1145 VanDerWaalsContact OD1-NH1 3.09Å; V1143-R1145 VanDerWaalsContact C-N 3.29Å; V1143-R1145 PolarHBondContact O-N 3.11Å; V1143-R1145 VanDerWaalsContact O-N 3.16Å; R1145-K1147 WeakPolarHBondContact O-CG 3.48Å; R1145-K1147 PolarHBondContact O-N 3.11Å; R1145-K1147 VanDerWaalsContact O-N 3.08Å
1146	S	85	Confident	87.4	Confident	4.8 Å²	4.8	62.3 Å²	62.3	3%	0.034	32%	0.324	C	S	.	.			trans	-53.7	121.2	-176.9	63.5	0	0	0	0	111.3	R1113 D1142 V1143 L1152	R1113-S1146 WeakPolarHBondContact CG-OG 3.34Å; R1113-S1146 PolarHBondContact NE-O 3.16Å; R1113-S1146 PolarHBondContact NE-OG 3.19Å; R1113-S1146 VanDerWaalsContact NE-OG 3.08Å; R1113-S1146 PolarHBondContact NH2-O 3.36Å; D1142-S1146 PolarHBondContact O-N 3.19Å; V1143-S1146 WeakPolarHBondContact O-CB 3.31Å; V1143-S1146 PolarHBondContact O-N 3.11Å; V1143-S1146 VanDerWaalsContact O-N 3.1Å; V1143-S1146 PolarHBondContact O-OG 3.2Å; S1146-L1152 VanDerWaalsContact OG-CD1 3.26Å; S1146-L1152 WeakPolarHBondContact OG-CD1 3.38Å; S1146-L1152 VanDerWaalsContact OG-CD2 3.23Å; S1146-L1152 WeakPolarHBondContact OG-CD2 3.39Å; S1146-L1152 WeakPolarHBondContact OG-CG 3.46Å
1147	K	81.8	Confident	87.4	Confident	147 Å²	147	62.5 Å²	62.5	64%	0.639	34%	0.336	S	S	*	.			trans	-100.5	-17.2	-178.3	-65.5	-167.5	-179.3	-170.3	0	112.6	S916 D919 L1109 R1145 D1151	S916-K1147 PolarHBondContact OG-NZ 3.46Å; D919-K1147 IonicContact OD1-NZ 3.28Å; D919-K1147 PolarHBondContact OD1-NZ 3.33Å; D919-K1147 IonicContact OD2-NZ 3.83Å; D919-K1147 PolarHBondContact OD2-NZ 2.83Å; L1109-K1147 VanDerWaalsContact CD2-O 3.22Å; L1109-K1147 WeakPolarHBondContact CD2-O 3.36Å; R1145-K1147 WeakPolarHBondContact O-CG 3.48Å; R1145-K1147 PolarHBondContact O-N 3.11Å; R1145-K1147 VanDerWaalsContact O-N 3.08Å; K1147-D1151 PolarHBondContact N-OD2 3Å; K1147-D1151 VanDerWaalsContact N-OD2 3.13Å
1148	S	81	Confident	87.6	Confident	36.6 Å²	36.6	63.2 Å²	63.2	26%	0.256	33%	0.33	S	S	.	.	S	Bend	trans	-119.3	151.5	179.1	109.5	0	0	0	0	112	S1150 D1151 L1152	S1148-S1150 PolarHBondContact O-N 3.15Å; S1148-S1150 WeakPolarHBondContact OG-CB 3.43Å; S1148-S1150 PolarHBondContact OG-N 3.16Å; S1148-S1150 PolarHBondContact OG-OG 3.27Å; S1148-D1151 WeakPolarHBondContact CB-OD2 3.47Å; S1148-D1151 PolarHBondContact N-OD2 3.24Å; S1148-D1151 VanDerWaalsContact N-OD2 3.08Å; S1148-D1151 WeakPolarHBondContact O-CB 3.34Å; S1148-D1151 PolarHBondContact O-N 3.02Å; S1148-D1151 VanDerWaalsContact O-N 3.13Å; S1148-D1151 PolarHBondContact OG-N 3.27Å; S1148-D1151 VanDerWaalsContact OG-N 3.13Å; S1148-D1151 PolarHBondContact OG-OD1 3.11Å; S1148-D1151 PolarHBondContact OG-OD2 3Å; S1148-L1152 PolarHBondContact O-N 3.03Å
1149	P	81.5	Confident	87.7	Confident	86.6 Å²	86.6	59.4 Å²	59.4	56%	0.562	31%	0.31	S	S	*	.	H	α-helix	trans	-59.7	-25.9	168.3	6.5	-7.9	0	0	0	112.7	L1109 L1152 A1153	L1109-P1149 HydrophobicContact CD1-CG 4.38Å; L1109-P1149 HydrophobicContact CD2-CB 4.16Å; P1149-L1152 WeakPolarHBondContact O-CB 3.33Å; P1149-L1152 PolarHBondContact O-N 3.07Å; P1149-A1153 WeakPolarHBondContact O-CB 3.34Å; P1149-A1153 PolarHBondContact O-N 3.2Å
1150	S	84.4	Confident	87.6	Confident	86.8 Å²	86.8	64.4 Å²	64.4	61%	0.607	33%	0.333	S	S	*	.	H	α-helix	trans	-66.4	-39.9	174.6	-56.3	0	0	0	0	112.3	S1148 L1152 A1153 F1154	S1148-S1150 PolarHBondContact O-N 3.15Å; S1148-S1150 WeakPolarHBondContact OG-CB 3.43Å; S1148-S1150 PolarHBondContact OG-N 3.16Å; S1148-S1150 PolarHBondContact OG-OG 3.27Å; S1150-L1152 VanDerWaalsContact C-N 3.32Å; S1150-L1152 PolarHBondContact O-N 3.18Å; S1150-A1153 PolarHBondContact O-N 2.9Å; S1150-F1154 PolarHBondContact O-N 3.35Å
1151	D	88.1	Confident	87.6	Confident	71.4 Å²	71.4	66.8 Å²	66.8	38%	0.382	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-44.4	173.9	-54.9	-31.7	0	0	0	110.1	K1147 S1148 A1153 F1154 L1155	K1147-D1151 PolarHBondContact N-OD2 3Å; K1147-D1151 VanDerWaalsContact N-OD2 3.13Å; S1148-D1151 WeakPolarHBondContact CB-OD2 3.47Å; S1148-D1151 PolarHBondContact N-OD2 3.24Å; S1148-D1151 VanDerWaalsContact N-OD2 3.08Å; S1148-D1151 WeakPolarHBondContact O-CB 3.34Å; S1148-D1151 PolarHBondContact O-N 3.02Å; S1148-D1151 VanDerWaalsContact O-N 3.13Å; S1148-D1151 PolarHBondContact OG-N 3.27Å; S1148-D1151 VanDerWaalsContact OG-N 3.13Å; S1148-D1151 PolarHBondContact OG-OD1 3.11Å; S1148-D1151 PolarHBondContact OG-OD2 3Å; D1151-A1153 VanDerWaalsContact C-N 3.34Å; D1151-A1153 PolarHBondContact O-N 3.08Å; D1151-F1154 WeakPolarHBondContact O-CB 3.33Å; D1151-F1154 PolarHBondContact O-N 2.88Å; D1151-L1155 VanDerWaalsContact O-CG 3.28Å; D1151-L1155 WeakPolarHBondContact O-CG 3.36Å; D1151-L1155 PolarHBondContact O-N 3.01Å
1152	L	88.3	Confident	87.8	Confident	12 Å²	12	62.5 Å²	62.5	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-62.8	-40.3	177.2	-105.6	143.5	0	0	0	112.1	L1109 L1112 R1113 L1116 V1143 S1146 S1148 P1149 S1150 F1154 L1155 L1156	L1109-L1152 HydrophobicContact CD1-CD1 3.47Å; L1109-L1152 VanDerWaalsContact CD1-CD1 3.47Å; L1109-L1152 HydrophobicContact CD1-CG 4.38Å; L1109-L1152 HydrophobicContact CG-CD1 4.43Å; L1112-L1152 HydrophobicContact CB-CD1 3.85Å; L1112-L1152 HydrophobicContact CB-CD2 3.68Å; L1112-L1152 HydrophobicContact CD1-CD1 4.47Å; L1112-L1152 HydrophobicContact CD1-CD2 4.49Å; R1113-L1152 HydrophobicContact CG-CD1 4.2Å; R1113-L1152 HydrophobicContact CG-CD2 4Å; L1116-L1152 HydrophobicContact CD1-CB 4.24Å; L1116-L1152 HydrophobicContact CD1-CD1 4.12Å; L1116-L1152 HydrophobicContact CD1-CD2 3.75Å; L1116-L1152 HydrophobicContact CD1-CG 4Å; L1116-L1152 HydrophobicContact CD2-CD1 3.55Å; L1116-L1152 HydrophobicContact CD2-CD2 4.07Å; L1116-L1152 HydrophobicContact CD2-CG 4.12Å; V1143-L1152 HydrophobicContact CG1-CD1 4.21Å; V1143-L1152 HydrophobicContact CG1-CD2 4.22Å; S1146-L1152 VanDerWaalsContact OG-CD1 3.26Å; S1146-L1152 WeakPolarHBondContact OG-CD1 3.38Å; S1146-L1152 VanDerWaalsContact OG-CD2 3.23Å; S1146-L1152 WeakPolarHBondContact OG-CD2 3.39Å; S1146-L1152 WeakPolarHBondContact OG-CG 3.46Å; S1148-L1152 PolarHBondContact O-N 3.03Å; P1149-L1152 WeakPolarHBondContact O-CB 3.33Å; P1149-L1152 PolarHBondContact O-N 3.07Å; S1150-L1152 VanDerWaalsContact C-N 3.32Å; S1150-L1152 PolarHBondContact O-N 3.18Å; L1152-F1154 VanDerWaalsContact C-N 3.33Å; L1152-F1154 PolarHBondContact O-N 3.01Å; L1152-L1155 HydrophobicContact CD2-CD1 4.47Å; L1152-L1155 PolarHBondContact O-N 3.2Å; L1152-L1156 VanDerWaalsContact O-CB 3.31Å; L1152-L1156 WeakPolarHBondContact O-CB 3.21Å; L1152-L1156 PolarHBondContact O-N 3.11Å
1153	A	88.9	Confident	87.8	Confident	57.6 Å²	57.6	61 Å²	61	48%	0.476	33%	0.331	S	S	.	.	H	α-helix	trans	-62.9	-40	175.4	0	0	0	0	0	112	P1149 S1150 D1151 L1156 A1157	P1149-A1153 WeakPolarHBondContact O-CB 3.34Å; P1149-A1153 PolarHBondContact O-N 3.2Å; S1150-A1153 PolarHBondContact O-N 2.9Å; D1151-A1153 VanDerWaalsContact C-N 3.34Å; D1151-A1153 PolarHBondContact O-N 3.08Å; A1153-L1156 WeakPolarHBondContact O-CB 3.08Å; A1153-L1156 PolarHBondContact O-N 3.15Å; A1153-A1157 WeakPolarHBondContact O-CB 3.31Å; A1153-A1157 PolarHBondContact O-N 3.26Å
1154	F	90.7	Very high	87.6	Confident	145.6 Å²	145.6	66.5 Å²	66.5	64%	0.639	35%	0.351	S	S	*	.	H	α-helix	trans	-64.6	-41	173.7	179.2	-98.8	0	0	0	112.1	S1150 D1151 L1152 A1157 R1158	S1150-F1154 PolarHBondContact O-N 3.35Å; D1151-F1154 WeakPolarHBondContact O-CB 3.33Å; D1151-F1154 PolarHBondContact O-N 2.88Å; L1152-F1154 VanDerWaalsContact C-N 3.33Å; L1152-F1154 PolarHBondContact O-N 3.01Å; F1154-A1157 PolarHBondContact O-N 3.01Å; F1154-R1158 PolarHBondContact O-N 3.06Å
1155	L	92.7	Very high	87.4	Confident	8.6 Å²	8.6	68.4 Å²	68.4	5%	0.045	37%	0.369	C	S	.	.	H	α-helix	trans	-68.8	-35.8	177.2	-68.5	167.2	0	0	0	112.4	W1139 D1142 V1143 D1151 L1152 R1158 L1159	W1139-L1155 PolarHBondContact NE1-O 3.04Å; D1142-L1155 VanDerWaalsContact C-CD1 3.49Å; D1142-L1155 HydrophobicContact CB-CD1 4.06Å; D1142-L1155 HydrophobicContact CB-CD2 3.62Å; D1142-L1155 HydrophobicContact CB-CG 4.47Å; D1142-L1155 WeakPolarHBondContact O-CD1 3.23Å; V1143-L1155 HydrophobicContact CB-CD1 4.39Å; V1143-L1155 HydrophobicContact CG2-CB 4.16Å; V1143-L1155 HydrophobicContact CG2-CD1 3.89Å; V1143-L1155 HydrophobicContact CG2-CG 4.46Å; D1151-L1155 VanDerWaalsContact O-CG 3.28Å; D1151-L1155 WeakPolarHBondContact O-CG 3.36Å; D1151-L1155 PolarHBondContact O-N 3.01Å; L1152-L1155 HydrophobicContact CD2-CD1 4.47Å; L1152-L1155 PolarHBondContact O-N 3.2Å; L1155-R1158 WeakPolarHBondContact O-CB 3.32Å; L1155-R1158 PolarHBondContact O-N 3.19Å; L1155-L1159 PolarHBondContact O-N 3.29Å
1156	L	91.3	Very high	87.1	Confident	80.8 Å²	80.8	65.4 Å²	65.4	42%	0.423	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-44.6	170.5	-147.1	99.8	0	0	0	111.4	L1116 L1152 A1153 R1158 L1159 E1160	L1116-L1156 HydrophobicContact CD1-CD1 3.81Å; L1116-L1156 HydrophobicContact CD1-CD2 3.56Å; L1116-L1156 HydrophobicContact CD1-CG 4.04Å; L1116-L1156 HydrophobicContact CD2-CB 4.42Å; L1116-L1156 HydrophobicContact CD2-CD1 4.01Å; L1116-L1156 HydrophobicContact CD2-CD2 3.98Å; L1116-L1156 HydrophobicContact CD2-CG 3.96Å; L1152-L1156 VanDerWaalsContact O-CB 3.31Å; L1152-L1156 WeakPolarHBondContact O-CB 3.21Å; L1152-L1156 PolarHBondContact O-N 3.11Å; A1153-L1156 WeakPolarHBondContact O-CB 3.08Å; A1153-L1156 PolarHBondContact O-N 3.15Å; L1156-R1158 VanDerWaalsContact C-N 3.28Å; L1156-R1158 PolarHBondContact O-N 3.07Å; L1156-L1159 HydrophobicContact CD1-CD2 4.44Å; L1156-L1159 WeakPolarHBondContact O-CB 3.44Å; L1156-L1159 PolarHBondContact O-N 3.18Å; L1156-L1159 VanDerWaalsContact O-N 3.13Å; L1156-E1160 WeakPolarHBondContact O-CB 3.2Å; L1156-E1160 PolarHBondContact O-N 3.22Å
1157	A	90	Very high	86.7	Confident	50 Å²	50	67 Å²	67	41%	0.413	38%	0.377	S	S	.	.	H	α-helix	trans	-62.1	-35.4	175.1	0	0	0	0	0	112.2	A1153 F1154 E1160 A1161	A1153-A1157 WeakPolarHBondContact O-CB 3.31Å; A1153-A1157 PolarHBondContact O-N 3.26Å; F1154-A1157 PolarHBondContact O-N 3.01Å; A1157-E1160 PolarHBondContact O-N 3.15Å; A1157-A1161 VanDerWaalsContact O-CB 3.3Å; A1157-A1161 WeakPolarHBondContact O-CB 3.44Å; A1157-A1161 PolarHBondContact O-N 3.1Å
1158	R	90.3	Very high	86.4	Confident	86.8 Å²	86.8	63.2 Å²	63.2	33%	0.328	36%	0.361	S	S	.	.	H	α-helix	trans	-67.8	-36.3	173.8	-170.1	173.8	-176.8	-175.3	3.2	112.5	D1142 F1154 L1155 L1156 S1162	D1142-R1158 IonicContact OD2-NH1 3.2Å; D1142-R1158 PolarHBondContact OD2-NH1 3.29Å; F1154-R1158 PolarHBondContact O-N 3.06Å; L1155-R1158 WeakPolarHBondContact O-CB 3.32Å; L1155-R1158 PolarHBondContact O-N 3.19Å; L1156-R1158 VanDerWaalsContact C-N 3.28Å; L1156-R1158 PolarHBondContact O-N 3.07Å; R1158-S1162 PolarHBondContact O-N 3.17Å; R1158-S1162 PolarHBondContact O-OG 3.25Å
1159	L	91.3	Very high	85.8	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.01	37%	0.372	C	S	.	.	H	α-helix	trans	-67.1	-46.5	173	-176.5	70	0	0	0	110.8	L1116 F1119 E1120 Y1128 W1132 W1139 L1155 L1156 A1161 S1162 I1163	L1116-L1159 HydrophobicContact CD1-CD2 3.92Å; F1119-L1159 HydrophobicContact CD1-CD2 3.98Å; F1119-L1159 HydrophobicContact CE1-CD2 4.08Å; E1120-L1159 HydrophobicContact CB-CD1 4.4Å; E1120-L1159 HydrophobicContact CG-CD1 3.92Å; Y1128-L1159 HydrophobicContact CE1-CD1 3.82Å; W1132-L1159 HydrophobicContact CH2-CB 4.48Å; W1132-L1159 HydrophobicContact CH2-CD1 3.49Å; W1132-L1159 VanDerWaalsContact CH2-CD1 3.47Å; W1132-L1159 HydrophobicContact CZ2-CD1 3.46Å; W1132-L1159 VanDerWaalsContact CZ2-CD1 3.45Å; W1132-L1159 HydrophobicContact CZ3-CD1 4.39Å; W1139-L1159 HydrophobicContact CH2-CD1 4.19Å; W1139-L1159 HydrophobicContact CH2-CD2 4.04Å; W1139-L1159 HydrophobicContact CH2-CG 4.47Å; W1139-L1159 HydrophobicContact CZ2-CB 3.83Å; W1139-L1159 HydrophobicContact CZ2-CD1 4.04Å; W1139-L1159 HydrophobicContact CZ2-CD2 3.87Å; W1139-L1159 HydrophobicContact CZ2-CG 4.13Å; L1155-L1159 PolarHBondContact O-N 3.29Å; L1156-L1159 HydrophobicContact CD1-CD2 4.44Å; L1156-L1159 WeakPolarHBondContact O-CB 3.44Å; L1156-L1159 PolarHBondContact O-N 3.18Å; L1156-L1159 VanDerWaalsContact O-N 3.13Å; L1159-A1161 VanDerWaalsContact C-N 3.33Å; L1159-A1161 PolarHBondContact O-N 3.3Å; L1159-S1162 WeakPolarHBondContact O-CA 3.31Å; L1159-S1162 WeakPolarHBondContact O-CB 3.46Å; L1159-S1162 PolarHBondContact O-N 3.05Å; L1159-S1162 PolarHBondContact O-OG 2.99Å; L1159-I1163 HydrophobicContact CD1-CD1 4.39Å; L1159-I1163 HydrophobicContact CG-CD1 4.08Å; L1159-I1163 WeakPolarHBondContact O-CG1 3.37Å; L1159-I1163 PolarHBondContact O-N 3.19Å
1160	E	89.6	Confident	85.1	Confident	103.8 Å²	103.8	71.5 Å²	71.5	49%	0.485	38%	0.38	S	S	.	.	H	α-helix	trans	-56.5	-47.1	176.2	-170.4	-164.3	160.4	0	0	111.2	L1156 A1157 S1162 I1163 R1164 F1168	L1156-E1160 WeakPolarHBondContact O-CB 3.2Å; L1156-E1160 PolarHBondContact O-N 3.22Å; A1157-E1160 PolarHBondContact O-N 3.15Å; E1160-S1162 VanDerWaalsContact C-N 3.34Å; E1160-S1162 PolarHBondContact O-N 2.89Å; E1160-S1162 VanDerWaalsContact O-N 3.14Å; E1160-I1163 PolarHBondContact O-N 2.99Å; E1160-I1163 VanDerWaalsContact O-N 3.14Å; E1160-R1164 VanDerWaalsContact CD-NH1 3.33Å; E1160-R1164 WeakPolarHBondContact O-CB 3.42Å; E1160-R1164 PolarHBondContact O-N 3.17Å; E1160-R1164 WeakPolarHBondContact OE1-CD 3.48Å; E1160-R1164 IonicContact OE1-CZ 3.08Å; E1160-R1164 IonicContact OE1-NE 3.29Å; E1160-R1164 IonicContact OE1-NH1 2.96Å; E1160-R1164 PolarHBondContact OE1-NH1 2.96Å; E1160-R1164 IonicContact OE1-NH2 2.66Å; E1160-F1168 HydrophobicContact CG-CE1 4.25Å; E1160-F1168 HydrophobicContact CG-CZ 3.82Å
1161	A	88.4	Confident	84.2	Confident	69.6 Å²	69.6	70.4 Å²	70.4	58%	0.575	37%	0.37	S	S	*	.	H	α-helix	trans	-63	-26.3	179	0	0	0	0	0	113.7	A1157 L1159 I1163	A1157-A1161 VanDerWaalsContact O-CB 3.3Å; A1157-A1161 WeakPolarHBondContact O-CB 3.44Å; A1157-A1161 PolarHBondContact O-N 3.1Å; L1159-A1161 VanDerWaalsContact C-N 3.33Å; L1159-A1161 PolarHBondContact O-N 3.3Å; A1161-I1163 VanDerWaalsContact C-N 3.33Å
1162	S	90.7	Very high	82.9	Confident	10.4 Å²	10.4	72.4 Å²	72.4	7%	0.073	37%	0.372	C	S	.	.	H	α-helix	trans	-83.5	-20.1	179.2	60.6	0	0	0	0	113.5	Y1128 T1129 W1132 R1158 L1159 E1160	Y1128-S1162 CarbonylContact C-O 3.56Å; Y1128-S1162 WeakPolarHBondContact CA-O 3.09Å; Y1128-S1162 WeakPolarHBondContact CD1-OG 3.41Å; T1129-S1162 WeakPolarHBondContact CG2-O 3.37Å; T1129-S1162 PolarHBondContact N-O 3.08Å; T1129-S1162 PolarHBondContact OG1-O 3.06Å; T1129-S1162 VanDerWaalsContact OG1-O 3.12Å; W1132-S1162 VanDerWaalsContact CE3-OG 3.27Å; W1132-S1162 VanDerWaalsContact CZ3-OG 3.31Å; W1132-S1162 WeakPolarHBondContact CZ3-OG 3.31Å; R1158-S1162 PolarHBondContact O-N 3.17Å; R1158-S1162 PolarHBondContact O-OG 3.25Å; L1159-S1162 WeakPolarHBondContact O-CA 3.31Å; L1159-S1162 WeakPolarHBondContact O-CB 3.46Å; L1159-S1162 PolarHBondContact O-N 3.05Å; L1159-S1162 PolarHBondContact O-OG 2.99Å; E1160-S1162 VanDerWaalsContact C-N 3.34Å; E1160-S1162 PolarHBondContact O-N 2.89Å; E1160-S1162 VanDerWaalsContact O-N 3.14Å
1163	I	90.1	Very high	81.7	Confident	25.2 Å²	25.2	77.3 Å²	77.3	13%	0.129	39%	0.393	C	S	.	.	B	Isolated β-bridge	trans	-83	134.5	176.8	-63.3	167.4	0	0	0	110.1	I1123 Y1128 L1159 E1160 A1161 S1165 V1166 C1167 F1168	I1123-I1163 HydrophobicContact CD1-CD1 3.95Å; Y1128-I1163 HydrophobicContact CD1-CD1 4.37Å; Y1128-I1163 HydrophobicContact CD1-CG1 3.82Å; Y1128-I1163 HydrophobicContact CE1-CD1 4.18Å; Y1128-I1163 HydrophobicContact CE1-CG1 3.53Å; Y1128-I1163 VanDerWaalsContact CE1-CG1 3.43Å; Y1128-I1163 HydrophobicContact CG-CG1 4.44Å; L1159-I1163 HydrophobicContact CD1-CD1 4.39Å; L1159-I1163 HydrophobicContact CG-CD1 4.08Å; L1159-I1163 WeakPolarHBondContact O-CG1 3.37Å; L1159-I1163 PolarHBondContact O-N 3.19Å; E1160-I1163 PolarHBondContact O-N 2.99Å; E1160-I1163 VanDerWaalsContact O-N 3.14Å; A1161-I1163 VanDerWaalsContact C-N 3.33Å; I1163-S1165 VanDerWaalsContact C-N 3.31Å; I1163-S1165 PolarHBondContact O-N 3.2Å; I1163-V1166 PolarHBondContact O-N 3.01Å; I1163-C1167 HydrophobicContact CG2-CB 3.89Å; I1163-C1167 VanDerWaalsContact CG2-SG 3.5Å; I1163-C1167 WeakPolarHBondContact CG2-SG 3.26Å; I1163-C1167 PolarHBondContact O-N 3.05Å; I1163-C1167 VanDerWaalsContact O-N 3.13Å; I1163-F1168 HydrophobicContact CB-CE2 4.01Å; I1163-F1168 HydrophobicContact CB-CZ 4Å; I1163-F1168 HydrophobicContact CD1-CZ 4.38Å; I1163-F1168 HydrophobicContact CG2-CD2 4.47Å; I1163-F1168 HydrophobicContact CG2-CE1 4.44Å; I1163-F1168 HydrophobicContact CG2-CE2 3.77Å; I1163-F1168 HydrophobicContact CG2-CZ 3.93Å
1164	R	86	Confident	80.2	Confident	115.2 Å²	115.2	80.3 Å²	80.3	44%	0.435	40%	0.401	S	S	.	.			trans	-62.4	138.3	-175.4	-105.8	178.1	-165.1	152.3	6.4	112	A1126 F1127 Y1128 E1160 V1166 C1167 F1168	A1126-R1164 PolarHBondContact O-NE 3.09Å; A1126-R1164 PolarHBondContact O-NH1 3.17Å; A1126-R1164 VanDerWaalsContact O-NH1 3.15Å; A1126-R1164 PolarHBondContact O-NH2 2.98Å; F1127-R1164 VanDerWaalsContact O-CB 3.3Å; F1127-R1164 WeakPolarHBondContact O-CB 3.22Å; F1127-R1164 WeakPolarHBondContact O-CG 3.13Å; F1127-R1164 PolarHBondContact O-N 3.15Å; Y1128-R1164 VanDerWaalsContact O-CZ 3.26Å; Y1128-R1164 PolarHBondContact O-NE 3.04Å; Y1128-R1164 PolarHBondContact O-NH2 3.14Å; Y1128-R1164 VanDerWaalsContact O-NH2 3.14Å; E1160-R1164 VanDerWaalsContact CD-NH1 3.33Å; E1160-R1164 WeakPolarHBondContact O-CB 3.42Å; E1160-R1164 PolarHBondContact O-N 3.17Å; E1160-R1164 WeakPolarHBondContact OE1-CD 3.48Å; E1160-R1164 IonicContact OE1-CZ 3.08Å; E1160-R1164 IonicContact OE1-NE 3.29Å; E1160-R1164 IonicContact OE1-NH1 2.96Å; E1160-R1164 PolarHBondContact OE1-NH1 2.96Å; E1160-R1164 IonicContact OE1-NH2 2.66Å; R1164-V1166 VanDerWaalsContact C-N 3.29Å; R1164-V1166 HydrophobicContact CB-CG1 3.99Å; R1164-V1166 PolarHBondContact O-N 3.12Å; R1164-C1167 WeakPolarHBondContact O-CB 3.31Å; R1164-C1167 PolarHBondContact O-N 3.23Å; R1164-C1167 PolarHBondContact O-SG 3.23Å; R1164-F1168 HydrophobicContact CB-CD2 4.3Å; R1164-F1168 HydrophobicContact CG-CB 4.46Å; R1164-F1168 HydrophobicContact CG-CD2 3.66Å; R1164-F1168 VanDerWaalsContact CG-CD2 3.49Å; R1164-F1168 HydrophobicContact CG-CE2 3.93Å; R1164-F1168 HydrophobicContact CG-CG 4Å; R1164-F1168 VanDerWaalsContact O-CB 3.29Å; R1164-F1168 WeakPolarHBondContact O-CB 3.35Å; R1164-F1168 VanDerWaalsContact O-CD2 3.31Å; R1164-F1168 WeakPolarHBondContact O-CD2 3.25Å; R1164-F1168 PolarHBondContact O-N 3.02Å
1165	S	80.7	Confident	78.5	Confident	88.2 Å²	88.2	75.9 Å²	75.9	62%	0.617	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-60.7	-23.5	-179.2	59.6	0	0	0	0	114.2	T1129 I1163 C1167 F1168	T1129-S1165 WeakPolarHBondContact CG2-OG 3.19Å; I1163-S1165 VanDerWaalsContact C-N 3.31Å; I1163-S1165 PolarHBondContact O-N 3.2Å; S1165-C1167 PolarHBondContact O-N 3.1Å; S1165-F1168 PolarHBondContact O-N 3.16Å
1166	V	79	Confident	76.7	Confident	83.6 Å²	83.6	80.8 Å²	80.8	51%	0.507	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-76.4	-34.4	177.2	113.2	0	0	0	0	112	F1127 T1129 I1163 R1164 F1168 Q1169 W1172	F1127-V1166 WeakPolarHBondContact O-CB 3.36Å; T1129-V1166 HydrophobicContact CG2-CG2 4.35Å; I1163-V1166 PolarHBondContact O-N 3.01Å; R1164-V1166 VanDerWaalsContact C-N 3.29Å; R1164-V1166 HydrophobicContact CB-CG1 3.99Å; R1164-V1166 PolarHBondContact O-N 3.12Å; V1166-F1168 VanDerWaalsContact C-N 3.3Å; V1166-F1168 PolarHBondContact O-N 2.99Å; V1166-F1168 VanDerWaalsContact O-N 3.09Å; V1166-Q1169 VanDerWaalsContact O-CB 3.25Å; V1166-Q1169 WeakPolarHBondContact O-CB 3.34Å; V1166-Q1169 PolarHBondContact O-N 3.03Å; V1166-Q1169 VanDerWaalsContact O-N 3.09Å; V1166-W1172 HydrophobicContact CB-CZ3 4.46Å; V1166-W1172 HydrophobicContact CG1-CH2 3.75Å; V1166-W1172 HydrophobicContact CG1-CZ3 3.68Å
1167	C	76.1	Confident	75	Confident	38.6 Å²	38.6	79 Å²	79	26%	0.261	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-70.7	-23	-180	-62	0	0	0	0	113	F1127 I1163 R1164 S1165 Q1169 W1172	F1127-C1167 VanDerWaalsContact CD1-SG 3.56Å; I1163-C1167 HydrophobicContact CG2-CB 3.89Å; I1163-C1167 VanDerWaalsContact CG2-SG 3.5Å; I1163-C1167 WeakPolarHBondContact CG2-SG 3.26Å; I1163-C1167 PolarHBondContact O-N 3.05Å; I1163-C1167 VanDerWaalsContact O-N 3.13Å; R1164-C1167 WeakPolarHBondContact O-CB 3.31Å; R1164-C1167 PolarHBondContact O-N 3.23Å; R1164-C1167 PolarHBondContact O-SG 3.23Å; S1165-C1167 PolarHBondContact O-N 3.1Å; C1167-Q1169 PolarHBondContact O-N 3.47Å; C1167-Q1169 VanDerWaalsContact O-N 3.12Å; C1167-W1172 WeakPolarHBondContact O-CB 3.13Å; C1167-W1172 WeakPolarHBondContact O-CH2 3.26Å; C1167-W1172 WeakPolarHBondContact O-CZ3 3.04Å
1168	F	74.3	Confident	73.7	Confident	67 Å²	67	79.9 Å²	79.9	29%	0.294	41%	0.41	S	S	.	.	S	Bend	trans	-92.6	78.4	179.9	-64.1	-89.3	0	0	0	112.2	E1160 I1163 R1164 S1165 V1166 W1172 F1173	E1160-F1168 HydrophobicContact CG-CE1 4.25Å; E1160-F1168 HydrophobicContact CG-CZ 3.82Å; I1163-F1168 HydrophobicContact CB-CE2 4.01Å; I1163-F1168 HydrophobicContact CB-CZ 4Å; I1163-F1168 HydrophobicContact CD1-CZ 4.38Å; I1163-F1168 HydrophobicContact CG2-CD2 4.47Å; I1163-F1168 HydrophobicContact CG2-CE1 4.44Å; I1163-F1168 HydrophobicContact CG2-CE2 3.77Å; I1163-F1168 HydrophobicContact CG2-CZ 3.93Å; R1164-F1168 HydrophobicContact CB-CD2 4.3Å; R1164-F1168 HydrophobicContact CG-CB 4.46Å; R1164-F1168 HydrophobicContact CG-CD2 3.66Å; R1164-F1168 VanDerWaalsContact CG-CD2 3.49Å; R1164-F1168 HydrophobicContact CG-CE2 3.93Å; R1164-F1168 HydrophobicContact CG-CG 4Å; R1164-F1168 VanDerWaalsContact O-CB 3.29Å; R1164-F1168 WeakPolarHBondContact O-CB 3.35Å; R1164-F1168 VanDerWaalsContact O-CD2 3.31Å; R1164-F1168 WeakPolarHBondContact O-CD2 3.25Å; R1164-F1168 PolarHBondContact O-N 3.02Å; S1165-F1168 PolarHBondContact O-N 3.16Å; V1166-F1168 VanDerWaalsContact C-N 3.3Å; V1166-F1168 PolarHBondContact O-N 2.99Å; V1166-F1168 VanDerWaalsContact O-N 3.09Å; F1168-W1172 HydrophobicContact CB-CE3 4.46Å; F1168-W1172 AromaticContact CD1-CD2 3.85Å; F1168-W1172 HydrophobicContact CD1-CD2 3.95Å; F1168-W1172 AromaticContact CD1-CE3 3.41Å; F1168-W1172 HydrophobicContact CD1-CE3 3.62Å; F1168-W1172 HydrophobicContact CD1-CG 4.41Å; F1168-W1172 HydrophobicContact CD1-CH2 4.27Å; F1168-W1172 AromaticContact CD1-CZ3 3.59Å; F1168-W1172 HydrophobicContact CD1-CZ3 3.8Å; F1168-W1172 AromaticContact CE1-CE3 3.85Å; F1168-W1172 HydrophobicContact CE1-CE3 3.85Å; F1168-W1172 HydrophobicContact CE1-CH2 4.36Å; F1168-W1172 AromaticContact CE1-CZ3 3.62Å; F1168-W1172 HydrophobicContact CE1-CZ3 3.62Å; F1168-W1172 VanDerWaalsContact CE1-CZ3 3.43Å; F1168-W1172 HydrophobicContact CG-CE3 4.2Å; F1168-F1173 HydrophobicContact CB-CD2 4.32Å; F1168-F1173 HydrophobicContact CB-CE2 3.62Å; F1168-F1173 HydrophobicContact CB-CZ 3.7Å; F1168-F1173 AromaticContact CD1-CD2 3.6Å; F1168-F1173 HydrophobicContact CD1-CD2 3.6Å; F1168-F1173 VanDerWaalsContact CD1-CD2 3.49Å; F1168-F1173 AromaticContact CD1-CE2 3.73Å; F1168-F1173 HydrophobicContact CD1-CE2 3.73Å; F1168-F1173 HydrophobicContact CD1-CZ 4.13Å; F1168-F1173 AromaticContact CD2-CZ 3.93Å; F1168-F1173 HydrophobicContact CD2-CZ 3.93Å; F1168-F1173 HydrophobicContact CE1-CD2 4.19Å; F1168-F1173 AromaticContact CE1-CE2 3.89Å; F1168-F1173 HydrophobicContact CE1-CE2 4Å; F1168-F1173 HydrophobicContact CG-CD2 4.2Å; F1168-F1173 HydrophobicContact CG-CE2 4.46Å; F1168-F1173 HydrophobicContact CG-CZ 4.13Å
1169	Q	69.4	Low	72.4	Confident	105.8 Å²	105.8	81.8 Å²	81.8	49%	0.494	43%	0.426	S	S	.	.			trans	-68.5	144.4	172.3	-162.7	100	-35.6	0	0	110.3	K1051 V1166 C1167 V1171 W1172 F1173	K1051-Q1169 VanDerWaalsContact O-CD 3.28Å; K1051-Q1169 PolarHBondContact O-NE2 2.86Å; K1051-Q1169 PolarHBondContact O-OE1 3.26Å; K1051-Q1169 VanDerWaalsContact O-OE1 3.06Å; V1166-Q1169 VanDerWaalsContact O-CB 3.25Å; V1166-Q1169 WeakPolarHBondContact O-CB 3.34Å; V1166-Q1169 PolarHBondContact O-N 3.03Å; V1166-Q1169 VanDerWaalsContact O-N 3.09Å; C1167-Q1169 PolarHBondContact O-N 3.47Å; C1167-Q1169 VanDerWaalsContact O-N 3.12Å; Q1169-V1171 HydrophobicContact CB-CG1 4.08Å; Q1169-V1171 HydrophobicContact CG-CG1 4.06Å; Q1169-V1171 HydrophobicContact CG-CG2 4.47Å; Q1169-V1171 PolarHBondContact O-N 3.33Å; Q1169-V1171 VanDerWaalsContact O-N 3.11Å; Q1169-W1172 HydrophobicContact CB-CD2 4.46Å; Q1169-W1172 CarbonylContact O-C 3.5Å; Q1169-W1172 WeakPolarHBondContact O-CB 3.45Å; Q1169-W1172 VanDerWaalsContact O-CD1 3.29Å; Q1169-W1172 PolarHBondContact O-N 3.19Å; Q1169-F1173 WeakPolarHBondContact O-CB 3.21Å; Q1169-F1173 PolarHBondContact O-N 2.95Å
1170	R	66.1	Low	71.2	Confident	192.2 Å²	192.2	86 Å²	86	73%	0.725	45%	0.452	S	S	*	.	H	α-helix	trans	-52.9	-29.5	-177	-77.2	-175.8	178.3	178.8	-0.2	114.4	W1172 F1173 N1174 L1474	R1170-W1172 PolarHBondContact O-N 3.17Å; R1170-F1173 PolarHBondContact O-N 2.97Å; R1170-N1174 VanDerWaalsContact O-CB 3.26Å; R1170-N1174 WeakPolarHBondContact O-CB 3.39Å; R1170-N1174 VanDerWaalsContact O-CG 3.26Å; R1170-N1174 PolarHBondContact O-N 3.23Å; R1170-N1174 VanDerWaalsContact O-N 3.09Å; R1170-N1174 PolarHBondContact O-ND2 3.14Å; R1170-N1174 PolarHBondContact O-OD1 3.48Å; R1170-L1474 PolarHBondContact NH2-O 3.35Å
1171	V	65.3	Low	70.5	Confident	63.8 Å²	63.8	83.1 Å²	83.1	39%	0.387	44%	0.44	S	S	.	.	H	α-helix	trans	-60.6	-35.1	178.1	112.4	0	0	0	0	111.6	K1051 F1052 Q1169 F1173 N1174 S1175	K1051-V1171 HydrophobicContact CB-CG1 4.45Å; K1051-V1171 HydrophobicContact CB-CG2 4.43Å; K1051-V1171 VanDerWaalsContact O-CG1 3.27Å; K1051-V1171 WeakPolarHBondContact O-CG1 3.38Å; F1052-V1171 HydrophobicContact CD1-CG1 3.96Å; F1052-V1171 HydrophobicContact CD1-CG2 4.33Å; F1052-V1171 HydrophobicContact CE1-CB 4.35Å; F1052-V1171 HydrophobicContact CE1-CG1 3.83Å; F1052-V1171 HydrophobicContact CE1-CG2 3.52Å; F1052-V1171 HydrophobicContact CZ-CG2 3.69Å; Q1169-V1171 HydrophobicContact CB-CG1 4.08Å; Q1169-V1171 HydrophobicContact CG-CG1 4.06Å; Q1169-V1171 HydrophobicContact CG-CG2 4.47Å; Q1169-V1171 PolarHBondContact O-N 3.33Å; Q1169-V1171 VanDerWaalsContact O-N 3.11Å; V1171-F1173 VanDerWaalsContact C-N 3.3Å; V1171-F1173 PolarHBondContact O-N 3.06Å; V1171-N1174 PolarHBondContact O-N 3.11Å; V1171-S1175 WeakPolarHBondContact CG2-OG 3.29Å; V1171-S1175 WeakPolarHBondContact O-CB 3.33Å; V1171-S1175 PolarHBondContact O-N 3.13Å; V1171-S1175 VanDerWaalsContact O-N 3.11Å; V1171-S1175 PolarHBondContact O-OG 3.11Å
1172	W	61.7	Low	69.7	Low	114 Å²	114	84 Å²	84	43%	0.432	43%	0.432	S	S	.	.	H	α-helix	trans	-77.6	-36	179.3	-60.8	32.7	0	0	0	112.2	W1062 F1127 V1166 C1167 F1168 Q1169 R1170 N1174 S1175 L1176	W1062-W1172 HydrophobicContact CZ2-CH2 4.16Å; F1127-W1172 HydrophobicContact CD1-CE3 4.25Å; F1127-W1172 AromaticContact CD1-CH2 3.94Å; F1127-W1172 HydrophobicContact CD1-CH2 3.94Å; F1127-W1172 AromaticContact CD1-CZ3 3.5Å; F1127-W1172 HydrophobicContact CD1-CZ3 3.5Å; F1127-W1172 VanDerWaalsContact CD1-CZ3 3.5Å; F1127-W1172 HydrophobicContact CE1-CD2 4.31Å; F1127-W1172 HydrophobicContact CE1-CE3 4.31Å; F1127-W1172 HydrophobicContact CE1-CH2 4.02Å; F1127-W1172 AromaticContact CE1-CZ3 3.76Å; F1127-W1172 HydrophobicContact CE1-CZ3 3.76Å; V1166-W1172 HydrophobicContact CB-CZ3 4.46Å; V1166-W1172 HydrophobicContact CG1-CH2 3.75Å; V1166-W1172 HydrophobicContact CG1-CZ3 3.68Å; C1167-W1172 WeakPolarHBondContact O-CB 3.13Å; C1167-W1172 WeakPolarHBondContact O-CH2 3.26Å; C1167-W1172 WeakPolarHBondContact O-CZ3 3.04Å; F1168-W1172 HydrophobicContact CB-CE3 4.46Å; F1168-W1172 AromaticContact CD1-CD2 3.85Å; F1168-W1172 HydrophobicContact CD1-CD2 3.95Å; F1168-W1172 AromaticContact CD1-CE3 3.41Å; F1168-W1172 HydrophobicContact CD1-CE3 3.62Å; F1168-W1172 HydrophobicContact CD1-CG 4.41Å; F1168-W1172 HydrophobicContact CD1-CH2 4.27Å; F1168-W1172 AromaticContact CD1-CZ3 3.59Å; F1168-W1172 HydrophobicContact CD1-CZ3 3.8Å; F1168-W1172 AromaticContact CE1-CE3 3.85Å; F1168-W1172 HydrophobicContact CE1-CE3 3.85Å; F1168-W1172 HydrophobicContact CE1-CH2 4.36Å; F1168-W1172 AromaticContact CE1-CZ3 3.62Å; F1168-W1172 HydrophobicContact CE1-CZ3 3.62Å; F1168-W1172 VanDerWaalsContact CE1-CZ3 3.43Å; F1168-W1172 HydrophobicContact CG-CE3 4.2Å; Q1169-W1172 HydrophobicContact CB-CD2 4.46Å; Q1169-W1172 CarbonylContact O-C 3.5Å; Q1169-W1172 WeakPolarHBondContact O-CB 3.45Å; Q1169-W1172 VanDerWaalsContact O-CD1 3.29Å; Q1169-W1172 PolarHBondContact O-N 3.19Å; R1170-W1172 PolarHBondContact O-N 3.17Å; W1172-N1174 VanDerWaalsContact C-N 3.29Å; W1172-N1174 PolarHBondContact O-N 2.89Å; W1172-S1175 WeakPolarHBondContact CA-OG 3.35Å; W1172-S1175 CarbonylContact O-C 3.57Å; W1172-S1175 WeakPolarHBondContact O-CA 3.46Å; W1172-S1175 PolarHBondContact O-N 3.16Å; W1172-S1175 VanDerWaalsContact O-N 3.17Å; W1172-S1175 PolarHBondContact O-OG 3.16Å; W1172-L1176 HydrophobicContact CB-CD1 4.22Å; W1172-L1176 HydrophobicContact CD2-CD1 4.28Å; W1172-L1176 HydrophobicContact CE3-CD1 4.34Å; W1172-L1176 HydrophobicContact CG-CD1 4.26Å; W1172-L1176 WeakPolarHBondContact O-CG 3.39Å; W1172-L1176 PolarHBondContact O-N 3.2Å
1173	F	62.3	Low	69	Low	114 Å²	114	86.5 Å²	86.5	50%	0.5	44%	0.44	S	S	.	.	H	α-helix	trans	-78.1	-27.6	178.9	-96.5	-83	0	0	0	113.3	F1168 Q1169 R1170 V1171 S1175 L1176	F1168-F1173 HydrophobicContact CB-CD2 4.32Å; F1168-F1173 HydrophobicContact CB-CE2 3.62Å; F1168-F1173 HydrophobicContact CB-CZ 3.7Å; F1168-F1173 AromaticContact CD1-CD2 3.6Å; F1168-F1173 HydrophobicContact CD1-CD2 3.6Å; F1168-F1173 VanDerWaalsContact CD1-CD2 3.49Å; F1168-F1173 AromaticContact CD1-CE2 3.73Å; F1168-F1173 HydrophobicContact CD1-CE2 3.73Å; F1168-F1173 HydrophobicContact CD1-CZ 4.13Å; F1168-F1173 AromaticContact CD2-CZ 3.93Å; F1168-F1173 HydrophobicContact CD2-CZ 3.93Å; F1168-F1173 HydrophobicContact CE1-CD2 4.19Å; F1168-F1173 AromaticContact CE1-CE2 3.89Å; F1168-F1173 HydrophobicContact CE1-CE2 4Å; F1168-F1173 HydrophobicContact CG-CD2 4.2Å; F1168-F1173 HydrophobicContact CG-CE2 4.46Å; F1168-F1173 HydrophobicContact CG-CZ 4.13Å; Q1169-F1173 WeakPolarHBondContact O-CB 3.21Å; Q1169-F1173 PolarHBondContact O-N 2.95Å; R1170-F1173 PolarHBondContact O-N 2.97Å; V1171-F1173 VanDerWaalsContact C-N 3.3Å; V1171-F1173 PolarHBondContact O-N 3.06Å; F1173-S1175 PolarHBondContact O-N 3.08Å; F1173-L1176 HydrophobicContact CD1-CD1 4.16Å; F1173-L1176 HydrophobicContact CD2-CB 4.49Å; F1173-L1176 HydrophobicContact CD2-CD1 3.87Å; F1173-L1176 HydrophobicContact CE2-CD1 4.44Å; F1173-L1176 CarbonylContact O-C 3.59Å; F1173-L1176 WeakPolarHBondContact O-CB 3.31Å; F1173-L1176 PolarHBondContact O-N 3.41Å
1174	N	57.4	Low	68.3	Low	121.8 Å²	121.8	86.7 Å²	86.7	65%	0.651	44%	0.441	S	S	*	.	H	α-helix	trans	-84.3	-20.3	-179.2	-72.4	-10.3	0	0	0	113.5	R1170 V1171 W1172	R1170-N1174 VanDerWaalsContact O-CB 3.26Å; R1170-N1174 WeakPolarHBondContact O-CB 3.39Å; R1170-N1174 VanDerWaalsContact O-CG 3.26Å; R1170-N1174 PolarHBondContact O-N 3.23Å; R1170-N1174 VanDerWaalsContact O-N 3.09Å; R1170-N1174 PolarHBondContact O-ND2 3.14Å; R1170-N1174 PolarHBondContact O-OD1 3.48Å; V1171-N1174 PolarHBondContact O-N 3.11Å; W1172-N1174 VanDerWaalsContact C-N 3.29Å; W1172-N1174 PolarHBondContact O-N 2.89Å
1175	S	56.6	Low	67.7	Low	52.6 Å²	52.6	82.5 Å²	82.5	37%	0.368	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	2.3	178.3	51.8	0	0	0	0	112.9	S426 V1171 W1172 F1173 G1177 H1178	S426-S1175 PolarHBondContact OG-O 3.13Å; S426-S1175 VanDerWaalsContact OG-O 3.07Å; V1171-S1175 WeakPolarHBondContact CG2-OG 3.29Å; V1171-S1175 WeakPolarHBondContact O-CB 3.33Å; V1171-S1175 PolarHBondContact O-N 3.13Å; V1171-S1175 VanDerWaalsContact O-N 3.11Å; V1171-S1175 PolarHBondContact O-OG 3.11Å; W1172-S1175 WeakPolarHBondContact CA-OG 3.35Å; W1172-S1175 CarbonylContact O-C 3.57Å; W1172-S1175 WeakPolarHBondContact O-CA 3.46Å; W1172-S1175 PolarHBondContact O-N 3.16Å; W1172-S1175 VanDerWaalsContact O-N 3.17Å; W1172-S1175 PolarHBondContact O-OG 3.16Å; F1173-S1175 PolarHBondContact O-N 3.08Å; S1175-G1177 VanDerWaalsContact C-N 3.33Å; S1175-G1177 PolarHBondContact O-N 3.02Å; S1175-H1178 PolarHBondContact O-CD2 3.12Å; S1175-H1178 PolarHBondContact O-N 3.15Å
1176	L	54.8	Low	67.4	Low	111.4 Å²	111.4	80.8 Å²	80.8	58%	0.583	42%	0.419	S	S	*	.			trans	-70.8	107.2	168.5	-66.8	174.9	0	0	0	109.4	W1172 F1173	W1172-L1176 HydrophobicContact CB-CD1 4.22Å; W1172-L1176 HydrophobicContact CD2-CD1 4.28Å; W1172-L1176 HydrophobicContact CE3-CD1 4.34Å; W1172-L1176 HydrophobicContact CG-CD1 4.26Å; W1172-L1176 WeakPolarHBondContact O-CG 3.39Å; W1172-L1176 PolarHBondContact O-N 3.2Å; F1173-L1176 HydrophobicContact CD1-CD1 4.16Å; F1173-L1176 HydrophobicContact CD2-CB 4.49Å; F1173-L1176 HydrophobicContact CD2-CD1 3.87Å; F1173-L1176 HydrophobicContact CE2-CD1 4.44Å; F1173-L1176 CarbonylContact O-C 3.59Å; F1173-L1176 WeakPolarHBondContact O-CB 3.31Å; F1173-L1176 PolarHBondContact O-N 3.41Å
1177	G	55.6	Low	67	Low	42.8 Å²	42.8	79.7 Å²	79.7	44%	0.441	42%	0.415	S	S	.	.			trans	-92	148.7	173.4	0	0	0	0	0	112.7	S426 S1175 L1179 S1256 A1257	S426-G1177 WeakPolarHBondContact OG-CA 3.19Å; S1175-G1177 VanDerWaalsContact C-N 3.33Å; S1175-G1177 PolarHBondContact O-N 3.02Å; G1177-L1179 WeakPolarHBondContact O-CG 3.18Å; G1177-L1179 PolarHBondContact O-N 3.16Å; G1177-S1256 CarbonylContact O-C 3.6Å; G1177-S1256 WeakPolarHBondContact O-CA 3.12Å; G1177-S1256 WeakPolarHBondContact O-CB 3.19Å; G1177-S1256 PolarHBondContact O-OG 3.47Å; G1177-A1257 PolarHBondContact O-N 3.13Å
1178	H	61.3	Low	66.8	Low	68.6 Å²	68.6	80.3 Å²	80.3	32%	0.318	41%	0.414	S	S	.	.			trans	-70.1	126.1	169.8	-47.5	-79.9	0	0	0	111.3	C423 S1175 T1180 Y1244 W1254 L1255	C423-H1178 PolarHBondContact SG-CD2 2.83Å; C423-H1178 PolarHBondContact SG-NE2 3.34Å; S1175-H1178 PolarHBondContact O-CD2 3.12Å; S1175-H1178 PolarHBondContact O-N 3.15Å; H1178-T1180 VanDerWaalsContact CB-O 3.26Å; H1178-T1180 WeakPolarHBondContact CB-O 3.23Å; H1178-T1180 PolarHBondContact O-N 3.2Å; H1178-Y1244 AromaticContact NE2-CE2 3.71Å; H1178-W1254 HydrophobicContact CB-CB 3.57Å; H1178-W1254 HydrophobicContact CB-CD2 4.05Å; H1178-W1254 HydrophobicContact CB-CE3 3.85Å; H1178-W1254 HydrophobicContact CB-CG 4.01Å; H1178-W1254 PolarHBondContact CE1-O 3.2Å; H1178-W1254 VanDerWaalsContact CG-CB 3.46Å; H1178-W1254 WeakPolarHBondContact ND1-CB 3.42Å; H1178-W1254 PolarHBondContact ND1-O 3.13Å; H1178-W1254 VanDerWaalsContact O-CZ3 3.31Å; H1178-W1254 WeakPolarHBondContact O-CZ3 3.35Å; H1178-L1255 CarbonylContact C-O 3.58Å; H1178-L1255 VanDerWaalsContact C-O 3.3Å; H1178-L1255 VanDerWaalsContact CA-O 3.25Å; H1178-L1255 WeakPolarHBondContact CA-O 3.42Å
1179	L	63.2	Low	66.8	Low	127 Å²	127	80.2 Å²	80.2	67%	0.665	41%	0.412	S	S	*	.	S	Bend	trans	-98.5	-15.6	179.1	-63.3	177.3	0	0	0	113	Y441 N445 G1177 L1255 A1257	Y441-L1179 PolarHBondContact OH-O 2.94Å; Y441-L1179 VanDerWaalsContact OH-O 3.1Å; N445-L1179 PolarHBondContact ND2-O 3.27Å; N445-L1179 PolarHBondContact OD1-O 2.99Å; G1177-L1179 WeakPolarHBondContact O-CG 3.18Å; G1177-L1179 PolarHBondContact O-N 3.16Å; L1179-L1255 PolarHBondContact N-O 3.1Å; L1179-A1257 HydrophobicContact CD1-CB 3.67Å; L1179-A1257 HydrophobicContact CG-CB 4Å
1180	T	67.4	Low	67.1	Low	89.6 Å²	89.6	78.5 Å²	78.5	55%	0.55	40%	0.404	S	S	.	.	S	Bend	trans	-130.8	138.8	-180	54.2	0	0	0	0	109.8	H1178 L1255	H1178-T1180 VanDerWaalsContact CB-O 3.26Å; H1178-T1180 WeakPolarHBondContact CB-O 3.23Å; H1178-T1180 PolarHBondContact O-N 3.2Å; T1180-L1255 PolarHBondContact N-O 3.35Å; T1180-L1255 PolarHBondContact O-N 3.08Å; T1180-L1255 WeakPolarHBondContact OG1-CB 3.47Å
1181	L	73.9	Confident	67.3	Low	44.6 Å²	44.6	73 Å²	73	23%	0.234	39%	0.386	C	S	.	.			trans	-86.9	128.8	175.7	-100.3	140.1	0	0	0	109.6	M418 V427 F431 N445 W1252 W1254	M418-L1181 HydrophobicContact CB-CB 4.42Å; M418-L1181 HydrophobicContact CB-CD2 4.22Å; V427-L1181 HydrophobicContact CG1-CD2 3.9Å; V427-L1181 HydrophobicContact CG2-CD2 4.37Å; F431-L1181 HydrophobicContact CZ-CD1 4.02Å; F431-L1181 HydrophobicContact CZ-CD2 4.36Å; N445-L1181 HydrophobicContact CB-CD1 4.13Å; N445-L1181 HydrophobicContact CB-CG 4.24Å; L1181-W1252 HydrophobicContact CD1-CB 4.17Å; L1181-W1252 HydrophobicContact CD1-CE3 4.26Å; L1181-W1252 HydrophobicContact CD2-CD2 4.15Å; L1181-W1252 HydrophobicContact CD2-CE3 3.58Å; L1181-W1252 HydrophobicContact CD2-CG 4.5Å; L1181-W1252 HydrophobicContact CD2-CH2 4.46Å; L1181-W1252 HydrophobicContact CD2-CZ3 3.83Å; L1181-W1252 HydrophobicContact CG-CB 4.36Å; L1181-W1252 HydrophobicContact CG-CD2 4.37Å; L1181-W1252 HydrophobicContact CG-CE3 3.67Å; L1181-W1252 HydrophobicContact CG-CZ3 4.17Å; L1181-W1254 HydrophobicContact CB-CD2 4.47Å; L1181-W1254 HydrophobicContact CB-CE3 4.18Å; L1181-W1254 HydrophobicContact CB-CH2 4.42Å; L1181-W1254 HydrophobicContact CB-CZ3 4.13Å; L1181-W1254 HydrophobicContact CD1-CD2 3.6Å; L1181-W1254 VanDerWaalsContact CD1-CE2 3.42Å; L1181-W1254 HydrophobicContact CD1-CE3 4.09Å; L1181-W1254 HydrophobicContact CD1-CG 3.93Å; L1181-W1254 HydrophobicContact CD1-CH2 4.38Å; L1181-W1254 HydrophobicContact CD1-CZ2 3.9Å; L1181-W1254 HydrophobicContact CD1-CZ3 4.46Å
1182	E	71	Confident	67.6	Low	88.4 Å²	88.4	71.6 Å²	71.6	41%	0.413	38%	0.376	S	S	.	.			trans	-111.1	113.6	176	-160.4	-179.3	-174.7	0	0	109	M418 C419 W1252 M1253 L1255 L1304	M418-E1182 CarbonylContact C-O 3.6Å; M418-E1182 WeakPolarHBondContact CA-O 3.43Å; M418-E1182 CarbonylContact O-C 3.57Å; M418-E1182 PolarHBondContact O-N 3.09Å; M418-E1182 VanDerWaalsContact O-O 3.12Å; C419-E1182 PolarHBondContact N-O 3.25Å; E1182-W1252 CarbonylContact O-C 3.59Å; E1182-W1252 WeakPolarHBondContact O-CA 3.31Å; E1182-M1253 HydrophobicContact CB-CG 4.1Å; E1182-M1253 HydrophobicContact CG-CG 4.44Å; E1182-M1253 PolarHBondContact N-O 3.17Å; E1182-M1253 CarbonylContact O-C 3.39Å; E1182-M1253 WeakPolarHBondContact O-CA 3.21Å; E1182-M1253 WeakPolarHBondContact O-CG 3.45Å; E1182-M1253 PolarHBondContact O-N 3.22Å; E1182-L1255 HydrophobicContact CB-CD1 4.32Å; E1182-L1255 HydrophobicContact CB-CG 4.34Å; E1182-L1255 WeakPolarHBondContact OE2-CD1 3.31Å; E1182-L1304 WeakPolarHBondContact OE2-CD2 3.28Å
1183	R	76.6	Confident	68.4	Low	61.8 Å²	61.8	71.1 Å²	71.1	23%	0.233	38%	0.377	C	S	.	.			trans	-89.5	122.3	-178.7	-173.8	176.1	-173.2	-105.8	1.1	110.6	D411 T416 T417 M418 T453 D481 E1040 T1185 W1252	D411-R1183 IonicContact OD1-CZ 3.45Å; D411-R1183 IonicContact OD1-NE 3.42Å; D411-R1183 IonicContact OD1-NH2 3.17Å; D411-R1183 PolarHBondContact OD1-NH2 3.31Å; D411-R1183 VanDerWaalsContact OD1-NH2 3.15Å; D411-R1183 IonicContact OD2-CZ 2.77Å; D411-R1183 IonicContact OD2-NE 3.5Å; D411-R1183 PolarHBondContact OD2-NE 3.34Å; D411-R1183 IonicContact OD2-NH2 3.9Å; D411-R1183 PolarHBondContact OD2-NH2 3.35Å; T416-R1183 HydrophobicContact CG2-CG 3.83Å; T417-R1183 CarbonylContact O-C 3.58Å; T417-R1183 WeakPolarHBondContact O-CA 3.28Å; M418-R1183 HydrophobicContact CE-CG 4.07Å; M418-R1183 HydrophobicContact SD-CB 3.78Å; M418-R1183 HydrophobicContact SD-CG 3.67Å; T453-R1183 HydrophobicContact CG2-CB 3.65Å; T453-R1183 HydrophobicContact CG2-CG 3.87Å; T453-R1183 VanDerWaalsContact CG2-O 3.26Å; T453-R1183 WeakPolarHBondContact CG2-O 3.44Å; T453-R1183 PolarHBondContact OG1-NH1 2.84Å; D481-R1183 IonicContact OD1-CZ 3.72Å; D481-R1183 IonicContact OD1-NH1 2.55Å; D481-R1183 PolarHBondContact OD1-NH1 3.12Å; D481-R1183 IonicContact OD1-NH2 2.79Å; D481-R1183 PolarHBondContact OD1-NH2 3.37Å; E1040-R1183 IonicContact OE1-CZ 3.11Å; E1040-R1183 IonicContact OE1-NE 2.73Å; E1040-R1183 PolarHBondContact OE1-NE 2.92Å; E1040-R1183 IonicContact OE1-NH2 2.93Å; E1040-R1183 PolarHBondContact OE1-NH2 3.2Å; E1040-R1183 IonicContact OE2-CZ 3.13Å; E1040-R1183 IonicContact OE2-NH2 2.75Å; E1040-R1183 PolarHBondContact OE2-NH2 2.96Å; R1183-T1185 PolarHBondContact O-N 3.14Å; R1183-T1185 VanDerWaalsContact O-N 3.12Å; R1183-W1252 HydrophobicContact CB-CD2 4.25Å; R1183-W1252 HydrophobicContact CB-CE3 3.66Å; R1183-W1252 HydrophobicContact CB-CH2 4.19Å; R1183-W1252 HydrophobicContact CB-CZ3 3.66Å; R1183-W1252 HydrophobicContact CG-CD2 4.27Å; R1183-W1252 HydrophobicContact CG-CE3 4.17Å; R1183-W1252 HydrophobicContact CG-CH2 4.44Å; R1183-W1252 HydrophobicContact CG-CZ2 4.44Å; R1183-W1252 HydrophobicContact CG-CZ3 4.29Å
1184	M	74.7	Confident	69.1	Low	30.4 Å²	30.4	72.7 Å²	72.7	15%	0.15	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-111.5	114.5	172.5	-74.9	-173.4	69.6	0	0	110	T417 Q1188 R1189 D1192 G1249 G1251 M1253 L1304	T417-M1184 PolarHBondContact N-O 3.28Å; T417-M1184 PolarHBondContact O-N 3.07Å; T417-M1184 PolarHBondContact OG1-O 2.84Å; M1184-Q1188 HydrophobicContact CE-CG 4.39Å; M1184-R1189 HydrophobicContact CB-CG 4.11Å; M1184-R1189 HydrophobicContact CE-CG 3.82Å; M1184-R1189 PolarHBondContact O-NH1 3.2Å; M1184-R1189 VanDerWaalsContact O-NH1 3.14Å; M1184-R1189 PolarHBondContact O-NH2 3.45Å; M1184-R1189 HydrophobicContact SD-CG 4.47Å; M1184-D1192 VanDerWaalsContact CE-OD2 3.25Å; M1184-D1192 WeakPolarHBondContact CE-OD2 3.31Å; M1184-G1249 WeakPolarHBondContact SD-CA 3.27Å; M1184-G1251 PolarHBondContact N-O 3.04Å; M1184-G1251 VanDerWaalsContact N-O 3.14Å; M1184-M1253 HydrophobicContact CG-SD 3.89Å; M1184-M1253 HydrophobicContact SD-CE 3.86Å; M1184-M1253 HydrophobicContact SD-SD 3.91Å; M1184-L1304 HydrophobicContact CG-CD1 4.03Å; M1184-L1304 HydrophobicContact SD-CB 4.04Å; M1184-L1304 HydrophobicContact SD-CD1 4Å; M1184-L1304 HydrophobicContact SD-CD2 4.48Å
1185	T	74.7	Confident	69.8	Low	26.4 Å²	26.4	71 Å²	71	16%	0.162	37%	0.371	C	S	.	.			trans	-72.8	161.2	179.6	66.7	0	0	0	0	111.6	T416 D481 R1183 S1187 Q1188 R1189	T416-T1185 HydrophobicContact CG2-CG2 4.39Å; D481-T1185 HydrophobicContact CB-CG2 4.05Å; D481-T1185 VanDerWaalsContact CG-CG2 3.45Å; D481-T1185 VanDerWaalsContact OD1-CG2 3.28Å; D481-T1185 WeakPolarHBondContact OD1-CG2 3.45Å; R1183-T1185 PolarHBondContact O-N 3.14Å; R1183-T1185 VanDerWaalsContact O-N 3.12Å; T1185-S1187 VanDerWaalsContact C-N 3.32Å; T1185-S1187 PolarHBondContact O-N 3.18Å; T1185-S1187 PolarHBondContact OG1-OG 3.11Å; T1185-S1187 VanDerWaalsContact OG1-OG 3.09Å; T1185-Q1188 PolarHBondContact O-N 3.06Å; T1185-Q1188 VanDerWaalsContact OG1-CB 3.27Å; T1185-Q1188 WeakPolarHBondContact OG1-CB 3.28Å; T1185-Q1188 PolarHBondContact OG1-N 3.12Å; T1185-Q1188 VanDerWaalsContact OG1-N 3.13Å; T1185-R1189 WeakPolarHBondContact O-CB 3.46Å; T1185-R1189 WeakPolarHBondContact O-CG 3.38Å; T1185-R1189 PolarHBondContact O-N 3.1Å
1186	A	73.7	Confident	70.4	Confident	51.4 Å²	51.4	74.3 Å²	74.3	43%	0.425	38%	0.375	S	S	.	.	H	α-helix	trans	-62.2	-36.9	175.5	0	0	0	0	0	112.3	N414 Q1188 R1189 E1190	N414-A1186 WeakPolarHBondContact O-CB 3.09Å; A1186-Q1188 PolarHBondContact O-N 3.39Å; A1186-R1189 PolarHBondContact O-N 3.29Å; A1186-E1190 VanDerWaalsContact O-CB 3.27Å; A1186-E1190 WeakPolarHBondContact O-CB 3.31Å; A1186-E1190 PolarHBondContact O-N 3.14Å; A1186-E1190 VanDerWaalsContact O-N 3.13Å
1187	S	71	Confident	71.3	Confident	60.6 Å²	60.6	73.7 Å²	73.7	42%	0.424	37%	0.369	S	S	.	.	H	α-helix	trans	-64.7	-46.6	174.5	52.4	0	0	0	0	112	T1185 R1189 E1190 E1191	T1185-S1187 VanDerWaalsContact C-N 3.32Å; T1185-S1187 PolarHBondContact O-N 3.18Å; T1185-S1187 PolarHBondContact OG1-OG 3.11Å; T1185-S1187 VanDerWaalsContact OG1-OG 3.09Å; S1187-R1189 VanDerWaalsContact C-N 3.3Å; S1187-R1189 PolarHBondContact O-N 3.17Å; S1187-E1190 PolarHBondContact O-N 3.02Å; S1187-E1190 VanDerWaalsContact O-N 3.13Å; S1187-E1191 WeakPolarHBondContact O-CB 3.2Å; S1187-E1191 PolarHBondContact O-N 3.07Å
1188	Q	72.5	Confident	72	Confident	51.4 Å²	51.4	78.3 Å²	78.3	24%	0.24	38%	0.377	C	S	.	.	H	α-helix	trans	-62	-42.4	178.1	-172.8	141.4	23.5	0	0	111.5	M1184 T1185 A1186 E1190 E1191 D1192	M1184-Q1188 HydrophobicContact CE-CG 4.39Å; T1185-Q1188 PolarHBondContact O-N 3.06Å; T1185-Q1188 VanDerWaalsContact OG1-CB 3.27Å; T1185-Q1188 WeakPolarHBondContact OG1-CB 3.28Å; T1185-Q1188 PolarHBondContact OG1-N 3.12Å; T1185-Q1188 VanDerWaalsContact OG1-N 3.13Å; A1186-Q1188 PolarHBondContact O-N 3.39Å; Q1188-E1190 VanDerWaalsContact C-N 3.27Å; Q1188-E1190 PolarHBondContact O-N 3.24Å; Q1188-E1191 PolarHBondContact NE2-OE2 2.94Å; Q1188-E1191 PolarHBondContact O-N 3.08Å; Q1188-D1192 VanDerWaalsContact O-CB 3.3Å; Q1188-D1192 WeakPolarHBondContact O-CB 3.42Å; Q1188-D1192 PolarHBondContact O-N 3.09Å
1189	R	74.1	Confident	72.2	Confident	65.8 Å²	65.8	79.8 Å²	79.8	25%	0.248	39%	0.388	C	S	.	.	H	α-helix	trans	-63.2	-37.1	175.5	-109.4	-170	-52.5	-136.7	-6	112.5	G415 T417 M1184 T1185 A1186 S1187 E1191 D1192 K1193 E1243 D1250	G415-R1189 PolarHBondContact O-NH1 3Å; G415-R1189 PolarHBondContact O-NH2 3.38Å; T417-R1189 PolarHBondContact OG1-NH1 2.97Å; M1184-R1189 HydrophobicContact CB-CG 4.11Å; M1184-R1189 HydrophobicContact CE-CG 3.82Å; M1184-R1189 PolarHBondContact O-NH1 3.2Å; M1184-R1189 VanDerWaalsContact O-NH1 3.14Å; M1184-R1189 PolarHBondContact O-NH2 3.45Å; M1184-R1189 HydrophobicContact SD-CG 4.47Å; T1185-R1189 WeakPolarHBondContact O-CB 3.46Å; T1185-R1189 WeakPolarHBondContact O-CG 3.38Å; T1185-R1189 PolarHBondContact O-N 3.1Å; A1186-R1189 PolarHBondContact O-N 3.29Å; S1187-R1189 VanDerWaalsContact C-N 3.3Å; S1187-R1189 PolarHBondContact O-N 3.17Å; R1189-E1191 VanDerWaalsContact C-N 3.33Å; R1189-D1192 WeakPolarHBondContact O-CB 3.23Å; R1189-D1192 PolarHBondContact O-N 3.31Å; R1189-K1193 WeakPolarHBondContact O-CB 3.29Å; R1189-K1193 VanDerWaalsContact O-CG 3.28Å; R1189-K1193 WeakPolarHBondContact O-CG 3.33Å; R1189-K1193 PolarHBondContact O-N 3.16Å; R1189-K1193 VanDerWaalsContact O-N 3.12Å; R1189-E1243 IonicContact CZ-OE1 3.5Å; R1189-E1243 IonicContact NH2-OE1 3.77Å; R1189-E1243 PolarHBondContact NH2-OE1 3.14Å; R1189-D1250 VanDerWaalsContact CD-OD1 3.29Å; R1189-D1250 WeakPolarHBondContact CD-OD1 3.18Å; R1189-D1250 WeakPolarHBondContact CG-OD1 3.37Å; R1189-D1250 VanDerWaalsContact CZ-CG 3.47Å; R1189-D1250 IonicContact CZ-OD1 3.67Å; R1189-D1250 IonicContact CZ-OD2 2.69Å; R1189-D1250 IonicContact NE-OD1 2.74Å; R1189-D1250 PolarHBondContact NE-OD1 2.91Å; R1189-D1250 IonicContact NH1-OD1 3.14Å; R1189-D1250 PolarHBondContact NH1-OD1 3.03Å; R1189-D1250 IonicContact NH1-OD2 3.05Å; R1189-D1250 PolarHBondContact NH1-OD2 3.29Å; R1189-D1250 PolarHBondContact NH2-O 3.32Å; R1189-D1250 IonicContact NH2-OD1 3.43Å; R1189-D1250 PolarHBondContact NH2-OD1 3.28Å
1190	E	74.3	Confident	72.3	Confident	70.6 Å²	70.6	80.4 Å²	80.4	33%	0.33	38%	0.381	S	S	.	.	H	α-helix	trans	-73	-36.7	178.1	-172	57	-154	0	0	111.8	A1186 S1187 Q1188 K1193 R1194	A1186-E1190 VanDerWaalsContact O-CB 3.27Å; A1186-E1190 WeakPolarHBondContact O-CB 3.31Å; A1186-E1190 PolarHBondContact O-N 3.14Å; A1186-E1190 VanDerWaalsContact O-N 3.13Å; S1187-E1190 PolarHBondContact O-N 3.02Å; S1187-E1190 VanDerWaalsContact O-N 3.13Å; Q1188-E1190 VanDerWaalsContact C-N 3.27Å; Q1188-E1190 PolarHBondContact O-N 3.24Å; E1190-K1193 WeakPolarHBondContact O-CB 3.21Å; E1190-K1193 PolarHBondContact O-N 3.17Å; E1190-K1193 WeakPolarHBondContact OE2-CD 3.3Å; E1190-K1193 IonicContact OE2-NZ 3.28Å; E1190-K1193 PolarHBondContact OE2-NZ 2.97Å; E1190-K1193 VanDerWaalsContact OE2-NZ 3.17Å; E1190-R1194 VanDerWaalsContact O-CG 3.27Å; E1190-R1194 WeakPolarHBondContact O-CG 3.32Å; E1190-R1194 PolarHBondContact O-N 3.14Å; E1190-R1194 VanDerWaalsContact O-N 3.1Å; E1190-R1194 IonicContact OE1-CZ 3.22Å; E1190-R1194 VanDerWaalsContact OE1-CZ 3.29Å; E1190-R1194 IonicContact OE1-NE 2.74Å; E1190-R1194 PolarHBondContact OE1-NE 3.47Å; E1190-R1194 IonicContact OE1-NH2 3.12Å; E1190-R1194 PolarHBondContact OE1-NH2 3.15Å
1191	E	71.5	Confident	72	Confident	75.4 Å²	75.4	82.5 Å²	82.5	35%	0.352	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-46.3	170.1	-173.6	173.8	-157.9	0	0	111.9	S1187 Q1188 R1189 K1193 R1194 L1195	S1187-E1191 WeakPolarHBondContact O-CB 3.2Å; S1187-E1191 PolarHBondContact O-N 3.07Å; Q1188-E1191 PolarHBondContact NE2-OE2 2.94Å; Q1188-E1191 PolarHBondContact O-N 3.08Å; R1189-E1191 VanDerWaalsContact C-N 3.33Å; E1191-K1193 VanDerWaalsContact C-N 3.27Å; E1191-K1193 PolarHBondContact O-N 3.16Å; E1191-R1194 CarbonylContact O-C 3.55Å; E1191-R1194 WeakPolarHBondContact O-CA 3.43Å; E1191-R1194 WeakPolarHBondContact O-CB 3.35Å; E1191-R1194 PolarHBondContact O-N 2.92Å; E1191-L1195 HydrophobicContact CG-CD1 4.11Å; E1191-L1195 HydrophobicContact CG-CG 4.47Å; E1191-L1195 WeakPolarHBondContact O-CG 3.29Å; E1191-L1195 PolarHBondContact O-N 3.17Å
1192	D	72.1	Confident	71	Confident	35 Å²	35	83.1 Å²	83.1	19%	0.187	39%	0.391	C	S	.	.	H	α-helix	trans	-58.6	-38.4	175.1	-104.1	4.1	0	0	0	112	M1184 Q1188 R1189 L1195 R1196 Q1305	M1184-D1192 VanDerWaalsContact CE-OD2 3.25Å; M1184-D1192 WeakPolarHBondContact CE-OD2 3.31Å; Q1188-D1192 VanDerWaalsContact O-CB 3.3Å; Q1188-D1192 WeakPolarHBondContact O-CB 3.42Å; Q1188-D1192 PolarHBondContact O-N 3.09Å; R1189-D1192 WeakPolarHBondContact O-CB 3.23Å; R1189-D1192 PolarHBondContact O-N 3.31Å; D1192-L1195 PolarHBondContact O-N 2.94Å; D1192-R1196 WeakPolarHBondContact O-CB 3.4Å; D1192-R1196 WeakPolarHBondContact O-CD 3.38Å; D1192-R1196 WeakPolarHBondContact O-CG 3.36Å; D1192-R1196 PolarHBondContact O-N 2.98Å; D1192-R1196 IonicContact OD1-NE 3.7Å; D1192-R1196 IonicContact OD2-CZ 2.66Å; D1192-R1196 IonicContact OD2-NE 2.75Å; D1192-R1196 PolarHBondContact OD2-NE 3.3Å; D1192-R1196 IonicContact OD2-NH2 2.9Å; D1192-R1196 PolarHBondContact OD2-NH2 3.18Å; D1192-Q1305 PolarHBondContact O-NE2 2.89Å; D1192-Q1305 PolarHBondContact OD1-NE2 3.14Å; D1192-Q1305 WeakPolarHBondContact OD2-CG 3.49Å; D1192-Q1305 PolarHBondContact OD2-NE2 3.15Å; D1192-Q1305 VanDerWaalsContact OD2-NE2 3.16Å
1193	K	77.3	Confident	70.1	Confident	104 Å²	104	82.2 Å²	82.2	45%	0.452	39%	0.394	S	S	.	.	H	α-helix	trans	-64.1	-43.7	172.3	-74.6	174.4	-159.9	165.3	0	111.8	R1189 E1190 E1191 R1196 Q1197	R1189-K1193 WeakPolarHBondContact O-CB 3.29Å; R1189-K1193 VanDerWaalsContact O-CG 3.28Å; R1189-K1193 WeakPolarHBondContact O-CG 3.33Å; R1189-K1193 PolarHBondContact O-N 3.16Å; R1189-K1193 VanDerWaalsContact O-N 3.12Å; E1190-K1193 WeakPolarHBondContact O-CB 3.21Å; E1190-K1193 PolarHBondContact O-N 3.17Å; E1190-K1193 WeakPolarHBondContact OE2-CD 3.3Å; E1190-K1193 IonicContact OE2-NZ 3.28Å; E1190-K1193 PolarHBondContact OE2-NZ 2.97Å; E1190-K1193 VanDerWaalsContact OE2-NZ 3.17Å; E1191-K1193 VanDerWaalsContact C-N 3.27Å; E1191-K1193 PolarHBondContact O-N 3.16Å; K1193-R1196 CarbonylContact O-C 3.47Å; K1193-R1196 PolarHBondContact O-N 3.37Å; K1193-Q1197 WeakPolarHBondContact O-CB 3.45Å; K1193-Q1197 VanDerWaalsContact O-CG 3.3Å; K1193-Q1197 WeakPolarHBondContact O-CG 3.19Å; K1193-Q1197 PolarHBondContact O-N 2.89Å
1194	R	77.3	Confident	68.8	Low	147.2 Å²	147.2	83.7 Å²	83.7	56%	0.555	41%	0.41	S	S	*	.	H	α-helix	trans	-64.2	-42.6	177.8	-72.6	172.5	-171.1	157	2.5	111.6	E1190 E1191 Q1197 F1198	E1190-R1194 VanDerWaalsContact O-CG 3.27Å; E1190-R1194 WeakPolarHBondContact O-CG 3.32Å; E1190-R1194 PolarHBondContact O-N 3.14Å; E1190-R1194 VanDerWaalsContact O-N 3.1Å; E1190-R1194 IonicContact OE1-CZ 3.22Å; E1190-R1194 VanDerWaalsContact OE1-CZ 3.29Å; E1190-R1194 IonicContact OE1-NE 2.74Å; E1190-R1194 PolarHBondContact OE1-NE 3.47Å; E1190-R1194 IonicContact OE1-NH2 3.12Å; E1190-R1194 PolarHBondContact OE1-NH2 3.15Å; E1191-R1194 CarbonylContact O-C 3.55Å; E1191-R1194 WeakPolarHBondContact O-CA 3.43Å; E1191-R1194 WeakPolarHBondContact O-CB 3.35Å; E1191-R1194 PolarHBondContact O-N 2.92Å; R1194-Q1197 WeakPolarHBondContact O-CB 3.37Å; R1194-Q1197 PolarHBondContact O-N 3.06Å; R1194-Q1197 VanDerWaalsContact O-N 3.16Å; R1194-F1198 WeakPolarHBondContact O-CB 3.29Å; R1194-F1198 PolarHBondContact O-N 2.95Å
1195	L	72.3	Confident	67.7	Low	86.6 Å²	86.6	88 Å²	88	45%	0.453	44%	0.438	S	S	.	.	H	α-helix	trans	-60.6	-48.5	173.8	-71.6	166.1	0	0	0	110.9	E1191 D1192 Q1197 F1198 D1199	E1191-L1195 HydrophobicContact CG-CD1 4.11Å; E1191-L1195 HydrophobicContact CG-CG 4.47Å; E1191-L1195 WeakPolarHBondContact O-CG 3.29Å; E1191-L1195 PolarHBondContact O-N 3.17Å; D1192-L1195 PolarHBondContact O-N 2.94Å; L1195-Q1197 VanDerWaalsContact C-N 3.3Å; L1195-Q1197 PolarHBondContact O-N 2.86Å; L1195-Q1197 VanDerWaalsContact O-N 3.13Å; L1195-F1198 WeakPolarHBondContact O-CB 3.29Å; L1195-F1198 PolarHBondContact O-N 2.99Å; L1195-F1198 VanDerWaalsContact O-N 3.14Å; L1195-D1199 PolarHBondContact O-N 3.2Å
1196	R	69.8	Low	66.3	Low	121.6 Å²	121.6	91 Å²	91	46%	0.459	46%	0.46	S	S	.	.	H	α-helix	trans	-62	-27.7	174.7	-71.5	172.1	-169.7	-152.5	8.2	113.5	D1192 K1193 R1200 Q1305	D1192-R1196 WeakPolarHBondContact O-CB 3.4Å; D1192-R1196 WeakPolarHBondContact O-CD 3.38Å; D1192-R1196 WeakPolarHBondContact O-CG 3.36Å; D1192-R1196 PolarHBondContact O-N 2.98Å; D1192-R1196 IonicContact OD1-NE 3.7Å; D1192-R1196 IonicContact OD2-CZ 2.66Å; D1192-R1196 IonicContact OD2-NE 2.75Å; D1192-R1196 PolarHBondContact OD2-NE 3.3Å; D1192-R1196 IonicContact OD2-NH2 2.9Å; D1192-R1196 PolarHBondContact OD2-NH2 3.18Å; K1193-R1196 CarbonylContact O-C 3.47Å; K1193-R1196 PolarHBondContact O-N 3.37Å; R1196-R1200 VanDerWaalsContact O-CG 3.29Å; R1196-R1200 WeakPolarHBondContact O-CG 3.4Å; R1196-R1200 PolarHBondContact O-N 3.11Å; R1196-R1200 VanDerWaalsContact O-N 3.14Å; R1196-R1200 PolarHBondContact O-NE 3.12Å; R1196-R1200 PolarHBondContact O-NH2 2.72Å; R1196-R1200 VanDerWaalsContact O-NH2 3.14Å; R1196-Q1305 VanDerWaalsContact NE-OE1 3.1Å
1197	Q	73	Confident	64.6	Low	98.4 Å²	98.4	91.4 Å²	91.4	46%	0.46	47%	0.469	S	S	.	.	H	α-helix	trans	-77	-44.8	172.6	-91.1	179.5	-1.1	0	0	110.8	K1193 R1194 L1195 D1199 R1200 F1201	K1193-Q1197 WeakPolarHBondContact O-CB 3.45Å; K1193-Q1197 VanDerWaalsContact O-CG 3.3Å; K1193-Q1197 WeakPolarHBondContact O-CG 3.19Å; K1193-Q1197 PolarHBondContact O-N 2.89Å; R1194-Q1197 WeakPolarHBondContact O-CB 3.37Å; R1194-Q1197 PolarHBondContact O-N 3.06Å; R1194-Q1197 VanDerWaalsContact O-N 3.16Å; L1195-Q1197 VanDerWaalsContact C-N 3.3Å; L1195-Q1197 PolarHBondContact O-N 2.86Å; L1195-Q1197 VanDerWaalsContact O-N 3.13Å; Q1197-D1199 VanDerWaalsContact C-N 3.32Å; Q1197-D1199 PolarHBondContact O-N 2.8Å; Q1197-R1200 CarbonylContact O-C 3.55Å; Q1197-R1200 WeakPolarHBondContact O-CA 3.2Å; Q1197-R1200 WeakPolarHBondContact O-CB 3.29Å; Q1197-R1200 PolarHBondContact O-N 3.1Å; Q1197-R1200 VanDerWaalsContact O-N 3.12Å; Q1197-F1201 HydrophobicContact CB-CD2 4.39Å; Q1197-F1201 HydrophobicContact CB-CE2 4.19Å; Q1197-F1201 WeakPolarHBondContact O-CD2 3.37Å; Q1197-F1201 PolarHBondContact O-N 3.14Å
1198	F	71	Confident	62.9	Low	139 Å²	139	91.4 Å²	91.4	61%	0.61	48%	0.479	S	S	*	.	H	α-helix	trans	-60.1	-42.6	177.9	-172.5	-94.9	0	0	0	112.1	R1194 L1195 R1200 F1201 S1202	R1194-F1198 WeakPolarHBondContact O-CB 3.29Å; R1194-F1198 PolarHBondContact O-N 2.95Å; L1195-F1198 WeakPolarHBondContact O-CB 3.29Å; L1195-F1198 PolarHBondContact O-N 2.99Å; L1195-F1198 VanDerWaalsContact O-N 3.14Å; F1198-R1200 VanDerWaalsContact C-N 3.31Å; F1198-R1200 PolarHBondContact O-N 3.17Å; F1198-F1201 CarbonylContact O-C 3.55Å; F1198-F1201 PolarHBondContact O-N 3.18Å; F1198-F1201 VanDerWaalsContact O-N 3.11Å; F1198-S1202 VanDerWaalsContact O-CB 3.26Å; F1198-S1202 WeakPolarHBondContact O-CB 3.39Å; F1198-S1202 PolarHBondContact O-N 2.9Å
1199	D	63.8	Low	61.2	Low	100.2 Å²	100.2	96.4 Å²	96.4	54%	0.536	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-36.9	175.2	-72.4	-22.2	0	0	0	112.2	L1195 Q1197 S1203	L1195-D1199 PolarHBondContact O-N 3.2Å; Q1197-D1199 VanDerWaalsContact C-N 3.32Å; Q1197-D1199 PolarHBondContact O-N 2.8Å; D1199-S1203 WeakPolarHBondContact O-CB 3.38Å; D1199-S1203 PolarHBondContact O-N 3.03Å; D1199-S1203 VanDerWaalsContact O-N 3.12Å; D1199-S1203 PolarHBondContact O-OG 3.28Å
1200	R	66.8	Low	59.4	Low	139.8 Å²	139.8	97 Å²	97	53%	0.528	54%	0.539	S	S	.	.	H	α-helix	trans	-67	-38.7	172.9	-77.3	177.8	-135.1	174.8	1.3	112.1	R1196 Q1197 F1198 S1203 T1204 E1243	R1196-R1200 VanDerWaalsContact O-CG 3.29Å; R1196-R1200 WeakPolarHBondContact O-CG 3.4Å; R1196-R1200 PolarHBondContact O-N 3.11Å; R1196-R1200 VanDerWaalsContact O-N 3.14Å; R1196-R1200 PolarHBondContact O-NE 3.12Å; R1196-R1200 PolarHBondContact O-NH2 2.72Å; R1196-R1200 VanDerWaalsContact O-NH2 3.14Å; Q1197-R1200 CarbonylContact O-C 3.55Å; Q1197-R1200 WeakPolarHBondContact O-CA 3.2Å; Q1197-R1200 WeakPolarHBondContact O-CB 3.29Å; Q1197-R1200 PolarHBondContact O-N 3.1Å; Q1197-R1200 VanDerWaalsContact O-N 3.12Å; F1198-R1200 VanDerWaalsContact C-N 3.31Å; F1198-R1200 PolarHBondContact O-N 3.17Å; R1200-S1203 WeakPolarHBondContact O-CB 3.36Å; R1200-S1203 PolarHBondContact O-N 3.14Å; R1200-S1203 PolarHBondContact O-OG 2.81Å; R1200-S1203 VanDerWaalsContact O-OG 3.11Å; R1200-T1204 PolarHBondContact O-N 3.04Å; R1200-T1204 VanDerWaalsContact O-N 3.11Å; R1200-T1204 PolarHBondContact O-OG1 2.85Å; R1200-E1243 IonicContact NH2-OE1 2.75Å
1201	F	61.1	Low	57.4	Low	133.2 Å²	133.2	98 Å²	98	58%	0.584	55%	0.554	S	S	*	*	H	α-helix	trans	-71.3	-37.7	176.1	-70.8	-60.9	0	0	0	112.7	Q1197 F1198 S1203 T1204 V1205	Q1197-F1201 HydrophobicContact CB-CD2 4.39Å; Q1197-F1201 HydrophobicContact CB-CE2 4.19Å; Q1197-F1201 WeakPolarHBondContact O-CD2 3.37Å; Q1197-F1201 PolarHBondContact O-N 3.14Å; F1198-F1201 CarbonylContact O-C 3.55Å; F1198-F1201 PolarHBondContact O-N 3.18Å; F1198-F1201 VanDerWaalsContact O-N 3.11Å; F1201-S1203 VanDerWaalsContact C-N 3.27Å; F1201-S1203 PolarHBondContact O-N 3.03Å; F1201-T1204 VanDerWaalsContact CA-OG1 3.29Å; F1201-T1204 WeakPolarHBondContact CA-OG1 3.33Å; F1201-T1204 PolarHBondContact O-N 3.2Å; F1201-T1204 VanDerWaalsContact O-N 3.08Å; F1201-T1204 PolarHBondContact O-OG1 3.18Å; F1201-T1204 VanDerWaalsContact O-OG1 3.08Å; F1201-V1205 WeakPolarHBondContact O-CG2 3.36Å; F1201-V1205 PolarHBondContact O-N 3.27Å
1202	S	53	Low	55.6	Low	58.2 Å²	58.2	100.1 Å²	100.1	41%	0.407	58%	0.577	S	S	.	*	H	α-helix	trans	-64.4	-37.1	176.5	-172.1	0	0	0	0	112	F1198 T1204 S1206	F1198-S1202 VanDerWaalsContact O-CB 3.26Å; F1198-S1202 WeakPolarHBondContact O-CB 3.39Å; F1198-S1202 PolarHBondContact O-N 2.9Å; S1202-T1204 VanDerWaalsContact C-N 3.34Å; S1202-T1204 PolarHBondContact O-N 3.25Å; S1202-S1206 WeakPolarHBondContact O-CB 3.39Å; S1202-S1206 PolarHBondContact O-N 2.95Å; S1202-S1206 VanDerWaalsContact O-N 3.15Å; S1202-S1206 PolarHBondContact O-OG 2.99Å
1203	S	51.2	Low	53.9	Low	69.4 Å²	69.4	105.2 Å²	105.2	49%	0.485	60%	0.604	S	S	.	*	H	α-helix	trans	-69.7	-30.6	174.9	68.8	0	0	0	0	113.5	D1199 R1200 F1201	D1199-S1203 WeakPolarHBondContact O-CB 3.38Å; D1199-S1203 PolarHBondContact O-N 3.03Å; D1199-S1203 VanDerWaalsContact O-N 3.12Å; D1199-S1203 PolarHBondContact O-OG 3.28Å; R1200-S1203 WeakPolarHBondContact O-CB 3.36Å; R1200-S1203 PolarHBondContact O-N 3.14Å; R1200-S1203 PolarHBondContact O-OG 2.81Å; R1200-S1203 VanDerWaalsContact O-OG 3.11Å; F1201-S1203 VanDerWaalsContact C-N 3.27Å; F1201-S1203 PolarHBondContact O-N 3.03Å
1204	T	50.1	Low	52	Low	92.8 Å²	92.8	105.1 Å²	105.1	57%	0.569	61%	0.612	S	S	*	*	H	α-helix	trans	-84.5	-35	179.5	42.3	0	0	0	0	113.5	R1200 F1201 S1202 S1206 G1207	R1200-T1204 PolarHBondContact O-N 3.04Å; R1200-T1204 VanDerWaalsContact O-N 3.11Å; R1200-T1204 PolarHBondContact O-OG1 2.85Å; F1201-T1204 VanDerWaalsContact CA-OG1 3.29Å; F1201-T1204 WeakPolarHBondContact CA-OG1 3.33Å; F1201-T1204 PolarHBondContact O-N 3.2Å; F1201-T1204 VanDerWaalsContact O-N 3.08Å; F1201-T1204 PolarHBondContact O-OG1 3.18Å; F1201-T1204 VanDerWaalsContact O-OG1 3.08Å; S1202-T1204 VanDerWaalsContact C-N 3.34Å; S1202-T1204 PolarHBondContact O-N 3.25Å; T1204-S1206 VanDerWaalsContact C-N 3.3Å; T1204-S1206 PolarHBondContact O-N 3.23Å; T1204-G1207 WeakPolarHBondContact O-CA 3.5Å; T1204-G1207 PolarHBondContact O-N 3.2Å
1205	V	51.9	Low	50	Low	121.8 Å²	121.8	103.7 Å²	103.7	74%	0.738	62%	0.616	S	S	*	*	H	α-helix	trans	-72.4	-27.9	177.4	174.9	0	0	0	0	111.9	F1201 G1207 G1208	F1201-V1205 WeakPolarHBondContact O-CG2 3.36Å; F1201-V1205 PolarHBondContact O-N 3.27Å; V1205-G1207 PolarHBondContact O-N 3.04Å; V1205-G1208 PolarHBondContact O-N 3.19Å
1206	S	44.7	Very low	48.4	Very low	88.4 Å²	88.4	105.4 Å²	105.4	62%	0.618	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-8.9	177.8	-52.8	0	0	0	0	114	S1202 T1204 G1208	S1202-S1206 WeakPolarHBondContact O-CB 3.39Å; S1202-S1206 PolarHBondContact O-N 2.95Å; S1202-S1206 VanDerWaalsContact O-N 3.15Å; S1202-S1206 PolarHBondContact O-OG 2.99Å; T1204-S1206 VanDerWaalsContact C-N 3.3Å; T1204-S1206 PolarHBondContact O-N 3.23Å; S1206-G1208 VanDerWaalsContact C-N 3.31Å; S1206-G1208 PolarHBondContact O-N 2.98Å
1207	G	37.9	Very low	47	Very low	60.2 Å²	60.2	103.4 Å²	103.4	62%	0.621	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	27.4	-178.5	0	0	0	0	0	114.7	T1204 V1205 V1209	T1204-G1207 WeakPolarHBondContact O-CA 3.5Å; T1204-G1207 PolarHBondContact O-N 3.2Å; V1205-G1207 PolarHBondContact O-N 3.04Å; G1207-V1209 PolarHBondContact O-N 2.96Å; G1207-V1209 VanDerWaalsContact O-N 3.11Å
1208	G	34.5	Very low	45.5	Very low	60.6 Å²	60.6	105.3 Å²	105.3	63%	0.625	66%	0.655	S	S	*	*			trans	-67	119.6	-179	0	0	0	0	0	113.4	V1205 S1206 G1210	V1205-G1208 PolarHBondContact O-N 3.19Å; S1206-G1208 VanDerWaalsContact C-N 3.31Å; S1206-G1208 PolarHBondContact O-N 2.98Å; G1208-G1210 PolarHBondContact O-N 3.07Å
1209	V	36.8	Very low	44	Very low	156 Å²	156	103.9 Å²	103.9	95%	0.945	65%	0.653	S	S	*	*	S	Bend	trans	22.1	99.2	169.7	-171.8	0	0	0	0	114.7	G1207	G1207-V1209 PolarHBondContact O-N 2.96Å; G1207-V1209 VanDerWaalsContact O-N 3.11Å
1210	G	36.2	Very low	42.8	Very low	77.6 Å²	77.6	103 Å²	103	80%	0.8	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	149.6	-12.1	160.4	0	0	0	0	0	118.5	G1208	G1208-G1210 PolarHBondContact O-N 3.07Å
1211	S	32.4	Very low	41.5	Very low	93 Å²	93	101.4 Å²	101.4	65%	0.65	66%	0.659	S	S	*	*			trans	-121.6	85.3	-175.1	-151.3	0	0	0	0	113.4	N1213	S1211-N1213 PolarHBondContact O-N 3.1Å; S1211-N1213 VanDerWaalsContact O-N 3.12Å
1212	S	34.8	Very low	40.5	Very low	119 Å²	119	98.7 Å²	98.7	83%	0.832	65%	0.65	S	S	*	*			trans	-76.8	36.8	171.8	56	0	0	0	0	113.4
1213	N	36.2	Very low	39.7	Very low	141.6 Å²	141.6	100.5 Å²	100.5	76%	0.757	66%	0.655	S	S	*	*			trans	-147.6	31.9	-172.7	-95.2	-1.3	0	0	0	114.4	S1211 N1215	S1211-N1213 PolarHBondContact O-N 3.1Å; S1211-N1213 VanDerWaalsContact O-N 3.12Å; N1213-N1215 PolarHBondContact O-N 3.39Å; N1213-N1215 VanDerWaalsContact O-N 3.16Å
1214	V	37	Very low	39.2	Very low	102 Å²	102	101 Å²	101	62%	0.618	65%	0.651	S	S	*	*			trans	-86.9	101.2	166.8	-177.1	0	0	0	0	108.4	P1216 N1218	V1214-P1216 VanDerWaalsContact O-CD 3.26Å; V1214-P1216 WeakPolarHBondContact O-CD 3.38Å; V1214-N1218 HydrophobicContact CG1-CB 4.05Å; V1214-N1218 WeakPolarHBondContact CG1-ND2 3.44Å
1215	N	35.3	Very low	38.5	Very low	118.8 Å²	118.8	105.1 Å²	105.1	64%	0.635	66%	0.656	S	S	*	*			trans	-55.5	136.8	177.3	-84.4	-36.7	0	0	0	111.1	N1213 A1217 N1218	N1213-N1215 PolarHBondContact O-N 3.39Å; N1213-N1215 VanDerWaalsContact O-N 3.16Å; N1215-A1217 HydrophobicContact CB-CB 4.42Å; N1215-A1217 PolarHBondContact O-N 3.08Å; N1215-N1218 PolarHBondContact O-N 3.01Å
1216	P	38.5	Very low	38.1	Very low	121.6 Å²	121.6	102 Å²	102	79%	0.79	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-64.1	-0.8	176.2	26.2	-34.2	0	0	0	114.2	V1214 N1218 L1219	V1214-P1216 VanDerWaalsContact O-CD 3.26Å; V1214-P1216 WeakPolarHBondContact O-CD 3.38Å; P1216-N1218 VanDerWaalsContact C-N 3.28Å; P1216-N1218 PolarHBondContact O-N 3.2Å; P1216-L1219 PolarHBondContact O-N 3.18Å
1217	A	41.4	Very low	37.8	Very low	78.8 Å²	78.8	106.7 Å²	106.7	65%	0.651	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-68.7	-20.8	175.6	0	0	0	0	0	114.4	N1215 L1219	N1215-A1217 HydrophobicContact CB-CB 4.42Å; N1215-A1217 PolarHBondContact O-N 3.08Å; A1217-L1219 VanDerWaalsContact C-N 3.3Å; A1217-L1219 PolarHBondContact O-N 3.17Å
1218	N	41.1	Very low	38.1	Very low	140 Å²	140	107.2 Å²	107.2	75%	0.749	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-92.8	12.7	-178.7	-78.2	3	0	0	0	114.2	V1214 N1215 P1216	V1214-N1218 HydrophobicContact CG1-CB 4.05Å; V1214-N1218 WeakPolarHBondContact CG1-ND2 3.44Å; N1215-N1218 PolarHBondContact O-N 3.01Å; P1216-N1218 VanDerWaalsContact C-N 3.28Å; P1216-N1218 PolarHBondContact O-N 3.2Å
1219	L	40.1	Very low	38.6	Very low	108.6 Å²	108.6	110.8 Å²	110.8	57%	0.569	65%	0.651	S	S	*	*	S	Bend	trans	-73.7	130.7	165.5	-146.6	78.4	0	0	0	108.5	P1216 A1217 T1221 L1223 W1252	P1216-L1219 PolarHBondContact O-N 3.18Å; A1217-L1219 VanDerWaalsContact C-N 3.3Å; A1217-L1219 PolarHBondContact O-N 3.17Å; L1219-T1221 PolarHBondContact O-N 3.19Å; L1219-T1221 VanDerWaalsContact O-N 3.16Å; L1219-L1223 HydrophobicContact CD2-CB 3.88Å; L1219-L1223 WeakPolarHBondContact CD2-O 3.37Å; L1219-W1252 HydrophobicContact CD1-CH2 4.16Å; L1219-W1252 HydrophobicContact CD2-CE3 4.01Å; L1219-W1252 HydrophobicContact CD2-CH2 3.53Å; L1219-W1252 HydrophobicContact CD2-CZ3 3.13Å; L1219-W1252 HydrophobicContact CG-CH2 4.46Å; L1219-W1252 HydrophobicContact CG-CZ3 4.41Å
1220	P	37.6	Very low	39	Very low	80.8 Å²	80.8	113.2 Å²	113.2	53%	0.525	64%	0.642	S	S	.	*			trans	-55.3	122.4	179.2	12.7	-20.7	0	0	0	110	N1222 L1223	P1220-N1222 WeakPolarHBondContact CB-OD1 3.21Å; P1220-N1222 PolarHBondContact O-N 3.18Å; P1220-L1223 HydrophobicContact CB-CD1 4.23Å; P1220-L1223 HydrophobicContact CG-CD1 4.17Å; P1220-L1223 PolarHBondContact O-N 3.28Å
1221	T	40.5	Very low	39.8	Very low	107.6 Å²	107.6	115.2 Å²	115.2	66%	0.66	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	4.2	-168.5	47.2	0	0	0	0	114.8	L1219 L1223 L1317	L1219-T1221 PolarHBondContact O-N 3.19Å; L1219-T1221 VanDerWaalsContact O-N 3.16Å; T1221-L1223 PolarHBondContact O-N 3.11Å; T1221-L1223 VanDerWaalsContact O-N 3.11Å; T1221-L1317 PolarHBondContact OG1-O 2.9Å
1222	N	40.1	Very low	40.8	Very low	75.8 Å²	75.8	113.4 Å²	113.4	41%	0.405	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	1.9	-177.9	-45.4	-26.4	0	0	0	114.2	P1220 I1224 W1254 L1255 Q1305 L1317	P1220-N1222 WeakPolarHBondContact CB-OD1 3.21Å; P1220-N1222 PolarHBondContact O-N 3.18Å; N1222-I1224 VanDerWaalsContact C-N 3.29Å; N1222-I1224 PolarHBondContact O-N 3.06Å; N1222-W1254 CarbonylContact O-C 3.51Å; N1222-W1254 VanDerWaalsContact O-CA 3.3Å; N1222-W1254 WeakPolarHBondContact O-CA 3.26Å; N1222-L1255 HydrophobicContact CB-CB 4.46Å; N1222-L1255 VanDerWaalsContact CB-O 3.23Å; N1222-L1255 WeakPolarHBondContact CB-O 3.04Å; N1222-L1255 PolarHBondContact O-N 3.29Å; N1222-Q1305 VanDerWaalsContact CB-OE1 3.3Å; N1222-L1317 PolarHBondContact OD1-O 2.88Å
1223	L	36.1	Very low	41.7	Very low	96.4 Å²	96.4	118.2 Å²	118.2	51%	0.505	63%	0.626	S	S	.	*			trans	-104.4	77.6	177.6	-126.1	97.5	0	0	0	111.5	L1219 P1220 T1221 R1225 L1247 W1252 M1253	L1219-L1223 HydrophobicContact CD2-CB 3.88Å; L1219-L1223 WeakPolarHBondContact CD2-O 3.37Å; P1220-L1223 HydrophobicContact CB-CD1 4.23Å; P1220-L1223 HydrophobicContact CG-CD1 4.17Å; P1220-L1223 PolarHBondContact O-N 3.28Å; T1221-L1223 PolarHBondContact O-N 3.11Å; T1221-L1223 VanDerWaalsContact O-N 3.11Å; L1223-R1225 VanDerWaalsContact C-N 3.28Å; L1223-R1225 PolarHBondContact O-N 3.11Å; L1223-R1225 VanDerWaalsContact O-N 3.12Å; L1223-L1247 HydrophobicContact CD1-CD2 4.39Å; L1223-L1247 HydrophobicContact CD2-CD2 4.29Å; L1223-W1252 HydrophobicContact CB-CE3 4.08Å; L1223-W1252 HydrophobicContact CD2-CB 3.81Å; L1223-W1252 HydrophobicContact CD2-CD2 3.87Å; L1223-W1252 HydrophobicContact CD2-CE3 3.89Å; L1223-W1252 HydrophobicContact CD2-CG 3.86Å; L1223-M1253 WeakPolarHBondContact CA-O 3.31Å
1224	I	39.9	Very low	42.9	Very low	79.8 Å²	79.8	117.3 Å²	117.3	41%	0.409	62%	0.617	S	S	.	*			trans	-82.2	100.6	177.4	-55.1	-177.9	0	0	0	109.8	N1222 T1226 M1253 L1255 I1339	N1222-I1224 VanDerWaalsContact C-N 3.29Å; N1222-I1224 PolarHBondContact O-N 3.06Å; I1224-T1226 PolarHBondContact O-N 2.94Å; I1224-T1226 VanDerWaalsContact O-N 3.11Å; I1224-M1253 PolarHBondContact N-O 3.41Å; I1224-M1253 VanDerWaalsContact N-O 3.16Å; I1224-M1253 PolarHBondContact O-N 3.19Å; I1224-L1255 HydrophobicContact CD1-CD1 3.77Å; I1224-I1339 HydrophobicContact CD1-CG2 3.96Å; I1224-I1339 HydrophobicContact CG1-CG2 4.46Å; I1224-I1339 HydrophobicContact CG2-CD1 4.33Å
1225	R	36.5	Very low	44.3	Very low	177.8 Å²	177.8	116.6 Å²	116.6	67%	0.671	61%	0.613	S	S	*	*			trans	-65.2	113.2	172.5	-145.9	-178.8	-173.4	128.7	-3.7	109.3	L1223 K1227 D1250 W1252	L1223-R1225 VanDerWaalsContact C-N 3.28Å; L1223-R1225 PolarHBondContact O-N 3.11Å; L1223-R1225 VanDerWaalsContact O-N 3.12Å; R1225-K1227 PolarHBondContact O-N 2.97Å; R1225-D1250 IonicContact CZ-OD1 3.81Å; R1225-D1250 VanDerWaalsContact CZ-OD1 3.28Å; R1225-D1250 IonicContact CZ-OD2 3.02Å; R1225-D1250 IonicContact NE-OD1 2.69Å; R1225-D1250 PolarHBondContact NE-OD1 2.6Å; R1225-D1250 IonicContact NE-OD2 3Å; R1225-D1250 IonicContact NH2-OD1 2.65Å; R1225-D1250 PolarHBondContact NH2-OD1 2.97Å; R1225-D1250 IonicContact NH2-OD2 3.98Å; R1225-D1250 PolarHBondContact NH2-OD2 3.33Å; R1225-W1252 HydrophobicContact CB-CE3 4.04Å; R1225-W1252 HydrophobicContact CB-CH2 4.23Å; R1225-W1252 HydrophobicContact CB-CZ3 3.72Å
1226	T	41.7	Very low	45.6	Very low	57.8 Å²	57.8	113.6 Å²	113.6	36%	0.355	60%	0.599	S	S	.	*			trans	-70.4	111.1	177.4	47.7	0	0	0	0	109.7	I1224 T1228 R1245 R1246 G1249 D1250 G1251 M1253 I1308	I1224-T1226 PolarHBondContact O-N 2.94Å; I1224-T1226 VanDerWaalsContact O-N 3.11Å; T1226-T1228 VanDerWaalsContact C-N 3.3Å; T1226-T1228 PolarHBondContact O-N 3.05Å; T1226-R1245 PolarHBondContact OG1-O 3.01Å; T1226-R1246 PolarHBondContact N-O 3.45Å; T1226-R1246 PolarHBondContact OG1-O 3.4Å; T1226-G1249 CarbonylContact C-O 3.59Å; T1226-G1249 CarbonylContact O-C 3.49Å; T1226-D1250 WeakPolarHBondContact O-CA 3.37Å; T1226-G1251 PolarHBondContact N-O 2.67Å; T1226-G1251 PolarHBondContact OG1-O 2.86Å; T1226-M1253 HydrophobicContact CG2-CE 4.06Å; T1226-I1308 HydrophobicContact CG2-CD1 4.37Å
1227	K	39.1	Very low	46.5	Very low	187.2 Å²	187.2	110.8 Å²	110.8	81%	0.814	57%	0.573	S	S	*	*			trans	-76.7	92.6	168.8	-74	-173.4	177.6	-178.5	0	108.8	R1225 P1229 G1249 P1338	R1225-K1227 PolarHBondContact O-N 2.97Å; K1227-P1229 WeakPolarHBondContact O-CD 3.41Å; K1227-G1249 CarbonylContact C-O 3.57Å; K1227-G1249 WeakPolarHBondContact CA-O 3.23Å; K1227-P1338 HydrophobicContact CD-CB 4.31Å; K1227-P1338 PolarHBondContact NZ-O 3.45Å
1228	T	44.6	Very low	47.7	Very low	70 Å²	70	113.5 Å²	113.5	43%	0.429	57%	0.57	S	S	.	*			trans	-66.9	132	168.8	51.4	0	0	0	0	109.2	T1226 R1230 V1232 G1249	T1226-T1228 VanDerWaalsContact C-N 3.3Å; T1226-T1228 PolarHBondContact O-N 3.05Å; T1228-R1230 CarbonylContact C-O 3.53Å; T1228-R1230 VanDerWaalsContact CB-O 3.3Å; T1228-R1230 WeakPolarHBondContact CB-O 3.47Å; T1228-R1230 CarbonylContact O-C 3.51Å; T1228-R1230 PolarHBondContact O-N 3.32Å; T1228-R1230 PolarHBondContact OG1-O 3.27Å; T1228-V1232 HydrophobicContact CG2-CG2 4.03Å; T1228-G1249 PolarHBondContact N-O 3.27Å; T1228-G1249 WeakPolarHBondContact OG1-CA 3.37Å
1229	P	44.2	Very low	48.6	Very low	137.2 Å²	137.2	110.8 Å²	110.8	89%	0.891	56%	0.558	S	S	*	*	S	Bend	trans	-70.2	-9.9	-172.4	17.8	-22.5	0	0	0	114.6	K1227	K1227-P1229 WeakPolarHBondContact O-CD 3.41Å
1230	R	46	Very low	49.5	Very low	205.2 Å²	205.2	116.6 Å²	116.6	77%	0.774	57%	0.573	S	S	*	*	S	Bend	trans	-132.1	145.3	167.6	-68.8	-177.9	174.3	161.6	-2	110.2	T1228 V1232	T1228-R1230 CarbonylContact C-O 3.53Å; T1228-R1230 VanDerWaalsContact CB-O 3.3Å; T1228-R1230 WeakPolarHBondContact CB-O 3.47Å; T1228-R1230 CarbonylContact O-C 3.51Å; T1228-R1230 PolarHBondContact O-N 3.32Å; T1228-R1230 PolarHBondContact OG1-O 3.27Å; R1230-V1232 PolarHBondContact O-N 3.21Å
1231	P	52	Low	50.5	Low	119.4 Å²	119.4	114.3 Å²	114.3	78%	0.775	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-60.6	130.5	172.2	-12.2	20.6	0	0	0	111.1	R1233	P1231-R1233 PolarHBondContact O-N 3.12Å; P1231-R1233 VanDerWaalsContact O-N 3.17Å
1232	V	55.1	Low	51.6	Low	55.6 Å²	55.6	111.4 Å²	111.4	34%	0.337	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-63.4	119.3	174.9	179.2	0	0	0	0	108.8	T1228 R1230 H1234 V1236 W1237 R1245 R1246	T1228-V1232 HydrophobicContact CG2-CG2 4.03Å; R1230-V1232 PolarHBondContact O-N 3.21Å; V1232-H1234 HydrophobicContact CG1-CB 4.37Å; V1232-H1234 WeakPolarHBondContact CG1-CE1 3.23Å; V1232-H1234 WeakPolarHBondContact CG1-ND1 3.3Å; V1232-H1234 PolarHBondContact O-N 2.98Å; V1232-V1236 HydrophobicContact CG1-CB 4.26Å; V1232-W1237 PolarHBondContact O-NE1 3.24Å; V1232-R1245 HydrophobicContact CG1-CB 4.21Å; V1232-R1245 HydrophobicContact CG2-CB 4.28Å; V1232-R1246 VanDerWaalsContact CB-NH2 3.29Å; V1232-R1246 PolarHBondContact O-NH2 3.27Å
1233	R	53.5	Low	52.6	Low	220 Å²	220	110.8 Å²	110.8	83%	0.83	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-57.6	106.9	-177.4	-77.6	-176.4	171.3	-179.2	-3.1	112.3	P1231 T1235 V1236	P1231-R1233 PolarHBondContact O-N 3.12Å; P1231-R1233 VanDerWaalsContact O-N 3.17Å; R1233-T1235 VanDerWaalsContact C-N 3.26Å; R1233-T1235 PolarHBondContact O-N 2.83Å; R1233-V1236 HydrophobicContact CB-CG2 4.23Å; R1233-V1236 PolarHBondContact O-N 3.18Å; R1233-V1236 VanDerWaalsContact O-N 3.16Å
1234	H	60.1	Low	53.5	Low	122 Å²	122	109.9 Å²	109.9	57%	0.565	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	53.4	-168.2	95.5	-86.9	0	0	0	113.6	V1232 V1236 W1237 K1238	V1232-H1234 HydrophobicContact CG1-CB 4.37Å; V1232-H1234 WeakPolarHBondContact CG1-CE1 3.23Å; V1232-H1234 WeakPolarHBondContact CG1-ND1 3.3Å; V1232-H1234 PolarHBondContact O-N 2.98Å; H1234-V1236 VanDerWaalsContact C-N 3.27Å; H1234-V1236 HydrophobicContact CB-CG2 4.35Å; H1234-V1236 WeakPolarHBondContact CE1-CG2 3.1Å; H1234-V1236 WeakPolarHBondContact ND1-CB 3.36Å; H1234-V1236 WeakPolarHBondContact ND1-CG2 3.32Å; H1234-V1236 PolarHBondContact ND1-N 3.41Å; H1234-V1236 PolarHBondContact O-N 2.96Å; H1234-W1237 VanDerWaalsContact C-NE1 3.3Å; H1234-W1237 AromaticContact CD2-CZ2 3.86Å; H1234-W1237 AromaticContact ND1-CD1 3.9Å; H1234-W1237 PolarHBondContact O-NE1 3Å; H1234-K1238 PolarHBondContact CE1-NZ 2.66Å; H1234-K1238 PolarHBondContact NE2-NZ 3.44Å
1235	T	67.3	Low	54.4	Low	88.4 Å²	88.4	111.1 Å²	111.1	54%	0.542	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-24	177.8	47.3	0	0	0	0	114.2	R1233 W1237 K1238 T1239	R1233-T1235 VanDerWaalsContact C-N 3.26Å; R1233-T1235 PolarHBondContact O-N 2.83Å; T1235-W1237 VanDerWaalsContact C-N 3.25Å; T1235-W1237 PolarHBondContact O-N 3.12Å; T1235-W1237 VanDerWaalsContact O-N 3.09Å; T1235-K1238 HydrophobicContact CG2-CD 4.15Å; T1235-K1238 WeakPolarHBondContact O-CA 3.39Å; T1235-K1238 VanDerWaalsContact O-CB 3.28Å; T1235-K1238 WeakPolarHBondContact O-CB 3.39Å; T1235-K1238 PolarHBondContact O-N 3.16Å; T1235-T1239 PolarHBondContact O-N 3.02Å; T1235-T1239 PolarHBondContact O-OG1 3.25Å
1236	V	61.6	Low	55.1	Low	55 Å²	55	108.4 Å²	108.4	33%	0.333	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-58.1	-34	-171.2	178.4	0	0	0	0	113.3	V1232 R1233 H1234 K1238 T1239 R1240 E1242	V1232-V1236 HydrophobicContact CG1-CB 4.26Å; R1233-V1236 HydrophobicContact CB-CG2 4.23Å; R1233-V1236 PolarHBondContact O-N 3.18Å; R1233-V1236 VanDerWaalsContact O-N 3.16Å; H1234-V1236 VanDerWaalsContact C-N 3.27Å; H1234-V1236 HydrophobicContact CB-CG2 4.35Å; H1234-V1236 WeakPolarHBondContact CE1-CG2 3.1Å; H1234-V1236 WeakPolarHBondContact ND1-CB 3.36Å; H1234-V1236 WeakPolarHBondContact ND1-CG2 3.32Å; H1234-V1236 PolarHBondContact ND1-N 3.41Å; H1234-V1236 PolarHBondContact O-N 2.96Å; V1236-K1238 VanDerWaalsContact C-N 3.29Å; V1236-K1238 PolarHBondContact O-N 3.11Å; V1236-K1238 VanDerWaalsContact O-N 3.07Å; V1236-T1239 WeakPolarHBondContact O-CB 3.49Å; V1236-T1239 PolarHBondContact O-N 3.13Å; V1236-T1239 VanDerWaalsContact O-N 3.14Å; V1236-T1239 PolarHBondContact O-OG1 3.04Å; V1236-T1239 VanDerWaalsContact O-OG1 3.12Å; V1236-R1240 VanDerWaalsContact O-CB 3.3Å; V1236-R1240 WeakPolarHBondContact O-CB 3.38Å; V1236-R1240 VanDerWaalsContact O-CG 3.27Å; V1236-R1240 WeakPolarHBondContact O-CG 3.47Å; V1236-R1240 PolarHBondContact O-N 3.25Å; V1236-R1240 VanDerWaalsContact O-N 3.1Å; V1236-E1242 HydrophobicContact CG1-CB 4.31Å; V1236-E1242 HydrophobicContact CG1-CG 4.26Å; V1236-E1242 VanDerWaalsContact O-CB 3.27Å; V1236-E1242 WeakPolarHBondContact O-CB 3.4Å
1237	W	58.2	Low	55.5	Low	62.6 Å²	62.6	109.9 Å²	109.9	24%	0.237	52%	0.523	C	S	.	.	G	3₁₀ helix	trans	-71.7	-13.9	175.9	63.3	-88.5	0	0	0	114	V1232 H1234 T1235 T1239 G1241 E1242 E1243 R1245 R1246	V1232-W1237 PolarHBondContact O-NE1 3.24Å; H1234-W1237 VanDerWaalsContact C-NE1 3.3Å; H1234-W1237 AromaticContact CD2-CZ2 3.86Å; H1234-W1237 AromaticContact ND1-CD1 3.9Å; H1234-W1237 PolarHBondContact O-NE1 3Å; T1235-W1237 VanDerWaalsContact C-N 3.25Å; T1235-W1237 PolarHBondContact O-N 3.12Å; T1235-W1237 VanDerWaalsContact O-N 3.09Å; W1237-T1239 VanDerWaalsContact C-N 3.32Å; W1237-G1241 PolarHBondContact O-N 3.37Å; W1237-E1242 WeakPolarHBondContact CA-O 3.49Å; W1237-E1242 PolarHBondContact O-N 3.32Å; W1237-E1243 HydrophobicContact CE3-CB 3.69Å; W1237-E1243 HydrophobicContact CZ3-CB 3.59Å; W1237-R1245 HydrophobicContact CB-CB 4.23Å; W1237-R1246 HydrophobicContact CB-CB 4.39Å; W1237-R1246 HydrophobicContact CB-CG 3.91Å; W1237-R1246 VanDerWaalsContact CD1-NE 3.33Å; W1237-R1246 HydrophobicContact CD2-CG 4.48Å; W1237-R1246 VanDerWaalsContact CD2-CZ 3.49Å; W1237-R1246 VanDerWaalsContact CD2-NE 3.31Å; W1237-R1246 VanDerWaalsContact CG-CD 3.44Å; W1237-R1246 HydrophobicContact CG-CG 4.02Å; W1237-R1246 VanDerWaalsContact CG-NE 3.33Å; W1237-R1246 VanDerWaalsContact CH2-NH1 3.27Å; W1237-R1246 VanDerWaalsContact CZ3-NH1 3.35Å; W1237-R1246 VanDerWaalsContact NE1-CZ 3.26Å
1238	K	65.7	Low	55.9	Low	136.8 Å²	136.8	102.3 Å²	102.3	60%	0.595	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-81.1	-20.7	174	-65.7	-173.3	172.5	-174.3	0	112.2	R1046 H1234 T1235 V1236 G1241	R1046-K1238 PolarHBondContact NH1-O 2.79Å; H1234-K1238 PolarHBondContact CE1-NZ 2.66Å; H1234-K1238 PolarHBondContact NE2-NZ 3.44Å; T1235-K1238 HydrophobicContact CG2-CD 4.15Å; T1235-K1238 WeakPolarHBondContact O-CA 3.39Å; T1235-K1238 VanDerWaalsContact O-CB 3.28Å; T1235-K1238 WeakPolarHBondContact O-CB 3.39Å; T1235-K1238 PolarHBondContact O-N 3.16Å; V1236-K1238 VanDerWaalsContact C-N 3.29Å; V1236-K1238 PolarHBondContact O-N 3.11Å; V1236-K1238 VanDerWaalsContact O-N 3.07Å; K1238-G1241 PolarHBondContact O-N 3.41Å
1239	T	61.3	Low	56.1	Low	82.2 Å²	82.2	100.2 Å²	100.2	50%	0.504	49%	0.489	S	S	.	.	S	Bend	trans	-73	139.2	175.4	28.7	0	0	0	0	110.3	R1046 T1235 V1236 W1237 G1241 E1242	R1046-T1239 PolarHBondContact NH1-O 2.88Å; T1235-T1239 PolarHBondContact O-N 3.02Å; T1235-T1239 PolarHBondContact O-OG1 3.25Å; V1236-T1239 WeakPolarHBondContact O-CB 3.49Å; V1236-T1239 PolarHBondContact O-N 3.13Å; V1236-T1239 VanDerWaalsContact O-N 3.14Å; V1236-T1239 PolarHBondContact O-OG1 3.04Å; V1236-T1239 VanDerWaalsContact O-OG1 3.12Å; W1237-T1239 VanDerWaalsContact C-N 3.32Å; T1239-G1241 VanDerWaalsContact C-N 3.28Å; T1239-G1241 PolarHBondContact O-N 3.18Å; T1239-G1241 VanDerWaalsContact O-N 3.1Å; T1239-E1242 WeakPolarHBondContact O-CB 3.3Å; T1239-E1242 PolarHBondContact O-N 3Å; T1239-E1242 VanDerWaalsContact O-N 3.15Å; T1239-E1242 WeakPolarHBondContact OG1-CB 3.48Å; T1239-E1242 WeakPolarHBondContact OG1-CG 3.43Å
1240	R	59.2	Low	56.4	Low	231.2 Å²	231.2	96.4 Å²	96.4	87%	0.872	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	105.5	-176.4	-157.9	-165.3	-176.8	144.2	-0.8	111.8	V1236 E1242	V1236-R1240 VanDerWaalsContact O-CB 3.3Å; V1236-R1240 WeakPolarHBondContact O-CB 3.38Å; V1236-R1240 VanDerWaalsContact O-CG 3.27Å; V1236-R1240 WeakPolarHBondContact O-CG 3.47Å; V1236-R1240 PolarHBondContact O-N 3.25Å; V1236-R1240 VanDerWaalsContact O-N 3.1Å; R1240-E1242 HydrophobicContact CB-CG 4.02Å
1241	G	58.7	Low	56.8	Low	32.8 Å²	32.8	87.7 Å²	87.7	34%	0.338	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	1.9	-177.4	0	0	0	0	0	114.1	W1237 K1238 T1239 E1243 Y1244	W1237-G1241 PolarHBondContact O-N 3.37Å; K1238-G1241 PolarHBondContact O-N 3.41Å; T1239-G1241 VanDerWaalsContact C-N 3.28Å; T1239-G1241 PolarHBondContact O-N 3.18Å; T1239-G1241 VanDerWaalsContact O-N 3.1Å; G1241-E1243 VanDerWaalsContact C-OE2 3.24Å; G1241-E1243 VanDerWaalsContact CA-OE2 3.25Å; G1241-E1243 WeakPolarHBondContact CA-OE2 3.36Å; G1241-E1243 PolarHBondContact N-OE2 3.15Å; G1241-Y1244 VanDerWaalsContact O-CD1 3.27Å; G1241-Y1244 WeakPolarHBondContact O-CD1 3.43Å; G1241-Y1244 VanDerWaalsContact O-CE1 3.23Å; G1241-Y1244 WeakPolarHBondContact O-CE1 3.39Å
1242	E	63.3	Low	56.8	Low	46.4 Å²	46.4	89.4 Å²	89.4	22%	0.217	43%	0.427	C	S	.	.			trans	-105.7	8.2	-178.1	-64.5	-85.8	141.4	0	0	113.5	K1051 V1236 W1237 T1239 R1240 Y1244 R1245	K1051-E1242 IonicContact NZ-OE1 2.7Å; K1051-E1242 PolarHBondContact NZ-OE1 3Å; V1236-E1242 HydrophobicContact CG1-CB 4.31Å; V1236-E1242 HydrophobicContact CG1-CG 4.26Å; V1236-E1242 VanDerWaalsContact O-CB 3.27Å; V1236-E1242 WeakPolarHBondContact O-CB 3.4Å; W1237-E1242 WeakPolarHBondContact CA-O 3.49Å; W1237-E1242 PolarHBondContact O-N 3.32Å; T1239-E1242 WeakPolarHBondContact O-CB 3.3Å; T1239-E1242 PolarHBondContact O-N 3Å; T1239-E1242 VanDerWaalsContact O-N 3.15Å; T1239-E1242 WeakPolarHBondContact OG1-CB 3.48Å; T1239-E1242 WeakPolarHBondContact OG1-CG 3.43Å; R1240-E1242 HydrophobicContact CB-CG 4.02Å; E1242-Y1244 HydrophobicContact CB-CE1 4.41Å; E1242-Y1244 VanDerWaalsContact CD-OH 3.31Å; E1242-Y1244 HydrophobicContact CG-CE1 4.46Å; E1242-Y1244 PolarHBondContact O-N 3.08Å; E1242-Y1244 VanDerWaalsContact O-N 3.12Å; E1242-Y1244 VanDerWaalsContact OE1-CE1 3.27Å; E1242-Y1244 WeakPolarHBondContact OE1-CE1 3.4Å; E1242-Y1244 VanDerWaalsContact OE1-CZ 3.29Å; E1242-Y1244 PolarHBondContact OE1-OH 3.39Å; E1242-Y1244 VanDerWaalsContact OE1-OH 3.06Å; E1242-Y1244 WeakPolarHBondContact OE2-CE1 3.23Å; E1242-Y1244 PolarHBondContact OE2-OH 3.1Å; E1242-R1245 HydrophobicContact CB-CG 4.14Å; E1242-R1245 VanDerWaalsContact CD-NH2 3.32Å; E1242-R1245 VanDerWaalsContact O-CB 3.27Å; E1242-R1245 WeakPolarHBondContact O-CB 3.31Å; E1242-R1245 PolarHBondContact O-N 3.03Å; E1242-R1245 VanDerWaalsContact O-N 3.14Å; E1242-R1245 IonicContact OE1-CZ 3.49Å; E1242-R1245 IonicContact OE1-NE 3.8Å; E1242-R1245 IonicContact OE1-NH1 3.26Å; E1242-R1245 PolarHBondContact OE1-NH1 2.71Å; E1242-R1245 IonicContact OE1-NH2 2.95Å; E1242-R1245 PolarHBondContact OE1-NH2 2.86Å; E1242-R1245 VanDerWaalsContact OE2-CD 3.23Å; E1242-R1245 WeakPolarHBondContact OE2-CD 3.3Å; E1242-R1245 IonicContact OE2-CZ 2.96Å; E1242-R1245 IonicContact OE2-NE 3.12Å; E1242-R1245 PolarHBondContact OE2-NE 3.1Å; E1242-R1245 IonicContact OE2-NH1 2.83Å; E1242-R1245 PolarHBondContact OE2-NH1 3.27Å; E1242-R1245 IonicContact OE2-NH2 3.24Å; E1242-R1245 PolarHBondContact OE2-NH2 2.93Å
1243	E	59.8	Low	56.7	Low	62.4 Å²	62.4	90.3 Å²	90.3	29%	0.292	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-29.8	176.1	54.1	-92.5	-154.5	0	0	113.7	R1189 R1200 W1237 G1241 R1245 R1246 L1247 D1250	R1189-E1243 IonicContact CZ-OE1 3.5Å; R1189-E1243 IonicContact NH2-OE1 3.77Å; R1189-E1243 PolarHBondContact NH2-OE1 3.14Å; R1200-E1243 IonicContact NH2-OE1 2.75Å; W1237-E1243 HydrophobicContact CE3-CB 3.69Å; W1237-E1243 HydrophobicContact CZ3-CB 3.59Å; G1241-E1243 VanDerWaalsContact C-OE2 3.24Å; G1241-E1243 VanDerWaalsContact CA-OE2 3.25Å; G1241-E1243 WeakPolarHBondContact CA-OE2 3.36Å; G1241-E1243 PolarHBondContact N-OE2 3.15Å; E1243-R1245 PolarHBondContact O-N 3.14Å; E1243-R1245 VanDerWaalsContact O-N 3.16Å; E1243-R1246 WeakPolarHBondContact O-CA 3.49Å; E1243-R1246 WeakPolarHBondContact O-CB 3.38Å; E1243-R1246 PolarHBondContact O-N 2.98Å; E1243-R1246 VanDerWaalsContact O-N 3.11Å; E1243-L1247 HydrophobicContact CB-CD1 4.25Å; E1243-L1247 HydrophobicContact CG-CD1 4.26Å; E1243-L1247 PolarHBondContact O-N 3.17Å; E1243-L1247 VanDerWaalsContact O-N 3.1Å; E1243-D1250 HydrophobicContact CG-CB 3.79Å; E1243-D1250 WeakPolarHBondContact CG-OD2 3.47Å
1244	Y	55.9	Low	56.4	Low	78.6 Å²	78.6	86.3 Å²	86.3	31%	0.308	41%	0.413	S	S	.	.	H	α-helix	trans	-58.3	-28.2	177.3	83.1	-93.3	0	0	0	113.2	H1178 G1241 E1242 R1246 L1247 G1248 D1250 G1251 W1254	H1178-Y1244 AromaticContact NE2-CE2 3.71Å; G1241-Y1244 VanDerWaalsContact O-CD1 3.27Å; G1241-Y1244 WeakPolarHBondContact O-CD1 3.43Å; G1241-Y1244 VanDerWaalsContact O-CE1 3.23Å; G1241-Y1244 WeakPolarHBondContact O-CE1 3.39Å; E1242-Y1244 HydrophobicContact CB-CE1 4.41Å; E1242-Y1244 VanDerWaalsContact CD-OH 3.31Å; E1242-Y1244 HydrophobicContact CG-CE1 4.46Å; E1242-Y1244 PolarHBondContact O-N 3.08Å; E1242-Y1244 VanDerWaalsContact O-N 3.12Å; E1242-Y1244 VanDerWaalsContact OE1-CE1 3.27Å; E1242-Y1244 WeakPolarHBondContact OE1-CE1 3.4Å; E1242-Y1244 VanDerWaalsContact OE1-CZ 3.29Å; E1242-Y1244 PolarHBondContact OE1-OH 3.39Å; E1242-Y1244 VanDerWaalsContact OE1-OH 3.06Å; E1242-Y1244 WeakPolarHBondContact OE2-CE1 3.23Å; E1242-Y1244 PolarHBondContact OE2-OH 3.1Å; Y1244-R1246 VanDerWaalsContact C-N 3.35Å; Y1244-R1246 PolarHBondContact O-N 3.01Å; Y1244-R1246 VanDerWaalsContact O-N 3.12Å; Y1244-L1247 PolarHBondContact O-N 3Å; Y1244-G1248 WeakPolarHBondContact O-CA 3.44Å; Y1244-G1248 PolarHBondContact O-N 3.08Å; Y1244-G1248 VanDerWaalsContact O-N 3.14Å; Y1244-D1250 WeakPolarHBondContact CA-OD1 3.46Å; Y1244-D1250 WeakPolarHBondContact CB-O 3.44Å; Y1244-D1250 WeakPolarHBondContact CB-OD1 3.46Å; Y1244-G1251 VanDerWaalsContact CB-N 3.31Å; Y1244-W1254 AromaticContact CE1-CD1 3.86Å; Y1244-W1254 HydrophobicContact CE2-CB 4.07Å; Y1244-W1254 AromaticContact CZ-CD1 3.98Å
1245	R	58.3	Low	55.7	Low	104.8 Å²	104.8	83.7 Å²	83.7	40%	0.395	40%	0.403	S	S	.	.	H	α-helix	trans	-67.4	-17.7	177.4	-62.2	-169	-173.1	-147	2.4	113.4	T1226 V1232 W1237 E1242 E1243 I1308 D1731	T1226-R1245 PolarHBondContact OG1-O 3.01Å; V1232-R1245 HydrophobicContact CG1-CB 4.21Å; V1232-R1245 HydrophobicContact CG2-CB 4.28Å; W1237-R1245 HydrophobicContact CB-CB 4.23Å; E1242-R1245 HydrophobicContact CB-CG 4.14Å; E1242-R1245 VanDerWaalsContact CD-NH2 3.32Å; E1242-R1245 VanDerWaalsContact O-CB 3.27Å; E1242-R1245 WeakPolarHBondContact O-CB 3.31Å; E1242-R1245 PolarHBondContact O-N 3.03Å; E1242-R1245 VanDerWaalsContact O-N 3.14Å; E1242-R1245 IonicContact OE1-CZ 3.49Å; E1242-R1245 IonicContact OE1-NE 3.8Å; E1242-R1245 IonicContact OE1-NH1 3.26Å; E1242-R1245 PolarHBondContact OE1-NH1 2.71Å; E1242-R1245 IonicContact OE1-NH2 2.95Å; E1242-R1245 PolarHBondContact OE1-NH2 2.86Å; E1242-R1245 VanDerWaalsContact OE2-CD 3.23Å; E1242-R1245 WeakPolarHBondContact OE2-CD 3.3Å; E1242-R1245 IonicContact OE2-CZ 2.96Å; E1242-R1245 IonicContact OE2-NE 3.12Å; E1242-R1245 PolarHBondContact OE2-NE 3.1Å; E1242-R1245 IonicContact OE2-NH1 2.83Å; E1242-R1245 PolarHBondContact OE2-NH1 3.27Å; E1242-R1245 IonicContact OE2-NH2 3.24Å; E1242-R1245 PolarHBondContact OE2-NH2 2.93Å; E1243-R1245 PolarHBondContact O-N 3.14Å; E1243-R1245 VanDerWaalsContact O-N 3.16Å; R1245-I1308 VanDerWaalsContact O-CD1 3.31Å; R1245-I1308 WeakPolarHBondContact O-CD1 3.43Å; R1245-D1731 IonicContact CZ-OD2 3.64Å; R1245-D1731 IonicContact NH1-OD2 3.86Å; R1245-D1731 PolarHBondContact NH1-OD2 3.22Å; R1245-D1731 IonicContact NH2-OD2 3.93Å; R1245-D1731 PolarHBondContact NH2-OD2 3.13Å
1246	R	50.6	Low	54.6	Low	120.2 Å²	120.2	80.8 Å²	80.8	45%	0.454	39%	0.386	S	S	.	.	H	α-helix	trans	-98.3	-41.3	175.6	-105.3	-173.5	176.5	-155.9	-1.5	113.1	T1226 V1232 W1237 E1243 Y1244	T1226-R1246 PolarHBondContact N-O 3.45Å; T1226-R1246 PolarHBondContact OG1-O 3.4Å; V1232-R1246 VanDerWaalsContact CB-NH2 3.29Å; V1232-R1246 PolarHBondContact O-NH2 3.27Å; W1237-R1246 HydrophobicContact CB-CB 4.39Å; W1237-R1246 HydrophobicContact CB-CG 3.91Å; W1237-R1246 VanDerWaalsContact CD1-NE 3.33Å; W1237-R1246 HydrophobicContact CD2-CG 4.48Å; W1237-R1246 VanDerWaalsContact CD2-CZ 3.49Å; W1237-R1246 VanDerWaalsContact CD2-NE 3.31Å; W1237-R1246 VanDerWaalsContact CG-CD 3.44Å; W1237-R1246 HydrophobicContact CG-CG 4.02Å; W1237-R1246 VanDerWaalsContact CG-NE 3.33Å; W1237-R1246 VanDerWaalsContact CH2-NH1 3.27Å; W1237-R1246 VanDerWaalsContact CZ3-NH1 3.35Å; W1237-R1246 VanDerWaalsContact NE1-CZ 3.26Å; E1243-R1246 WeakPolarHBondContact O-CA 3.49Å; E1243-R1246 WeakPolarHBondContact O-CB 3.38Å; E1243-R1246 PolarHBondContact O-N 2.98Å; E1243-R1246 VanDerWaalsContact O-N 3.11Å; Y1244-R1246 VanDerWaalsContact C-N 3.35Å; Y1244-R1246 PolarHBondContact O-N 3.01Å; Y1244-R1246 VanDerWaalsContact O-N 3.12Å
1247	L	51.4	Low	53.8	Low	90.2 Å²	90.2	82.2 Å²	82.2	47%	0.472	40%	0.404	S	S	.	.	H	α-helix	trans	-95	-26.5	-169.1	-65.4	173.7	0	0	0	113.8	L1223 E1243 Y1244 G1249 D1250	L1223-L1247 HydrophobicContact CD1-CD2 4.39Å; L1223-L1247 HydrophobicContact CD2-CD2 4.29Å; E1243-L1247 HydrophobicContact CB-CD1 4.25Å; E1243-L1247 HydrophobicContact CG-CD1 4.26Å; E1243-L1247 PolarHBondContact O-N 3.17Å; E1243-L1247 VanDerWaalsContact O-N 3.1Å; Y1244-L1247 PolarHBondContact O-N 3Å; L1247-G1249 PolarHBondContact O-N 2.74Å; L1247-D1250 PolarHBondContact O-N 3.19Å
1248	G	46.9	Very low	53.1	Low	26.6 Å²	26.6	84.9 Å²	84.9	27%	0.274	43%	0.427	S	S	.	.	S	Bend	trans	57.5	97.3	-175.4	0	0	0	0	0	113.2	Y1244 D1250	Y1244-G1248 WeakPolarHBondContact O-CA 3.44Å; Y1244-G1248 PolarHBondContact O-N 3.08Å; Y1244-G1248 VanDerWaalsContact O-N 3.14Å; G1248-D1250 PolarHBondContact O-N 3.46Å
1249	G	49.4	Very low	51.9	Low	26.4 Å²	26.4	85 Å²	85	27%	0.272	42%	0.424	S	S	.	.	S	Bend	trans	111.2	-11.6	173.2	0	0	0	0	0	115.7	M1184 T1226 K1227 T1228 L1247 G1251	M1184-G1249 WeakPolarHBondContact SD-CA 3.27Å; T1226-G1249 CarbonylContact C-O 3.59Å; T1226-G1249 CarbonylContact O-C 3.49Å; K1227-G1249 CarbonylContact C-O 3.57Å; K1227-G1249 WeakPolarHBondContact CA-O 3.23Å; T1228-G1249 PolarHBondContact N-O 3.27Å; T1228-G1249 WeakPolarHBondContact OG1-CA 3.37Å; L1247-G1249 PolarHBondContact O-N 2.74Å; G1249-G1251 VanDerWaalsContact C-N 3.32Å; G1249-G1251 PolarHBondContact O-N 3.05Å
1250	D	50	Low	51	Low	58.2 Å²	58.2	84.6 Å²	84.6	31%	0.311	43%	0.425	S	S	.	.	S	Bend	trans	-102.8	96	179.9	-111.3	-40.1	0	0	0	112.2	R1189 R1225 T1226 E1243 Y1244 L1247 G1248	R1189-D1250 VanDerWaalsContact CD-OD1 3.29Å; R1189-D1250 WeakPolarHBondContact CD-OD1 3.18Å; R1189-D1250 WeakPolarHBondContact CG-OD1 3.37Å; R1189-D1250 VanDerWaalsContact CZ-CG 3.47Å; R1189-D1250 IonicContact CZ-OD1 3.67Å; R1189-D1250 IonicContact CZ-OD2 2.69Å; R1189-D1250 IonicContact NE-OD1 2.74Å; R1189-D1250 PolarHBondContact NE-OD1 2.91Å; R1189-D1250 IonicContact NH1-OD1 3.14Å; R1189-D1250 PolarHBondContact NH1-OD1 3.03Å; R1189-D1250 IonicContact NH1-OD2 3.05Å; R1189-D1250 PolarHBondContact NH1-OD2 3.29Å; R1189-D1250 PolarHBondContact NH2-O 3.32Å; R1189-D1250 IonicContact NH2-OD1 3.43Å; R1189-D1250 PolarHBondContact NH2-OD1 3.28Å; R1225-D1250 IonicContact CZ-OD1 3.81Å; R1225-D1250 VanDerWaalsContact CZ-OD1 3.28Å; R1225-D1250 IonicContact CZ-OD2 3.02Å; R1225-D1250 IonicContact NE-OD1 2.69Å; R1225-D1250 PolarHBondContact NE-OD1 2.6Å; R1225-D1250 IonicContact NE-OD2 3Å; R1225-D1250 IonicContact NH2-OD1 2.65Å; R1225-D1250 PolarHBondContact NH2-OD1 2.97Å; R1225-D1250 IonicContact NH2-OD2 3.98Å; R1225-D1250 PolarHBondContact NH2-OD2 3.33Å; T1226-D1250 WeakPolarHBondContact O-CA 3.37Å; E1243-D1250 HydrophobicContact CG-CB 3.79Å; E1243-D1250 WeakPolarHBondContact CG-OD2 3.47Å; Y1244-D1250 WeakPolarHBondContact CA-OD1 3.46Å; Y1244-D1250 WeakPolarHBondContact CB-O 3.44Å; Y1244-D1250 WeakPolarHBondContact CB-OD1 3.46Å; L1247-D1250 PolarHBondContact O-N 3.19Å; G1248-D1250 PolarHBondContact O-N 3.46Å
1251	G	53.7	Low	50.3	Low	21.2 Å²	21.2	79.5 Å²	79.5	22%	0.219	41%	0.414	C	S	.	.	S	Bend	trans	165.5	-160	177.7	0	0	0	0	0	114.2	M1184 T1226 Y1244 G1249 M1253	M1184-G1251 PolarHBondContact N-O 3.04Å; M1184-G1251 VanDerWaalsContact N-O 3.14Å; T1226-G1251 PolarHBondContact N-O 2.67Å; T1226-G1251 PolarHBondContact OG1-O 2.86Å; Y1244-G1251 VanDerWaalsContact CB-N 3.31Å; G1249-G1251 VanDerWaalsContact C-N 3.32Å; G1249-G1251 PolarHBondContact O-N 3.05Å; G1251-M1253 PolarHBondContact O-N 3Å
1252	W	51.9	Low	49.6	Very low	156 Å²	156	81.5 Å²	81.5	59%	0.591	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.4	174	-64.6	101.6	0	0	0	110.3	L1047 L1181 E1182 R1183 L1219 L1223 R1225	L1047-W1252 HydrophobicContact CD1-CB 4.39Å; L1047-W1252 HydrophobicContact CD1-CG 4.49Å; L1181-W1252 HydrophobicContact CD1-CB 4.17Å; L1181-W1252 HydrophobicContact CD1-CE3 4.26Å; L1181-W1252 HydrophobicContact CD2-CD2 4.15Å; L1181-W1252 HydrophobicContact CD2-CE3 3.58Å; L1181-W1252 HydrophobicContact CD2-CG 4.5Å; L1181-W1252 HydrophobicContact CD2-CH2 4.46Å; L1181-W1252 HydrophobicContact CD2-CZ3 3.83Å; L1181-W1252 HydrophobicContact CG-CB 4.36Å; L1181-W1252 HydrophobicContact CG-CD2 4.37Å; L1181-W1252 HydrophobicContact CG-CE3 3.67Å; L1181-W1252 HydrophobicContact CG-CZ3 4.17Å; E1182-W1252 CarbonylContact O-C 3.59Å; E1182-W1252 WeakPolarHBondContact O-CA 3.31Å; R1183-W1252 HydrophobicContact CB-CD2 4.25Å; R1183-W1252 HydrophobicContact CB-CE3 3.66Å; R1183-W1252 HydrophobicContact CB-CH2 4.19Å; R1183-W1252 HydrophobicContact CB-CZ3 3.66Å; R1183-W1252 HydrophobicContact CG-CD2 4.27Å; R1183-W1252 HydrophobicContact CG-CE3 4.17Å; R1183-W1252 HydrophobicContact CG-CH2 4.44Å; R1183-W1252 HydrophobicContact CG-CZ2 4.44Å; R1183-W1252 HydrophobicContact CG-CZ3 4.29Å; L1219-W1252 HydrophobicContact CD1-CH2 4.16Å; L1219-W1252 HydrophobicContact CD2-CE3 4.01Å; L1219-W1252 HydrophobicContact CD2-CH2 3.53Å; L1219-W1252 HydrophobicContact CD2-CZ3 3.13Å; L1219-W1252 HydrophobicContact CG-CH2 4.46Å; L1219-W1252 HydrophobicContact CG-CZ3 4.41Å; L1223-W1252 HydrophobicContact CB-CE3 4.08Å; L1223-W1252 HydrophobicContact CD2-CB 3.81Å; L1223-W1252 HydrophobicContact CD2-CD2 3.87Å; L1223-W1252 HydrophobicContact CD2-CE3 3.89Å; L1223-W1252 HydrophobicContact CD2-CG 3.86Å; R1225-W1252 HydrophobicContact CB-CE3 4.04Å; R1225-W1252 HydrophobicContact CB-CH2 4.23Å; R1225-W1252 HydrophobicContact CB-CZ3 3.72Å
1253	M	52.8	Low	48.8	Very low	73.8 Å²	73.8	81.1 Å²	81.1	36%	0.364	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.6	174.5	170.4	174.8	-44	0	0	110.3	E1182 M1184 L1223 I1224 T1226 G1251 L1255 L1304	E1182-M1253 HydrophobicContact CB-CG 4.1Å; E1182-M1253 HydrophobicContact CG-CG 4.44Å; E1182-M1253 PolarHBondContact N-O 3.17Å; E1182-M1253 CarbonylContact O-C 3.39Å; E1182-M1253 WeakPolarHBondContact O-CA 3.21Å; E1182-M1253 WeakPolarHBondContact O-CG 3.45Å; E1182-M1253 PolarHBondContact O-N 3.22Å; M1184-M1253 HydrophobicContact CG-SD 3.89Å; M1184-M1253 HydrophobicContact SD-CE 3.86Å; M1184-M1253 HydrophobicContact SD-SD 3.91Å; L1223-M1253 WeakPolarHBondContact CA-O 3.31Å; I1224-M1253 PolarHBondContact N-O 3.41Å; I1224-M1253 VanDerWaalsContact N-O 3.16Å; I1224-M1253 PolarHBondContact O-N 3.19Å; T1226-M1253 HydrophobicContact CG2-CE 4.06Å; G1251-M1253 PolarHBondContact O-N 3Å; M1253-L1255 HydrophobicContact CE-CD2 3.72Å; M1253-L1255 HydrophobicContact CG-CD2 4.3Å; M1253-L1255 PolarHBondContact O-N 2.96Å; M1253-L1255 HydrophobicContact SD-CD2 4Å; M1253-L1304 HydrophobicContact CE-CD2 3.94Å; M1253-L1304 HydrophobicContact SD-CD2 4.35Å
1254	W	47.2	Very low	48.3	Very low	135.8 Å²	135.8	87.3 Å²	87.3	51%	0.514	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	117.2	179	-113.1	100.7	0	0	0	109.5	F1052 H1178 L1181 N1222 Y1244 S1256	F1052-W1254 HydrophobicContact CE2-CH2 4.06Å; F1052-W1254 AromaticContact CE2-CZ2 3.98Å; F1052-W1254 HydrophobicContact CE2-CZ2 3.98Å; F1052-W1254 AromaticContact CZ-CH2 3.97Å; F1052-W1254 HydrophobicContact CZ-CH2 3.97Å; F1052-W1254 HydrophobicContact CZ-CZ2 4.3Å; H1178-W1254 HydrophobicContact CB-CB 3.57Å; H1178-W1254 HydrophobicContact CB-CD2 4.05Å; H1178-W1254 HydrophobicContact CB-CE3 3.85Å; H1178-W1254 HydrophobicContact CB-CG 4.01Å; H1178-W1254 PolarHBondContact CE1-O 3.2Å; H1178-W1254 VanDerWaalsContact CG-CB 3.46Å; H1178-W1254 WeakPolarHBondContact ND1-CB 3.42Å; H1178-W1254 PolarHBondContact ND1-O 3.13Å; H1178-W1254 VanDerWaalsContact O-CZ3 3.31Å; H1178-W1254 WeakPolarHBondContact O-CZ3 3.35Å; L1181-W1254 HydrophobicContact CB-CD2 4.47Å; L1181-W1254 HydrophobicContact CB-CE3 4.18Å; L1181-W1254 HydrophobicContact CB-CH2 4.42Å; L1181-W1254 HydrophobicContact CB-CZ3 4.13Å; L1181-W1254 HydrophobicContact CD1-CD2 3.6Å; L1181-W1254 VanDerWaalsContact CD1-CE2 3.42Å; L1181-W1254 HydrophobicContact CD1-CE3 4.09Å; L1181-W1254 HydrophobicContact CD1-CG 3.93Å; L1181-W1254 HydrophobicContact CD1-CH2 4.38Å; L1181-W1254 HydrophobicContact CD1-CZ2 3.9Å; L1181-W1254 HydrophobicContact CD1-CZ3 4.46Å; N1222-W1254 CarbonylContact O-C 3.51Å; N1222-W1254 VanDerWaalsContact O-CA 3.3Å; N1222-W1254 WeakPolarHBondContact O-CA 3.26Å; Y1244-W1254 AromaticContact CE1-CD1 3.86Å; Y1244-W1254 HydrophobicContact CE2-CB 4.07Å; Y1244-W1254 AromaticContact CZ-CD1 3.98Å; W1254-S1256 VanDerWaalsContact CH2-CA 3.46Å; W1254-S1256 WeakPolarHBondContact CH2-OG 2.97Å; W1254-S1256 VanDerWaalsContact CZ3-CA 3.44Å
1255	L	46.4	Very low	47.7	Very low	67.4 Å²	67.4	89 Å²	89	35%	0.353	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.9	173.2	-59.8	175.5	0	0	0	109.8	H1178 L1179 T1180 E1182 N1222 I1224 M1253 A1257 R1259	H1178-L1255 CarbonylContact C-O 3.58Å; H1178-L1255 VanDerWaalsContact C-O 3.3Å; H1178-L1255 VanDerWaalsContact CA-O 3.25Å; H1178-L1255 WeakPolarHBondContact CA-O 3.42Å; L1179-L1255 PolarHBondContact N-O 3.1Å; T1180-L1255 PolarHBondContact N-O 3.35Å; T1180-L1255 PolarHBondContact O-N 3.08Å; T1180-L1255 WeakPolarHBondContact OG1-CB 3.47Å; E1182-L1255 HydrophobicContact CB-CD1 4.32Å; E1182-L1255 HydrophobicContact CB-CG 4.34Å; E1182-L1255 WeakPolarHBondContact OE2-CD1 3.31Å; N1222-L1255 HydrophobicContact CB-CB 4.46Å; N1222-L1255 VanDerWaalsContact CB-O 3.23Å; N1222-L1255 WeakPolarHBondContact CB-O 3.04Å; N1222-L1255 PolarHBondContact O-N 3.29Å; I1224-L1255 HydrophobicContact CD1-CD1 3.77Å; M1253-L1255 HydrophobicContact CE-CD2 3.72Å; M1253-L1255 HydrophobicContact CG-CD2 4.3Å; M1253-L1255 PolarHBondContact O-N 2.96Å; M1253-L1255 HydrophobicContact SD-CD2 4Å; L1255-A1257 PolarHBondContact O-N 3.11Å; L1255-R1259 HydrophobicContact CB-CB 4.21Å; L1255-R1259 HydrophobicContact CD2-CB 4.41Å
1256	S	44.2	Very low	47	Very low	27.6 Å²	27.6	86.5 Å²	86.5	19%	0.193	47%	0.471	C	S	.	.			trans	-78	146.5	175.5	-177.6	0	0	0	0	111.4	G1177 W1254 T1258 R1259	G1177-S1256 CarbonylContact O-C 3.6Å; G1177-S1256 WeakPolarHBondContact O-CA 3.12Å; G1177-S1256 WeakPolarHBondContact O-CB 3.19Å; G1177-S1256 PolarHBondContact O-OG 3.47Å; W1254-S1256 VanDerWaalsContact CH2-CA 3.46Å; W1254-S1256 WeakPolarHBondContact CH2-OG 2.97Å; W1254-S1256 VanDerWaalsContact CZ3-CA 3.44Å; S1256-T1258 WeakPolarHBondContact CB-OG1 3.3Å; S1256-T1258 PolarHBondContact O-N 2.93Å; S1256-T1258 VanDerWaalsContact O-N 3.09Å; S1256-T1258 PolarHBondContact OG-N 3.13Å; S1256-T1258 VanDerWaalsContact OG-N 3.11Å; S1256-T1258 PolarHBondContact OG-OG1 3.24Å; S1256-R1259 CarbonylContact O-C 3.5Å; S1256-R1259 WeakPolarHBondContact O-CA 3.27Å; S1256-R1259 WeakPolarHBondContact O-CB 3.34Å; S1256-R1259 PolarHBondContact O-N 3.12Å
1257	A	44.6	Very low	46.8	Very low	84.8 Å²	84.8	87.1 Å²	87.1	70%	0.701	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-23.5	167.1	0	0	0	0	0	112.9	G1177 L1179 L1255 R1259	G1177-A1257 PolarHBondContact O-N 3.13Å; L1179-A1257 HydrophobicContact CD1-CB 3.67Å; L1179-A1257 HydrophobicContact CG-CB 4Å; L1255-A1257 PolarHBondContact O-N 3.11Å; A1257-R1259 VanDerWaalsContact C-N 3.29Å; A1257-R1259 PolarHBondContact O-N 3.32Å
1258	T	43.6	Very low	46.5	Very low	119.2 Å²	119.2	87.9 Å²	87.9	73%	0.731	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-5.4	175.6	65.1	0	0	0	0	114.4	S1256 S1260 R1350	S1256-T1258 WeakPolarHBondContact CB-OG1 3.3Å; S1256-T1258 PolarHBondContact O-N 2.93Å; S1256-T1258 VanDerWaalsContact O-N 3.09Å; S1256-T1258 PolarHBondContact OG-N 3.13Å; S1256-T1258 VanDerWaalsContact OG-N 3.11Å; S1256-T1258 PolarHBondContact OG-OG1 3.24Å; T1258-S1260 PolarHBondContact O-N 3.08Å; T1258-S1260 VanDerWaalsContact O-N 3.16Å; T1258-R1350 VanDerWaalsContact CG2-NH2 3.34Å
1259	R	40.5	Very low	46.4	Very low	139.2 Å²	139.2	89.1 Å²	89.1	53%	0.525	49%	0.487	S	S	.	.			trans	-99.7	71.4	174.1	-74.2	-172	173.5	-123.7	-1.1	109.8	L1255 S1256 A1257 N1261 H1306	L1255-R1259 HydrophobicContact CB-CB 4.21Å; L1255-R1259 HydrophobicContact CD2-CB 4.41Å; S1256-R1259 CarbonylContact O-C 3.5Å; S1256-R1259 WeakPolarHBondContact O-CA 3.27Å; S1256-R1259 WeakPolarHBondContact O-CB 3.34Å; S1256-R1259 PolarHBondContact O-N 3.12Å; A1257-R1259 VanDerWaalsContact C-N 3.29Å; A1257-R1259 PolarHBondContact O-N 3.32Å; R1259-N1261 PolarHBondContact O-N 3.41Å; R1259-H1306 PolarHBondContact NH1-O 3.13Å; R1259-H1306 VanDerWaalsContact NH1-O 3.14Å; R1259-H1306 PolarHBondContact NH2-O 2.88Å
1260	S	41.4	Very low	46	Very low	74.2 Å²	74.2	93 Å²	93	52%	0.519	50%	0.501	S	S	.	.			trans	-60.3	135.2	166.4	72	0	0	0	0	109.9	T1258 A1262 M1265	T1258-S1260 PolarHBondContact O-N 3.08Å; T1258-S1260 VanDerWaalsContact O-N 3.16Å; S1260-A1262 PolarHBondContact O-N 3.3Å; S1260-A1262 VanDerWaalsContact O-N 3.1Å; S1260-M1265 VanDerWaalsContact OG-CG 3.26Å; S1260-M1265 WeakPolarHBondContact OG-CG 3.28Å; S1260-M1265 PolarHBondContact OG-SD 2.93Å
1261	N	44.7	Very low	46	Very low	123 Å²	123	94.4 Å²	94.4	66%	0.658	52%	0.516	S	S	*	.			trans	-55.8	121.2	178.9	-161.5	-16.1	0	0	0	110.1	R1259 G1263 R1264 M1265	R1259-N1261 PolarHBondContact O-N 3.41Å; N1261-G1263 PolarHBondContact O-N 3.12Å; N1261-G1263 VanDerWaalsContact O-N 3.16Å; N1261-G1263 PolarHBondContact OD1-N 3.1Å; N1261-R1264 HydrophobicContact CB-CB 4.41Å; N1261-R1264 PolarHBondContact O-N 3Å; N1261-M1265 PolarHBondContact O-N 3.11Å
1262	A	45.4	Very low	45.5	Very low	76.4 Å²	76.4	97.9 Å²	97.9	63%	0.631	53%	0.528	S	S	*	.	H	α-helix	trans	-58	-27.5	-175.1	0	0	0	0	0	113.2	S1260 R1264 M1265 A1266	S1260-A1262 PolarHBondContact O-N 3.3Å; S1260-A1262 VanDerWaalsContact O-N 3.1Å; A1262-R1264 PolarHBondContact O-N 3.22Å; A1262-M1265 PolarHBondContact O-N 3.3Å; A1262-A1266 PolarHBondContact O-N 3.02Å
1263	G	46.8	Very low	44.7	Very low	37.6 Å²	37.6	96.5 Å²	96.5	39%	0.388	53%	0.528	S	S	.	.	H	α-helix	trans	-59.9	-50.1	172.7	0	0	0	0	0	112.6	N1261 M1265 A1266 E1267	N1261-G1263 PolarHBondContact O-N 3.12Å; N1261-G1263 VanDerWaalsContact O-N 3.16Å; N1261-G1263 PolarHBondContact OD1-N 3.1Å; G1263-M1265 VanDerWaalsContact C-N 3.29Å; G1263-M1265 PolarHBondContact O-N 2.96Å; G1263-A1266 WeakPolarHBondContact O-CA 3.31Å; G1263-A1266 WeakPolarHBondContact O-CB 3.41Å; G1263-A1266 PolarHBondContact O-N 3.27Å; G1263-A1266 VanDerWaalsContact O-N 3.16Å; G1263-E1267 WeakPolarHBondContact O-CG 3.48Å; G1263-E1267 PolarHBondContact O-N 3.29Å
1264	R	47.4	Very low	43.8	Very low	192.8 Å²	192.8	97.9 Å²	97.9	73%	0.728	54%	0.543	S	S	*	.	H	α-helix	trans	-64.7	-33.8	177.9	-85.7	-168.6	172.7	-165.2	-1.8	113.2	N1261 A1262 A1266 E1267 H1268	N1261-R1264 HydrophobicContact CB-CB 4.41Å; N1261-R1264 PolarHBondContact O-N 3Å; A1262-R1264 PolarHBondContact O-N 3.22Å; R1264-A1266 VanDerWaalsContact C-N 3.33Å; R1264-E1267 VanDerWaalsContact CA-OE2 3.3Å; R1264-E1267 WeakPolarHBondContact CA-OE2 3.32Å; R1264-H1268 VanDerWaalsContact O-CB 3.26Å; R1264-H1268 WeakPolarHBondContact O-CB 3.39Å; R1264-H1268 PolarHBondContact O-N 3.23Å
1265	M	43.8	Very low	43.2	Very low	113.8 Å²	113.8	97.9 Å²	97.9	56%	0.561	55%	0.552	S	S	*	*	H	α-helix	trans	-69.2	-33.9	173.6	-71.5	-128	79.8	0	0	112.3	S1260 N1261 A1262 G1263 H1268 A1269	S1260-M1265 VanDerWaalsContact OG-CG 3.26Å; S1260-M1265 WeakPolarHBondContact OG-CG 3.28Å; S1260-M1265 PolarHBondContact OG-SD 2.93Å; N1261-M1265 PolarHBondContact O-N 3.11Å; A1262-M1265 PolarHBondContact O-N 3.3Å; G1263-M1265 VanDerWaalsContact C-N 3.29Å; G1263-M1265 PolarHBondContact O-N 2.96Å; M1265-H1268 PolarHBondContact O-N 3.46Å; M1265-A1269 VanDerWaalsContact O-CB 3.25Å; M1265-A1269 WeakPolarHBondContact O-CB 3.38Å; M1265-A1269 PolarHBondContact O-N 3.18Å; M1265-A1269 VanDerWaalsContact O-N 3.13Å
1266	A	44.2	Very low	42.5	Very low	52.2 Å²	52.2	102.4 Å²	102.4	43%	0.431	58%	0.575	S	S	.	*	H	α-helix	trans	-70.1	-44	174.1	0	0	0	0	0	111.7	A1262 G1263 R1264 H1268 A1269 L1270	A1262-A1266 PolarHBondContact O-N 3.02Å; G1263-A1266 WeakPolarHBondContact O-CA 3.31Å; G1263-A1266 WeakPolarHBondContact O-CB 3.41Å; G1263-A1266 PolarHBondContact O-N 3.27Å; G1263-A1266 VanDerWaalsContact O-N 3.16Å; R1264-A1266 VanDerWaalsContact C-N 3.33Å; A1266-H1268 VanDerWaalsContact C-N 3.35Å; A1266-H1268 PolarHBondContact O-N 2.8Å; A1266-A1269 PolarHBondContact O-N 3.09Å; A1266-L1270 WeakPolarHBondContact O-CB 3.42Å; A1266-L1270 VanDerWaalsContact O-CG 3.29Å; A1266-L1270 WeakPolarHBondContact O-CG 3.32Å; A1266-L1270 PolarHBondContact O-N 3.19Å
1267	E	46.6	Very low	42	Very low	133 Å²	133	105.8 Å²	105.8	62%	0.621	60%	0.599	S	S	*	*	H	α-helix	trans	-60.7	-45.7	174.3	-74.4	173.1	155.3	0	0	111.7	G1263 R1264 A1269 L1270 S1271	G1263-E1267 WeakPolarHBondContact O-CG 3.48Å; G1263-E1267 PolarHBondContact O-N 3.29Å; R1264-E1267 VanDerWaalsContact CA-OE2 3.3Å; R1264-E1267 WeakPolarHBondContact CA-OE2 3.32Å; E1267-A1269 VanDerWaalsContact C-N 3.27Å; E1267-A1269 PolarHBondContact O-N 2.84Å; E1267-L1270 PolarHBondContact O-N 3.22Å; E1267-L1270 VanDerWaalsContact O-N 3.12Å; E1267-S1271 PolarHBondContact O-N 3.18Å; E1267-S1271 PolarHBondContact O-OG 3.02Å
1268	H	44.7	Very low	41.4	Very low	107.2 Å²	107.2	107.5 Å²	107.5	50%	0.496	61%	0.605	S	S	.	*	H	α-helix	trans	-71	-25.2	178.8	-163.2	-82.3	0	0	0	112.9	R1264 M1265 A1266 S1271 I1272	R1264-H1268 VanDerWaalsContact O-CB 3.26Å; R1264-H1268 WeakPolarHBondContact O-CB 3.39Å; R1264-H1268 PolarHBondContact O-N 3.23Å; M1265-H1268 PolarHBondContact O-N 3.46Å; A1266-H1268 VanDerWaalsContact C-N 3.35Å; A1266-H1268 PolarHBondContact O-N 2.8Å; H1268-S1271 WeakPolarHBondContact CA-OG 3.36Å; H1268-S1271 PolarHBondContact O-N 2.86Å; H1268-S1271 VanDerWaalsContact O-N 3.17Å; H1268-S1271 PolarHBondContact O-OG 2.99Å; H1268-I1272 VanDerWaalsContact CE1-CD1 3.41Å; H1268-I1272 WeakPolarHBondContact CE1-CD1 3.31Å; H1268-I1272 VanDerWaalsContact ND1-CD1 3.3Å; H1268-I1272 WeakPolarHBondContact ND1-CD1 3.3Å; H1268-I1272 WeakPolarHBondContact O-CD1 3.47Å; H1268-I1272 VanDerWaalsContact O-CG1 3.28Å; H1268-I1272 WeakPolarHBondContact O-CG1 3.35Å; H1268-I1272 PolarHBondContact O-N 3.44Å; H1268-I1272 VanDerWaalsContact O-N 3.1Å
1269	A	44.4	Very low	40.8	Very low	51.6 Å²	51.6	105.3 Å²	105.3	43%	0.426	61%	0.606	S	S	.	*	H	α-helix	trans	-75.1	-38.2	170.4	0	0	0	0	0	111.7	M1265 A1266 E1267 S1271 I1272 H1273	M1265-A1269 VanDerWaalsContact O-CB 3.25Å; M1265-A1269 WeakPolarHBondContact O-CB 3.38Å; M1265-A1269 PolarHBondContact O-N 3.18Å; M1265-A1269 VanDerWaalsContact O-N 3.13Å; A1266-A1269 PolarHBondContact O-N 3.09Å; E1267-A1269 VanDerWaalsContact C-N 3.27Å; E1267-A1269 PolarHBondContact O-N 2.84Å; A1269-S1271 VanDerWaalsContact C-N 3.31Å; A1269-S1271 PolarHBondContact O-N 3.21Å; A1269-I1272 PolarHBondContact O-N 3.12Å; A1269-H1273 WeakPolarHBondContact O-CB 3.45Å; A1269-H1273 PolarHBondContact O-N 3.31Å; A1269-H1273 VanDerWaalsContact O-N 3.15Å
1270	L	42.2	Very low	40.3	Very low	108.4 Å²	108.4	110.3 Å²	110.3	57%	0.568	63%	0.625	S	S	*	*	H	α-helix	trans	-69.8	-29.5	175.5	-73.3	166.7	0	0	0	112.7	A1266 E1267 H1273 L1275	A1266-L1270 WeakPolarHBondContact O-CB 3.42Å; A1266-L1270 VanDerWaalsContact O-CG 3.29Å; A1266-L1270 WeakPolarHBondContact O-CG 3.32Å; A1266-L1270 PolarHBondContact O-N 3.19Å; E1267-L1270 PolarHBondContact O-N 3.22Å; E1267-L1270 VanDerWaalsContact O-N 3.12Å; L1270-H1273 CarbonylContact O-C 3.47Å; L1270-L1275 HydrophobicContact CD2-CD1 4.08Å
1271	S	48.6	Very low	39.8	Very low	87.2 Å²	87.2	115.4 Å²	115.4	61%	0.61	64%	0.64	S	S	*	*	H	α-helix	trans	-77.4	-29.4	174.5	71.4	0	0	0	0	113.5	E1267 H1268 A1269	E1267-S1271 PolarHBondContact O-N 3.18Å; E1267-S1271 PolarHBondContact O-OG 3.02Å; H1268-S1271 WeakPolarHBondContact CA-OG 3.36Å; H1268-S1271 PolarHBondContact O-N 2.86Å; H1268-S1271 VanDerWaalsContact O-N 3.17Å; H1268-S1271 PolarHBondContact O-OG 2.99Å; A1269-S1271 VanDerWaalsContact C-N 3.31Å; A1269-S1271 PolarHBondContact O-N 3.21Å
1272	I	43.7	Very low	39.1	Very low	94.2 Å²	94.2	117.3 Å²	117.3	48%	0.483	65%	0.65	S	S	.	*	H	α-helix	trans	-82.1	-31.8	176.8	-68.8	174.4	0	0	0	111.8	H1268 A1269 P1274	H1268-I1272 VanDerWaalsContact CE1-CD1 3.41Å; H1268-I1272 WeakPolarHBondContact CE1-CD1 3.31Å; H1268-I1272 VanDerWaalsContact ND1-CD1 3.3Å; H1268-I1272 WeakPolarHBondContact ND1-CD1 3.3Å; H1268-I1272 WeakPolarHBondContact O-CD1 3.47Å; H1268-I1272 VanDerWaalsContact O-CG1 3.28Å; H1268-I1272 WeakPolarHBondContact O-CG1 3.35Å; H1268-I1272 PolarHBondContact O-N 3.44Å; H1268-I1272 VanDerWaalsContact O-N 3.1Å; A1269-I1272 PolarHBondContact O-N 3.12Å; I1272-P1274 WeakPolarHBondContact O-CD 3.4Å
1273	H	35.3	Very low	38.3	Very low	128 Å²	128	122.1 Å²	122.1	59%	0.593	66%	0.659	S	S	*	*	S	Bend	trans	-123.5	90	-179.7	-67.5	-56.9	0	0	0	111.2	A1269 L1270 L1275	A1269-H1273 WeakPolarHBondContact O-CB 3.45Å; A1269-H1273 PolarHBondContact O-N 3.31Å; A1269-H1273 VanDerWaalsContact O-N 3.15Å; L1270-H1273 CarbonylContact O-C 3.47Å; H1273-L1275 PolarHBondContact O-N 2.97Å
1274	P	33.9	Very low	37.6	Very low	102.4 Å²	102.4	128.5 Å²	128.5	67%	0.665	68%	0.683	S	S	*	*			trans	-60.2	136	168.6	26.2	-33.1	0	0	0	109.5	I1272 I1276	I1272-P1274 WeakPolarHBondContact O-CD 3.4Å; P1274-I1276 PolarHBondContact O-N 3Å
1275	L	34.3	Very low	36.7	Very low	136 Å²	136	125.7 Å²	125.7	71%	0.712	69%	0.688	S	S	*	*			trans	-60.3	110.6	-175.8	-100	101.8	0	0	0	111.3	L1270 H1273 S1277	L1270-L1275 HydrophobicContact CD2-CD1 4.08Å; H1273-L1275 PolarHBondContact O-N 2.97Å; L1275-S1277 PolarHBondContact O-N 3.22Å
1276	I	33	Very low	36.1	Very low	162 Å²	162	124.7 Å²	124.7	83%	0.831	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	70	170.8	-51.3	176.9	0	0	0	108.7	P1274	P1274-I1276 PolarHBondContact O-N 3Å
1277	S	33.3	Very low	35.5	Very low	99.6 Å²	99.6	128.8 Å²	128.8	70%	0.697	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.3	18.7	175.4	-72.6	0	0	0	0	112.6	L1275 G1279	L1275-S1277 PolarHBondContact O-N 3.22Å; S1277-G1279 PolarHBondContact O-N 2.9Å; S1277-G1279 VanDerWaalsContact O-N 3.07Å
1278	S	32.1	Very low	34.8	Very low	120 Å²	120	127.6 Å²	127.6	84%	0.839	72%	0.724	S	S	*	*			trans	-93.3	15.2	173.4	51.9	0	0	0	0	113.3
1279	G	30.7	Very low	34	Very low	71.8 Å²	71.8	128.2 Å²	128.2	74%	0.74	74%	0.74	S	S	*	*	S	Bend	trans	-110.3	16.8	-175.4	0	0	0	0	0	116	S1277	S1277-G1279 PolarHBondContact O-N 2.9Å; S1277-G1279 VanDerWaalsContact O-N 3.07Å
1280	R	30.7	Very low	33.2	Very low	244.4 Å²	244.4	129.1 Å²	129.1	92%	0.922	75%	0.754	S	S	*	*	S	Bend	trans	-157.6	55.3	-177.8	-86.7	-171.6	179.4	-139.4	-0.7	115.4
1281	Q	30.8	Very low	32.6	Very low	182 Å²	182	131.7 Å²	131.7	85%	0.85	77%	0.769	S	S	*	*			trans	-145.8	59.4	153.4	-144.1	163.4	7.1	0	0	111.7
1282	L	28.9	Very low	31.4	Very low	162.6 Å²	162.6	138.1 Å²	138.1	85%	0.851	78%	0.78	S	S	*	*	S	Bend	trans	-109.5	70.4	170.9	-135	116.7	0	0	0	110.2
1283	E	29.7	Very low	30.6	Very low	177.8 Å²	177.8	140.9 Å²	140.9	83%	0.831	80%	0.795	S	S	*	*			trans	-175.6	101.6	175.1	-90.3	178.2	163.7	0	0	113
1284	L	32.2	Very low	30.3	Very low	171 Å²	171	142.2 Å²	142.2	90%	0.895	81%	0.805	S	S	*	*			trans	-173.5	56	167.4	-75.7	161.3	0	0	0	113.6
1285	T	28.6	Very low	30.1	Very low	134.6 Å²	134.6	145.3 Å²	145.3	83%	0.826	81%	0.814	S	S	*	*			trans	-110.5	100	166.3	48.8	0	0	0	0	112
1286	A	29.7	Very low	29.8	Very low	91.8 Å²	91.8	146.8 Å²	146.8	76%	0.759	82%	0.817	S	S	*	*			trans	168.8	77.7	167.9	0	0	0	0	0	115.9	S1288	A1286-S1288 PolarHBondContact O-N 2.92Å
1287	T	32.4	Very low	29.5	Very low	138.6 Å²	138.6	150.6 Å²	150.6	85%	0.85	82%	0.821	S	S	*	*			trans	-153.5	115.4	157.1	47.7	0	0	0	0	114.4
1288	S	31	Very low	29.3	Very low	108.8 Å²	108.8	157.4 Å²	157.4	76%	0.761	83%	0.832	S	S	*	*			trans	96.8	109.1	146.1	-164.5	0	0	0	0	117.1	A1286	A1286-S1288 PolarHBondContact O-N 2.92Å
1289	S	28.7	Very low	29.1	Very low	118.6 Å²	118.6	155.3 Å²	155.3	83%	0.829	83%	0.829	S	S	*	*			trans	25.6	121	135.7	10.8	0	0	0	0	118.6
1290	G	27.2	Very low	29	Very low	70.4 Å²	70.4	158.9 Å²	158.9	73%	0.726	83%	0.831	S	S	*	*			trans	131	90.3	148.8	0	0	0	0	0	116.8
1291	N	28.8	Very low	29.1	Very low	164.4 Å²	164.4	152.5 Å²	152.5	88%	0.879	82%	0.821	S	S	*	*			trans	99.6	117.5	148.7	-89.8	-27.9	0	0	0	118
1292	R	25.2	Very low	29	Very low	221.8 Å²	221.8	153.2 Å²	153.2	84%	0.837	82%	0.816	S	S	*	*			trans	-54.8	115.3	158.4	-95.7	178.7	172.8	-176.1	-2.3	115.9	L1294	R1292-L1294 PolarHBondContact O-N 3.12Å
1293	L	26.2	Very low	29.1	Very low	151.8 Å²	151.8	148 Å²	148	80%	0.795	80%	0.802	S	S	*	*			trans	66.3	80.9	141.2	-91	151.6	0	0	0	117.2
1294	L	27.9	Very low	29.4	Very low	155.8 Å²	155.8	144.6 Å²	144.6	82%	0.816	79%	0.789	S	S	*	*			trans	-157.7	58.7	162.1	-66.9	175.4	0	0	0	116	R1292 H1296	R1292-L1294 PolarHBondContact O-N 3.12Å; L1294-H1296 VanDerWaalsContact C-N 3.27Å; L1294-H1296 PolarHBondContact O-N 3.16Å
1295	I	30.3	Very low	29.6	Very low	166.8 Å²	166.8	141 Å²	141	86%	0.855	77%	0.768	S	S	*	*			trans	-110.2	79.3	155.3	-56.4	-176.4	0	0	0	110.4	R1297	I1295-R1297 PolarHBondContact O-N 3.46Å
1296	H	27.9	Very low	29.8	Very low	167.8 Å²	167.8	139.9 Å²	139.9	78%	0.777	75%	0.753	S	S	*	*			trans	-61.8	89.4	177.9	-81.9	-76.9	0	0	0	116.8	L1294 R1298	L1294-H1296 VanDerWaalsContact C-N 3.27Å; L1294-H1296 PolarHBondContact O-N 3.16Å; H1296-R1298 PolarHBondContact O-N 3.35Å
1297	R	27.8	Very low	29.9	Very low	242 Å²	242	137.8 Å²	137.8	91%	0.913	74%	0.741	S	S	*	*			trans	-70.6	87	152.3	-72.9	-170.9	-178.9	-166.5	-0.2	113.6	I1295 G1299	I1295-R1297 PolarHBondContact O-N 3.46Å; R1297-G1299 PolarHBondContact O-N 2.9Å
1298	R	28	Very low	29.9	Very low	243 Å²	243	137.1 Å²	137.1	92%	0.917	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-83	134	154	-78	-169.5	177.9	-160.2	0.2	108.4	H1296 N1300	H1296-R1298 PolarHBondContact O-N 3.35Å; R1298-N1300 PolarHBondContact O-N 3.39Å
1299	G	27.4	Very low	30.1	Very low	74.8 Å²	74.8	135.1 Å²	135.1	77%	0.771	73%	0.727	S	S	*	*			trans	-52.4	116.8	-170.8	0	0	0	0	0	113.6	R1297 P1301	R1297-G1299 PolarHBondContact O-N 2.9Å; G1299-P1301 WeakPolarHBondContact O-CD 3.35Å
1300	N	29.1	Very low	30.4	Very low	147.8 Å²	147.8	136.1 Å²	136.1	79%	0.79	71%	0.712	S	S	*	*			trans	-61.4	123.2	173.5	-144.4	11	0	0	0	109.3	R1298 R1302	R1298-N1300 PolarHBondContact O-N 3.39Å; N1300-R1302 VanDerWaalsContact C-N 3.31Å; N1300-R1302 PolarHBondContact O-N 3.37Å; N1300-R1302 VanDerWaalsContact O-N 3.09Å
1301	P	32.6	Very low	31	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	71%	0.705	S	S	*	*			trans	-67.3	114.5	-179.4	27.6	-32.6	0	0	0	109	G1299 G1303	G1299-P1301 WeakPolarHBondContact O-CD 3.35Å; P1301-G1303 PolarHBondContact O-N 3.24Å; P1301-G1303 VanDerWaalsContact O-N 3.1Å
1302	R	29.5	Very low	31.6	Very low	195.8 Å²	195.8	129.2 Å²	129.2	74%	0.739	67%	0.673	S	S	*	*			trans	-61	114.4	-172.9	-62.2	-176.3	-154	-144.7	2.2	109.9	N1300 L1304	N1300-R1302 VanDerWaalsContact C-N 3.31Å; N1300-R1302 PolarHBondContact O-N 3.37Å; N1300-R1302 VanDerWaalsContact O-N 3.09Å; R1302-L1304 PolarHBondContact O-N 2.96Å; R1302-L1304 VanDerWaalsContact O-N 3.15Å
1303	G	31.1	Very low	32.5	Very low	54.6 Å²	54.6	120.3 Å²	120.3	56%	0.563	65%	0.645	S	S	*	*			trans	-64	139.6	177	0	0	0	0	0	112	P1301 Q1305	P1301-G1303 PolarHBondContact O-N 3.24Å; P1301-G1303 VanDerWaalsContact O-N 3.1Å; G1303-Q1305 PolarHBondContact O-N 2.85Å
1304	L	35.9	Very low	33.4	Very low	104.8 Å²	104.8	115.5 Å²	115.5	55%	0.549	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-46.7	29	178.8	-75.8	120.3	0	0	0	115.4	E1182 M1184 M1253 R1302 H1306	E1182-L1304 WeakPolarHBondContact OE2-CD2 3.28Å; M1184-L1304 HydrophobicContact CG-CD1 4.03Å; M1184-L1304 HydrophobicContact SD-CB 4.04Å; M1184-L1304 HydrophobicContact SD-CD1 4Å; M1184-L1304 HydrophobicContact SD-CD2 4.48Å; M1253-L1304 HydrophobicContact CE-CD2 3.94Å; M1253-L1304 HydrophobicContact SD-CD2 4.35Å; R1302-L1304 PolarHBondContact O-N 2.96Å; R1302-L1304 VanDerWaalsContact O-N 3.15Å; L1304-H1306 VanDerWaalsContact C-N 3.26Å; L1304-H1306 VanDerWaalsContact CB-CE1 3.41Å; L1304-H1306 WeakPolarHBondContact CB-CE1 3.13Å; L1304-H1306 WeakPolarHBondContact CB-ND1 3.42Å; L1304-H1306 WeakPolarHBondContact CD2-CE1 3.4Å; L1304-H1306 WeakPolarHBondContact CD2-NE2 3.25Å; L1304-H1306 PolarHBondContact O-N 3.33Å; L1304-H1306 VanDerWaalsContact O-N 3.12Å
1305	Q	35.8	Very low	34.6	Very low	96.4 Å²	96.4	111.2 Å²	111.2	45%	0.45	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.7	25.6	-175.1	-67.7	174	-9	0	0	113.8	D1192 R1196 N1222 G1303 G1307	D1192-Q1305 PolarHBondContact O-NE2 2.89Å; D1192-Q1305 PolarHBondContact OD1-NE2 3.14Å; D1192-Q1305 WeakPolarHBondContact OD2-CG 3.49Å; D1192-Q1305 PolarHBondContact OD2-NE2 3.15Å; D1192-Q1305 VanDerWaalsContact OD2-NE2 3.16Å; R1196-Q1305 VanDerWaalsContact NE-OE1 3.1Å; N1222-Q1305 VanDerWaalsContact CB-OE1 3.3Å; G1303-Q1305 PolarHBondContact O-N 2.85Å; Q1305-G1307 VanDerWaalsContact C-N 3.32Å; Q1305-G1307 PolarHBondContact O-N 3.06Å; Q1305-G1307 VanDerWaalsContact O-N 3.16Å
1306	H	33.3	Very low	35.7	Very low	110.2 Å²	110.2	106.5 Å²	106.5	51%	0.51	57%	0.571	S	S	.	*			trans	-65.9	101.8	164.9	-67.2	88.7	0	0	0	112.2	R1259 L1304 I1308	R1259-H1306 PolarHBondContact NH1-O 3.13Å; R1259-H1306 VanDerWaalsContact NH1-O 3.14Å; R1259-H1306 PolarHBondContact NH2-O 2.88Å; L1304-H1306 VanDerWaalsContact C-N 3.26Å; L1304-H1306 VanDerWaalsContact CB-CE1 3.41Å; L1304-H1306 WeakPolarHBondContact CB-CE1 3.13Å; L1304-H1306 WeakPolarHBondContact CB-ND1 3.42Å; L1304-H1306 WeakPolarHBondContact CD2-CE1 3.4Å; L1304-H1306 WeakPolarHBondContact CD2-NE2 3.25Å; L1304-H1306 PolarHBondContact O-N 3.33Å; L1304-H1306 VanDerWaalsContact O-N 3.12Å; H1306-I1308 WeakPolarHBondContact O-CG1 3.41Å; H1306-I1308 PolarHBondContact O-N 2.95Å
1307	G	31.2	Very low	36.7	Very low	48.8 Å²	48.8	102.2 Å²	102.2	50%	0.503	55%	0.553	S	S	.	*			trans	-75	143.1	173.7	0	0	0	0	0	113.3	Q1305 G1309	Q1305-G1307 VanDerWaalsContact C-N 3.32Å; Q1305-G1307 PolarHBondContact O-N 3.06Å; Q1305-G1307 VanDerWaalsContact O-N 3.16Å; G1307-G1309 PolarHBondContact O-N 3.02Å
1308	I	33.2	Very low	37.9	Very low	123.4 Å²	123.4	95.6 Å²	95.6	63%	0.633	53%	0.532	S	S	*	.	S	Bend	trans	-0.1	97	167	-54.1	164.6	0	0	0	113.6	T1226 R1245 H1306 W1310 V1312	T1226-I1308 HydrophobicContact CG2-CD1 4.37Å; R1245-I1308 VanDerWaalsContact O-CD1 3.31Å; R1245-I1308 WeakPolarHBondContact O-CD1 3.43Å; H1306-I1308 WeakPolarHBondContact O-CG1 3.41Å; H1306-I1308 PolarHBondContact O-N 2.95Å; I1308-W1310 VanDerWaalsContact C-N 3.32Å; I1308-W1310 VanDerWaalsContact O-CD1 3.23Å; I1308-W1310 PolarHBondContact O-N 3.19Å; I1308-V1312 HydrophobicContact CD1-CG2 4.26Å; I1308-V1312 HydrophobicContact CG1-CG2 4.04Å
1309	G	34.2	Very low	39	Very low	66.8 Å²	66.8	90.8 Å²	90.8	69%	0.689	53%	0.525	S	S	*	.			trans	144.3	54.3	148.8	0	0	0	0	0	114.5	G1307 G1311	G1307-G1309 PolarHBondContact O-N 3.02Å; G1309-G1311 PolarHBondContact O-N 3.3Å; G1309-G1311 VanDerWaalsContact O-N 3.14Å
1310	W	35.2	Very low	40.3	Very low	139 Å²	139	93.3 Å²	93.3	53%	0.527	52%	0.517	S	S	.	.			trans	-77.1	26.3	-177.9	-63.4	90.5	0	0	0	115.6	I1308 V1335 H1337 P1338 L1344	I1308-W1310 VanDerWaalsContact C-N 3.32Å; I1308-W1310 VanDerWaalsContact O-CD1 3.23Å; I1308-W1310 PolarHBondContact O-N 3.19Å; W1310-V1335 HydrophobicContact CH2-CG1 4.33Å; W1310-H1337 WeakPolarHBondContact CB-NE2 3.41Å; W1310-H1337 AromaticContact CE3-CD2 3.38Å; W1310-H1337 AromaticContact CE3-NE2 3.65Å; W1310-H1337 AromaticContact CG-NE2 4Å; W1310-H1337 HydrophobicContact CZ3-CB 4.43Å; W1310-H1337 AromaticContact CZ3-CD2 3.96Å; W1310-H1337 PolarHBondContact O-CD2 2.99Å; W1310-H1337 PolarHBondContact O-NE2 3.23Å; W1310-P1338 HydrophobicContact CD2-CG 3.59Å; W1310-P1338 VanDerWaalsContact CD2-CG 3.49Å; W1310-P1338 HydrophobicContact CE3-CG 3.87Å; W1310-P1338 HydrophobicContact CG-CG 4.01Å; W1310-P1338 HydrophobicContact CH2-CG 4.01Å; W1310-P1338 HydrophobicContact CZ2-CG 3.99Å; W1310-P1338 HydrophobicContact CZ3-CG 3.87Å; W1310-L1344 HydrophobicContact CD2-CD2 4.42Å; W1310-L1344 HydrophobicContact CE3-CD1 4.4Å; W1310-L1344 HydrophobicContact CE3-CD2 3.5Å; W1310-L1344 VanDerWaalsContact CE3-CD2 3.5Å; W1310-L1344 HydrophobicContact CE3-CG 4.35Å; W1310-L1344 HydrophobicContact CH2-CD1 3.62Å; W1310-L1344 HydrophobicContact CH2-CD2 4.24Å; W1310-L1344 HydrophobicContact CH2-CG 4.27Å; W1310-L1344 HydrophobicContact CZ2-CD1 4.4Å; W1310-L1344 HydrophobicContact CZ3-CD1 4.02Å; W1310-L1344 HydrophobicContact CZ3-CD2 3.39Å; W1310-L1344 HydrophobicContact CZ3-CG 3.74Å
1311	G	39.8	Very low	41.5	Very low	55.8 Å²	55.8	90.4 Å²	90.4	58%	0.575	50%	0.5	S	S	*	.			trans	89	50.1	161.4	0	0	0	0	0	116.2	G1309 N1347	G1309-G1311 PolarHBondContact O-N 3.3Å; G1309-G1311 VanDerWaalsContact O-N 3.14Å; G1311-N1347 VanDerWaalsContact C-ND2 3.32Å; G1311-N1347 VanDerWaalsContact O-CG 3.24Å; G1311-N1347 PolarHBondContact O-ND2 3.04Å; G1311-N1347 PolarHBondContact O-OD1 3.21Å
1312	V	42.7	Very low	42.3	Very low	34.2 Å²	34.2	90 Å²	90	21%	0.207	50%	0.498	C	S	.	.			trans	-62.9	137.9	171.3	-163.1	0	0	0	0	110.7	I1308 P1314 Y1316 L1317 H1337 T1340	I1308-V1312 HydrophobicContact CD1-CG2 4.26Å; I1308-V1312 HydrophobicContact CG1-CG2 4.04Å; V1312-P1314 WeakPolarHBondContact O-CD 3.36Å; V1312-Y1316 HydrophobicContact CG1-CD2 4.15Å; V1312-Y1316 HydrophobicContact CG1-CG 4.5Å; V1312-L1317 HydrophobicContact CB-CD1 4.15Å; V1312-L1317 HydrophobicContact CB-CG 4.31Å; V1312-L1317 HydrophobicContact CG1-CD2 4.46Å; V1312-L1317 HydrophobicContact CG1-CG 4.23Å; V1312-L1317 HydrophobicContact CG2-CD1 4.24Å; V1312-L1317 HydrophobicContact CG2-CD2 4.24Å; V1312-L1317 HydrophobicContact CG2-CG 4.17Å; V1312-H1337 VanDerWaalsContact CG2-CE1 3.44Å; V1312-H1337 WeakPolarHBondContact CG2-CE1 3.32Å; V1312-H1337 WeakPolarHBondContact CG2-NE2 3.34Å; V1312-T1340 HydrophobicContact CG1-CG2 3.8Å; V1312-T1340 HydrophobicContact CG2-CG2 4.25Å
1313	C	43.1	Very low	43.4	Very low	35.6 Å²	35.6	84.4 Å²	84.4	24%	0.241	49%	0.485	C	S	.	.			trans	-58.2	120.6	162.3	-117	0	0	0	0	109.7	E1315 Y1316 N1347 P1348	C1313-E1315 VanDerWaalsContact C-OE2 3.24Å; C1313-E1315 WeakPolarHBondContact CA-OE2 3.27Å; C1313-E1315 WeakPolarHBondContact CB-OE2 3.28Å; C1313-E1315 PolarHBondContact O-N 3.16Å; C1313-E1315 VanDerWaalsContact O-N 3.1Å; C1313-E1315 PolarHBondContact SG-OE2 3.08Å; C1313-Y1316 HydrophobicContact CB-CD2 3.69Å; C1313-Y1316 VanDerWaalsContact CB-CD2 3.49Å; C1313-Y1316 HydrophobicContact CB-CE2 3.96Å; C1313-Y1316 WeakPolarHBondContact O-CB 3.44Å; C1313-Y1316 PolarHBondContact O-N 3.04Å; C1313-Y1316 VanDerWaalsContact O-N 3.12Å; C1313-N1347 PolarHBondContact N-OD1 3.3Å; C1313-N1347 VanDerWaalsContact N-OD1 3.1Å; C1313-P1348 HydrophobicContact CB-CB 4.49Å; C1313-P1348 HydrophobicContact CB-CG 4.17Å; C1313-P1348 VanDerWaalsContact SG-CB 3.57Å; C1313-P1348 VanDerWaalsContact SG-CD 3.55Å
1314	P	45.2	Very low	44.5	Very low	51.4 Å²	51.4	90.9 Å²	90.9	33%	0.334	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-55.2	-25.5	-175.7	-26.8	34.8	0	0	0	114.6	V1312 Y1316 L1317 Q1318	V1312-P1314 WeakPolarHBondContact O-CD 3.36Å; P1314-Y1316 VanDerWaalsContact C-N 3.27Å; P1314-Y1316 PolarHBondContact O-N 2.9Å; P1314-L1317 CarbonylContact O-C 3.6Å; P1314-L1317 WeakPolarHBondContact O-CA 3.23Å; P1314-L1317 WeakPolarHBondContact O-CB 3.24Å; P1314-L1317 PolarHBondContact O-N 3.39Å; P1314-Q1318 VanDerWaalsContact C-NE2 3.27Å; P1314-Q1318 VanDerWaalsContact CB-NE2 3.26Å; P1314-Q1318 WeakPolarHBondContact O-CB 3.4Å; P1314-Q1318 VanDerWaalsContact O-CG 3.25Å; P1314-Q1318 WeakPolarHBondContact O-CG 3.31Å; P1314-Q1318 PolarHBondContact O-N 2.99Å; P1314-Q1318 PolarHBondContact O-NE2 3.34Å
1315	E	54.1	Low	45.4	Very low	66.2 Å²	66.2	91.1 Å²	91.1	31%	0.309	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-65.1	-27.2	-178.4	-57.7	73.3	-157	0	0	112.2	C1313 L1317 Q1318 D1319 Q1320 I1321	C1313-E1315 VanDerWaalsContact C-OE2 3.24Å; C1313-E1315 WeakPolarHBondContact CA-OE2 3.27Å; C1313-E1315 WeakPolarHBondContact CB-OE2 3.28Å; C1313-E1315 PolarHBondContact O-N 3.16Å; C1313-E1315 VanDerWaalsContact O-N 3.1Å; C1313-E1315 PolarHBondContact SG-OE2 3.08Å; E1315-L1317 VanDerWaalsContact C-N 3.31Å; E1315-L1317 PolarHBondContact O-N 3.3Å; E1315-Q1318 CarbonylContact O-C 3.59Å; E1315-Q1318 PolarHBondContact O-N 2.74Å; E1315-Q1318 VanDerWaalsContact O-N 3.15Å; E1315-D1319 PolarHBondContact O-N 2.91Å; E1315-Q1320 CarbonylContact C-O 2.93Å; E1315-Q1320 HydrophobicContact CB-CB 4.35Å; E1315-Q1320 PolarHBondContact O-N 3.01Å; E1315-Q1320 VanDerWaalsContact O-N 3.08Å; E1315-I1321 HydrophobicContact CB-CD1 3.67Å; E1315-I1321 HydrophobicContact CB-CG1 3.97Å; E1315-I1321 HydrophobicContact CG-CD1 4.43Å; E1315-I1321 PolarHBondContact O-N 3.34Å
1316	Y	52.2	Low	46.3	Very low	67.4 Å²	67.4	88.4 Å²	88.4	26%	0.264	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-77.6	-21.1	171.6	-67.3	-64.2	0	0	0	113.6	V1312 C1313 P1314 Q1318 I1321 P1322 V1323 I1342 P1348	V1312-Y1316 HydrophobicContact CG1-CD2 4.15Å; V1312-Y1316 HydrophobicContact CG1-CG 4.5Å; C1313-Y1316 HydrophobicContact CB-CD2 3.69Å; C1313-Y1316 VanDerWaalsContact CB-CD2 3.49Å; C1313-Y1316 HydrophobicContact CB-CE2 3.96Å; C1313-Y1316 WeakPolarHBondContact O-CB 3.44Å; C1313-Y1316 PolarHBondContact O-N 3.04Å; C1313-Y1316 VanDerWaalsContact O-N 3.12Å; P1314-Y1316 VanDerWaalsContact C-N 3.27Å; P1314-Y1316 PolarHBondContact O-N 2.9Å; Y1316-Q1318 VanDerWaalsContact C-N 3.32Å; Y1316-I1321 HydrophobicContact CD1-CB 4.01Å; Y1316-I1321 HydrophobicContact CD1-CG2 4.2Å; Y1316-I1321 HydrophobicContact CE1-CB 3.89Å; Y1316-I1321 HydrophobicContact CE1-CD1 4.47Å; Y1316-I1321 HydrophobicContact CE1-CG2 3.59Å; Y1316-I1321 HydrophobicContact CE2-CD1 4.28Å; Y1316-P1322 HydrophobicContact CD1-CG 4.27Å; Y1316-P1322 HydrophobicContact CD2-CG 4.22Å; Y1316-P1322 HydrophobicContact CE1-CG 3.66Å; Y1316-P1322 HydrophobicContact CE2-CG 3.59Å; Y1316-P1322 WeakPolarHBondContact OH-CG 3.26Å; Y1316-V1323 HydrophobicContact CD1-CG2 3.72Å; Y1316-V1323 HydrophobicContact CE1-CG2 4.22Å; Y1316-V1323 HydrophobicContact CG-CG2 4.46Å; Y1316-I1342 HydrophobicContact CD1-CD1 3.81Å; Y1316-I1342 HydrophobicContact CD2-CD1 3.84Å; Y1316-I1342 HydrophobicContact CE1-CD1 4.01Å; Y1316-I1342 HydrophobicContact CE2-CD1 4.04Å; Y1316-I1342 HydrophobicContact CG-CD1 3.83Å; Y1316-P1348 HydrophobicContact CE2-CG 3.82Å; Y1316-P1348 VanDerWaalsContact CE2-CG 3.5Å; Y1316-P1348 WeakPolarHBondContact OH-CD 3.48Å; Y1316-P1348 WeakPolarHBondContact OH-CG 3.2Å
1317	L	48.4	Very low	47.4	Very low	77.8 Å²	77.8	89.9 Å²	89.9	41%	0.407	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-86.9	-5	174.7	-62.9	174.7	0	0	0	112	T1221 N1222 V1312 P1314 E1315 I1339 T1340	T1221-L1317 PolarHBondContact OG1-O 2.9Å; N1222-L1317 PolarHBondContact OD1-O 2.88Å; V1312-L1317 HydrophobicContact CB-CD1 4.15Å; V1312-L1317 HydrophobicContact CB-CG 4.31Å; V1312-L1317 HydrophobicContact CG1-CD2 4.46Å; V1312-L1317 HydrophobicContact CG1-CG 4.23Å; V1312-L1317 HydrophobicContact CG2-CD1 4.24Å; V1312-L1317 HydrophobicContact CG2-CD2 4.24Å; V1312-L1317 HydrophobicContact CG2-CG 4.17Å; P1314-L1317 CarbonylContact O-C 3.6Å; P1314-L1317 WeakPolarHBondContact O-CA 3.23Å; P1314-L1317 WeakPolarHBondContact O-CB 3.24Å; P1314-L1317 PolarHBondContact O-N 3.39Å; E1315-L1317 VanDerWaalsContact C-N 3.31Å; E1315-L1317 PolarHBondContact O-N 3.3Å; L1317-I1339 HydrophobicContact CD2-CB 4.48Å; L1317-I1339 HydrophobicContact CD2-CG2 4.03Å; L1317-T1340 HydrophobicContact CD2-CG2 3.92Å
1318	Q	54.2	Low	48.5	Very low	102.6 Å²	102.6	92 Å²	92	48%	0.479	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	13	-176.8	-65.3	174.7	10.8	0	0	112	P1314 E1315 Y1316 Q1320	P1314-Q1318 VanDerWaalsContact C-NE2 3.27Å; P1314-Q1318 VanDerWaalsContact CB-NE2 3.26Å; P1314-Q1318 WeakPolarHBondContact O-CB 3.4Å; P1314-Q1318 VanDerWaalsContact O-CG 3.25Å; P1314-Q1318 WeakPolarHBondContact O-CG 3.31Å; P1314-Q1318 PolarHBondContact O-N 2.99Å; P1314-Q1318 PolarHBondContact O-NE2 3.34Å; E1315-Q1318 CarbonylContact O-C 3.59Å; E1315-Q1318 PolarHBondContact O-N 2.74Å; E1315-Q1318 VanDerWaalsContact O-N 3.15Å; Y1316-Q1318 VanDerWaalsContact C-N 3.32Å; Q1318-Q1320 HydrophobicContact CB-CG 4.27Å; Q1318-Q1320 VanDerWaalsContact CB-NE2 3.27Å; Q1318-Q1320 PolarHBondContact O-N 3.21Å; Q1318-Q1320 VanDerWaalsContact O-N 3.12Å; Q1318-Q1320 VanDerWaalsContact OE1-NE2 3.08Å
1319	D	51.9	Low	49.8	Very low	142.8 Å²	142.8	90.6 Å²	90.6	76%	0.764	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	21.6	-177.4	-64.4	-41.4	0	0	0	115.4	E1315 I1321	E1315-D1319 PolarHBondContact O-N 2.91Å; D1319-I1321 VanDerWaalsContact C-N 3.3Å; D1319-I1321 PolarHBondContact O-N 3.31Å
1320	Q	53.3	Low	50.8	Low	127.6 Å²	127.6	91.6 Å²	91.6	60%	0.596	50%	0.502	S	S	*	.	S	Bend	trans	-81.5	-14.3	178.9	-72.3	178.8	52.9	0	0	112.3	E1315 Q1318 P1322	E1315-Q1320 CarbonylContact C-O 2.93Å; E1315-Q1320 HydrophobicContact CB-CB 4.35Å; E1315-Q1320 PolarHBondContact O-N 3.01Å; E1315-Q1320 VanDerWaalsContact O-N 3.08Å; Q1318-Q1320 HydrophobicContact CB-CG 4.27Å; Q1318-Q1320 VanDerWaalsContact CB-NE2 3.27Å; Q1318-Q1320 PolarHBondContact O-N 3.21Å; Q1318-Q1320 VanDerWaalsContact O-N 3.12Å; Q1318-Q1320 VanDerWaalsContact OE1-NE2 3.08Å; Q1320-P1322 WeakPolarHBondContact O-CD 3.49Å
1321	I	53.8	Low	51.6	Low	86 Å²	86	86.6 Å²	86.6	44%	0.441	49%	0.488	S	S	.	.	S	Bend	trans	-110.1	115.4	173.3	-57.3	173.5	0	0	0	107.9	E1315 Y1316 D1319 V1323	E1315-I1321 HydrophobicContact CB-CD1 3.67Å; E1315-I1321 HydrophobicContact CB-CG1 3.97Å; E1315-I1321 HydrophobicContact CG-CD1 4.43Å; E1315-I1321 PolarHBondContact O-N 3.34Å; Y1316-I1321 HydrophobicContact CD1-CB 4.01Å; Y1316-I1321 HydrophobicContact CD1-CG2 4.2Å; Y1316-I1321 HydrophobicContact CE1-CB 3.89Å; Y1316-I1321 HydrophobicContact CE1-CD1 4.47Å; Y1316-I1321 HydrophobicContact CE1-CG2 3.59Å; Y1316-I1321 HydrophobicContact CE2-CD1 4.28Å; D1319-I1321 VanDerWaalsContact C-N 3.3Å; D1319-I1321 PolarHBondContact O-N 3.31Å; I1321-V1323 PolarHBondContact O-N 3.18Å; I1321-V1323 VanDerWaalsContact O-N 3.09Å
1322	P	51	Low	52	Low	102.8 Å²	102.8	94.8 Å²	94.8	67%	0.668	50%	0.501	S	S	*	.			trans	-65.2	120.5	-177.8	17.3	-22.4	0	0	0	111	Y1316 Q1320 K1324	Y1316-P1322 HydrophobicContact CD1-CG 4.27Å; Y1316-P1322 HydrophobicContact CD2-CG 4.22Å; Y1316-P1322 HydrophobicContact CE1-CG 3.66Å; Y1316-P1322 HydrophobicContact CE2-CG 3.59Å; Y1316-P1322 WeakPolarHBondContact OH-CG 3.26Å; Q1320-P1322 WeakPolarHBondContact O-CD 3.49Å; P1322-K1324 PolarHBondContact O-N 3.08Å; P1322-K1324 VanDerWaalsContact O-N 3.12Å
1323	V	51.5	Low	52.7	Low	78.8 Å²	78.8	97 Å²	97	48%	0.478	53%	0.53	S	S	.	.			trans	-72.4	110.2	177.4	-177.2	0	0	0	0	109.1	Y1316 I1321 P1325 I1342	Y1316-V1323 HydrophobicContact CD1-CG2 3.72Å; Y1316-V1323 HydrophobicContact CE1-CG2 4.22Å; Y1316-V1323 HydrophobicContact CG-CG2 4.46Å; I1321-V1323 PolarHBondContact O-N 3.18Å; I1321-V1323 VanDerWaalsContact O-N 3.09Å; V1323-P1325 VanDerWaalsContact O-CD 3.32Å; V1323-P1325 WeakPolarHBondContact O-CD 3.4Å; V1323-I1342 HydrophobicContact CG1-CD1 3.95Å; V1323-I1342 HydrophobicContact CG1-CG1 3.77Å; V1323-I1342 HydrophobicContact CG2-CD1 3.97Å
1324	K	54	Low	53.3	Low	190.4 Å²	190.4	100 Å²	100	83%	0.828	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-69.5	124.5	168.2	-124.3	175.7	-177.4	171.7	0	108.3	P1322	P1322-K1324 PolarHBondContact O-N 3.08Å; P1322-K1324 VanDerWaalsContact O-N 3.12Å
1325	P	55.2	Low	53.8	Low	108.6 Å²	108.6	102.3 Å²	102.3	71%	0.705	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-60.5	132.1	176.8	23.5	-31.9	0	0	0	109.4	V1323	V1323-P1325 VanDerWaalsContact O-CD 3.32Å; V1323-P1325 WeakPolarHBondContact O-CD 3.4Å
1326	P	54.2	Low	53.8	Low	40.8 Å²	40.8	102.6 Å²	102.6	27%	0.265	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-61.7	145.1	178.6	24.9	-33.3	0	0	0	110.3	E1330 C1331 P1343	P1326-E1330 WeakPolarHBondContact CA-OE2 3.28Å; P1326-E1330 HydrophobicContact CB-CB 4.24Å; P1326-E1330 WeakPolarHBondContact CB-OE2 3.39Å; P1326-C1331 VanDerWaalsContact CG-SG 3.54Å; P1326-C1331 WeakPolarHBondContact CG-SG 3.37Å; P1326-P1343 HydrophobicContact CB-CG 4.38Å; P1326-P1343 HydrophobicContact CG-CG 4.45Å
1327	K	57.8	Low	53.7	Low	141 Å²	141	100 Å²	100	61%	0.613	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-64.1	151	176.5	-62.9	-178.3	-170.1	142.5	0	109.2	S1329 E1330 C1331	K1327-S1329 WeakPolarHBondContact CB-OG 3.33Å; K1327-S1329 PolarHBondContact O-N 3.04Å; K1327-S1329 VanDerWaalsContact O-N 3.1Å; K1327-E1330 HydrophobicContact CB-CG 4.15Å; K1327-E1330 WeakPolarHBondContact CD-OE1 3.32Å; K1327-E1330 WeakPolarHBondContact CG-OE1 3.44Å; K1327-E1330 PolarHBondContact N-OE2 3.1Å; K1327-E1330 VanDerWaalsContact N-OE2 3.16Å; K1327-E1330 IonicContact NZ-OE1 2.73Å; K1327-E1330 PolarHBondContact NZ-OE1 3.17Å; K1327-E1330 WeakPolarHBondContact O-CA 3.46Å; K1327-E1330 WeakPolarHBondContact O-CB 3.35Å; K1327-E1330 PolarHBondContact O-N 3.02Å; K1327-C1331 PolarHBondContact O-N 3.08Å
1328	A	54	Low	53.6	Low	94 Å²	94	100.1 Å²	100.1	78%	0.777	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-27.2	177.6	0	0	0	0	0	113.4	E1330 C1331	A1328-E1330 VanDerWaalsContact C-N 3.33Å; A1328-E1330 PolarHBondContact O-N 2.8Å; A1328-C1331 PolarHBondContact O-N 2.96Å
1329	S	59.7	Low	53.2	Low	92.2 Å²	92.2	100 Å²	100	65%	0.645	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-27.1	172.6	53.7	0	0	0	0	114.5	K1327	K1327-S1329 WeakPolarHBondContact CB-OG 3.33Å; K1327-S1329 PolarHBondContact O-N 3.04Å; K1327-S1329 VanDerWaalsContact O-N 3.1Å
1330	E	55.8	Low	53.4	Low	88.2 Å²	88.2	95.1 Å²	95.1	41%	0.412	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-14.9	-176.3	-66.6	161.2	-177.3	0	0	112.4	P1326 K1327 A1328 R1332 H1334 Y1345	P1326-E1330 WeakPolarHBondContact CA-OE2 3.28Å; P1326-E1330 HydrophobicContact CB-CB 4.24Å; P1326-E1330 WeakPolarHBondContact CB-OE2 3.39Å; K1327-E1330 HydrophobicContact CB-CG 4.15Å; K1327-E1330 WeakPolarHBondContact CD-OE1 3.32Å; K1327-E1330 WeakPolarHBondContact CG-OE1 3.44Å; K1327-E1330 PolarHBondContact N-OE2 3.1Å; K1327-E1330 VanDerWaalsContact N-OE2 3.16Å; K1327-E1330 IonicContact NZ-OE1 2.73Å; K1327-E1330 PolarHBondContact NZ-OE1 3.17Å; K1327-E1330 WeakPolarHBondContact O-CA 3.46Å; K1327-E1330 WeakPolarHBondContact O-CB 3.35Å; K1327-E1330 PolarHBondContact O-N 3.02Å; A1328-E1330 VanDerWaalsContact C-N 3.33Å; A1328-E1330 PolarHBondContact O-N 2.8Å; E1330-R1332 VanDerWaalsContact C-N 3.31Å; E1330-R1332 PolarHBondContact O-N 3.48Å; E1330-H1334 PolarHBondContact O-CD2 3.14Å; E1330-Y1345 PolarHBondContact O-OH 2.87Å
1331	C	51.6	Low	53.5	Low	34.8 Å²	34.8	90.6 Å²	90.6	24%	0.235	52%	0.518	C	S	.	.	H	α-helix	trans	-89.9	-11.1	179.6	-63.9	0	0	0	0	114.1	P1326 K1327 A1328 G1333 H1334 L1336	P1326-C1331 VanDerWaalsContact CG-SG 3.54Å; P1326-C1331 WeakPolarHBondContact CG-SG 3.37Å; K1327-C1331 PolarHBondContact O-N 3.08Å; A1328-C1331 PolarHBondContact O-N 2.96Å; C1331-G1333 PolarHBondContact O-N 3.01Å; C1331-G1333 VanDerWaalsContact O-N 3.15Å; C1331-H1334 PolarHBondContact O-N 3.01Å; C1331-L1336 HydrophobicContact CB-CD2 4.33Å
1332	R	47.9	Very low	53.7	Low	227.8 Å²	227.8	87.8 Å²	87.8	86%	0.86	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	108.5	-173.7	-134.1	179.9	-177.7	174	1.5	110.8	E1330	E1330-R1332 VanDerWaalsContact C-N 3.31Å; E1330-R1332 PolarHBondContact O-N 3.48Å
1333	G	58.4	Low	54	Low	79.2 Å²	79.2	83.2 Å²	83.2	82%	0.816	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.5	0	176.8	0	0	0	0	0	115.6	C1331	C1331-G1333 PolarHBondContact O-N 3.01Å; C1331-G1333 VanDerWaalsContact O-N 3.15Å
1334	H	54.6	Low	54	Low	99.4 Å²	99.4	82.6 Å²	82.6	46%	0.46	47%	0.467	S	S	.	.			trans	-108	132.8	-178.9	-65.4	-64.6	0	0	0	112.4	E1330 C1331 L1336 P1343 Y1345	E1330-H1334 PolarHBondContact O-CD2 3.14Å; C1331-H1334 PolarHBondContact O-N 3.01Å; H1334-L1336 PolarHBondContact O-N 3.1Å; H1334-P1343 HydrophobicContact CB-CB 4.4Å; H1334-Y1345 HydrophobicContact CB-CD1 4.27Å; H1334-Y1345 HydrophobicContact CB-CE1 3.93Å; H1334-Y1345 AromaticContact CD2-CE1 3.61Å; H1334-Y1345 VanDerWaalsContact CD2-CE1 3.48Å; H1334-Y1345 WeakPolarHBondContact CD2-CE1 3.32Å; H1334-Y1345 AromaticContact CE1-CD1 3.94Å; H1334-Y1345 AromaticContact CE1-CE1 3.88Å; H1334-Y1345 AromaticContact CG-CD1 3.87Å; H1334-Y1345 AromaticContact CG-CE1 3.52Å; H1334-Y1345 VanDerWaalsContact CG-CE1 3.43Å; H1334-Y1345 AromaticContact ND1-CD1 3.69Å; H1334-Y1345 AromaticContact ND1-CE1 3.68Å; H1334-Y1345 AromaticContact NE2-CE1 3.78Å
1335	V	56.2	Low	54.2	Low	100.6 Å²	100.6	79.5 Å²	79.5	61%	0.61	45%	0.451	S	S	*	.			trans	-68.5	115.8	174.1	-178.7	0	0	0	0	108.9	W1310 L1344	W1310-V1335 HydrophobicContact CH2-CG1 4.33Å; V1335-L1344 HydrophobicContact CB-CD1 4.05Å; V1335-L1344 HydrophobicContact CG1-CD1 3.79Å; V1335-L1344 HydrophobicContact CG1-CG 4.41Å; V1335-L1344 WeakPolarHBondContact O-CG 3.33Å; V1335-L1344 PolarHBondContact O-N 3.25Å
1336	L	53.9	Low	54	Low	71.4 Å²	71.4	78.5 Å²	78.5	37%	0.374	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-80.1	143	174.6	-55.9	-178.5	0	0	0	110.2	C1331 H1334 G1341 P1343	C1331-L1336 HydrophobicContact CB-CD2 4.33Å; H1334-L1336 PolarHBondContact O-N 3.1Å; L1336-G1341 WeakPolarHBondContact CD2-O 3.48Å; L1336-P1343 HydrophobicContact CD2-CB 4.15Å; L1336-P1343 HydrophobicContact CD2-CG 3.69Å
1337	H	51.1	Low	53.7	Low	14.2 Å²	14.2	79.2 Å²	79.2	7%	0.066	44%	0.441	C	S	.	.			trans	-68.1	122.8	175.9	-175.3	-85.6	0	0	0	110.4	W1310 V1312 I1339 T1340 G1341 I1342 L1344	W1310-H1337 WeakPolarHBondContact CB-NE2 3.41Å; W1310-H1337 AromaticContact CE3-CD2 3.38Å; W1310-H1337 AromaticContact CE3-NE2 3.65Å; W1310-H1337 AromaticContact CG-NE2 4Å; W1310-H1337 HydrophobicContact CZ3-CB 4.43Å; W1310-H1337 AromaticContact CZ3-CD2 3.96Å; W1310-H1337 PolarHBondContact O-CD2 2.99Å; W1310-H1337 PolarHBondContact O-NE2 3.23Å; V1312-H1337 VanDerWaalsContact CG2-CE1 3.44Å; V1312-H1337 WeakPolarHBondContact CG2-CE1 3.32Å; V1312-H1337 WeakPolarHBondContact CG2-NE2 3.34Å; H1337-I1339 VanDerWaalsContact C-N 3.26Å; H1337-I1339 PolarHBondContact ND1-N 3.14Å; H1337-I1339 PolarHBondContact O-N 3.03Å; H1337-I1339 VanDerWaalsContact O-N 3.13Å; H1337-T1340 WeakPolarHBondContact CB-OG1 3.3Å; H1337-T1340 PolarHBondContact ND1-N 3.1Å; H1337-T1340 PolarHBondContact ND1-OG1 3.15Å; H1337-T1340 PolarHBondContact O-N 2.91Å; H1337-T1340 VanDerWaalsContact O-N 3.11Å; H1337-G1341 VanDerWaalsContact O-CA 3.31Å; H1337-G1341 WeakPolarHBondContact O-CA 3.38Å; H1337-G1341 PolarHBondContact O-N 3.23Å; H1337-I1342 VanDerWaalsContact CB-O 3.3Å; H1337-I1342 WeakPolarHBondContact CB-O 3.41Å; H1337-I1342 PolarHBondContact N-O 3.17Å; H1337-L1344 HydrophobicContact CB-CD2 3.95Å
1338	P	46.2	Very low	52.9	Low	79.4 Å²	79.4	76 Å²	76	52%	0.516	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.3	-165.9	21.2	-28.9	0	0	0	115.3	K1227 W1310	K1227-P1338 HydrophobicContact CD-CB 4.31Å; K1227-P1338 PolarHBondContact NZ-O 3.45Å; W1310-P1338 HydrophobicContact CD2-CG 3.59Å; W1310-P1338 VanDerWaalsContact CD2-CG 3.49Å; W1310-P1338 HydrophobicContact CE3-CG 3.87Å; W1310-P1338 HydrophobicContact CG-CG 4.01Å; W1310-P1338 HydrophobicContact CH2-CG 4.01Å; W1310-P1338 HydrophobicContact CZ2-CG 3.99Å; W1310-P1338 HydrophobicContact CZ3-CG 3.87Å
1339	I	45.6	Very low	52.2	Low	101 Å²	101	79.3 Å²	79.3	52%	0.518	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-27.7	178.2	-49.5	176.3	0	0	0	111.9	I1224 L1317 H1337	I1224-I1339 HydrophobicContact CD1-CG2 3.96Å; I1224-I1339 HydrophobicContact CG1-CG2 4.46Å; I1224-I1339 HydrophobicContact CG2-CD1 4.33Å; L1317-I1339 HydrophobicContact CD2-CB 4.48Å; L1317-I1339 HydrophobicContact CD2-CG2 4.03Å; H1337-I1339 VanDerWaalsContact C-N 3.26Å; H1337-I1339 PolarHBondContact ND1-N 3.14Å; H1337-I1339 PolarHBondContact O-N 3.03Å; H1337-I1339 VanDerWaalsContact O-N 3.13Å
1340	T	54.8	Low	51	Low	38.4 Å²	38.4	85.5 Å²	85.5	24%	0.236	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119	-11.2	-171.9	56.8	0	0	0	0	114.4	V1312 L1317 H1337 I1342	V1312-T1340 HydrophobicContact CG1-CG2 3.8Å; V1312-T1340 HydrophobicContact CG2-CG2 4.25Å; L1317-T1340 HydrophobicContact CD2-CG2 3.92Å; H1337-T1340 WeakPolarHBondContact CB-OG1 3.3Å; H1337-T1340 PolarHBondContact ND1-N 3.1Å; H1337-T1340 PolarHBondContact ND1-OG1 3.15Å; H1337-T1340 PolarHBondContact O-N 2.91Å; H1337-T1340 VanDerWaalsContact O-N 3.11Å; T1340-I1342 PolarHBondContact O-N 3.1Å
1341	G	56.1	Low	49.8	Very low	34.4 Å²	34.4	88.5 Å²	88.5	36%	0.355	46%	0.46	S	S	.	.			trans	70.2	-4.5	-176.5	0	0	0	0	0	114.8	L1336 H1337	L1336-G1341 WeakPolarHBondContact CD2-O 3.48Å; H1337-G1341 VanDerWaalsContact O-CA 3.31Å; H1337-G1341 WeakPolarHBondContact O-CA 3.38Å; H1337-G1341 PolarHBondContact O-N 3.23Å
1342	I	57.5	Low	49	Very low	27 Å²	27	91.1 Å²	91.1	14%	0.138	48%	0.476	C	S	.	.			trans	-74.2	132.1	179.9	-58.8	173	0	0	0	109.6	Y1316 V1323 H1337 T1340 L1344 L1346	Y1316-I1342 HydrophobicContact CD1-CD1 3.81Å; Y1316-I1342 HydrophobicContact CD2-CD1 3.84Å; Y1316-I1342 HydrophobicContact CE1-CD1 4.01Å; Y1316-I1342 HydrophobicContact CE2-CD1 4.04Å; Y1316-I1342 HydrophobicContact CG-CD1 3.83Å; V1323-I1342 HydrophobicContact CG1-CD1 3.95Å; V1323-I1342 HydrophobicContact CG1-CG1 3.77Å; V1323-I1342 HydrophobicContact CG2-CD1 3.97Å; H1337-I1342 VanDerWaalsContact CB-O 3.3Å; H1337-I1342 WeakPolarHBondContact CB-O 3.41Å; H1337-I1342 PolarHBondContact N-O 3.17Å; T1340-I1342 PolarHBondContact O-N 3.1Å; I1342-L1344 PolarHBondContact O-N 3.25Å; I1342-L1346 HydrophobicContact CG2-CB 3.6Å; I1342-L1346 VanDerWaalsContact CG2-CB 3.42Å; I1342-L1346 HydrophobicContact CG2-CD1 4.2Å; I1342-L1346 HydrophobicContact CG2-CG 4.49Å
1343	P	57.3	Low	48.1	Very low	5.4 Å²	5.4	90.9 Å²	90.9	4%	0.035	48%	0.477	C	S	.	.	B	Isolated β-bridge	trans	-55.4	133.9	171.3	-23.9	31.4	0	0	0	112.3	P1326 H1334 L1336 Y1345 L1346	P1326-P1343 HydrophobicContact CB-CG 4.38Å; P1326-P1343 HydrophobicContact CG-CG 4.45Å; H1334-P1343 HydrophobicContact CB-CB 4.4Å; L1336-P1343 HydrophobicContact CD2-CB 4.15Å; L1336-P1343 HydrophobicContact CD2-CG 3.69Å; P1343-Y1345 HydrophobicContact CB-CD1 3.55Å; P1343-Y1345 HydrophobicContact CB-CE1 3.16Å; P1343-Y1345 HydrophobicContact CB-CE2 4.44Å; P1343-Y1345 HydrophobicContact CB-CG 4.36Å; P1343-Y1345 HydrophobicContact CG-CE1 3.95Å; P1343-Y1345 PolarHBondContact O-N 3.21Å; P1343-L1346 HydrophobicContact CB-CD1 4.5Å; P1343-L1346 HydrophobicContact CG-CD1 4.26Å; P1343-L1346 PolarHBondContact O-N 3.19Å
1344	L	52.6	Low	46.9	Very low	66.4 Å²	66.4	93 Å²	93	35%	0.348	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-57.4	-20.8	-173.8	-75.8	175.3	0	0	0	115	W1310 V1335 H1337 I1342 L1346 N1347	W1310-L1344 HydrophobicContact CD2-CD2 4.42Å; W1310-L1344 HydrophobicContact CE3-CD1 4.4Å; W1310-L1344 HydrophobicContact CE3-CD2 3.5Å; W1310-L1344 VanDerWaalsContact CE3-CD2 3.5Å; W1310-L1344 HydrophobicContact CE3-CG 4.35Å; W1310-L1344 HydrophobicContact CH2-CD1 3.62Å; W1310-L1344 HydrophobicContact CH2-CD2 4.24Å; W1310-L1344 HydrophobicContact CH2-CG 4.27Å; W1310-L1344 HydrophobicContact CZ2-CD1 4.4Å; W1310-L1344 HydrophobicContact CZ3-CD1 4.02Å; W1310-L1344 HydrophobicContact CZ3-CD2 3.39Å; W1310-L1344 HydrophobicContact CZ3-CG 3.74Å; V1335-L1344 HydrophobicContact CB-CD1 4.05Å; V1335-L1344 HydrophobicContact CG1-CD1 3.79Å; V1335-L1344 HydrophobicContact CG1-CG 4.41Å; V1335-L1344 WeakPolarHBondContact O-CG 3.33Å; V1335-L1344 PolarHBondContact O-N 3.25Å; H1337-L1344 HydrophobicContact CB-CD2 3.95Å; I1342-L1344 PolarHBondContact O-N 3.25Å; L1344-L1346 VanDerWaalsContact C-N 3.25Å; L1344-L1346 PolarHBondContact O-N 3.11Å; L1344-L1346 VanDerWaalsContact O-N 3.16Å; L1344-N1347 VanDerWaalsContact O-CB 3.24Å; L1344-N1347 WeakPolarHBondContact O-CB 3.35Å; L1344-N1347 PolarHBondContact O-N 2.76Å; L1344-N1347 VanDerWaalsContact O-N 3.13Å
1345	Y	56.8	Low	46.1	Very low	124.6 Å²	124.6	92.8 Å²	92.8	49%	0.489	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-75.3	-16.7	177.4	67.8	-98.9	0	0	0	114.2	E1330 H1334 P1343 N1347	E1330-Y1345 PolarHBondContact O-OH 2.87Å; H1334-Y1345 HydrophobicContact CB-CD1 4.27Å; H1334-Y1345 HydrophobicContact CB-CE1 3.93Å; H1334-Y1345 AromaticContact CD2-CE1 3.61Å; H1334-Y1345 VanDerWaalsContact CD2-CE1 3.48Å; H1334-Y1345 WeakPolarHBondContact CD2-CE1 3.32Å; H1334-Y1345 AromaticContact CE1-CD1 3.94Å; H1334-Y1345 AromaticContact CE1-CE1 3.88Å; H1334-Y1345 AromaticContact CG-CD1 3.87Å; H1334-Y1345 AromaticContact CG-CE1 3.52Å; H1334-Y1345 VanDerWaalsContact CG-CE1 3.43Å; H1334-Y1345 AromaticContact ND1-CD1 3.69Å; H1334-Y1345 AromaticContact ND1-CE1 3.68Å; H1334-Y1345 AromaticContact NE2-CE1 3.78Å; P1343-Y1345 HydrophobicContact CB-CD1 3.55Å; P1343-Y1345 HydrophobicContact CB-CE1 3.16Å; P1343-Y1345 HydrophobicContact CB-CE2 4.44Å; P1343-Y1345 HydrophobicContact CB-CG 4.36Å; P1343-Y1345 HydrophobicContact CG-CE1 3.95Å; P1343-Y1345 PolarHBondContact O-N 3.21Å; Y1345-N1347 VanDerWaalsContact C-N 3.27Å; Y1345-N1347 PolarHBondContact O-N 3.25Å
1346	L	51.5	Low	45.6	Very low	89.2 Å²	89.2	90.9 Å²	90.9	47%	0.467	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-87.5	-10.5	177.6	-76.9	170	0	0	0	113.3	I1342 P1343 L1344 P1348	I1342-L1346 HydrophobicContact CG2-CB 3.6Å; I1342-L1346 VanDerWaalsContact CG2-CB 3.42Å; I1342-L1346 HydrophobicContact CG2-CD1 4.2Å; I1342-L1346 HydrophobicContact CG2-CG 4.49Å; P1343-L1346 HydrophobicContact CB-CD1 4.5Å; P1343-L1346 HydrophobicContact CG-CD1 4.26Å; P1343-L1346 PolarHBondContact O-N 3.19Å; L1344-L1346 VanDerWaalsContact C-N 3.25Å; L1344-L1346 PolarHBondContact O-N 3.11Å; L1344-L1346 VanDerWaalsContact O-N 3.16Å; L1346-P1348 WeakPolarHBondContact O-CD 3.35Å; L1346-P1348 WeakPolarHBondContact O-CG 3.45Å
1347	N	47.4	Very low	45.4	Very low	55.4 Å²	55.4	91.1 Å²	91.1	30%	0.296	47%	0.465	S	S	.	.	S	Bend	trans	-62.4	105.4	165.4	-142.2	17.3	0	0	0	111.5	G1311 C1313 L1344 Y1345 K1349	G1311-N1347 VanDerWaalsContact C-ND2 3.32Å; G1311-N1347 VanDerWaalsContact O-CG 3.24Å; G1311-N1347 PolarHBondContact O-ND2 3.04Å; G1311-N1347 PolarHBondContact O-OD1 3.21Å; C1313-N1347 PolarHBondContact N-OD1 3.3Å; C1313-N1347 VanDerWaalsContact N-OD1 3.1Å; L1344-N1347 VanDerWaalsContact O-CB 3.24Å; L1344-N1347 WeakPolarHBondContact O-CB 3.35Å; L1344-N1347 PolarHBondContact O-N 2.76Å; L1344-N1347 VanDerWaalsContact O-N 3.13Å; Y1345-N1347 VanDerWaalsContact C-N 3.27Å; Y1345-N1347 PolarHBondContact O-N 3.25Å; N1347-K1349 PolarHBondContact O-N 2.93Å
1348	P	42.9	Very low	45.8	Very low	74 Å²	74	95.9 Å²	95.9	48%	0.481	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-62.3	139.8	-172.6	-3.8	7.2	0	0	0	111.9	C1313 Y1316 L1346 R1350	C1313-P1348 HydrophobicContact CB-CB 4.49Å; C1313-P1348 HydrophobicContact CB-CG 4.17Å; C1313-P1348 VanDerWaalsContact SG-CB 3.57Å; C1313-P1348 VanDerWaalsContact SG-CD 3.55Å; Y1316-P1348 HydrophobicContact CE2-CG 3.82Å; Y1316-P1348 VanDerWaalsContact CE2-CG 3.5Å; Y1316-P1348 WeakPolarHBondContact OH-CD 3.48Å; Y1316-P1348 WeakPolarHBondContact OH-CG 3.2Å; L1346-P1348 WeakPolarHBondContact O-CD 3.35Å; L1346-P1348 WeakPolarHBondContact O-CG 3.45Å; P1348-R1350 PolarHBondContact O-N 3.04Å
1349	K	38.4	Very low	46.6	Very low	162.4 Å²	162.4	95.3 Å²	95.3	71%	0.706	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-65.2	137.6	-176.8	-65.3	176.3	-178.7	176.8	0	109.8	N1347 N1351 S1475 N1476	N1347-K1349 PolarHBondContact O-N 2.93Å; K1349-N1351 PolarHBondContact O-N 3.04Å; K1349-N1351 VanDerWaalsContact O-N 3.08Å; K1349-S1475 PolarHBondContact NZ-OG 3.17Å; K1349-N1476 PolarHBondContact NZ-OD1 3.49Å; K1349-N1476 VanDerWaalsContact NZ-OD1 3.13Å
1350	R	33.7	Very low	46.6	Very low	221.4 Å²	221.4	94.8 Å²	94.8	84%	0.835	48%	0.483	S	S	*	.			trans	-54	127.5	169	-75.6	-178.3	169	-154.1	-2.6	109.4	T1258 P1348 P1352	T1258-R1350 VanDerWaalsContact CG2-NH2 3.34Å; P1348-R1350 PolarHBondContact O-N 3.04Å; R1350-P1352 VanDerWaalsContact O-CD 3.24Å; R1350-P1352 WeakPolarHBondContact O-CD 3.37Å; R1350-P1352 VanDerWaalsContact O-N 3.07Å
1351	N	32.2	Very low	46.7	Very low	152 Å²	152	96.6 Å²	96.6	81%	0.813	50%	0.497	S	S	*	.			trans	-58.3	119.2	174	-78.3	-1.8	0	0	0	109.4	K1349 Y1353	K1349-N1351 PolarHBondContact O-N 3.04Å; K1349-N1351 VanDerWaalsContact O-N 3.08Å; N1351-Y1353 PolarHBondContact O-N 3.14Å
1352	P	32.8	Very low	47.2	Very low	88.6 Å²	88.6	97.8 Å²	97.8	58%	0.575	50%	0.5	S	S	*	.			trans	-66.8	135.3	176.5	27.1	-32.4	0	0	0	109.3	R1350 I1354	R1350-P1352 VanDerWaalsContact O-CD 3.24Å; R1350-P1352 WeakPolarHBondContact O-CD 3.37Å; R1350-P1352 VanDerWaalsContact O-N 3.07Å; P1352-I1354 VanDerWaalsContact C-N 3.27Å; P1352-I1354 HydrophobicContact CB-CD1 4.38Å; P1352-I1354 HydrophobicContact CB-CG1 4.09Å; P1352-I1354 HydrophobicContact CG-CD1 3.91Å; P1352-I1354 HydrophobicContact CG-CG1 4.07Å; P1352-I1354 PolarHBondContact O-N 3.19Å
1353	Y	29.8	Very low	47.2	Very low	225 Å²	225	101 Å²	101	88%	0.882	52%	0.517	S	S	*	.			trans	-73.7	98.9	175.2	-119.5	-94	0	0	0	108.7	N1351 I1355	N1351-Y1353 PolarHBondContact O-N 3.14Å; Y1353-I1355 HydrophobicContact CD1-CG1 4.47Å; Y1353-I1355 PolarHBondContact O-N 3.49Å
1354	I	33.1	Very low	47.4	Very low	122.8 Å²	122.8	105.5 Å²	105.5	63%	0.63	54%	0.54	S	S	*	.			trans	-99.3	113.4	176.2	-59.8	172.1	0	0	0	107	P1352 P1356	P1352-I1354 VanDerWaalsContact C-N 3.27Å; P1352-I1354 HydrophobicContact CB-CD1 4.38Å; P1352-I1354 HydrophobicContact CB-CG1 4.09Å; P1352-I1354 HydrophobicContact CG-CD1 3.91Å; P1352-I1354 HydrophobicContact CG-CG1 4.07Å; P1352-I1354 PolarHBondContact O-N 3.19Å; I1354-P1356 WeakPolarHBondContact O-CD 3.38Å
1355	I	37.5	Very low	48	Very low	94.6 Å²	94.6	107.3 Å²	107.3	49%	0.485	55%	0.547	S	S	.	.			trans	-73.9	122.6	168.4	-56.7	175.4	0	0	0	106.9	Y1353 V1359 L1360	Y1353-I1355 HydrophobicContact CD1-CG1 4.47Å; Y1353-I1355 PolarHBondContact O-N 3.49Å; I1355-V1359 HydrophobicContact CG2-CB 4.04Å; I1355-V1359 HydrophobicContact CG2-CG1 4.03Å; I1355-L1360 HydrophobicContact CB-CD2 4.27Å; I1355-L1360 HydrophobicContact CB-CG 4.26Å; I1355-L1360 HydrophobicContact CD1-CD2 4.29Å; I1355-L1360 HydrophobicContact CG2-CD2 3.82Å; I1355-L1360 HydrophobicContact CG2-CG 4.04Å
1356	P	47.2	Very low	48.2	Very low	61.8 Å²	61.8	107.1 Å²	107.1	40%	0.401	55%	0.551	S	S	.	*			trans	-60.3	143.7	179.1	-24	34.3	0	0	0	111.7	I1354 D1358 V1359 L1360	I1354-P1356 WeakPolarHBondContact O-CD 3.38Å; P1356-D1358 PolarHBondContact O-N 3.03Å; P1356-D1358 VanDerWaalsContact O-N 3.13Å; P1356-V1359 HydrophobicContact CB-CB 4.37Å; P1356-V1359 HydrophobicContact CB-CG2 4.22Å; P1356-V1359 HydrophobicContact CG-CG2 4.06Å; P1356-V1359 WeakPolarHBondContact O-CB 3.4Å; P1356-V1359 PolarHBondContact O-N 3.14Å; P1356-L1360 PolarHBondContact O-N 2.99Å; P1356-L1360 VanDerWaalsContact O-N 3.14Å
1357	P	48	Very low	48.3	Very low	74.6 Å²	74.6	106.4 Å²	106.4	48%	0.484	55%	0.55	S	S	.	*	H	α-helix	trans	-57.6	-34.7	-179.3	17.1	-23.7	0	0	0	112.1	V1359 L1360 C1361	P1357-V1359 VanDerWaalsContact C-N 3.26Å; P1357-V1359 PolarHBondContact O-N 3.11Å; P1357-L1360 CarbonylContact O-C 3.53Å; P1357-L1360 WeakPolarHBondContact O-CA 3.47Å; P1357-L1360 WeakPolarHBondContact O-CB 3.28Å; P1357-L1360 PolarHBondContact O-N 3.11Å; P1357-L1360 VanDerWaalsContact O-N 3.11Å; P1357-C1361 WeakPolarHBondContact O-CB 3.46Å; P1357-C1361 PolarHBondContact O-N 3.12Å; P1357-C1361 PolarHBondContact O-SG 2.94Å; P1357-C1361 VanDerWaalsContact O-SG 3.37Å
1358	D	61.3	Low	48.7	Very low	115.6 Å²	115.6	108.6 Å²	108.6	62%	0.618	56%	0.561	S	S	*	*	H	α-helix	trans	-62.1	-33.1	179	-36.3	-41.1	0	0	0	112	P1356 S1362	P1356-D1358 PolarHBondContact O-N 3.03Å; P1356-D1358 VanDerWaalsContact O-N 3.13Å; D1358-S1362 VanDerWaalsContact O-CB 3.22Å; D1358-S1362 WeakPolarHBondContact O-CB 3.39Å; D1358-S1362 PolarHBondContact O-N 3.05Å; D1358-S1362 PolarHBondContact O-OG 2.99Å
1359	V	61.7	Low	49.3	Very low	66.6 Å²	66.6	110.9 Å²	110.9	40%	0.404	56%	0.564	S	S	.	*	H	α-helix	trans	-74.5	-38.3	175.9	179.4	0	0	0	0	110.5	I1355 P1356 P1357 S1362 L1363	I1355-V1359 HydrophobicContact CG2-CB 4.04Å; I1355-V1359 HydrophobicContact CG2-CG1 4.03Å; P1356-V1359 HydrophobicContact CB-CB 4.37Å; P1356-V1359 HydrophobicContact CB-CG2 4.22Å; P1356-V1359 HydrophobicContact CG-CG2 4.06Å; P1356-V1359 WeakPolarHBondContact O-CB 3.4Å; P1356-V1359 PolarHBondContact O-N 3.14Å; P1357-V1359 VanDerWaalsContact C-N 3.26Å; P1357-V1359 PolarHBondContact O-N 3.11Å; V1359-S1362 PolarHBondContact O-N 3.09Å; V1359-L1363 HydrophobicContact CG1-CD1 4.2Å; V1359-L1363 WeakPolarHBondContact O-CB 3.35Å; V1359-L1363 PolarHBondContact O-N 3.17Å
1360	L	45.7	Very low	49.7	Very low	90 Å²	90	106.7 Å²	106.7	47%	0.471	56%	0.555	S	S	.	*	H	α-helix	trans	-66.2	-41.9	173.2	-71.7	170.9	0	0	0	111.7	I1355 P1356 P1357 S1362 L1363 N1364	I1355-L1360 HydrophobicContact CB-CD2 4.27Å; I1355-L1360 HydrophobicContact CB-CG 4.26Å; I1355-L1360 HydrophobicContact CD1-CD2 4.29Å; I1355-L1360 HydrophobicContact CG2-CD2 3.82Å; I1355-L1360 HydrophobicContact CG2-CG 4.04Å; P1356-L1360 PolarHBondContact O-N 2.99Å; P1356-L1360 VanDerWaalsContact O-N 3.14Å; P1357-L1360 CarbonylContact O-C 3.53Å; P1357-L1360 WeakPolarHBondContact O-CA 3.47Å; P1357-L1360 WeakPolarHBondContact O-CB 3.28Å; P1357-L1360 PolarHBondContact O-N 3.11Å; P1357-L1360 VanDerWaalsContact O-N 3.11Å; L1360-S1362 VanDerWaalsContact C-N 3.34Å; L1360-S1362 PolarHBondContact O-N 2.68Å; L1360-L1363 PolarHBondContact O-N 3.22Å; L1360-N1364 VanDerWaalsContact O-CB 3.23Å; L1360-N1364 WeakPolarHBondContact O-CB 3.39Å; L1360-N1364 PolarHBondContact O-N 3.11Å
1361	C	57.7	Low	50.2	Low	77.6 Å²	77.6	99.8 Å²	99.8	52%	0.524	54%	0.54	S	S	.	.	H	α-helix	trans	-62.2	-43.2	173	-72.1	0	0	0	0	111.3	P1357 L1363 N1364 E1365	P1357-C1361 WeakPolarHBondContact O-CB 3.46Å; P1357-C1361 PolarHBondContact O-N 3.12Å; P1357-C1361 PolarHBondContact O-SG 2.94Å; P1357-C1361 VanDerWaalsContact O-SG 3.37Å; C1361-L1363 VanDerWaalsContact C-N 3.32Å; C1361-L1363 PolarHBondContact O-N 3.36Å; C1361-N1364 PolarHBondContact O-N 3.04Å; C1361-N1364 VanDerWaalsContact O-N 3.12Å; C1361-E1365 VanDerWaalsContact O-CB 3.29Å; C1361-E1365 WeakPolarHBondContact O-CB 3.2Å; C1361-E1365 WeakPolarHBondContact O-CG 3.35Å; C1361-E1365 PolarHBondContact O-N 3.15Å
1362	S	65.3	Low	50.7	Low	59.2 Å²	59.2	96.8 Å²	96.8	41%	0.414	53%	0.528	S	S	.	.	H	α-helix	trans	-63.1	-40.2	175.9	-61.5	0	0	0	0	112.5	D1358 V1359 L1360 N1364 E1365 Q1366	D1358-S1362 VanDerWaalsContact O-CB 3.22Å; D1358-S1362 WeakPolarHBondContact O-CB 3.39Å; D1358-S1362 PolarHBondContact O-N 3.05Å; D1358-S1362 PolarHBondContact O-OG 2.99Å; V1359-S1362 PolarHBondContact O-N 3.09Å; L1360-S1362 VanDerWaalsContact C-N 3.34Å; L1360-S1362 PolarHBondContact O-N 2.68Å; S1362-N1364 VanDerWaalsContact C-N 3.32Å; S1362-E1365 PolarHBondContact O-N 3.45Å; S1362-Q1366 WeakPolarHBondContact O-CB 3.38Å; S1362-Q1366 VanDerWaalsContact O-CG 3.25Å; S1362-Q1366 WeakPolarHBondContact O-CG 3.29Å; S1362-Q1366 PolarHBondContact O-N 3.04Å; S1362-Q1366 PolarHBondContact O-NE2 2.9Å
1363	L	58.1	Low	50.9	Low	94 Å²	94	98.7 Å²	98.7	49%	0.492	53%	0.533	S	S	.	.	H	α-helix	trans	-65.8	-41.3	174.8	-115.6	106.4	0	0	0	111.4	V1359 L1360 C1361 Q1366 T1367	V1359-L1363 HydrophobicContact CG1-CD1 4.2Å; V1359-L1363 WeakPolarHBondContact O-CB 3.35Å; V1359-L1363 PolarHBondContact O-N 3.17Å; L1360-L1363 PolarHBondContact O-N 3.22Å; C1361-L1363 VanDerWaalsContact C-N 3.32Å; C1361-L1363 PolarHBondContact O-N 3.36Å; L1363-Q1366 PolarHBondContact O-N 2.97Å; L1363-Q1366 VanDerWaalsContact O-N 3.15Å; L1363-T1367 PolarHBondContact O-N 3.13Å; L1363-T1367 PolarHBondContact O-OG1 3.04Å
1364	N	60.9	Low	51.3	Low	98.8 Å²	98.8	94.7 Å²	94.7	53%	0.528	53%	0.527	S	S	.	.	H	α-helix	trans	-69	-38.2	178.6	-158.3	56.8	0	0	0	111.8	L1360 C1361 S1362 Q1366 T1367 L1368	L1360-N1364 VanDerWaalsContact O-CB 3.23Å; L1360-N1364 WeakPolarHBondContact O-CB 3.39Å; L1360-N1364 PolarHBondContact O-N 3.11Å; C1361-N1364 PolarHBondContact O-N 3.04Å; C1361-N1364 VanDerWaalsContact O-N 3.12Å; S1362-N1364 VanDerWaalsContact C-N 3.32Å; N1364-Q1366 VanDerWaalsContact C-N 3.33Å; N1364-Q1366 PolarHBondContact O-N 3.42Å; N1364-T1367 VanDerWaalsContact CA-OG1 3.25Å; N1364-T1367 WeakPolarHBondContact CA-OG1 3.34Å; N1364-T1367 PolarHBondContact O-N 3.24Å; N1364-T1367 PolarHBondContact O-OG1 3.29Å; N1364-T1367 VanDerWaalsContact O-OG1 3.08Å; N1364-L1368 WeakPolarHBondContact ND2-CD1 3.44Å; N1364-L1368 VanDerWaalsContact O-CB 3.26Å; N1364-L1368 WeakPolarHBondContact O-CB 3.32Å; N1364-L1368 WeakPolarHBondContact O-CD1 3.32Å; N1364-L1368 VanDerWaalsContact O-CG 3.25Å; N1364-L1368 WeakPolarHBondContact O-CG 3.41Å; N1364-L1368 PolarHBondContact O-N 3.24Å
1365	E	66.3	Low	51.4	Low	105 Å²	105	95.6 Å²	95.6	49%	0.491	53%	0.533	S	S	.	.	H	α-helix	trans	-64.6	-38.5	170.3	-81.6	-169.6	-155.4	0	0	112.2	C1361 S1362 T1367 L1368 K1369	C1361-E1365 VanDerWaalsContact O-CB 3.29Å; C1361-E1365 WeakPolarHBondContact O-CB 3.2Å; C1361-E1365 WeakPolarHBondContact O-CG 3.35Å; C1361-E1365 PolarHBondContact O-N 3.15Å; S1362-E1365 PolarHBondContact O-N 3.45Å; E1365-T1367 VanDerWaalsContact C-N 3.33Å; E1365-L1368 PolarHBondContact O-N 3.44Å; E1365-K1369 HydrophobicContact CB-CD 4.45Å; E1365-K1369 VanDerWaalsContact O-CB 3.25Å; E1365-K1369 WeakPolarHBondContact O-CB 3.4Å; E1365-K1369 VanDerWaalsContact O-CD 3.28Å; E1365-K1369 WeakPolarHBondContact O-CD 3.35Å; E1365-K1369 WeakPolarHBondContact O-CG 3.37Å; E1365-K1369 PolarHBondContact O-N 3.04Å; E1365-K1369 WeakPolarHBondContact OE2-CE 3.13Å; E1365-K1369 IonicContact OE2-NZ 3.38Å; E1365-K1369 PolarHBondContact OE2-NZ 3.01Å
1366	Q	61.5	Low	51.1	Low	120.8 Å²	120.8	99.5 Å²	99.5	56%	0.564	55%	0.55	S	S	*	.	H	α-helix	trans	-67.4	-38.8	176.2	-76.9	173.9	21.5	0	0	111.9	S1362 L1363 N1364 K1369 S1370	S1362-Q1366 WeakPolarHBondContact O-CB 3.38Å; S1362-Q1366 VanDerWaalsContact O-CG 3.25Å; S1362-Q1366 WeakPolarHBondContact O-CG 3.29Å; S1362-Q1366 PolarHBondContact O-N 3.04Å; S1362-Q1366 PolarHBondContact O-NE2 2.9Å; L1363-Q1366 PolarHBondContact O-N 2.97Å; L1363-Q1366 VanDerWaalsContact O-N 3.15Å; N1364-Q1366 VanDerWaalsContact C-N 3.33Å; N1364-Q1366 PolarHBondContact O-N 3.42Å; Q1366-K1369 PolarHBondContact O-N 2.87Å; Q1366-S1370 VanDerWaalsContact O-CB 3.28Å; Q1366-S1370 WeakPolarHBondContact O-CB 3.35Å; Q1366-S1370 PolarHBondContact O-N 3.23Å; Q1366-S1370 PolarHBondContact O-OG 3.13Å
1367	T	53.5	Low	50.3	Low	74 Å²	74	104.7 Å²	104.7	45%	0.454	57%	0.57	S	S	.	*	H	α-helix	trans	-70.1	-37.5	174.5	41	0	0	0	0	112.5	L1363 N1364 E1365 S1370 S1371	L1363-T1367 PolarHBondContact O-N 3.13Å; L1363-T1367 PolarHBondContact O-OG1 3.04Å; N1364-T1367 VanDerWaalsContact CA-OG1 3.25Å; N1364-T1367 WeakPolarHBondContact CA-OG1 3.34Å; N1364-T1367 PolarHBondContact O-N 3.24Å; N1364-T1367 PolarHBondContact O-OG1 3.29Å; N1364-T1367 VanDerWaalsContact O-OG1 3.08Å; E1365-T1367 VanDerWaalsContact C-N 3.33Å; T1367-S1370 WeakPolarHBondContact CA-OG 3.29Å; T1367-S1370 CarbonylContact O-C 3.57Å; T1367-S1370 PolarHBondContact O-N 3.25Å; T1367-S1370 PolarHBondContact O-OG 3.08Å; T1367-S1370 VanDerWaalsContact O-OG 3.1Å; T1367-S1371 WeakPolarHBondContact O-CB 3.34Å; T1367-S1371 PolarHBondContact O-N 3.1Å; T1367-S1371 VanDerWaalsContact O-N 3.14Å; T1367-S1371 PolarHBondContact O-OG 3.14Å
1368	L	54.7	Low	49.5	Very low	101.2 Å²	101.2	108.8 Å²	108.8	53%	0.53	59%	0.588	S	S	.	*	H	α-helix	trans	-64.6	-42.3	172.5	-79.7	161.9	0	0	0	111.9	N1364 E1365 S1370 S1371 T1372	N1364-L1368 WeakPolarHBondContact ND2-CD1 3.44Å; N1364-L1368 VanDerWaalsContact O-CB 3.26Å; N1364-L1368 WeakPolarHBondContact O-CB 3.32Å; N1364-L1368 WeakPolarHBondContact O-CD1 3.32Å; N1364-L1368 VanDerWaalsContact O-CG 3.25Å; N1364-L1368 WeakPolarHBondContact O-CG 3.41Å; N1364-L1368 PolarHBondContact O-N 3.24Å; E1365-L1368 PolarHBondContact O-N 3.44Å; L1368-S1370 VanDerWaalsContact C-N 3.32Å; L1368-S1370 PolarHBondContact O-N 3.23Å; L1368-S1371 WeakPolarHBondContact O-CB 3.33Å; L1368-S1371 PolarHBondContact O-N 3.21Å; L1368-S1371 VanDerWaalsContact O-N 3.12Å; L1368-S1371 PolarHBondContact O-OG 2.94Å; L1368-T1372 WeakPolarHBondContact O-CB 3.46Å; L1368-T1372 WeakPolarHBondContact O-CG2 3.47Å; L1368-T1372 PolarHBondContact O-N 2.97Å; L1368-T1372 PolarHBondContact O-OG1 3.17Å
1369	K	55.4	Low	47.9	Very low	122.4 Å²	122.4	108.6 Å²	108.6	53%	0.532	60%	0.596	S	S	.	*	H	α-helix	trans	-68.4	-31.8	177.4	-73	166.4	-174	168.1	0	112.8	E1365 Q1366 S1371 T1372 N1373	E1365-K1369 HydrophobicContact CB-CD 4.45Å; E1365-K1369 VanDerWaalsContact O-CB 3.25Å; E1365-K1369 WeakPolarHBondContact O-CB 3.4Å; E1365-K1369 VanDerWaalsContact O-CD 3.28Å; E1365-K1369 WeakPolarHBondContact O-CD 3.35Å; E1365-K1369 WeakPolarHBondContact O-CG 3.37Å; E1365-K1369 PolarHBondContact O-N 3.04Å; E1365-K1369 WeakPolarHBondContact OE2-CE 3.13Å; E1365-K1369 IonicContact OE2-NZ 3.38Å; E1365-K1369 PolarHBondContact OE2-NZ 3.01Å; Q1366-K1369 PolarHBondContact O-N 2.87Å; K1369-S1371 VanDerWaalsContact C-N 3.32Å; K1369-S1371 PolarHBondContact O-N 3.3Å; K1369-T1372 WeakPolarHBondContact CA-OG1 3.32Å; K1369-T1372 PolarHBondContact O-OG1 2.99Å; K1369-N1373 WeakPolarHBondContact O-CB 3.43Å; K1369-N1373 PolarHBondContact O-N 2.92Å; K1369-N1373 VanDerWaalsContact O-N 3.1Å; K1369-N1373 PolarHBondContact O-ND2 3.41Å; K1369-N1373 PolarHBondContact O-OD1 3.21Å
1370	S	48.2	Very low	46.4	Very low	74.6 Å²	74.6	110.9 Å²	110.9	52%	0.522	62%	0.615	S	S	.	*	H	α-helix	trans	-75.9	-21.2	173.7	61.7	0	0	0	0	113.3	Q1366 T1367 L1368 N1374	Q1366-S1370 VanDerWaalsContact O-CB 3.28Å; Q1366-S1370 WeakPolarHBondContact O-CB 3.35Å; Q1366-S1370 PolarHBondContact O-N 3.23Å; Q1366-S1370 PolarHBondContact O-OG 3.13Å; T1367-S1370 WeakPolarHBondContact CA-OG 3.29Å; T1367-S1370 CarbonylContact O-C 3.57Å; T1367-S1370 PolarHBondContact O-N 3.25Å; T1367-S1370 PolarHBondContact O-OG 3.08Å; T1367-S1370 VanDerWaalsContact O-OG 3.1Å; L1368-S1370 VanDerWaalsContact C-N 3.32Å; L1368-S1370 PolarHBondContact O-N 3.23Å; S1370-N1374 PolarHBondContact O-ND2 3.24Å
1371	S	44	Very low	45.7	Very low	75.8 Å²	75.8	112 Å²	112	53%	0.53	63%	0.63	S	S	.	*	H	α-helix	trans	-83.9	-32.7	177.2	-40.8	0	0	0	0	112.7	T1367 L1368 K1369 N1373 N1374 D1375	T1367-S1371 WeakPolarHBondContact O-CB 3.34Å; T1367-S1371 PolarHBondContact O-N 3.1Å; T1367-S1371 VanDerWaalsContact O-N 3.14Å; T1367-S1371 PolarHBondContact O-OG 3.14Å; L1368-S1371 WeakPolarHBondContact O-CB 3.33Å; L1368-S1371 PolarHBondContact O-N 3.21Å; L1368-S1371 VanDerWaalsContact O-N 3.12Å; L1368-S1371 PolarHBondContact O-OG 2.94Å; K1369-S1371 VanDerWaalsContact C-N 3.32Å; K1369-S1371 PolarHBondContact O-N 3.3Å; S1371-N1373 VanDerWaalsContact C-N 3.29Å; S1371-N1373 PolarHBondContact O-N 3.18Å; S1371-N1373 VanDerWaalsContact O-N 3.12Å; S1371-N1374 PolarHBondContact O-N 3.01Å; S1371-D1375 PolarHBondContact O-N 2.83Å
1372	T	41.2	Very low	44.3	Very low	90.6 Å²	90.6	113.8 Å²	113.8	56%	0.556	64%	0.644	S	S	*	*	H	α-helix	trans	-81.8	-7.7	-177.1	47.5	0	0	0	0	114.8	L1368 K1369 N1374 D1375	L1368-T1372 WeakPolarHBondContact O-CB 3.46Å; L1368-T1372 WeakPolarHBondContact O-CG2 3.47Å; L1368-T1372 PolarHBondContact O-N 2.97Å; L1368-T1372 PolarHBondContact O-OG1 3.17Å; K1369-T1372 WeakPolarHBondContact CA-OG1 3.32Å; K1369-T1372 PolarHBondContact O-OG1 2.99Å; T1372-N1374 VanDerWaalsContact C-N 3.28Å; T1372-N1374 PolarHBondContact O-N 3.09Å; T1372-D1375 PolarHBondContact O-N 3.17Å
1373	N	38.4	Very low	42.8	Very low	127.8 Å²	127.8	116.4 Å²	116.4	68%	0.683	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	7.1	175.6	-78.2	-2.8	0	0	0	112.9	K1369 S1371	K1369-N1373 WeakPolarHBondContact O-CB 3.43Å; K1369-N1373 PolarHBondContact O-N 2.92Å; K1369-N1373 VanDerWaalsContact O-N 3.1Å; K1369-N1373 PolarHBondContact O-ND2 3.41Å; K1369-N1373 PolarHBondContact O-OD1 3.21Å; S1371-N1373 VanDerWaalsContact C-N 3.29Å; S1371-N1373 PolarHBondContact O-N 3.18Å; S1371-N1373 VanDerWaalsContact O-N 3.12Å
1374	N	37.3	Very low	41.5	Very low	140.4 Å²	140.4	119.9 Å²	119.9	75%	0.751	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-3.6	171.6	-77.3	-23.4	0	0	0	113.8	S1370 S1371 T1372 Q1376	S1370-N1374 PolarHBondContact O-ND2 3.24Å; S1371-N1374 PolarHBondContact O-N 3.01Å; T1372-N1374 VanDerWaalsContact C-N 3.28Å; T1372-N1374 PolarHBondContact O-N 3.09Å; N1374-Q1376 VanDerWaalsContact C-N 3.28Å; N1374-Q1376 PolarHBondContact O-N 3.01Å
1375	D	35.6	Very low	40.1	Very low	141.8 Å²	141.8	120.5 Å²	120.5	76%	0.758	68%	0.683	S	S	*	*			trans	-104.9	29.9	179.1	-68.4	-36.6	0	0	0	113.1	S1371 T1372	S1371-D1375 PolarHBondContact O-N 2.83Å; T1372-D1375 PolarHBondContact O-N 3.17Å
1376	Q	32	Very low	38.6	Very low	177.8 Å²	177.8	122 Å²	122	83%	0.831	69%	0.694	S	S	*	*			trans	-122.1	46.2	171.9	-74.2	-162.2	-3.8	0	0	113.3	N1374	N1374-Q1376 VanDerWaalsContact C-N 3.28Å; N1374-Q1376 PolarHBondContact O-N 3.01Å
1377	M	30.5	Very low	37.4	Very low	170.2 Å²	170.2	123.4 Å²	123.4	84%	0.838	71%	0.705	S	S	*	*	S	Bend	trans	-141.6	108.9	154.4	-81.3	-167.1	175.1	0	0	111.3
1378	N	29.5	Very low	36.5	Very low	159.6 Å²	159.6	127 Å²	127	85%	0.853	72%	0.721	S	S	*	*			trans	109.9	68.6	153.7	-70.2	-20.2	0	0	0	115.5
1379	S	27.7	Very low	35.7	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	73%	0.733	S	S	*	*			trans	-108.2	111.6	152.4	53.4	0	0	0	0	110.7
1380	S	30.8	Very low	34.6	Very low	113.4 Å²	113.4	126.9 Å²	126.9	79%	0.793	74%	0.738	S	S	*	*			trans	-152.8	139.3	145.1	-35.8	0	0	0	0	111.3
1381	S	31.5	Very low	34	Very low	114 Å²	114	132 Å²	132	80%	0.797	75%	0.751	S	S	*	*			trans	99.5	127.4	164.2	57.5	0	0	0	0	113.7
1382	S	28.7	Very low	33.5	Very low	116.4 Å²	116.4	137.4 Å²	137.4	81%	0.814	76%	0.764	S	S	*	*				-23.3	132.4	128.6	151.2	0	0	0	0	112.6
1383	S	32.2	Very low	33.1	Very low	112.8 Å²	112.8	142.5 Å²	142.5	79%	0.789	78%	0.779	S	S	*	*			trans	172.4	142.2	158.7	59.3	0	0	0	0	113
1384	H	30.7	Very low	32.7	Very low	167 Å²	167	143.6 Å²	143.6	77%	0.773	79%	0.785	S	S	*	*			trans	176.7	116.4	173	-144.3	5.4	0	0	0	114.1	D1386	H1384-D1386 IonicContact CE1-OD2 3.51Å; H1384-D1386 PolarHBondContact CE1-OD2 3.11Å; H1384-D1386 IonicContact ND1-OD2 3.71Å
1385	V	32.8	Very low	32.9	Very low	112.8 Å²	112.8	141.7 Å²	141.7	68%	0.684	78%	0.78	S	S	*	*			trans	51.2	118.9	136.5	-174.5	0	0	0	0	115.8
1386	D	34.3	Very low	32.6	Very low	134.8 Å²	134.8	142.3 Å²	142.3	72%	0.721	78%	0.783	S	S	*	*			trans	-128.4	151.4	131.9	-62	-58.8	0	0	0	115.3	H1384	H1384-D1386 IonicContact CE1-OD2 3.51Å; H1384-D1386 PolarHBondContact CE1-OD2 3.11Å; H1384-D1386 IonicContact ND1-OD2 3.71Å
1387	D	35.8	Very low	32.5	Very low	150 Å²	150	138.7 Å²	138.7	80%	0.802	78%	0.778	S	S	*	*			trans	147.2	138.7	146.5	-90.1	-29.3	0	0	0	117.4
1388	D	35.9	Very low	32.2	Very low	149.6 Å²	149.6	140.7 Å²	140.7	80%	0.8	78%	0.778	S	S	*	*			trans	96.6	142.5	148.6	-89.9	-27.4	0	0	0	120.7
1389	D	36.4	Very low	32.3	Very low	145.6 Å²	145.6	141.3 Å²	141.3	78%	0.779	78%	0.775	S	S	*	*			trans	80.6	99.6	149.7	-109.8	-11.6	0	0	0	120.5	K1391	D1389-K1391 IonicContact OD1-NZ 3.14Å; D1389-K1391 PolarHBondContact OD1-NZ 3.17Å; D1389-K1391 IonicContact OD2-NZ 2.74Å; D1389-K1391 PolarHBondContact OD2-NZ 3.12Å; D1389-K1391 VanDerWaalsContact OD2-NZ 3.14Å
1390	A	33.2	Very low	32.1	Very low	76 Å²	76	144 Å²	144	63%	0.628	78%	0.775	S	S	*	*			trans	45.9	123	131.4	0	0	0	0	0	120.9
1391	K	35.1	Very low	32	Very low	181.8 Å²	181.8	145.9 Å²	145.9	79%	0.79	78%	0.775	S	S	*	*				138.9	120.7	126.9	-82.3	160.7	-168.3	146.5	0	117.3	D1389	D1389-K1391 IonicContact OD1-NZ 3.14Å; D1389-K1391 PolarHBondContact OD1-NZ 3.17Å; D1389-K1391 IonicContact OD2-NZ 2.74Å; D1389-K1391 PolarHBondContact OD2-NZ 3.12Å; D1389-K1391 VanDerWaalsContact OD2-NZ 3.14Å
1392	K	33	Very low	31.9	Very low	189 Å²	189	146.1 Å²	146.1	82%	0.822	77%	0.771	S	S	*	*			trans	53.8	118.3	133.4	-70	179.8	176.1	180	0	120.3
1393	K	33.3	Very low	31.8	Very low	198.6 Å²	198.6	146.2 Å²	146.2	86%	0.863	77%	0.767	S	S	*	*				145	140.5	117.2	-88.7	177.1	178	-173.2	0	115.8
1394	N	31.4	Very low	31.7	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	77%	0.768	S	S	*	*			trans	-31.6	163.8	163.9	-92.7	26.9	0	0	0	116
1395	P	40.2	Very low	31.7	Very low	100.6 Å²	100.6	148.5 Å²	148.5	65%	0.653	77%	0.767	S	S	*	*			trans	-109.1	171.9	-163.2	40.7	-32.1	0	0	0	115
1396	D	30.3	Very low	31.6	Very low	154 Å²	154	149.9 Å²	149.9	82%	0.824	77%	0.771	S	S	*	*			trans	113.9	149.4	151.2	-65	-32.4	0	0	0	115.2
1397	S	29.3	Very low	31.4	Very low	101.8 Å²	101.8	150.6 Å²	150.6	71%	0.712	77%	0.77	S	S	*	*			trans	98.4	120.2	160.1	161.8	0	0	0	0	117.2
1398	Y	25.1	Very low	31.2	Very low	213.2 Å²	213.2	150.1 Å²	150.1	84%	0.836	77%	0.768	S	S	*	*			trans	-27.2	143.7	156.4	-61.8	-93.3	0	0	0	114
1399	H	29.9	Very low	31	Very low	171.8 Å²	171.8	149.7 Å²	149.7	80%	0.795	77%	0.765	S	S	*	*				-153.7	131.5	123.3	-108.7	-64	0	0	0	110.1
1400	E	24.5	Very low	30.9	Very low	170.6 Å²	170.6	149.6 Å²	149.6	80%	0.797	77%	0.765	S	S	*	*			trans	-51.8	161.9	160	-137.1	175.4	177.4	0	0	112.4
1401	I	28	Very low	30.8	Very low	152 Å²	152	150.2 Å²	150.2	78%	0.779	77%	0.765	S	S	*	*			trans	-133.1	114.5	165.7	-60.1	174.2	0	0	0	112.2
1402	T	29.6	Very low	30.7	Very low	119 Å²	119	149.3 Å²	149.3	73%	0.73	77%	0.765	S	S	*	*			trans	-123.4	149.9	157.6	-27.6	0	0	0	0	112.9
1403	V	27.8	Very low	30.7	Very low	118.6 Å²	118.6	146.7 Å²	146.7	72%	0.719	76%	0.76	S	S	*	*			trans	2.9	126.6	158.7	173.3	0	0	0	0	114.9
1404	N	30.2	Very low	30.6	Very low	153 Å²	153	142.9 Å²	142.9	82%	0.818	75%	0.749	S	S	*	*				-148.2	144.3	124.5	-96.3	-32.5	0	0	0	110.6
1405	K	29	Very low	30.6	Very low	173.8 Å²	173.8	141.9 Å²	141.9	76%	0.756	74%	0.744	S	S	*	*			trans	-96.4	147.6	132.6	-74.7	-178.2	171.4	-167.7	0	111.7	E1407	K1405-E1407 IonicContact NZ-OE1 2.73Å; K1405-E1407 PolarHBondContact NZ-OE1 3.16Å
1406	N	30.9	Very low	30.2	Very low	143.2 Å²	143.2	145.5 Å²	145.5	77%	0.766	75%	0.749	S	S	*	*			trans	167.3	111.3	143.4	-83.7	6	0	0	0	107.7
1407	E	29.6	Very low	30.3	Very low	150.2 Å²	150.2	145.7 Å²	145.7	70%	0.702	74%	0.743	S	S	*	*				90.1	144.4	66.9	-72.5	175.4	175.8	0	0	111	K1405	K1405-E1407 IonicContact NZ-OE1 2.73Å; K1405-E1407 PolarHBondContact NZ-OE1 3.16Å
1408	N	32.5	Very low	30.4	Very low	139.6 Å²	139.6	148.1 Å²	148.1	75%	0.747	74%	0.743	S	S	*	*			trans	102.6	133.8	147	-67.9	-7.2	0	0	0	114.2
1409	D	31.9	Very low	30.7	Very low	139.4 Å²	139.4	144.2 Å²	144.2	75%	0.745	74%	0.737	S	S	*	*				149.9	145.4	68.3	-72.5	-32.7	0	0	0	111.4
1410	D	33.9	Very low	30.8	Very low	145 Å²	145	144.6 Å²	144.6	78%	0.775	74%	0.736	S	S	*	*				-148.5	150.9	80.4	-96.1	-30.9	0	0	0	114.1	M1412	D1410-M1412 PolarHBondContact O-N 2.86Å
1411	S	30.7	Very low	31.1	Very low	88.4 Å²	88.4	143.2 Å²	143.2	62%	0.618	73%	0.732	S	S	*	*				109.1	143.1	115.8	85.5	0	0	0	0	113.7
1412	M	34.3	Very low	31.2	Very low	163 Å²	163	142.3 Å²	142.3	80%	0.803	73%	0.729	S	S	*	*			trans	151.3	125.8	151.6	-72	-49.6	157.2	0	0	111.7	D1410	D1410-M1412 PolarHBondContact O-N 2.86Å
1413	N	31.9	Very low	31.3	Very low	134.6 Å²	134.6	144.7 Å²	144.7	72%	0.72	73%	0.732	S	S	*	*			cis	96.1	144.5	14.6	-155.7	8.3	0	0	0	112.3
1414	N	30.7	Very low	31.5	Very low	118.4 Å²	118.4	145.7 Å²	145.7	63%	0.633	73%	0.733	S	S	*	*			trans	-134.9	138.6	163.5	-78.5	-53.6	0	0	0	113.5
1415	N	31.4	Very low	31.6	Very low	130.4 Å²	130.4	145 Å²	145	70%	0.697	73%	0.729	S	S	*	*				96	125.5	126.9	-75.4	-43.9	0	0	0	115.5	K1417	N1415-K1417 PolarHBondContact O-N 3.3Å
1416	F	31.8	Very low	31.7	Very low	174.6 Å²	174.6	145 Å²	145	77%	0.766	73%	0.732	S	S	*	*				-134.8	124.5	114.5	-90.2	-85.9	0	0	0	110.5
1417	K	33.3	Very low	31.9	Very low	159.2 Å²	159.2	145.5 Å²	145.5	69%	0.692	73%	0.734	S	S	*	*				62	127.1	99.3	-75.4	-177.1	178.6	-152.2	0	113.2	N1415 N1419	N1415-K1417 PolarHBondContact O-N 3.3Å; K1417-N1419 PolarHBondContact O-N 3.01Å
1418	E	30.5	Very low	31.9	Very low	152.8 Å²	152.8	145.8 Å²	145.8	71%	0.714	74%	0.735	S	S	*	*			cis	-136	148.2	40	-113.1	170.8	166.5	0	0	108
1419	N	32.2	Very low	31.9	Very low	131.4 Å²	131.4	146.9 Å²	146.9	70%	0.703	74%	0.735	S	S	*	*			trans	106.9	124.1	157.4	-75.1	-53.8	0	0	0	115.6	K1417	K1417-N1419 PolarHBondContact O-N 3.01Å
1420	K	31.3	Very low	31.9	Very low	180.2 Å²	180.2	146.9 Å²	146.9	78%	0.783	73%	0.731	S	S	*	*				171.2	148	114.5	-92.7	176	-178.5	-179	0	112.4	D1422	K1420-D1422 PolarHBondContact O-N 3.01Å
1421	I	31.1	Very low	31.7	Very low	139.4 Å²	139.4	145.4 Å²	145.4	72%	0.715	73%	0.73	S	S	*	*			trans	52.5	114.5	135.8	-62.4	166.5	0	0	0	111.9	L1424	I1421-L1424 HydrophobicContact CD1-CD1 4.17Å; I1421-L1424 HydrophobicContact CG1-CD1 4.4Å
1422	D	30.8	Very low	31.6	Very low	133.6 Å²	133.6	147.5 Å²	147.5	71%	0.714	73%	0.734	S	S	*	*				104.6	122.3	52.9	-98.9	-0.5	0	0	0	115.2	K1420	K1420-D1422 PolarHBondContact O-N 3.01Å
1423	Q	31.3	Very low	31.3	Very low	169.2 Å²	169.2	148.2 Å²	148.2	79%	0.791	74%	0.736	S	S	*	*			trans	90.1	125.1	159.8	-65.5	163.6	73.4	0	0	115.3
1424	L	32.9	Very low	31.4	Very low	141.2 Å²	141.2	147.1 Å²	147.1	74%	0.739	74%	0.736	S	S	*	*				151	120.1	123.6	-81.8	157.7	0	0	0	110.3	I1421	I1421-L1424 HydrophobicContact CD1-CD1 4.17Å; I1421-L1424 HydrophobicContact CG1-CD1 4.4Å
1425	D	30.7	Very low	31.2	Very low	137.2 Å²	137.2	148.6 Å²	148.6	73%	0.734	74%	0.739	S	S	*	*				-142	151.9	73	-80.1	-27.9	0	0	0	110.5
1426	E	32.4	Very low	31.2	Very low	174.2 Å²	174.2	149.4 Å²	149.4	81%	0.814	74%	0.742	S	S	*	*			trans	84.6	139.8	140.7	-76.8	-177.5	163	0	0	113.5
1427	L	33.7	Very low	31	Very low	152.6 Å²	152.6	148.6 Å²	148.6	80%	0.799	74%	0.738	S	S	*	*				-169.9	128.3	99.8	-76.1	174.4	0	0	0	108.7
1428	H	30.7	Very low	30.8	Very low	157.2 Å²	157.2	148.2 Å²	148.2	73%	0.728	74%	0.742	S	S	*	*			cis	115.3	115.2	48.3	-130.6	-91.5	0	0	0	112.4	H1430	H1428-H1430 AromaticContact CE1-CD2 3.41Å; H1428-H1430 PolarHBondContact CE1-CD2 3.09Å; H1428-H1430 VanDerWaalsContact CE1-CD2 3.41Å; H1428-H1430 AromaticContact CE1-NE2 3.68Å; H1428-H1430 PolarHBondContact CE1-NE2 3.23Å; H1428-H1430 AromaticContact NE2-CD2 3.88Å; H1428-H1430 AromaticContact NE2-NE2 3.65Å
1429	E	33.1	Very low	30.8	Very low	162.4 Å²	162.4	148.9 Å²	148.9	76%	0.759	75%	0.745	S	S	*	*			trans	179.9	124.4	130.3	-72.3	-169.5	146.1	0	0	112.7
1430	H	30.5	Very low	30.6	Very low	140.4 Å²	140.4	150.1 Å²	150.1	65%	0.65	75%	0.747	S	S	*	*				102.3	133.1	88.4	-89.3	-43.7	0	0	0	114.9	H1428 N1432	H1428-H1430 AromaticContact CE1-CD2 3.41Å; H1428-H1430 PolarHBondContact CE1-CD2 3.09Å; H1428-H1430 VanDerWaalsContact CE1-CD2 3.41Å; H1428-H1430 AromaticContact CE1-NE2 3.68Å; H1428-H1430 PolarHBondContact CE1-NE2 3.23Å; H1428-H1430 AromaticContact NE2-CD2 3.88Å; H1428-H1430 AromaticContact NE2-NE2 3.65Å; H1430-N1432 PolarHBondContact ND1-OD1 2.7Å
1431	C	29.8	Very low	30.5	Very low	112.4 Å²	112.4	152.6 Å²	152.6	76%	0.759	75%	0.751	S	S	*	*				-165.4	121.4	102.1	-85.4	0	0	0	0	109.7
1432	N	29.3	Very low	30.5	Very low	132.6 Å²	132.6	154.3 Å²	154.3	71%	0.709	75%	0.754	S	S	*	*				88.7	122.9	61.6	-68.7	-15.9	0	0	0	111.4	H1430	H1430-N1432 PolarHBondContact ND1-OD1 2.7Å
1433	E	27.3	Very low	30.5	Very low	178.4 Å²	178.4	154 Å²	154	83%	0.834	75%	0.752	S	S	*	*			trans	-69.1	154.5	151.3	-71.8	-176.3	144	0	0	111.9
1434	P	33.5	Very low	30.4	Very low	111.2 Å²	111.2	149.7 Å²	149.7	72%	0.722	74%	0.741	S	S	*	*			trans	-108.6	115.2	144.4	35.6	-27.8	0	0	0	113.2	I1436	P1434-I1436 HydrophobicContact CB-CD1 4.26Å; P1434-I1436 HydrophobicContact CB-CG1 4.29Å; P1434-I1436 HydrophobicContact CG-CD1 4.06Å; P1434-I1436 HydrophobicContact CG-CG1 4.28Å; P1434-I1436 PolarHBondContact O-N 3.03Å
1435	E	27.1	Very low	30.3	Very low	151 Å²	151	150.9 Å²	150.9	71%	0.706	74%	0.742	S	S	*	*			trans	-73.8	111.8	165.9	-144.5	-162.8	-170.3	0	0	110.4	K1437	E1435-K1437 HydrophobicContact CB-CD 4.34Å; E1435-K1437 HydrophobicContact CG-CG 4.17Å; E1435-K1437 WeakPolarHBondContact OE1-CE 3.36Å; E1435-K1437 IonicContact OE1-NZ 3.09Å; E1435-K1437 PolarHBondContact OE1-NZ 2.97Å; E1435-K1437 WeakPolarHBondContact OE2-CD 3.49Å; E1435-K1437 VanDerWaalsContact OE2-CE 3.3Å; E1435-K1437 WeakPolarHBondContact OE2-CE 3.23Å; E1435-K1437 IonicContact OE2-NZ 2.94Å; E1435-K1437 PolarHBondContact OE2-NZ 3.27Å
1436	I	31.1	Very low	30.2	Very low	145.6 Å²	145.6	149.8 Å²	149.8	75%	0.747	75%	0.745	S	S	*	*			trans	-118	102.8	172	-60.3	-179.1	0	0	0	110.1	P1434 I1438	P1434-I1436 HydrophobicContact CB-CD1 4.26Å; P1434-I1436 HydrophobicContact CB-CG1 4.29Å; P1434-I1436 HydrophobicContact CG-CD1 4.06Å; P1434-I1436 HydrophobicContact CG-CG1 4.28Å; P1434-I1436 PolarHBondContact O-N 3.03Å; I1436-I1438 HydrophobicContact CG2-CG1 4.38Å
1437	K	27.4	Very low	30.1	Very low	157.6 Å²	157.6	144.9 Å²	144.9	69%	0.685	74%	0.741	S	S	*	*			trans	-40.7	129.9	150.4	-80	172.4	-178	147.1	0	112.9	E1435	E1435-K1437 HydrophobicContact CB-CD 4.34Å; E1435-K1437 HydrophobicContact CG-CG 4.17Å; E1435-K1437 WeakPolarHBondContact OE1-CE 3.36Å; E1435-K1437 IonicContact OE1-NZ 3.09Å; E1435-K1437 PolarHBondContact OE1-NZ 2.97Å; E1435-K1437 WeakPolarHBondContact OE2-CD 3.49Å; E1435-K1437 VanDerWaalsContact OE2-CE 3.3Å; E1435-K1437 WeakPolarHBondContact OE2-CE 3.23Å; E1435-K1437 IonicContact OE2-NZ 2.94Å; E1435-K1437 PolarHBondContact OE2-NZ 3.27Å
1438	I	30.5	Very low	29.9	Very low	152.4 Å²	152.4	146.2 Å²	146.2	78%	0.782	74%	0.743	S	S	*	*			trans	-126.4	123.4	161.6	-57.9	164.1	0	0	0	110.5	I1436	I1436-I1438 HydrophobicContact CG2-CG1 4.38Å
1439	E	29.4	Very low	29.7	Very low	166.2 Å²	166.2	144.6 Å²	144.6	78%	0.777	75%	0.745	S	S	*	*				-149.2	136.2	108.9	-107.1	-177.7	177.4	0	0	115.9
1440	Q	28.7	Very low	29.5	Very low	157.8 Å²	157.8	142 Å²	142	74%	0.737	74%	0.744	S	S	*	*			trans	1.4	119.4	153.6	-58.1	-177.6	23.3	0	0	116.2
1441	R	29.8	Very low	29.3	Very low	231.2 Å²	231.2	140.2 Å²	140.2	87%	0.872	75%	0.748	S	S	*	*			trans	-167.8	138.5	135.9	-88.6	161	-161.6	-152.5	4.9	111
1442	K	30.1	Very low	29.4	Very low	176.2 Å²	176.2	142.5 Å²	142.5	77%	0.766	75%	0.751	S	S	*	*				-25.4	124.1	105.4	-83.9	-179.2	170.1	-163.5	0	110.9
1443	D	31.1	Very low	29.4	Very low	126 Å²	126	142.6 Å²	142.6	67%	0.674	75%	0.751	S	S	*	*				-172.4	145.2	111.9	-84.1	-34.6	0	0	0	111.6	T1906 A1907 P1908	D1443-T1906 WeakPolarHBondContact O-CB 3.38Å; D1443-T1906 WeakPolarHBondContact O-CG2 3.18Å; D1443-T1906 PolarHBondContact O-OG1 3.11Å; D1443-A1907 VanDerWaalsContact CB-O 3.26Å; D1443-A1907 WeakPolarHBondContact CB-O 3.38Å; D1443-A1907 VanDerWaalsContact CG-O 3.22Å; D1443-P1908 WeakPolarHBondContact OD1-CD 3.45Å; D1443-P1908 WeakPolarHBondContact OD1-CG 3.27Å
1444	S	29.9	Very low	29.4	Very low	80.8 Å²	80.8	140.7 Å²	140.7	57%	0.565	75%	0.747	S	S	*	*				136.3	137.4	66.2	-59	0	0	0	0	112.4	T1906 A1907 P1908	S1444-T1906 VanDerWaalsContact N-CB 3.34Å; S1444-A1907 PolarHBondContact O-N 2.98Å; S1444-P1908 VanDerWaalsContact OG-CB 3.27Å; S1444-P1908 WeakPolarHBondContact OG-CB 3.5Å; S1444-P1908 VanDerWaalsContact OG-CG 3.32Å; S1444-P1908 WeakPolarHBondContact OG-CG 3.32Å
1445	H	31.1	Very low	29.2	Very low	165.8 Å²	165.8	142.2 Å²	142.2	77%	0.768	75%	0.749	S	S	*	*			trans	150.7	129.3	166.2	-86.1	-48.8	0	0	0	113.8	A1907 A1909	H1445-A1907 HydrophobicContact CB-CB 3.82Å; H1445-A1907 WeakPolarHBondContact CD2-CB 3.35Å; H1445-A1909 PolarHBondContact CE1-N 3.01Å; H1445-A1909 PolarHBondContact CE1-O 2.91Å; H1445-A1909 PolarHBondContact ND1-N 2.89Å; H1445-A1909 PolarHBondContact NE2-N 2.84Å; H1445-A1909 VanDerWaalsContact NE2-N 3.2Å
1446	S	27.6	Very low	29.3	Very low	114 Å²	114	141.9 Å²	141.9	80%	0.797	75%	0.752	S	S	*	*				56	134	126.3	72.1	0	0	0	0	116
1447	G	29.6	Very low	29.4	Very low	70.8 Å²	70.8	140.9 Å²	140.9	73%	0.73	75%	0.753	S	S	*	*				163.6	142.2	83.6	0	0	0	0	0	111.7
1448	Q	29.4	Very low	29.5	Very low	180.4 Å²	180.4	140.5 Å²	140.5	84%	0.843	76%	0.758	S	S	*	*				96.7	121.5	87.2	-82.1	174.1	-21.1	0	0	113.8
1449	T	26.7	Very low	29.7	Very low	124 Å²	124	141 Å²	141	76%	0.761	76%	0.763	S	S	*	*				57.3	125.6	86.4	69.6	0	0	0	0	117.7
1450	S	29.2	Very low	29.7	Very low	106.2 Å²	106.2	136.7 Å²	136.7	74%	0.743	76%	0.762	S	S	*	*				150	125.7	129.7	49.5	0	0	0	0	113.3
1451	S	27	Very low	30	Very low	104.2 Å²	104.2	136 Å²	136	73%	0.729	76%	0.764	S	S	*	*				64.6	100.8	88.8	-15.7	0	0	0	0	116.3
1452	I	31.2	Very low	30.2	Very low	160.4 Å²	160.4	130.9 Å²	130.9	82%	0.823	75%	0.754	S	S	*	*			trans	-170.6	125.7	135	-80.8	160.5	0	0	0	110.6
1453	N	29.4	Very low	30.5	Very low	134.8 Å²	134.8	129.7 Å²	129.7	72%	0.721	76%	0.756	S	S	*	*			trans	28.5	128.6	156.6	-72.2	-14.5	0	0	0	118.2
1454	N	28.4	Very low	30.9	Very low	138.8 Å²	138.8	130.5 Å²	130.5	74%	0.742	75%	0.753	S	S	*	*			trans	85.6	130.4	131.9	-64.8	-13.9	0	0	0	117.9
1455	N	29.1	Very low	31.2	Very low	141.6 Å²	141.6	132.3 Å²	132.3	76%	0.757	76%	0.757	S	S	*	*			trans	102.9	132.4	144.6	-73.3	-10.5	0	0	0	116.5
1456	N	29.2	Very low	31.5	Very low	146 Å²	146	130.2 Å²	130.2	78%	0.781	76%	0.758	S	S	*	*			trans	77.3	117.1	150.3	-60.2	-17.3	0	0	0	115.7
1457	T	32.2	Very low	31.9	Very low	124.6 Å²	124.6	129.7 Å²	129.7	76%	0.764	75%	0.75	S	S	*	*				-177.9	129.6	114.2	38.2	0	0	0	0	110.8
1458	N	30.5	Very low	32.5	Very low	147.8 Å²	147.8	131.8 Å²	131.8	79%	0.79	74%	0.743	S	S	*	*			trans	36.6	116.9	154.6	-60.4	-23.7	0	0	0	115.6
1459	D	33.4	Very low	33.3	Very low	164 Å²	164	127.1 Å²	127.1	88%	0.877	72%	0.724	S	S	*	*			trans	99.1	135.8	149.9	-66.9	-31.7	0	0	0	114.3
1460	G	31.3	Very low	34	Very low	74.8 Å²	74.8	126.6 Å²	126.6	77%	0.771	72%	0.716	S	S	*	*			cis	156.4	72.2	26.7	0	0	0	0	0	113.7
1461	D	33.1	Very low	34.5	Very low	144 Å²	144	124.5 Å²	124.5	77%	0.77	70%	0.701	S	S	*	*			trans	-111.4	101.4	-179.4	-147.7	5	0	0	0	116.4	N1463 K1464	D1461-N1463 PolarHBondContact O-N 3.35Å; D1461-K1464 PolarHBondContact O-NZ 2.74Å; D1461-K1464 IonicContact OD1-NZ 2.7Å; D1461-K1464 PolarHBondContact OD1-NZ 3.04Å; D1461-K1464 IonicContact OD2-NZ 2.78Å; D1461-K1464 PolarHBondContact OD2-NZ 3.15Å
1462	D	35.6	Very low	35.2	Very low	124.4 Å²	124.4	125.6 Å²	125.6	67%	0.665	69%	0.69	S	S	*	*			trans	-72.6	91.2	158.9	-99.7	-12.4	0	0	0	116.4	K1464	D1462-K1464 HydrophobicContact CB-CD 4.4Å; D1462-K1464 HydrophobicContact CB-CG 4.4Å; D1462-K1464 VanDerWaalsContact CG-NZ 3.3Å; D1462-K1464 PolarHBondContact O-N 3.33Å; D1462-K1464 WeakPolarHBondContact OD1-CD 3.44Å; D1462-K1464 VanDerWaalsContact OD1-CE 3.32Å; D1462-K1464 WeakPolarHBondContact OD1-CE 3.43Å; D1462-K1464 IonicContact OD1-NZ 3.14Å; D1462-K1464 PolarHBondContact OD1-NZ 3.4Å; D1462-K1464 WeakPolarHBondContact OD2-CE 3.23Å; D1462-K1464 IonicContact OD2-NZ 3.44Å; D1462-K1464 PolarHBondContact OD2-NZ 2.86Å
1463	N	35.3	Very low	35.8	Very low	150.6 Å²	150.6	120.3 Å²	120.3	81%	0.805	67%	0.666	S	S	*	*			trans	-135.9	89	138.7	-114.3	-33.1	0	0	0	111.9	D1461 N1465	D1461-N1463 PolarHBondContact O-N 3.35Å; N1463-N1465 PolarHBondContact O-N 3.16Å
1464	K	40.7	Very low	36.6	Very low	142.8 Å²	142.8	120.2 Å²	120.2	62%	0.621	67%	0.665	S	S	*	*			trans	-81.8	102.8	172.3	-72.1	168.2	179.9	120.3	0	113.3	D1461 D1462	D1461-K1464 PolarHBondContact O-NZ 2.74Å; D1461-K1464 IonicContact OD1-NZ 2.7Å; D1461-K1464 PolarHBondContact OD1-NZ 3.04Å; D1461-K1464 IonicContact OD2-NZ 2.78Å; D1461-K1464 PolarHBondContact OD2-NZ 3.15Å; D1462-K1464 HydrophobicContact CB-CD 4.4Å; D1462-K1464 HydrophobicContact CB-CG 4.4Å; D1462-K1464 VanDerWaalsContact CG-NZ 3.3Å; D1462-K1464 PolarHBondContact O-N 3.33Å; D1462-K1464 WeakPolarHBondContact OD1-CD 3.44Å; D1462-K1464 VanDerWaalsContact OD1-CE 3.32Å; D1462-K1464 WeakPolarHBondContact OD1-CE 3.43Å; D1462-K1464 IonicContact OD1-NZ 3.14Å; D1462-K1464 PolarHBondContact OD1-NZ 3.4Å; D1462-K1464 WeakPolarHBondContact OD2-CE 3.23Å; D1462-K1464 IonicContact OD2-NZ 3.44Å; D1462-K1464 PolarHBondContact OD2-NZ 2.86Å
1465	N	34.8	Very low	37.6	Very low	117.6 Å²	117.6	117.2 Å²	117.2	63%	0.629	66%	0.655	S	S	*	*			trans	-25.6	128.2	170.2	-64.6	-16.2	0	0	0	115.6	N1463 V1467	N1463-N1465 PolarHBondContact O-N 3.16Å; N1465-V1467 VanDerWaalsContact C-N 3.32Å; N1465-V1467 HydrophobicContact CB-CG2 4.3Å; N1465-V1467 PolarHBondContact O-N 3.06Å; N1465-V1467 VanDerWaalsContact O-N 3.12Å
1466	P	38.2	Very low	38.2	Very low	121.8 Å²	121.8	114.3 Å²	114.3	79%	0.791	64%	0.64	S	S	*	*			trans	-78.4	78.1	179.5	32.3	-34.4	0	0	0	112.2	L1468 H1510	P1466-L1468 PolarHBondContact O-N 2.96Å; P1466-H1510 VanDerWaalsContact CG-NE2 3.27Å; P1466-H1510 WeakPolarHBondContact CG-NE2 3.18Å
1467	V	36.8	Very low	38.7	Very low	105 Å²	105	117.7 Å²	117.7	64%	0.636	64%	0.642	S	S	*	*			trans	-90.4	112.7	172.9	179.7	0	0	0	0	109.4	N1465 N1469	N1465-V1467 VanDerWaalsContact C-N 3.32Å; N1465-V1467 HydrophobicContact CB-CG2 4.3Å; N1465-V1467 PolarHBondContact O-N 3.06Å; N1465-V1467 VanDerWaalsContact O-N 3.12Å; V1467-N1469 PolarHBondContact O-N 3.19Å; V1467-N1469 VanDerWaalsContact O-N 3.15Å
1468	L	41.4	Very low	39.1	Very low	113.4 Å²	113.4	116.1 Å²	116.1	59%	0.594	63%	0.627	S	S	*	*			trans	-63.3	107.3	-178.9	-170.4	82.2	0	0	0	111	P1466 I1470 F1502	P1466-L1468 PolarHBondContact O-N 2.96Å; L1468-I1470 VanDerWaalsContact C-N 3.32Å; L1468-I1470 HydrophobicContact CD2-CG1 4.35Å; L1468-I1470 HydrophobicContact CG-CG1 4.39Å; L1468-I1470 PolarHBondContact O-N 3.11Å; L1468-F1502 HydrophobicContact CD1-CE2 4.26Å; L1468-F1502 HydrophobicContact CD1-CZ 3.96Å
1469	N	45.7	Very low	39.6	Very low	82 Å²	82	116.8 Å²	116.8	44%	0.439	63%	0.626	S	S	.	*			trans	-78.2	89	176.2	-172.4	-15.5	0	0	0	110.8	V1467 S1471 Y1472 C1473	V1467-N1469 PolarHBondContact O-N 3.19Å; V1467-N1469 VanDerWaalsContact O-N 3.15Å; N1469-S1471 PolarHBondContact O-N 3.05Å; N1469-S1471 VanDerWaalsContact O-N 3.1Å; N1469-S1471 WeakPolarHBondContact OD1-CB 3.26Å; N1469-S1471 PolarHBondContact OD1-N 3.08Å; N1469-S1471 VanDerWaalsContact OD1-N 3.16Å; N1469-S1471 PolarHBondContact OD1-OG 3.07Å; N1469-Y1472 VanDerWaalsContact CG-CB 3.47Å; N1469-Y1472 WeakPolarHBondContact O-CA 3.32Å; N1469-Y1472 VanDerWaalsContact O-CB 3.27Å; N1469-Y1472 WeakPolarHBondContact O-CB 3.33Å; N1469-Y1472 PolarHBondContact O-N 3Å; N1469-Y1472 VanDerWaalsContact O-N 3.09Å; N1469-Y1472 WeakPolarHBondContact OD1-CB 3.4Å; N1469-Y1472 PolarHBondContact OD1-N 3.24Å; N1469-Y1472 VanDerWaalsContact OD1-N 3.12Å; N1469-C1473 PolarHBondContact O-N 3.28Å; N1469-C1473 PolarHBondContact O-SG 3.06Å
1470	I	40.8	Very low	39.8	Very low	114.2 Å²	114.2	116.9 Å²	116.9	59%	0.586	62%	0.619	S	S	*	*	H	α-helix	trans	-54.3	-34.1	-178.7	-58.4	169.3	0	0	0	111.9	L1468 Y1472 C1473 L1474	L1468-I1470 VanDerWaalsContact C-N 3.32Å; L1468-I1470 HydrophobicContact CD2-CG1 4.35Å; L1468-I1470 HydrophobicContact CG-CG1 4.39Å; L1468-I1470 PolarHBondContact O-N 3.11Å; I1470-Y1472 VanDerWaalsContact C-N 3.3Å; I1470-Y1472 PolarHBondContact O-N 3.25Å; I1470-C1473 PolarHBondContact O-N 3.33Å; I1470-L1474 HydrophobicContact CG2-CD1 4.14Å; I1470-L1474 HydrophobicContact CG2-CG 4.39Å; I1470-L1474 WeakPolarHBondContact O-CB 3.28Å; I1470-L1474 VanDerWaalsContact O-CG 3.28Å; I1470-L1474 WeakPolarHBondContact O-CG 3.46Å; I1470-L1474 PolarHBondContact O-N 3.32Å
1471	S	40.1	Very low	40	Very low	61 Å²	61	117.8 Å²	117.8	43%	0.427	61%	0.61	S	S	.	*	H	α-helix	trans	-65.1	-29.9	177	52.4	0	0	0	0	113.5	N1469 L1474 S1475	N1469-S1471 PolarHBondContact O-N 3.05Å; N1469-S1471 VanDerWaalsContact O-N 3.1Å; N1469-S1471 WeakPolarHBondContact OD1-CB 3.26Å; N1469-S1471 PolarHBondContact OD1-N 3.08Å; N1469-S1471 VanDerWaalsContact OD1-N 3.16Å; N1469-S1471 PolarHBondContact OD1-OG 3.07Å; S1471-L1474 PolarHBondContact O-N 3.03Å; S1471-S1475 WeakPolarHBondContact O-CB 3.43Å; S1471-S1475 PolarHBondContact O-N 3.35Å; S1471-S1475 PolarHBondContact O-OG 3.08Å
1472	Y	42.1	Very low	40.2	Very low	128.6 Å²	128.6	115.6 Å²	115.6	50%	0.504	60%	0.604	S	S	.	*	H	α-helix	trans	-74.8	-39.3	175.8	-171.6	-100.2	0	0	0	112.1	N1469 I1470 L1474 S1475 N1476 I1478	N1469-Y1472 VanDerWaalsContact CG-CB 3.47Å; N1469-Y1472 WeakPolarHBondContact O-CA 3.32Å; N1469-Y1472 VanDerWaalsContact O-CB 3.27Å; N1469-Y1472 WeakPolarHBondContact O-CB 3.33Å; N1469-Y1472 PolarHBondContact O-N 3Å; N1469-Y1472 VanDerWaalsContact O-N 3.09Å; N1469-Y1472 WeakPolarHBondContact OD1-CB 3.4Å; N1469-Y1472 PolarHBondContact OD1-N 3.24Å; N1469-Y1472 VanDerWaalsContact OD1-N 3.12Å; I1470-Y1472 VanDerWaalsContact C-N 3.3Å; I1470-Y1472 PolarHBondContact O-N 3.25Å; Y1472-L1474 VanDerWaalsContact C-N 3.32Å; Y1472-L1474 PolarHBondContact O-N 3.23Å; Y1472-S1475 WeakPolarHBondContact CA-OG 3.41Å; Y1472-S1475 PolarHBondContact O-N 3.08Å; Y1472-S1475 VanDerWaalsContact O-N 3.13Å; Y1472-S1475 PolarHBondContact O-OG 3.11Å; Y1472-S1475 VanDerWaalsContact O-OG 3.1Å; Y1472-N1476 VanDerWaalsContact CE2-ND2 3.3Å; Y1472-N1476 WeakPolarHBondContact CE2-ND2 3.1Å; Y1472-N1476 VanDerWaalsContact CZ-ND2 3.32Å; Y1472-N1476 WeakPolarHBondContact O-CB 3.31Å; Y1472-N1476 PolarHBondContact O-N 3.11Å; Y1472-N1476 PolarHBondContact OH-ND2 3.17Å; Y1472-I1478 HydrophobicContact CD1-CD1 4.19Å; Y1472-I1478 HydrophobicContact CE1-CD1 3.57Å
1473	C	44.4	Very low	40.3	Very low	47.8 Å²	47.8	115.4 Å²	115.4	32%	0.323	61%	0.61	S	S	.	*	H	α-helix	trans	-61.8	-40.2	175.9	-58.2	0	0	0	0	111.7	N1469 I1470 S1475 R1477 I1478	N1469-C1473 PolarHBondContact O-N 3.28Å; N1469-C1473 PolarHBondContact O-SG 3.06Å; I1470-C1473 PolarHBondContact O-N 3.33Å; C1473-S1475 VanDerWaalsContact C-N 3.28Å; C1473-S1475 PolarHBondContact O-N 2.83Å; C1473-R1477 PolarHBondContact O-N 3.17Å; C1473-R1477 VanDerWaalsContact O-N 3.17Å; C1473-I1478 PolarHBondContact O-N 3.09Å; C1473-I1478 VanDerWaalsContact O-N 3.14Å
1474	L	45	Very low	40.4	Very low	134.2 Å²	134.2	115.3 Å²	115.3	70%	0.703	61%	0.607	S	S	*	*	H	α-helix	trans	-72.3	-27.2	179.2	-69.4	172.2	0	0	0	113.7	R1170 I1470 S1471 Y1472	R1170-L1474 PolarHBondContact NH2-O 3.35Å; I1470-L1474 HydrophobicContact CG2-CD1 4.14Å; I1470-L1474 HydrophobicContact CG2-CG 4.39Å; I1470-L1474 WeakPolarHBondContact O-CB 3.28Å; I1470-L1474 VanDerWaalsContact O-CG 3.28Å; I1470-L1474 WeakPolarHBondContact O-CG 3.46Å; I1470-L1474 PolarHBondContact O-N 3.32Å; S1471-L1474 PolarHBondContact O-N 3.03Å; Y1472-L1474 VanDerWaalsContact C-N 3.32Å; Y1472-L1474 PolarHBondContact O-N 3.23Å
1475	S	49.8	Very low	40.1	Very low	75.6 Å²	75.6	115.7 Å²	115.7	53%	0.529	62%	0.617	S	S	.	*	H	α-helix	trans	-80.5	-33.9	-178	31.6	0	0	0	0	113.5	K1349 S1471 Y1472 C1473	K1349-S1475 PolarHBondContact NZ-OG 3.17Å; S1471-S1475 WeakPolarHBondContact O-CB 3.43Å; S1471-S1475 PolarHBondContact O-N 3.35Å; S1471-S1475 PolarHBondContact O-OG 3.08Å; Y1472-S1475 WeakPolarHBondContact CA-OG 3.41Å; Y1472-S1475 PolarHBondContact O-N 3.08Å; Y1472-S1475 VanDerWaalsContact O-N 3.13Å; Y1472-S1475 PolarHBondContact O-OG 3.11Å; Y1472-S1475 VanDerWaalsContact O-OG 3.1Å; C1473-S1475 VanDerWaalsContact C-N 3.28Å; C1473-S1475 PolarHBondContact O-N 2.83Å
1476	N	42.6	Very low	40.1	Very low	79.6 Å²	79.6	121 Å²	121	43%	0.426	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.2	5.4	-170.4	-68.7	6.4	0	0	0	114.9	K1349 Y1472 I1478	K1349-N1476 PolarHBondContact NZ-OD1 3.49Å; K1349-N1476 VanDerWaalsContact NZ-OD1 3.13Å; Y1472-N1476 VanDerWaalsContact CE2-ND2 3.3Å; Y1472-N1476 WeakPolarHBondContact CE2-ND2 3.1Å; Y1472-N1476 VanDerWaalsContact CZ-ND2 3.32Å; Y1472-N1476 WeakPolarHBondContact O-CB 3.31Å; Y1472-N1476 PolarHBondContact O-N 3.11Å; Y1472-N1476 PolarHBondContact OH-ND2 3.17Å; N1476-I1478 HydrophobicContact CB-CB 4.24Å; N1476-I1478 HydrophobicContact CB-CD1 3.88Å; N1476-I1478 HydrophobicContact CB-CG1 3.91Å; N1476-I1478 WeakPolarHBondContact O-CG1 2.98Å; N1476-I1478 PolarHBondContact O-N 3.01Å; N1476-I1478 VanDerWaalsContact O-N 3.12Å
1477	R	40.1	Very low	39.8	Very low	218.8 Å²	218.8	123.3 Å²	123.3	83%	0.826	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.7	26.1	-173.2	-62.7	-169.5	-179.7	-163.7	3.8	114.7	C1473 H1479	C1473-R1477 PolarHBondContact O-N 3.17Å; C1473-R1477 VanDerWaalsContact O-N 3.17Å; R1477-H1479 VanDerWaalsContact C-N 3.3Å; R1477-H1479 PolarHBondContact O-CD2 3.06Å; R1477-H1479 VanDerWaalsContact O-CD2 3.28Å; R1477-H1479 PolarHBondContact O-N 2.96Å
1478	I	39.3	Very low	39.7	Very low	90.6 Å²	90.6	126 Å²	126	47%	0.465	63%	0.633	S	S	.	*			trans	-77.7	99.9	178.7	-63.5	174	0	0	0	108.1	Y1472 C1473 N1476 F1480	Y1472-I1478 HydrophobicContact CD1-CD1 4.19Å; Y1472-I1478 HydrophobicContact CE1-CD1 3.57Å; C1473-I1478 PolarHBondContact O-N 3.09Å; C1473-I1478 VanDerWaalsContact O-N 3.14Å; N1476-I1478 HydrophobicContact CB-CB 4.24Å; N1476-I1478 HydrophobicContact CB-CD1 3.88Å; N1476-I1478 HydrophobicContact CB-CG1 3.91Å; N1476-I1478 WeakPolarHBondContact O-CG1 2.98Å; N1476-I1478 PolarHBondContact O-N 3.01Å; N1476-I1478 VanDerWaalsContact O-N 3.12Å; I1478-F1480 VanDerWaalsContact C-N 3.29Å; I1478-F1480 WeakPolarHBondContact CG2-O 3.21Å; I1478-F1480 PolarHBondContact O-N 2.87Å
1479	H	41.9	Very low	39.4	Very low	162.4 Å²	162.4	126.1 Å²	126.1	75%	0.752	64%	0.644	S	S	*	*			trans	-70.8	100.1	173.5	-81.6	-98.4	0	0	0	111	R1477	R1477-H1479 VanDerWaalsContact C-N 3.3Å; R1477-H1479 PolarHBondContact O-CD2 3.06Å; R1477-H1479 VanDerWaalsContact O-CD2 3.28Å; R1477-H1479 PolarHBondContact O-N 2.96Å
1480	F	36.4	Very low	38.9	Very low	166.4 Å²	166.4	132.7 Å²	132.7	73%	0.73	66%	0.664	S	S	*	*			trans	-86.8	130.6	177.3	-62.8	-87.2	0	0	0	112.8	I1478	I1478-F1480 VanDerWaalsContact C-N 3.29Å; I1478-F1480 WeakPolarHBondContact CG2-O 3.21Å; I1478-F1480 PolarHBondContact O-N 2.87Å
1481	P	36.3	Very low	38.9	Very low	92 Å²	92	132.8 Å²	132.8	60%	0.597	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-65.7	146.2	171.4	28.8	-33.1	0	0	0	110.4
1482	P	38	Very low	38.7	Very low	99.4 Å²	99.4	135.2 Å²	135.2	65%	0.645	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-62.1	149.9	178.9	-3.2	7.5	0	0	0	111.9	I1484	P1482-I1484 HydrophobicContact CB-CG1 4.46Å; P1482-I1484 PolarHBondContact O-N 2.75Å
1483	P	36.5	Very low	38.3	Very low	119.8 Å²	119.8	134.7 Å²	134.7	78%	0.778	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-60.5	135.1	169.8	-7.4	18.3	0	0	0	109.8	D1485	P1483-D1485 PolarHBondContact O-N 2.79Å
1484	I	37.1	Very low	37.8	Very low	147.6 Å²	147.6	138.2 Å²	138.2	76%	0.757	73%	0.729	S	S	*	*			trans	-99.8	112	173	-62.1	173.3	0	0	0	106.7	P1482 R1486	P1482-I1484 HydrophobicContact CB-CG1 4.46Å; P1482-I1484 PolarHBondContact O-N 2.75Å; I1484-R1486 HydrophobicContact CG2-CG 4.48Å; I1484-R1486 PolarHBondContact O-N 3.15Å
1485	D	34	Very low	37.4	Very low	152.4 Å²	152.4	137.4 Å²	137.4	82%	0.815	73%	0.734	S	S	*	*			trans	-63.1	135	174.2	-68	-52.8	0	0	0	110.5	P1483	P1483-D1485 PolarHBondContact O-N 2.79Å
1486	R	35.1	Very low	36.6	Very low	229.4 Å²	229.4	138.9 Å²	138.9	87%	0.866	75%	0.745	S	S	*	*			trans	-121.5	129.9	172	-78.7	-171.2	171.7	-176.2	-2.3	109.4	I1484	I1484-R1486 HydrophobicContact CG2-CG 4.48Å; I1484-R1486 PolarHBondContact O-N 3.15Å
1487	E	33.3	Very low	36.4	Very low	169.6 Å²	169.6	139.8 Å²	139.8	79%	0.793	76%	0.757	S	S	*	*			trans	-89.3	142.2	-176.1	-62.4	-176.1	172.4	0	0	112.5
1488	H	34.5	Very low	36.3	Very low	162 Å²	162	138.6 Å²	138.6	75%	0.75	76%	0.758	S	S	*	*			trans	43.5	123.4	143.2	-55.4	-60.3	0	0	0	118.2
1489	S	35.5	Very low	36.4	Very low	115.6 Å²	115.6	144.2 Å²	144.2	81%	0.808	77%	0.774	S	S	*	*			trans	160.9	127.4	142.3	51.3	0	0	0	0	115	P1491	S1489-P1491 WeakPolarHBondContact O-CD 3.41Å
1490	Y	33.7	Very low	36.4	Very low	219.6 Å²	219.6	143 Å²	143	86%	0.861	77%	0.772	S	S	*	*			trans	-89.7	163.9	178.2	-67.4	-90.9	0	0	0	111.8
1491	P	41.5	Very low	36.7	Very low	117.2 Å²	117.2	145.1 Å²	145.1	76%	0.761	78%	0.775	S	S	*	*				-119.1	166.1	-111.2	28.6	-11.1	0	0	0	113.2	S1489	S1489-P1491 WeakPolarHBondContact O-CD 3.41Å
1492	S	35.5	Very low	37.2	Very low	110.8 Å²	110.8	148.4 Å²	148.4	78%	0.775	78%	0.78	S	S	*	*			trans	-143.7	127	145.1	96.1	0	0	0	0	116.1	S1494	S1492-S1494 PolarHBondContact O-N 3.01Å
1493	S	33.9	Very low	37.8	Very low	118.8 Å²	118.8	152 Å²	152	83%	0.831	78%	0.781	S	S	*	*			trans	-74.9	128.6	162.2	-13.6	0	0	0	0	115.6	S1495	S1493-S1495 PolarHBondContact O-N 3.45Å
1494	S	34.2	Very low	39.2	Very low	121.2 Å²	121.2	151.8 Å²	151.8	85%	0.848	77%	0.773	S	S	*	*			trans	139.4	103.2	159.8	174.9	0	0	0	0	116.2	S1492	S1492-S1494 PolarHBondContact O-N 3.01Å
1495	S	35.6	Very low	40.9	Very low	115.6 Å²	115.6	149.2 Å²	149.2	81%	0.808	76%	0.76	S	S	*	*			trans	-165.8	136	155.8	-155.4	0	0	0	0	114.4	S1493 S1497	S1493-S1495 PolarHBondContact O-N 3.45Å; S1495-S1497 PolarHBondContact O-N 2.85Å
1496	S	33.5	Very low	42.7	Very low	108 Å²	108	144.6 Å²	144.6	76%	0.755	74%	0.741	S	S	*	*			trans	-88.1	117.4	-172.7	166.9	0	0	0	0	113.4	K1498	S1496-K1498 PolarHBondContact O-N 3.23Å
1497	S	38.1	Very low	44.3	Very low	97.8 Å²	97.8	138 Å²	138	68%	0.684	72%	0.721	S	S	*	*			trans	-155	102.7	155.9	-161.6	0	0	0	0	111.9	S1495 R1499	S1495-S1497 PolarHBondContact O-N 2.85Å; S1497-R1499 VanDerWaalsContact C-N 3.34Å; S1497-R1499 PolarHBondContact O-N 2.99Å; S1497-R1499 VanDerWaalsContact O-N 3.16Å
1498	K	38.1	Very low	46.4	Very low	194.4 Å²	194.4	134.1 Å²	134.1	85%	0.845	71%	0.706	S	S	*	*			trans	-81.4	54.3	177.8	-67	-179.6	179.4	176.3	0	112.5	F1095 S1496 L1500	F1095-K1498 VanDerWaalsContact CZ-NZ 3.32Å; S1496-K1498 PolarHBondContact O-N 3.23Å; K1498-L1500 VanDerWaalsContact C-N 3.32Å; K1498-L1500 PolarHBondContact O-N 3.05Å; K1498-L1500 VanDerWaalsContact O-N 3.09Å
1499	R	42.3	Very low	48.5	Very low	209.2 Å²	209.2	132.2 Å²	132.2	79%	0.789	70%	0.697	S	S	*	*			trans	-87.3	117.9	163.1	-139.8	177.2	-174.2	-168.7	1.3	108.3	S1497 R1501	S1497-R1499 VanDerWaalsContact C-N 3.34Å; S1497-R1499 PolarHBondContact O-N 2.99Å; S1497-R1499 VanDerWaalsContact O-N 3.16Å; R1499-R1501 VanDerWaalsContact C-N 3.34Å; R1499-R1501 PolarHBondContact O-N 3.28Å
1500	L	42.4	Very low	50.3	Low	136.8 Å²	136.8	132.5 Å²	132.5	72%	0.716	69%	0.685	S	S	*	*			trans	-54.2	109.2	174.4	-75.1	166.8	0	0	0	109.7	K1498 F1502	K1498-L1500 VanDerWaalsContact C-N 3.32Å; K1498-L1500 PolarHBondContact O-N 3.05Å; K1498-L1500 VanDerWaalsContact O-N 3.09Å; L1500-F1502 VanDerWaalsContact C-N 3.33Å; L1500-F1502 HydrophobicContact CB-CD1 4.46Å; L1500-F1502 HydrophobicContact CB-CD2 4.2Å; L1500-F1502 HydrophobicContact CB-CE1 4.22Å; L1500-F1502 HydrophobicContact CB-CE2 3.89Å; L1500-F1502 HydrophobicContact CB-CG 4.44Å; L1500-F1502 HydrophobicContact CB-CZ 4.17Å; L1500-F1502 HydrophobicContact CD1-CE1 3.99Å; L1500-F1502 HydrophobicContact CD1-CE2 4.4Å; L1500-F1502 HydrophobicContact CD1-CZ 4.03Å; L1500-F1502 VanDerWaalsContact O-CD2 3.3Å; L1500-F1502 WeakPolarHBondContact O-CD2 3.41Å; L1500-F1502 PolarHBondContact O-N 3.36Å
1501	R	41	Very low	52.4	Low	210.8 Å²	210.8	129.4 Å²	129.4	80%	0.795	67%	0.672	S	S	*	*			trans	-73.1	96.1	168.8	-72.8	-174.5	179	-174.7	-0.1	106.9	R1499 R1503	R1499-R1501 VanDerWaalsContact C-N 3.34Å; R1499-R1501 PolarHBondContact O-N 3.28Å; R1501-R1503 PolarHBondContact O-N 2.96Å
1502	F	46.7	Very low	54.5	Low	161 Å²	161	131.3 Å²	131.3	71%	0.706	67%	0.665	S	S	*	*			trans	-60.8	90.5	167.2	-70.6	-86.1	0	0	0	108.7	L1468 L1500 L1504 L1507	L1468-F1502 HydrophobicContact CD1-CE2 4.26Å; L1468-F1502 HydrophobicContact CD1-CZ 3.96Å; L1500-F1502 VanDerWaalsContact C-N 3.33Å; L1500-F1502 HydrophobicContact CB-CD1 4.46Å; L1500-F1502 HydrophobicContact CB-CD2 4.2Å; L1500-F1502 HydrophobicContact CB-CE1 4.22Å; L1500-F1502 HydrophobicContact CB-CE2 3.89Å; L1500-F1502 HydrophobicContact CB-CG 4.44Å; L1500-F1502 HydrophobicContact CB-CZ 4.17Å; L1500-F1502 HydrophobicContact CD1-CE1 3.99Å; L1500-F1502 HydrophobicContact CD1-CE2 4.4Å; L1500-F1502 HydrophobicContact CD1-CZ 4.03Å; L1500-F1502 VanDerWaalsContact O-CD2 3.3Å; L1500-F1502 WeakPolarHBondContact O-CD2 3.41Å; L1500-F1502 PolarHBondContact O-N 3.36Å; F1502-L1504 PolarHBondContact O-N 3.07Å; F1502-L1507 HydrophobicContact CB-CD1 4.08Å; F1502-L1507 HydrophobicContact CD1-CD1 4.04Å; F1502-L1507 HydrophobicContact CD1-CD2 4.24Å; F1502-L1507 HydrophobicContact CD1-CG 4.29Å; F1502-L1507 HydrophobicContact CG-CD1 4.44Å
1503	R	51.8	Low	56.9	Low	174.8 Å²	174.8	129.7 Å²	129.7	66%	0.66	65%	0.648	S	S	*	*			trans	-71.3	127.5	168	-77.1	-173.5	134.7	143.6	-1	107.4	R1501 D1505 S1506 L1507	R1501-R1503 PolarHBondContact O-N 2.96Å; R1503-D1505 HydrophobicContact CB-CB 4.33Å; R1503-D1505 WeakPolarHBondContact CB-OD2 3.46Å; R1503-D1505 WeakPolarHBondContact CD-OD2 3.3Å; R1503-D1505 IonicContact CZ-OD2 2.82Å; R1503-D1505 VanDerWaalsContact CZ-OD2 3.28Å; R1503-D1505 IonicContact NE-OD2 3.16Å; R1503-D1505 PolarHBondContact NE-OD2 3.11Å; R1503-D1505 IonicContact NH2-OD2 3.39Å; R1503-D1505 PolarHBondContact NH2-OD2 3.48Å; R1503-D1505 PolarHBondContact O-N 3.21Å; R1503-S1506 PolarHBondContact O-N 3.09Å; R1503-S1506 VanDerWaalsContact O-N 3.14Å; R1503-L1507 PolarHBondContact O-N 2.94Å
1504	L	66.6	Low	59.1	Low	116 Å²	116	126.2 Å²	126.2	61%	0.607	63%	0.626	S	S	*	*	H	α-helix	trans	-53.1	-37.5	178.7	-171.7	66.1	0	0	0	110.7	F1502 S1506 L1507 L1508	F1502-L1504 PolarHBondContact O-N 3.07Å; L1504-S1506 VanDerWaalsContact C-N 3.32Å; L1504-S1506 PolarHBondContact O-N 3.19Å; L1504-L1507 CarbonylContact O-C 3.54Å; L1504-L1507 WeakPolarHBondContact O-CA 3.47Å; L1504-L1507 VanDerWaalsContact O-CB 3.31Å; L1504-L1507 WeakPolarHBondContact O-CB 3.37Å; L1504-L1507 PolarHBondContact O-N 2.99Å; L1504-L1507 VanDerWaalsContact O-N 3.1Å; L1504-L1508 HydrophobicContact CD2-CD1 4.37Å; L1504-L1508 HydrophobicContact CG-CD1 4.07Å; L1504-L1508 HydrophobicContact CG-CG 4.31Å; L1504-L1508 WeakPolarHBondContact O-CB 3.47Å; L1504-L1508 VanDerWaalsContact O-CG 3.31Å; L1504-L1508 WeakPolarHBondContact O-CG 3.4Å; L1504-L1508 PolarHBondContact O-N 3.24Å
1505	D	71.7	Confident	61.4	Low	91.4 Å²	91.4	122.9 Å²	122.9	49%	0.489	61%	0.606	S	S	.	*	H	α-helix	trans	-48.3	-50	175.3	-36.9	-31.5	0	0	0	113	R1503 L1507 L1508 E1509 K2099	R1503-D1505 HydrophobicContact CB-CB 4.33Å; R1503-D1505 WeakPolarHBondContact CB-OD2 3.46Å; R1503-D1505 WeakPolarHBondContact CD-OD2 3.3Å; R1503-D1505 IonicContact CZ-OD2 2.82Å; R1503-D1505 VanDerWaalsContact CZ-OD2 3.28Å; R1503-D1505 IonicContact NE-OD2 3.16Å; R1503-D1505 PolarHBondContact NE-OD2 3.11Å; R1503-D1505 IonicContact NH2-OD2 3.39Å; R1503-D1505 PolarHBondContact NH2-OD2 3.48Å; R1503-D1505 PolarHBondContact O-N 3.21Å; D1505-L1507 VanDerWaalsContact C-N 3.33Å; D1505-L1507 PolarHBondContact O-N 3Å; D1505-L1508 WeakPolarHBondContact O-CB 3.4Å; D1505-L1508 PolarHBondContact O-N 2.86Å; D1505-L1508 VanDerWaalsContact O-N 3.14Å; D1505-E1509 WeakPolarHBondContact O-CB 3.37Å; D1505-E1509 PolarHBondContact O-N 3.17Å; D1505-K2099 WeakPolarHBondContact OD1-CE 3.43Å; D1505-K2099 IonicContact OD1-NZ 2.65Å; D1505-K2099 PolarHBondContact OD1-NZ 3.21Å; D1505-K2099 IonicContact OD2-NZ 2.78Å; D1505-K2099 PolarHBondContact OD2-NZ 2.83Å
1506	S	71.2	Confident	63.8	Low	57.6 Å²	57.6	120.5 Å²	120.5	40%	0.403	58%	0.582	S	S	.	*	H	α-helix	trans	-70.6	-30.1	179.5	-172.9	0	0	0	0	112.5	R1503 L1504 L1508 E1509 H1510	R1503-S1506 PolarHBondContact O-N 3.09Å; R1503-S1506 VanDerWaalsContact O-N 3.14Å; L1504-S1506 VanDerWaalsContact C-N 3.32Å; L1504-S1506 PolarHBondContact O-N 3.19Å; S1506-L1508 VanDerWaalsContact C-N 3.34Å; S1506-E1509 PolarHBondContact O-N 3.2Å; S1506-H1510 WeakPolarHBondContact O-CB 3.37Å; S1506-H1510 PolarHBondContact O-CD2 3.15Å; S1506-H1510 VanDerWaalsContact O-CD2 3.24Å; S1506-H1510 PolarHBondContact O-N 3.29Å
1507	L	70	Confident	66.3	Low	88.8 Å²	88.8	119.4 Å²	119.4	47%	0.465	57%	0.568	S	S	.	*	H	α-helix	trans	-73.8	-32.3	173.1	-97	172.4	0	0	0	111.9	F1502 R1503 L1504 D1505 H1510 R1511	F1502-L1507 HydrophobicContact CB-CD1 4.08Å; F1502-L1507 HydrophobicContact CD1-CD1 4.04Å; F1502-L1507 HydrophobicContact CD1-CD2 4.24Å; F1502-L1507 HydrophobicContact CD1-CG 4.29Å; F1502-L1507 HydrophobicContact CG-CD1 4.44Å; R1503-L1507 PolarHBondContact O-N 2.94Å; L1504-L1507 CarbonylContact O-C 3.54Å; L1504-L1507 WeakPolarHBondContact O-CA 3.47Å; L1504-L1507 VanDerWaalsContact O-CB 3.31Å; L1504-L1507 WeakPolarHBondContact O-CB 3.37Å; L1504-L1507 PolarHBondContact O-N 2.99Å; L1504-L1507 VanDerWaalsContact O-N 3.1Å; D1505-L1507 VanDerWaalsContact C-N 3.33Å; D1505-L1507 PolarHBondContact O-N 3Å; L1507-H1510 PolarHBondContact O-N 3Å; L1507-R1511 HydrophobicContact CD2-CG 4.47Å; L1507-R1511 WeakPolarHBondContact O-CB 3.38Å; L1507-R1511 WeakPolarHBondContact O-CD 3.39Å; L1507-R1511 VanDerWaalsContact O-CG 3.25Å; L1507-R1511 WeakPolarHBondContact O-CG 3.39Å; L1507-R1511 PolarHBondContact O-N 3.1Å; L1507-R1511 VanDerWaalsContact O-N 3.13Å
1508	L	76.4	Confident	68.5	Low	89.4 Å²	89.4	119.7 Å²	119.7	47%	0.468	56%	0.561	S	S	.	*	H	α-helix	trans	-69.6	-43.2	172.1	-71.5	169	0	0	0	111	L1504 D1505 S1506 H1510 R1511 Y1512	L1504-L1508 HydrophobicContact CD2-CD1 4.37Å; L1504-L1508 HydrophobicContact CG-CD1 4.07Å; L1504-L1508 HydrophobicContact CG-CG 4.31Å; L1504-L1508 WeakPolarHBondContact O-CB 3.47Å; L1504-L1508 VanDerWaalsContact O-CG 3.31Å; L1504-L1508 WeakPolarHBondContact O-CG 3.4Å; L1504-L1508 PolarHBondContact O-N 3.24Å; D1505-L1508 WeakPolarHBondContact O-CB 3.4Å; D1505-L1508 PolarHBondContact O-N 2.86Å; D1505-L1508 VanDerWaalsContact O-N 3.14Å; S1506-L1508 VanDerWaalsContact C-N 3.34Å; L1508-H1510 PolarHBondContact O-N 2.81Å; L1508-R1511 CarbonylContact O-C 3.58Å; L1508-R1511 WeakPolarHBondContact O-CA 3.27Å; L1508-R1511 WeakPolarHBondContact O-CB 3.4Å; L1508-R1511 PolarHBondContact O-N 3.18Å; L1508-R1511 VanDerWaalsContact O-N 3.11Å; L1508-Y1512 WeakPolarHBondContact O-CB 3.38Å; L1508-Y1512 PolarHBondContact O-N 3.29Å
1509	E	79.5	Confident	70.9	Confident	121.6 Å²	121.6	117.1 Å²	117.1	57%	0.568	55%	0.55	S	S	*	*	H	α-helix	trans	-61.3	-47.4	175.3	-173	157.2	-151.4	0	0	111.7	D1505 S1506 R1511 Y1512 I1513	D1505-E1509 WeakPolarHBondContact O-CB 3.37Å; D1505-E1509 PolarHBondContact O-N 3.17Å; S1506-E1509 PolarHBondContact O-N 3.2Å; E1509-R1511 VanDerWaalsContact C-N 3.31Å; E1509-R1511 PolarHBondContact O-N 3.03Å; E1509-Y1512 WeakPolarHBondContact O-CB 3.48Å; E1509-Y1512 PolarHBondContact O-N 3.09Å; E1509-Y1512 VanDerWaalsContact O-N 3.13Å; E1509-I1513 HydrophobicContact CG-CD1 4.11Å; E1509-I1513 VanDerWaalsContact O-CG1 3.3Å; E1509-I1513 WeakPolarHBondContact O-CG1 3.39Å; E1509-I1513 PolarHBondContact O-N 2.99Å
1510	H	73.3	Confident	73.2	Confident	121 Å²	121	112.8 Å²	112.8	56%	0.56	54%	0.537	S	S	*	.	H	α-helix	trans	-62	-35.5	173.7	-86.9	-66.3	0	0	0	113.1	P1466 S1506 L1507 L1508 A1514	P1466-H1510 VanDerWaalsContact CG-NE2 3.27Å; P1466-H1510 WeakPolarHBondContact CG-NE2 3.18Å; S1506-H1510 WeakPolarHBondContact O-CB 3.37Å; S1506-H1510 PolarHBondContact O-CD2 3.15Å; S1506-H1510 VanDerWaalsContact O-CD2 3.24Å; S1506-H1510 PolarHBondContact O-N 3.29Å; L1507-H1510 PolarHBondContact O-N 3Å; L1508-H1510 PolarHBondContact O-N 2.81Å; H1510-A1514 VanDerWaalsContact O-CB 3.3Å; H1510-A1514 WeakPolarHBondContact O-CB 3.4Å; H1510-A1514 PolarHBondContact O-N 2.99Å; H1510-A1514 VanDerWaalsContact O-N 3.12Å
1511	R	78.1	Confident	75.2	Confident	154.2 Å²	154.2	108.9 Å²	108.9	58%	0.582	53%	0.525	S	S	*	.	H	α-helix	trans	-68.8	-39.2	173.3	-83.7	-179.6	170.9	-163.2	-1.5	112.4	L1507 L1508 E1509 A1514 A1515	L1507-R1511 HydrophobicContact CD2-CG 4.47Å; L1507-R1511 WeakPolarHBondContact O-CB 3.38Å; L1507-R1511 WeakPolarHBondContact O-CD 3.39Å; L1507-R1511 VanDerWaalsContact O-CG 3.25Å; L1507-R1511 WeakPolarHBondContact O-CG 3.39Å; L1507-R1511 PolarHBondContact O-N 3.1Å; L1507-R1511 VanDerWaalsContact O-N 3.13Å; L1508-R1511 CarbonylContact O-C 3.58Å; L1508-R1511 WeakPolarHBondContact O-CA 3.27Å; L1508-R1511 WeakPolarHBondContact O-CB 3.4Å; L1508-R1511 PolarHBondContact O-N 3.18Å; L1508-R1511 VanDerWaalsContact O-N 3.11Å; E1509-R1511 VanDerWaalsContact C-N 3.31Å; E1509-R1511 PolarHBondContact O-N 3.03Å; R1511-A1514 PolarHBondContact O-N 3.02Å; R1511-A1515 WeakPolarHBondContact O-CB 3.4Å; R1511-A1515 PolarHBondContact O-N 2.97Å
1512	Y	84.5	Confident	77.4	Confident	157.2 Å²	157.2	101.4 Å²	101.4	62%	0.616	51%	0.505	S	S	*	.	H	α-helix	trans	-63.5	-47.8	176.2	-178.9	-95.8	0	0	0	110.8	L1508 E1509 A1514 A1515 E1516	L1508-Y1512 WeakPolarHBondContact O-CB 3.38Å; L1508-Y1512 PolarHBondContact O-N 3.29Å; E1509-Y1512 WeakPolarHBondContact O-CB 3.48Å; E1509-Y1512 PolarHBondContact O-N 3.09Å; E1509-Y1512 VanDerWaalsContact O-N 3.13Å; Y1512-A1514 VanDerWaalsContact C-N 3.32Å; Y1512-A1514 PolarHBondContact O-N 3.06Å; Y1512-A1515 PolarHBondContact O-N 3.24Å; Y1512-E1516 HydrophobicContact CD2-CG 4.47Å; Y1512-E1516 HydrophobicContact CE1-CG 4.29Å; Y1512-E1516 WeakPolarHBondContact CE1-OE2 3.28Å; Y1512-E1516 HydrophobicContact CE2-CG 3.83Å; Y1512-E1516 WeakPolarHBondContact O-CB 3.4Å; Y1512-E1516 PolarHBondContact O-N 3.15Å; Y1512-E1516 PolarHBondContact OH-OE2 2.82Å; Y1512-E1516 VanDerWaalsContact OH-OE2 3.11Å
1513	I	85.4	Confident	79.4	Confident	78.8 Å²	78.8	96.1 Å²	96.1	40%	0.404	49%	0.491	S	S	.	.	H	α-helix	trans	-60.6	-40.7	175.3	-66.3	165.4	0	0	0	111.2	E1509 E1516 N1517	E1509-I1513 HydrophobicContact CG-CD1 4.11Å; E1509-I1513 VanDerWaalsContact O-CG1 3.3Å; E1509-I1513 WeakPolarHBondContact O-CG1 3.39Å; E1509-I1513 PolarHBondContact O-N 2.99Å; I1513-E1516 PolarHBondContact O-N 3Å; I1513-N1517 WeakPolarHBondContact O-CB 3.32Å; I1513-N1517 VanDerWaalsContact O-CG 3.24Å; I1513-N1517 PolarHBondContact O-N 3.14Å; I1513-N1517 VanDerWaalsContact O-N 3.17Å; I1513-N1517 PolarHBondContact O-ND2 3.28Å
1514	A	80.5	Confident	81.2	Confident	45.4 Å²	45.4	90.7 Å²	90.7	38%	0.375	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-47.6	175.2	0	0	0	0	0	111.9	H1510 R1511 Y1512 E1516 N1517 D1518	H1510-A1514 VanDerWaalsContact O-CB 3.3Å; H1510-A1514 WeakPolarHBondContact O-CB 3.4Å; H1510-A1514 PolarHBondContact O-N 2.99Å; H1510-A1514 VanDerWaalsContact O-N 3.12Å; R1511-A1514 PolarHBondContact O-N 3.02Å; Y1512-A1514 VanDerWaalsContact C-N 3.32Å; Y1512-A1514 PolarHBondContact O-N 3.06Å; A1514-E1516 VanDerWaalsContact C-N 3.33Å; A1514-E1516 PolarHBondContact O-N 2.95Å; A1514-N1517 CarbonylContact O-C 3.59Å; A1514-N1517 WeakPolarHBondContact O-CB 3.48Å; A1514-N1517 PolarHBondContact O-N 3.22Å; A1514-N1517 VanDerWaalsContact O-N 3.13Å; A1514-D1518 PolarHBondContact O-N 3.32Å
1515	A	83.3	Confident	82.2	Confident	51.6 Å²	51.6	87.2 Å²	87.2	43%	0.426	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-38.2	178.5	0	0	0	0	0	112.9	R1511 Y1512 N1517 D1518 K1519	R1511-A1515 WeakPolarHBondContact O-CB 3.4Å; R1511-A1515 PolarHBondContact O-N 2.97Å; Y1512-A1515 PolarHBondContact O-N 3.24Å; A1515-N1517 VanDerWaalsContact C-N 3.33Å; A1515-N1517 PolarHBondContact O-N 3.06Å; A1515-D1518 PolarHBondContact O-N 3.05Å; A1515-K1519 VanDerWaalsContact O-CB 3.26Å; A1515-K1519 WeakPolarHBondContact O-CB 3.4Å; A1515-K1519 PolarHBondContact O-N 2.98Å
1516	E	86	Confident	83.1	Confident	63.8 Å²	63.8	87.7 Å²	87.7	30%	0.298	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-35.7	174.1	-125.3	-101.7	139.2	0	0	112	Y1512 I1513 A1514 K1519 K1520	Y1512-E1516 HydrophobicContact CD2-CG 4.47Å; Y1512-E1516 HydrophobicContact CE1-CG 4.29Å; Y1512-E1516 WeakPolarHBondContact CE1-OE2 3.28Å; Y1512-E1516 HydrophobicContact CE2-CG 3.83Å; Y1512-E1516 WeakPolarHBondContact O-CB 3.4Å; Y1512-E1516 PolarHBondContact O-N 3.15Å; Y1512-E1516 PolarHBondContact OH-OE2 2.82Å; Y1512-E1516 VanDerWaalsContact OH-OE2 3.11Å; I1513-E1516 PolarHBondContact O-N 3Å; A1514-E1516 VanDerWaalsContact C-N 3.33Å; A1514-E1516 PolarHBondContact O-N 2.95Å; E1516-K1519 PolarHBondContact O-N 3.23Å; E1516-K1519 WeakPolarHBondContact OE1-CD 3.44Å; E1516-K1519 WeakPolarHBondContact OE1-CE 3.45Å; E1516-K1519 IonicContact OE1-NZ 3.05Å; E1516-K1519 PolarHBondContact OE1-NZ 3.04Å; E1516-K1519 IonicContact OE2-NZ 2.73Å; E1516-K1519 PolarHBondContact OE2-NZ 3.01Å; E1516-K1520 WeakPolarHBondContact O-CB 3.45Å; E1516-K1520 VanDerWaalsContact O-CD 3.27Å; E1516-K1520 WeakPolarHBondContact O-CD 3.38Å; E1516-K1520 VanDerWaalsContact O-CG 3.28Å; E1516-K1520 WeakPolarHBondContact O-CG 3.38Å; E1516-K1520 PolarHBondContact O-N 3.03Å; E1516-K1520 VanDerWaalsContact O-N 3.15Å; E1516-K1520 VanDerWaalsContact OE1-CE 3.23Å; E1516-K1520 WeakPolarHBondContact OE1-CE 3.25Å; E1516-K1520 IonicContact OE1-NZ 2.77Å; E1516-K1520 PolarHBondContact OE1-NZ 3.2Å; E1516-K1520 WeakPolarHBondContact OE2-CE 3.45Å; E1516-K1520 IonicContact OE2-NZ 3Å; E1516-K1520 PolarHBondContact OE2-NZ 2.84Å
1517	N	85.5	Confident	84	Confident	86.6 Å²	86.6	90.7 Å²	90.7	46%	0.463	49%	0.485	S	S	.	.	H	α-helix	trans	-71.2	-40.5	174.3	-73.1	-28.1	0	0	0	112.2	I1513 A1514 A1515 K1519 K1520 A1521	I1513-N1517 WeakPolarHBondContact O-CB 3.32Å; I1513-N1517 VanDerWaalsContact O-CG 3.24Å; I1513-N1517 PolarHBondContact O-N 3.14Å; I1513-N1517 VanDerWaalsContact O-N 3.17Å; I1513-N1517 PolarHBondContact O-ND2 3.28Å; A1514-N1517 CarbonylContact O-C 3.59Å; A1514-N1517 WeakPolarHBondContact O-CB 3.48Å; A1514-N1517 PolarHBondContact O-N 3.22Å; A1514-N1517 VanDerWaalsContact O-N 3.13Å; A1515-N1517 VanDerWaalsContact C-N 3.33Å; A1515-N1517 PolarHBondContact O-N 3.06Å; N1517-K1519 VanDerWaalsContact C-N 3.32Å; N1517-K1519 PolarHBondContact O-N 3.11Å; N1517-K1520 PolarHBondContact O-N 3.23Å; N1517-A1521 WeakPolarHBondContact O-CB 3.38Å; N1517-A1521 PolarHBondContact O-N 3.15Å
1518	D	85.1	Confident	85	Confident	103.2 Å²	103.2	88.6 Å²	88.6	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-64.7	-38.8	174.7	-74.5	-17.2	0	0	0	111.4	A1514 A1515 K1520 A1521 S1522	A1514-D1518 PolarHBondContact O-N 3.32Å; A1515-D1518 PolarHBondContact O-N 3.05Å; D1518-K1520 VanDerWaalsContact C-N 3.32Å; D1518-K1520 PolarHBondContact O-N 3.04Å; D1518-A1521 PolarHBondContact O-N 3.02Å; D1518-S1522 VanDerWaalsContact O-CB 3.27Å; D1518-S1522 WeakPolarHBondContact O-CB 3.33Å; D1518-S1522 PolarHBondContact O-N 3.15Å
1519	K	88.1	Confident	85.7	Confident	139.8 Å²	139.8	87 Å²	87	61%	0.608	47%	0.474	S	S	*	.	H	α-helix	trans	-62.3	-42.1	172.6	-176.6	175.8	173.6	-170.3	0	111.9	A1515 E1516 N1517 S1522 A1523	A1515-K1519 VanDerWaalsContact O-CB 3.26Å; A1515-K1519 WeakPolarHBondContact O-CB 3.4Å; A1515-K1519 PolarHBondContact O-N 2.98Å; E1516-K1519 PolarHBondContact O-N 3.23Å; E1516-K1519 WeakPolarHBondContact OE1-CD 3.44Å; E1516-K1519 WeakPolarHBondContact OE1-CE 3.45Å; E1516-K1519 IonicContact OE1-NZ 3.05Å; E1516-K1519 PolarHBondContact OE1-NZ 3.04Å; E1516-K1519 IonicContact OE2-NZ 2.73Å; E1516-K1519 PolarHBondContact OE2-NZ 3.01Å; N1517-K1519 VanDerWaalsContact C-N 3.32Å; N1517-K1519 PolarHBondContact O-N 3.11Å; K1519-S1522 PolarHBondContact O-N 3.19Å; K1519-A1523 WeakPolarHBondContact O-CB 3.46Å; K1519-A1523 PolarHBondContact O-N 3.32Å
1520	K	90.3	Very high	86.3	Confident	118 Å²	118	84.6 Å²	84.6	51%	0.513	47%	0.471	S	S	.	.	H	α-helix	trans	-65.7	-41	174.3	-73	165.4	-172.5	163.8	0	112.2	E1516 N1517 D1518 A1523 A1524	E1516-K1520 WeakPolarHBondContact O-CB 3.45Å; E1516-K1520 VanDerWaalsContact O-CD 3.27Å; E1516-K1520 WeakPolarHBondContact O-CD 3.38Å; E1516-K1520 VanDerWaalsContact O-CG 3.28Å; E1516-K1520 WeakPolarHBondContact O-CG 3.38Å; E1516-K1520 PolarHBondContact O-N 3.03Å; E1516-K1520 VanDerWaalsContact O-N 3.15Å; E1516-K1520 VanDerWaalsContact OE1-CE 3.23Å; E1516-K1520 WeakPolarHBondContact OE1-CE 3.25Å; E1516-K1520 IonicContact OE1-NZ 2.77Å; E1516-K1520 PolarHBondContact OE1-NZ 3.2Å; E1516-K1520 WeakPolarHBondContact OE2-CE 3.45Å; E1516-K1520 IonicContact OE2-NZ 3Å; E1516-K1520 PolarHBondContact OE2-NZ 2.84Å; N1517-K1520 PolarHBondContact O-N 3.23Å; D1518-K1520 VanDerWaalsContact C-N 3.32Å; D1518-K1520 PolarHBondContact O-N 3.04Å; K1520-A1523 PolarHBondContact O-N 3.06Å; K1520-A1524 WeakPolarHBondContact O-CB 3.33Å; K1520-A1524 PolarHBondContact O-N 3.06Å; K1520-A1524 VanDerWaalsContact O-N 3.08Å
1521	A	84.5	Confident	87.2	Confident	55.2 Å²	55.2	85.9 Å²	85.9	46%	0.456	48%	0.475	S	S	.	.	H	α-helix	trans	-65.2	-40.9	175.9	0	0	0	0	0	111.9	N1517 D1518 A1524 A1525	N1517-A1521 WeakPolarHBondContact O-CB 3.38Å; N1517-A1521 PolarHBondContact O-N 3.15Å; D1518-A1521 PolarHBondContact O-N 3.02Å; A1521-A1524 PolarHBondContact O-N 3.16Å; A1521-A1525 VanDerWaalsContact O-CB 3.24Å; A1521-A1525 WeakPolarHBondContact O-CB 3.24Å; A1521-A1525 PolarHBondContact O-N 3.01Å
1522	S	86.5	Confident	87.9	Confident	54.8 Å²	54.8	82.5 Å²	82.5	38%	0.383	47%	0.468	S	S	.	.	H	α-helix	trans	-63.2	-45.3	174.4	-178.2	0	0	0	0	112	D1518 K1519 A1524 A1525 L1526	D1518-S1522 VanDerWaalsContact O-CB 3.27Å; D1518-S1522 WeakPolarHBondContact O-CB 3.33Å; D1518-S1522 PolarHBondContact O-N 3.15Å; K1519-S1522 PolarHBondContact O-N 3.19Å; S1522-A1524 VanDerWaalsContact C-N 3.3Å; S1522-A1524 PolarHBondContact O-N 3.12Å; S1522-A1525 CarbonylContact O-C 3.55Å; S1522-A1525 WeakPolarHBondContact O-CA 3.37Å; S1522-A1525 WeakPolarHBondContact O-CB 3.45Å; S1522-A1525 PolarHBondContact O-N 3.16Å; S1522-A1525 VanDerWaalsContact O-N 3.14Å; S1522-L1526 WeakPolarHBondContact O-CG 3.19Å; S1522-L1526 PolarHBondContact O-N 3.2Å
1523	A	88.8	Confident	88.3	Confident	48.8 Å²	48.8	80.3 Å²	80.3	40%	0.403	46%	0.463	S	S	.	.	H	α-helix	trans	-62	-40	175.4	0	0	0	0	0	112.5	K1519 K1520 A1525 L1526 N1527	K1519-A1523 WeakPolarHBondContact O-CB 3.46Å; K1519-A1523 PolarHBondContact O-N 3.32Å; K1520-A1523 PolarHBondContact O-N 3.06Å; A1523-A1525 VanDerWaalsContact C-N 3.34Å; A1523-A1525 PolarHBondContact O-N 3.12Å; A1523-L1526 PolarHBondContact O-N 3.11Å; A1523-N1527 PolarHBondContact O-N 3.19Å; A1523-N1527 VanDerWaalsContact O-N 3.14Å; A1523-N1527 PolarHBondContact O-ND2 3.09Å
1524	A	89.1	Confident	88.7	Confident	60.6 Å²	60.6	79.2 Å²	79.2	50%	0.501	47%	0.466	S	S	.	.	H	α-helix	trans	-65.7	-37	174	0	0	0	0	0	112.5	K1520 A1521 S1522 N1527 A1528	K1520-A1524 WeakPolarHBondContact O-CB 3.33Å; K1520-A1524 PolarHBondContact O-N 3.06Å; K1520-A1524 VanDerWaalsContact O-N 3.08Å; A1521-A1524 PolarHBondContact O-N 3.16Å; S1522-A1524 VanDerWaalsContact C-N 3.3Å; S1522-A1524 PolarHBondContact O-N 3.12Å; A1524-N1527 PolarHBondContact O-N 3.11Å; A1524-A1528 WeakPolarHBondContact O-CB 3.34Å; A1524-A1528 PolarHBondContact O-N 2.97Å; A1524-A1528 VanDerWaalsContact O-N 3.07Å
1525	A	87.9	Confident	89.4	Confident	43.6 Å²	43.6	81.5 Å²	81.5	36%	0.36	47%	0.469	S	S	.	.	H	α-helix	trans	-68.1	-41.6	175.7	0	0	0	0	0	112.2	A1521 S1522 A1523 N1527 A1528 V1529	A1521-A1525 VanDerWaalsContact O-CB 3.24Å; A1521-A1525 WeakPolarHBondContact O-CB 3.24Å; A1521-A1525 PolarHBondContact O-N 3.01Å; S1522-A1525 CarbonylContact O-C 3.55Å; S1522-A1525 WeakPolarHBondContact O-CA 3.37Å; S1522-A1525 WeakPolarHBondContact O-CB 3.45Å; S1522-A1525 PolarHBondContact O-N 3.16Å; S1522-A1525 VanDerWaalsContact O-N 3.14Å; A1523-A1525 VanDerWaalsContact C-N 3.34Å; A1523-A1525 PolarHBondContact O-N 3.12Å; A1525-N1527 VanDerWaalsContact C-N 3.34Å; A1525-N1527 PolarHBondContact O-N 3.03Å; A1525-A1528 CarbonylContact O-C 3.51Å; A1525-A1528 WeakPolarHBondContact O-CA 3.41Å; A1525-A1528 WeakPolarHBondContact O-CB 3.34Å; A1525-A1528 PolarHBondContact O-N 3.16Å; A1525-A1528 VanDerWaalsContact O-N 3.16Å; A1525-V1529 WeakPolarHBondContact O-CG2 3.3Å; A1525-V1529 PolarHBondContact O-N 3Å
1526	L	90.3	Very high	89.9	Confident	100.8 Å²	100.8	82.7 Å²	82.7	53%	0.528	47%	0.467	S	S	.	.	H	α-helix	trans	-59.9	-45.2	174.6	-73.1	170.7	0	0	0	111.7	S1522 A1523 A1528 V1529 S1530	S1522-L1526 WeakPolarHBondContact O-CG 3.19Å; S1522-L1526 PolarHBondContact O-N 3.2Å; A1523-L1526 PolarHBondContact O-N 3.11Å; L1526-A1528 VanDerWaalsContact C-N 3.29Å; L1526-A1528 PolarHBondContact O-N 3.14Å; L1526-V1529 PolarHBondContact O-N 3.17Å; L1526-V1529 VanDerWaalsContact O-N 3.16Å; L1526-S1530 PolarHBondContact O-N 3.19Å; L1526-S1530 PolarHBondContact O-OG 2.99Å
1527	N	91.1	Very high	90.2	Very high	121.8 Å²	121.8	84.5 Å²	84.5	65%	0.651	48%	0.476	S	S	*	.	H	α-helix	trans	-61.9	-34.2	174.8	-74.3	-29.5	0	0	0	112.6	A1523 A1524 A1525 K1531	A1523-N1527 PolarHBondContact O-N 3.19Å; A1523-N1527 VanDerWaalsContact O-N 3.14Å; A1523-N1527 PolarHBondContact O-ND2 3.09Å; A1524-N1527 PolarHBondContact O-N 3.11Å; A1525-N1527 VanDerWaalsContact C-N 3.34Å; A1525-N1527 PolarHBondContact O-N 3.03Å; N1527-K1531 WeakPolarHBondContact O-CB 3.47Å; N1527-K1531 PolarHBondContact O-N 3.18Å; N1527-K1531 VanDerWaalsContact O-N 3.12Å
1528	A	91	Very high	90.7	Very high	44.8 Å²	44.8	84.7 Å²	84.7	37%	0.37	48%	0.477	S	S	.	.	H	α-helix	trans	-71.5	-38.7	175	0	0	0	0	0	112.3	A1524 A1525 L1526 K1531 L1532	A1524-A1528 WeakPolarHBondContact O-CB 3.34Å; A1524-A1528 PolarHBondContact O-N 2.97Å; A1524-A1528 VanDerWaalsContact O-N 3.07Å; A1525-A1528 CarbonylContact O-C 3.51Å; A1525-A1528 WeakPolarHBondContact O-CA 3.41Å; A1525-A1528 WeakPolarHBondContact O-CB 3.34Å; A1525-A1528 PolarHBondContact O-N 3.16Å; A1525-A1528 VanDerWaalsContact O-N 3.16Å; L1526-A1528 VanDerWaalsContact C-N 3.29Å; L1526-A1528 PolarHBondContact O-N 3.14Å; A1528-K1531 PolarHBondContact O-N 3.04Å; A1528-L1532 WeakPolarHBondContact O-CB 3.4Å; A1528-L1532 VanDerWaalsContact O-CG 3.29Å; A1528-L1532 WeakPolarHBondContact O-CG 3.37Å; A1528-L1532 PolarHBondContact O-N 3.24Å; A1528-L1532 VanDerWaalsContact O-N 3.13Å
1529	V	90.6	Very high	91.1	Very high	56.2 Å²	56.2	83.4 Å²	83.4	34%	0.341	47%	0.469	S	S	.	.	H	α-helix	trans	-62	-51.6	174.1	170.2	0	0	0	0	110.4	A1525 L1526 K1531 L1532 E1533	A1525-V1529 WeakPolarHBondContact O-CG2 3.3Å; A1525-V1529 PolarHBondContact O-N 3Å; L1526-V1529 PolarHBondContact O-N 3.17Å; L1526-V1529 VanDerWaalsContact O-N 3.16Å; V1529-K1531 VanDerWaalsContact C-N 3.26Å; V1529-K1531 PolarHBondContact O-N 3.26Å; V1529-K1531 VanDerWaalsContact O-N 3.14Å; V1529-L1532 CarbonylContact O-C 3.56Å; V1529-L1532 WeakPolarHBondContact O-CA 3.45Å; V1529-L1532 WeakPolarHBondContact O-CB 3.39Å; V1529-L1532 PolarHBondContact O-N 3.3Å; V1529-E1533 VanDerWaalsContact CG1-CD 3.44Å; V1529-E1533 HydrophobicContact CG1-CG 4.21Å; V1529-E1533 WeakPolarHBondContact CG1-OE1 3.37Å; V1529-E1533 WeakPolarHBondContact O-CB 3.47Å; V1529-E1533 VanDerWaalsContact O-CG 3.31Å; V1529-E1533 WeakPolarHBondContact O-CG 3.35Å; V1529-E1533 PolarHBondContact O-N 3.22Å
1530	S	91.9	Very high	91.3	Very high	70 Å²	70	81.4 Å²	81.4	49%	0.49	46%	0.462	S	S	.	.	H	α-helix	trans	-60.7	-30.9	179.1	-68.8	0	0	0	0	113.3	L1526 E1533 A1534	L1526-S1530 PolarHBondContact O-N 3.19Å; L1526-S1530 PolarHBondContact O-OG 2.99Å; S1530-E1533 VanDerWaalsContact CA-OE2 3.29Å; S1530-E1533 WeakPolarHBondContact CA-OE2 3.44Å; S1530-E1533 PolarHBondContact O-N 3.06Å; S1530-E1533 PolarHBondContact OG-OE2 3.33Å; S1530-A1534 PolarHBondContact O-N 3.31Å; S1530-A1534 VanDerWaalsContact O-N 3.11Å
1531	K	93.2	Very high	91.6	Very high	149 Å²	149	81.3 Å²	81.3	65%	0.648	46%	0.462	S	S	*	.	H	α-helix	trans	-69.1	-41	172	-173.2	-178.7	175.8	-174.2	0	112.3	N1527 A1528 V1529 E1533 A1534 E1535	N1527-K1531 WeakPolarHBondContact O-CB 3.47Å; N1527-K1531 PolarHBondContact O-N 3.18Å; N1527-K1531 VanDerWaalsContact O-N 3.12Å; A1528-K1531 PolarHBondContact O-N 3.04Å; V1529-K1531 VanDerWaalsContact C-N 3.26Å; V1529-K1531 PolarHBondContact O-N 3.26Å; V1529-K1531 VanDerWaalsContact O-N 3.14Å; K1531-E1533 VanDerWaalsContact C-N 3.35Å; K1531-A1534 PolarHBondContact O-N 3.17Å; K1531-E1535 PolarHBondContact O-N 2.96Å; K1531-E1535 VanDerWaalsContact O-N 3.1Å
1532	L	92.3	Very high	92	Very high	82.2 Å²	82.2	84.7 Å²	84.7	43%	0.43	46%	0.463	S	S	.	.	H	α-helix	trans	-69.5	-37.4	177.3	-71.6	169	0	0	0	111.8	A1528 V1529 A1534 E1535 I1536	A1528-L1532 WeakPolarHBondContact O-CB 3.4Å; A1528-L1532 VanDerWaalsContact O-CG 3.29Å; A1528-L1532 WeakPolarHBondContact O-CG 3.37Å; A1528-L1532 PolarHBondContact O-N 3.24Å; A1528-L1532 VanDerWaalsContact O-N 3.13Å; V1529-L1532 CarbonylContact O-C 3.56Å; V1529-L1532 WeakPolarHBondContact O-CA 3.45Å; V1529-L1532 WeakPolarHBondContact O-CB 3.39Å; V1529-L1532 PolarHBondContact O-N 3.3Å; L1532-A1534 VanDerWaalsContact C-N 3.34Å; L1532-A1534 PolarHBondContact O-N 2.92Å; L1532-E1535 CarbonylContact O-C 3.5Å; L1532-E1535 WeakPolarHBondContact O-CA 3.35Å; L1532-E1535 PolarHBondContact O-N 3.19Å; L1532-E1535 VanDerWaalsContact O-N 3.15Å; L1532-I1536 WeakPolarHBondContact O-CB 3.38Å; L1532-I1536 WeakPolarHBondContact O-CD1 3.49Å; L1532-I1536 VanDerWaalsContact O-CG1 3.29Å; L1532-I1536 WeakPolarHBondContact O-CG1 3.25Å; L1532-I1536 PolarHBondContact O-N 3.11Å
1533	E	93.6	Very high	92.4	Very high	110.8 Å²	110.8	86.2 Å²	86.2	52%	0.518	46%	0.463	S	S	.	.	H	α-helix	trans	-59.6	-45.5	173.7	-70.8	170.3	156.7	0	0	111.2	V1529 S1530 K1531 E1535 I1536 E1537	V1529-E1533 VanDerWaalsContact CG1-CD 3.44Å; V1529-E1533 HydrophobicContact CG1-CG 4.21Å; V1529-E1533 WeakPolarHBondContact CG1-OE1 3.37Å; V1529-E1533 WeakPolarHBondContact O-CB 3.47Å; V1529-E1533 VanDerWaalsContact O-CG 3.31Å; V1529-E1533 WeakPolarHBondContact O-CG 3.35Å; V1529-E1533 PolarHBondContact O-N 3.22Å; S1530-E1533 VanDerWaalsContact CA-OE2 3.29Å; S1530-E1533 WeakPolarHBondContact CA-OE2 3.44Å; S1530-E1533 PolarHBondContact O-N 3.06Å; S1530-E1533 PolarHBondContact OG-OE2 3.33Å; K1531-E1533 VanDerWaalsContact C-N 3.35Å; E1533-E1535 VanDerWaalsContact C-N 3.32Å; E1533-E1535 PolarHBondContact O-N 3.03Å; E1533-I1536 PolarHBondContact O-N 3.03Å; E1533-E1537 WeakPolarHBondContact O-CB 3.42Å; E1533-E1537 PolarHBondContact O-N 3.22Å
1534	A	93.3	Very high	92.7	Very high	56.6 Å²	56.6	88 Å²	88	47%	0.468	47%	0.466	S	S	.	.	H	α-helix	trans	-65.5	-32.2	174.4	0	0	0	0	0	113.4	S1530 K1531 L1532 N1538	S1530-A1534 PolarHBondContact O-N 3.31Å; S1530-A1534 VanDerWaalsContact O-N 3.11Å; K1531-A1534 PolarHBondContact O-N 3.17Å; L1532-A1534 VanDerWaalsContact C-N 3.34Å; L1532-A1534 PolarHBondContact O-N 2.92Å; A1534-N1538 WeakPolarHBondContact O-CB 3.35Å; A1534-N1538 PolarHBondContact O-N 3.21Å; A1534-N1538 VanDerWaalsContact O-N 3.11Å
1535	E	93.9	Very high	93	Very high	93.8 Å²	93.8	90.1 Å²	90.1	44%	0.438	47%	0.466	S	S	.	.	H	α-helix	trans	-71.5	-38.2	174	-156.3	171.4	176.5	0	0	112	K1531 L1532 E1533 N1538 L1539	K1531-E1535 PolarHBondContact O-N 2.96Å; K1531-E1535 VanDerWaalsContact O-N 3.1Å; L1532-E1535 CarbonylContact O-C 3.5Å; L1532-E1535 WeakPolarHBondContact O-CA 3.35Å; L1532-E1535 PolarHBondContact O-N 3.19Å; L1532-E1535 VanDerWaalsContact O-N 3.15Å; E1533-E1535 VanDerWaalsContact C-N 3.32Å; E1533-E1535 PolarHBondContact O-N 3.03Å; E1535-N1538 PolarHBondContact O-N 3.16Å; E1535-L1539 HydrophobicContact CG-CD1 4.29Å; E1535-L1539 WeakPolarHBondContact O-CB 3.21Å; E1535-L1539 VanDerWaalsContact O-CG 3.32Å; E1535-L1539 WeakPolarHBondContact O-CG 3.41Å; E1535-L1539 PolarHBondContact O-N 3.32Å
1536	I	94	Very high	93.3	Very high	76.2 Å²	76.2	91.5 Å²	91.5	39%	0.391	47%	0.469	S	S	.	.	H	α-helix	trans	-63.6	-48	173.9	-70.4	164	0	0	0	110.4	L1532 E1533 N1538 L1539 E1540	L1532-I1536 WeakPolarHBondContact O-CB 3.38Å; L1532-I1536 WeakPolarHBondContact O-CD1 3.49Å; L1532-I1536 VanDerWaalsContact O-CG1 3.29Å; L1532-I1536 WeakPolarHBondContact O-CG1 3.25Å; L1532-I1536 PolarHBondContact O-N 3.11Å; E1533-I1536 PolarHBondContact O-N 3.03Å; I1536-N1538 VanDerWaalsContact C-N 3.27Å; I1536-N1538 PolarHBondContact O-N 3.03Å; I1536-L1539 CarbonylContact O-C 3.35Å; I1536-L1539 WeakPolarHBondContact O-CA 3.44Å; I1536-L1539 WeakPolarHBondContact O-CB 3.28Å; I1536-L1539 PolarHBondContact O-N 3.18Å; I1536-E1540 HydrophobicContact CG2-CG 4.41Å; I1536-E1540 WeakPolarHBondContact O-CB 3.27Å; I1536-E1540 WeakPolarHBondContact O-CG 3.2Å; I1536-E1540 PolarHBondContact O-N 2.93Å
1537	E	94	Very high	93.6	Very high	102 Å²	102	89.5 Å²	89.5	48%	0.477	46%	0.461	S	S	.	.	H	α-helix	trans	-59.5	-37	178.2	-161	-149.5	169.4	0	0	111.8	E1533 E1540 K1541	E1533-E1537 WeakPolarHBondContact O-CB 3.42Å; E1533-E1537 PolarHBondContact O-N 3.22Å; E1537-E1540 PolarHBondContact O-N 3.02Å; E1537-K1541 WeakPolarHBondContact O-CB 3.37Å; E1537-K1541 WeakPolarHBondContact O-CD 3.25Å; E1537-K1541 VanDerWaalsContact O-CG 3.25Å; E1537-K1541 WeakPolarHBondContact O-CG 3.41Å; E1537-K1541 PolarHBondContact O-N 3.23Å; E1537-K1541 VanDerWaalsContact OE1-CE 3.26Å; E1537-K1541 WeakPolarHBondContact OE1-CE 3.42Å; E1537-K1541 IonicContact OE1-NZ 2.68Å; E1537-K1541 PolarHBondContact OE1-NZ 3.03Å; E1537-K1541 WeakPolarHBondContact OE2-CE 3.49Å; E1537-K1541 IonicContact OE2-NZ 2.79Å; E1537-K1541 PolarHBondContact OE2-NZ 3.06Å
1538	N	94.9	Very high	93.7	Very high	91.2 Å²	91.2	89.9 Å²	89.9	49%	0.488	46%	0.459	S	S	.	.	H	α-helix	trans	-70.4	-38.6	174.8	-173.4	9	0	0	0	112.6	A1534 E1535 I1536 K1541 R1542	A1534-N1538 WeakPolarHBondContact O-CB 3.35Å; A1534-N1538 PolarHBondContact O-N 3.21Å; A1534-N1538 VanDerWaalsContact O-N 3.11Å; E1535-N1538 PolarHBondContact O-N 3.16Å; I1536-N1538 VanDerWaalsContact C-N 3.27Å; I1536-N1538 PolarHBondContact O-N 3.03Å; N1538-K1541 PolarHBondContact O-N 3.12Å; N1538-R1542 WeakPolarHBondContact O-CG 3.37Å; N1538-R1542 PolarHBondContact O-N 3.29Å; N1538-R1542 VanDerWaalsContact O-N 3.12Å; N1538-R1542 PolarHBondContact O-NE 3.35Å; N1538-R1542 PolarHBondContact OD1-NE 3.14Å
1539	L	93.3	Very high	93.9	Very high	74.4 Å²	74.4	95 Å²	95	39%	0.39	47%	0.469	S	S	.	.	H	α-helix	trans	-64.7	-40.9	173	-79.4	164.3	0	0	0	111.8	E1535 I1536 R1542 H1543	E1535-L1539 HydrophobicContact CG-CD1 4.29Å; E1535-L1539 WeakPolarHBondContact O-CB 3.21Å; E1535-L1539 VanDerWaalsContact O-CG 3.32Å; E1535-L1539 WeakPolarHBondContact O-CG 3.41Å; E1535-L1539 PolarHBondContact O-N 3.32Å; I1536-L1539 CarbonylContact O-C 3.35Å; I1536-L1539 WeakPolarHBondContact O-CA 3.44Å; I1536-L1539 WeakPolarHBondContact O-CB 3.28Å; I1536-L1539 PolarHBondContact O-N 3.18Å; L1539-R1542 VanDerWaalsContact CD2-NH2 3.3Å; L1539-R1542 PolarHBondContact O-N 3.2Å; L1539-H1543 WeakPolarHBondContact O-CB 3.42Å; L1539-H1543 PolarHBondContact O-N 3.16Å
1540	E	93.8	Very high	94.1	Very high	99.2 Å²	99.2	97.2 Å²	97.2	46%	0.464	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-42.3	176	-72.8	-177.2	166.4	0	0	111.9	I1536 E1537 R1542 H1543 N1544	I1536-E1540 HydrophobicContact CG2-CG 4.41Å; I1536-E1540 WeakPolarHBondContact O-CB 3.27Å; I1536-E1540 WeakPolarHBondContact O-CG 3.2Å; I1536-E1540 PolarHBondContact O-N 2.93Å; E1537-E1540 PolarHBondContact O-N 3.02Å; E1540-R1542 VanDerWaalsContact C-N 3.31Å; E1540-R1542 PolarHBondContact O-N 3.34Å; E1540-H1543 WeakPolarHBondContact O-CB 3.44Å; E1540-H1543 PolarHBondContact O-N 3.1Å; E1540-H1543 VanDerWaalsContact O-N 3.15Å; E1540-N1544 WeakPolarHBondContact O-CB 3.31Å; E1540-N1544 VanDerWaalsContact O-CG 3.26Å; E1540-N1544 PolarHBondContact O-N 3.26Å; E1540-N1544 PolarHBondContact O-ND2 3.08Å
1541	K	94.9	Very high	94.2	Very high	114.6 Å²	114.6	97.8 Å²	97.8	50%	0.498	48%	0.479	S	S	.	.	H	α-helix	trans	-56.6	-45.7	172.1	-74.9	165.9	-174	168.5	0	111.6	E1537 N1538 H1543 N1544 E1545	E1537-K1541 WeakPolarHBondContact O-CB 3.37Å; E1537-K1541 WeakPolarHBondContact O-CD 3.25Å; E1537-K1541 VanDerWaalsContact O-CG 3.25Å; E1537-K1541 WeakPolarHBondContact O-CG 3.41Å; E1537-K1541 PolarHBondContact O-N 3.23Å; E1537-K1541 VanDerWaalsContact OE1-CE 3.26Å; E1537-K1541 WeakPolarHBondContact OE1-CE 3.42Å; E1537-K1541 IonicContact OE1-NZ 2.68Å; E1537-K1541 PolarHBondContact OE1-NZ 3.03Å; E1537-K1541 WeakPolarHBondContact OE2-CE 3.49Å; E1537-K1541 IonicContact OE2-NZ 2.79Å; E1537-K1541 PolarHBondContact OE2-NZ 3.06Å; N1538-K1541 PolarHBondContact O-N 3.12Å; K1541-H1543 PolarHBondContact O-N 2.88Å; K1541-N1544 PolarHBondContact O-N 3.1Å; K1541-E1545 WeakPolarHBondContact O-CG 3.39Å; K1541-E1545 PolarHBondContact O-N 2.98Å; K1541-E1545 VanDerWaalsContact O-N 3.1Å
1542	R	93.9	Very high	94.2	Very high	127 Å²	127	94.4 Å²	94.4	48%	0.479	47%	0.471	S	S	.	.	H	α-helix	trans	-68.7	-36.9	176.6	-87	-177.5	-75	138.9	-6	113.2	N1538 L1539 E1540 N1544 E1545 V1546	N1538-R1542 WeakPolarHBondContact O-CG 3.37Å; N1538-R1542 PolarHBondContact O-N 3.29Å; N1538-R1542 VanDerWaalsContact O-N 3.12Å; N1538-R1542 PolarHBondContact O-NE 3.35Å; N1538-R1542 PolarHBondContact OD1-NE 3.14Å; L1539-R1542 VanDerWaalsContact CD2-NH2 3.3Å; L1539-R1542 PolarHBondContact O-N 3.2Å; E1540-R1542 VanDerWaalsContact C-N 3.31Å; E1540-R1542 PolarHBondContact O-N 3.34Å; R1542-N1544 VanDerWaalsContact C-N 3.35Å; R1542-N1544 PolarHBondContact O-N 2.94Å; R1542-E1545 WeakPolarHBondContact O-CB 3.32Å; R1542-E1545 PolarHBondContact O-N 3.19Å; R1542-V1546 HydrophobicContact CG-CG2 4.39Å; R1542-V1546 VanDerWaalsContact O-CG2 3.3Å; R1542-V1546 WeakPolarHBondContact O-CG2 3.26Å; R1542-V1546 PolarHBondContact O-N 3.09Å; R1542-V1546 VanDerWaalsContact O-N 3.08Å
1543	H	94.9	Very high	94.4	Very high	86.6 Å²	86.6	94.4 Å²	94.4	40%	0.401	47%	0.471	S	S	.	.	H	α-helix	trans	-60.8	-47.1	173.7	175.3	-99.1	0	0	0	110.7	L1539 E1540 K1541 E1545 V1546 V1547	L1539-H1543 WeakPolarHBondContact O-CB 3.42Å; L1539-H1543 PolarHBondContact O-N 3.16Å; E1540-H1543 WeakPolarHBondContact O-CB 3.44Å; E1540-H1543 PolarHBondContact O-N 3.1Å; E1540-H1543 VanDerWaalsContact O-N 3.15Å; K1541-H1543 PolarHBondContact O-N 2.88Å; H1543-E1545 VanDerWaalsContact C-N 3.34Å; H1543-E1545 PolarHBondContact O-N 3.13Å; H1543-V1546 CarbonylContact O-C 3.6Å; H1543-V1546 PolarHBondContact O-N 3.22Å; H1543-V1546 VanDerWaalsContact O-N 3.11Å; H1543-V1547 WeakPolarHBondContact O-CB 3.37Å; H1543-V1547 WeakPolarHBondContact O-CG2 3.31Å; H1543-V1547 PolarHBondContact O-N 3.19Å
1544	N	95	Very high	94.4	Very high	87.2 Å²	87.2	90.9 Å²	90.9	47%	0.466	47%	0.465	S	S	.	.	H	α-helix	trans	-62.4	-38.6	177.5	-70.8	-33.1	0	0	0	112.3	E1540 K1541 R1542 V1546 V1547 Q1548	E1540-N1544 WeakPolarHBondContact O-CB 3.31Å; E1540-N1544 VanDerWaalsContact O-CG 3.26Å; E1540-N1544 PolarHBondContact O-N 3.26Å; E1540-N1544 PolarHBondContact O-ND2 3.08Å; K1541-N1544 PolarHBondContact O-N 3.1Å; R1542-N1544 VanDerWaalsContact C-N 3.35Å; R1542-N1544 PolarHBondContact O-N 2.94Å; N1544-V1546 VanDerWaalsContact C-N 3.34Å; N1544-V1546 PolarHBondContact O-N 3.39Å; N1544-V1547 PolarHBondContact O-N 3.09Å; N1544-Q1548 WeakPolarHBondContact O-CB 3.43Å; N1544-Q1548 VanDerWaalsContact O-CG 3.3Å; N1544-Q1548 WeakPolarHBondContact O-CG 3.33Å; N1544-Q1548 PolarHBondContact O-N 2.92Å
1545	E	95	Very high	94.5	Very high	105 Å²	105	92.2 Å²	92.2	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-62	-43.9	172.4	-149.1	-164.8	162.2	0	0	112.2	K1541 R1542 H1543 V1547 Q1548 R1549	K1541-E1545 WeakPolarHBondContact O-CG 3.39Å; K1541-E1545 PolarHBondContact O-N 2.98Å; K1541-E1545 VanDerWaalsContact O-N 3.1Å; R1542-E1545 WeakPolarHBondContact O-CB 3.32Å; R1542-E1545 PolarHBondContact O-N 3.19Å; H1543-E1545 VanDerWaalsContact C-N 3.34Å; H1543-E1545 PolarHBondContact O-N 3.13Å; E1545-V1547 VanDerWaalsContact C-N 3.32Å; E1545-V1547 PolarHBondContact O-N 3.46Å; E1545-Q1548 PolarHBondContact O-N 3.12Å; E1545-R1549 WeakPolarHBondContact O-CB 3.05Å; E1545-R1549 VanDerWaalsContact O-CG 3.3Å; E1545-R1549 WeakPolarHBondContact O-CG 3.44Å; E1545-R1549 PolarHBondContact O-N 3.23Å; E1545-R1549 IonicContact OE1-CZ 3.36Å; E1545-R1549 IonicContact OE1-NE 2.85Å; E1545-R1549 PolarHBondContact OE1-NE 3.23Å; E1545-R1549 IonicContact OE1-NH2 2.96Å; E1545-R1549 PolarHBondContact OE1-NH2 2.84Å
1546	V	95.1	Very high	94.5	Very high	71.2 Å²	71.2	93.1 Å²	93.1	43%	0.432	47%	0.471	S	S	.	.	H	α-helix	trans	-65.8	-39.9	177.6	171.4	0	0	0	0	111.3	R1542 H1543 N1544 R1549 L1550	R1542-V1546 HydrophobicContact CG-CG2 4.39Å; R1542-V1546 VanDerWaalsContact O-CG2 3.3Å; R1542-V1546 WeakPolarHBondContact O-CG2 3.26Å; R1542-V1546 PolarHBondContact O-N 3.09Å; R1542-V1546 VanDerWaalsContact O-N 3.08Å; H1543-V1546 CarbonylContact O-C 3.6Å; H1543-V1546 PolarHBondContact O-N 3.22Å; H1543-V1546 VanDerWaalsContact O-N 3.11Å; N1544-V1546 VanDerWaalsContact C-N 3.34Å; N1544-V1546 PolarHBondContact O-N 3.39Å; V1546-R1549 WeakPolarHBondContact O-CB 3.15Å; V1546-R1549 PolarHBondContact O-N 3.14Å; V1546-L1550 HydrophobicContact CG1-CD1 4.14Å; V1546-L1550 WeakPolarHBondContact O-CB 3.32Å; V1546-L1550 WeakPolarHBondContact O-CG 3.45Å; V1546-L1550 PolarHBondContact O-N 3.19Å
1547	V	95.4	Very high	94.5	Very high	58.8 Å²	58.8	91.2 Å²	91.2	36%	0.356	47%	0.467	S	S	.	.	H	α-helix	trans	-63.8	-44.1	174.2	171	0	0	0	0	111	H1543 N1544 E1545 R1549 L1550 T1551	H1543-V1547 WeakPolarHBondContact O-CB 3.37Å; H1543-V1547 WeakPolarHBondContact O-CG2 3.31Å; H1543-V1547 PolarHBondContact O-N 3.19Å; N1544-V1547 PolarHBondContact O-N 3.09Å; E1545-V1547 VanDerWaalsContact C-N 3.32Å; E1545-V1547 PolarHBondContact O-N 3.46Å; V1547-R1549 VanDerWaalsContact C-N 3.3Å; V1547-R1549 PolarHBondContact O-N 3.02Å; V1547-L1550 WeakPolarHBondContact O-CA 3.5Å; V1547-L1550 WeakPolarHBondContact O-CB 3.43Å; V1547-L1550 PolarHBondContact O-N 3.12Å; V1547-L1550 VanDerWaalsContact O-N 3.12Å; V1547-T1551 HydrophobicContact CG1-CG2 4.48Å; V1547-T1551 WeakPolarHBondContact O-CG2 3.33Å; V1547-T1551 PolarHBondContact O-N 3.11Å; V1547-T1551 PolarHBondContact O-OG1 2.93Å; V1547-T1551 VanDerWaalsContact O-OG1 3.08Å
1548	Q	94.5	Very high	94.4	Very high	131.4 Å²	131.4	91.7 Å²	91.7	61%	0.614	47%	0.469	S	S	*	.	H	α-helix	trans	-61.2	-43.3	174.9	-87.3	176.1	19.6	0	0	111.7	N1544 E1545 L1550 T1551 T1552	N1544-Q1548 WeakPolarHBondContact O-CB 3.43Å; N1544-Q1548 VanDerWaalsContact O-CG 3.3Å; N1544-Q1548 WeakPolarHBondContact O-CG 3.33Å; N1544-Q1548 PolarHBondContact O-N 2.92Å; E1545-Q1548 PolarHBondContact O-N 3.12Å; Q1548-L1550 VanDerWaalsContact C-N 3.31Å; Q1548-L1550 PolarHBondContact O-N 3.02Å; Q1548-T1551 WeakPolarHBondContact CA-OG1 3.25Å; Q1548-T1551 PolarHBondContact O-N 2.98Å; Q1548-T1551 VanDerWaalsContact O-N 3.09Å; Q1548-T1551 PolarHBondContact O-OG1 3.26Å; Q1548-T1552 WeakPolarHBondContact O-CB 3.49Å; Q1548-T1552 WeakPolarHBondContact O-CG2 3.37Å; Q1548-T1552 PolarHBondContact O-N 3.12Å; Q1548-T1552 VanDerWaalsContact O-N 3.09Å; Q1548-T1552 PolarHBondContact O-OG1 3.06Å
1549	R	94.8	Very high	94.3	Very high	151.6 Å²	151.6	93.7 Å²	93.7	57%	0.572	48%	0.476	S	S	*	.	H	α-helix	trans	-62.3	-35.8	173.7	-107.6	174	179.5	-145.1	6	112.5	E1545 V1546 V1547 T1552 L1553	E1545-R1549 WeakPolarHBondContact O-CB 3.05Å; E1545-R1549 VanDerWaalsContact O-CG 3.3Å; E1545-R1549 WeakPolarHBondContact O-CG 3.44Å; E1545-R1549 PolarHBondContact O-N 3.23Å; E1545-R1549 IonicContact OE1-CZ 3.36Å; E1545-R1549 IonicContact OE1-NE 2.85Å; E1545-R1549 PolarHBondContact OE1-NE 3.23Å; E1545-R1549 IonicContact OE1-NH2 2.96Å; E1545-R1549 PolarHBondContact OE1-NH2 2.84Å; V1546-R1549 WeakPolarHBondContact O-CB 3.15Å; V1546-R1549 PolarHBondContact O-N 3.14Å; V1547-R1549 VanDerWaalsContact C-N 3.3Å; V1547-R1549 PolarHBondContact O-N 3.02Å; R1549-T1552 WeakPolarHBondContact CA-OG1 3.39Å; R1549-T1552 PolarHBondContact O-OG1 3.3Å; R1549-T1552 VanDerWaalsContact O-OG1 3.07Å; R1549-L1553 HydrophobicContact CG-CD1 4.29Å; R1549-L1553 WeakPolarHBondContact O-CB 3.37Å; R1549-L1553 WeakPolarHBondContact O-CD1 3.36Å; R1549-L1553 VanDerWaalsContact O-CG 3.26Å; R1549-L1553 WeakPolarHBondContact O-CG 3.39Å; R1549-L1553 PolarHBondContact O-N 3.33Å; R1549-L1553 VanDerWaalsContact O-N 3.09Å
1550	L	94.3	Very high	94.3	Very high	102 Å²	102	92.6 Å²	92.6	53%	0.534	48%	0.477	S	S	.	.	H	α-helix	trans	-70.7	-39.8	176.6	-157.6	78.2	0	0	0	112	V1546 V1547 Q1548 G1554	V1546-L1550 HydrophobicContact CG1-CD1 4.14Å; V1546-L1550 WeakPolarHBondContact O-CB 3.32Å; V1546-L1550 WeakPolarHBondContact O-CG 3.45Å; V1546-L1550 PolarHBondContact O-N 3.19Å; V1547-L1550 WeakPolarHBondContact O-CA 3.5Å; V1547-L1550 WeakPolarHBondContact O-CB 3.43Å; V1547-L1550 PolarHBondContact O-N 3.12Å; V1547-L1550 VanDerWaalsContact O-N 3.12Å; Q1548-L1550 VanDerWaalsContact C-N 3.31Å; Q1548-L1550 PolarHBondContact O-N 3.02Å; L1550-G1554 PolarHBondContact O-N 3.18Å
1551	T	93.7	Very high	94.2	Very high	83.4 Å²	83.4	96 Å²	96	51%	0.512	49%	0.486	S	S	.	.	H	α-helix	trans	-66.4	-42.6	175.4	44.4	0	0	0	0	111.8	V1547 Q1548 G1554 T1555	V1547-T1551 HydrophobicContact CG1-CG2 4.48Å; V1547-T1551 WeakPolarHBondContact O-CG2 3.33Å; V1547-T1551 PolarHBondContact O-N 3.11Å; V1547-T1551 PolarHBondContact O-OG1 2.93Å; V1547-T1551 VanDerWaalsContact O-OG1 3.08Å; Q1548-T1551 WeakPolarHBondContact CA-OG1 3.25Å; Q1548-T1551 PolarHBondContact O-N 2.98Å; Q1548-T1551 VanDerWaalsContact O-N 3.09Å; Q1548-T1551 PolarHBondContact O-OG1 3.26Å; T1551-G1554 WeakPolarHBondContact O-CA 3.34Å; T1551-G1554 PolarHBondContact O-N 3.22Å; T1551-G1554 VanDerWaalsContact O-N 3.15Å; T1551-T1555 WeakPolarHBondContact O-CG2 3.24Å; T1551-T1555 PolarHBondContact O-N 3.28Å
1552	T	94.6	Very high	94.2	Very high	78 Å²	78	93.9 Å²	93.9	48%	0.479	48%	0.483	S	S	.	.	H	α-helix	trans	-63.2	-46.7	176	51.8	0	0	0	0	111.7	Q1548 R1549 G1554 T1555 E1556	Q1548-T1552 WeakPolarHBondContact O-CB 3.49Å; Q1548-T1552 WeakPolarHBondContact O-CG2 3.37Å; Q1548-T1552 PolarHBondContact O-N 3.12Å; Q1548-T1552 VanDerWaalsContact O-N 3.09Å; Q1548-T1552 PolarHBondContact O-OG1 3.06Å; R1549-T1552 WeakPolarHBondContact CA-OG1 3.39Å; R1549-T1552 PolarHBondContact O-OG1 3.3Å; R1549-T1552 VanDerWaalsContact O-OG1 3.07Å; T1552-G1554 VanDerWaalsContact C-N 3.27Å; T1552-G1554 PolarHBondContact O-N 2.93Å; T1552-T1555 PolarHBondContact O-N 3.11Å; T1552-T1555 VanDerWaalsContact O-N 3.12Å; T1552-T1555 PolarHBondContact O-OG1 3.16Å; T1552-E1556 WeakPolarHBondContact O-CG 3.01Å; T1552-E1556 PolarHBondContact O-N 3.1Å
1553	L	94.7	Very high	94.1	Very high	80.4 Å²	80.4	90.1 Å²	90.1	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-33.5	173.1	-73.2	170.3	0	0	0	112.5	R1549 E1556 A1557	R1549-L1553 HydrophobicContact CG-CD1 4.29Å; R1549-L1553 WeakPolarHBondContact O-CB 3.37Å; R1549-L1553 WeakPolarHBondContact O-CD1 3.36Å; R1549-L1553 VanDerWaalsContact O-CG 3.26Å; R1549-L1553 WeakPolarHBondContact O-CG 3.39Å; R1549-L1553 PolarHBondContact O-N 3.33Å; R1549-L1553 VanDerWaalsContact O-N 3.09Å; L1553-E1556 PolarHBondContact O-N 2.93Å; L1553-A1557 VanDerWaalsContact O-CB 3.28Å; L1553-A1557 WeakPolarHBondContact O-CB 3.38Å; L1553-A1557 PolarHBondContact O-N 2.99Å
1554	G	95	Very high	94	Very high	38.8 Å²	38.8	92.6 Å²	92.6	40%	0.4	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-46.5	172.5	0	0	0	0	0	112.5	L1550 T1551 T1552 A1557 Q1558	L1550-G1554 PolarHBondContact O-N 3.18Å; T1551-G1554 WeakPolarHBondContact O-CA 3.34Å; T1551-G1554 PolarHBondContact O-N 3.22Å; T1551-G1554 VanDerWaalsContact O-N 3.15Å; T1552-G1554 VanDerWaalsContact C-N 3.27Å; T1552-G1554 PolarHBondContact O-N 2.93Å; G1554-A1557 PolarHBondContact O-N 3.11Å; G1554-Q1558 WeakPolarHBondContact O-CB 3.48Å; G1554-Q1558 PolarHBondContact O-N 3.1Å; G1554-Q1558 VanDerWaalsContact O-N 3.11Å
1555	T	94.2	Very high	93.8	Very high	83.4 Å²	83.4	91.3 Å²	91.3	51%	0.512	49%	0.49	S	S	.	.	H	α-helix	trans	-67.2	-40	176	61.6	0	0	0	0	112.3	T1551 T1552 A1557 Q1558 Q1559	T1551-T1555 WeakPolarHBondContact O-CG2 3.24Å; T1551-T1555 PolarHBondContact O-N 3.28Å; T1552-T1555 PolarHBondContact O-N 3.11Å; T1552-T1555 VanDerWaalsContact O-N 3.12Å; T1552-T1555 PolarHBondContact O-OG1 3.16Å; T1555-A1557 PolarHBondContact O-N 3Å; T1555-Q1558 WeakPolarHBondContact O-CB 3.47Å; T1555-Q1558 PolarHBondContact O-N 2.97Å; T1555-Q1558 VanDerWaalsContact O-N 3.14Å; T1555-Q1559 WeakPolarHBondContact O-CB 3.38Å; T1555-Q1559 VanDerWaalsContact O-CG 3.31Å; T1555-Q1559 WeakPolarHBondContact O-CG 3.36Å; T1555-Q1559 PolarHBondContact O-N 3.17Å
1556	E	94.5	Very high	93.7	Very high	112.8 Å²	112.8	92.9 Å²	92.9	53%	0.527	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-44.6	174.8	-154.3	-173.4	171.2	0	0	111.2	T1552 L1553 Q1558 Q1559 A1560	T1552-E1556 WeakPolarHBondContact O-CG 3.01Å; T1552-E1556 PolarHBondContact O-N 3.1Å; L1553-E1556 PolarHBondContact O-N 2.93Å; E1556-Q1558 VanDerWaalsContact C-N 3.28Å; E1556-Q1558 PolarHBondContact O-N 3.19Å; E1556-Q1559 CarbonylContact O-C 3.55Å; E1556-Q1559 PolarHBondContact O-N 3.09Å; E1556-Q1559 VanDerWaalsContact O-N 3.16Å; E1556-A1560 WeakPolarHBondContact O-CB 3.3Å; E1556-A1560 PolarHBondContact O-N 3.34Å
1557	A	93.7	Very high	93.4	Very high	35.4 Å²	35.4	91.6 Å²	91.6	29%	0.293	49%	0.494	S	S	.	.	H	α-helix	trans	-62.6	-35	175.6	0	0	0	0	0	112.2	L1553 G1554 T1555 R1561	L1553-A1557 VanDerWaalsContact O-CB 3.28Å; L1553-A1557 WeakPolarHBondContact O-CB 3.38Å; L1553-A1557 PolarHBondContact O-N 2.99Å; G1554-A1557 PolarHBondContact O-N 3.11Å; T1555-A1557 PolarHBondContact O-N 3Å; A1557-R1561 WeakPolarHBondContact O-CB 3.39Å; A1557-R1561 WeakPolarHBondContact O-CD 3.34Å; A1557-R1561 VanDerWaalsContact O-CG 3.31Å; A1557-R1561 WeakPolarHBondContact O-CG 3.34Å; A1557-R1561 PolarHBondContact O-N 3.09Å; A1557-R1561 VanDerWaalsContact O-N 3.11Å
1558	Q	92.1	Very high	93.2	Very high	113.4 Å²	113.4	92.2 Å²	92.2	53%	0.53	50%	0.498	S	S	.	.	H	α-helix	trans	-71.6	-39.6	174.7	-173	123.6	-27	0	0	112	G1554 T1555 E1556 A1560 R1561 T1562	G1554-Q1558 WeakPolarHBondContact O-CB 3.48Å; G1554-Q1558 PolarHBondContact O-N 3.1Å; G1554-Q1558 VanDerWaalsContact O-N 3.11Å; T1555-Q1558 WeakPolarHBondContact O-CB 3.47Å; T1555-Q1558 PolarHBondContact O-N 2.97Å; T1555-Q1558 VanDerWaalsContact O-N 3.14Å; E1556-Q1558 VanDerWaalsContact C-N 3.28Å; E1556-Q1558 PolarHBondContact O-N 3.19Å; Q1558-A1560 VanDerWaalsContact C-N 3.32Å; Q1558-A1560 PolarHBondContact O-N 2.96Å; Q1558-R1561 WeakPolarHBondContact O-CB 3.47Å; Q1558-R1561 PolarHBondContact O-N 3.19Å; Q1558-R1561 VanDerWaalsContact O-N 3.14Å; Q1558-T1562 WeakPolarHBondContact O-CG2 3.44Å; Q1558-T1562 PolarHBondContact O-N 3.06Å; Q1558-T1562 PolarHBondContact O-OG1 3.17Å
1559	Q	93.1	Very high	93	Very high	133 Å²	133	92.8 Å²	92.8	62%	0.621	50%	0.498	S	S	*	.	H	α-helix	trans	-63.6	-41.9	172.5	-107.6	178.6	15.5	0	0	111.7	T1555 E1556 R1561 T1562 A1563	T1555-Q1559 WeakPolarHBondContact O-CB 3.38Å; T1555-Q1559 VanDerWaalsContact O-CG 3.31Å; T1555-Q1559 WeakPolarHBondContact O-CG 3.36Å; T1555-Q1559 PolarHBondContact O-N 3.17Å; E1556-Q1559 CarbonylContact O-C 3.55Å; E1556-Q1559 PolarHBondContact O-N 3.09Å; E1556-Q1559 VanDerWaalsContact O-N 3.16Å; Q1559-R1561 VanDerWaalsContact C-N 3.32Å; Q1559-R1561 PolarHBondContact O-N 3.09Å; Q1559-T1562 VanDerWaalsContact CA-OG1 3.28Å; Q1559-T1562 WeakPolarHBondContact CA-OG1 3.36Å; Q1559-T1562 PolarHBondContact O-N 3.13Å; Q1559-T1562 PolarHBondContact O-OG1 3.08Å; Q1559-A1563 VanDerWaalsContact O-CB 3.26Å; Q1559-A1563 WeakPolarHBondContact O-CB 3.4Å; Q1559-A1563 PolarHBondContact O-N 3.15Å
1560	A	93.2	Very high	92.5	Very high	50.8 Å²	50.8	88 Å²	88	42%	0.42	49%	0.491	S	S	.	.	H	α-helix	trans	-64.1	-37.6	174.9	0	0	0	0	0	112.2	E1556 Q1558 K1564	E1556-A1560 WeakPolarHBondContact O-CB 3.3Å; E1556-A1560 PolarHBondContact O-N 3.34Å; Q1558-A1560 VanDerWaalsContact C-N 3.32Å; Q1558-A1560 PolarHBondContact O-N 2.96Å; A1560-K1564 VanDerWaalsContact O-CB 3.28Å; A1560-K1564 WeakPolarHBondContact O-CB 3.33Å; A1560-K1564 PolarHBondContact O-N 3.01Å
1561	R	92	Very high	92.2	Very high	170.6 Å²	170.6	89.6 Å²	89.6	64%	0.644	49%	0.494	S	S	*	.	H	α-helix	trans	-65.4	-44.7	173.3	-74.1	168.9	-165	-162.9	4.9	112	A1557 Q1558 Q1559 K1564 A1565	A1557-R1561 WeakPolarHBondContact O-CB 3.39Å; A1557-R1561 WeakPolarHBondContact O-CD 3.34Å; A1557-R1561 VanDerWaalsContact O-CG 3.31Å; A1557-R1561 WeakPolarHBondContact O-CG 3.34Å; A1557-R1561 PolarHBondContact O-N 3.09Å; A1557-R1561 VanDerWaalsContact O-N 3.11Å; Q1558-R1561 WeakPolarHBondContact O-CB 3.47Å; Q1558-R1561 PolarHBondContact O-N 3.19Å; Q1558-R1561 VanDerWaalsContact O-N 3.14Å; Q1559-R1561 VanDerWaalsContact C-N 3.32Å; Q1559-R1561 PolarHBondContact O-N 3.09Å; R1561-K1564 PolarHBondContact O-N 3.29Å; R1561-A1565 WeakPolarHBondContact O-CB 3.25Å; R1561-A1565 PolarHBondContact O-N 2.93Å
1562	T	93.8	Very high	91.7	Very high	71.2 Å²	71.2	91.5 Å²	91.5	44%	0.437	50%	0.497	S	S	.	.	H	α-helix	trans	-69.1	-41.3	178.7	51.4	0	0	0	0	111.9	Q1558 Q1559 K1564 A1565 Q1566	Q1558-T1562 WeakPolarHBondContact O-CG2 3.44Å; Q1558-T1562 PolarHBondContact O-N 3.06Å; Q1558-T1562 PolarHBondContact O-OG1 3.17Å; Q1559-T1562 VanDerWaalsContact CA-OG1 3.28Å; Q1559-T1562 WeakPolarHBondContact CA-OG1 3.36Å; Q1559-T1562 PolarHBondContact O-N 3.13Å; Q1559-T1562 PolarHBondContact O-OG1 3.08Å; T1562-K1564 VanDerWaalsContact C-N 3.34Å; T1562-K1564 PolarHBondContact O-N 3Å; T1562-A1565 PolarHBondContact O-N 2.99Å; T1562-Q1566 WeakPolarHBondContact O-CG 3.3Å; T1562-Q1566 PolarHBondContact O-N 3.14Å
1563	A	91.9	Very high	91.1	Very high	47.6 Å²	47.6	91.4 Å²	91.4	39%	0.393	50%	0.496	S	S	.	.	H	α-helix	trans	-61	-42.3	172.8	0	0	0	0	0	111.9	Q1559 A1565 Q1566 A1567	Q1559-A1563 VanDerWaalsContact O-CB 3.26Å; Q1559-A1563 WeakPolarHBondContact O-CB 3.4Å; Q1559-A1563 PolarHBondContact O-N 3.15Å; A1563-A1565 VanDerWaalsContact C-N 3.32Å; A1563-A1565 PolarHBondContact O-N 3.22Å; A1563-Q1566 WeakPolarHBondContact O-CB 3.29Å; A1563-Q1566 PolarHBondContact O-N 3.05Å; A1563-A1567 WeakPolarHBondContact O-CB 3.35Å; A1563-A1567 PolarHBondContact O-N 3.13Å
1564	K	93.6	Very high	90.2	Very high	137.6 Å²	137.6	90.5 Å²	90.5	60%	0.598	50%	0.501	S	S	*	.	H	α-helix	trans	-62.1	-41.7	173.5	-176	175.8	179.6	176.6	0	111.9	A1560 R1561 T1562 A1567 V1568	A1560-K1564 VanDerWaalsContact O-CB 3.28Å; A1560-K1564 WeakPolarHBondContact O-CB 3.33Å; A1560-K1564 PolarHBondContact O-N 3.01Å; R1561-K1564 PolarHBondContact O-N 3.29Å; T1562-K1564 VanDerWaalsContact C-N 3.34Å; T1562-K1564 PolarHBondContact O-N 3Å; K1564-A1567 PolarHBondContact O-N 3.01Å; K1564-V1568 WeakPolarHBondContact O-CB 3.33Å; K1564-V1568 VanDerWaalsContact O-CG2 3.29Å; K1564-V1568 WeakPolarHBondContact O-CG2 3.31Å; K1564-V1568 PolarHBondContact O-N 3.17Å
1565	A	91.6	Very high	88.8	Confident	60.8 Å²	60.8	95.5 Å²	95.5	50%	0.502	52%	0.517	S	S	.	.	H	α-helix	trans	-65.1	-42	175.7	0	0	0	0	0	112.2	R1561 T1562 A1563 V1568 K1569	R1561-A1565 WeakPolarHBondContact O-CB 3.25Å; R1561-A1565 PolarHBondContact O-N 2.93Å; T1562-A1565 PolarHBondContact O-N 2.99Å; A1563-A1565 VanDerWaalsContact C-N 3.32Å; A1563-A1565 PolarHBondContact O-N 3.22Å; A1565-V1568 PolarHBondContact O-N 3.23Å; A1565-K1569 VanDerWaalsContact O-CB 3.23Å; A1565-K1569 WeakPolarHBondContact O-CB 3.35Å; A1565-K1569 PolarHBondContact O-N 2.9Å
1566	Q	91.9	Very high	87.4	Confident	138 Å²	138	98.6 Å²	98.6	65%	0.645	53%	0.53	S	S	*	.	H	α-helix	trans	-61.8	-45.1	173.5	-73.3	176.4	-3	0	0	111.7	T1562 A1563 V1568 K1569 A1570	T1562-Q1566 WeakPolarHBondContact O-CG 3.3Å; T1562-Q1566 PolarHBondContact O-N 3.14Å; A1563-Q1566 WeakPolarHBondContact O-CB 3.29Å; A1563-Q1566 PolarHBondContact O-N 3.05Å; Q1566-V1568 VanDerWaalsContact C-N 3.33Å; Q1566-V1568 PolarHBondContact O-N 3.16Å; Q1566-K1569 PolarHBondContact O-N 3.09Å; Q1566-A1570 VanDerWaalsContact O-CB 3.27Å; Q1566-A1570 WeakPolarHBondContact O-CB 3.4Å; Q1566-A1570 PolarHBondContact O-N 3.13Å
1567	A	89.3	Confident	85.6	Confident	45 Å²	45	99.5 Å²	99.5	37%	0.372	54%	0.537	S	S	.	.	H	α-helix	trans	-64	-37.5	177.6	0	0	0	0	0	112.7	A1563 K1564 A1570 K1571	A1563-A1567 WeakPolarHBondContact O-CB 3.35Å; A1563-A1567 PolarHBondContact O-N 3.13Å; K1564-A1567 PolarHBondContact O-N 3.01Å; A1567-A1570 PolarHBondContact O-N 3.09Å; A1567-K1571 WeakPolarHBondContact O-CB 3.33Å; A1567-K1571 WeakPolarHBondContact O-CG 3.36Å; A1567-K1571 PolarHBondContact O-N 3.28Å; A1567-K1571 VanDerWaalsContact O-N 3.1Å
1568	V	90.4	Very high	83.4	Confident	70 Å²	70	106.8 Å²	106.8	42%	0.424	56%	0.562	S	S	.	*	H	α-helix	trans	-66.3	-44.9	172.9	169.9	0	0	0	0	110.9	K1564 A1565 Q1566 A1570 K1571 Q1572	K1564-V1568 WeakPolarHBondContact O-CB 3.33Å; K1564-V1568 VanDerWaalsContact O-CG2 3.29Å; K1564-V1568 WeakPolarHBondContact O-CG2 3.31Å; K1564-V1568 PolarHBondContact O-N 3.17Å; A1565-V1568 PolarHBondContact O-N 3.23Å; Q1566-V1568 VanDerWaalsContact C-N 3.33Å; Q1566-V1568 PolarHBondContact O-N 3.16Å; V1568-A1570 VanDerWaalsContact C-N 3.35Å; V1568-A1570 PolarHBondContact O-N 3.2Å; V1568-K1571 PolarHBondContact O-N 3.11Å; V1568-Q1572 WeakPolarHBondContact O-CG 3.38Å; V1568-Q1572 PolarHBondContact O-N 3.14Å
1569	K	89.6	Confident	81.2	Confident	145 Å²	145	107.5 Å²	107.5	63%	0.63	58%	0.577	S	S	*	*	H	α-helix	trans	-62.3	-42.3	176.5	-170.8	176.7	-179	-179.5	0	111.7	A1565 Q1566 K1571 Q1572 T1573	A1565-K1569 VanDerWaalsContact O-CB 3.23Å; A1565-K1569 WeakPolarHBondContact O-CB 3.35Å; A1565-K1569 PolarHBondContact O-N 2.9Å; Q1566-K1569 PolarHBondContact O-N 3.09Å; K1569-K1571 VanDerWaalsContact C-N 3.33Å; K1569-K1571 PolarHBondContact O-N 3.16Å; K1569-Q1572 WeakPolarHBondContact O-CB 3.4Å; K1569-Q1572 PolarHBondContact O-N 2.97Å; K1569-Q1572 VanDerWaalsContact O-N 3.16Å; K1569-T1573 PolarHBondContact O-N 3.08Å; K1569-T1573 PolarHBondContact O-OG1 3.12Å; K1569-T1573 VanDerWaalsContact O-OG1 3.11Å
1570	A	85.6	Confident	78.7	Confident	51.4 Å²	51.4	106.1 Å²	106.1	43%	0.425	58%	0.581	S	S	.	*	H	α-helix	trans	-62.1	-40.5	175.9	0	0	0	0	0	112.1	Q1566 A1567 V1568 Q1572 T1573 A1574	Q1566-A1570 VanDerWaalsContact O-CB 3.27Å; Q1566-A1570 WeakPolarHBondContact O-CB 3.4Å; Q1566-A1570 PolarHBondContact O-N 3.13Å; A1567-A1570 PolarHBondContact O-N 3.09Å; V1568-A1570 VanDerWaalsContact C-N 3.35Å; V1568-A1570 PolarHBondContact O-N 3.2Å; A1570-Q1572 PolarHBondContact O-N 3.35Å; A1570-T1573 VanDerWaalsContact CA-OG1 3.26Å; A1570-T1573 WeakPolarHBondContact CA-OG1 3.4Å; A1570-T1573 PolarHBondContact O-N 3.2Å; A1570-T1573 PolarHBondContact O-OG1 3Å; A1570-A1574 VanDerWaalsContact O-CB 3.28Å; A1570-A1574 WeakPolarHBondContact O-CB 3.44Å; A1570-A1574 PolarHBondContact O-N 3.14Å
1571	K	86.7	Confident	76.1	Confident	135.8 Å²	135.8	112.1 Å²	112.1	59%	0.59	60%	0.601	S	S	*	*	H	α-helix	trans	-64.9	-39.8	173.5	-112.1	176.3	179.6	178.4	0	112	A1567 V1568 K1569 A1574 L1575	A1567-K1571 WeakPolarHBondContact O-CB 3.33Å; A1567-K1571 WeakPolarHBondContact O-CG 3.36Å; A1567-K1571 PolarHBondContact O-N 3.28Å; A1567-K1571 VanDerWaalsContact O-N 3.1Å; V1568-K1571 PolarHBondContact O-N 3.11Å; K1569-K1571 VanDerWaalsContact C-N 3.33Å; K1569-K1571 PolarHBondContact O-N 3.16Å; K1571-A1574 PolarHBondContact O-N 3.12Å; K1571-L1575 HydrophobicContact CG-CD1 4.1Å; K1571-L1575 WeakPolarHBondContact O-CB 3.41Å; K1571-L1575 WeakPolarHBondContact O-CD1 3.11Å; K1571-L1575 VanDerWaalsContact O-CG 3.3Å; K1571-L1575 WeakPolarHBondContact O-CG 3.38Å; K1571-L1575 PolarHBondContact O-N 3.3Å; K1571-L1575 VanDerWaalsContact O-N 3.07Å
1572	Q	83.5	Confident	73.3	Confident	122.2 Å²	122.2	110.2 Å²	110.2	57%	0.571	61%	0.608	S	S	*	*	H	α-helix	trans	-64.4	-42.4	174.8	-71.9	172.5	-12.2	0	0	112.1	V1568 K1569 A1570 L1575 L1576	V1568-Q1572 WeakPolarHBondContact O-CG 3.38Å; V1568-Q1572 PolarHBondContact O-N 3.14Å; K1569-Q1572 WeakPolarHBondContact O-CB 3.4Å; K1569-Q1572 PolarHBondContact O-N 2.97Å; K1569-Q1572 VanDerWaalsContact O-N 3.16Å; A1570-Q1572 PolarHBondContact O-N 3.35Å; Q1572-L1575 PolarHBondContact O-N 3.19Å; Q1572-L1576 WeakPolarHBondContact O-CD1 3.49Å; Q1572-L1576 PolarHBondContact O-N 2.98Å; Q1572-L1576 VanDerWaalsContact O-N 3.16Å
1573	T	82.4	Confident	70.6	Confident	75.6 Å²	75.6	112.2 Å²	112.2	46%	0.464	63%	0.625	S	S	.	*	H	α-helix	trans	-69.4	-37.7	176.8	49.6	0	0	0	0	112.7	K1569 A1570 L1575 L1576 I1577	K1569-T1573 PolarHBondContact O-N 3.08Å; K1569-T1573 PolarHBondContact O-OG1 3.12Å; K1569-T1573 VanDerWaalsContact O-OG1 3.11Å; A1570-T1573 VanDerWaalsContact CA-OG1 3.26Å; A1570-T1573 WeakPolarHBondContact CA-OG1 3.4Å; A1570-T1573 PolarHBondContact O-N 3.2Å; A1570-T1573 PolarHBondContact O-OG1 3Å; T1573-L1575 VanDerWaalsContact C-N 3.3Å; T1573-L1575 PolarHBondContact O-N 3.32Å; T1573-L1576 WeakPolarHBondContact O-CB 3.44Å; T1573-L1576 PolarHBondContact O-N 3.18Å; T1573-L1576 VanDerWaalsContact O-N 3.1Å; T1573-I1577 WeakPolarHBondContact O-CG1 3.35Å; T1573-I1577 PolarHBondContact O-N 3.17Å
1574	A	75.1	Confident	67.8	Low	62 Å²	62	114.7 Å²	114.7	51%	0.512	64%	0.64	S	S	.	*	H	α-helix	trans	-63.9	-37.2	176.2	0	0	0	0	0	112.3	A1570 K1571 L1576 I1577	A1570-A1574 VanDerWaalsContact O-CB 3.28Å; A1570-A1574 WeakPolarHBondContact O-CB 3.44Å; A1570-A1574 PolarHBondContact O-N 3.14Å; K1571-A1574 PolarHBondContact O-N 3.12Å; A1574-L1576 VanDerWaalsContact C-N 3.3Å; A1574-L1576 PolarHBondContact O-N 2.86Å; A1574-I1577 PolarHBondContact O-N 3.08Å; A1574-I1577 VanDerWaalsContact O-N 3.14Å
1575	L	67.5	Low	64.9	Low	144.2 Å²	144.2	115.7 Å²	115.7	76%	0.755	65%	0.651	S	S	*	*	H	α-helix	trans	-68.6	-18.5	175.2	-73.5	168	0	0	0	113.8	K1571 Q1572 T1573	K1571-L1575 HydrophobicContact CG-CD1 4.1Å; K1571-L1575 WeakPolarHBondContact O-CB 3.41Å; K1571-L1575 WeakPolarHBondContact O-CD1 3.11Å; K1571-L1575 VanDerWaalsContact O-CG 3.3Å; K1571-L1575 WeakPolarHBondContact O-CG 3.38Å; K1571-L1575 PolarHBondContact O-N 3.3Å; K1571-L1575 VanDerWaalsContact O-N 3.07Å; Q1572-L1575 PolarHBondContact O-N 3.19Å; T1573-L1575 VanDerWaalsContact C-N 3.3Å; T1573-L1575 PolarHBondContact O-N 3.32Å
1576	L	63.2	Low	62.1	Low	147.8 Å²	147.8	118.6 Å²	118.6	77%	0.774	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-15.9	178.6	-148.5	77.8	0	0	0	112.9	Q1572 T1573 A1574 K1578	Q1572-L1576 WeakPolarHBondContact O-CD1 3.49Å; Q1572-L1576 PolarHBondContact O-N 2.98Å; Q1572-L1576 VanDerWaalsContact O-N 3.16Å; T1573-L1576 WeakPolarHBondContact O-CB 3.44Å; T1573-L1576 PolarHBondContact O-N 3.18Å; T1573-L1576 VanDerWaalsContact O-N 3.1Å; A1574-L1576 VanDerWaalsContact C-N 3.3Å; A1574-L1576 PolarHBondContact O-N 2.86Å; L1576-K1578 PolarHBondContact O-N 3.19Å; L1576-K1578 VanDerWaalsContact O-N 3.11Å
1577	I	57.8	Low	59.3	Low	133 Å²	133	120.3 Å²	120.3	68%	0.682	68%	0.675	S	S	*	*	S	Bend	trans	-96.6	94.8	178.8	-57.4	173.1	0	0	0	108.8	T1573 A1574 P1579	T1573-I1577 WeakPolarHBondContact O-CG1 3.35Å; T1573-I1577 PolarHBondContact O-N 3.17Å; A1574-I1577 PolarHBondContact O-N 3.08Å; A1574-I1577 VanDerWaalsContact O-N 3.14Å; I1577-P1579 VanDerWaalsContact O-CD 3.3Å; I1577-P1579 WeakPolarHBondContact O-CD 3.36Å
1578	K	46.9	Very low	56.6	Low	188.2 Å²	188.2	121.4 Å²	121.4	82%	0.818	69%	0.691	S	S	*	*			trans	-68.5	129.4	172.3	-79	-178.1	176	178.1	0	110.4	L1576 S1580	L1576-K1578 PolarHBondContact O-N 3.19Å; L1576-K1578 VanDerWaalsContact O-N 3.11Å; K1578-S1580 VanDerWaalsContact C-N 3.33Å; K1578-S1580 PolarHBondContact O-N 3.33Å; K1578-S1580 VanDerWaalsContact O-N 3.16Å
1579	P	45.9	Very low	54	Low	128.6 Å²	128.6	124.3 Å²	124.3	84%	0.835	72%	0.715	S	S	*	*			trans	-79.5	127.8	178.8	32.1	-34.2	0	0	0	111.3	I1577 Q1581	I1577-P1579 VanDerWaalsContact O-CD 3.3Å; I1577-P1579 WeakPolarHBondContact O-CD 3.36Å; P1579-Q1581 PolarHBondContact O-N 2.88Å
1580	S	39.6	Very low	51.3	Low	102.4 Å²	102.4	121 Å²	121	72%	0.716	72%	0.722	S	S	*	*			trans	-118.4	124.4	173.7	54.4	0	0	0	0	110.9	K1578	K1578-S1580 VanDerWaalsContact C-N 3.33Å; K1578-S1580 PolarHBondContact O-N 3.33Å; K1578-S1580 VanDerWaalsContact O-N 3.16Å
1581	Q	40.2	Very low	48.7	Very low	177.6 Å²	177.6	122 Å²	122	83%	0.83	74%	0.737	S	S	*	*			trans	62.9	108	165.4	-56.5	179.5	16.9	0	0	116.1	P1579	P1579-Q1581 PolarHBondContact O-N 2.88Å
1582	T	32.9	Very low	46.3	Very low	130.4 Å²	130.4	123.4 Å²	123.4	80%	0.8	75%	0.751	S	S	*	*				78.7	104.7	91.4	52.8	0	0	0	0	114.7
1583	S	36.5	Very low	43.8	Very low	114 Å²	114	123.7 Å²	123.7	80%	0.797	76%	0.761	S	S	*	*			trans	166.1	134.8	148.6	-60.7	0	0	0	0	114
1584	S	34.1	Very low	41.3	Very low	99.6 Å²	99.6	125.9 Å²	125.9	70%	0.697	77%	0.774	S	S	*	*			trans	48	125	157.7	61.1	0	0	0	0	118.8
1585	L	31.2	Very low	39.2	Very low	157.2 Å²	157.2	130.6 Å²	130.6	82%	0.823	79%	0.787	S	S	*	*			trans	77.7	138.2	133	-69.7	167.6	0	0	0	117
1586	T	33.6	Very low	37.6	Very low	123 Å²	123	129.4 Å²	129.4	76%	0.755	79%	0.786	S	S	*	*				-155.3	147.4	94.6	21.5	0	0	0	0	114
1587	L	32	Very low	36.1	Very low	173 Å²	173	129.1 Å²	129.1	91%	0.906	79%	0.785	S	S	*	*			trans	-10.5	148.6	164	-101.6	67.7	0	0	0	115.6
1588	G	34.1	Very low	34.9	Very low	69.4 Å²	69.4	128 Å²	128	72%	0.715	79%	0.79	S	S	*	*				151.9	126.1	127.3	0	0	0	0	0	113.1
1589	S	34.6	Very low	34.2	Very low	130 Å²	130	130.2 Å²	130.2	91%	0.909	79%	0.793	S	S	*	*				82	132.5	116.6	-156	0	0	0	0	114.6
1590	G	32.6	Very low	33.5	Very low	76 Å²	76	130.9 Å²	130.9	78%	0.784	79%	0.789	S	S	*	*			cis	136	136.9	4.1	0	0	0	0	0	113.8
1591	G	32.9	Very low	33.3	Very low	72.2 Å²	72.2	132.8 Å²	132.8	74%	0.744	79%	0.789	S	S	*	*			trans	152.2	137	147.4	0	0	0	0	0	111.7	V1593	G1591-V1593 PolarHBondContact O-N 3.36Å
1592	N	34.8	Very low	32.9	Very low	164.2 Å²	164.2	132.3 Å²	132.3	88%	0.878	79%	0.787	S	S	*	*			trans	-109.4	123.8	174	-75.4	-20.9	0	0	0	112.4
1593	V	31.3	Very low	33	Very low	129 Å²	129	132.9 Å²	132.9	78%	0.782	78%	0.784	S	S	*	*				98.9	126.8	114.7	-179.5	0	0	0	0	113	G1591	G1591-V1593 PolarHBondContact O-N 3.36Å
1594	V	30.9	Very low	32.7	Very low	122.4 Å²	122.4	133.5 Å²	133.5	74%	0.742	78%	0.779	S	S	*	*			trans	106.3	113.8	157.7	177.7	0	0	0	0	115.1
1595	M	30.9	Very low	32.8	Very low	160.4 Å²	160.4	136.8 Å²	136.8	79%	0.79	78%	0.783	S	S	*	*			trans	84.5	118.1	144.8	-76.8	-74.7	-110.7	0	0	116.7	N1597	M1595-N1597 PolarHBondContact O-N 3.11Å
1596	T	32.6	Very low	32.8	Very low	120 Å²	120	135.8 Å²	135.8	74%	0.736	78%	0.779	S	S	*	*			trans	-118.2	128.8	131.2	43.2	0	0	0	0	113.9
1597	N	31.9	Very low	32.7	Very low	139.8 Å²	139.8	134.6 Å²	134.6	75%	0.748	78%	0.776	S	S	*	*			trans	-48.6	116.3	158.2	-73.2	-24.6	0	0	0	116.1	M1595	M1595-N1597 PolarHBondContact O-N 3.11Å
1598	S	33.1	Very low	32.8	Very low	111.6 Å²	111.6	133.1 Å²	133.1	78%	0.78	77%	0.768	S	S	*	*			trans	135.7	127.4	131.4	9.4	0	0	0	0	112.9	L1600	S1598-L1600 PolarHBondContact O-N 3.05Å
1599	R	32.5	Very low	32.7	Very low	233.2 Å²	233.2	136 Å²	136	88%	0.88	77%	0.767	S	S	*	*				-146.7	142.5	122.5	-89.1	169.9	177.5	-178	-1.5	109.5
1600	L	30.1	Very low	32.7	Very low	143.8 Å²	143.8	135.1 Å²	135.1	75%	0.753	76%	0.756	S	S	*	*				119.8	142.1	52.5	-168.8	80.6	0	0	0	111	S1598	S1598-L1600 PolarHBondContact O-N 3.05Å
1601	I	36.3	Very low	32.8	Very low	141 Å²	141	138.3 Å²	138.3	72%	0.723	76%	0.756	S	S	*	*			trans	115.9	106.9	166.2	-67.9	166.3	0	0	0	109.7
1602	Q	32.2	Very low	32.8	Very low	168.8 Å²	168.8	141.4 Å²	141.4	79%	0.789	76%	0.755	S	S	*	*				76.8	114.2	113.3	-83.3	179.3	-19.8	0	0	113.7
1603	L	34	Very low	32.5	Very low	141.6 Å²	141.6	139.5 Å²	139.5	74%	0.741	75%	0.75	S	S	*	*			cis	-139.8	137.9	47	-79.1	163.4	0	0	0	107.8
1604	N	31.9	Very low	32.6	Very low	127 Å²	127	140.2 Å²	140.2	68%	0.679	75%	0.748	S	S	*	*				56.2	97.7	74.6	-161.4	51.8	0	0	0	115.7	N1606	N1604-N1606 PolarHBondContact O-N 3.33Å; N1604-N1606 PolarHBondContact OD1-ND2 2.72Å
1605	E	34.7	Very low	32.5	Very low	168.2 Å²	168.2	138.5 Å²	138.5	79%	0.786	75%	0.747	S	S	*	*			trans	175.7	113.9	137.2	-67.1	-170.2	-177.4	0	0	112
1606	N	31.5	Very low	32.5	Very low	138 Å²	138	136.9 Å²	136.9	74%	0.738	75%	0.746	S	S	*	*				-151.7	112.1	94.2	-117.6	-8	0	0	0	110.1	N1604	N1604-N1606 PolarHBondContact O-N 3.33Å; N1604-N1606 PolarHBondContact OD1-ND2 2.72Å
1607	S	32.7	Very low	32.3	Very low	97.6 Å²	97.6	136.8 Å²	136.8	68%	0.683	75%	0.745	S	S	*	*				122	148.6	116.9	-142.3	0	0	0	0	114
1608	N	32.6	Very low	32.2	Very low	141.8 Å²	141.8	139.7 Å²	139.7	76%	0.758	75%	0.752	S	S	*	*			trans	55.1	131.6	158.3	-57.7	-37.5	0	0	0	116.9
1609	N	32.3	Very low	32.2	Very low	129 Å²	129	139.2 Å²	139.2	69%	0.69	75%	0.754	S	S	*	*				117.1	136.2	71.8	-139	-6.9	0	0	0	115.2	N1611	N1609-N1611 PolarHBondContact O-N 3.26Å
1610	T	34.8	Very low	32.1	Very low	111.2 Å²	111.2	132.1 Å²	132.1	68%	0.682	75%	0.753	S	S	*	*			trans	113.6	137.5	145.4	43.6	0	0	0	0	114.2	N1612	T1610-N1612 WeakPolarHBondContact CB-ND2 3.4Å; T1610-N1612 PolarHBondContact OG1-ND2 3.1Å
1611	N	33.9	Very low	32.2	Very low	143 Å²	143	128.6 Å²	128.6	77%	0.765	75%	0.752	S	S	*	*			trans	-112.7	123.9	132.3	-76.6	-42.1	0	0	0	110.7	N1609	N1609-N1611 PolarHBondContact O-N 3.26Å
1612	N	33.4	Very low	32.1	Very low	137.2 Å²	137.2	131.1 Å²	131.1	73%	0.734	76%	0.758	S	S	*	*				49.8	124.9	122.8	-86.9	-31.3	0	0	0	115.2	T1610 I1614	T1610-N1612 WeakPolarHBondContact CB-ND2 3.4Å; T1610-N1612 PolarHBondContact OG1-ND2 3.1Å; N1612-I1614 HydrophobicContact CB-CD1 4.22Å; N1612-I1614 HydrophobicContact CB-CG1 4.16Å
1613	T	29.9	Very low	32.3	Very low	124.6 Å²	124.6	130.7 Å²	130.7	76%	0.764	76%	0.756	S	S	*	*			trans	-105.9	115.4	130.7	-58.8	0	0	0	0	110.9	A1615	T1613-A1615 HydrophobicContact CG2-CB 4.42Å
1614	I	32.1	Very low	32.1	Very low	144.4 Å²	144.4	130.7 Å²	130.7	74%	0.741	76%	0.755	S	S	*	*			trans	-125.6	117.7	153.4	-64	166.2	0	0	0	110	N1612 T1616	N1612-I1614 HydrophobicContact CB-CD1 4.22Å; N1612-I1614 HydrophobicContact CB-CG1 4.16Å; I1614-T1616 HydrophobicContact CG2-CG2 4.35Å; I1614-T1616 PolarHBondContact O-N 3.21Å
1615	A	28.5	Very low	32.2	Very low	87.2 Å²	87.2	131.6 Å²	131.6	72%	0.721	76%	0.759	S	S	*	*			trans	-82.2	97	136.5	0	0	0	0	0	112.9	T1613	T1613-A1615 HydrophobicContact CG2-CB 4.42Å
1616	T	31	Very low	32	Very low	125 Å²	125	130.6 Å²	130.6	77%	0.767	75%	0.754	S	S	*	*			trans	-137.7	115.9	163.3	44.3	0	0	0	0	108.6	I1614 F1618	I1614-T1616 HydrophobicContact CG2-CG2 4.35Å; I1614-T1616 PolarHBondContact O-N 3.21Å; T1616-F1618 PolarHBondContact O-N 3.01Å
1617	T	29.5	Very low	32	Very low	118 Å²	118	131.5 Å²	131.5	72%	0.724	75%	0.754	S	S	*	*				9.3	125.6	81.1	-57.8	0	0	0	0	112.1
1618	F	30	Very low	32	Very low	201.8 Å²	201.8	131.5 Å²	131.5	89%	0.885	75%	0.754	S	S	*	*			trans	122.6	136.1	160.6	-81.3	-86.4	0	0	0	117.1	T1616	T1616-F1618 PolarHBondContact O-N 3.01Å
1619	A	31.9	Very low	32.2	Very low	100.6 Å²	100.6	130.2 Å²	130.2	83%	0.831	75%	0.751	S	S	*	*			trans	48.3	122.5	165.6	0	0	0	0	0	119.4
1620	G	30.6	Very low	32.4	Very low	83.8 Å²	83.8	130.3 Å²	130.3	86%	0.864	75%	0.751	S	S	*	*				99.8	98.5	123.5	0	0	0	0	0	117.3
1621	G	31.9	Very low	32.8	Very low	69.8 Å²	69.8	129.9 Å²	129.9	72%	0.72	75%	0.748	S	S	*	*			trans	148.1	102.9	164.9	0	0	0	0	0	115.9	Q1623	G1621-Q1623 PolarHBondContact O-N 3.22Å
1622	K	34.3	Very low	33.2	Very low	195.2 Å²	195.2	130 Å²	130	85%	0.849	75%	0.749	S	S	*	*			trans	-77.6	119.3	168.1	-63.7	-179.5	-179.9	179.7	0	112.7	L1624	K1622-L1624 PolarHBondContact O-N 3.23Å
1623	Q	35.9	Very low	33.6	Very low	160.6 Å²	160.6	131.8 Å²	131.8	75%	0.75	75%	0.753	S	S	*	*			trans	-90.5	140.9	151	-76.8	179.3	-8.3	0	0	114.2	G1621 I1625 G1990	G1621-Q1623 PolarHBondContact O-N 3.22Å; Q1623-I1625 PolarHBondContact O-N 2.63Å; Q1623-G1990 PolarHBondContact NE2-O 2.99Å
1624	L	31.5	Very low	34	Very low	140.4 Å²	140.4	128.8 Å²	128.8	74%	0.735	75%	0.746	S	S	*	*			trans	-85.9	126.1	166	-80.3	81.2	0	0	0	111.8	K1622 Q1626 V1639	K1622-L1624 PolarHBondContact O-N 3.23Å; L1624-Q1626 PolarHBondContact O-N 3.26Å; L1624-Q1626 VanDerWaalsContact O-N 3.16Å; L1624-V1639 HydrophobicContact CD2-CG1 4.04Å
1625	I	33	Very low	34.4	Very low	145.6 Å²	145.6	126.9 Å²	126.9	75%	0.747	74%	0.741	S	S	*	*			trans	-118.3	133.5	130.8	-70.3	172.6	0	0	0	111.8	Q1623 Q1627	Q1623-I1625 PolarHBondContact O-N 2.63Å; I1625-Q1627 HydrophobicContact CG2-CG 4.41Å; I1625-Q1627 PolarHBondContact O-N 2.68Å
1626	Q	31.3	Very low	34.8	Very low	147 Å²	147	132.8 Å²	132.8	69%	0.687	75%	0.745	S	S	*	*			trans	-35.1	125.2	179.7	-70.2	174.6	-49.1	0	0	113.3	L1624 R1638	L1624-Q1626 PolarHBondContact O-N 3.26Å; L1624-Q1626 VanDerWaalsContact O-N 3.16Å; Q1626-R1638 VanDerWaalsContact OE1-NH1 3.12Å
1627	Q	30.9	Very low	35.2	Very low	157.8 Å²	157.8	135.9 Å²	135.9	74%	0.737	74%	0.744	S	S	*	*				42.4	128	123.9	-72.4	-179.5	-17.1	0	0	113.1	I1625	I1625-Q1627 HydrophobicContact CG2-CG 4.41Å; I1625-Q1627 PolarHBondContact O-N 2.68Å
1628	S	33.4	Very low	35.6	Very low	97 Å²	97	140.5 Å²	140.5	68%	0.678	75%	0.748	S	S	*	*			trans	-82	130.1	151.2	55.5	0	0	0	0	113.5
1629	V	35.9	Very low	35.9	Very low	114.4 Å²	114.4	137.1 Å²	137.1	69%	0.693	74%	0.743	S	S	*	*			trans	-96.8	134.1	146.4	166.6	0	0	0	0	110.1	T1631 R1636	V1629-T1631 HydrophobicContact CG1-CG2 4.12Å; V1629-R1636 PolarHBondContact N-O 2.68Å; V1629-R1636 PolarHBondContact O-N 2.99Å
1630	L	36.5	Very low	36	Very low	132.4 Å²	132.4	139.4 Å²	139.4	69%	0.693	74%	0.741	S	S	*	*			trans	-76	137.1	161	-136.1	69.9	0	0	0	111	V1635 R1636	L1630-V1635 HydrophobicContact CD1-CG2 3.74Å; L1630-R1636 HydrophobicContact CD1-CG 3.89Å
1631	T	43.2	Very low	36.1	Very low	101.2 Å²	101.2	139.6 Å²	139.6	62%	0.621	73%	0.734	S	S	*	*			trans	-127.9	158.1	146.5	59.3	0	0	0	0	111.4	V1629 Q1633 G1634 V1635	V1629-T1631 HydrophobicContact CG1-CG2 4.12Å; T1631-Q1633 PolarHBondContact O-N 3.23Å; T1631-Q1633 VanDerWaalsContact O-N 3.16Å; T1631-G1634 PolarHBondContact N-O 3.01Å; T1631-G1634 PolarHBondContact O-N 3.29Å; T1631-G1634 PolarHBondContact OG1-O 3.23Å; T1631-V1635 PolarHBondContact N-O 3.37Å; T1631-V1635 PolarHBondContact OG1-O 2.99Å
1632	D	41.7	Very low	36.3	Very low	145.4 Å²	145.4	142.3 Å²	142.3	78%	0.778	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	43.9	-163	-43.3	-49	0	0	0	113	G1634	D1632-G1634 VanDerWaalsContact C-N 3.26Å; D1632-G1634 PolarHBondContact O-N 2.87Å
1633	Q	42	Very low	36.2	Very low	176.2 Å²	176.2	143.9 Å²	143.9	82%	0.823	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	69.9	170.1	-63.9	-56.7	-53.3	0	0	112.2	T1631 V1635	T1631-Q1633 PolarHBondContact O-N 3.23Å; T1631-Q1633 VanDerWaalsContact O-N 3.16Å; Q1633-V1635 VanDerWaalsContact C-N 3.26Å; Q1633-V1635 PolarHBondContact O-N 3.47Å
1634	G	37.9	Very low	36.1	Very low	60.2 Å²	60.2	142.8 Å²	142.8	62%	0.621	74%	0.744	S	S	*	*			trans	172.4	131.7	-179.3	0	0	0	0	0	116.4	T1631 D1632	T1631-G1634 PolarHBondContact N-O 3.01Å; T1631-G1634 PolarHBondContact O-N 3.29Å; T1631-G1634 PolarHBondContact OG1-O 3.23Å; D1632-G1634 VanDerWaalsContact C-N 3.26Å; D1632-G1634 PolarHBondContact O-N 2.87Å
1635	V	41.3	Very low	36.4	Very low	105.6 Å²	105.6	143.2 Å²	143.2	64%	0.64	75%	0.746	S	S	*	*			trans	-105.1	134.1	156.5	-179.5	0	0	0	0	108.7	L1630 T1631 Q1633 Y1637	L1630-V1635 HydrophobicContact CD1-CG2 3.74Å; T1631-V1635 PolarHBondContact N-O 3.37Å; T1631-V1635 PolarHBondContact OG1-O 2.99Å; Q1633-V1635 VanDerWaalsContact C-N 3.26Å; Q1633-V1635 PolarHBondContact O-N 3.47Å; V1635-Y1637 HydrophobicContact CB-CE2 4.12Å; V1635-Y1637 HydrophobicContact CG1-CD2 4.16Å; V1635-Y1637 HydrophobicContact CG1-CE1 4.31Å; V1635-Y1637 HydrophobicContact CG1-CE2 3.68Å
1636	R	37.7	Very low	36.5	Very low	211.4 Å²	211.4	141.6 Å²	141.6	80%	0.798	75%	0.745	S	S	*	*			trans	-114	120.9	178.1	-68.4	-174.6	-178.9	-159.9	2.2	111.5	V1629 L1630	V1629-R1636 PolarHBondContact N-O 2.68Å; V1629-R1636 PolarHBondContact O-N 2.99Å; L1630-R1636 HydrophobicContact CD1-CG 3.89Å
1637	Y	37.9	Very low	36.4	Very low	190.4 Å²	190.4	141.6 Å²	141.6	75%	0.747	75%	0.749	S	S	*	*			trans	-96.5	137.2	160.2	-69	-83.2	0	0	0	110.1	V1635	V1635-Y1637 HydrophobicContact CB-CE2 4.12Å; V1635-Y1637 HydrophobicContact CG1-CD2 4.16Å; V1635-Y1637 HydrophobicContact CG1-CE1 4.31Å; V1635-Y1637 HydrophobicContact CG1-CE2 3.68Å
1638	R	37.5	Very low	36.6	Very low	213.6 Å²	213.6	141.5 Å²	141.5	81%	0.806	75%	0.753	S	S	*	*			trans	-99.5	120.1	168.3	-68	-173.4	-174.5	-159.7	5.2	109.2	Q1626 L1640	Q1626-R1638 VanDerWaalsContact OE1-NH1 3.12Å; R1638-L1640 PolarHBondContact O-N 3.3Å; R1638-L1640 VanDerWaalsContact O-N 3.14Å
1639	V	36.5	Very low	36.5	Very low	130 Å²	130	144.7 Å²	144.7	79%	0.788	76%	0.756	S	S	*	*			trans	-105.6	126.9	157	-177.7	0	0	0	0	107.4	L1624 A1641	L1624-V1639 HydrophobicContact CD2-CG1 4.04Å; V1639-A1641 PolarHBondContact O-N 3.37Å
1640	L	34.2	Very low	36.4	Very low	149 Å²	149	146.7 Å²	146.7	78%	0.78	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-86.2	133.4	-179.1	-63.5	172.6	0	0	0	110.3	R1638	R1638-L1640 PolarHBondContact O-N 3.3Å; R1638-L1640 VanDerWaalsContact O-N 3.14Å
1641	A	33.9	Very low	36.2	Very low	88.4 Å²	88.4	146.3 Å²	146.3	73%	0.731	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-77	137.6	170.9	0	0	0	0	0	110.7	V1639 R1643	V1639-A1641 PolarHBondContact O-N 3.37Å; A1641-R1643 PolarHBondContact O-N 2.97Å
1642	P	34.7	Very low	35.6	Very low	127 Å²	127	149.3 Å²	149.3	83%	0.825	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-68.7	134	169.2	-13.5	27.7	0	0	0	111.1	T1644	P1642-T1644 PolarHBondContact O-N 3.02Å; P1642-T1644 VanDerWaalsContact O-N 3.09Å
1643	R	33.5	Very low	35.3	Very low	229 Å²	229	148.6 Å²	148.6	86%	0.864	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-82.2	129.1	174.8	-75.5	179.6	169.2	179.7	-5	110.9	A1641 I1645	A1641-R1643 PolarHBondContact O-N 2.97Å; R1643-I1645 HydrophobicContact CB-CG1 4.44Å; R1643-I1645 PolarHBondContact O-N 3.2Å
1644	T	34.1	Very low	34.7	Very low	135.8 Å²	135.8	144.1 Å²	144.1	83%	0.833	76%	0.759	S	S	*	*			trans	-72.5	121.1	164.8	50.4	0	0	0	0	111.2	P1642	P1642-T1644 PolarHBondContact O-N 3.02Å; P1642-T1644 VanDerWaalsContact O-N 3.09Å
1645	I	37.2	Very low	34.5	Very low	149.6 Å²	149.6	150.2 Å²	150.2	77%	0.767	77%	0.769	S	S	*	*			trans	-125.4	138.4	167.2	-69	174.5	0	0	0	108.2	R1643 N1647	R1643-I1645 HydrophobicContact CB-CG1 4.44Å; R1643-I1645 PolarHBondContact O-N 3.2Å; I1645-N1647 PolarHBondContact O-N 3.11Å
1646	P	34.2	Very low	34.1	Very low	113 Å²	113	151.9 Å²	151.9	73%	0.734	77%	0.774	S	S	*	*			trans	-90.8	156.9	-169.8	35.9	-36.2	0	0	0	114
1647	N	30.9	Very low	33.9	Very low	145.8 Å²	145.8	147.4 Å²	147.4	78%	0.78	77%	0.773	S	S	*	*			trans	-47.5	129.7	169.6	-87	-17.9	0	0	0	114.9	I1645 H1649 N2005	I1645-N1647 PolarHBondContact O-N 3.11Å; N1647-H1649 PolarHBondContact O-N 3.26Å; N1647-N2005 PolarHBondContact ND2-O 3.13Å
1648	I	34	Very low	33.7	Very low	157 Å²	157	144.2 Å²	144.2	81%	0.805	77%	0.773	S	S	*	*			trans	-114.4	127.3	160.6	-60.4	170.7	0	0	0	110.1
1649	H	32.4	Very low	33.4	Very low	163 Å²	163	141.9 Å²	141.9	76%	0.755	77%	0.771	S	S	*	*			trans	-179.6	137.7	155.4	-131.3	67.1	0	0	0	115.2	N1647	N1647-H1649 PolarHBondContact O-N 3.26Å
1650	M	32.1	Very low	33.2	Very low	156.2 Å²	156.2	144.3 Å²	144.3	77%	0.769	77%	0.771	S	S	*	*			trans	-76.8	139	159.8	-101.3	-103.5	176.6	0	0	113.3
1651	N	33	Very low	33	Very low	124.2 Å²	124.2	143.6 Å²	143.6	66%	0.664	77%	0.773	S	S	*	*				-168	152.8	79.9	-115.9	-29.8	0	0	0	112.4
1652	Q	31.3	Very low	32.8	Very low	163.8 Å²	163.8	143.8 Å²	143.8	77%	0.765	77%	0.774	S	S	*	*			trans	16.9	142.6	159.7	-59	173.6	12.2	0	0	118.6
1653	V	34	Very low	32.8	Very low	131.4 Å²	131.4	143.1 Å²	143.1	80%	0.796	77%	0.772	S	S	*	*				155.7	121.6	114.8	179.5	0	0	0	0	111.6	F1655	V1653-F1655 HydrophobicContact CG1-CE2 4.3Å
1654	A	30.2	Very low	33	Very low	81 Å²	81	138.4 Å²	138.4	67%	0.669	77%	0.769	S	S	*	*				175.2	152.3	125.9	0	0	0	0	0	113.1
1655	F	32.8	Very low	33.1	Very low	189.4 Å²	189.4	137.4 Å²	137.4	83%	0.831	77%	0.765	S	S	*	*			trans	161.9	133.6	145.1	-86.2	-75.3	0	0	0	113.3	V1653	V1653-F1655 HydrophobicContact CG1-CE2 4.3Å
1656	N	33.5	Very low	33	Very low	140.6 Å²	140.6	136.9 Å²	136.9	75%	0.752	76%	0.762	S	S	*	*			trans	-104.2	140.2	161.9	-101.4	-11.9	0	0	0	114
1657	P	34.2	Very low	32.8	Very low	117.4 Å²	117.4	137.7 Å²	137.7	76%	0.762	76%	0.76	S	S	*	*			trans	-97.9	143.7	168.1	32.5	-24.6	0	0	0	112.5
1658	V	32.6	Very low	32.9	Very low	123.4 Å²	123.4	141.7 Å²	141.7	75%	0.748	76%	0.764	S	S	*	*			trans	-136.8	121.2	163.7	-178.2	0	0	0	0	112.3
1659	Q	31.8	Very low	32.9	Very low	165.2 Å²	165.2	140.4 Å²	140.4	77%	0.772	76%	0.764	S	S	*	*			trans	3.2	143.7	151	-50.1	172.9	-3.5	0	0	119.2
1660	K	31.6	Very low	33.1	Very low	180.2 Å²	180.2	138 Å²	138	78%	0.783	76%	0.763	S	S	*	*				176.3	137.5	125.1	-77.2	173.1	178.9	177.8	0	114.1
1661	T	31.3	Very low	33.1	Very low	134.2 Å²	134.2	137.9 Å²	137.9	82%	0.823	76%	0.761	S	S	*	*				84	134.3	112.1	48.5	0	0	0	0	116.3
1662	A	30.4	Very low	33	Very low	92 Å²	92	139 Å²	139	76%	0.76	76%	0.762	S	S	*	*			trans	-122.8	137.1	136.5	0	0	0	0	0	116.3
1663	S	34.3	Very low	33	Very low	112.4 Å²	112.4	135.8 Å²	135.8	79%	0.786	75%	0.754	S	S	*	*			trans	-176.7	120	141.4	38.3	0	0	0	0	112.4
1664	V	37.6	Very low	32.8	Very low	131.8 Å²	131.8	138.9 Å²	138.9	80%	0.799	75%	0.752	S	S	*	*				52.6	124.4	90.8	-178	0	0	0	0	113.1
1665	P	36.6	Very low	32.8	Very low	113.2 Å²	113.2	145 Å²	145	74%	0.735	76%	0.758	S	S	*	*				-127.9	-175.8	67.9	36	-18.9	0	0	0	112.6
1666	I	34.1	Very low	32.7	Very low	140 Å²	140	140.4 Å²	140.4	72%	0.718	75%	0.749	S	S	*	*				-173	131.9	71.2	-95.4	173.5	0	0	0	112.3
1667	N	29.8	Very low	32.6	Very low	129.4 Å²	129.4	140 Å²	140	69%	0.692	75%	0.747	S	S	*	*			trans	31.2	146.3	156.1	-60.1	-31.1	0	0	0	119.1
1668	R	34.2	Very low	32.6	Very low	229.8 Å²	229.8	141.7 Å²	141.7	87%	0.867	75%	0.745	S	S	*	*			cis	-163.8	126.7	44.7	-97.9	162.9	-163.3	-149.5	2.4	112.9
1669	T	33.2	Very low	32.6	Very low	130.4 Å²	130.4	143.1 Å²	143.1	80%	0.8	74%	0.741	S	S	*	*			trans	-69.6	176.3	147	51.6	0	0	0	0	112.3
1670	P	37.5	Very low	32.6	Very low	111.8 Å²	111.8	144.5 Å²	144.5	73%	0.726	74%	0.739	S	S	*	*			cis	-129.9	-178.4	-35.1	40.4	-24.5	0	0	0	114.5
1671	Q	31.2	Very low	32.6	Very low	154.8 Å²	154.8	146.1 Å²	146.1	72%	0.723	74%	0.74	S	S	*	*			trans	121.9	143.7	140.1	-73.1	-154.1	-30.8	0	0	116.9	T1673	Q1671-T1673 PolarHBondContact NE2-OG1 2.87Å
1672	Q	31.7	Very low	32.8	Very low	147.4 Å²	147.4	143.7 Å²	143.7	69%	0.689	73%	0.734	S	S	*	*				75.4	139.8	81.9	-93.4	-172.2	21.5	0	0	115.8
1673	T	29.7	Very low	33	Very low	97 Å²	97	145.6 Å²	145.6	60%	0.595	73%	0.731	S	S	*	*				151.1	144.6	65.6	28.8	0	0	0	0	115.1	Q1671	Q1671-T1673 PolarHBondContact NE2-OG1 2.87Å
1674	Y	29.8	Very low	33.1	Very low	194.8 Å²	194.8	150.2 Å²	150.2	76%	0.764	73%	0.731	S	S	*	*				81	149.7	127.6	-86.8	-86.8	0	0	0	120.2
1675	R	30.7	Very low	33.1	Very low	210.2 Å²	210.2	149.9 Å²	149.9	79%	0.793	73%	0.725	S	S	*	*			trans	84.2	100.9	142	-80.1	173.7	-176.2	-159	0.2	116.1
1676	S	30.9	Very low	33.1	Very low	92 Å²	92	148.9 Å²	148.9	64%	0.643	72%	0.721	S	S	*	*				58.7	145.1	96.1	73	0	0	0	0	117.9
1677	N	31.8	Very low	33.2	Very low	132 Å²	132	148.5 Å²	148.5	71%	0.706	72%	0.72	S	S	*	*			trans	102	122.7	152.3	-73.4	-44.2	0	0	0	117
1678	Q	34	Very low	33.8	Very low	153.8 Å²	153.8	149.2 Å²	149.2	72%	0.719	72%	0.723	S	S	*	*				78.9	133.2	128.6	-71.7	-175.6	53.5	0	0	118.4
1679	K	32.5	Very low	34	Very low	152.2 Å²	152.2	142.2 Å²	142.2	66%	0.662	71%	0.709	S	S	*	*			cis	134.1	137.5	28.3	-171.9	176.8	177.9	171.1	0	112.8
1680	R	31.7	Very low	34.3	Very low	194.6 Å²	194.6	144 Å²	144	73%	0.734	71%	0.709	S	S	*	*			trans	72.5	137.7	157.5	-71	173.8	168	-178.2	-4.1	117.1
1681	R	32.6	Very low	34.5	Very low	215.2 Å²	215.2	143.3 Å²	143.3	81%	0.812	71%	0.706	S	S	*	*				157.6	131.3	70.5	-94.7	171	172.2	-179.5	-6.3	112.2
1682	A	35.3	Very low	34.9	Very low	83.6 Å²	83.6	142.8 Å²	142.8	69%	0.691	71%	0.709	S	S	*	*				78	149.1	88.4	0	0	0	0	0	114.8
1683	N	34.1	Very low	35.3	Very low	132.2 Å²	132.2	140.1 Å²	140.1	71%	0.707	71%	0.707	S	S	*	*				118.1	135.6	108.1	-106.1	8.6	0	0	0	114.4	N1685	N1683-N1685 PolarHBondContact OD1-OD1 3.42Å
1684	R	36.3	Very low	35.7	Very low	208.2 Å²	208.2	142.5 Å²	142.5	79%	0.786	72%	0.716	S	S	*	*				150.4	142.6	69.9	-98.5	178.9	175	-179.3	-4.1	111.8
1685	N	37	Very low	36.1	Very low	125 Å²	125	137.8 Å²	137.8	67%	0.668	71%	0.711	S	S	*	*				75.5	144.4	124.7	-76.1	49.3	0	0	0	113.4	N1683	N1683-N1685 PolarHBondContact OD1-OD1 3.42Å
1686	S	37.5	Very low	36.4	Very low	92 Å²	92	134.4 Å²	134.4	64%	0.643	71%	0.709	S	S	*	*			cis	176.2	158.3	34.6	44.1	0	0	0	0	112.5
1687	D	35.8	Very low	36.6	Very low	131.8 Å²	131.8	134.8 Å²	134.8	71%	0.705	71%	0.711	S	S	*	*			cis	148.1	154.8	37.6	-89.2	-23.7	0	0	0	113.2
1688	L	42.4	Very low	36.8	Very low	144.4 Å²	144.4	134.3 Å²	134.3	76%	0.756	71%	0.713	S	S	*	*				107.8	137.2	119.8	-77.7	163.3	0	0	0	113.7
1689	S	39.3	Very low	36.9	Very low	82 Å²	82	133 Å²	133	57%	0.573	72%	0.716	S	S	*	*				84.8	147.9	64.1	79.3	0	0	0	0	114.7
1690	E	38.9	Very low	37	Very low	168.8 Å²	168.8	129.6 Å²	129.6	79%	0.789	72%	0.716	S	S	*	*			cis	152.6	141.7	37.8	-99.1	156.4	175.2	0	0	113
1691	S	40.5	Very low	37.2	Very low	96.8 Å²	96.8	127.1 Å²	127.1	68%	0.677	72%	0.717	S	S	*	*				139.4	166.2	105.6	-83.9	0	0	0	0	115.2
1692	D	39.8	Very low	37.3	Very low	144.4 Å²	144.4	122.6 Å²	122.6	77%	0.772	71%	0.714	S	S	*	*			cis	146.3	150.5	6.3	-97	-13.9	0	0	0	112.6
1693	S	40.1	Very low	37.3	Very low	92 Å²	92	122.2 Å²	122.2	64%	0.643	72%	0.718	S	S	*	*				129.2	136.6	117.2	-83.8	0	0	0	0	116.5
1694	D	38.6	Very low	37.1	Very low	146.6 Å²	146.6	126.4 Å²	126.4	78%	0.784	72%	0.724	S	S	*	*				77.5	150.8	118.6	-67.2	-37.1	0	0	0	119.9
1695	S	39.1	Very low	37	Very low	95.2 Å²	95.2	121.7 Å²	121.7	67%	0.666	72%	0.718	S	S	*	*			cis	177.8	157.4	-17.4	50.6	0	0	0	0	113.3
1696	D	36.1	Very low	36.8	Very low	140.2 Å²	140.2	122.9 Å²	122.9	75%	0.75	72%	0.724	S	S	*	*			trans	43.3	141.4	149.3	-75.7	-22.9	0	0	0	118.5	R1784	D1696-R1784 IonicContact OD2-CZ 3.49Å; D1696-R1784 IonicContact OD2-NH1 2.65Å; D1696-R1784 PolarHBondContact OD2-NH1 3.39Å; D1696-R1784 IonicContact OD2-NH2 2.73Å; D1696-R1784 PolarHBondContact OD2-NH2 3.44Å
1697	S	34.9	Very low	36.4	Very low	98.8 Å²	98.8	123.5 Å²	123.5	69%	0.691	73%	0.729	S	S	*	*			cis	165	162.9	39.9	62.1	0	0	0	0	113.6
1698	V	36.6	Very low	36	Very low	121.6 Å²	121.6	128.3 Å²	128.3	74%	0.737	74%	0.737	S	S	*	*			trans	63	116.4	132.8	-173.5	0	0	0	0	119.1
1699	T	35.5	Very low	35.4	Very low	128.4 Å²	128.4	126.9 Å²	126.9	79%	0.788	74%	0.739	S	S	*	*				100.2	154.2	123	54.7	0	0	0	0	116.4
1700	A	35.2	Very low	35	Very low	80.4 Å²	80.4	127.3 Å²	127.3	66%	0.664	75%	0.747	S	S	*	*			cis	163.3	146.6	25.6	0	0	0	0	0	112.9
1701	N	35.6	Very low	34.5	Very low	142.2 Å²	142.2	129.1 Å²	129.1	76%	0.76	75%	0.747	S	S	*	*				109.6	147.4	102.3	-103.4	-8.3	0	0	0	118.8
1702	T	35.3	Very low	34	Very low	120.6 Å²	120.6	131.2 Å²	131.2	74%	0.74	75%	0.746	S	S	*	*			trans	55.7	128.7	142	51.8	0	0	0	0	118.6	K2255	T1702-K2255 HydrophobicContact CG2-CD 3.95Å
1703	G	34.9	Very low	33.7	Very low	75.2 Å²	75.2	130.8 Å²	130.8	78%	0.775	74%	0.744	S	S	*	*				145.5	117.4	124.5	0	0	0	0	0	114
1704	R	29.9	Very low	33.6	Very low	220.6 Å²	220.6	132.7 Å²	132.7	83%	0.832	75%	0.751	S	S	*	*			trans	-31.9	144.9	137.8	-85.1	-164.8	-161.6	-131.7	2.9	111.2
1705	V	34.7	Very low	33.6	Very low	109.4 Å²	109.4	131 Å²	131	66%	0.663	75%	0.748	S	S	*	*			cis	-157.9	158.3	27.8	-115.6	0	0	0	0	112.5
1706	N	31.6	Very low	33.2	Very low	150 Å²	150	133.6 Å²	133.6	80%	0.802	75%	0.754	S	S	*	*			trans	-6.8	135.4	155.3	-45.6	-8.7	0	0	0	116.8
1707	S	30.6	Very low	33.1	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	75%	0.754	S	S	*	*				170.3	158.5	94.4	-158.7	0	0	0	0	113.1
1708	W	26.6	Very low	33	Very low	231.4 Å²	231.4	142.2 Å²	142.2	88%	0.877	76%	0.761	S	S	*	*			trans	-49.7	140.1	171.9	-63.7	-36.9	0	0	0	118.5
1709	S	28.9	Very low	32.7	Very low	115.6 Å²	115.6	141.4 Å²	141.4	81%	0.808	76%	0.761	S	S	*	*				83.1	132.2	126	66.5	0	0	0	0	119.6
1710	A	31.1	Very low	32.5	Very low	89.6 Å²	89.6	140.1 Å²	140.1	74%	0.74	76%	0.763	S	S	*	*			trans	113.6	122.4	151.1	0	0	0	0	0	113.7
1711	R	29.6	Very low	32.7	Very low	206.6 Å²	206.6	147.6 Å²	147.6	78%	0.78	77%	0.774	S	S	*	*				65.6	135.7	109.2	-77.1	-172.5	162.5	-155.6	-0.7	115.7	G2349 R2351	R1711-G2349 PolarHBondContact NH1-O 3.44Å; R1711-R2351 PolarHBondContact NH2-O 3.06Å
1712	E	30.1	Very low	32.6	Very low	141.8 Å²	141.8	151.2 Å²	151.2	66%	0.663	78%	0.777	S	S	*	*				153.7	152.5	105.6	-97.5	157.2	-161.1	0	0	114.2
1713	N	32	Very low	32.6	Very low	135.2 Å²	135.2	151.6 Å²	151.6	72%	0.723	78%	0.779	S	S	*	*			trans	41.8	117.6	153	-63.7	-30.1	0	0	0	117.2
1714	V	38	Very low	32.4	Very low	132.6 Å²	132.6	158.2 Å²	158.2	80%	0.804	78%	0.78	S	S	*	*			trans	-143.1	130.5	130.7	171.1	0	0	0	0	111.2	L1716	V1714-L1716 HydrophobicContact CG1-CD1 4.07Å
1715	P	38.8	Very low	32.6	Very low	109.8 Å²	109.8	152.2 Å²	152.2	71%	0.713	78%	0.778	S	S	*	*			trans	-124.1	133.9	175.9	37.3	-24.4	0	0	0	114.7	R1717	P1715-R1717 PolarHBondContact O-N 2.82Å
1716	L	31.4	Very low	32.6	Very low	150.2 Å²	150.2	152.6 Å²	152.6	79%	0.786	78%	0.78	S	S	*	*			trans	-133.6	130.6	162.2	-83.5	126.4	0	0	0	112.8	V1714	V1714-L1716 HydrophobicContact CG1-CD1 4.07Å
1717	R	33.1	Very low	32.6	Very low	201 Å²	201	156.3 Å²	156.3	76%	0.758	78%	0.783	S	S	*	*				165.3	122.5	60.9	-153.5	176.9	177.6	159.7	-2.8	111.1	P1715	P1715-R1717 PolarHBondContact O-N 2.82Å
1718	R	32.9	Very low	32.9	Very low	218 Å²	218	159.1 Å²	159.1	82%	0.823	78%	0.784	S	S	*	*			trans	37.8	133.5	138.6	-62.8	165.7	-171.9	-126.7	1.6	113.6
1719	S	30.7	Very low	33.6	Very low	106.6 Å²	106.6	154.7 Å²	154.7	75%	0.745	78%	0.778	S	S	*	*			cis	175.6	145.6	27.5	43.6	0	0	0	0	110.8	R1721	S1719-R1721 PolarHBondContact O-N 3.03Å
1720	A	32.5	Very low	34.2	Very low	100.4 Å²	100.4	154.5 Å²	154.5	83%	0.83	77%	0.774	S	S	*	*			trans	12.8	120.8	144.6	0	0	0	0	0	115.8
1721	R	37.5	Very low	34.7	Very low	238.2 Å²	238.2	156.2 Å²	156.2	90%	0.899	77%	0.771	S	S	*	*			trans	-127.6	120.1	149.2	-134.1	177.2	-160.2	-143.2	2.5	111.3	S1719 V1723	S1719-R1721 PolarHBondContact O-N 3.03Å; R1721-V1723 VanDerWaalsContact C-N 3.29Å; R1721-V1723 HydrophobicContact CB-CG2 4.15Å; R1721-V1723 HydrophobicContact CG-CG2 3.9Å; R1721-V1723 PolarHBondContact O-N 3Å
1722	R	33.4	Very low	34.9	Very low	216.8 Å²	216.8	155.8 Å²	155.8	82%	0.818	78%	0.775	S	S	*	*			trans	-62.1	110.5	169.6	-81.3	159.5	80.7	-170.6	7	110.1
1723	V	36.5	Very low	35.4	Very low	128.6 Å²	128.6	154.2 Å²	154.2	78%	0.779	78%	0.775	S	S	*	*			trans	-105.1	126.1	156.7	-179.3	0	0	0	0	107.3	R1721 A1725	R1721-V1723 VanDerWaalsContact C-N 3.29Å; R1721-V1723 HydrophobicContact CB-CG2 4.15Å; R1721-V1723 HydrophobicContact CG-CG2 3.9Å; R1721-V1723 PolarHBondContact O-N 3Å; V1723-A1725 PolarHBondContact O-N 2.99Å; V1723-A1725 VanDerWaalsContact O-N 3.12Å
1724	R	30.8	Very low	35.9	Very low	214.2 Å²	214.2	152.8 Å²	152.8	81%	0.808	77%	0.771	S	S	*	*			trans	-78.4	117.6	172.1	-72.8	175.7	165.6	112.9	-12.7	107.9	V1726	R1724-V1726 VanDerWaalsContact C-N 3.34Å; R1724-V1726 PolarHBondContact O-N 3.44Å
1725	A	34.1	Very low	36.2	Very low	95 Å²	95	152.1 Å²	152.1	79%	0.785	76%	0.762	S	S	*	*			trans	-105.3	125.7	163.6	0	0	0	0	0	108.1	V1723 R1727	V1723-A1725 PolarHBondContact O-N 2.99Å; V1723-A1725 VanDerWaalsContact O-N 3.12Å; A1725-R1727 PolarHBondContact O-N 3.26Å
1726	V	33.9	Very low	36.3	Very low	117.6 Å²	117.6	155.3 Å²	155.3	71%	0.713	77%	0.765	S	S	*	*			trans	-72.1	134.9	-178.6	-179.6	0	0	0	0	109.3	R1724 H1728	R1724-V1726 VanDerWaalsContact C-N 3.34Å; R1724-V1726 PolarHBondContact O-N 3.44Å; V1726-H1728 PolarHBondContact O-N 3.09Å; V1726-H1728 VanDerWaalsContact O-N 3.15Å
1727	R	32.6	Very low	37	Very low	227.6 Å²	227.6	154.9 Å²	154.9	86%	0.859	76%	0.764	S	S	*	*			trans	-98.4	114	159.2	-74.3	-178.9	178.9	-177.1	-2	109.4	A1725	A1725-R1727 PolarHBondContact O-N 3.26Å
1728	H	36.1	Very low	37.3	Very low	163.6 Å²	163.6	153.8 Å²	153.8	76%	0.757	77%	0.768	S	S	*	*			trans	-78.7	112.3	152.6	-74.3	-80.2	0	0	0	109.9	V1726 P1730	V1726-H1728 PolarHBondContact O-N 3.09Å; V1726-H1728 VanDerWaalsContact O-N 3.15Å; H1728-P1730 WeakPolarHBondContact O-CD 3.37Å
1729	D	41	Very low	38.1	Very low	139.4 Å²	139.4	150.4 Å²	150.4	75%	0.745	77%	0.766	S	S	*	*			trans	-67.1	135.1	151	-68.1	-60.8	0	0	0	108.3	D1731	D1729-D1731 PolarHBondContact O-N 2.92Å; D1729-D1731 VanDerWaalsContact O-N 3.15Å
1730	P	42.2	Very low	38.9	Very low	112.2 Å²	112.2	152.1 Å²	152.1	73%	0.729	77%	0.766	S	S	*	*			trans	-88.2	117.3	158.4	33.7	-30.9	0	0	0	109.4	H1728	H1728-P1730 WeakPolarHBondContact O-CD 3.37Å
1731	D	41.9	Very low	39.6	Very low	125.2 Å²	125.2	154.3 Å²	154.3	67%	0.67	76%	0.764	S	S	*	*			trans	-50.1	138.1	177	-79.8	-47.5	0	0	0	113.7	R1245 D1729 V1733	R1245-D1731 IonicContact CZ-OD2 3.64Å; R1245-D1731 IonicContact NH1-OD2 3.86Å; R1245-D1731 PolarHBondContact NH1-OD2 3.22Å; R1245-D1731 IonicContact NH2-OD2 3.93Å; R1245-D1731 PolarHBondContact NH2-OD2 3.13Å; D1729-D1731 PolarHBondContact O-N 2.92Å; D1729-D1731 VanDerWaalsContact O-N 3.15Å; D1731-V1733 HydrophobicContact CB-CG2 3.96Å; D1731-V1733 PolarHBondContact O-N 3.27Å; D1731-V1733 VanDerWaalsContact O-N 3.17Å
1732	F	34	Very low	40.1	Very low	198.6 Å²	198.6	151.2 Å²	151.2	87%	0.871	76%	0.76	S	S	*	*			trans	-84.9	84.9	160.2	-83.2	-93.4	0	0	0	110.7	V1734	F1732-V1734 PolarHBondContact O-N 3.07Å
1733	V	40.2	Very low	41	Very low	108 Å²	108	148.3 Å²	148.3	66%	0.655	76%	0.761	S	S	*	*			trans	-94	123.9	154.7	-171	0	0	0	0	107.5	D1731 D1735	D1731-V1733 HydrophobicContact CB-CG2 3.96Å; D1731-V1733 PolarHBondContact O-N 3.27Å; D1731-V1733 VanDerWaalsContact O-N 3.17Å; V1733-D1735 HydrophobicContact CG1-CB 4.48Å; V1733-D1735 VanDerWaalsContact CG1-CG 3.44Å; V1733-D1735 VanDerWaalsContact CG1-OD1 3.27Å; V1733-D1735 WeakPolarHBondContact CG1-OD1 3.33Å; V1733-D1735 VanDerWaalsContact CG1-OD2 3.27Å; V1733-D1735 WeakPolarHBondContact CG1-OD2 3.17Å
1734	V	43.2	Very low	41.4	Very low	105 Å²	105	150 Å²	150	64%	0.636	77%	0.766	S	S	*	*			trans	-102.8	98.1	163.5	-179.6	0	0	0	0	105.2	F1732 F1736 R2193	F1732-V1734 PolarHBondContact O-N 3.07Å; V1734-F1736 HydrophobicContact CB-CE2 4.46Å; V1734-F1736 HydrophobicContact CG1-CD2 4.1Å; V1734-F1736 HydrophobicContact CG1-CE2 3.9Å; V1734-F1736 HydrophobicContact CG1-CZ 4.27Å; V1734-F1736 WeakPolarHBondContact O-CD2 3.36Å; V1734-F1736 PolarHBondContact O-N 3Å; V1734-R2193 PolarHBondContact O-NH2 3.25Å
1735	D	43.5	Very low	42	Very low	117.2 Å²	117.2	143.2 Å²	143.2	63%	0.627	76%	0.762	S	S	*	*			trans	-75.2	126.9	171.2	-66.7	-59.8	0	0	0	108.4	V1733 D1737 R2193	V1733-D1735 HydrophobicContact CG1-CB 4.48Å; V1733-D1735 VanDerWaalsContact CG1-CG 3.44Å; V1733-D1735 VanDerWaalsContact CG1-OD1 3.27Å; V1733-D1735 WeakPolarHBondContact CG1-OD1 3.33Å; V1733-D1735 VanDerWaalsContact CG1-OD2 3.27Å; V1733-D1735 WeakPolarHBondContact CG1-OD2 3.17Å; D1735-D1737 VanDerWaalsContact C-N 3.28Å; D1735-D1737 PolarHBondContact O-N 3.4Å; D1735-R2193 VanDerWaalsContact CG-CZ 3.43Å; D1735-R2193 WeakPolarHBondContact OD1-CG 3.47Å; D1735-R2193 IonicContact OD1-CZ 3.71Å; D1735-R2193 IonicContact OD1-NE 2.64Å; D1735-R2193 PolarHBondContact OD1-NE 3.06Å; D1735-R2193 IonicContact OD1-NH1 2.61Å; D1735-R2193 PolarHBondContact OD1-NH1 3.04Å; D1735-R2193 IonicContact OD1-NH2 3.78Å; D1735-R2193 PolarHBondContact OD1-NH2 2.93Å; D1735-R2193 IonicContact OD2-CZ 2.62Å; D1735-R2193 IonicContact OD2-NE 3.23Å; D1735-R2193 PolarHBondContact OD2-NE 3.41Å; D1735-R2193 IonicContact OD2-NH2 2.8Å
1736	F	39.8	Very low	42.6	Very low	177.2 Å²	177.2	146.3 Å²	146.3	78%	0.777	76%	0.764	S	S	*	*			trans	-106.3	105.5	168.7	-84	-86.4	0	0	0	107.1	V1734 E1738	V1734-F1736 HydrophobicContact CB-CE2 4.46Å; V1734-F1736 HydrophobicContact CG1-CD2 4.1Å; V1734-F1736 HydrophobicContact CG1-CE2 3.9Å; V1734-F1736 HydrophobicContact CG1-CZ 4.27Å; V1734-F1736 WeakPolarHBondContact O-CD2 3.36Å; V1734-F1736 PolarHBondContact O-N 3Å; F1736-E1738 PolarHBondContact O-N 3.16Å
1737	D	47.7	Very low	42.9	Very low	143.4 Å²	143.4	147.6 Å²	147.6	77%	0.767	77%	0.768	S	S	*	*			trans	-68.5	107.6	173.3	-56.8	-48.7	0	0	0	109.4	D1735 D1739	D1735-D1737 VanDerWaalsContact C-N 3.28Å; D1735-D1737 PolarHBondContact O-N 3.4Å; D1737-D1739 PolarHBondContact O-N 3.33Å
1738	E	39.1	Very low	43.3	Very low	176.8 Å²	176.8	141.5 Å²	141.5	83%	0.826	76%	0.759	S	S	*	*			trans	-37	114.4	143.1	-68.8	-177.9	150.2	0	0	110.5	F1736 D1740	F1736-E1738 PolarHBondContact O-N 3.16Å; E1738-D1740 VanDerWaalsContact C-N 3.29Å; E1738-D1740 PolarHBondContact O-N 2.88Å
1739	D	48.7	Very low	43.5	Very low	146.6 Å²	146.6	142.9 Å²	142.9	78%	0.784	76%	0.763	S	S	*	*			trans	-164.4	126.6	149.4	-84.5	-22.2	0	0	0	111.9	D1737	D1737-D1739 PolarHBondContact O-N 3.33Å
1740	D	47.4	Very low	43.7	Very low	142.2 Å²	142.2	139.8 Å²	139.8	76%	0.76	76%	0.757	S	S	*	*			trans	45.7	121.4	151.4	-67.7	-29	0	0	0	117.7	E1738	E1738-D1740 VanDerWaalsContact C-N 3.29Å; E1738-D1740 PolarHBondContact O-N 2.88Å
1741	D	49	Very low	44.1	Very low	146.6 Å²	146.6	140.9 Å²	140.9	78%	0.784	76%	0.757	S	S	*	*				122.4	130.7	128.6	-80.1	-25.2	0	0	0	119.2
1742	E	47.7	Very low	44.4	Very low	174.4 Å²	174.4	142 Å²	142	82%	0.815	76%	0.762	S	S	*	*			trans	67.9	123.2	152.8	-60.3	-174.7	150.9	0	0	118.7
1743	D	50.8	Low	45	Very low	155.4 Å²	155.4	136.8 Å²	136.8	83%	0.831	75%	0.751	S	S	*	*				144.4	132.2	128.7	-80.6	-27.4	0	0	0	117.6
1744	D	45.5	Very low	45.5	Very low	164.8 Å²	164.8	138.5 Å²	138.5	88%	0.881	76%	0.756	S	S	*	*			trans	-40.6	133.6	159.5	-85	-31.2	0	0	0	117.8
1745	G	43.7	Very low	45.7	Very low	70.4 Å²	70.4	140.2 Å²	140.2	73%	0.726	76%	0.762	S	S	*	*			trans	-160.3	62.9	167.9	0	0	0	0	0	117.9
1746	L	45.9	Very low	45.6	Very low	159.8 Å²	159.8	143.2 Å²	143.2	84%	0.837	77%	0.77	S	S	*	*			trans	50.1	130.6	161.1	-58.6	171.9	0	0	0	119.5
1747	N	40.3	Very low	46.3	Very low	146 Å²	146	141 Å²	141	78%	0.781	77%	0.766	S	S	*	*			trans	63.7	138.9	137.2	-88.7	-19.1	0	0	0	119.9
1748	S	41.2	Very low	46.2	Very low	98.2 Å²	98.2	138.5 Å²	138.5	69%	0.687	76%	0.758	S	S	*	*			cis	147.3	135.8	30.5	52.5	0	0	0	0	114.9
1749	K	40.4	Very low	46.5	Very low	193.2 Å²	193.2	137.2 Å²	137.2	84%	0.84	76%	0.756	S	S	*	*			trans	69.8	117.3	137.8	-170.5	165.2	-177.3	169.6	0	117.2
1750	A	45.9	Very low	46.4	Very low	73.8 Å²	73.8	138.1 Å²	138.1	61%	0.61	76%	0.761	S	S	*	*			trans	90.4	144.3	133.2	0	0	0	0	0	117.1
1751	D	49.4	Very low	45.9	Very low	136.2 Å²	136.2	138.9 Å²	138.9	73%	0.728	76%	0.76	S	S	*	*			cis	165.1	168.1	26.2	-69.6	-34.5	0	0	0	112.1
1752	D	48.5	Very low	45.7	Very low	147.2 Å²	147.2	137.9 Å²	137.9	79%	0.787	75%	0.754	S	S	*	*			trans	107.1	144.9	135.3	-81.7	-31	0	0	0	115.7
1753	S	47.3	Very low	45.2	Very low	89.4 Å²	89.4	138 Å²	138	63%	0.625	75%	0.754	S	S	*	*				59	147	65.5	73.7	0	0	0	0	117.1
1754	D	50.1	Low	44.5	Very low	145.2 Å²	145.2	134 Å²	134	78%	0.776	75%	0.749	S	S	*	*				166.7	140.8	109.2	-83	-40.1	0	0	0	117.1
1755	N	48.1	Very low	44.2	Very low	140.6 Å²	140.6	131.8 Å²	131.8	75%	0.752	75%	0.747	S	S	*	*			trans	98.7	133.6	132.3	-125.8	5	0	0	0	118.5
1756	F	40.3	Very low	43.8	Very low	179.6 Å²	179.6	133 Å²	133	79%	0.788	75%	0.745	S	S	*	*			trans	37.9	135	154.3	-116.5	-110.2	0	0	0	116.6	P1758	F1756-P1758 HydrophobicContact CE1-CG 3.83Å; F1756-P1758 HydrophobicContact CZ-CG 4.1Å
1757	D	54.9	Low	43.6	Very low	131.4 Å²	131.4	134.4 Å²	134.4	70%	0.703	74%	0.744	S	S	*	*			cis	-140.8	138.3	45.2	-157.5	4.4	0	0	0	110.5
1758	P	46.8	Very low	43.5	Very low	91.2 Å²	91.2	135.2 Å²	135.2	59%	0.592	74%	0.74	S	S	*	*			trans	-104.7	133.3	-177.8	37.7	-29.7	0	0	0	114	F1756	F1756-P1758 HydrophobicContact CE1-CG 3.83Å; F1756-P1758 HydrophobicContact CZ-CG 4.1Å
1759	N	44.1	Very low	43.2	Very low	148.8 Å²	148.8	140.4 Å²	140.4	80%	0.796	75%	0.746	S	S	*	*			trans	117.3	106.5	176.7	-59.2	-65.8	0	0	0	114.5
1760	D	46.7	Very low	42.9	Very low	166 Å²	166	136.5 Å²	136.5	89%	0.888	74%	0.743	S	S	*	*				-137.9	143.4	119.8	-110.6	-21.8	0	0	0	111.4
1761	E	38.2	Very low	42.4	Very low	158.4 Å²	158.4	136.5 Å²	136.5	74%	0.74	75%	0.751	S	S	*	*			trans	-103.6	171.6	-169.7	-162.5	-158.7	137.6	0	0	110
1762	I	43.8	Very low	41.8	Very low	126.6 Å²	126.6	138.9 Å²	138.9	65%	0.649	76%	0.757	S	S	*	*			trans	119.8	104.3	140.7	-68.5	166.6	0	0	0	116.4
1763	Q	37.6	Very low	41.1	Very low	175.6 Å²	175.6	141.1 Å²	141.1	82%	0.821	76%	0.76	S	S	*	*			trans	49.3	133.3	133.2	-51.9	169.8	27.2	0	0	121.6
1764	G	36.7	Very low	40.2	Very low	70.8 Å²	70.8	148.4 Å²	148.4	73%	0.73	77%	0.774	S	S	*	*			trans	160.3	47.1	153.8	0	0	0	0	0	121.2
1765	S	37.8	Very low	39.4	Very low	119.6 Å²	119.6	146.3 Å²	146.3	84%	0.836	77%	0.77	S	S	*	*			trans	64.7	144.4	161.8	76.2	0	0	0	0	117.6
1766	S	36.7	Very low	38.6	Very low	95.8 Å²	95.8	147.7 Å²	147.7	67%	0.67	77%	0.773	S	S	*	*				-146.7	137.3	96.7	-164.6	0	0	0	0	116
1767	K	40.1	Very low	38.2	Very low	189.2 Å²	189.2	145.1 Å²	145.1	82%	0.823	77%	0.771	S	S	*	*				175.7	141.7	120.5	-96.8	164.6	-173.8	158.9	0	114.1
1768	K	38	Very low	37	Very low	161.4 Å²	161.4	143.8 Å²	143.8	70%	0.702	77%	0.772	S	S	*	*			trans	50	139.8	157.7	-70.2	-178.1	176	-167.5	0	114.4
1769	Y	36.2	Very low	36.5	Very low	208 Å²	208	146.8 Å²	146.8	82%	0.816	78%	0.782	S	S	*	*				156.1	153.4	113	-83.7	-64.2	0	0	0	115.4
1770	S	33.3	Very low	35.8	Very low	111 Å²	111	147.3 Å²	147.3	78%	0.776	78%	0.779	S	S	*	*			trans	-88	143.9	178.1	56.2	0	0	0	0	114.9
1771	G	34.8	Very low	35.3	Very low	74.4 Å²	74.4	147.1 Å²	147.1	77%	0.767	78%	0.777	S	S	*	*			trans	164.9	153.2	131.2	0	0	0	0	0	113.1
1772	Q	37.4	Very low	34.9	Very low	186.4 Å²	186.4	146.3 Å²	146.3	87%	0.871	78%	0.778	S	S	*	*			trans	-81	137.3	133.7	-64.1	-176.8	-24.2	0	0	117.2
1773	K	33.6	Very low	34.4	Very low	194 Å²	194	144.2 Å²	144.2	84%	0.843	78%	0.78	S	S	*	*			trans	-8.3	129.3	150	-61.9	174.2	-179.6	172.3	0	117.3
1774	R	29.6	Very low	34.1	Very low	241.4 Å²	241.4	146.9 Å²	146.9	91%	0.911	78%	0.782	S	S	*	*				118.1	111.3	124.4	-167.8	179.5	-173	179.4	3.9	116.4
1775	S	32.4	Very low	33.9	Very low	101.2 Å²	101.2	148.9 Å²	148.9	71%	0.708	79%	0.785	S	S	*	*			trans	171.5	140.7	147.6	-173.7	0	0	0	0	113.6
1776	Q	31	Very low	33.6	Very low	170.6 Å²	170.6	147.3 Å²	147.3	80%	0.797	78%	0.779	S	S	*	*			trans	23.9	120.6	151.8	-69.1	-113.3	-2.6	0	0	113.9
1777	V	33	Very low	33.5	Very low	124.6 Å²	124.6	148.5 Å²	148.5	76%	0.755	78%	0.783	S	S	*	*			trans	-143.7	116.5	156.1	-175.7	0	0	0	0	109.9	I1779	V1777-I1779 HydrophobicContact CG1-CD1 4.29Å; V1777-I1779 HydrophobicContact CG1-CG1 4.07Å; V1777-I1779 PolarHBondContact O-N 2.77Å
1778	S	30	Very low	33.1	Very low	104.6 Å²	104.6	150.3 Å²	150.3	73%	0.731	78%	0.784	S	S	*	*			trans	-76.8	128.8	169.7	-14.5	0	0	0	0	111.2	H1780	S1778-H1780 PolarHBondContact O-N 3.42Å
1779	I	35.4	Very low	32.9	Very low	154.8 Å²	154.8	147.5 Å²	147.5	79%	0.794	79%	0.785	S	S	*	*			trans	-120.1	117.9	161.2	-68.6	175.3	0	0	0	109.4	V1777 L1781	V1777-I1779 HydrophobicContact CG1-CD1 4.29Å; V1777-I1779 HydrophobicContact CG1-CG1 4.07Å; V1777-I1779 PolarHBondContact O-N 2.77Å; I1779-L1781 HydrophobicContact CG2-CG 4.45Å; I1779-L1781 PolarHBondContact O-N 2.73Å
1780	H	29.5	Very low	33	Very low	159.2 Å²	159.2	145.6 Å²	145.6	74%	0.737	79%	0.788	S	S	*	*			trans	-74.9	146.7	174.1	-120.2	-113.6	0	0	0	111.1	S1778	S1778-H1780 PolarHBondContact O-N 3.42Å
1781	L	35.6	Very low	33.2	Very low	161.6 Å²	161.6	146 Å²	146	85%	0.846	79%	0.788	S	S	*	*			trans	-156.8	100	147.7	-75.1	179.2	0	0	0	111.8	I1779	I1779-L1781 HydrophobicContact CG2-CG 4.45Å; I1779-L1781 PolarHBondContact O-N 2.73Å
1782	N	31.1	Very low	33.2	Very low	142.2 Å²	142.2	150.2 Å²	150.2	76%	0.76	79%	0.788	S	S	*	*			trans	-88	134.7	134.2	-153.1	19	0	0	0	112.2
1783	A	32.2	Very low	33.1	Very low	82.4 Å²	82.4	152 Å²	152	68%	0.681	79%	0.788	S	S	*	*			trans	150.7	136.2	152.4	0	0	0	0	0	114.2
1784	R	31.7	Very low	33.4	Very low	231.2 Å²	231.2	149 Å²	149	87%	0.872	78%	0.781	S	S	*	*			trans	-42.6	147.2	145.1	-73.1	166.8	170.6	-176.7	-5.8	111.3	D1696	D1696-R1784 IonicContact OD2-CZ 3.49Å; D1696-R1784 IonicContact OD2-NH1 2.65Å; D1696-R1784 PolarHBondContact OD2-NH1 3.39Å; D1696-R1784 IonicContact OD2-NH2 2.73Å; D1696-R1784 PolarHBondContact OD2-NH2 3.44Å
1785	S	31.5	Very low	33.7	Very low	113.6 Å²	113.6	140.7 Å²	140.7	79%	0.794	77%	0.771	S	S	*	*				175.6	148.2	59.3	-93.4	0	0	0	0	111.9
1786	A	33.3	Very low	34.2	Very low	86 Å²	86	142.5 Å²	142.5	71%	0.711	78%	0.778	S	S	*	*			trans	60.6	126.9	150	0	0	0	0	0	117.4	R1788	A1786-R1788 PolarHBondContact O-N 2.94Å
1787	T	33.7	Very low	34.6	Very low	120.6 Å²	120.6	137.9 Å²	137.9	74%	0.74	78%	0.776	S	S	*	*			trans	42.6	139.2	139.8	53.3	0	0	0	0	117.7	T2329	T1787-T2329 WeakPolarHBondContact CG2-O 3.34Å
1788	R	32.5	Very low	35	Very low	227.6 Å²	227.6	139.1 Å²	139.1	86%	0.859	78%	0.778	S	S	*	*			trans	95.2	147.2	133.9	-90.4	-175.6	170.1	-155.7	-1.8	115.9	A1786	A1786-R1788 PolarHBondContact O-N 2.94Å
1789	S	32.9	Very low	35.5	Very low	102.6 Å²	102.6	139.6 Å²	139.6	72%	0.717	78%	0.777	S	S	*	*			trans	-138	138.8	153.5	47.4	0	0	0	0	112.7
1790	L	38.2	Very low	35.9	Very low	166.6 Å²	166.6	138.1 Å²	138.1	87%	0.872	78%	0.775	S	S	*	*			trans	-64.5	142.5	157.9	-72.1	164.3	0	0	0	111.4	Q1792	L1790-Q1792 PolarHBondContact O-N 2.86Å
1791	P	37.2	Very low	36.9	Very low	119.6 Å²	119.6	136.5 Å²	136.5	78%	0.777	77%	0.772	S	S	*	*			trans	-90.8	157.9	147	25.6	-19.4	0	0	0	111.8
1792	Q	35.3	Very low	37.7	Very low	163.2 Å²	163.2	137.1 Å²	137.1	76%	0.763	77%	0.77	S	S	*	*			trans	-110.8	134.3	158.6	-176.7	172.4	-38.9	0	0	110.1	L1790 D1794	L1790-Q1792 PolarHBondContact O-N 2.86Å; Q1792-D1794 VanDerWaalsContact C-N 3.33Å; Q1792-D1794 PolarHBondContact NE2-OD2 2.98Å; Q1792-D1794 PolarHBondContact O-N 2.78Å; Q1792-D1794 VanDerWaalsContact O-OD1 3.1Å
1793	Y	35.9	Very low	38.6	Very low	225.2 Å²	225.2	137.2 Å²	137.2	88%	0.883	77%	0.771	S	S	*	*			trans	-98.7	103.3	169.3	-147.4	-85.1	0	0	0	112
1794	D	39.7	Very low	39.7	Very low	129.6 Å²	129.6	140.2 Å²	140.2	69%	0.693	77%	0.774	S	S	*	*			trans	-107.9	124.2	171	-72	-34.9	0	0	0	110.2	Q1792 V1796	Q1792-D1794 VanDerWaalsContact C-N 3.33Å; Q1792-D1794 PolarHBondContact NE2-OD2 2.98Å; Q1792-D1794 PolarHBondContact O-N 2.78Å; Q1792-D1794 VanDerWaalsContact O-OD1 3.1Å; D1794-V1796 PolarHBondContact O-N 2.92Å
1795	G	36.6	Very low	40.6	Very low	68 Å²	68	135.1 Å²	135.1	70%	0.701	76%	0.764	S	S	*	*			trans	-127.9	87.5	164.8	0	0	0	0	0	115.1
1796	V	41.6	Very low	41.5	Very low	139.2 Å²	139.2	136.9 Å²	136.9	84%	0.844	76%	0.76	S	S	*	*			trans	-148.5	124.4	166.8	-114.8	0	0	0	0	112.5	D1794	D1794-V1796 PolarHBondContact O-N 2.92Å
1797	G	40	Very low	42.7	Very low	73.6 Å²	73.6	141.6 Å²	141.6	76%	0.759	76%	0.76	S	S	*	*			trans	110	119	152.3	0	0	0	0	0	112
1798	D	42.2	Very low	43.6	Very low	149.6 Å²	149.6	142.4 Å²	142.4	80%	0.8	76%	0.76	S	S	*	*			cis	153.5	150.6	33.8	-155.4	6	0	0	0	111.5
1799	T	40.1	Very low	44.7	Very low	115.6 Å²	115.6	138.6 Å²	138.6	71%	0.709	76%	0.757	S	S	*	*			trans	50.9	123.6	-175.2	64.1	0	0	0	0	116.1	D1801	T1799-D1801 WeakPolarHBondContact CB-OD2 3.36Å; T1799-D1801 WeakPolarHBondContact CG2-OD2 3.47Å; T1799-D1801 PolarHBondContact O-N 3.43Å
1800	T	44.1	Very low	45.7	Very low	123.8 Å²	123.8	140.3 Å²	140.3	76%	0.76	76%	0.758	S	S	*	*				-115	135.7	97.9	53.5	0	0	0	0	112.1
1801	D	50.2	Low	46.6	Very low	124.4 Å²	124.4	138.4 Å²	138.4	67%	0.665	75%	0.749	S	S	*	*				-101.5	145.3	127.4	-56.2	-57.7	0	0	0	110.9	T1799	T1799-D1801 WeakPolarHBondContact CB-OD2 3.36Å; T1799-D1801 WeakPolarHBondContact CG2-OD2 3.47Å; T1799-D1801 PolarHBondContact O-N 3.43Å
1802	E	51	Low	47.5	Very low	173.8 Å²	173.8	138.6 Å²	138.6	81%	0.812	74%	0.744	S	S	*	*				165.3	132.7	61.7	-92.7	171.9	-178.7	0	0	112.5
1803	D	51.4	Low	48.3	Very low	145.6 Å²	145.6	137.5 Å²	137.5	78%	0.779	74%	0.743	S	S	*	*			trans	43.4	152.5	160.3	-60.5	-22.4	0	0	0	119.9
1804	I	55	Low	49.1	Very low	144.6 Å²	144.6	131 Å²	131	74%	0.742	74%	0.736	S	S	*	*			trans	143.7	117.9	131.7	-90.9	164.7	0	0	0	112.2
1805	D	49.7	Very low	49.8	Very low	123.8 Å²	123.8	131.8 Å²	131.8	66%	0.662	74%	0.738	S	S	*	*			trans	59.3	137.2	145.5	-49.6	-30.4	0	0	0	119.3	Y1807	D1805-Y1807 HydrophobicContact CB-CD2 4.14Å; D1805-Y1807 HydrophobicContact CB-CE2 3.88Å
1806	E	51.6	Low	50.6	Low	152.2 Å²	152.2	135.1 Å²	135.1	71%	0.711	74%	0.74	S	S	*	*				64.6	136.3	128	-124.3	176.2	-162.9	0	0	115.9
1807	Y	57.7	Low	51.1	Low	183.6 Å²	183.6	135.2 Å²	135.2	72%	0.72	74%	0.736	S	S	*	*			trans	-165.4	129.9	140.7	-69.4	-78.7	0	0	0	114.1	D1805	D1805-Y1807 HydrophobicContact CB-CD2 4.14Å; D1805-Y1807 HydrophobicContact CB-CE2 3.88Å
1808	D	53.6	Low	51.7	Low	137.8 Å²	137.8	140.2 Å²	140.2	74%	0.737	74%	0.739	S	S	*	*			trans	-60.8	163.3	145.2	-59.1	-67.7	0	0	0	111.9
1809	D	54.8	Low	52.1	Low	147.8 Å²	147.8	142 Å²	142	79%	0.79	74%	0.743	S	S	*	*			trans	137	118.2	155.4	-74.4	-20.5	0	0	0	110.3
1810	D	54.6	Low	52.8	Low	138 Å²	138	145.3 Å²	145.3	74%	0.738	75%	0.75	S	S	*	*				109.8	165.5	58.4	-112.4	-19.2	0	0	0	114.4
1811	D	56.8	Low	53	Low	127.6 Å²	127.6	146.6 Å²	146.6	68%	0.682	75%	0.753	S	S	*	*			trans	68.5	125.1	152.1	-71.4	-8.3	0	0	0	120.9
1812	N	54.8	Low	53.5	Low	124.4 Å²	124.4	147.9 Å²	147.9	67%	0.665	76%	0.758	S	S	*	*				154.9	145.8	71.6	-86	-42.7	0	0	0	115.3
1813	D	52.8	Low	53.6	Low	139.8 Å²	139.8	145.3 Å²	145.3	75%	0.748	75%	0.753	S	S	*	*			trans	36.7	122.3	144.7	-54.2	-22.4	0	0	0	118.9
1814	A	52.3	Low	53.7	Low	88.4 Å²	88.4	144.7 Å²	144.7	73%	0.731	75%	0.751	S	S	*	*			cis	94.6	156.6	37.5	0	0	0	0	0	111.6
1815	I	55.6	Low	53.6	Low	146.4 Å²	146.4	143.8 Å²	143.8	75%	0.751	75%	0.747	S	S	*	*			trans	97.6	114.7	177.7	-70.6	163.2	0	0	0	111.5
1816	D	52.9	Low	53.9	Low	137.8 Å²	137.8	147.6 Å²	147.6	74%	0.737	75%	0.754	S	S	*	*				87.9	148	63.3	-73.6	-26.3	0	0	0	113.6
1817	D	51.8	Low	53.8	Low	140.6 Å²	140.6	147.7 Å²	147.7	75%	0.752	76%	0.759	S	S	*	*			trans	39	139	142.6	-65.8	-36.7	0	0	0	116.1
1818	E	53.2	Low	53.8	Low	178.4 Å²	178.4	148.8 Å²	148.8	83%	0.834	76%	0.763	S	S	*	*			trans	109	127.8	130.4	-86.2	167.6	-171.1	0	0	115
1819	E	49.6	Very low	53.7	Low	188 Å²	188	147.6 Å²	147.6	88%	0.879	76%	0.761	S	S	*	*			trans	25.9	124.3	131.8	-68.6	-173.6	155.3	0	0	114.1
1820	E	55.5	Low	53.6	Low	184 Å²	184	147 Å²	147	86%	0.86	76%	0.757	S	S	*	*			trans	-144.8	141.1	141.7	-104.1	-172.3	171.9	0	0	112	I1822	E1820-I1822 PolarHBondContact O-N 3.43Å; E1820-I1822 VanDerWaalsContact O-N 3.07Å
1821	D	48.1	Very low	53.5	Low	151.6 Å²	151.6	148.8 Å²	148.8	81%	0.811	76%	0.761	S	S	*	*			trans	-74.9	147.9	177.1	-74.1	-51.3	0	0	0	113.4
1822	I	59.7	Low	53.1	Low	151 Å²	151	150.3 Å²	150.3	77%	0.774	77%	0.769	S	S	*	*			trans	-161.6	118.9	150.4	-78.7	166.5	0	0	0	109.9	E1820	E1820-I1822 PolarHBondContact O-N 3.43Å; E1820-I1822 VanDerWaalsContact O-N 3.07Å
1823	V	53.4	Low	53	Low	119.2 Å²	119.2	149.8 Å²	149.8	72%	0.722	77%	0.774	S	S	*	*			trans	-127.1	139.6	165.7	-120.7	0	0	0	0	110.1
1824	D	54.2	Low	52.9	Low	134 Å²	134	149.8 Å²	149.8	72%	0.717	77%	0.774	S	S	*	*			trans	165.3	119.2	166.1	-74.3	-30	0	0	0	112.7	Y1826	D1824-Y1826 HydrophobicContact CB-CD2 4.5Å; D1824-Y1826 HydrophobicContact CB-CE2 4.36Å
1825	D	52.8	Low	53.1	Low	124.4 Å²	124.4	155.6 Å²	155.6	67%	0.665	78%	0.779	S	S	*	*				-131.5	147.1	56.6	-152.9	9.8	0	0	0	111.6
1826	Y	55.4	Low	52.9	Low	204.6 Å²	204.6	154.6 Å²	154.6	80%	0.802	78%	0.775	S	S	*	*			trans	-161	105.3	159.1	-71	-65.6	0	0	0	113.9	D1824	D1824-Y1826 HydrophobicContact CB-CD2 4.5Å; D1824-Y1826 HydrophobicContact CB-CE2 4.36Å
1827	D	49.9	Very low	52.9	Low	153.4 Å²	153.4	154.5 Å²	154.5	82%	0.82	78%	0.775	S	S	*	*			trans	-84.2	145.6	151.4	-81.1	-41.3	0	0	0	110.8
1828	Y	58	Low	53	Low	206.8 Å²	206.8	154.4 Å²	154.4	81%	0.811	77%	0.774	S	S	*	*			trans	-141.7	124	165	-143.6	-95	0	0	0	111.8	D1830	Y1828-D1830 VanDerWaalsContact CE1-CG 3.43Å; Y1828-D1830 WeakPolarHBondContact CE1-OD1 3.25Å; Y1828-D1830 WeakPolarHBondContact CE1-OD2 3.34Å; Y1828-D1830 VanDerWaalsContact CZ-OD1 3.27Å; Y1828-D1830 PolarHBondContact OH-OD1 3.02Å
1829	V	52.1	Low	53.2	Low	113 Å²	113	153.1 Å²	153.1	69%	0.685	77%	0.773	S	S	*	*			trans	-72.7	157.6	171.5	-89.5	0	0	0	0	115.2
1830	D	51.7	Low	53.4	Low	135.2 Å²	135.2	151.4 Å²	151.4	72%	0.723	77%	0.77	S	S	*	*			trans	-30.9	139.2	158.3	-51.7	-49.3	0	0	0	112.4	Y1828	Y1828-D1830 VanDerWaalsContact CE1-CG 3.43Å; Y1828-D1830 WeakPolarHBondContact CE1-OD1 3.25Å; Y1828-D1830 WeakPolarHBondContact CE1-OD2 3.34Å; Y1828-D1830 VanDerWaalsContact CZ-OD1 3.27Å; Y1828-D1830 PolarHBondContact OH-OD1 3.02Å
1831	E	51.8	Low	53.5	Low	176 Å²	176	150.2 Å²	150.2	82%	0.822	77%	0.769	S	S	*	*			trans	-147.1	147.7	137.4	-116	177.3	-177.4	0	0	109.4
1832	D	49.1	Very low	53.8	Low	158.6 Å²	158.6	150.2 Å²	150.2	85%	0.848	77%	0.769	S	S	*	*			trans	-57.9	147.1	177.2	-54.8	-62.5	0	0	0	114.7
1833	C	52.9	Low	53.5	Low	114.4 Å²	114.4	146.1 Å²	146.1	77%	0.773	77%	0.765	S	S	*	*				-157.8	112	115.5	51.1	0	0	0	0	111.8	Y1835	C1833-Y1835 VanDerWaalsContact C-N 3.32Å; C1833-Y1835 HydrophobicContact CB-CD2 4.08Å; C1833-Y1835 HydrophobicContact CB-CE2 4.28Å; C1833-Y1835 PolarHBondContact O-N 3.34Å
1834	D	49.9	Very low	53.3	Low	139.8 Å²	139.8	148 Å²	148	75%	0.748	77%	0.766	S	S	*	*			trans	-84	129.6	157.6	-135.9	-18.5	0	0	0	109.2	N1836	D1834-N1836 PolarHBondContact OD1-ND2 2.97Å
1835	Y	58	Low	53.2	Low	211 Å²	211	151.9 Å²	151.9	83%	0.827	77%	0.772	S	S	*	*			trans	-119.1	128.9	164	-94.8	-85.2	0	0	0	111.1	C1833	C1833-Y1835 VanDerWaalsContact C-N 3.32Å; C1833-Y1835 HydrophobicContact CB-CD2 4.08Å; C1833-Y1835 HydrophobicContact CB-CE2 4.28Å; C1833-Y1835 PolarHBondContact O-N 3.34Å
1836	N	50	Low	53.3	Low	124.2 Å²	124.2	154.8 Å²	154.8	66%	0.664	78%	0.775	S	S	*	*			trans	-100.2	157.8	162	-58.4	-86.1	0	0	0	109.1	D1834	D1834-N1836 PolarHBondContact OD1-ND2 2.97Å
1837	D	53.8	Low	53.1	Low	137 Å²	137	154 Å²	154	73%	0.733	77%	0.772	S	S	*	*			trans	159.8	134.2	157.8	-83.2	-21	0	0	0	110.2
1838	D	53.2	Low	53.2	Low	138.4 Å²	138.4	153.5 Å²	153.5	74%	0.74	77%	0.769	S	S	*	*				71.8	145	108.3	-73.1	-14.8	0	0	0	116.4
1839	D	57.2	Low	52.7	Low	150.6 Å²	150.6	149.6 Å²	149.6	81%	0.805	76%	0.762	S	S	*	*			trans	115.1	103.4	149.3	-77.3	-17.9	0	0	0	116
1840	D	55.5	Low	52.6	Low	153.2 Å²	153.2	152.5 Å²	152.5	82%	0.819	77%	0.768	S	S	*	*			trans	1.5	133.9	143.4	-59.3	-40.6	0	0	0	117
1841	D	57.5	Low	52.5	Low	158.2 Å²	158.2	154.2 Å²	154.2	85%	0.846	77%	0.772	S	S	*	*				-175.7	136.9	113.8	-153.1	3.5	0	0	0	111	G1843	D1841-G1843 PolarHBondContact O-N 3.46Å
1842	D	53.1	Low	52.6	Low	150.4 Å²	150.4	152.4 Å²	152.4	80%	0.804	77%	0.767	S	S	*	*			trans	-113	145.7	-179.7	58.5	-41.9	0	0	0	114.1	E1844	D1842-E1844 PolarHBondContact O-N 2.82Å
1843	G	53.8	Low	52.8	Low	66 Å²	66	152.2 Å²	152.2	68%	0.68	76%	0.761	S	S	*	*			trans	-133.7	99.6	-176	0	0	0	0	0	115.4	D1841 Y1845	D1841-G1843 PolarHBondContact O-N 3.46Å; G1843-Y1845 PolarHBondContact O-N 3.45Å
1844	E	49.3	Very low	52.5	Low	159 Å²	159	154.9 Å²	154.9	74%	0.743	76%	0.762	S	S	*	*			trans	-65	139.3	161.4	-69	-169.3	148	0	0	114.5	D1842	D1842-E1844 PolarHBondContact O-N 2.82Å
1845	Y	52.9	Low	52.6	Low	215.8 Å²	215.8	155.2 Å²	155.2	85%	0.846	76%	0.764	S	S	*	*			trans	-104.4	132.1	161	-81.5	-99.4	0	0	0	111.2	G1843 Y1847	G1843-Y1845 PolarHBondContact O-N 3.45Å; Y1845-Y1847 HydrophobicContact CD1-CE2 4.48Å
1846	Y	53.3	Low	52.2	Low	185.2 Å²	185.2	153.5 Å²	153.5	73%	0.726	76%	0.763	S	S	*	*			trans	-109.8	132.6	166.3	-90.2	-100.3	0	0	0	111.5
1847	Y	51.9	Low	52.4	Low	188 Å²	188	153.3 Å²	153.3	74%	0.737	77%	0.767	S	S	*	*			trans	-84.6	133.4	155.7	-82.5	-97.8	0	0	0	109.4	Y1845	Y1845-Y1847 HydrophobicContact CD1-CE2 4.48Å
1848	D	53	Low	52.3	Low	143.2 Å²	143.2	152 Å²	152	77%	0.766	76%	0.764	S	S	*	*			trans	-138.8	130.2	132.4	-149.2	-0.6	0	0	0	110.8
1849	N	47.6	Very low	52.1	Low	125.2 Å²	125.2	153.3 Å²	153.3	67%	0.67	77%	0.765	S	S	*	*			trans	-139.7	147.3	-179.5	-60.7	-79.9	0	0	0	110.5
1850	E	49.1	Very low	51.7	Low	172.6 Å²	172.6	153.7 Å²	153.7	81%	0.807	76%	0.762	S	S	*	*			trans	169.7	132.1	152.4	-67.7	178	-174.3	0	0	111.8
1851	E	49.7	Very low	51.5	Low	170.4 Å²	170.4	152.4 Å²	152.4	80%	0.796	76%	0.755	S	S	*	*				113.2	118.5	82.2	-131.8	172.6	-162.4	0	0	112.6
1852	L	54.1	Low	51.2	Low	139 Å²	139	152.9 Å²	152.9	73%	0.728	75%	0.753	S	S	*	*			trans	117.6	118.5	137.8	-72.7	174.5	0	0	0	111.8
1853	E	52.2	Low	51.4	Low	154.8 Å²	154.8	151.9 Å²	151.9	72%	0.723	75%	0.747	S	S	*	*				75	145.9	92.4	-91.5	161.5	-167.3	0	0	111.3
1854	E	46.9	Very low	51.4	Low	170.2 Å²	170.2	154.8 Å²	154.8	80%	0.795	75%	0.747	S	S	*	*			cis	160.9	169.5	23.9	-96.8	172.8	-170.3	0	0	110.6
1855	D	52.3	Low	51.5	Low	147.8 Å²	147.8	154 Å²	154	79%	0.79	75%	0.748	S	S	*	*			trans	105.6	109.7	152.2	-86.6	-18.8	0	0	0	115.6
1856	E	49.8	Very low	51.2	Low	173.4 Å²	173.4	151.1 Å²	151.1	81%	0.81	75%	0.747	S	S	*	*				51.3	130.5	112.4	-96.9	-165.3	176.8	0	0	116.9	V1858	E1856-V1858 HydrophobicContact CG-CG2 4.33Å
1857	V	53.8	Low	51.1	Low	120.8 Å²	120.8	151.4 Å²	151.4	73%	0.732	76%	0.755	S	S	*	*				-121.2	142.7	112.6	-135.1	0	0	0	0	115.4	E1859	V1857-E1859 HydrophobicContact CG1-CG 4.45Å
1858	V	52.1	Low	50.8	Low	110.4 Å²	110.4	151.7 Å²	151.7	67%	0.669	76%	0.756	S	S	*	*			trans	-98.7	149.8	148.4	-155.7	0	0	0	0	110.8	E1856 E1860	E1856-V1858 HydrophobicContact CG-CG2 4.33Å; V1858-E1860 HydrophobicContact CG1-CB 4.29Å; V1858-E1860 HydrophobicContact CG1-CG 4.04Å
1859	E	49.2	Very low	50.2	Low	165.8 Å²	165.8	152.2 Å²	152.2	78%	0.775	75%	0.752	S	S	*	*			trans	-115.6	164.7	143.3	-68.3	-65.8	175.8	0	0	111.3	V1857	V1857-E1859 HydrophobicContact CG1-CG 4.45Å
1860	E	48.2	Very low	49.8	Very low	159.2 Å²	159.2	151.3 Å²	151.3	74%	0.744	75%	0.752	S	S	*	*			trans	163.5	158.5	154	-79.8	167.6	-167.8	0	0	113.1	V1858 M2336	V1858-E1860 HydrophobicContact CG1-CB 4.29Å; V1858-E1860 HydrophobicContact CG1-CG 4.04Å; E1860-M2336 WeakPolarHBondContact O-CB 3.39Å; E1860-M2336 VanDerWaalsContact O-CG 3.22Å; E1860-M2336 WeakPolarHBondContact O-CG 3.44Å
1861	D	53	Low	49	Very low	126 Å²	126	150.2 Å²	150.2	67%	0.674	75%	0.751	S	S	*	*			trans	108.4	142	-141.8	-75.3	-28	0	0	0	115	M2336 I2337 S2338	D1861-M2336 HydrophobicContact CB-CB 4.07Å; D1861-M2336 WeakPolarHBondContact OD2-CB 3.5Å; D1861-I2337 HydrophobicContact CB-CB 3.74Å; D1861-I2337 HydrophobicContact CB-CG2 4.09Å; D1861-I2337 PolarHBondContact OD2-N 3.36Å; D1861-S2338 WeakPolarHBondContact CB-OG 3.19Å
1862	E	50.2	Low	48.3	Very low	168.4 Å²	168.4	149.7 Å²	149.7	79%	0.787	75%	0.753	S	S	*	*				87.5	146.5	60.5	-74.6	-155.9	147.8	0	0	119.2	I2337 S2338	E1862-I2337 VanDerWaalsContact C-CG2 3.43Å; E1862-I2337 WeakPolarHBondContact O-CG2 3.4Å; E1862-S2338 VanDerWaalsContact O-CA 3.3Å; E1862-S2338 WeakPolarHBondContact O-CA 3.47Å; E1862-S2338 WeakPolarHBondContact O-CB 3.43Å; E1862-S2338 PolarHBondContact O-N 2.95Å; E1862-S2338 PolarHBondContact O-OG 2.81Å
1863	D	56.3	Low	47.4	Very low	127.8 Å²	127.8	148.6 Å²	148.6	68%	0.683	75%	0.754	S	S	*	*			trans	81.7	92	165.5	-82.8	7.2	0	0	0	120.2	I2337	D1863-I2337 HydrophobicContact CB-CG2 3.34Å
1864	D	54	Low	46.5	Very low	127.6 Å²	127.6	152.3 Å²	152.3	68%	0.682	76%	0.761	S	S	*	*			trans	39.7	136.4	132	-73.7	-5.2	0	0	0	121.5	D2339	D1864-D2339 PolarHBondContact N-OD1 2.68Å
1865	N	51.7	Low	46	Very low	142.6 Å²	142.6	153.3 Å²	153.3	76%	0.763	76%	0.763	S	S	*	*				167.7	122.6	111	-91.8	-81.1	0	0	0	113.7
1866	D	46.1	Very low	45	Very low	154 Å²	154	153.4 Å²	153.4	82%	0.824	76%	0.758	S	S	*	*			trans	-76.2	149.1	169.6	-67.3	-53.1	0	0	0	117.2
1867	E	52.2	Low	44.1	Very low	193 Å²	193	154.9 Å²	154.9	90%	0.902	76%	0.762	S	S	*	*			trans	176.2	111.5	141.4	-123.1	-177.2	169.2	0	0	113.4
1868	Y	46.2	Very low	42.9	Very low	192.6 Å²	192.6	156.9 Å²	156.9	76%	0.755	76%	0.763	S	S	*	*			cis	143.2	114.1	12.6	-178.9	-101.5	0	0	0	113.6
1869	F	39.2	Very low	42	Very low	154.6 Å²	154.6	159.6 Å²	159.6	68%	0.678	77%	0.771	S	S	*	*			trans	123	166.9	141.4	-83.9	-80.3	0	0	0	115.2	I1871	F1869-I1871 HydrophobicContact CB-CG1 4.06Å
1870	P	38.8	Very low	41.1	Very low	105.4 Å²	105.4	158.1 Å²	158.1	68%	0.684	76%	0.764	S	S	*	*			cis	-131.1	164.9	-48.8	32.5	-16	0	0	0	114.9
1871	I	32.7	Very low	40.4	Very low	151 Å²	151	155.3 Å²	155.3	77%	0.774	76%	0.762	S	S	*	*			trans	-47.6	142.1	160.3	-48.5	168.4	0	0	0	113.7	F1869	F1869-I1871 HydrophobicContact CB-CG1 4.06Å
1872	L	34.4	Very low	39.6	Very low	159.4 Å²	159.4	157.9 Å²	157.9	84%	0.835	77%	0.767	S	S	*	*			trans	172.4	137.9	150	-73.3	177.8	0	0	0	114.5	R1874	L1872-R1874 PolarHBondContact O-N 3.21Å
1873	P	36.7	Very low	38.8	Very low	114.8 Å²	114.8	157.1 Å²	157.1	75%	0.745	77%	0.768	S	S	*	*			trans	-112.9	156.6	-156.6	38.5	-30.1	0	0	0	115.3
1874	R	33.3	Very low	38	Very low	233.2 Å²	233.2	156.2 Å²	156.2	88%	0.88	77%	0.769	S	S	*	*			trans	-61.4	132.4	162.6	-152.3	-176.2	-157.4	-172.6	1.4	113.4	L1872	L1872-R1874 PolarHBondContact O-N 3.21Å
1875	K	35.3	Very low	37	Very low	192.2 Å²	192.2	156.9 Å²	156.9	84%	0.836	77%	0.769	S	S	*	*			trans	-136.9	152	153.7	-83.6	175.8	-178.8	179.8	0	111.9
1876	H	31.4	Very low	36.2	Very low	148.4 Å²	148.4	158.8 Å²	158.8	69%	0.687	77%	0.77	S	S	*	*			trans	-35	142.1	159.3	-69.4	-101.1	0	0	0	115.5
1877	F	31.7	Very low	35.6	Very low	205.6 Å²	205.6	156.6 Å²	156.6	90%	0.902	77%	0.767	S	S	*	*				-153.9	141.6	124.6	-94	-72.1	0	0	0	112.3
1878	H	28.2	Very low	34.9	Very low	163 Å²	163	153.3 Å²	153.3	76%	0.755	76%	0.762	S	S	*	*			trans	-132.5	145.9	165.3	-176.3	59.4	0	0	0	110.1	E1880	H1878-E1880 IonicContact CE1-OE2 3.18Å; H1878-E1880 IonicContact NE2-OE2 2.73Å; H1878-E1880 PolarHBondContact NE2-OE2 2.94Å
1879	M	33.9	Very low	34.1	Very low	166.6 Å²	166.6	153.3 Å²	153.3	82%	0.821	77%	0.766	S	S	*	*			trans	160.6	152.6	169.1	-83.8	-152.5	125.9	0	0	112.1
1880	E	28.6	Very low	33.8	Very low	134.6 Å²	134.6	153.8 Å²	153.8	63%	0.629	78%	0.775	S	S	*	*				-148.8	145	-72.7	-172.6	-171.6	131.2	0	0	110	H1878 K1882	H1878-E1880 IonicContact CE1-OE2 3.18Å; H1878-E1880 IonicContact NE2-OE2 2.73Å; H1878-E1880 PolarHBondContact NE2-OE2 2.94Å; E1880-K1882 WeakPolarHBondContact OE1-CE 3.26Å; E1880-K1882 IonicContact OE1-NZ 2.95Å; E1880-K1882 PolarHBondContact OE1-NZ 3.05Å
1881	S	34.9	Very low	33.6	Very low	100 Å²	100	153.7 Å²	153.7	70%	0.699	78%	0.777	S	S	*	*			trans	163.1	124.2	162.8	56.1	0	0	0	0	115.2
1882	K	36.2	Very low	33.6	Very low	181 Å²	181	155.9 Å²	155.9	79%	0.787	78%	0.781	S	S	*	*				111	125.3	100.4	-73.5	162.3	-174.8	163.4	0	116.5	E1880	E1880-K1882 WeakPolarHBondContact OE1-CE 3.26Å; E1880-K1882 IonicContact OE1-NZ 2.95Å; E1880-K1882 PolarHBondContact OE1-NZ 3.05Å
1883	N	32.8	Very low	33.6	Very low	151.2 Å²	151.2	155.9 Å²	155.9	81%	0.809	78%	0.78	S	S	*	*			trans	-48.4	166.1	154.5	-93.9	-13.5	0	0	0	114	E1885	N1883-E1885 HydrophobicContact CB-CG 4.4Å
1884	P	40.2	Very low	33.5	Very low	109.8 Å²	109.8	154.9 Å²	154.9	71%	0.713	78%	0.781	S	S	*	*				-142.5	160.9	51.6	40	-23.7	0	0	0	116.9
1885	E	32.5	Very low	33.5	Very low	142.6 Å²	142.6	148.3 Å²	148.3	67%	0.666	78%	0.776	S	S	*	*			trans	45.5	131.2	131.1	-58.9	-166.8	129.4	0	0	121.4	N1883	N1883-E1885 HydrophobicContact CB-CG 4.4Å
1886	K	34.4	Very low	33.6	Very low	180.8 Å²	180.8	144.6 Å²	144.6	79%	0.786	77%	0.772	S	S	*	*				106.3	125.7	126.5	-80.5	156.3	-175.9	153.7	0	118.2
1887	S	32.7	Very low	33.5	Very low	109.8 Å²	109.8	143.3 Å²	143.3	77%	0.768	78%	0.778	S	S	*	*			trans	-88	165.8	157.7	47.1	0	0	0	0	114.3
1888	P	38	Very low	33.5	Very low	122.6 Å²	122.6	138.1 Å²	138.1	80%	0.796	77%	0.768	S	S	*	*				-134.3	-176.3	108.4	39.4	-26.1	0	0	0	115.4
1889	K	31	Very low	33.7	Very low	192.8 Å²	192.8	135.4 Å²	135.4	84%	0.838	76%	0.763	S	S	*	*			trans	-126.1	152.7	-177.7	-54.8	168.8	-179.1	173.9	0	113.1
1890	L	32.3	Very low	33.8	Very low	164.6 Å²	164.6	135.8 Å²	135.8	86%	0.862	76%	0.762	S	S	*	*			trans	166.5	129.7	150.8	-76.7	133	0	0	0	111.8
1891	S	34.1	Very low	33.9	Very low	103.4 Å²	103.4	134.6 Å²	134.6	72%	0.723	77%	0.769	S	S	*	*				156.6	149.7	53.7	59.4	0	0	0	0	112.8
1892	K	33.5	Very low	33.9	Very low	197.8 Å²	197.8	133.9 Å²	133.9	86%	0.86	77%	0.769	S	S	*	*			trans	-97.7	152.1	138	-87.3	-179.8	174.7	-179.2	0	112.8
1893	I	34.3	Very low	33.7	Very low	159.4 Å²	159.4	134.8 Å²	134.8	82%	0.817	77%	0.773	S	S	*	*			trans	161.5	118.6	160.2	-71.8	151.9	0	0	0	108
1894	A	33.7	Very low	33.7	Very low	94 Å²	94	132.3 Å²	132.3	78%	0.777	77%	0.768	S	S	*	*			cis	99.3	149.2	44.1	0	0	0	0	0	112.5
1895	A	33	Very low	33.4	Very low	93.2 Å²	93.2	134.1 Å²	134.1	77%	0.77	77%	0.771	S	S	*	*			trans	-121.2	-173.6	-172.8	0	0	0	0	0	111.4
1896	P	38.4	Very low	33.5	Very low	114.8 Å²	114.8	133.5 Å²	133.5	75%	0.745	78%	0.777	S	S	*	*			cis	-135.4	177	28.7	37.1	-19.4	0	0	0	116.2
1897	C	29.3	Very low	33.5	Very low	121.8 Å²	121.8	128.7 Å²	128.7	82%	0.823	77%	0.771	S	S	*	*			trans	78.3	152.4	139.2	-97	0	0	0	0	119.4
1898	S	32.2	Very low	33.7	Very low	96.8 Å²	96.8	128.9 Å²	128.9	68%	0.677	77%	0.77	S	S	*	*			cis	149.4	153.6	-45	-117.4	0	0	0	0	113.8
1899	T	32.3	Very low	33.6	Very low	106 Å²	106	127.4 Å²	127.4	65%	0.65	77%	0.768	S	S	*	*			cis	170.1	154.9	18.1	28.6	0	0	0	0	115.6
1900	H	34.7	Very low	33.7	Very low	174 Å²	174	124.7 Å²	124.7	81%	0.806	77%	0.768	S	S	*	*			trans	87.5	145.8	150.4	-57.6	-72.2	0	0	0	118.8
1901	S	31.6	Very low	33.9	Very low	110.4 Å²	110.4	122.1 Å²	122.1	77%	0.772	76%	0.761	S	S	*	*				123.3	144	128.5	143.7	0	0	0	0	116.4
1902	A	34.3	Very low	33.7	Very low	86 Å²	86	126.7 Å²	126.7	71%	0.711	77%	0.768	S	S	*	*			trans	147.4	145.2	139.8	0	0	0	0	0	113.7
1903	K	31.9	Very low	33.5	Very low	198.8 Å²	198.8	122.7 Å²	122.7	86%	0.864	76%	0.759	S	S	*	*			trans	103.4	152.8	166.9	-73.8	179	179.5	-179.6	0	115.1
1904	S	33.7	Very low	33.4	Very low	99.2 Å²	99.2	121.3 Å²	121.3	69%	0.694	76%	0.758	S	S	*	*			trans	150.6	134.3	149	55.4	0	0	0	0	114.8	T1906	S1904-T1906 PolarHBondContact O-N 3.43Å
1905	D	32.7	Very low	33.2	Very low	148.2 Å²	148.2	123.3 Å²	123.3	79%	0.793	75%	0.754	S	S	*	*			trans	153.1	152.7	146.1	-72.6	-46.8	0	0	0	114.6	A1907	D1905-A1907 PolarHBondContact O-N 2.99Å
1906	T	36.2	Very low	33.1	Very low	129.4 Å²	129.4	126.4 Å²	126.4	79%	0.794	76%	0.757	S	S	*	*			trans	95.6	116.9	150.7	-32.6	0	0	0	0	116.9	D1443 S1444 S1904	D1443-T1906 WeakPolarHBondContact O-CB 3.38Å; D1443-T1906 WeakPolarHBondContact O-CG2 3.18Å; D1443-T1906 PolarHBondContact O-OG1 3.11Å; S1444-T1906 VanDerWaalsContact N-CB 3.34Å; S1904-T1906 PolarHBondContact O-N 3.43Å
1907	A	32.8	Very low	32.8	Very low	79.8 Å²	79.8	129.3 Å²	129.3	66%	0.66	76%	0.758	S	S	*	*			trans	-125.3	178.9	169.2	0	0	0	0	0	114.1	D1443 S1444 H1445 D1905	D1443-A1907 VanDerWaalsContact CB-O 3.26Å; D1443-A1907 WeakPolarHBondContact CB-O 3.38Å; D1443-A1907 VanDerWaalsContact CG-O 3.22Å; S1444-A1907 PolarHBondContact O-N 2.98Å; H1445-A1907 HydrophobicContact CB-CB 3.82Å; H1445-A1907 WeakPolarHBondContact CD2-CB 3.35Å; D1905-A1907 PolarHBondContact O-N 2.99Å
1908	P	38.4	Very low	32.9	Very low	113.2 Å²	113.2	130.3 Å²	130.3	74%	0.735	76%	0.755	S	S	*	*			trans	-115.1	165.8	-176.1	37	-27.3	0	0	0	114.6	D1443 S1444 V1910	D1443-P1908 WeakPolarHBondContact OD1-CD 3.45Å; D1443-P1908 WeakPolarHBondContact OD1-CG 3.27Å; S1444-P1908 VanDerWaalsContact OG-CB 3.27Å; S1444-P1908 WeakPolarHBondContact OG-CB 3.5Å; S1444-P1908 VanDerWaalsContact OG-CG 3.32Å; S1444-P1908 WeakPolarHBondContact OG-CG 3.32Å; P1908-V1910 PolarHBondContact O-N 2.99Å
1909	A	34.5	Very low	32.8	Very low	92.8 Å²	92.8	132.3 Å²	132.3	77%	0.767	76%	0.758	S	S	*	*			trans	-135	148	166.1	0	0	0	0	0	113.2	H1445	H1445-A1909 PolarHBondContact CE1-N 3.01Å; H1445-A1909 PolarHBondContact CE1-O 2.91Å; H1445-A1909 PolarHBondContact ND1-N 2.89Å; H1445-A1909 PolarHBondContact NE2-N 2.84Å; H1445-A1909 VanDerWaalsContact NE2-N 3.2Å
1910	V	34.8	Very low	32.8	Very low	135.8 Å²	135.8	133.4 Å²	133.4	82%	0.823	77%	0.765	S	S	*	*			trans	-127.6	148.7	177.9	-171.7	0	0	0	0	109.6	P1908 K1912	P1908-V1910 PolarHBondContact O-N 2.99Å; V1910-K1912 PolarHBondContact O-N 2.91Å; V1910-K1912 VanDerWaalsContact O-N 3.12Å
1911	P	35.2	Very low	32.6	Very low	109.6 Å²	109.6	129.1 Å²	129.1	71%	0.712	76%	0.759	S	S	*	*			trans	-122	144.8	179.1	35.8	-25	0	0	0	116.6	V1913	P1911-V1913 PolarHBondContact O-N 3.3Å
1912	K	30.8	Very low	32.8	Very low	200.2 Å²	200.2	128.9 Å²	128.9	87%	0.87	76%	0.755	S	S	*	*			trans	17.2	141.3	150.3	-75.8	174.9	-177.6	175	0	117.4	V1910 V1914	V1910-K1912 PolarHBondContact O-N 2.91Å; V1910-K1912 VanDerWaalsContact O-N 3.12Å; K1912-V1914 PolarHBondContact O-N 3.05Å; K1912-V1914 VanDerWaalsContact O-N 3.14Å
1913	V	29.1	Very low	32.5	Very low	113.6 Å²	113.6	134.7 Å²	134.7	69%	0.688	76%	0.76	S	S	*	*			trans	-123.9	136	177.4	168.4	0	0	0	0	109.2	P1911 I1915	P1911-V1913 PolarHBondContact O-N 3.3Å; V1913-I1915 HydrophobicContact CG1-CD1 4.37Å; V1913-I1915 HydrophobicContact CG1-CG1 4.18Å; V1913-I1915 PolarHBondContact O-N 2.94Å; V1913-I1915 VanDerWaalsContact O-N 3.16Å
1914	V	32.1	Very low	32.5	Very low	128.8 Å²	128.8	132.8 Å²	132.8	78%	0.781	76%	0.758	S	S	*	*			trans	-135.8	126.8	163.7	175.9	0	0	0	0	108.2	K1912 L1916	K1912-V1914 PolarHBondContact O-N 3.05Å; K1912-V1914 VanDerWaalsContact O-N 3.14Å; V1914-L1916 HydrophobicContact CG1-CD2 4.14Å; V1914-L1916 HydrophobicContact CG1-CG 4.28Å; V1914-L1916 PolarHBondContact O-N 3.46Å
1915	I	30.1	Very low	32.3	Very low	137.2 Å²	137.2	138.4 Å²	138.4	70%	0.704	77%	0.765	S	S	*	*			trans	-114.8	119.7	166.7	-59.4	169.7	0	0	0	110.2	V1913 K1917	V1913-I1915 HydrophobicContact CG1-CD1 4.37Å; V1913-I1915 HydrophobicContact CG1-CG1 4.18Å; V1913-I1915 PolarHBondContact O-N 2.94Å; V1913-I1915 VanDerWaalsContact O-N 3.16Å; I1915-K1917 PolarHBondContact O-N 2.59Å
1916	L	31	Very low	32.2	Very low	157.2 Å²	157.2	134.5 Å²	134.5	82%	0.823	76%	0.761	S	S	*	*			trans	-128.9	131.2	159	-73.8	176.7	0	0	0	109.8	V1914 N1918	V1914-L1916 HydrophobicContact CG1-CD2 4.14Å; V1914-L1916 HydrophobicContact CG1-CG 4.28Å; V1914-L1916 PolarHBondContact O-N 3.46Å; L1916-N1918 PolarHBondContact O-N 3Å
1917	K	31	Very low	31.9	Very low	175.6 Å²	175.6	135.3 Å²	135.3	76%	0.763	76%	0.76	S	S	*	*			trans	-125	130.7	159.4	-84.3	-173.1	174	-178.9	0	110.8	I1915 N1919	I1915-K1917 PolarHBondContact O-N 2.59Å; K1917-N1919 PolarHBondContact O-N 3.24Å
1918	N	32.1	Very low	31.8	Very low	143.6 Å²	143.6	137.9 Å²	137.9	77%	0.768	77%	0.768	S	S	*	*			trans	176.6	138.4	149.5	-73.5	6.5	0	0	0	115.2	L1916	L1916-N1918 PolarHBondContact O-N 3Å
1919	N	30.3	Very low	31.4	Very low	138.6 Å²	138.6	137.1 Å²	137.1	74%	0.741	77%	0.771	S	S	*	*			trans	-39.9	144.6	175.1	-83	-1.6	0	0	0	117.1	K1917 A1921	K1917-N1919 PolarHBondContact O-N 3.24Å; N1919-A1921 PolarHBondContact O-N 2.8Å
1920	T	31.2	Very low	31.4	Very low	130 Å²	130	138.9 Å²	138.9	80%	0.798	77%	0.772	S	S	*	*			trans	66.4	122.6	138.9	-40.2	0	0	0	0	116.8
1921	A	30.8	Very low	31.2	Very low	82.8 Å²	82.8	138.4 Å²	138.4	68%	0.684	77%	0.77	S	S	*	*			trans	-98.2	173.1	145	0	0	0	0	0	112.5	N1919	N1919-A1921 PolarHBondContact O-N 2.8Å
1922	P	35.4	Very low	31.2	Very low	106.8 Å²	106.8	138.6 Å²	138.6	69%	0.694	77%	0.769	S	S	*	*			trans	-118.3	176.9	-141.4	38.9	-29.4	0	0	0	113.9	I1924	P1922-I1924 PolarHBondContact O-N 2.82Å
1923	Y	29	Very low	31.4	Very low	206.8 Å²	206.8	137.4 Å²	137.4	81%	0.811	76%	0.764	S	S	*	*			trans	-108.6	141.9	146.7	-101.8	-93.6	0	0	0	113.8	Y1925 S2328	Y1923-Y1925 HydrophobicContact CD1-CD2 4.35Å; Y1923-Y1925 HydrophobicContact CE1-CD2 4.07Å; Y1923-Y1925 HydrophobicContact CE1-CE2 4.45Å; Y1923-S2328 WeakPolarHBondContact CD2-OG 3.46Å; Y1923-S2328 WeakPolarHBondContact CE2-OG 3.28Å
1924	I	30.4	Very low	31.6	Very low	158.6 Å²	158.6	138.8 Å²	138.8	81%	0.813	77%	0.767	S	S	*	*			trans	-154.2	135.6	161.7	-68.4	174.8	0	0	0	110.5	P1922	P1922-I1924 PolarHBondContact O-N 2.82Å
1925	Y	29.7	Very low	31.7	Very low	216.8 Å²	216.8	140.5 Å²	140.5	85%	0.85	76%	0.764	S	S	*	*			trans	-113.2	150.1	172.9	-98.9	-101.8	0	0	0	110.5	Y1923	Y1923-Y1925 HydrophobicContact CD1-CD2 4.35Å; Y1923-Y1925 HydrophobicContact CE1-CD2 4.07Å; Y1923-Y1925 HydrophobicContact CE1-CE2 4.45Å
1926	G	31	Very low	32	Very low	67.2 Å²	67.2	139.8 Å²	139.8	69%	0.693	76%	0.762	S	S	*	*			trans	164.5	134.7	153.3	0	0	0	0	0	114.2
1927	N	29.9	Very low	32.1	Very low	147.2 Å²	147.2	138.5 Å²	138.5	79%	0.787	76%	0.755	S	S	*	*			trans	-102.1	161.9	-176.9	-81	-9.3	0	0	0	113.9	R2262	N1927-R2262 PolarHBondContact OD1-NH1 3.46Å
1928	T	31.6	Very low	32.3	Very low	133.4 Å²	133.4	136.1 Å²	136.1	82%	0.818	76%	0.756	S	S	*	*			trans	33.5	129.2	159.9	57.3	0	0	0	0	116.5
1929	A	29.6	Very low	32.3	Very low	96 Å²	96	136.5 Å²	136.5	79%	0.793	76%	0.758	S	S	*	*				-176.5	134.6	122	0	0	0	0	0	114.7
1930	T	33.8	Very low	32.5	Very low	130.4 Å²	130.4	135.3 Å²	135.3	80%	0.8	76%	0.758	S	S	*	*			trans	-130	127.8	152.1	36.6	0	0	0	0	111.6	V1932	T1930-V1932 PolarHBondContact O-N 2.84Å
1931	T	31.5	Very low	32.5	Very low	125.8 Å²	125.8	139.8 Å²	139.8	77%	0.772	76%	0.76	S	S	*	*				73	119.2	125	-51	0	0	0	0	116.9	K1933	T1931-K1933 HydrophobicContact CG2-CG 4.12Å
1932	V	34.6	Very low	32.5	Very low	113.8 Å²	113.8	141.6 Å²	141.6	69%	0.69	76%	0.762	S	S	*	*			trans	134.9	117.1	148.8	-179.3	0	0	0	0	114.8	T1930 N1934	T1930-V1932 PolarHBondContact O-N 2.84Å; V1932-N1934 PolarHBondContact O-N 2.85Å
1933	K	34.4	Very low	32.2	Very low	175.8 Å²	175.8	143.9 Å²	143.9	76%	0.764	77%	0.768	S	S	*	*			trans	158.1	117.6	136.5	-79.7	170.5	-168.9	168.8	0	115.6	T1931 K1935	T1931-K1933 HydrophobicContact CG2-CG 4.12Å; K1933-K1935 PolarHBondContact O-N 2.67Å
1934	N	33.4	Very low	32.3	Very low	141.6 Å²	141.6	139.1 Å²	139.1	76%	0.757	76%	0.764	S	S	*	*				51.4	132.5	126.4	-68	-2	0	0	0	116.6	V1932	V1932-N1934 PolarHBondContact O-N 2.85Å
1935	K	33.9	Very low	32.3	Very low	166.2 Å²	166.2	138.7 Å²	138.7	72%	0.723	76%	0.762	S	S	*	*				-164.1	159.5	52.6	-130.9	-177.6	170.5	-135.6	0	111.8	K1933	K1933-K1935 PolarHBondContact O-N 2.67Å
1936	D	37	Very low	32.5	Very low	122 Å²	122	134 Å²	134	65%	0.652	76%	0.759	S	S	*	*				-178.5	147.5	116.5	-96.2	-32.9	0	0	0	115.6
1937	N	32.6	Very low	32.4	Very low	128.8 Å²	128.8	135.6 Å²	135.6	69%	0.689	76%	0.759	S	S	*	*			trans	-89.3	139.9	138.4	-75.9	-45.5	0	0	0	115.4
1938	T	36.5	Very low	32.4	Very low	126 Å²	126	133.7 Å²	133.7	77%	0.773	76%	0.757	S	S	*	*				155.5	136.1	106.4	37.1	0	0	0	0	116.2
1939	N	30.6	Very low	32.3	Very low	152.2 Å²	152.2	133.5 Å²	133.5	81%	0.814	76%	0.756	S	S	*	*			trans	-69.6	157.9	147.8	-95.9	-29.3	0	0	0	114.3
1940	P	35.9	Very low	32.3	Very low	113.6 Å²	113.6	134.8 Å²	134.8	74%	0.738	75%	0.754	S	S	*	*				-126	174	68.3	39.5	-26.5	0	0	0	115.6
1941	R	30.8	Very low	32.2	Very low	224.4 Å²	224.4	134.8 Å²	134.8	85%	0.847	75%	0.754	S	S	*	*			trans	176.3	117.9	130.5	-153.5	174	-178.1	162.3	1.1	113.1	L1943	R1941-L1943 HydrophobicContact CG-CG 4.37Å
1942	V	30.1	Very low	32.1	Very low	120.6 Å²	120.6	134.6 Å²	134.6	73%	0.731	75%	0.753	S	S	*	*				21	133.7	121.5	-178.2	0	0	0	0	114
1943	L	29.9	Very low	31.9	Very low	155.4 Å²	155.4	135.3 Å²	135.3	81%	0.814	76%	0.758	S	S	*	*			trans	152.9	136.2	153.1	-77.7	173	0	0	0	113	R1941	R1941-L1943 HydrophobicContact CG-CG 4.37Å
1944	S	31.5	Very low	31.8	Very low	104.4 Å²	104.4	132.8 Å²	132.8	73%	0.73	76%	0.758	S	S	*	*			trans	-147.1	151.8	-153.2	12.7	0	0	0	0	113.3
1945	I	30.7	Very low	31.7	Very low	150.4 Å²	150.4	132.2 Å²	132.2	77%	0.771	76%	0.759	S	S	*	*			trans	-85.7	151.7	170.1	-52.8	166.9	0	0	0	111.3	S1947	I1945-S1947 WeakPolarHBondContact CG2-OG 3.43Å
1946	P	33.3	Very low	31.6	Very low	119.6 Å²	119.6	127.5 Å²	127.5	78%	0.777	76%	0.758	S	S	*	*				-120.9	142.7	121	32.3	-19.5	0	0	0	112.8
1947	S	28.3	Very low	31.4	Very low	100.6 Å²	100.6	130.4 Å²	130.4	70%	0.703	77%	0.767	S	S	*	*			trans	-24.4	125.6	137.7	-52.4	0	0	0	0	115.1	I1945	I1945-S1947 WeakPolarHBondContact CG2-OG 3.43Å
1948	S	30	Very low	31.2	Very low	106.4 Å²	106.4	135.3 Å²	135.3	74%	0.744	78%	0.776	S	S	*	*			trans	131.5	140.5	136.8	53.9	0	0	0	0	114.1
1949	T	30.8	Very low	31	Very low	129.4 Å²	129.4	136 Å²	136	79%	0.794	77%	0.774	S	S	*	*				-178.4	133.8	125.5	32.5	0	0	0	0	113.6
1950	T	29.2	Very low	31.2	Very low	123.4 Å²	123.4	136 Å²	136	76%	0.757	77%	0.772	S	S	*	*			trans	-84.2	130.1	162.1	37.7	0	0	0	0	113.7
1951	T	30.6	Very low	31	Very low	129.6 Å²	129.6	138 Å²	138	80%	0.795	78%	0.776	S	S	*	*				174.2	127.6	129.8	49.5	0	0	0	0	112.9
1952	T	30.2	Very low	31.2	Very low	121.4 Å²	121.4	133 Å²	133	75%	0.745	77%	0.772	S	S	*	*				-163.4	127.2	85.3	47.6	0	0	0	0	112.3
1953	T	30.7	Very low	31.3	Very low	129.2 Å²	129.2	131.3 Å²	131.3	79%	0.793	77%	0.771	S	S	*	*			trans	-144.9	140.6	141.6	13.3	0	0	0	0	112.8
1954	T	31.6	Very low	31.5	Very low	124.6 Å²	124.6	133.5 Å²	133.5	76%	0.764	77%	0.774	S	S	*	*				-150.9	137.4	96	-46	0	0	0	0	110.7	G1956	T1954-G1956 PolarHBondContact O-N 3.22Å; T1954-G1956 VanDerWaalsContact O-N 3.08Å
1955	T	32.5	Very low	31.6	Very low	128.6 Å²	128.6	135.9 Å²	135.9	79%	0.789	78%	0.778	S	S	*	*				-138.2	142.6	106.8	-46.4	0	0	0	0	113.1	Q1957	T1955-Q1957 HydrophobicContact CG2-CG 4.5Å
1956	G	31	Very low	31.7	Very low	66.8 Å²	66.8	137.5 Å²	137.5	69%	0.689	78%	0.779	S	S	*	*			trans	-166.4	164	161.9	0	0	0	0	0	115.4	T1954 R1958	T1954-G1956 PolarHBondContact O-N 3.22Å; T1954-G1956 VanDerWaalsContact O-N 3.08Å; G1956-R1958 PolarHBondContact O-N 2.97Å
1957	Q	32.7	Very low	31.8	Very low	184 Å²	184	137.7 Å²	137.7	86%	0.86	78%	0.778	S	S	*	*			trans	-120.4	140.6	163.6	-66.4	-179.8	-21.1	0	0	112.5	T1955 I1959	T1955-Q1957 HydrophobicContact CG2-CG 4.5Å; Q1957-I1959 VanDerWaalsContact C-N 3.29Å; Q1957-I1959 PolarHBondContact O-N 3.39Å
1958	R	28.9	Very low	32.2	Very low	230.2 Å²	230.2	138.4 Å²	138.4	87%	0.869	78%	0.781	S	S	*	*			trans	-78.4	127.8	158.2	-87.6	-174.2	172.5	-162.1	-1.3	114.8	G1956 I1960	G1956-R1958 PolarHBondContact O-N 2.97Å; R1958-I1960 PolarHBondContact O-N 2.96Å
1959	I	31.8	Very low	32.3	Very low	141.4 Å²	141.4	139.5 Å²	139.5	73%	0.725	78%	0.783	S	S	*	*			trans	-148.7	131.9	146.4	-77.8	168.7	0	0	0	110.5	Q1957 L1961	Q1957-I1959 VanDerWaalsContact C-N 3.29Å; Q1957-I1959 PolarHBondContact O-N 3.39Å; I1959-L1961 HydrophobicContact CG2-CD2 3.92Å; I1959-L1961 HydrophobicContact CG2-CG 4.21Å; I1959-L1961 PolarHBondContact O-N 3.45Å
1960	I	34.2	Very low	32.3	Very low	151.4 Å²	151.4	140.2 Å²	140.2	78%	0.776	78%	0.782	S	S	*	*				-151.3	154.6	98.1	-97.2	168	0	0	0	112.2	R1958	R1958-I1960 PolarHBondContact O-N 2.96Å
1961	L	31.9	Very low	32.4	Very low	155.4 Å²	155.4	139.4 Å²	139.4	81%	0.814	78%	0.777	S	S	*	*			trans	-103.9	163.8	177.1	-63	169.5	0	0	0	109.9	I1959	I1959-L1961 HydrophobicContact CG2-CD2 3.92Å; I1959-L1961 HydrophobicContact CG2-CG 4.21Å; I1959-L1961 PolarHBondContact O-N 3.45Å
1962	P	35	Very low	32.4	Very low	119.8 Å²	119.8	139.8 Å²	139.8	78%	0.778	77%	0.774	S	S	*	*				-130	174.4	67.1	36.1	-20.5	0	0	0	114.4
1963	A	32.8	Very low	32.6	Very low	85 Å²	85	140.8 Å²	140.8	70%	0.702	77%	0.77	S	S	*	*			trans	34.7	144.2	136.5	0	0	0	0	0	117.1	L1965	A1963-L1965 PolarHBondContact O-N 2.87Å
1964	K	33.6	Very low	32.7	Very low	201 Å²	201	142.6 Å²	142.6	87%	0.874	77%	0.767	S	S	*	*			trans	73.8	147.1	142.1	-67.3	173.6	-178.7	177.8	0	112.8
1965	L	33	Very low	32.7	Very low	155 Å²	155	141.3 Å²	141.3	81%	0.812	76%	0.763	S	S	*	*			cis	-135.6	155.1	10.8	-155.9	73.8	0	0	0	111.1	A1963	A1963-L1965 PolarHBondContact O-N 2.87Å
1966	K	33.6	Very low	32.7	Very low	185 Å²	185	142.7 Å²	142.7	80%	0.804	76%	0.764	S	S	*	*			trans	134.4	143.1	156.7	-99.2	-173.5	176.9	-175.7	0	116.1
1967	T	34.9	Very low	32.9	Very low	123.2 Å²	123.2	143.8 Å²	143.8	76%	0.756	76%	0.762	S	S	*	*			trans	-111.9	159.6	148.9	35.2	0	0	0	0	112.5
1968	P	36.9	Very low	32.9	Very low	116.4 Å²	116.4	142 Å²	142	76%	0.756	76%	0.757	S	S	*	*			trans	-123.4	161.1	142.6	36.3	-25.5	0	0	0	114
1969	T	31.8	Very low	33	Very low	128.6 Å²	128.6	137.9 Å²	137.9	79%	0.789	75%	0.753	S	S	*	*			trans	-86.7	143.4	148	49.5	0	0	0	0	114.3
1970	N	30.4	Very low	33.1	Very low	144.2 Å²	144.2	140.2 Å²	140.2	77%	0.771	76%	0.758	S	S	*	*				159.7	140.7	128.3	-133.4	-0.6	0	0	0	114
1971	T	32.3	Very low	32.9	Very low	105.6 Å²	105.6	138.5 Å²	138.5	65%	0.648	75%	0.754	S	S	*	*			trans	73.9	131.8	140.7	59.8	0	0	0	0	117
1972	N	30.8	Very low	33	Very low	140 Å²	140	138.3 Å²	138.3	75%	0.749	75%	0.753	S	S	*	*				154.3	134.5	127.2	-91	-1.4	0	0	0	115.9
1973	E	33.2	Very low	32.8	Very low	141.8 Å²	141.8	137 Å²	137	66%	0.663	75%	0.747	S	S	*	*			trans	56	139.9	142	-64.9	-173	177	0	0	119.6
1974	K	33.4	Very low	32.6	Very low	166.6 Å²	166.6	140.9 Å²	140.9	72%	0.724	76%	0.755	S	S	*	*				111.5	138.5	73.1	-89.1	168.5	-172.6	155.6	0	112.4
1975	S	31.4	Very low	32.6	Very low	97.4 Å²	97.4	134.6 Å²	134.6	68%	0.681	75%	0.747	S	S	*	*				148.3	135.5	74.2	44.1	0	0	0	0	114.4
1976	I	33.8	Very low	32.6	Very low	158.6 Å²	158.6	134.1 Å²	134.1	81%	0.813	75%	0.745	S	S	*	*				107.8	136.9	114.1	-76.9	161.8	0	0	0	113.8
1977	S	33.8	Very low	32.6	Very low	90 Å²	90	132.5 Å²	132.5	63%	0.629	74%	0.742	S	S	*	*			trans	-143.8	171.1	179.3	60	0	0	0	0	113.5
1978	N	33.6	Very low	32.5	Very low	144.6 Å²	144.6	134.6 Å²	134.6	77%	0.773	74%	0.741	S	S	*	*				176.7	157.9	89.4	-98	-22.5	0	0	0	114.7
1979	N	30.4	Very low	32.3	Very low	145.4 Å²	145.4	136.8 Å²	136.8	78%	0.778	74%	0.741	S	S	*	*			trans	-90.7	145.7	174.9	-57.5	-49.5	0	0	0	114.3
1980	K	34	Very low	32.3	Very low	188.6 Å²	188.6	134 Å²	134	82%	0.82	74%	0.738	S	S	*	*				160.7	138.3	112.7	-125	178.7	179.7	-179.2	0	111.2	I1982	K1980-I1982 HydrophobicContact CD-CD1 4.38Å; K1980-I1982 HydrophobicContact CG-CD1 4.31Å
1981	T	30	Very low	32.5	Very low	115.8 Å²	115.8	132.7 Å²	132.7	71%	0.71	74%	0.74	S	S	*	*			cis	117.2	138.2	27.2	-35.8	0	0	0	0	115
1982	I	33.8	Very low	32.5	Very low	151.4 Å²	151.4	132.3 Å²	132.3	78%	0.776	74%	0.741	S	S	*	*			trans	100.7	132.5	162.4	-63	163.1	0	0	0	113.3	K1980	K1980-I1982 HydrophobicContact CD-CD1 4.38Å; K1980-I1982 HydrophobicContact CG-CD1 4.31Å
1983	S	30.6	Very low	32.5	Very low	93.4 Å²	93.4	134.6 Å²	134.6	65%	0.653	75%	0.748	S	S	*	*			cis	151.9	145.4	-10	-135.4	0	0	0	0	113.6
1984	L	28.7	Very low	32.4	Very low	165.4 Å²	165.4	132.1 Å²	132.1	87%	0.866	75%	0.751	S	S	*	*			trans	66.7	145.7	152.8	-68.4	167	0	0	0	118.5
1985	G	34	Very low	32.3	Very low	68.6 Å²	68.6	132.2 Å²	132.2	71%	0.707	76%	0.759	S	S	*	*			trans	142.5	108.3	160.9	0	0	0	0	0	112.2
1986	N	33.5	Very low	32.2	Very low	144.6 Å²	144.6	135.5 Å²	135.5	77%	0.773	76%	0.763	S	S	*	*			cis	85.8	138.3	45.1	-88.1	6.8	0	0	0	113
1987	M	32.7	Very low	32.1	Very low	151.4 Å²	151.4	135.2 Å²	135.2	75%	0.746	76%	0.763	S	S	*	*			cis	177.3	176.8	12.8	-67	-154.5	85.4	0	0	112.9
1988	K	34.2	Very low	32.1	Very low	168 Å²	168	136.3 Å²	136.3	73%	0.73	77%	0.768	S	S	*	*			cis	-172.4	147.7	12.2	-151.2	169.8	-175.2	-174.2	0	114.1
1989	E	31	Very low	32.3	Very low	163.6 Å²	163.6	135.3 Å²	135.3	76%	0.764	77%	0.769	S	S	*	*			trans	-47	154.2	160.7	-71.6	146.4	154.8	0	0	117.5
1990	G	33	Very low	32.4	Very low	69.8 Å²	69.8	134 Å²	134	72%	0.72	77%	0.771	S	S	*	*			trans	157.5	127.9	162.8	0	0	0	0	0	113.6	Q1623	Q1623-G1990 PolarHBondContact NE2-O 2.99Å
1991	S	33.1	Very low	32.3	Very low	116.2 Å²	116.2	133.8 Å²	133.8	81%	0.813	77%	0.773	S	S	*	*			trans	-123.9	161	171.6	152.4	0	0	0	0	113.8
1992	S	32.9	Very low	32.4	Very low	97.2 Å²	97.2	133.9 Å²	133.9	68%	0.68	78%	0.776	S	S	*	*				-138.6	143.4	124.5	-72.9	0	0	0	0	114.8
1993	Q	31.6	Very low	32.1	Very low	188.4 Å²	188.4	131.5 Å²	131.5	88%	0.88	77%	0.772	S	S	*	*			trans	91	132.2	139.6	-76.8	168.9	46.3	0	0	115.6
1994	A	30.3	Very low	32.2	Very low	89.2 Å²	89.2	133.2 Å²	133.2	74%	0.737	78%	0.779	S	S	*	*			cis	154.9	134.1	33.4	0	0	0	0	0	112.1
1995	L	31.1	Very low	32.3	Very low	169 Å²	169	131.9 Å²	131.9	89%	0.885	77%	0.772	S	S	*	*			trans	-117.4	144.8	160.7	-73	159.3	0	0	0	113.8
1996	Q	29.5	Very low	32.1	Very low	166.4 Å²	166.4	136.4 Å²	136.4	78%	0.778	78%	0.777	S	S	*	*			trans	-150.4	145.4	150.1	-172	82.8	-6	0	0	111.6
1997	L	33	Very low	32.1	Very low	153.2 Å²	153.2	134.5 Å²	134.5	80%	0.802	77%	0.773	S	S	*	*			trans	164.5	154.8	165.4	-75.4	136.5	0	0	0	115.1
1998	P	33.5	Very low	31.9	Very low	112.6 Å²	112.6	135.9 Å²	135.9	73%	0.731	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-102	166.8	-161.3	31.3	-23.3	0	0	0	114.8	S2000	P1998-S2000 PolarHBondContact O-N 3.26Å
1999	P	36.9	Very low	31.8	Very low	124 Å²	124	131.1 Å²	131.1	81%	0.805	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-88	139.4	-177.4	32.7	-29.2	0	0	0	113.4
2000	S	33	Very low	31.8	Very low	116.8 Å²	116.8	131.5 Å²	131.5	82%	0.817	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-94.1	149.8	177.6	51.8	0	0	0	0	113.6	P1998	P1998-S2000 PolarHBondContact O-N 3.26Å
2001	Q	31.1	Very low	32	Very low	184.4 Å²	184.4	137.3 Å²	137.3	86%	0.862	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80.8	150.7	172	-66.1	-179.6	-27.7	0	0	113	S2003	Q2001-S2003 PolarHBondContact O-N 2.74Å
2002	P	32.3	Very low	32.1	Very low	118.8 Å²	118.8	138.1 Å²	138.1	77%	0.771	78%	0.777	S	S	*	*			trans	-95.1	133.7	156.4	34.5	-31.6	0	0	0	112.6	V2004	P2002-V2004 PolarHBondContact O-N 3.49Å; P2002-V2004 VanDerWaalsContact O-N 3.11Å
2003	S	28.2	Very low	32.6	Very low	100.2 Å²	100.2	136.8 Å²	136.8	70%	0.701	76%	0.764	S	S	*	*			trans	-78.7	134.3	173.6	55.1	0	0	0	0	112.5	Q2001 N2005	Q2001-S2003 PolarHBondContact O-N 2.74Å; S2003-N2005 PolarHBondContact O-N 2.82Å; S2003-N2005 VanDerWaalsContact O-N 3.09Å
2004	V	32.1	Very low	33.3	Very low	130 Å²	130	134.2 Å²	134.2	79%	0.788	75%	0.75	S	S	*	*			trans	-113	118.5	160.9	178.3	0	0	0	0	110.2	P2002 M2006	P2002-V2004 PolarHBondContact O-N 3.49Å; P2002-V2004 VanDerWaalsContact O-N 3.11Å; V2004-M2006 PolarHBondContact O-N 2.88Å
2005	N	30.8	Very low	34.7	Very low	136.8 Å²	136.8	135.6 Å²	135.6	73%	0.732	74%	0.744	S	S	*	*			trans	-53.3	125.2	176.7	-78.1	-32.6	0	0	0	114.1	N1647 S2003	N1647-N2005 PolarHBondContact ND2-O 3.13Å; S2003-N2005 PolarHBondContact O-N 2.82Å; S2003-N2005 VanDerWaalsContact O-N 3.09Å
2006	M	30.1	Very low	36.2	Very low	163.6 Å²	163.6	129.8 Å²	129.8	81%	0.806	72%	0.716	S	S	*	*			trans	-85.4	133.7	162.6	-129.6	-179.8	83.8	0	0	109.9	V2004 Q2008	V2004-M2006 PolarHBondContact O-N 2.88Å; M2006-Q2008 VanDerWaalsContact C-N 3.31Å; M2006-Q2008 PolarHBondContact O-N 3.04Å
2007	P	33.1	Very low	37.1	Very low	104.4 Å²	104.4	131.8 Å²	131.8	68%	0.678	72%	0.716	S	S	*	*			trans	-69.4	114.4	175.1	27.5	-33.3	0	0	0	111.2	G2009 P2331	P2007-G2009 PolarHBondContact O-N 3.17Å; P2007-P2331 HydrophobicContact CG-CB 4.28Å; P2007-P2331 HydrophobicContact CG-CG 3.76Å
2008	Q	29.9	Very low	38.3	Very low	180.4 Å²	180.4	126.6 Å²	126.6	84%	0.843	69%	0.689	S	S	*	*			trans	-79.9	112.9	174.3	-64.1	-177.5	4.1	0	0	110.3	M2006	M2006-Q2008 VanDerWaalsContact C-N 3.31Å; M2006-Q2008 PolarHBondContact O-N 3.04Å
2009	G	31.2	Very low	39.2	Very low	68 Å²	68	127.8 Å²	127.8	70%	0.701	70%	0.697	S	S	*	*			trans	178	34	175.2	0	0	0	0	0	116.9	P2007 R2011	P2007-G2009 PolarHBondContact O-N 3.17Å; G2009-R2011 PolarHBondContact O-N 3.17Å; G2009-R2011 VanDerWaalsContact O-N 3.1Å
2010	L	31	Very low	40.6	Very low	172.2 Å²	172.2	127.7 Å²	127.7	90%	0.902	69%	0.689	S	S	*	*			trans	-88.4	94.5	176.4	-63.7	178.6	0	0	0	111.7
2011	R	37.3	Very low	41.4	Very low	191.8 Å²	191.8	125.2 Å²	125.2	72%	0.724	68%	0.682	S	S	*	*			trans	-83.9	132.3	161.7	-80.5	-177.9	169.1	-174.5	-3.2	109.2	G2009 V2013	G2009-R2011 PolarHBondContact O-N 3.17Å; G2009-R2011 VanDerWaalsContact O-N 3.1Å; R2011-V2013 WeakPolarHBondContact O-CG2 3.41Å; R2011-V2013 PolarHBondContact O-N 2.82Å
2012	L	34.7	Very low	42.5	Very low	132.2 Å²	132.2	117.8 Å²	117.8	69%	0.692	66%	0.656	S	S	*	*			trans	-68.6	132.9	168.2	-120.4	73.2	0	0	0	109.3	V2028	L2012-V2028 HydrophobicContact CB-CB 4.13Å; L2012-V2028 HydrophobicContact CB-CG1 4.34Å; L2012-V2028 HydrophobicContact CB-CG2 4.26Å; L2012-V2028 HydrophobicContact CD2-CB 4.43Å; L2012-V2028 WeakPolarHBondContact O-CB 3.37Å; L2012-V2028 PolarHBondContact O-N 3.12Å; L2012-V2028 VanDerWaalsContact O-N 3.08Å
2013	V	43.5	Very low	43.5	Very low	69.4 Å²	69.4	116 Å²	116	42%	0.421	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.9	124.2	179.2	-178.9	0	0	0	0	109	R2011 I2015 I2025 I2026	R2011-V2013 WeakPolarHBondContact O-CG2 3.41Å; R2011-V2013 PolarHBondContact O-N 2.82Å; V2013-I2015 HydrophobicContact CG1-CG1 4.24Å; V2013-I2015 PolarHBondContact O-N 2.83Å; V2013-I2025 HydrophobicContact CG1-CB 4.24Å; V2013-I2025 HydrophobicContact CG1-CG1 4.45Å; V2013-I2025 HydrophobicContact CG1-CG2 3.54Å; V2013-I2025 VanDerWaalsContact CG1-CG2 3.41Å; V2013-I2025 HydrophobicContact CG2-CG2 4.4Å; V2013-I2026 CarbonylContact C-O 3.56Å; V2013-I2026 WeakPolarHBondContact CA-O 3.47Å; V2013-I2026 WeakPolarHBondContact CG1-O 3.44Å
2014	K	47.4	Very low	44.7	Very low	134.8 Å²	134.8	115.2 Å²	115.2	59%	0.586	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87	104.4	171.9	-172.9	177.9	-177.7	177.1	0	108.5	V2016 I2026 V2028	K2014-V2016 HydrophobicContact CD-CG2 4.34Å; K2014-V2016 HydrophobicContact CG-CG2 4.04Å; K2014-V2016 PolarHBondContact O-N 2.98Å; K2014-I2026 HydrophobicContact CB-CB 4.41Å; K2014-I2026 PolarHBondContact N-O 3.31Å; K2014-I2026 PolarHBondContact O-N 3.01Å; K2014-V2028 HydrophobicContact CB-CG2 4.04Å
2015	I	58.3	Low	45.8	Very low	118.4 Å²	118.4	114.8 Å²	114.8	61%	0.607	62%	0.622	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.4	117.1	171.1	-56.1	176.8	0	0	0	107.8	V2013 T2023 N2024	V2013-I2015 HydrophobicContact CG1-CG1 4.24Å; V2013-I2015 PolarHBondContact O-N 2.83Å; I2015-T2023 HydrophobicContact CG2-CG2 4.16Å; I2015-N2024 WeakPolarHBondContact CA-O 3.17Å
2016	V	62.5	Low	47	Very low	46.6 Å²	46.6	112.2 Å²	112.2	28%	0.282	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.9	121.2	176.2	-179.2	0	0	0	0	108.2	K2014 T2023 N2024 I2026	K2014-V2016 HydrophobicContact CD-CG2 4.34Å; K2014-V2016 HydrophobicContact CG-CG2 4.04Å; K2014-V2016 PolarHBondContact O-N 2.98Å; V2016-T2023 CarbonylContact O-C 3.49Å; V2016-T2023 WeakPolarHBondContact O-CA 3.35Å; V2016-N2024 HydrophobicContact CB-CB 4.41Å; V2016-N2024 PolarHBondContact N-O 3.12Å; V2016-N2024 PolarHBondContact O-N 3.12Å; V2016-I2026 HydrophobicContact CG2-CD1 3.92Å; V2016-I2026 HydrophobicContact CG2-CG1 4.44Å
2017	R	50.3	Low	47.6	Very low	210.2 Å²	210.2	108.4 Å²	108.4	79%	0.793	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.1	122.8	164.4	-77.4	-178	179.7	162.6	2	108.7	G2022 T2023	R2017-G2022 WeakPolarHBondContact CA-O 3.41Å; R2017-T2023 HydrophobicContact CG-CG2 3.75Å
2018	N	58.1	Low	48.2	Very low	44 Å²	44	107 Å²	107	24%	0.235	58%	0.584	C	S	.	*			trans	-76	158.9	170.6	-66.1	-1	0	0	0	110.1	D2020 G2021 G2022 N2024	N2018-D2020 VanDerWaalsContact CB-CG 3.44Å; N2018-D2020 WeakPolarHBondContact CB-OD1 3.36Å; N2018-D2020 WeakPolarHBondContact CB-OD2 3.37Å; N2018-D2020 PolarHBondContact ND2-OD1 2.82Å; N2018-D2020 PolarHBondContact ND2-OD2 3.09Å; N2018-D2020 PolarHBondContact O-N 2.89Å; N2018-G2021 PolarHBondContact O-N 3.16Å; N2018-G2021 VanDerWaalsContact O-N 3.14Å; N2018-G2022 WeakPolarHBondContact CB-O 3.18Å; N2018-G2022 PolarHBondContact N-O 3.14Å; N2018-N2024 PolarHBondContact ND2-ND2 3.19Å; N2018-N2024 VanDerWaalsContact ND2-ND2 3.19Å; N2018-N2024 PolarHBondContact OD1-ND2 3.18Å; N2018-N2024 VanDerWaalsContact OD1-ND2 3.07Å
2019	P	52.1	Low	48.6	Very low	137.4 Å²	137.4	102.1 Å²	102.1	89%	0.892	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-17.3	174	29.4	-36.8	0	0	0	113.8	G2021	P2019-G2021 VanDerWaalsContact C-N 3.31Å; P2019-G2021 PolarHBondContact O-N 3.04Å
2020	D	65.8	Low	48.6	Very low	120.4 Å²	120.4	103.7 Å²	103.7	64%	0.644	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-4.1	174	54.5	23	0	0	0	114	N2018 G2022	N2018-D2020 VanDerWaalsContact CB-CG 3.44Å; N2018-D2020 WeakPolarHBondContact CB-OD1 3.36Å; N2018-D2020 WeakPolarHBondContact CB-OD2 3.37Å; N2018-D2020 PolarHBondContact ND2-OD1 2.82Å; N2018-D2020 PolarHBondContact ND2-OD2 3.09Å; N2018-D2020 PolarHBondContact O-N 2.89Å; D2020-G2022 VanDerWaalsContact C-N 3.27Å; D2020-G2022 PolarHBondContact O-N 3.16Å; D2020-G2022 VanDerWaalsContact OD1-CA 3.28Å; D2020-G2022 WeakPolarHBondContact OD1-CA 3.39Å; D2020-G2022 PolarHBondContact OD1-N 3.22Å
2021	G	50.2	Low	48.7	Very low	64.6 Å²	64.6	101 Å²	101	67%	0.666	57%	0.573	S	S	*	*	S	Bend	trans	91	-10.6	-177.4	0	0	0	0	0	114.8	N2018 P2019	N2018-G2021 PolarHBondContact O-N 3.16Å; N2018-G2021 VanDerWaalsContact O-N 3.14Å; P2019-G2021 VanDerWaalsContact C-N 3.31Å; P2019-G2021 PolarHBondContact O-N 3.04Å
2022	G	53	Low	48.5	Very low	29.4 Å²	29.4	98.9 Å²	98.9	30%	0.303	58%	0.576	S	S	.	*			trans	-67	152.7	173.8	0	0	0	0	0	113.2	R2017 N2018 D2020	R2017-G2022 WeakPolarHBondContact CA-O 3.41Å; N2018-G2022 WeakPolarHBondContact CB-O 3.18Å; N2018-G2022 PolarHBondContact N-O 3.14Å; D2020-G2022 VanDerWaalsContact C-N 3.27Å; D2020-G2022 PolarHBondContact O-N 3.16Å; D2020-G2022 VanDerWaalsContact OD1-CA 3.28Å; D2020-G2022 WeakPolarHBondContact OD1-CA 3.39Å; D2020-G2022 PolarHBondContact OD1-N 3.22Å
2023	T	54.8	Low	48.2	Very low	82 Å²	82	98.2 Å²	98.2	50%	0.503	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.7	109.3	175.6	26.3	0	0	0	0	110.8	I2015 V2016 R2017	I2015-T2023 HydrophobicContact CG2-CG2 4.16Å; V2016-T2023 CarbonylContact O-C 3.49Å; V2016-T2023 WeakPolarHBondContact O-CA 3.35Å; R2017-T2023 HydrophobicContact CG-CG2 3.75Å
2024	N	51.6	Low	47.6	Very low	82.8 Å²	82.8	101.4 Å²	101.4	44%	0.443	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.9	135.4	173.2	-85.4	-43.8	0	0	0	110.9	I2015 V2016 N2018	I2015-N2024 WeakPolarHBondContact CA-O 3.17Å; V2016-N2024 HydrophobicContact CB-CB 4.41Å; V2016-N2024 PolarHBondContact N-O 3.12Å; V2016-N2024 PolarHBondContact O-N 3.12Å; N2018-N2024 PolarHBondContact ND2-ND2 3.19Å; N2018-N2024 VanDerWaalsContact ND2-ND2 3.19Å; N2018-N2024 PolarHBondContact OD1-ND2 3.18Å; N2018-N2024 VanDerWaalsContact OD1-ND2 3.07Å
2025	I	56.5	Low	46.9	Very low	120.6 Å²	120.6	101.8 Å²	101.8	62%	0.618	60%	0.598	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.5	101.3	-176.4	-70.2	177.7	0	0	0	107.6	V2013 P2027	V2013-I2025 HydrophobicContact CG1-CB 4.24Å; V2013-I2025 HydrophobicContact CG1-CG1 4.45Å; V2013-I2025 HydrophobicContact CG1-CG2 3.54Å; V2013-I2025 VanDerWaalsContact CG1-CG2 3.41Å; V2013-I2025 HydrophobicContact CG2-CG2 4.4Å; I2025-P2027 WeakPolarHBondContact O-CD 3.33Å
2026	I	55.9	Low	45.5	Very low	83.8 Å²	83.8	101.3 Å²	101.3	43%	0.43	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	115.2	-174.8	-53.3	177.4	0	0	0	109.6	V2013 K2014 V2016 V2028	V2013-I2026 CarbonylContact C-O 3.56Å; V2013-I2026 WeakPolarHBondContact CA-O 3.47Å; V2013-I2026 WeakPolarHBondContact CG1-O 3.44Å; K2014-I2026 HydrophobicContact CB-CB 4.41Å; K2014-I2026 PolarHBondContact N-O 3.31Å; K2014-I2026 PolarHBondContact O-N 3.01Å; V2016-I2026 HydrophobicContact CG2-CD1 3.92Å; V2016-I2026 HydrophobicContact CG2-CG1 4.44Å; I2026-V2028 PolarHBondContact O-N 3.13Å
2027	P	42.7	Very low	44.1	Very low	84 Å²	84	105.4 Å²	105.4	55%	0.545	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.2	132.7	175.1	29	-33.3	0	0	0	110.8	I2025 A2029	I2025-P2027 WeakPolarHBondContact O-CD 3.33Å; P2027-A2029 PolarHBondContact O-N 3.05Å
2028	V	45.1	Very low	43.2	Very low	73 Å²	73	99.6 Å²	99.6	44%	0.442	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.2	119	177.1	-176.4	0	0	0	0	109.2	L2012 K2014 I2026 A2030	L2012-V2028 HydrophobicContact CB-CB 4.13Å; L2012-V2028 HydrophobicContact CB-CG1 4.34Å; L2012-V2028 HydrophobicContact CB-CG2 4.26Å; L2012-V2028 HydrophobicContact CD2-CB 4.43Å; L2012-V2028 WeakPolarHBondContact O-CB 3.37Å; L2012-V2028 PolarHBondContact O-N 3.12Å; L2012-V2028 VanDerWaalsContact O-N 3.08Å; K2014-V2028 HydrophobicContact CB-CG2 4.04Å; I2026-V2028 PolarHBondContact O-N 3.13Å; V2028-A2030 PolarHBondContact O-N 2.95Å
2029	A	38.2	Very low	41.9	Very low	77.6 Å²	77.6	105.7 Å²	105.7	64%	0.641	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-84.3	140.1	172.1	0	0	0	0	0	110.7	P2027 T2031	P2027-A2029 PolarHBondContact O-N 3.05Å; A2029-T2031 VanDerWaalsContact C-N 3.31Å; A2029-T2031 PolarHBondContact O-N 3.08Å; A2029-T2031 VanDerWaalsContact O-N 3.17Å
2030	A	32.1	Very low	41.1	Very low	102.8 Å²	102.8	106.5 Å²	106.5	85%	0.85	65%	0.651	S	S	*	*			trans	-89.8	61	-175	0	0	0	0	0	113	V2028	V2028-A2030 PolarHBondContact O-N 2.95Å
2031	T	33.6	Very low	39.5	Very low	116 Å²	116	106.6 Å²	106.6	71%	0.712	66%	0.658	S	S	*	*			trans	-138.4	83.3	169.9	47	0	0	0	0	110.2	A2029 T2033	A2029-T2031 VanDerWaalsContact C-N 3.31Å; A2029-T2031 PolarHBondContact O-N 3.08Å; A2029-T2031 VanDerWaalsContact O-N 3.17Å; T2031-T2033 PolarHBondContact O-N 3.15Å
2032	D	31.7	Very low	38.7	Very low	147.4 Å²	147.4	111 Å²	111	79%	0.788	67%	0.665	S	S	*	*			trans	-134.8	110.9	160.5	-88.8	-20.1	0	0	0	110.9	I2034	D2032-I2034 HydrophobicContact CB-CD1 4.21Å; D2032-I2034 PolarHBondContact O-N 2.83Å
2033	T	29.8	Very low	37.6	Very low	116.8 Å²	116.8	115.7 Å²	115.7	72%	0.717	68%	0.684	S	S	*	*			trans	-111.5	105.9	174.1	-54.1	0	0	0	0	108.7	T2031 L2035 Q2376	T2031-T2033 PolarHBondContact O-N 3.15Å; T2033-L2035 VanDerWaalsContact C-N 3.31Å; T2033-L2035 HydrophobicContact CG2-CD1 4.46Å; T2033-L2035 WeakPolarHBondContact O-CD1 3.13Å; T2033-L2035 PolarHBondContact O-N 3.28Å; T2033-Q2376 VanDerWaalsContact CG2-OE1 3.3Å; T2033-Q2376 PolarHBondContact O-NE2 2.93Å
2034	I	30.6	Very low	36.6	Very low	137.6 Å²	137.6	117.1 Å²	117.1	71%	0.706	69%	0.692	S	S	*	*			trans	-128.7	130.6	174.1	-44.9	165.9	0	0	0	111.3	D2032 Q2376	D2032-I2034 HydrophobicContact CB-CD1 4.21Å; D2032-I2034 PolarHBondContact O-N 2.83Å; I2034-Q2376 HydrophobicContact CD1-CB 4.03Å; I2034-Q2376 HydrophobicContact CD1-CG 3.53Å; I2034-Q2376 HydrophobicContact CG1-CG 3.96Å
2035	L	32.4	Very low	35.6	Very low	143.2 Å²	143.2	119 Å²	119	75%	0.75	70%	0.702	S	S	*	*				39.7	130.4	128.9	-90.2	89.5	0	0	0	115.2	T2033	T2033-L2035 VanDerWaalsContact C-N 3.31Å; T2033-L2035 HydrophobicContact CG2-CD1 4.46Å; T2033-L2035 WeakPolarHBondContact O-CD1 3.13Å; T2033-L2035 PolarHBondContact O-N 3.28Å
2036	S	29.3	Very low	34.4	Very low	106.4 Å²	106.4	121.6 Å²	121.6	74%	0.744	71%	0.712	S	S	*	*			trans	-66.2	147	164.3	-47.1	0	0	0	0	111.5	A2038	S2036-A2038 VanDerWaalsContact C-N 3.3Å; S2036-A2038 PolarHBondContact O-N 3.2Å
2037	P	31.6	Very low	33.1	Very low	132.8 Å²	132.8	123.2 Å²	123.2	86%	0.862	73%	0.725	S	S	*	*			trans	-76.6	109.1	178.4	31.2	-34.5	0	0	0	111.7	M2039	P2037-M2039 PolarHBondContact O-N 2.97Å
2038	A	31.2	Very low	32.7	Very low	88.6 Å²	88.6	124.9 Å²	124.9	73%	0.732	73%	0.734	S	S	*	*			trans	-116.5	127.9	169.7	0	0	0	0	0	110.7	S2036	S2036-A2038 VanDerWaalsContact C-N 3.3Å; S2036-A2038 PolarHBondContact O-N 3.2Å
2039	M	32.7	Very low	32.1	Very low	172.4 Å²	172.4	127.5 Å²	127.5	85%	0.849	75%	0.746	S	S	*	*			trans	63.6	123.7	166.2	-77.2	-95	41.1	0	0	114.3	P2037 P2041	P2037-M2039 PolarHBondContact O-N 2.97Å; M2039-P2041 WeakPolarHBondContact O-CD 3.42Å
2040	E	33.9	Very low	31.8	Very low	154 Å²	154	130.2 Å²	130.2	72%	0.72	75%	0.749	S	S	*	*			trans	-77.2	147.2	178.3	-66.1	177.2	109	0	0	112.4	L2042	E2040-L2042 VanDerWaalsContact C-N 3.33Å; E2040-L2042 HydrophobicContact CB-CG 4.47Å; E2040-L2042 PolarHBondContact O-N 3.18Å; E2040-L2042 VanDerWaalsContact O-N 3.15Å
2041	P	32.5	Very low	31.8	Very low	122 Å²	122	130.3 Å²	130.3	79%	0.792	74%	0.743	S	S	*	*			trans	-86.5	102.1	168.4	33.9	-31.3	0	0	0	111.1	M2039 N2043	M2039-P2041 WeakPolarHBondContact O-CD 3.42Å; P2041-N2043 PolarHBondContact O-N 2.99Å; P2041-N2043 VanDerWaalsContact O-N 3.16Å
2042	L	32.7	Very low	31.7	Very low	156.8 Å²	156.8	130.7 Å²	130.7	82%	0.821	75%	0.746	S	S	*	*			trans	-90.7	128.3	170	-104.8	168.2	0	0	0	111.1	E2040 V2044	E2040-L2042 VanDerWaalsContact C-N 3.33Å; E2040-L2042 HydrophobicContact CB-CG 4.47Å; E2040-L2042 PolarHBondContact O-N 3.18Å; E2040-L2042 VanDerWaalsContact O-N 3.15Å; L2042-V2044 PolarHBondContact O-N 3.27Å
2043	N	30.8	Very low	31.8	Very low	129 Å²	129	129.5 Å²	129.5	69%	0.69	74%	0.744	S	S	*	*			trans	-115.9	125.9	-178.2	176	24.4	0	0	0	111.7	P2041 N2045 V2379	P2041-N2043 PolarHBondContact O-N 2.99Å; P2041-N2043 VanDerWaalsContact O-N 3.16Å; N2043-N2045 PolarHBondContact OD1-ND2 3.16Å; N2043-V2379 WeakPolarHBondContact O-CG2 3.36Å
2044	V	34.1	Very low	32	Very low	110.8 Å²	110.8	129.9 Å²	129.9	67%	0.672	75%	0.746	S	S	*	*			trans	-158	124.1	152.9	179.1	0	0	0	0	110.1	L2042 V2379 I2381	L2042-V2044 PolarHBondContact O-N 3.27Å; V2044-V2379 HydrophobicContact CG1-CG1 4.22Å; V2044-V2379 HydrophobicContact CG2-CB 4.29Å; V2044-V2379 HydrophobicContact CG2-CG1 4.11Å; V2044-V2379 HydrophobicContact CG2-CG2 4.22Å; V2044-I2381 HydrophobicContact CB-CD1 4.49Å; V2044-I2381 HydrophobicContact CG1-CB 3.88Å; V2044-I2381 HydrophobicContact CG1-CD1 4.18Å; V2044-I2381 HydrophobicContact CG1-CG1 4.01Å
2045	N	29.6	Very low	31.9	Very low	123.2 Å²	123.2	130.1 Å²	130.1	66%	0.659	75%	0.749	S	S	*	*			trans	-76.3	159.7	168.6	-71.2	-56.1	0	0	0	113.1	N2043	N2043-N2045 PolarHBondContact OD1-ND2 3.16Å
2046	Q	30.9	Very low	32	Very low	175.8 Å²	175.8	129.3 Å²	129.3	82%	0.821	75%	0.75	S	S	*	*			trans	75.7	139.7	155.7	-67.1	174.7	-11.7	0	0	117.5
2047	T	28.5	Very low	32.1	Very low	116.2 Å²	116.2	130.9 Å²	130.9	71%	0.713	76%	0.755	S	S	*	*			cis	-167.9	146.9	8.8	11.3	0	0	0	0	112.7
2048	V	35.9	Very low	32.2	Very low	121 Å²	121	127.8 Å²	127.8	73%	0.733	75%	0.747	S	S	*	*			trans	67.7	122	141.5	176.1	0	0	0	0	116.7	N2050	V2048-N2050 WeakPolarHBondContact CG1-ND2 3.4Å
2049	D	32.9	Very low	32.3	Very low	128 Å²	128	132.7 Å²	132.7	68%	0.684	76%	0.755	S	S	*	*				102.2	126.3	122.9	-81.5	-4.2	0	0	0	118.6
2050	N	31.4	Very low	32.3	Very low	133.6 Å²	133.6	129.1 Å²	129.1	71%	0.714	75%	0.747	S	S	*	*				56.5	131.6	122.4	-61.9	-39.3	0	0	0	119.8	V2048	V2048-N2050 WeakPolarHBondContact CG1-ND2 3.4Å
2051	S	31.7	Very low	32.1	Very low	104.2 Å²	104.2	128.4 Å²	128.4	73%	0.729	75%	0.748	S	S	*	*				164.7	150.5	96	45	0	0	0	0	115.6
2052	T	32.4	Very low	32.1	Very low	124.6 Å²	124.6	129.6 Å²	129.6	76%	0.764	75%	0.747	S	S	*	*				60.3	145.3	104.5	14.9	0	0	0	0	117.8
2053	V	31.9	Very low	32.1	Very low	122.6 Å²	122.6	128.1 Å²	128.1	74%	0.743	74%	0.744	S	S	*	*				163.5	143.5	104.9	163.6	0	0	0	0	111.3
2054	T	34.5	Very low	32.4	Very low	125.6 Å²	125.6	127.4 Å²	127.4	77%	0.771	75%	0.746	S	S	*	*				179.9	145.7	111.1	41.6	0	0	0	0	115.5
2055	N	28.9	Very low	32.1	Very low	142 Å²	142	127.1 Å²	127.1	76%	0.759	75%	0.749	S	S	*	*			trans	-65	150	159.1	-65.7	-22.7	0	0	0	115.3
2056	T	34.1	Very low	32.1	Very low	125.6 Å²	125.6	126.8 Å²	126.8	77%	0.771	76%	0.757	S	S	*	*				150.5	137.8	108.8	49.8	0	0	0	0	114
2057	T	31.6	Very low	32.2	Very low	141 Å²	141	123.3 Å²	123.3	87%	0.865	75%	0.752	S	S	*	*				87.4	117.1	104.8	-56	0	0	0	0	115.1
2058	G	33.6	Very low	32.2	Very low	66.6 Å²	66.6	123.7 Å²	123.7	69%	0.687	75%	0.754	S	S	*	*			trans	153.3	142.8	161.1	0	0	0	0	0	113.9
2059	Q	33.1	Very low	32	Very low	190.8 Å²	190.8	124.1 Å²	124.1	89%	0.892	76%	0.757	S	S	*	*			trans	39.6	144.5	137.1	-81.7	169.5	-16.9	0	0	113.2
2060	S	32.5	Very low	31.8	Very low	97.8 Å²	97.8	128.4 Å²	128.4	68%	0.684	76%	0.764	S	S	*	*			cis	146.3	139.8	25.6	54.7	0	0	0	0	110.5
2061	D	30.1	Very low	31.8	Very low	138.6 Å²	138.6	129.5 Å²	129.5	74%	0.741	77%	0.768	S	S	*	*			cis	152.9	160.4	47.5	-123.8	-35.7	0	0	0	114.6
2062	L	32.6	Very low	31.6	Very low	147.8 Å²	147.8	131.2 Å²	131.2	77%	0.774	77%	0.77	S	S	*	*			trans	62.7	118.5	156.2	-59.5	170.4	0	0	0	120.5
2063	V	33	Very low	31.8	Very low	124.8 Å²	124.8	130.9 Å²	130.9	76%	0.756	77%	0.77	S	S	*	*				110.3	138.5	90.2	169.1	0	0	0	0	113.8
2064	P	36.5	Very low	31.9	Very low	114.2 Å²	114.2	130.5 Å²	130.5	74%	0.742	77%	0.767	S	S	*	*			trans	-127.3	166.4	133.9	36.7	-21.8	0	0	0	115.8
2065	S	28.7	Very low	31.7	Very low	104.4 Å²	104.4	131.1 Å²	131.1	73%	0.73	77%	0.766	S	S	*	*			trans	88.9	137.1	142.6	-53.7	0	0	0	0	117
2066	S	29.4	Very low	31.8	Very low	116.8 Å²	116.8	129.6 Å²	129.6	82%	0.817	77%	0.766	S	S	*	*			trans	83.6	152.4	143.5	77.3	0	0	0	0	115.8
2067	S	31.7	Very low	31.8	Very low	103.6 Å²	103.6	130.4 Å²	130.4	72%	0.724	77%	0.766	S	S	*	*			cis	-165.1	147.6	29.5	62.3	0	0	0	0	114.9
2068	V	30.2	Very low	31.7	Very low	125 Å²	125	130.2 Å²	130.2	76%	0.758	76%	0.759	S	S	*	*			trans	27	130.8	131	172.9	0	0	0	0	114.6
2069	T	32	Very low	31.5	Very low	128.8 Å²	128.8	134 Å²	134	79%	0.79	76%	0.763	S	S	*	*			trans	-166.5	164.4	136.1	-31	0	0	0	0	113
2070	R	27.9	Very low	31.3	Very low	218.2 Å²	218.2	132.5 Å²	132.5	82%	0.823	76%	0.755	S	S	*	*			trans	-108.9	163.5	-166.9	-70.3	158.8	179.5	-159.2	-3.8	111.2
2071	L	31.9	Very low	31.1	Very low	156 Å²	156	134.9 Å²	134.9	82%	0.817	76%	0.759	S	S	*	*				-165.6	169.9	93.7	-103.2	175.3	0	0	0	111.4
2072	N	27.6	Very low	30.9	Very low	141.4 Å²	141.4	133.4 Å²	133.4	76%	0.756	76%	0.755	S	S	*	*			trans	-101.8	168.9	179	-73.5	-9.1	0	0	0	110.3	V2074	N2072-V2074 HydrophobicContact CB-CG2 4.12Å
2073	P	35.8	Very low	30.8	Very low	117.8 Å²	117.8	133.3 Å²	133.3	77%	0.765	76%	0.755	S	S	*	*			cis	-128.1	177.2	45.7	39.6	-25.3	0	0	0	114.4
2074	V	33.3	Very low	30.5	Very low	113 Å²	113	134 Å²	134	69%	0.685	75%	0.754	S	S	*	*			trans	96.3	115.6	143.4	179	0	0	0	0	115.3	N2072	N2072-V2074 HydrophobicContact CB-CG2 4.12Å
2075	D	30.9	Very low	30	Very low	139.8 Å²	139.8	133.4 Å²	133.4	75%	0.748	75%	0.753	S	S	*	*				33.1	146.4	94.3	-65.8	-28.9	0	0	0	117.4
2076	S	32.1	Very low	30	Very low	108.8 Å²	108.8	133.3 Å²	133.3	76%	0.761	75%	0.752	S	S	*	*			trans	-162.9	140	150.9	-66.2	0	0	0	0	114.5	D2078	S2076-D2078 PolarHBondContact O-N 3.42Å
2077	N	32.3	Very low	29.9	Very low	142.8 Å²	142.8	134.7 Å²	134.7	76%	0.764	75%	0.75	S	S	*	*			trans	-172.6	141.8	130.3	-96.8	0.9	0	0	0	111.6	I2079	N2077-I2079 PolarHBondContact O-N 3.09Å
2078	D	30	Very low	29.8	Very low	137.6 Å²	137.6	135.6 Å²	135.6	74%	0.736	75%	0.751	S	S	*	*			trans	-72.4	145.9	157	-74.4	-55.4	0	0	0	114.1	S2076 H2080	S2076-D2078 PolarHBondContact O-N 3.42Å; D2078-H2080 PolarHBondContact O-N 2.92Å
2079	I	30.7	Very low	29.9	Very low	147 Å²	147	136.2 Å²	136.2	75%	0.754	76%	0.756	S	S	*	*			trans	-120.9	117.7	141.6	-84.3	168.3	0	0	0	112.1	N2077 L2081	N2077-I2079 PolarHBondContact O-N 3.09Å; I2079-L2081 HydrophobicContact CG2-CD1 4.14Å; I2079-L2081 HydrophobicContact CG2-CG 4.14Å; I2079-L2081 PolarHBondContact O-N 2.98Å
2080	H	27.1	Very low	29.7	Very low	158.2 Å²	158.2	133.3 Å²	133.3	73%	0.732	75%	0.751	S	S	*	*			trans	-42.7	120.9	154.9	-96.9	-97.3	0	0	0	115.2	D2078 V2082	D2078-H2080 PolarHBondContact O-N 2.92Å; H2080-V2082 VanDerWaalsContact C-N 3.27Å; H2080-V2082 HydrophobicContact CB-CG2 4.38Å; H2080-V2082 PolarHBondContact O-N 2.75Å
2081	L	28.7	Very low	29.8	Very low	148.2 Å²	148.2	132.2 Å²	132.2	78%	0.776	75%	0.753	S	S	*	*			trans	-137	125.2	140.2	-79.1	173.6	0	0	0	112.3	I2079	I2079-L2081 HydrophobicContact CG2-CD1 4.14Å; I2079-L2081 HydrophobicContact CG2-CG 4.14Å; I2079-L2081 PolarHBondContact O-N 2.98Å
2082	V	26.6	Very low	29.5	Very low	107 Å²	107	132.1 Å²	132.1	65%	0.648	75%	0.753	S	S	*	*				-161.2	116.3	108.4	164.1	0	0	0	0	113.9	H2080	H2080-V2082 VanDerWaalsContact C-N 3.27Å; H2080-V2082 HydrophobicContact CB-CG2 4.38Å; H2080-V2082 PolarHBondContact O-N 2.75Å
2083	L	29.3	Very low	29.6	Very low	146.6 Å²	146.6	130.9 Å²	130.9	77%	0.768	76%	0.755	S	S	*	*			trans	169.7	133.1	146.1	-68.4	174.4	0	0	0	114.2
2084	N	27.2	Very low	29.2	Very low	138.2 Å²	138.2	131.1 Å²	131.1	74%	0.739	75%	0.754	S	S	*	*				68.4	132.7	75.7	-104.5	3.7	0	0	0	116.5
2085	S	27	Very low	29	Very low	102.6 Å²	102.6	131.7 Å²	131.7	72%	0.717	76%	0.758	S	S	*	*			trans	-146.2	130.1	165.8	-74.1	0	0	0	0	111.8
2086	S	28.7	Very low	28.9	Very low	101.6 Å²	101.6	130.1 Å²	130.1	71%	0.71	76%	0.758	S	S	*	*				89	135.7	128.3	64.6	0	0	0	0	116.6
2087	N	27.6	Very low	28.7	Very low	146.4 Å²	146.4	132.7 Å²	132.7	78%	0.783	76%	0.762	S	S	*	*			trans	71.2	148.5	138.3	-67.9	-13.2	0	0	0	117.1
2088	T	28.8	Very low	28.7	Very low	121.6 Å²	121.6	130.7 Å²	130.7	75%	0.746	76%	0.76	S	S	*	*				153.4	143.5	98.6	35.6	0	0	0	0	113.8
2089	T	31.3	Very low	28.6	Very low	138.8 Å²	138.8	132.7 Å²	132.7	85%	0.852	76%	0.762	S	S	*	*			trans	49.1	129.2	161.8	61	0	0	0	0	117
2090	G	28.8	Very low	28.7	Very low	67 Å²	67	131.6 Å²	131.6	69%	0.691	76%	0.764	S	S	*	*				142.5	127	97.1	0	0	0	0	0	115.9
2091	F	29.5	Very low	28.7	Very low	196 Å²	196	128.9 Å²	128.9	86%	0.86	76%	0.763	S	S	*	*			trans	60.6	117.2	165.3	-67.8	-76.7	0	0	0	118.4
2092	N	26.8	Very low	28.8	Very low	154.2 Å²	154.2	128.3 Å²	128.3	83%	0.825	77%	0.765	S	S	*	*			trans	44.9	119.9	136.8	-61.2	-16.1	0	0	0	117.7
2093	S	29.8	Very low	28.8	Very low	115.4 Å²	115.4	128.6 Å²	128.6	81%	0.807	77%	0.767	S	S	*	*			trans	-160.8	136.2	146.9	-154.5	0	0	0	0	111.5
2094	V	26.6	Very low	28.7	Very low	121.6 Å²	121.6	129.2 Å²	129.2	74%	0.737	77%	0.77	S	S	*	*			trans	-117.3	122	176.8	171.9	0	0	0	0	109.8
2095	V	29.4	Very low	28.7	Very low	127.2 Å²	127.2	128.2 Å²	128.2	77%	0.771	77%	0.769	S	S	*	*			trans	-138.7	113.3	162.4	-175	0	0	0	0	109.2	L2097	V2095-L2097 HydrophobicContact CG1-CD1 4.23Å; V2095-L2097 HydrophobicContact CG1-CG 4.04Å; V2095-L2097 PolarHBondContact O-N 3.46Å
2096	S	27.5	Very low	28.8	Very low	105.2 Å²	105.2	130.1 Å²	130.1	74%	0.736	78%	0.777	S	S	*	*			trans	-104.6	124	173.2	7.3	0	0	0	0	109.6
2097	L	29.7	Very low	28.6	Very low	163.2 Å²	163.2	129.6 Å²	129.6	85%	0.854	78%	0.779	S	S	*	*			trans	-103.9	126.8	153.4	-87	147.7	0	0	0	110.8	V2095	V2095-L2097 HydrophobicContact CG1-CD1 4.23Å; V2095-L2097 HydrophobicContact CG1-CG 4.04Å; V2095-L2097 PolarHBondContact O-N 3.46Å
2098	S	30.6	Very low	28.8	Very low	101.6 Å²	101.6	129.5 Å²	129.5	71%	0.71	78%	0.784	S	S	*	*			trans	-113.7	146.2	-161.7	49.1	0	0	0	0	113.8
2099	K	29	Very low	28.8	Very low	179.8 Å²	179.8	128 Å²	128	78%	0.782	78%	0.783	S	S	*	*			trans	-7.6	145.6	155.1	-58	175	179.6	179.2	0	115.2	D1505 S2101	D1505-K2099 WeakPolarHBondContact OD1-CE 3.43Å; D1505-K2099 IonicContact OD1-NZ 2.65Å; D1505-K2099 PolarHBondContact OD1-NZ 3.21Å; D1505-K2099 IonicContact OD2-NZ 2.78Å; D1505-K2099 PolarHBondContact OD2-NZ 2.83Å; K2099-S2101 PolarHBondContact O-N 3.02Å
2100	P	33.2	Very low	28.7	Very low	122.8 Å²	122.8	126.8 Å²	126.8	80%	0.797	78%	0.781	S	S	*	*			trans	-104.8	130.2	137.6	37.3	-28.5	0	0	0	113.4	V2102	P2100-V2102 PolarHBondContact O-N 2.84Å
2101	S	27	Very low	28.8	Very low	102.2 Å²	102.2	128.5 Å²	128.5	72%	0.715	78%	0.782	S	S	*	*			trans	29.7	113.4	140	-167.9	0	0	0	0	114.7	K2099 V2103	K2099-S2101 PolarHBondContact O-N 3.02Å; S2101-V2103 WeakPolarHBondContact O-CG2 3.44Å
2102	V	30.5	Very low	28.7	Very low	134.4 Å²	134.4	127.4 Å²	127.4	82%	0.815	78%	0.78	S	S	*	*			trans	-141.3	122	157.5	166.8	0	0	0	0	110.4	P2100	P2100-V2102 PolarHBondContact O-N 2.84Å
2103	V	27	Very low	29	Very low	113.2 Å²	113.2	128 Å²	128	69%	0.686	78%	0.782	S	S	*	*			trans	-47.5	129.9	141.5	-178	0	0	0	0	111.8	S2101	S2101-V2103 WeakPolarHBondContact O-CG2 3.44Å
2104	L	26.5	Very low	28.8	Very low	161 Å²	161	131.5 Å²	131.5	84%	0.843	78%	0.782	S	S	*	*			trans	-89.6	139.4	162.5	-111.4	78.5	0	0	0	111.2
2105	T	26.5	Very low	29	Very low	116.2 Å²	116.2	131.3 Å²	131.3	71%	0.713	78%	0.784	S	S	*	*			trans	-151.2	126.1	136.7	10.3	0	0	0	0	112.4
2106	T	29.3	Very low	28.9	Very low	142.8 Å²	142.8	129 Å²	129	88%	0.876	78%	0.778	S	S	*	*			trans	167	142.6	146.1	35.1	0	0	0	0	112.2
2107	A	26	Very low	29	Very low	91.6 Å²	91.6	130.8 Å²	130.8	76%	0.757	78%	0.778	S	S	*	*			trans	-154.7	151.2	142.9	0	0	0	0	0	111.4
2108	T	30.9	Very low	29	Very low	144 Å²	144	128 Å²	128	88%	0.883	77%	0.768	S	S	*	*			trans	-172.4	141.9	160.5	28.2	0	0	0	0	109.4
2109	A	28.6	Very low	28.8	Very low	89.4 Å²	89.4	129.7 Å²	129.7	74%	0.739	77%	0.769	S	S	*	*			cis	152.2	135.7	28.2	0	0	0	0	0	113.6
2110	S	29.8	Very low	28.9	Very low	113.8 Å²	113.8	127.1 Å²	127.1	80%	0.796	77%	0.768	S	S	*	*			trans	142.8	148.1	146.1	-65.4	0	0	0	0	114
2111	S	30.4	Very low	28.8	Very low	103.4 Å²	103.4	126.4 Å²	126.4	72%	0.723	76%	0.764	S	S	*	*				67.8	118.7	115.9	80.5	0	0	0	0	116.2
2112	E	28.4	Very low	28.8	Very low	173.2 Å²	173.2	129.3 Å²	129.3	81%	0.809	77%	0.771	S	S	*	*				-13.4	143.3	113.9	-58.8	179.1	102.1	0	0	116
2113	L	31.8	Very low	28.6	Very low	166.6 Å²	166.6	128.5 Å²	128.5	87%	0.872	77%	0.766	S	S	*	*				-154.5	144.9	119.8	-109	172.6	0	0	0	111.1	P2115	L2113-P2115 WeakPolarHBondContact O-CD 3.43Å
2114	K	26.7	Very low	28.5	Very low	187.6 Å²	187.6	128.1 Å²	128.1	82%	0.816	77%	0.768	S	S	*	*			trans	-108.1	134.7	-177.7	-147.5	-179.2	-175.1	177.3	0	112.4	A2116	K2114-A2116 PolarHBondContact O-N 2.82Å
2115	P	30.5	Very low	28.5	Very low	118.4 Å²	118.4	127.4 Å²	127.4	77%	0.769	76%	0.764	S	S	*	*			trans	-114.4	146	138.7	35.5	-28.3	0	0	0	111.7	L2113 I2117	L2113-P2115 WeakPolarHBondContact O-CD 3.43Å; P2115-I2117 PolarHBondContact O-N 3.43Å; P2115-I2117 VanDerWaalsContact O-N 3.15Å
2116	A	26.8	Very low	28.4	Very low	79 Å²	79	127 Å²	127	65%	0.653	77%	0.765	S	S	*	*			trans	-119.3	147.6	155.5	0	0	0	0	0	111.8	K2114 T2118	K2114-A2116 PolarHBondContact O-N 2.82Å; A2116-T2118 HydrophobicContact CB-CG2 4.39Å; A2116-T2118 PolarHBondContact O-N 2.94Å
2117	I	29.7	Very low	28.3	Very low	143.4 Å²	143.4	125.9 Å²	125.9	74%	0.735	76%	0.758	S	S	*	*			trans	114	110.6	144.3	-59.6	169.1	0	0	0	111.8	P2115	P2115-I2117 PolarHBondContact O-N 3.43Å; P2115-I2117 VanDerWaalsContact O-N 3.15Å
2118	T	28.8	Very low	28.3	Very low	104.2 Å²	104.2	129.9 Å²	129.9	64%	0.639	76%	0.761	S	S	*	*			trans	-137.7	133.8	-177.7	28.4	0	0	0	0	111.9	A2116 T2120	A2116-T2118 HydrophobicContact CB-CG2 4.39Å; A2116-T2118 PolarHBondContact O-N 2.94Å; T2118-T2120 PolarHBondContact O-N 3.17Å
2119	N	27.7	Very low	28.3	Very low	137.2 Å²	137.2	129.7 Å²	129.7	73%	0.734	76%	0.755	S	S	*	*			trans	-117.7	130.3	167	-81.6	-26.7	0	0	0	114.7
2120	T	30	Very low	28.3	Very low	124.2 Å²	124.2	133.5 Å²	133.5	76%	0.762	76%	0.757	S	S	*	*			trans	-175.9	154.5	171.4	50.9	0	0	0	0	113.1	T2118	T2118-T2120 PolarHBondContact O-N 3.17Å
2121	P	32.3	Very low	28.4	Very low	109.4 Å²	109.4	134.2 Å²	134.2	71%	0.71	76%	0.757	S	S	*	*				-114.2	159.4	-106.4	36.2	-25.3	0	0	0	114.1	V2123	P2121-V2123 PolarHBondContact O-N 3.23Å
2122	L	27.1	Very low	28.4	Very low	162.8 Å²	162.8	133.4 Å²	133.4	85%	0.852	76%	0.756	S	S	*	*			trans	-74.2	135.8	163	-78.6	160.2	0	0	0	112.5	S2124	L2122-S2124 PolarHBondContact O-N 3.11Å
2123	V	26.4	Very low	28.4	Very low	117.2 Å²	117.2	133.6 Å²	133.6	71%	0.71	76%	0.757	S	S	*	*			trans	-122.7	109.1	-176.4	167.5	0	0	0	0	109.2	P2121 I2125	P2121-V2123 PolarHBondContact O-N 3.23Å; V2123-I2125 HydrophobicContact CB-CG1 4.48Å; V2123-I2125 HydrophobicContact CG1-CD1 4.44Å; V2123-I2125 HydrophobicContact CG1-CG1 3.98Å; V2123-I2125 PolarHBondContact O-N 2.95Å
2124	S	24.9	Very low	28.3	Very low	104.2 Å²	104.2	134.3 Å²	134.3	73%	0.729	76%	0.756	S	S	*	*			trans	31.9	113	133.4	-45.9	0	0	0	0	113.3	L2122 S2126	L2122-S2124 PolarHBondContact O-N 3.11Å; S2124-S2126 VanDerWaalsContact C-N 3.26Å; S2124-S2126 PolarHBondContact O-N 3.19Å
2125	I	25.4	Very low	28.4	Very low	147.6 Å²	147.6	130.2 Å²	130.2	76%	0.757	75%	0.749	S	S	*	*				-120.8	120.6	114.2	-67.5	175.3	0	0	0	109.4	V2123 V2127	V2123-I2125 HydrophobicContact CB-CG1 4.48Å; V2123-I2125 HydrophobicContact CG1-CD1 4.44Å; V2123-I2125 HydrophobicContact CG1-CG1 3.98Å; V2123-I2125 PolarHBondContact O-N 2.95Å; I2125-V2127 HydrophobicContact CG2-CG2 4Å; I2125-V2127 PolarHBondContact O-N 3.13Å; I2125-V2127 VanDerWaalsContact O-N 3.09Å
2126	S	25.1	Very low	28.3	Very low	106.6 Å²	106.6	131.9 Å²	131.9	75%	0.745	75%	0.749	S	S	*	*			trans	-53.7	127.9	160.4	-63	0	0	0	0	113	S2124 E2128	S2124-S2126 VanDerWaalsContact C-N 3.26Å; S2124-S2126 PolarHBondContact O-N 3.19Å; S2126-E2128 PolarHBondContact O-N 3.11Å
2127	V	27.3	Very low	28.4	Very low	121 Å²	121	133.8 Å²	133.8	73%	0.733	75%	0.753	S	S	*	*			trans	-121.6	116.8	137.1	157.1	0	0	0	0	109.7	I2125 N2129	I2125-V2127 HydrophobicContact CG2-CG2 4Å; I2125-V2127 PolarHBondContact O-N 3.13Å; I2125-V2127 VanDerWaalsContact O-N 3.09Å; V2127-N2129 HydrophobicContact CG1-CB 4.22Å; V2127-N2129 PolarHBondContact O-N 3.2Å
2128	E	26.4	Very low	28.3	Very low	174.2 Å²	174.2	134.1 Å²	134.1	81%	0.814	76%	0.755	S	S	*	*			trans	-65.5	132.5	165.3	-60.1	171.1	160.4	0	0	111.5	S2126	S2126-E2128 PolarHBondContact O-N 3.11Å
2129	N	30	Very low	28.2	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	76%	0.756	S	S	*	*			trans	-155.5	133.5	135.7	-131.9	-1.2	0	0	0	110.5	V2127 T2131	V2127-N2129 HydrophobicContact CG1-CB 4.22Å; V2127-N2129 PolarHBondContact O-N 3.2Å; N2129-T2131 PolarHBondContact O-N 2.85Å
2130	E	28.9	Very low	28.2	Very low	170.2 Å²	170.2	133.1 Å²	133.1	80%	0.795	76%	0.758	S	S	*	*			trans	-54.2	144.6	159.8	-60.6	-164.1	134.7	0	0	112.9
2131	T	31.9	Very low	28.3	Very low	127.2 Å²	127.2	132.8 Å²	132.8	78%	0.78	76%	0.756	S	S	*	*			trans	150.7	150.4	137.7	38.1	0	0	0	0	115.4	N2129	N2129-T2131 PolarHBondContact O-N 2.85Å
2132	A	29.9	Very low	28.1	Very low	86.8 Å²	86.8	134 Å²	134	72%	0.717	76%	0.757	S	S	*	*			trans	62	135.7	157.4	0	0	0	0	0	121.2
2133	Q	29	Very low	28.3	Very low	177.2 Å²	177.2	132.7 Å²	132.7	83%	0.828	75%	0.75	S	S	*	*			trans	-21.7	125.1	150.6	-60.9	127.7	-24.4	0	0	116.5
2134	Q	30	Very low	28.5	Very low	182.4 Å²	182.4	135 Å²	135	85%	0.852	75%	0.753	S	S	*	*				-172.9	160.1	113.4	-96.8	-169.7	41.5	0	0	114
2135	P	28.9	Very low	28.9	Very low	100.8 Å²	100.8	138.2 Å²	138.2	66%	0.655	76%	0.756	S	S	*	*			trans	-102.1	150.6	-164.4	36.7	-31.2	0	0	0	114.6	T2137 N2177	P2135-T2137 PolarHBondContact O-N 3.41Å; P2135-N2177 VanDerWaalsContact CB-OD1 3.3Å; P2135-N2177 WeakPolarHBondContact CB-OD1 3.46Å
2136	I	28.4	Very low	29	Very low	153.6 Å²	153.6	136.9 Å²	136.9	79%	0.788	76%	0.759	S	S	*	*			trans	-98.9	128.1	171.4	-56.4	179.3	0	0	0	111.9	I2138	I2136-I2138 HydrophobicContact CG2-CD1 3.6Å; I2136-I2138 HydrophobicContact CG2-CG1 4.07Å
2137	T	28.1	Very low	29.1	Very low	119.6 Å²	119.6	135.5 Å²	135.5	73%	0.734	76%	0.761	S	S	*	*			trans	-112.1	139.3	158.2	-57.3	0	0	0	0	110.8	P2135	P2135-T2137 PolarHBondContact O-N 3.41Å
2138	I	27	Very low	29.1	Very low	148.8 Å²	148.8	137 Å²	137	76%	0.763	76%	0.764	S	S	*	*			trans	-130.6	133.3	173.1	-68.5	167.9	0	0	0	109.9	I2136 T2140	I2136-I2138 HydrophobicContact CG2-CD1 3.6Å; I2136-I2138 HydrophobicContact CG2-CG1 4.07Å; I2138-T2140 HydrophobicContact CG2-CG2 3.74Å
2139	S	26.9	Very low	29.1	Very low	96.6 Å²	96.6	136.9 Å²	136.9	68%	0.676	76%	0.763	S	S	*	*			trans	-107	155.1	175.3	-63.7	0	0	0	0	111.8	T2141	S2139-T2141 PolarHBondContact O-N 3.08Å; S2139-T2141 VanDerWaalsContact O-N 3.08Å
2140	T	28.6	Very low	29	Very low	125.6 Å²	125.6	137.8 Å²	137.8	77%	0.771	77%	0.767	S	S	*	*			trans	-89.2	103.3	-175.1	52.3	0	0	0	0	115.7	I2138 N2142 L2143	I2138-T2140 HydrophobicContact CG2-CG2 3.74Å; T2140-N2142 PolarHBondContact O-N 2.93Å; T2140-L2143 PolarHBondContact O-N 2.76Å
2141	T	31.2	Very low	29	Very low	116.2 Å²	116.2	134.4 Å²	134.4	71%	0.713	76%	0.758	S	S	*	*			trans	-147.5	100.1	165.8	55.5	0	0	0	0	116.3	S2139 L2143	S2139-T2141 PolarHBondContact O-N 3.08Å; S2139-T2141 VanDerWaalsContact O-N 3.08Å; T2141-L2143 VanDerWaalsContact C-N 3.25Å; T2141-L2143 PolarHBondContact O-N 2.79Å
2142	N	29.5	Very low	28.8	Very low	136.2 Å²	136.2	135 Å²	135	73%	0.728	76%	0.756	S	S	*	*			trans	-149	95.9	174	-88.2	-31.1	0	0	0	115.2	T2140 Q2144	T2140-N2142 PolarHBondContact O-N 2.93Å; N2142-Q2144 PolarHBondContact O-N 3.02Å
2143	L	30.3	Very low	28.7	Very low	134.8 Å²	134.8	137.9 Å²	137.9	71%	0.706	76%	0.759	S	S	*	*			trans	-156.3	83.7	156.3	-88.5	166.2	0	0	0	112.3	T2140 T2141 Q2145	T2140-L2143 PolarHBondContact O-N 2.76Å; T2141-L2143 VanDerWaalsContact C-N 3.25Å; T2141-L2143 PolarHBondContact O-N 2.79Å; L2143-Q2145 VanDerWaalsContact C-N 3.32Å; L2143-Q2145 PolarHBondContact O-N 2.77Å
2144	Q	31.7	Very low	28.8	Very low	166.2 Å²	166.2	136.8 Å²	136.8	78%	0.777	76%	0.757	S	S	*	*			trans	32.4	76.3	150.1	-69.6	-177	-23.6	0	0	116.3	N2142 C2146	N2142-Q2144 PolarHBondContact O-N 3.02Å; Q2144-C2146 VanDerWaalsContact C-N 3.34Å; Q2144-C2146 PolarHBondContact O-N 3.13Å
2145	Q	31.5	Very low	28.8	Very low	170.6 Å²	170.6	134.2 Å²	134.2	80%	0.797	75%	0.754	S	S	*	*			trans	-148.1	122.2	140.4	-112.1	165.3	-21.1	0	0	115.5	L2143	L2143-Q2145 VanDerWaalsContact C-N 3.32Å; L2143-Q2145 PolarHBondContact O-N 2.77Å
2146	C	27.9	Very low	28.9	Very low	120.6 Å²	120.6	135.1 Å²	135.1	82%	0.815	76%	0.76	S	S	*	*			trans	-85.5	114.3	173.8	-59.7	0	0	0	0	113.8	Q2144 I2148	Q2144-C2146 VanDerWaalsContact C-N 3.34Å; Q2144-C2146 PolarHBondContact O-N 3.13Å; C2146-I2148 VanDerWaalsContact C-N 3.3Å; C2146-I2148 PolarHBondContact O-N 3.12Å
2147	G	26.8	Very low	28.9	Very low	76.8 Å²	76.8	132 Å²	132	79%	0.792	76%	0.757	S	S	*	*			trans	165.2	92.8	-174	0	0	0	0	0	114.4
2148	I	28.5	Very low	29.1	Very low	153.4 Å²	153.4	132.6 Å²	132.6	79%	0.787	76%	0.761	S	S	*	*			trans	-124.1	124.8	173.4	-60.1	174	0	0	0	110	C2146	C2146-I2148 VanDerWaalsContact C-N 3.3Å; C2146-I2148 PolarHBondContact O-N 3.12Å
2149	Q	26.9	Very low	29.2	Very low	170.4 Å²	170.4	131.5 Å²	131.5	80%	0.796	76%	0.76	S	S	*	*			trans	-66.6	141.6	164.6	-68.6	-176.2	13.6	0	0	113.3
2150	L	27.1	Very low	29.2	Very low	159.4 Å²	159.4	131.7 Å²	131.7	84%	0.835	76%	0.762	S	S	*	*			trans	-131.1	111.5	152.5	-102	160.1	0	0	0	109.8
2151	T	28.7	Very low	29.2	Very low	99 Å²	99	132.6 Å²	132.6	61%	0.607	76%	0.762	S	S	*	*			trans	-143.2	139.2	171.1	53.9	0	0	0	0	111
2152	D	27.8	Very low	29.1	Very low	139.6 Å²	139.6	133.1 Å²	133.1	75%	0.747	77%	0.765	S	S	*	*				-159.4	138	62.1	-87.1	-42.6	0	0	0	113.5
2153	L	27.7	Very low	29.1	Very low	149 Å²	149	132.6 Å²	132.6	78%	0.78	77%	0.767	S	S	*	*			trans	169.2	146	154.1	-106.7	81.7	0	0	0	113.5
2154	I	31.5	Very low	28.9	Very low	153.4 Å²	153.4	132.3 Å²	132.3	79%	0.787	77%	0.771	S	S	*	*			trans	76.7	112.5	153.7	-54.3	164.7	0	0	0	115.6
2155	T	28.8	Very low	28.8	Very low	127.6 Å²	127.6	129.5 Å²	129.5	78%	0.783	77%	0.769	S	S	*	*			trans	-112.1	160.9	159.4	9.5	0	0	0	0	111.5
2156	P	32.1	Very low	28.7	Very low	119.2 Å²	119.2	128.6 Å²	128.6	77%	0.774	77%	0.769	S	S	*	*			trans	-114.2	163.6	-171	38	-30.3	0	0	0	114.5
2157	A	29.3	Very low	28.9	Very low	88.4 Å²	88.4	128.4 Å²	128.4	73%	0.731	77%	0.766	S	S	*	*			trans	119.2	124.7	149.9	0	0	0	0	0	114.2	V2159	A2157-V2159 PolarHBondContact O-N 3.34Å
2158	T	30.3	Very low	29	Very low	131.8 Å²	131.8	128.6 Å²	128.6	81%	0.809	76%	0.76	S	S	*	*				-151.9	125.5	114.3	-58.2	0	0	0	0	111.4
2159	V	29.2	Very low	29.1	Very low	125.8 Å²	125.8	129 Å²	129	76%	0.762	76%	0.763	S	S	*	*			trans	7.1	113.7	140.6	-167.4	0	0	0	0	112.7	A2157	A2157-V2159 PolarHBondContact O-N 3.34Å
2160	S	28.6	Very low	29.2	Very low	101.2 Å²	101.2	127.4 Å²	127.4	71%	0.708	76%	0.758	S	S	*	*			trans	-136.9	138.8	136	-16.4	0	0	0	0	113.9
2161	N	28.2	Very low	29.4	Very low	145.6 Å²	145.6	126.7 Å²	126.7	78%	0.779	76%	0.755	S	S	*	*			trans	156.1	139.8	145.3	-72.5	-22.2	0	0	0	114.6
2162	T	28.6	Very low	29.3	Very low	126.8 Å²	126.8	130.7 Å²	130.7	78%	0.778	77%	0.767	S	S	*	*				-154	149.6	117.7	-59.2	0	0	0	0	110.2	V2164	T2162-V2164 HydrophobicContact CG2-CG2 4.14Å
2163	T	28.7	Very low	29.4	Very low	125.2 Å²	125.2	130 Å²	130	77%	0.768	77%	0.77	S	S	*	*			trans	-83.1	130.1	174.9	34.4	0	0	0	0	113.4
2164	V	27.9	Very low	29.5	Very low	128.4 Å²	128.4	127.3 Å²	127.3	78%	0.778	77%	0.769	S	S	*	*				-155.4	139.2	117.2	177.6	0	0	0	0	109.4	T2162 I2166	T2162-V2164 HydrophobicContact CG2-CG2 4.14Å; V2164-I2166 HydrophobicContact CG1-CD1 4.04Å; V2164-I2166 HydrophobicContact CG1-CG1 4.33Å
2165	S	29.2	Very low	29.2	Very low	106.8 Å²	106.8	125.8 Å²	125.8	75%	0.747	77%	0.768	S	S	*	*			trans	-134.2	154.1	178.5	-66.5	0	0	0	0	111.9
2166	I	29.2	Very low	29.1	Very low	152.8 Å²	152.8	125.6 Å²	125.6	78%	0.784	77%	0.766	S	S	*	*			trans	-148.6	148.1	163.4	-52.9	168.6	0	0	0	109.8	V2164 A2168	V2164-I2166 HydrophobicContact CG1-CD1 4.04Å; V2164-I2166 HydrophobicContact CG1-CG1 4.33Å; I2166-A2168 HydrophobicContact CG2-CB 4.36Å
2167	P	31.8	Very low	28.8	Very low	115.6 Å²	115.6	126.4 Å²	126.4	75%	0.751	76%	0.764	S	S	*	*				-131.7	172.5	54.1	30	-12	0	0	0	114.2
2168	A	28.3	Very low	28.8	Very low	80.2 Å²	80.2	129.2 Å²	129.2	66%	0.663	76%	0.764	S	S	*	*				91.7	106.4	105.8	0	0	0	0	0	115.9	I2166	I2166-A2168 HydrophobicContact CG2-CB 4.36Å
2169	L	30.7	Very low	28.7	Very low	162.6 Å²	162.6	127.2 Å²	127.2	85%	0.851	76%	0.762	S	S	*	*				-166.2	133.1	91	-106.9	114.7	0	0	0	110.1
2170	I	30.4	Very low	28.8	Very low	137.4 Å²	137.4	127.5 Å²	127.5	71%	0.705	76%	0.764	S	S	*	*				105.3	119.7	84.2	-67.8	173.3	0	0	0	110.6
2171	N	29.5	Very low	28.8	Very low	143.4 Å²	143.4	129.5 Å²	129.5	77%	0.767	77%	0.771	S	S	*	*			trans	83.2	112.2	148.3	-72.3	-12.2	0	0	0	118.1
2172	Q	28.1	Very low	29	Very low	184.6 Å²	184.6	126 Å²	126	86%	0.863	77%	0.771	S	S	*	*			trans	-155.8	140.9	135.5	-80.6	-165.1	18.5	0	0	112.5	A2174	Q2172-A2174 PolarHBondContact O-N 3.07Å
2173	P	30.2	Very low	29	Very low	125.2 Å²	125.2	129.8 Å²	129.8	81%	0.813	78%	0.776	S	S	*	*			trans	-91	118.6	-179.6	34.7	-32.3	0	0	0	112.2	T2175	P2173-T2175 PolarHBondContact O-N 3.23Å
2174	A	27.9	Very low	29.2	Very low	92 Å²	92	131.8 Å²	131.8	76%	0.76	78%	0.781	S	S	*	*			trans	-98.4	123.6	172.5	0	0	0	0	0	111.7	Q2172 V2176	Q2172-A2174 PolarHBondContact O-N 3.07Å; A2174-V2176 PolarHBondContact O-N 3.17Å
2175	T	26.5	Very low	29.3	Very low	122 Å²	122	134.9 Å²	134.9	75%	0.748	78%	0.784	S	S	*	*			trans	-74.7	136.4	170.4	39.9	0	0	0	0	111.2	P2173	P2173-T2175 PolarHBondContact O-N 3.23Å
2176	V	26.4	Very low	29.4	Very low	123.4 Å²	123.4	135.4 Å²	135.4	75%	0.748	79%	0.785	S	S	*	*			trans	-125.9	114.9	160.9	174	0	0	0	0	110	A2174 I2178	A2174-V2176 PolarHBondContact O-N 3.17Å; V2176-I2178 HydrophobicContact CG1-CD1 4.01Å; V2176-I2178 HydrophobicContact CG1-CG1 3.87Å; V2176-I2178 PolarHBondContact O-N 2.99Å
2177	N	26.7	Very low	29.6	Very low	135.8 Å²	135.8	133.8 Å²	133.8	73%	0.726	78%	0.784	S	S	*	*			trans	-81.2	129.7	173.1	-70.4	-35.4	0	0	0	110.7	P2135 A2179	P2135-N2177 VanDerWaalsContact CB-OD1 3.3Å; P2135-N2177 WeakPolarHBondContact CB-OD1 3.46Å; N2177-A2179 VanDerWaalsContact C-N 3.31Å; N2177-A2179 PolarHBondContact O-N 3.38Å
2178	I	28.9	Very low	29.7	Very low	145.8 Å²	145.8	133.6 Å²	133.6	75%	0.748	79%	0.786	S	S	*	*			trans	-123.6	110.5	160.5	-64.8	173.5	0	0	0	109.3	V2176 T2180	V2176-I2178 HydrophobicContact CG1-CD1 4.01Å; V2176-I2178 HydrophobicContact CG1-CG1 3.87Å; V2176-I2178 PolarHBondContact O-N 2.99Å; I2178-T2180 HydrophobicContact CG2-CG2 3.87Å; I2178-T2180 PolarHBondContact O-N 3.27Å; I2178-T2180 VanDerWaalsContact O-N 3.1Å
2179	A	27.1	Very low	29.8	Very low	91 Å²	91	134 Å²	134	75%	0.752	79%	0.789	S	S	*	*			trans	-101.2	121	162.7	0	0	0	0	0	112.3	N2177 V2181	N2177-A2179 VanDerWaalsContact C-N 3.31Å; N2177-A2179 PolarHBondContact O-N 3.38Å; A2179-V2181 PolarHBondContact O-N 3.35Å
2180	T	31.8	Very low	29.7	Very low	132.2 Å²	132.2	134.1 Å²	134.1	81%	0.811	79%	0.79	S	S	*	*			trans	-118.6	127.6	176.6	31.6	0	0	0	0	111.3	I2178	I2178-T2180 HydrophobicContact CG2-CG2 3.87Å; I2178-T2180 PolarHBondContact O-N 3.27Å; I2178-T2180 VanDerWaalsContact O-N 3.1Å
2181	V	29.3	Very low	29.7	Very low	141.8 Å²	141.8	132.8 Å²	132.8	86%	0.859	79%	0.794	S	S	*	*			trans	-117.4	115.2	169.9	179.8	0	0	0	0	111.6	A2179	A2179-V2181 PolarHBondContact O-N 3.35Å
2182	G	32.1	Very low	29.6	Very low	74 Å²	74	131.5 Å²	131.5	76%	0.763	79%	0.79	S	S	*	*			trans	166.2	121.2	171.5	0	0	0	0	0	112.7	L2184	G2182-L2184 PolarHBondContact O-N 3.13Å
2183	K	29.1	Very low	29.5	Very low	205.8 Å²	205.8	132.4 Å²	132.4	90%	0.895	79%	0.786	S	S	*	*			trans	-86.1	122.2	-177.7	-63.6	177.3	-179	176.1	0	111.4
2184	L	31.3	Very low	29.4	Very low	167.6 Å²	167.6	134.6 Å²	134.6	88%	0.877	78%	0.783	S	S	*	*			trans	-137.7	139.6	155.1	-81.3	174.6	0	0	0	112	G2182	G2182-L2184 PolarHBondContact O-N 3.13Å
2185	K	31.2	Very low	29.3	Very low	193.6 Å²	193.6	137.4 Å²	137.4	84%	0.842	78%	0.784	S	S	*	*			trans	-84.2	127.8	-177.7	-171.8	177.9	-179.2	-179.2	0	113	P2187	K2185-P2187 VanDerWaalsContact O-CD 3.31Å; K2185-P2187 WeakPolarHBondContact O-CD 3.48Å
2186	P	31.7	Very low	29.4	Very low	116.4 Å²	116.4	138.2 Å²	138.2	76%	0.756	78%	0.782	S	S	*	*			trans	-83.1	143	-177	32.3	-35	0	0	0	113.4
2187	P	32.8	Very low	29.4	Very low	118.6 Å²	118.6	135.7 Å²	135.7	77%	0.77	77%	0.774	S	S	*	*			trans	-88.5	152.6	165.2	33.9	-30.9	0	0	0	112.3	K2185 A2189	K2185-P2187 VanDerWaalsContact O-CD 3.31Å; K2185-P2187 WeakPolarHBondContact O-CD 3.48Å; P2187-A2189 PolarHBondContact O-N 3.22Å
2188	S	32.8	Very low	29.6	Very low	112.4 Å²	112.4	134.9 Å²	134.9	79%	0.786	78%	0.776	S	S	*	*			trans	-68.3	133.6	-178.3	56.3	0	0	0	0	116.7
2189	A	30.2	Very low	29.6	Very low	87.6 Å²	87.6	133.8 Å²	133.8	72%	0.724	78%	0.777	S	S	*	*			trans	36.8	107.6	151.7	0	0	0	0	0	118.8	P2187 S2191	P2187-A2189 PolarHBondContact O-N 3.22Å; A2189-S2191 PolarHBondContact O-N 3.1Å
2190	N	30	Very low	29.8	Very low	165.4 Å²	165.4	135.8 Å²	135.8	88%	0.884	78%	0.78	S	S	*	*			trans	-139.4	131.7	143.6	-95.6	-36.5	0	0	0	110	V2192	N2190-V2192 PolarHBondContact O-N 2.94Å
2191	S	29	Very low	29.7	Very low	110.8 Å²	110.8	134.4 Å²	134.4	78%	0.775	77%	0.774	S	S	*	*			trans	-95.9	125.9	-178.6	-172.4	0	0	0	0	111.8	A2189 R2193	A2189-S2191 PolarHBondContact O-N 3.1Å; S2191-R2193 PolarHBondContact O-N 3.32Å; S2191-R2193 VanDerWaalsContact O-N 3.12Å
2192	V	27.8	Very low	29.7	Very low	115.4 Å²	115.4	133.4 Å²	133.4	70%	0.699	77%	0.77	S	S	*	*			trans	-89.2	120.2	173.1	178.7	0	0	0	0	109.3	N2190 F2194	N2190-V2192 PolarHBondContact O-N 2.94Å; V2192-F2194 HydrophobicContact CB-CE2 4.48Å; V2192-F2194 HydrophobicContact CG1-CD2 4.2Å; V2192-F2194 HydrophobicContact CG1-CE1 4.34Å; V2192-F2194 HydrophobicContact CG1-CE2 4.11Å; V2192-F2194 HydrophobicContact CG1-CZ 4.28Å; V2192-F2194 WeakPolarHBondContact O-CD2 3.33Å; V2192-F2194 PolarHBondContact O-N 3.03Å
2193	R	26.3	Very low	29.7	Very low	202.6 Å²	202.6	136.2 Å²	136.2	77%	0.765	77%	0.772	S	S	*	*			trans	-87.7	125.2	172	-94.2	-174.7	-176.6	-111.4	3.6	110.9	V1734 D1735 S2191 I2195	V1734-R2193 PolarHBondContact O-NH2 3.25Å; D1735-R2193 VanDerWaalsContact CG-CZ 3.43Å; D1735-R2193 WeakPolarHBondContact OD1-CG 3.47Å; D1735-R2193 IonicContact OD1-CZ 3.71Å; D1735-R2193 IonicContact OD1-NE 2.64Å; D1735-R2193 PolarHBondContact OD1-NE 3.06Å; D1735-R2193 IonicContact OD1-NH1 2.61Å; D1735-R2193 PolarHBondContact OD1-NH1 3.04Å; D1735-R2193 IonicContact OD1-NH2 3.78Å; D1735-R2193 PolarHBondContact OD1-NH2 2.93Å; D1735-R2193 IonicContact OD2-CZ 2.62Å; D1735-R2193 IonicContact OD2-NE 3.23Å; D1735-R2193 PolarHBondContact OD2-NE 3.41Å; D1735-R2193 IonicContact OD2-NH2 2.8Å; S2191-R2193 PolarHBondContact O-N 3.32Å; S2191-R2193 VanDerWaalsContact O-N 3.12Å; R2193-I2195 HydrophobicContact CB-CG1 4.37Å
2194	F	27.4	Very low	29.8	Very low	172.8 Å²	172.8	132.5 Å²	132.5	76%	0.758	77%	0.767	S	S	*	*			trans	-82.3	139	160.7	-65.2	-87	0	0	0	109.5	V2192 I2251	V2192-F2194 HydrophobicContact CB-CE2 4.48Å; V2192-F2194 HydrophobicContact CG1-CD2 4.2Å; V2192-F2194 HydrophobicContact CG1-CE1 4.34Å; V2192-F2194 HydrophobicContact CG1-CE2 4.11Å; V2192-F2194 HydrophobicContact CG1-CZ 4.28Å; V2192-F2194 WeakPolarHBondContact O-CD2 3.33Å; V2192-F2194 PolarHBondContact O-N 3.03Å; F2194-I2251 HydrophobicContact CZ-CD1 4.5Å
2195	I	26.7	Very low	29.7	Very low	151.4 Å²	151.4	130.5 Å²	130.5	78%	0.776	76%	0.763	S	S	*	*			trans	-115	116.7	170.6	-60.3	174.4	0	0	0	106.8	R2193	R2193-I2195 HydrophobicContact CB-CG1 4.37Å
2196	I	28.9	Very low	29.9	Very low	136.8 Å²	136.8	127.5 Å²	127.5	70%	0.702	76%	0.76	S	S	*	*			trans	-106.4	116.8	166.8	-57.4	163.2	0	0	0	106.8	N2547	I2196-N2547 HydrophobicContact CB-CB 4.04Å; I2196-N2547 HydrophobicContact CG2-CB 3.69Å
2197	A	26.6	Very low	30	Very low	71.2 Å²	71.2	126.5 Å²	126.5	59%	0.588	76%	0.756	S	S	*	*			trans	-99.6	126.2	174.5	0	0	0	0	0	109.2	T2199	A2197-T2199 PolarHBondContact O-N 3.22Å; A2197-T2199 VanDerWaalsContact O-N 3.08Å; A2197-T2199 PolarHBondContact O-OG1 3.43Å
2198	P	30.3	Very low	30	Very low	119.2 Å²	119.2	128 Å²	128	77%	0.774	76%	0.758	S	S	*	*			trans	-72.3	109	175.4	28.8	-32.5	0	0	0	109.9	V2200	P2198-V2200 PolarHBondContact O-N 3.1Å; P2198-V2200 VanDerWaalsContact O-N 3.15Å
2199	T	29.5	Very low	30.2	Very low	122.6 Å²	122.6	127.7 Å²	127.7	75%	0.752	76%	0.756	S	S	*	*			trans	-83.8	110.7	175.2	-54.9	0	0	0	0	109.5	A2197 C2201	A2197-T2199 PolarHBondContact O-N 3.22Å; A2197-T2199 VanDerWaalsContact O-N 3.08Å; A2197-T2199 PolarHBondContact O-OG1 3.43Å; T2199-C2201 PolarHBondContact O-N 3.45Å
2200	V	31.3	Very low	30.3	Very low	134.6 Å²	134.6	129.3 Å²	129.3	82%	0.816	76%	0.762	S	S	*	*			trans	-102.4	107.9	172	-175.8	0	0	0	0	108.7	P2198 P2202	P2198-V2200 PolarHBondContact O-N 3.1Å; P2198-V2200 VanDerWaalsContact O-N 3.15Å; V2200-P2202 WeakPolarHBondContact O-CD 3.24Å
2201	C	30.1	Very low	30.5	Very low	101.2 Å²	101.2	125.2 Å²	125.2	68%	0.684	76%	0.758	S	S	*	*			trans	-95.1	138.9	169.1	-71.8	0	0	0	0	110.1	T2199 T2203	T2199-C2201 PolarHBondContact O-N 3.45Å; C2201-T2203 PolarHBondContact O-N 2.91Å
2202	P	29.2	Very low	30.5	Very low	122 Å²	122	125.4 Å²	125.4	79%	0.792	76%	0.76	S	S	*	*			trans	-76.8	148	177	32.8	-34.9	0	0	0	111.5	V2200	V2200-P2202 WeakPolarHBondContact O-CD 3.24Å
2203	T	31.8	Very low	30.9	Very low	131.4 Å²	131.4	127.4 Å²	127.4	81%	0.806	77%	0.765	S	S	*	*			trans	-128.7	140.4	157.6	41.5	0	0	0	0	112.3	C2201 T2205	C2201-T2203 PolarHBondContact O-N 2.91Å; T2203-T2205 PolarHBondContact O-N 3.39Å
2204	T	30.9	Very low	31.1	Very low	128.8 Å²	128.8	124.9 Å²	124.9	79%	0.79	77%	0.767	S	S	*	*			trans	-101.3	120.2	165.4	43.4	0	0	0	0	112.6
2205	T	30.3	Very low	31.6	Very low	126.4 Å²	126.4	122.2 Å²	122.2	78%	0.775	77%	0.766	S	S	*	*			trans	176.2	128.1	133.9	49.7	0	0	0	0	115.1	T2203	T2203-T2205 PolarHBondContact O-N 3.39Å
2206	T	33.5	Very low	32	Very low	129 Å²	129	120.7 Å²	120.7	79%	0.791	77%	0.766	S	S	*	*			trans	-161.6	140.4	139.2	36.1	0	0	0	0	114.2
2207	S	34.6	Very low	32	Very low	95.4 Å²	95.4	119.3 Å²	119.3	67%	0.667	77%	0.769	S	S	*	*			trans	43	126.9	140.4	65.3	0	0	0	0	118.5
2208	D	33.2	Very low	32.2	Very low	151 Å²	151	124.7 Å²	124.7	81%	0.807	78%	0.782	S	S	*	*				151.6	160.4	72.6	-83.1	-39.2	0	0	0	115.9
2209	S	36.2	Very low	32	Very low	105.8 Å²	105.8	124.3 Å²	124.3	74%	0.74	78%	0.778	S	S	*	*			trans	109.1	112.3	143.1	56.7	0	0	0	0	117.6
2210	S	32.9	Very low	32.1	Very low	121.8 Å²	121.8	123.7 Å²	123.7	85%	0.852	78%	0.776	S	S	*	*			trans	18.4	126.5	140.6	59.9	0	0	0	0	121
2211	G	33.4	Very low	31.8	Very low	79 Å²	79	123.1 Å²	123.1	81%	0.814	77%	0.772	S	S	*	*			trans	175.9	109.5	161.9	0	0	0	0	0	113
2212	S	30.2	Very low	31.7	Very low	114.6 Å²	114.6	125 Å²	125	80%	0.801	78%	0.775	S	S	*	*			trans	-84.5	136.7	166.1	171.4	0	0	0	0	112.5
2213	I	35.9	Very low	31.7	Very low	157.8 Å²	157.8	124.3 Å²	124.3	81%	0.809	77%	0.768	S	S	*	*			trans	-172.5	135	136.6	-76.6	160	0	0	0	110.7
2214	N	31.4	Very low	31.4	Very low	150 Å²	150	124.9 Å²	124.9	80%	0.802	77%	0.765	S	S	*	*			trans	-66.8	148.6	169.7	-62.7	-52.3	0	0	0	113.4
2215	P	37.9	Very low	31.3	Very low	115.4 Å²	115.4	124.8 Å²	124.8	75%	0.749	76%	0.764	S	S	*	*				-131.5	-165	114.9	39.8	-24.8	0	0	0	113.7
2216	P	34	Very low	31.1	Very low	119.8 Å²	119.8	128.1 Å²	128.1	78%	0.778	77%	0.767	S	S	*	*				-117.1	173	-127.1	37.7	-24.3	0	0	0	113.4
2217	S	28.6	Very low	30.9	Very low	108 Å²	108	126.4 Å²	126.4	76%	0.755	77%	0.767	S	S	*	*			trans	-91.7	140.3	-179.5	57.1	0	0	0	0	114.7
2218	Q	31.7	Very low	30.6	Very low	185.2 Å²	185.2	127.2 Å²	127.2	87%	0.865	77%	0.772	S	S	*	*			trans	-126.8	138.6	162.1	-76.3	-174.2	5.9	0	0	111.4	R2351	Q2218-R2351 VanDerWaalsContact C-NH2 3.34Å; Q2218-R2351 PolarHBondContact O-NH1 3.44Å; Q2218-R2351 PolarHBondContact O-NH2 3.36Å
2219	T	26.5	Very low	30.4	Very low	110.8 Å²	110.8	127.4 Å²	127.4	68%	0.68	77%	0.773	S	S	*	*			trans	-93.9	137.5	-177.2	40.1	0	0	0	0	112.7	T2221	T2219-T2221 PolarHBondContact O-N 3.36Å
2220	P	30.2	Very low	30.2	Very low	110 Å²	110	131 Å²	131	71%	0.714	78%	0.778	S	S	*	*			trans	-79.9	131.2	178.4	32.1	-34.5	0	0	0	112.1	R2351 S2352	P2220-R2351 HydrophobicContact CB-CB 4.34Å; P2220-R2351 HydrophobicContact CB-CG 4.01Å; P2220-R2351 HydrophobicContact CG-CB 4.48Å; P2220-R2351 HydrophobicContact CG-CG 3.93Å; P2220-S2352 WeakPolarHBondContact CG-OG 3.45Å
2221	T	26.2	Very low	30.1	Very low	121.2 Å²	121.2	129.8 Å²	129.8	74%	0.744	77%	0.769	S	S	*	*			trans	-101.3	134.2	173.7	-60.4	0	0	0	0	110.5	T2219 T2223	T2219-T2221 PolarHBondContact O-N 3.36Å; T2221-T2223 PolarHBondContact O-N 3.1Å
2222	I	28	Very low	30	Very low	142.4 Å²	142.4	133 Å²	133	73%	0.73	77%	0.768	S	S	*	*			trans	-112.4	120.4	177.6	-69.3	-176	0	0	0	109.7	S2352 A2354	I2222-S2352 VanDerWaalsContact CG1-C 3.44Å; I2222-S2352 WeakPolarHBondContact CG1-O 3.46Å; I2222-A2354 HydrophobicContact CB-CB 3.92Å; I2222-A2354 HydrophobicContact CD1-CB 4.09Å; I2222-A2354 HydrophobicContact CG1-CB 3.88Å; I2222-A2354 HydrophobicContact CG2-CB 3.67Å
2223	T	27.8	Very low	30.2	Very low	106.8 Å²	106.8	134 Å²	134	66%	0.655	77%	0.769	S	S	*	*			trans	-113.1	126.8	178.2	-49	0	0	0	0	110.8	T2221 V2225 A2354	T2221-T2223 PolarHBondContact O-N 3.1Å; T2223-V2225 HydrophobicContact CG2-CG2 4.14Å; T2223-V2225 PolarHBondContact O-N 2.83Å; T2223-V2225 VanDerWaalsContact O-N 3.12Å; T2223-A2354 VanDerWaalsContact CA-CB 3.46Å
2224	I	26.3	Very low	29.9	Very low	143 Å²	143	131.1 Å²	131.1	73%	0.733	76%	0.763	S	S	*	*			trans	-96.8	120.7	172.6	-62.1	178.8	0	0	0	108.8	K2226 I2353 A2354 K2355	I2224-K2226 PolarHBondContact O-N 3.34Å; I2224-I2353 HydrophobicContact CD1-CG2 3.92Å; I2224-I2353 HydrophobicContact CG1-CG2 3.61Å; I2224-A2354 HydrophobicContact CB-CB 4.45Å; I2224-A2354 WeakPolarHBondContact CB-O 3.3Å; I2224-A2354 VanDerWaalsContact CD1-O 3.24Å; I2224-A2354 WeakPolarHBondContact CD1-O 3.39Å; I2224-A2354 HydrophobicContact CG1-CB 4.04Å; I2224-A2354 WeakPolarHBondContact CG1-O 3.27Å; I2224-K2355 HydrophobicContact CB-CB 4.29Å; I2224-K2355 WeakPolarHBondContact O-CD 3.25Å
2225	V	28.4	Very low	30.1	Very low	127.6 Å²	127.6	129.1 Å²	129.1	77%	0.773	76%	0.76	S	S	*	*			trans	-110.4	132.3	168.3	-178.1	0	0	0	0	109	T2223 A2227	T2223-V2225 HydrophobicContact CG2-CG2 4.14Å; T2223-V2225 PolarHBondContact O-N 2.83Å; T2223-V2225 VanDerWaalsContact O-N 3.12Å; V2225-A2227 PolarHBondContact O-N 2.91Å
2226	K	25.7	Very low	29.8	Very low	195 Å²	195	130.7 Å²	130.7	85%	0.848	76%	0.763	S	S	*	*			trans	-106.4	120.8	179	-178.7	175.8	-179.7	177.5	0	109.4	I2224 S2228	I2224-K2226 PolarHBondContact O-N 3.34Å; K2226-S2228 PolarHBondContact O-N 2.66Å
2227	A	29.1	Very low	29.8	Very low	94.6 Å²	94.6	130 Å²	130	78%	0.782	76%	0.761	S	S	*	*			trans	-116.3	149.7	167.3	0	0	0	0	0	111.7	V2225	V2225-A2227 PolarHBondContact O-N 2.91Å
2228	S	29.8	Very low	29.9	Very low	110.8 Å²	110.8	132 Å²	132	78%	0.775	76%	0.763	S	S	*	*			trans	-109.3	146.3	-178.2	59.7	0	0	0	0	114.4	K2226 Q2230	K2226-S2228 PolarHBondContact O-N 2.66Å; S2228-Q2230 PolarHBondContact O-N 2.95Å
2229	N	28.5	Very low	29.9	Very low	156.6 Å²	156.6	128.8 Å²	128.8	84%	0.837	76%	0.756	S	S	*	*			trans	-76.2	140.4	174.6	-53.6	-23.4	0	0	0	111.5
2230	Q	31.9	Very low	30.1	Very low	181.4 Å²	181.4	130.6 Å²	130.6	85%	0.848	76%	0.76	S	S	*	*			trans	-154.4	149.3	145	-109.6	170.6	21.9	0	0	112.4	S2228	S2228-Q2230 PolarHBondContact O-N 2.95Å
2231	S	31.6	Very low	30.1	Very low	94.8 Å²	94.8	131.2 Å²	131.2	66%	0.663	76%	0.762	S	S	*	*			trans	14	128	164.6	54.9	0	0	0	0	118.2	V2233	S2231-V2233 PolarHBondContact O-N 2.98Å
2232	D	30	Very low	30.2	Very low	146.4 Å²	146.4	130 Å²	130	78%	0.783	76%	0.759	S	S	*	*				150.9	165	98.9	-79	-43.6	0	0	0	114.7
2233	V	34	Very low	30.2	Very low	137.4 Å²	137.4	131.5 Å²	131.5	83%	0.833	76%	0.764	S	S	*	*			trans	92.1	112.8	162.3	-167.4	0	0	0	0	116.2	S2231	S2231-V2233 PolarHBondContact O-N 2.98Å
2234	S	31.2	Very low	30.3	Very low	96.4 Å²	96.4	130.2 Å²	130.2	67%	0.674	77%	0.765	S	S	*	*			trans	-54.8	157.1	162.6	100.1	0	0	0	0	116.4
2235	S	34.5	Very low	30.5	Very low	107 Å²	107	129.6 Å²	129.6	75%	0.748	77%	0.768	S	S	*	*				-168.1	139.6	100.8	-59.8	0	0	0	0	113.7
2236	D	32.4	Very low	30.5	Very low	149.6 Å²	149.6	128.4 Å²	128.4	80%	0.8	77%	0.766	S	S	*	*			trans	-28.4	133.6	164.1	-61	-57.5	0	0	0	117.2
2237	S	32.4	Very low	30.7	Very low	105 Å²	105	123.8 Å²	123.8	73%	0.734	76%	0.758	S	S	*	*				179	132.3	123.1	52.3	0	0	0	0	113.9
2238	N	32.2	Very low	30.8	Very low	150.6 Å²	150.6	128.6 Å²	128.6	81%	0.805	76%	0.761	S	S	*	*			trans	6.1	124.7	156.7	-70.3	-41.7	0	0	0	116.4
2239	T	31.2	Very low	30.9	Very low	117.4 Å²	117.4	129.1 Å²	129.1	72%	0.72	76%	0.76	S	S	*	*				-171	139.7	123.2	-58.5	0	0	0	0	111.9
2240	I	30.4	Very low	31.1	Very low	149 Å²	149	127.3 Å²	127.3	76%	0.764	76%	0.757	S	S	*	*			trans	58.9	123.9	149	-61.9	169.4	0	0	0	115.2
2241	T	30	Very low	31.1	Very low	122.8 Å²	122.8	125.8 Å²	125.8	75%	0.753	75%	0.753	S	S	*	*				148.5	138.5	78.6	-71.9	0	0	0	0	111.4
2242	S	28.6	Very low	31.3	Very low	95.8 Å²	95.8	127.9 Å²	127.9	67%	0.67	76%	0.756	S	S	*	*				-177.4	153.7	121.9	57.7	0	0	0	0	113
2243	M	29.1	Very low	31.4	Very low	172.6 Å²	172.6	126.4 Å²	126.4	85%	0.85	75%	0.754	S	S	*	*			trans	98	147.4	131.6	-83.1	174.9	118.2	0	0	114.8
2244	A	29.4	Very low	31.3	Very low	81.2 Å²	81.2	131.1 Å²	131.1	67%	0.671	76%	0.757	S	S	*	*				172.7	163.3	74.3	0	0	0	0	0	115.7
2245	T	29.8	Very low	31.4	Very low	129.2 Å²	129.2	135.8 Å²	135.8	79%	0.793	77%	0.765	S	S	*	*			trans	43.5	132.8	141.9	50.8	0	0	0	0	118.9
2246	S	28.8	Very low	31.5	Very low	103.6 Å²	103.6	136.1 Å²	136.1	72%	0.724	77%	0.765	S	S	*	*				115.4	141	84.8	67.4	0	0	0	0	116.4
2247	S	30.1	Very low	31.7	Very low	98.4 Å²	98.4	134.5 Å²	134.5	69%	0.688	76%	0.763	S	S	*	*			trans	47.8	150.9	149.3	65.1	0	0	0	0	118.4
2248	F	30.9	Very low	31.9	Very low	194 Å²	194	135.5 Å²	135.5	85%	0.851	77%	0.766	S	S	*	*			trans	72.2	148.4	160.4	-68.1	-77.8	0	0	0	116.4
2249	T	31.9	Very low	32	Very low	121 Å²	121	132.5 Å²	132.5	74%	0.742	76%	0.763	S	S	*	*			trans	-124.1	160.9	152.8	49.6	0	0	0	0	110.9
2250	P	32.8	Very low	32.1	Very low	118.8 Å²	118.8	133.4 Å²	133.4	77%	0.771	76%	0.762	S	S	*	*			trans	-111	150.4	-144	33.6	-22.6	0	0	0	114.2
2251	I	31.8	Very low	32.2	Very low	150.4 Å²	150.4	133.4 Å²	133.4	77%	0.771	76%	0.762	S	S	*	*			trans	-91.7	125.2	166.2	-61.2	174.5	0	0	0	114	F2194 P2253	F2194-I2251 HydrophobicContact CZ-CD1 4.5Å; I2251-P2253 WeakPolarHBondContact O-CD 3.49Å
2252	L	35	Very low	32.3	Very low	139.8 Å²	139.8	136.3 Å²	136.3	73%	0.732	76%	0.759	S	S	*	*			trans	-90.9	139.4	163.2	-79.9	145.9	0	0	0	111.4	R2254 Q2341	L2252-R2254 HydrophobicContact CD2-CG 4.39Å; L2252-Q2341 HydrophobicContact CD1-CB 3.6Å; L2252-Q2341 HydrophobicContact CD2-CB 4.13Å
2253	P	32.3	Very low	32.5	Very low	114 Å²	114	142.8 Å²	142.8	74%	0.74	77%	0.769	S	S	*	*				-120.6	150	129.4	33.2	-21.2	0	0	0	113	I2251 K2255	I2251-P2253 WeakPolarHBondContact O-CD 3.49Å; P2253-K2255 PolarHBondContact O-N 2.91Å
2254	R	32.2	Very low	32.6	Very low	236.2 Å²	236.2	139.7 Å²	139.7	89%	0.891	76%	0.76	S	S	*	*			trans	-69	133.8	162.3	-70.6	168.1	-178.3	-178.2	-0.9	112.5	L2252	L2252-R2254 HydrophobicContact CD2-CG 4.39Å
2255	K	33.7	Very low	32.6	Very low	196.2 Å²	196.2	143.8 Å²	143.8	85%	0.853	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-82.4	137.6	162.5	-77.1	-175	174.4	-178.4	0	110.6	T1702 P2253	T1702-K2255 HydrophobicContact CG2-CD 3.95Å; P2253-K2255 PolarHBondContact O-N 2.91Å
2256	P	36.6	Very low	32.6	Very low	112.8 Å²	112.8	142.1 Å²	142.1	73%	0.732	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-83.1	160	173	24.7	-24	0	0	0	112.2
2257	P	35.5	Very low	32.7	Very low	116.2 Å²	116.2	141.6 Å²	141.6	76%	0.755	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-81.4	145.5	172.7	30.4	-27.9	0	0	0	111.7	A2259	P2257-A2259 PolarHBondContact O-N 3.18Å
2258	P	38.2	Very low	32.7	Very low	125.6 Å²	125.6	142.1 Å²	142.1	82%	0.816	78%	0.782	S	S	*	*			trans	-84.4	132.4	171.2	31.5	-31.8	0	0	0	111.2	I2260	P2258-I2260 VanDerWaalsContact C-N 3.33Å; P2258-I2260 PolarHBondContact O-N 3.41Å
2259	A	33.2	Very low	32.7	Very low	87.8 Å²	87.8	136.4 Å²	136.4	73%	0.726	78%	0.777	S	S	*	*			trans	-124.6	133.8	-173.4	0	0	0	0	0	110.1	P2257 L2261	P2257-A2259 PolarHBondContact O-N 3.18Å; A2259-L2261 PolarHBondContact O-N 2.87Å; A2259-L2261 VanDerWaalsContact O-N 3.09Å
2260	I	33.4	Very low	32.7	Very low	136.2 Å²	136.2	136.8 Å²	136.8	70%	0.698	79%	0.785	S	S	*	*			trans	-94.1	113.7	-171.9	-66.8	-174.2	0	0	0	110.3	P2258 R2262	P2258-I2260 VanDerWaalsContact C-N 3.33Å; P2258-I2260 PolarHBondContact O-N 3.41Å; I2260-R2262 VanDerWaalsContact C-N 3.33Å; I2260-R2262 HydrophobicContact CG2-CG 4.04Å; I2260-R2262 PolarHBondContact O-N 3.1Å
2261	L	32.7	Very low	32.7	Very low	149.6 Å²	149.6	135 Å²	135	78%	0.783	79%	0.788	S	S	*	*			trans	-85.9	113.1	156.3	-68.3	158.5	0	0	0	112.2	A2259 R2263 Q2296 Q2297 S2298	A2259-L2261 PolarHBondContact O-N 2.87Å; A2259-L2261 VanDerWaalsContact O-N 3.09Å; L2261-R2263 PolarHBondContact O-N 2.78Å; L2261-Q2296 HydrophobicContact CB-CG 3.92Å; L2261-Q2296 WeakPolarHBondContact CB-O 3.24Å; L2261-Q2296 HydrophobicContact CD2-CG 4.13Å; L2261-Q2296 HydrophobicContact CG-CG 4.18Å; L2261-Q2297 HydrophobicContact CB-CG 4.02Å; L2261-Q2297 HydrophobicContact CD2-CG 3.69Å; L2261-Q2297 HydrophobicContact CG-CG 4.47Å; L2261-S2298 WeakPolarHBondContact CD2-OG 3.42Å
2262	R	32.7	Very low	32.8	Very low	182.6 Å²	182.6	131.9 Å²	131.9	69%	0.689	79%	0.793	S	S	*	*			trans	-91.1	134.2	164.1	-72.1	165.6	177.2	175.2	-2.2	110.5	N1927 I2260 T2264 Q2296 Q2297	N1927-R2262 PolarHBondContact OD1-NH1 3.46Å; I2260-R2262 VanDerWaalsContact C-N 3.33Å; I2260-R2262 HydrophobicContact CG2-CG 4.04Å; I2260-R2262 PolarHBondContact O-N 3.1Å; R2262-T2264 HydrophobicContact CB-CG2 4.46Å; R2262-T2264 PolarHBondContact O-N 2.77Å; R2262-Q2296 VanDerWaalsContact CA-O 3.29Å; R2262-Q2296 WeakPolarHBondContact CA-O 3.06Å; R2262-Q2296 PolarHBondContact N-O 3.34Å; R2262-Q2297 VanDerWaalsContact CG-CD 3.49Å; R2262-Q2297 HydrophobicContact CG-CG 4Å
2263	R	33.5	Very low	32.7	Very low	232.8 Å²	232.8	128.8 Å²	128.8	88%	0.878	80%	0.795	S	S	*	*			trans	-146.8	120.6	137.2	-87.4	177.1	178.9	151.2	0	108.5	L2261	L2261-R2263 PolarHBondContact O-N 2.78Å
2264	T	29.6	Very low	33.1	Very low	106.4 Å²	106.4	129.1 Å²	129.1	65%	0.653	80%	0.797	S	S	*	*				162.9	120.9	57.3	37.9	0	0	0	0	111.8	R2262	R2262-T2264 HydrophobicContact CB-CG2 4.46Å; R2262-T2264 PolarHBondContact O-N 2.77Å
2265	L	30.1	Very low	33.1	Very low	167.4 Å²	167.4	122.8 Å²	122.8	88%	0.876	79%	0.789	S	S	*	*			trans	79.4	137.3	157.6	-68.8	165.2	0	0	0	115.1
2266	A	30	Very low	33	Very low	93.6 Å²	93.6	118.1 Å²	118.1	77%	0.774	78%	0.781	S	S	*	*				178.3	128.4	59	0	0	0	0	0	113.2
2267	A	29.7	Very low	32.8	Very low	93.2 Å²	93.2	118.6 Å²	118.6	77%	0.77	78%	0.782	S	S	*	*				87.7	127.6	125.3	0	0	0	0	0	115.5
2268	A	30.6	Very low	32.6	Very low	110 Å²	110	117.4 Å²	117.4	91%	0.909	78%	0.776	S	S	*	*			trans	81.4	150.4	160.5	0	0	0	0	0	115.8
2269	G	31.4	Very low	32.4	Very low	72.8 Å²	72.8	118.9 Å²	118.9	75%	0.751	78%	0.777	S	S	*	*			cis	138.6	120.5	-27.6	0	0	0	0	0	112.8
2270	S	32.8	Very low	32.4	Very low	131.2 Å²	131.2	121.3 Å²	121.3	92%	0.917	78%	0.776	S	S	*	*				62.9	110.2	123.3	-169.3	0	0	0	0	118
2271	G	31.7	Very low	32.5	Very low	80 Å²	80	122.3 Å²	122.3	83%	0.825	78%	0.782	S	S	*	*			trans	105.1	128.4	146.7	0	0	0	0	0	117.5
2272	G	32.9	Very low	32.6	Very low	85.4 Å²	85.4	120.2 Å²	120.2	88%	0.88	78%	0.777	S	S	*	*			trans	128.5	144.1	151.9	0	0	0	0	0	115.7
2273	G	34.4	Very low	32.6	Very low	75.4 Å²	75.4	117.7 Å²	117.7	78%	0.777	78%	0.782	S	S	*	*			trans	-131.4	-169.3	148.8	0	0	0	0	0	112.3
2274	P	39.6	Very low	32.5	Very low	119.2 Å²	119.2	111.8 Å²	111.8	77%	0.774	78%	0.776	S	S	*	*			cis	-121.5	-169.7	-37.5	39.3	-25.7	0	0	0	113.2
2275	S	32.4	Very low	32.7	Very low	104.8 Å²	104.8	112 Å²	112	73%	0.733	78%	0.782	S	S	*	*			trans	118.6	136.8	162.3	-99.3	0	0	0	0	115.8
2276	S	32.4	Very low	32.9	Very low	97.6 Å²	97.6	109.4 Å²	109.4	68%	0.683	78%	0.778	S	S	*	*				66.5	140.4	73.3	-55.2	0	0	0	0	114.9
2277	T	32.3	Very low	33	Very low	123.4 Å²	123.4	109.5 Å²	109.5	76%	0.757	77%	0.773	S	S	*	*				-168	152.8	74	-33.3	0	0	0	0	113.4
2278	S	31	Very low	33.3	Very low	89.6 Å²	89.6	111.4 Å²	111.4	63%	0.627	77%	0.77	S	S	*	*			trans	79.6	140.5	152.6	60.1	0	0	0	0	116.9
2279	L	34.4	Very low	33.4	Very low	158 Å²	158	116.5 Å²	116.5	83%	0.827	77%	0.767	S	S	*	*				165.6	145.4	114.3	-78	173.9	0	0	0	112.9
2280	I	32.1	Very low	33.6	Very low	138 Å²	138	118.3 Å²	118.3	71%	0.708	77%	0.765	S	S	*	*			trans	179.3	142.1	135.6	-76.6	165.3	0	0	0	114.6
2281	L	35.6	Very low	33.5	Very low	157.4 Å²	157.4	120.2 Å²	120.2	82%	0.824	76%	0.76	S	S	*	*			trans	-144.4	168.6	162.9	-89.9	167.3	0	0	0	111.6
2282	P	35.3	Very low	33.5	Very low	104.4 Å²	104.4	123.6 Å²	123.6	68%	0.678	76%	0.757	S	S	*	*				-129.4	172.7	-116.5	39.5	-25.2	0	0	0	114.6
2283	V	32	Very low	33.4	Very low	130.8 Å²	130.8	125.9 Å²	125.9	79%	0.793	75%	0.754	S	S	*	*				100.8	126.5	128.4	173.9	0	0	0	0	114
2284	S	32.3	Very low	33.3	Very low	110.2 Å²	110.2	125.2 Å²	125.2	77%	0.771	75%	0.747	S	S	*	*			trans	-167.2	150.4	133.2	-75.4	0	0	0	0	113.2
2285	S	33.7	Very low	33	Very low	110 Å²	110	125.4 Å²	125.4	77%	0.769	75%	0.746	S	S	*	*			trans	-169.7	147.5	131.7	41.7	0	0	0	0	114.2
2286	S	32.9	Very low	33	Very low	113.2 Å²	113.2	127.5 Å²	127.5	79%	0.792	74%	0.744	S	S	*	*				81.4	127	126.4	-175.5	0	0	0	0	117.5
2287	S	33.1	Very low	33	Very low	94.2 Å²	94.2	130.9 Å²	130.9	66%	0.659	75%	0.749	S	S	*	*			cis	176.1	172.6	7.6	-160.9	0	0	0	0	114.3
2288	D	35.7	Very low	32.9	Very low	133.6 Å²	133.6	130.3 Å²	130.3	71%	0.714	75%	0.75	S	S	*	*				119.8	130.5	128.9	-75	-23.9	0	0	0	117.7
2289	Y	32.4	Very low	32.9	Very low	218 Å²	218	131.6 Å²	131.6	86%	0.855	76%	0.759	S	S	*	*			trans	55.3	154.5	154.1	-86.1	-91.1	0	0	0	119.1	Q2291	Y2289-Q2291 PolarHBondContact O-N 3.02Å
2290	P	36.4	Very low	32.8	Very low	109 Å²	109	129.2 Å²	129.2	71%	0.708	76%	0.756	S	S	*	*			trans	-124.5	171.2	-139.5	38.5	-23	0	0	0	114.1
2291	Q	31.5	Very low	32.8	Very low	173 Å²	173	130.3 Å²	130.3	81%	0.808	76%	0.762	S	S	*	*			trans	154.5	141.9	152.8	-117.6	-171.9	23.1	0	0	114.1	Y2289	Y2289-Q2291 PolarHBondContact O-N 3.02Å
2292	I	30.4	Very low	32.8	Very low	150 Å²	150	133.5 Å²	133.5	77%	0.769	76%	0.763	S	S	*	*			trans	-177.3	130.1	170.6	-84.4	173	0	0	0	109.9
2293	V	31.9	Very low	33	Very low	134.8 Å²	134.8	134.3 Å²	134.3	82%	0.817	77%	0.767	S	S	*	*			trans	89.8	135.5	172.6	172.5	0	0	0	0	112.5
2294	G	31.6	Very low	33.4	Very low	59.6 Å²	59.6	132.3 Å²	132.3	61%	0.614	76%	0.756	S	S	*	*			trans	115.3	130.2	130.1	0	0	0	0	0	113.6
2295	T	34.2	Very low	34.1	Very low	123.8 Å²	123.8	131 Å²	131	76%	0.76	75%	0.747	S	S	*	*				156.2	138.2	58.6	45.2	0	0	0	0	113.9
2296	Q	32.4	Very low	34.6	Very low	149.6 Å²	149.6	131.4 Å²	131.4	70%	0.699	75%	0.745	S	S	*	*			trans	42.4	136.3	160.1	-55.1	-161.2	42.9	0	0	118.9	L2261 R2262	L2261-Q2296 HydrophobicContact CB-CG 3.92Å; L2261-Q2296 WeakPolarHBondContact CB-O 3.24Å; L2261-Q2296 HydrophobicContact CD2-CG 4.13Å; L2261-Q2296 HydrophobicContact CG-CG 4.18Å; R2262-Q2296 VanDerWaalsContact CA-O 3.29Å; R2262-Q2296 WeakPolarHBondContact CA-O 3.06Å; R2262-Q2296 PolarHBondContact N-O 3.34Å
2297	Q	32.2	Very low	35.1	Very low	167.8 Å²	167.8	129.5 Å²	129.5	78%	0.784	74%	0.736	S	S	*	*				93.6	127.2	129.2	-78	179.8	44.2	0	0	114.8	L2261 R2262	L2261-Q2297 HydrophobicContact CB-CG 4.02Å; L2261-Q2297 HydrophobicContact CD2-CG 3.69Å; L2261-Q2297 HydrophobicContact CG-CG 4.47Å; R2262-Q2297 VanDerWaalsContact CG-CD 3.49Å; R2262-Q2297 HydrophobicContact CG-CG 4Å
2298	S	30.2	Very low	35.7	Very low	111.8 Å²	111.8	127.7 Å²	127.7	78%	0.782	72%	0.723	S	S	*	*			trans	-141.2	144.6	170.8	53.7	0	0	0	0	112	L2261 S2300	L2261-S2298 WeakPolarHBondContact CD2-OG 3.42Å; S2298-S2300 PolarHBondContact O-N 3.49Å
2299	S	30.3	Very low	36.1	Very low	117 Å²	117	126.1 Å²	126.1	82%	0.818	71%	0.714	S	S	*	*			trans	-95.3	119.6	-176.6	46.9	0	0	0	0	114.4	L2301	S2299-L2301 PolarHBondContact O-N 2.87Å
2300	S	32.1	Very low	37.2	Very low	107.8 Å²	107.8	120.2 Å²	120.2	75%	0.754	70%	0.7	S	S	*	*			trans	-79.5	114.1	158.7	-150	0	0	0	0	115.6	S2298 R2302	S2298-S2300 PolarHBondContact O-N 3.49Å; S2300-R2302 PolarHBondContact O-N 3.15Å
2301	L	33.1	Very low	37.7	Very low	161.2 Å²	161.2	117.5 Å²	117.5	84%	0.844	69%	0.687	S	S	*	*			trans	-57.1	115.4	159.2	-70.7	135.9	0	0	0	111.3	S2299 T2303	S2299-L2301 PolarHBondContact O-N 2.87Å; L2301-T2303 PolarHBondContact O-N 3.18Å
2302	R	35	Very low	38.5	Very low	223.2 Å²	223.2	112.7 Å²	112.7	84%	0.842	67%	0.67	S	S	*	*			trans	-80.4	112.6	173.6	-87.5	-176.1	178.3	-173.3	0.4	110.1	S2300	S2300-R2302 PolarHBondContact O-N 3.15Å
2303	T	39.2	Very low	39.3	Very low	122.2 Å²	122.2	109.6 Å²	109.6	75%	0.75	66%	0.655	S	S	*	*			trans	-65.9	147.7	166.1	52.5	0	0	0	0	109.8	L2301 S2305	L2301-T2303 PolarHBondContact O-N 3.18Å; T2303-S2305 PolarHBondContact O-N 3.04Å
2304	P	41.2	Very low	40.2	Very low	87.8 Å²	87.8	106.7 Å²	106.7	57%	0.57	64%	0.638	S	S	*	*			trans	-74.2	141.3	172.2	21.4	-20.6	0	0	0	110.5	V2306 L2309	P2304-V2306 PolarHBondContact O-N 2.9Å; P2304-L2309 HydrophobicContact CB-CD1 3.92Å; P2304-L2309 HydrophobicContact CG-CD1 4.12Å
2305	S	45.9	Very low	40.7	Very low	83.6 Å²	83.6	106.6 Å²	106.6	59%	0.585	63%	0.631	S	S	*	*			trans	-55.4	134.7	166.6	172.9	0	0	0	0	112.2	T2303 A2307 S2308 L2309	T2303-S2305 PolarHBondContact O-N 3.04Å; S2305-A2307 PolarHBondContact O-N 3.18Å; S2305-A2307 VanDerWaalsContact O-N 3.13Å; S2305-A2307 PolarHBondContact OG-N 3.26Å; S2305-S2308 CarbonylContact O-C 3.58Å; S2305-S2308 WeakPolarHBondContact O-CA 3.33Å; S2305-S2308 VanDerWaalsContact O-CB 3.3Å; S2305-S2308 WeakPolarHBondContact O-CB 3.42Å; S2305-S2308 PolarHBondContact O-N 3.01Å; S2305-L2309 PolarHBondContact O-N 3.14Å
2306	V	45.2	Very low	41	Very low	118.8 Å²	118.8	108.9 Å²	108.9	72%	0.72	63%	0.626	S	S	*	*	H	α-helix	trans	-41.5	-29.5	168.6	-178.5	0	0	0	0	113.1	P2304 S2308 L2309 V2310	P2304-V2306 PolarHBondContact O-N 2.9Å; V2306-S2308 PolarHBondContact O-N 3.12Å; V2306-L2309 PolarHBondContact O-N 3.14Å; V2306-V2310 HydrophobicContact CG1-CG2 4.17Å; V2306-V2310 WeakPolarHBondContact O-CB 3.4Å; V2306-V2310 VanDerWaalsContact O-CG2 3.26Å; V2306-V2310 WeakPolarHBondContact O-CG2 3.42Å; V2306-V2310 PolarHBondContact O-N 3.27Å
2307	A	42.5	Very low	41.6	Very low	73.4 Å²	73.4	108.6 Å²	108.6	61%	0.607	62%	0.624	S	S	*	*	H	α-helix	trans	-53.8	-26.9	169.1	0	0	0	0	0	114.5	S2305 V2310 A2311	S2305-A2307 PolarHBondContact O-N 3.18Å; S2305-A2307 VanDerWaalsContact O-N 3.13Å; S2305-A2307 PolarHBondContact OG-N 3.26Å; A2307-V2310 PolarHBondContact O-N 3.45Å; A2307-A2311 VanDerWaalsContact O-CB 3.24Å; A2307-A2311 WeakPolarHBondContact O-CB 3.39Å; A2307-A2311 PolarHBondContact O-N 3.02Å
2308	S	45.4	Very low	42.1	Very low	55.8 Å²	55.8	106.8 Å²	106.8	39%	0.39	62%	0.619	S	S	.	*	H	α-helix	trans	-83.3	-24.4	167.5	-175.5	0	0	0	0	113	S2305 V2306 V2310 A2311 T2312	S2305-S2308 CarbonylContact O-C 3.58Å; S2305-S2308 WeakPolarHBondContact O-CA 3.33Å; S2305-S2308 VanDerWaalsContact O-CB 3.3Å; S2305-S2308 WeakPolarHBondContact O-CB 3.42Å; S2305-S2308 PolarHBondContact O-N 3.01Å; V2306-S2308 PolarHBondContact O-N 3.12Å; S2308-V2310 VanDerWaalsContact C-N 3.35Å; S2308-A2311 PolarHBondContact O-N 3.09Å; S2308-T2312 WeakPolarHBondContact O-CB 3.38Å; S2308-T2312 WeakPolarHBondContact O-CG2 3.25Å; S2308-T2312 PolarHBondContact O-N 2.87Å; S2308-T2312 PolarHBondContact O-OG1 2.99Å
2309	L	45.1	Very low	42.7	Very low	99.6 Å²	99.6	106.1 Å²	106.1	52%	0.521	61%	0.61	S	S	.	*	H	α-helix	trans	-83.2	-22.7	172	-138.8	116.2	0	0	0	111.8	P2304 S2305 V2306 A2311 T2312 N2313	P2304-L2309 HydrophobicContact CB-CD1 3.92Å; P2304-L2309 HydrophobicContact CG-CD1 4.12Å; S2305-L2309 PolarHBondContact O-N 3.14Å; V2306-L2309 PolarHBondContact O-N 3.14Å; L2309-A2311 WeakPolarHBondContact CD2-O 3.38Å; L2309-T2312 WeakPolarHBondContact CA-OG1 3.39Å; L2309-T2312 PolarHBondContact O-OG1 3.08Å; L2309-N2313 WeakPolarHBondContact CD2-ND2 3.42Å; L2309-N2313 VanDerWaalsContact O-CB 3.28Å; L2309-N2313 WeakPolarHBondContact O-CB 3.37Å; L2309-N2313 PolarHBondContact O-N 3.1Å; L2309-N2313 VanDerWaalsContact O-N 3.09Å; L2309-N2313 PolarHBondContact O-ND2 3.07Å
2310	V	54.6	Low	43	Very low	93.6 Å²	93.6	104.8 Å²	104.8	57%	0.567	60%	0.6	S	S	*	*	H	α-helix	trans	-72.7	-46.8	171.1	170.6	0	0	0	0	110.1	V2306 A2307 S2308 T2312 N2313 T2314	V2306-V2310 HydrophobicContact CG1-CG2 4.17Å; V2306-V2310 WeakPolarHBondContact O-CB 3.4Å; V2306-V2310 VanDerWaalsContact O-CG2 3.26Å; V2306-V2310 WeakPolarHBondContact O-CG2 3.42Å; V2306-V2310 PolarHBondContact O-N 3.27Å; A2307-V2310 PolarHBondContact O-N 3.45Å; S2308-V2310 VanDerWaalsContact C-N 3.35Å; V2310-T2312 VanDerWaalsContact C-N 3.33Å; V2310-T2312 PolarHBondContact O-N 3.26Å; V2310-N2313 CarbonylContact O-C 3.54Å; V2310-N2313 WeakPolarHBondContact O-CA 3.21Å; V2310-N2313 PolarHBondContact O-N 3.23Å; V2310-T2314 HydrophobicContact CG1-CG2 4.31Å; V2310-T2314 WeakPolarHBondContact O-CB 3.3Å; V2310-T2314 WeakPolarHBondContact O-CG2 3.26Å; V2310-T2314 PolarHBondContact O-N 3.16Å; V2310-T2314 PolarHBondContact O-OG1 3.1Å; V2310-T2314 VanDerWaalsContact O-OG1 3.14Å
2311	A	48.1	Very low	43.1	Very low	52.2 Å²	52.2	102.7 Å²	102.7	43%	0.431	60%	0.596	S	S	.	*	H	α-helix	trans	-48.9	-32.4	-178	0	0	0	0	0	112.6	A2307 S2308 L2309 N2313 T2314 A2315 W2641	A2307-A2311 VanDerWaalsContact O-CB 3.24Å; A2307-A2311 WeakPolarHBondContact O-CB 3.39Å; A2307-A2311 PolarHBondContact O-N 3.02Å; S2308-A2311 PolarHBondContact O-N 3.09Å; L2309-A2311 WeakPolarHBondContact CD2-O 3.38Å; A2311-N2313 VanDerWaalsContact C-N 3.34Å; A2311-N2313 PolarHBondContact O-N 3.24Å; A2311-T2314 WeakPolarHBondContact CA-OG1 3.38Å; A2311-T2314 PolarHBondContact O-OG1 3.17Å; A2311-T2314 VanDerWaalsContact O-OG1 3.11Å; A2311-A2315 WeakPolarHBondContact O-CB 3.4Å; A2311-A2315 PolarHBondContact O-N 3.01Å; A2311-W2641 HydrophobicContact CB-CZ2 4.18Å
2312	T	48.7	Very low	43.2	Very low	72.6 Å²	72.6	98.2 Å²	98.2	45%	0.445	59%	0.588	S	S	.	*	H	α-helix	trans	-78.3	-20.2	170.3	52.3	0	0	0	0	112.8	S2308 L2309 V2310 R2316 W2641	S2308-T2312 WeakPolarHBondContact O-CB 3.38Å; S2308-T2312 WeakPolarHBondContact O-CG2 3.25Å; S2308-T2312 PolarHBondContact O-N 2.87Å; S2308-T2312 PolarHBondContact O-OG1 2.99Å; L2309-T2312 WeakPolarHBondContact CA-OG1 3.39Å; L2309-T2312 PolarHBondContact O-OG1 3.08Å; V2310-T2312 VanDerWaalsContact C-N 3.33Å; V2310-T2312 PolarHBondContact O-N 3.26Å; T2312-R2316 WeakPolarHBondContact O-CB 3.33Å; T2312-R2316 VanDerWaalsContact O-CD 3.23Å; T2312-R2316 WeakPolarHBondContact O-CD 3.42Å; T2312-R2316 VanDerWaalsContact O-CG 3.26Å; T2312-R2316 WeakPolarHBondContact O-CG 3.2Å; T2312-R2316 PolarHBondContact O-N 2.86Å; T2312-R2316 VanDerWaalsContact O-N 3.14Å; T2312-W2641 HydrophobicContact CG2-CH2 3.9Å; T2312-W2641 HydrophobicContact CG2-CZ2 4.42Å; T2312-W2641 HydrophobicContact CG2-CZ3 4.33Å
2313	N	46.1	Very low	43.1	Very low	84.4 Å²	84.4	97.7 Å²	97.7	45%	0.451	59%	0.588	S	S	.	*	H	α-helix	trans	-85.9	-34.3	175.7	-92.7	-47.7	0	0	0	113.3	L2309 V2310 A2311 R2316 Q2317	L2309-N2313 WeakPolarHBondContact CD2-ND2 3.42Å; L2309-N2313 VanDerWaalsContact O-CB 3.28Å; L2309-N2313 WeakPolarHBondContact O-CB 3.37Å; L2309-N2313 PolarHBondContact O-N 3.1Å; L2309-N2313 VanDerWaalsContact O-N 3.09Å; L2309-N2313 PolarHBondContact O-ND2 3.07Å; V2310-N2313 CarbonylContact O-C 3.54Å; V2310-N2313 WeakPolarHBondContact O-CA 3.21Å; V2310-N2313 PolarHBondContact O-N 3.23Å; A2311-N2313 VanDerWaalsContact C-N 3.34Å; A2311-N2313 PolarHBondContact O-N 3.24Å; N2313-R2316 WeakPolarHBondContact O-CB 3.26Å; N2313-R2316 PolarHBondContact O-N 3.36Å; N2313-R2316 VanDerWaalsContact O-N 3.16Å; N2313-Q2317 WeakPolarHBondContact O-CB 3.47Å; N2313-Q2317 WeakPolarHBondContact O-CG 3.3Å; N2313-Q2317 PolarHBondContact O-N 3.14Å; N2313-Q2317 PolarHBondContact O-NE2 3.07Å
2314	T	51.7	Low	42.9	Very low	75 Å²	75	98.2 Å²	98.2	46%	0.46	59%	0.586	S	S	.	*	H	α-helix	trans	-55.6	-31	169	52.4	0	0	0	0	113	V2310 A2311 R2316 Q2317 L2318	V2310-T2314 HydrophobicContact CG1-CG2 4.31Å; V2310-T2314 WeakPolarHBondContact O-CB 3.3Å; V2310-T2314 WeakPolarHBondContact O-CG2 3.26Å; V2310-T2314 PolarHBondContact O-N 3.16Å; V2310-T2314 PolarHBondContact O-OG1 3.1Å; V2310-T2314 VanDerWaalsContact O-OG1 3.14Å; A2311-T2314 WeakPolarHBondContact CA-OG1 3.38Å; A2311-T2314 PolarHBondContact O-OG1 3.17Å; A2311-T2314 VanDerWaalsContact O-OG1 3.11Å; T2314-R2316 VanDerWaalsContact C-N 3.31Å; T2314-R2316 PolarHBondContact O-N 3.13Å; T2314-Q2317 PolarHBondContact O-N 3.08Å; T2314-Q2317 VanDerWaalsContact O-N 3.16Å; T2314-L2318 WeakPolarHBondContact O-CB 3.3Å; T2314-L2318 VanDerWaalsContact O-CG 3.29Å; T2314-L2318 WeakPolarHBondContact O-CG 3.23Å; T2314-L2318 PolarHBondContact O-N 3.33Å
2315	A	42.1	Very low	42.5	Very low	57 Å²	57	104.1 Å²	104.1	47%	0.471	60%	0.597	S	S	.	*	H	α-helix	trans	-75.1	-35	157.8	0	0	0	0	0	112.2	A2311 L2318 V2319	A2311-A2315 WeakPolarHBondContact O-CB 3.4Å; A2311-A2315 PolarHBondContact O-N 3.01Å; A2315-L2318 PolarHBondContact O-N 2.97Å; A2315-V2319 VanDerWaalsContact O-CB 3.27Å; A2315-V2319 WeakPolarHBondContact O-CB 3.38Å; A2315-V2319 VanDerWaalsContact O-CG2 3.26Å; A2315-V2319 WeakPolarHBondContact O-CG2 3.35Å; A2315-V2319 PolarHBondContact O-N 3.07Å
2316	R	40.2	Very low	41.8	Very low	173 Å²	173	110.5 Å²	110.5	65%	0.653	61%	0.61	S	S	*	*	H	α-helix	trans	-83.2	-40	177.9	-87.8	171.8	-175.6	-128.2	2.8	110.5	T2312 N2313 T2314 L2318 V2319 C2320	T2312-R2316 WeakPolarHBondContact O-CB 3.33Å; T2312-R2316 VanDerWaalsContact O-CD 3.23Å; T2312-R2316 WeakPolarHBondContact O-CD 3.42Å; T2312-R2316 VanDerWaalsContact O-CG 3.26Å; T2312-R2316 WeakPolarHBondContact O-CG 3.2Å; T2312-R2316 PolarHBondContact O-N 2.86Å; T2312-R2316 VanDerWaalsContact O-N 3.14Å; N2313-R2316 WeakPolarHBondContact O-CB 3.26Å; N2313-R2316 PolarHBondContact O-N 3.36Å; N2313-R2316 VanDerWaalsContact O-N 3.16Å; T2314-R2316 VanDerWaalsContact C-N 3.31Å; T2314-R2316 PolarHBondContact O-N 3.13Å; R2316-L2318 VanDerWaalsContact C-N 3.34Å; R2316-L2318 PolarHBondContact O-N 2.74Å; R2316-V2319 PolarHBondContact O-N 3.03Å; R2316-C2320 CarbonylContact O-C 3.54Å; R2316-C2320 WeakPolarHBondContact O-CA 3.4Å; R2316-C2320 VanDerWaalsContact O-CB 3.22Å; R2316-C2320 WeakPolarHBondContact O-CB 3.39Å; R2316-C2320 PolarHBondContact O-N 3.12Å; R2316-C2320 PolarHBondContact O-SG 3.36Å
2317	Q	44.4	Very low	41.2	Very low	142.2 Å²	142.2	112 Å²	112	66%	0.664	61%	0.612	S	S	*	*	H	α-helix	trans	-54.3	-28.8	162.5	-87.1	176.3	27.3	0	0	112.9	N2313 T2314 V2319 C2320 G2321	N2313-Q2317 WeakPolarHBondContact O-CB 3.47Å; N2313-Q2317 WeakPolarHBondContact O-CG 3.3Å; N2313-Q2317 PolarHBondContact O-N 3.14Å; N2313-Q2317 PolarHBondContact O-NE2 3.07Å; T2314-Q2317 PolarHBondContact O-N 3.08Å; T2314-Q2317 VanDerWaalsContact O-N 3.16Å; Q2317-V2319 VanDerWaalsContact C-N 3.31Å; Q2317-C2320 CarbonylContact O-C 3.53Å; Q2317-G2321 PolarHBondContact O-N 3.4Å
2318	L	42.9	Very low	40.6	Very low	129.6 Å²	129.6	113.3 Å²	113.3	68%	0.679	62%	0.616	S	S	*	*	H	α-helix	trans	-67.6	-23.6	176	-64.2	171.3	0	0	0	112.9	T2314 A2315 R2316	T2314-L2318 WeakPolarHBondContact O-CB 3.3Å; T2314-L2318 VanDerWaalsContact O-CG 3.29Å; T2314-L2318 WeakPolarHBondContact O-CG 3.23Å; T2314-L2318 PolarHBondContact O-N 3.33Å; A2315-L2318 PolarHBondContact O-N 2.97Å; R2316-L2318 VanDerWaalsContact C-N 3.34Å; R2316-L2318 PolarHBondContact O-N 2.74Å
2319	V	43.1	Very low	40	Very low	97.6 Å²	97.6	116.7 Å²	116.7	59%	0.592	64%	0.635	S	S	*	*	H	α-helix	trans	-102.6	-32.5	178.8	176.3	0	0	0	0	110.8	A2315 R2316 Q2317 G2321 A2634	A2315-V2319 VanDerWaalsContact O-CB 3.27Å; A2315-V2319 WeakPolarHBondContact O-CB 3.38Å; A2315-V2319 VanDerWaalsContact O-CG2 3.26Å; A2315-V2319 WeakPolarHBondContact O-CG2 3.35Å; A2315-V2319 PolarHBondContact O-N 3.07Å; R2316-V2319 PolarHBondContact O-N 3.03Å; Q2317-V2319 VanDerWaalsContact C-N 3.31Å; V2319-G2321 PolarHBondContact O-N 3.27Å; V2319-A2634 HydrophobicContact CG2-CB 3.87Å
2320	C	36.5	Very low	39.3	Very low	89.8 Å²	89.8	114.9 Å²	114.9	61%	0.607	64%	0.641	S	S	*	*	S	Bend	trans	-84.4	71.5	163.4	-60.7	0	0	0	0	112.5	R2316 Q2317 G2322	R2316-C2320 CarbonylContact O-C 3.54Å; R2316-C2320 WeakPolarHBondContact O-CA 3.4Å; R2316-C2320 VanDerWaalsContact O-CB 3.22Å; R2316-C2320 WeakPolarHBondContact O-CB 3.39Å; R2316-C2320 PolarHBondContact O-N 3.12Å; R2316-C2320 PolarHBondContact O-SG 3.36Å; Q2317-C2320 CarbonylContact O-C 3.53Å; C2320-G2322 PolarHBondContact O-N 3.18Å
2321	G	34.7	Very low	38.3	Very low	64.8 Å²	64.8	115.9 Å²	115.9	67%	0.668	65%	0.649	S	S	*	*			trans	-9.8	118.6	-178.3	0	0	0	0	0	114.1	Q2317 V2319 Y2323	Q2317-G2321 PolarHBondContact O-N 3.4Å; V2319-G2321 PolarHBondContact O-N 3.27Å; G2321-Y2323 VanDerWaalsContact C-N 3.34Å; G2321-Y2323 WeakPolarHBondContact O-CD2 3.42Å; G2321-Y2323 PolarHBondContact O-N 3.12Å
2322	G	34.9	Very low	37.6	Very low	66.4 Å²	66.4	118.3 Å²	118.3	69%	0.685	66%	0.663	S	S	*	*			trans	-115.8	90	-165.5	0	0	0	0	0	114.6	C2320 N2324	C2320-G2322 PolarHBondContact O-N 3.18Å; G2322-N2324 VanDerWaalsContact C-N 3.3Å; G2322-N2324 PolarHBondContact O-N 3.14Å
2323	Y	33.3	Very low	36.8	Very low	213.2 Å²	213.2	122.3 Å²	122.3	84%	0.836	68%	0.68	S	S	*	*			trans	-56.9	109.3	170.5	-82.9	-86.6	0	0	0	113.5	G2321	G2321-Y2323 VanDerWaalsContact C-N 3.34Å; G2321-Y2323 WeakPolarHBondContact O-CD2 3.42Å; G2321-Y2323 PolarHBondContact O-N 3.12Å
2324	N	35.1	Very low	36	Very low	131.6 Å²	131.6	129.2 Å²	129.2	70%	0.704	70%	0.7	S	S	*	*			trans	179.6	86.5	169.8	-101.5	-17.5	0	0	0	114.8	G2322 Y2326	G2322-N2324 VanDerWaalsContact C-N 3.3Å; G2322-N2324 PolarHBondContact O-N 3.14Å; N2324-Y2326 VanDerWaalsContact ND2-CE2 3.29Å; N2324-Y2326 WeakPolarHBondContact ND2-CE2 3.19Å; N2324-Y2326 PolarHBondContact O-N 3.1Å; N2324-Y2326 VanDerWaalsContact O-N 3.14Å
2325	R	32.6	Very low	35.1	Very low	211.2 Å²	211.2	130.7 Å²	130.7	80%	0.797	71%	0.711	S	S	*	*			trans	-146	79.2	138.6	-132.1	-170.9	-65.6	-145.9	4.1	113.5	I2327	R2325-I2327 PolarHBondContact O-N 2.81Å
2326	Y	31.1	Very low	34.6	Very low	219 Å²	219	134.1 Å²	134.1	86%	0.859	72%	0.719	S	S	*	*			trans	-130.3	101.2	151.8	-97.5	-78	0	0	0	110.1	N2324	N2324-Y2326 VanDerWaalsContact ND2-CE2 3.29Å; N2324-Y2326 WeakPolarHBondContact ND2-CE2 3.19Å; N2324-Y2326 PolarHBondContact O-N 3.1Å; N2324-Y2326 VanDerWaalsContact O-N 3.14Å
2327	I	32.7	Very low	34.2	Very low	150.8 Å²	150.8	132.4 Å²	132.4	77%	0.773	72%	0.721	S	S	*	*			trans	-120.9	132.9	161.7	-62.4	179	0	0	0	107.2	R2325 T2329	R2325-I2327 PolarHBondContact O-N 2.81Å; I2327-T2329 PolarHBondContact O-N 2.79Å
2328	S	29.4	Very low	33.6	Very low	99 Å²	99	129.5 Å²	129.5	69%	0.692	72%	0.716	S	S	*	*			trans	-91.8	154.3	171.4	-166.7	0	0	0	0	111.3	Y1923 G2330	Y1923-S2328 WeakPolarHBondContact CD2-OG 3.46Å; Y1923-S2328 WeakPolarHBondContact CE2-OG 3.28Å; S2328-G2330 PolarHBondContact O-N 3.2Å
2329	T	32.4	Very low	33	Very low	127.4 Å²	127.4	129.4 Å²	129.4	78%	0.782	72%	0.716	S	S	*	*			trans	-42.5	127.1	176.4	52	0	0	0	0	115	T1787 I2327	T1787-T2329 WeakPolarHBondContact CG2-O 3.34Å; I2327-T2329 PolarHBondContact O-N 2.79Å
2330	G	31.3	Very low	32.5	Very low	62.4 Å²	62.4	129 Å²	129	64%	0.643	72%	0.718	S	S	*	*			trans	-158.9	145.7	164.5	0	0	0	0	0	113.2	S2328 S2332	S2328-G2330 PolarHBondContact O-N 3.2Å; G2330-S2332 PolarHBondContact O-N 2.89Å
2331	P	34	Very low	32.4	Very low	114 Å²	114	133.4 Å²	133.4	74%	0.74	73%	0.73	S	S	*	*			trans	-121.1	169.6	-176.7	39.2	-29.8	0	0	0	114	P2007	P2007-P2331 HydrophobicContact CG-CB 4.28Å; P2007-P2331 HydrophobicContact CG-CG 3.76Å
2332	S	31.7	Very low	32.2	Very low	104.2 Å²	104.2	133.7 Å²	133.7	73%	0.729	73%	0.733	S	S	*	*			trans	126.2	122	157.8	-141.5	0	0	0	0	116.5	G2330	G2330-S2332 PolarHBondContact O-N 2.89Å
2333	I	32.1	Very low	32.1	Very low	156.2 Å²	156.2	139.1 Å²	139.1	80%	0.801	74%	0.742	S	S	*	*				110.1	139.3	127.4	-68.1	162.9	0	0	0	115.3
2334	R	30.7	Very low	32.1	Very low	229.6 Å²	229.6	133 Å²	133	87%	0.866	73%	0.731	S	S	*	*			trans	-98.3	173.7	169.3	-72.4	-177	174.3	-138.1	0.8	110.6
2335	P	32.5	Very low	31.9	Very low	104.8 Å²	104.8	133.5 Å²	133.5	68%	0.681	73%	0.734	S	S	*	*			trans	-102.6	169.9	171	30.3	-20.5	0	0	0	114.2
2336	M	30.6	Very low	32	Very low	129.8 Å²	129.8	130 Å²	130	64%	0.639	73%	0.73	S	S	*	*			trans	158.6	140.5	147.2	-69.9	-89.7	82.2	0	0	112.9	E1860 D1861	E1860-M2336 WeakPolarHBondContact O-CB 3.39Å; E1860-M2336 VanDerWaalsContact O-CG 3.22Å; E1860-M2336 WeakPolarHBondContact O-CG 3.44Å; D1861-M2336 HydrophobicContact CB-CB 4.07Å; D1861-M2336 WeakPolarHBondContact OD2-CB 3.5Å
2337	I	32.1	Very low	32.3	Very low	135.8 Å²	135.8	126.6 Å²	126.6	70%	0.696	72%	0.721	S	S	*	*			trans	72.3	138.6	136.6	-66.3	171.3	0	0	0	114.2	D1861 E1862 D1863	D1861-I2337 HydrophobicContact CB-CB 3.74Å; D1861-I2337 HydrophobicContact CB-CG2 4.09Å; D1861-I2337 PolarHBondContact OD2-N 3.36Å; E1862-I2337 VanDerWaalsContact C-CG2 3.43Å; E1862-I2337 WeakPolarHBondContact O-CG2 3.4Å; D1863-I2337 HydrophobicContact CB-CG2 3.34Å
2338	S	32.2	Very low	32.6	Very low	81.8 Å²	81.8	128.3 Å²	128.3	57%	0.572	73%	0.726	S	S	*	*			trans	89.5	142.2	163.4	-78	0	0	0	0	119.1	D1861 E1862	D1861-S2338 WeakPolarHBondContact CB-OG 3.19Å; E1862-S2338 VanDerWaalsContact O-CA 3.3Å; E1862-S2338 WeakPolarHBondContact O-CA 3.47Å; E1862-S2338 WeakPolarHBondContact O-CB 3.43Å; E1862-S2338 PolarHBondContact O-N 2.95Å; E1862-S2338 PolarHBondContact O-OG 2.81Å
2339	D	30.4	Very low	32.8	Very low	127 Å²	127	126.9 Å²	126.9	68%	0.679	73%	0.727	S	S	*	*				101.7	134.9	119.8	-73.9	-38.6	0	0	0	119.8	D1864	D1864-D2339 PolarHBondContact N-OD1 2.68Å
2340	S	33	Very low	32.8	Very low	90 Å²	90	131.5 Å²	131.5	63%	0.629	73%	0.73	S	S	*	*			trans	120	133.5	141.4	68.8	0	0	0	0	117.9
2341	Q	32.9	Very low	33.1	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	74%	0.737	S	S	*	*				73	145.6	123.6	-75	-177.7	-8.8	0	0	118	L2252	L2252-Q2341 HydrophobicContact CD1-CB 3.6Å; L2252-Q2341 HydrophobicContact CD2-CB 4.13Å
2342	G	32.4	Very low	33.1	Very low	71 Å²	71	137.4 Å²	137.4	73%	0.732	73%	0.732	S	S	*	*			trans	141.6	109	159.7	0	0	0	0	0	116.8
2343	M	31.4	Very low	33.4	Very low	180 Å²	180	139.7 Å²	139.7	89%	0.887	74%	0.735	S	S	*	*			trans	50.6	137.5	138	-64.3	-177.8	65.5	0	0	119.3
2344	S	32.8	Very low	33.4	Very low	84.8 Å²	84.8	135.8 Å²	135.8	59%	0.593	73%	0.726	S	S	*	*			cis	151.1	149.1	28.2	48.9	0	0	0	0	114.9
2345	D	32.4	Very low	33.5	Very low	142.6 Å²	142.6	134.1 Å²	134.1	76%	0.763	73%	0.725	S	S	*	*			trans	72	155	135.6	-80.7	-31	0	0	0	118.3	H2347	D2345-H2347 IonicContact OD1-CE1 2.66Å; D2345-H2347 IonicContact OD1-ND1 2.76Å
2346	L	33.2	Very low	33.5	Very low	137.6 Å²	137.6	133.4 Å²	133.4	72%	0.72	73%	0.728	S	S	*	*			cis	-169	143.6	42.7	-158.2	64.6	0	0	0	114.7
2347	H	38.6	Very low	33.7	Very low	147.4 Å²	147.4	135.5 Å²	135.5	68%	0.682	74%	0.736	S	S	*	*			trans	20.6	140.3	153.4	-72.2	-8.3	0	0	0	121.3	D2345	D2345-H2347 IonicContact OD1-CE1 2.66Å; D2345-H2347 IonicContact OD1-ND1 2.76Å
2348	Q	38	Very low	33.7	Very low	187.6 Å²	187.6	136.8 Å²	136.8	88%	0.877	74%	0.739	S	S	*	*				135.1	148.4	124.5	-87.3	153.1	37.3	0	0	115.5
2349	G	34.5	Very low	33.8	Very low	68.8 Å²	68.8	139.6 Å²	139.6	71%	0.709	75%	0.746	S	S	*	*			trans	154.2	47	167	0	0	0	0	0	118.4	R1711	R1711-G2349 PolarHBondContact NH1-O 3.44Å
2350	R	32.9	Very low	34	Very low	224.4 Å²	224.4	143.9 Å²	143.9	85%	0.847	75%	0.753	S	S	*	*			trans	-7.7	133.5	160	-76.9	-176.6	168.9	-162.2	-1.3	117.2
2351	R	37.4	Very low	34.1	Very low	208.2 Å²	208.2	147.2 Å²	147.2	79%	0.786	76%	0.758	S	S	*	*			trans	93	113.4	150	-57.8	179.3	-167.2	-101.5	1.1	115.4	R1711 Q2218 P2220	R1711-R2351 PolarHBondContact NH2-O 3.06Å; Q2218-R2351 VanDerWaalsContact C-NH2 3.34Å; Q2218-R2351 PolarHBondContact O-NH1 3.44Å; Q2218-R2351 PolarHBondContact O-NH2 3.36Å; P2220-R2351 HydrophobicContact CB-CB 4.34Å; P2220-R2351 HydrophobicContact CB-CG 4.01Å; P2220-R2351 HydrophobicContact CG-CB 4.48Å; P2220-R2351 HydrophobicContact CG-CG 3.93Å
2352	S	34.3	Very low	34	Very low	92 Å²	92	145.3 Å²	145.3	64%	0.643	75%	0.753	S	S	*	*				-168.9	149.6	59.6	57	0	0	0	0	111.1	P2220 I2222	P2220-S2352 WeakPolarHBondContact CG-OG 3.45Å; I2222-S2352 VanDerWaalsContact CG1-C 3.44Å; I2222-S2352 WeakPolarHBondContact CG1-O 3.46Å
2353	I	37.1	Very low	34	Very low	152.8 Å²	152.8	146.8 Å²	146.8	78%	0.784	75%	0.753	S	S	*	*			trans	-165.6	124.9	165.9	-79.9	170.1	0	0	0	107.1	I2224	I2224-I2353 HydrophobicContact CD1-CG2 3.92Å; I2224-I2353 HydrophobicContact CG1-CG2 3.61Å
2354	A	31.8	Very low	34.1	Very low	73.4 Å²	73.4	144.7 Å²	144.7	61%	0.607	75%	0.745	S	S	*	*			cis	117.3	104.6	13.4	0	0	0	0	0	114.6	I2222 T2223 I2224	I2222-A2354 HydrophobicContact CB-CB 3.92Å; I2222-A2354 HydrophobicContact CD1-CB 4.09Å; I2222-A2354 HydrophobicContact CG1-CB 3.88Å; I2222-A2354 HydrophobicContact CG2-CB 3.67Å; T2223-A2354 VanDerWaalsContact CA-CB 3.46Å; I2224-A2354 HydrophobicContact CB-CB 4.45Å; I2224-A2354 WeakPolarHBondContact CB-O 3.3Å; I2224-A2354 VanDerWaalsContact CD1-O 3.24Å; I2224-A2354 WeakPolarHBondContact CD1-O 3.39Å; I2224-A2354 HydrophobicContact CG1-CB 4.04Å; I2224-A2354 WeakPolarHBondContact CG1-O 3.27Å
2355	K	33	Very low	34.2	Very low	193.8 Å²	193.8	147.4 Å²	147.4	84%	0.843	75%	0.751	S	S	*	*			trans	142.3	127.3	151.4	-116.8	171.6	179.7	178.5	0	113.3	I2224	I2224-K2355 HydrophobicContact CB-CB 4.29Å; I2224-K2355 WeakPolarHBondContact O-CD 3.25Å
2356	A	32.7	Very low	34.2	Very low	90.2 Å²	90.2	147.2 Å²	147.2	75%	0.745	75%	0.75	S	S	*	*			trans	-145.5	129.8	156.2	0	0	0	0	0	112
2357	Q	34.3	Very low	34.3	Very low	173.6 Å²	173.6	148.5 Å²	148.5	81%	0.811	75%	0.752	S	S	*	*				-143.5	138.2	103.3	-79.3	169	-54	0	0	110.9
2358	H	32.5	Very low	34.1	Very low	164 Å²	164	147.7 Å²	147.7	76%	0.759	75%	0.753	S	S	*	*				-159.5	145	106	-100.6	-70.2	0	0	0	111.2
2359	I	34.5	Very low	34	Very low	139.8 Å²	139.8	144.3 Å²	144.3	72%	0.717	75%	0.747	S	S	*	*			trans	108.5	135.6	140	-66.7	165	0	0	0	112.7
2360	R	34.8	Very low	33.7	Very low	217.8 Å²	217.8	151.7 Å²	151.7	82%	0.822	75%	0.754	S	S	*	*			cis	160.5	130.4	-15.9	-90.7	177.5	-132	175.1	1.6	110.8
2361	H	33.9	Very low	33.5	Very low	160.4 Å²	160.4	146.2 Å²	146.2	74%	0.743	75%	0.749	S	S	*	*				-9.3	148.5	117	-101	-104.9	0	0	0	112
2362	N	32.2	Very low	33.2	Very low	140.6 Å²	140.6	143.2 Å²	143.2	75%	0.752	75%	0.747	S	S	*	*				76.2	123.7	128.4	-77.3	13.9	0	0	0	116.8
2363	S	32.1	Very low	33.1	Very low	103.4 Å²	103.4	146.3 Å²	146.3	72%	0.723	75%	0.753	S	S	*	*				82.9	147.8	84.1	-144.9	0	0	0	0	117.2
2364	L	32.7	Very low	32.8	Very low	136 Å²	136	145.5 Å²	145.5	71%	0.712	75%	0.751	S	S	*	*			cis	151.7	137.1	14.1	-154.4	68.6	0	0	0	112.3
2365	I	35.1	Very low	32.9	Very low	141.2 Å²	141.2	148.2 Å²	148.2	72%	0.724	76%	0.755	S	S	*	*			trans	71.2	138.7	155.5	-65.5	171.4	0	0	0	116
2366	D	32.4	Very low	32.7	Very low	137.4 Å²	137.4	145.3 Å²	145.3	74%	0.735	75%	0.745	S	S	*	*				126.8	158.4	72.9	-117.3	-22.4	0	0	0	115
2367	E	35.9	Very low	32.8	Very low	165 Å²	165	146.3 Å²	146.3	77%	0.771	75%	0.746	S	S	*	*			trans	80	129.9	151.9	-66.4	-56.7	123.5	0	0	120.4
2368	D	33.8	Very low	32.8	Very low	132.2 Å²	132.2	146 Å²	146	71%	0.707	74%	0.742	S	S	*	*			trans	-10.8	150.9	162.3	-118.2	12.9	0	0	0	119.7	R2370	D2368-R2370 VanDerWaalsContact C-N 3.3Å; D2368-R2370 HydrophobicContact CB-CB 4.29Å; D2368-R2370 PolarHBondContact O-N 2.95Å; D2368-R2370 WeakPolarHBondContact OD2-CB 3.32Å; D2368-R2370 WeakPolarHBondContact OD2-CD 3.27Å
2369	P	35.2	Very low	32.8	Very low	114.4 Å²	114.4	143.6 Å²	143.6	74%	0.743	74%	0.739	S	S	*	*			trans	-108.5	126.5	174.6	37.8	-30.3	0	0	0	114.1
2370	R	29.3	Very low	32.6	Very low	225.8 Å²	225.8	144 Å²	144	85%	0.852	74%	0.742	S	S	*	*			trans	-156.7	97.2	166.7	-73.2	172.4	170.6	-148.3	-0.6	115	D2368	D2368-R2370 VanDerWaalsContact C-N 3.3Å; D2368-R2370 HydrophobicContact CB-CB 4.29Å; D2368-R2370 PolarHBondContact O-N 2.95Å; D2368-R2370 WeakPolarHBondContact OD2-CB 3.32Å; D2368-R2370 WeakPolarHBondContact OD2-CD 3.27Å
2371	S	29.3	Very low	32.6	Very low	108.2 Å²	108.2	140.6 Å²	140.6	76%	0.757	74%	0.738	S	S	*	*			trans	169.8	146.7	161.9	80.7	0	0	0	0	111.6
2372	I	31.1	Very low	32.6	Very low	144.8 Å²	144.8	137.1 Å²	137.1	74%	0.743	73%	0.732	S	S	*	*				83.3	114.4	114.3	-63.3	161.4	0	0	0	111.2
2373	M	31.4	Very low	32.7	Very low	156.8 Å²	156.8	137.3 Å²	137.3	77%	0.772	73%	0.733	S	S	*	*				165.6	125	87.4	-82.1	162.4	75.6	0	0	113.7
2374	N	30.8	Very low	32.8	Very low	136.6 Å²	136.6	143 Å²	143	73%	0.73	74%	0.74	S	S	*	*				21.4	114.4	122.4	-108.1	5.6	0	0	0	113.1	Q2376	N2374-Q2376 PolarHBondContact O-N 3.07Å; N2374-Q2376 PolarHBondContact OD1-NE2 3.12Å
2375	N	33.5	Very low	33	Very low	130 Å²	130	146.4 Å²	146.4	70%	0.695	75%	0.749	S	S	*	*			trans	153.3	119.8	153.7	-67.7	-15.7	0	0	0	112.9	S2377	N2375-S2377 PolarHBondContact O-N 2.98Å
2376	Q	29.8	Very low	32.9	Very low	133.8 Å²	133.8	142.9 Å²	142.9	63%	0.625	75%	0.747	S	S	*	*				25.1	100.7	95.3	-59.2	-175.6	19.7	0	0	112.6	T2033 I2034 N2374 K2378 D2424	T2033-Q2376 VanDerWaalsContact CG2-OE1 3.3Å; T2033-Q2376 PolarHBondContact O-NE2 2.93Å; I2034-Q2376 HydrophobicContact CD1-CB 4.03Å; I2034-Q2376 HydrophobicContact CD1-CG 3.53Å; I2034-Q2376 HydrophobicContact CG1-CG 3.96Å; N2374-Q2376 PolarHBondContact O-N 3.07Å; N2374-Q2376 PolarHBondContact OD1-NE2 3.12Å; Q2376-K2378 PolarHBondContact O-N 2.98Å; Q2376-D2424 PolarHBondContact NE2-OD1 2.93Å; Q2376-D2424 PolarHBondContact NE2-OD2 3.31Å
2377	S	33.7	Very low	33	Very low	111.4 Å²	111.4	143.6 Å²	143.6	78%	0.779	75%	0.75	S	S	*	*			trans	-126.8	108.4	152.2	-62.5	0	0	0	0	109.2	N2375 V2379	N2375-S2377 PolarHBondContact O-N 2.98Å; S2377-V2379 PolarHBondContact O-N 3.06Å
2378	K	34.7	Very low	32.9	Very low	166 Å²	166	142.1 Å²	142.1	72%	0.722	75%	0.752	S	S	*	*				11.2	104.1	84.6	-94	-169.5	-179.8	-175.5	0	112.2	Q2376 L2380	Q2376-K2378 PolarHBondContact O-N 2.98Å; K2378-L2380 PolarHBondContact O-N 2.86Å
2379	V	31.5	Very low	33	Very low	114 Å²	114	145.7 Å²	145.7	69%	0.691	76%	0.756	S	S	*	*			trans	-40.3	111.1	162.1	-174.8	0	0	0	0	110.5	N2043 V2044 S2377 I2381	N2043-V2379 WeakPolarHBondContact O-CG2 3.36Å; V2044-V2379 HydrophobicContact CG1-CG1 4.22Å; V2044-V2379 HydrophobicContact CG2-CB 4.29Å; V2044-V2379 HydrophobicContact CG2-CG1 4.11Å; V2044-V2379 HydrophobicContact CG2-CG2 4.22Å; S2377-V2379 PolarHBondContact O-N 3.06Å; V2379-I2381 VanDerWaalsContact C-N 3.32Å; V2379-I2381 HydrophobicContact CG1-CG1 4.01Å; V2379-I2381 PolarHBondContact O-N 2.93Å
2380	L	31.6	Very low	32.9	Very low	149 Å²	149	147.4 Å²	147.4	78%	0.78	75%	0.754	S	S	*	*				-124.7	100.7	122.2	-80.3	175.5	0	0	0	110.4	K2378 S2382	K2378-L2380 PolarHBondContact O-N 2.86Å; L2380-S2382 PolarHBondContact O-N 3.37Å
2381	I	34.5	Very low	33.2	Very low	146.2 Å²	146.2	145.9 Å²	145.9	75%	0.75	75%	0.754	S	S	*	*			trans	-84.4	115.9	155	-63.7	175.9	0	0	0	106	V2044 V2379 D2383	V2044-I2381 HydrophobicContact CB-CD1 4.49Å; V2044-I2381 HydrophobicContact CG1-CB 3.88Å; V2044-I2381 HydrophobicContact CG1-CD1 4.18Å; V2044-I2381 HydrophobicContact CG1-CG1 4.01Å; V2379-I2381 VanDerWaalsContact C-N 3.32Å; V2379-I2381 HydrophobicContact CG1-CG1 4.01Å; V2379-I2381 PolarHBondContact O-N 2.93Å; I2381-D2383 WeakPolarHBondContact CG2-OD2 3.4Å; I2381-D2383 PolarHBondContact O-N 3.22Å
2382	S	33.2	Very low	33.5	Very low	87.2 Å²	87.2	146.5 Å²	146.5	61%	0.61	75%	0.749	S	S	*	*			trans	-117.2	101.6	178.6	69.3	0	0	0	0	110.5	L2380 Y2384	L2380-S2382 PolarHBondContact O-N 3.37Å; S2382-Y2384 VanDerWaalsContact O-CD2 3.28Å; S2382-Y2384 WeakPolarHBondContact O-CD2 3.34Å; S2382-Y2384 PolarHBondContact O-N 3.16Å; S2382-Y2384 VanDerWaalsContact O-N 3.12Å
2383	D	34.8	Very low	33.8	Very low	143.4 Å²	143.4	145.8 Å²	145.8	77%	0.767	76%	0.757	S	S	*	*			trans	-29.2	108.2	164.8	-69.5	-35.6	0	0	0	115.8	I2381 K2385	I2381-D2383 WeakPolarHBondContact CG2-OD2 3.4Å; I2381-D2383 PolarHBondContact O-N 3.22Å; D2383-K2385 VanDerWaalsContact C-N 3.35Å; D2383-K2385 PolarHBondContact O-N 2.83Å
2384	Y	34.1	Very low	34	Very low	223.6 Å²	223.6	141.9 Å²	141.9	88%	0.877	76%	0.757	S	S	*	*			trans	-82.9	92.8	152.3	-100.4	-91.2	0	0	0	113.1	S2382 G2386	S2382-Y2384 VanDerWaalsContact O-CD2 3.28Å; S2382-Y2384 WeakPolarHBondContact O-CD2 3.34Å; S2382-Y2384 PolarHBondContact O-N 3.16Å; S2382-Y2384 VanDerWaalsContact O-N 3.12Å; Y2384-G2386 PolarHBondContact O-N 3.08Å; Y2384-G2386 VanDerWaalsContact O-N 3.07Å
2385	K	36.4	Very low	34.2	Very low	207.8 Å²	207.8	140.9 Å²	140.9	90%	0.903	76%	0.761	S	S	*	*			trans	-124.2	99	146.7	-108	173.1	-177.4	176	0	110.6	D2383 L2387	D2383-K2385 VanDerWaalsContact C-N 3.35Å; D2383-K2385 PolarHBondContact O-N 2.83Å; K2385-L2387 PolarHBondContact O-N 3.38Å
2386	G	33.5	Very low	34.5	Very low	66.4 Å²	66.4	141.4 Å²	141.4	69%	0.685	77%	0.769	S	S	*	*			trans	-143.7	109.4	171.5	0	0	0	0	0	114.4	Y2384 V2388	Y2384-G2386 PolarHBondContact O-N 3.08Å; Y2384-G2386 VanDerWaalsContact O-N 3.07Å; G2386-V2388 PolarHBondContact O-N 2.79Å
2387	L	34.2	Very low	34.7	Very low	152.6 Å²	152.6	140.1 Å²	140.1	80%	0.799	78%	0.781	S	S	*	*			trans	-41.4	108	168.6	-126.7	77.2	0	0	0	114.1	K2385 R2389	K2385-L2387 PolarHBondContact O-N 3.38Å; L2387-R2389 PolarHBondContact O-N 3.06Å; L2387-R2389 VanDerWaalsContact O-N 3.13Å
2388	V	33.8	Very low	34.9	Very low	134.6 Å²	134.6	139.4 Å²	139.4	82%	0.816	78%	0.781	S	S	*	*			trans	-102.7	117.5	145	178.6	0	0	0	0	109.4	G2386 Q2390	G2386-V2388 PolarHBondContact O-N 2.79Å; V2388-Q2390 PolarHBondContact O-N 3.39Å
2389	R	35.8	Very low	34.9	Very low	206.2 Å²	206.2	142.4 Å²	142.4	78%	0.778	79%	0.788	S	S	*	*			trans	-44.4	111.1	156.3	-68.3	178.9	-155.8	-102.7	1.6	113	L2387 F2391	L2387-R2389 PolarHBondContact O-N 3.06Å; L2387-R2389 VanDerWaalsContact O-N 3.13Å; R2389-F2391 PolarHBondContact O-N 3.4Å
2390	Q	33.6	Very low	35.2	Very low	150 Å²	150	144.9 Å²	144.9	70%	0.701	80%	0.797	S	S	*	*				3.3	124.4	128.6	-175.2	-179.2	8.1	0	0	114.3	V2388 D2392	V2388-Q2390 PolarHBondContact O-N 3.39Å; Q2390-D2392 WeakPolarHBondContact CG-OD2 3.15Å; Q2390-D2392 PolarHBondContact NE2-OD1 2.93Å; Q2390-D2392 PolarHBondContact NE2-OD2 3.23Å
2391	F	35.9	Very low	35.4	Very low	194.6 Å²	194.6	145.6 Å²	145.6	85%	0.854	80%	0.796	S	S	*	*			trans	-160.6	117.1	152.4	-86.2	-73.1	0	0	0	110.3	R2389	R2389-F2391 PolarHBondContact O-N 3.4Å
2392	D	36.4	Very low	35.8	Very low	121.6 Å²	121.6	144.1 Å²	144.1	65%	0.65	79%	0.794	S	S	*	*			trans	-82.5	139.6	168	-62.9	-50.4	0	0	0	116.9	Q2390 G2394	Q2390-D2392 WeakPolarHBondContact CG-OD2 3.15Å; Q2390-D2392 PolarHBondContact NE2-OD1 2.93Å; Q2390-D2392 PolarHBondContact NE2-OD2 3.23Å; D2392-G2394 PolarHBondContact O-N 3.25Å
2393	S	36.6	Very low	36.4	Very low	129.4 Å²	129.4	145.4 Å²	145.4	91%	0.905	80%	0.8	S	S	*	*			trans	56.4	136.3	160.1	71.5	0	0	0	0	118
2394	G	36.4	Very low	37.1	Very low	76.2 Å²	76.2	145.1 Å²	145.1	79%	0.786	80%	0.797	S	S	*	*			trans	162.9	45.8	174.5	0	0	0	0	0	117.3	D2392	D2392-G2394 PolarHBondContact O-N 3.25Å
2395	S	34.5	Very low	38.4	Very low	115.8 Å²	115.8	138.4 Å²	138.4	81%	0.81	78%	0.779	S	S	*	*			trans	-30	134.4	173.9	-173.6	0	0	0	0	115.7
2396	T	40.5	Very low	39.9	Very low	140 Å²	140	132.9 Å²	132.9	86%	0.859	76%	0.76	S	S	*	*			trans	179.6	139	139.6	16.4	0	0	0	0	113.1
2397	A	32.8	Very low	41.9	Very low	105.4 Å²	105.4	136.4 Å²	136.4	87%	0.871	76%	0.759	S	S	*	*			trans	-88.1	118.6	178.9	0	0	0	0	0	115.4
2398	A	37.9	Very low	43.9	Very low	96.4 Å²	96.4	132.1 Å²	132.1	80%	0.797	75%	0.745	S	S	*	*			trans	-144.4	99.3	159.7	0	0	0	0	0	110.7	L2400	A2398-L2400 PolarHBondContact O-N 3.28Å; A2398-L2400 VanDerWaalsContact O-N 3.13Å
2399	R	35	Very low	45.9	Very low	229.8 Å²	229.8	128.7 Å²	128.7	87%	0.867	72%	0.724	S	S	*	*			trans	-38.2	99.7	161	-174.7	-178.1	-176.3	-179.2	1.7	113.4	Q2401	R2399-Q2401 PolarHBondContact O-N 2.87Å
2400	L	37.7	Very low	48.1	Very low	166 Å²	166	122.9 Å²	122.9	87%	0.869	71%	0.708	S	S	*	*			trans	-24.3	107.1	162.2	-69.9	170.5	0	0	0	113.1	A2398	A2398-L2400 PolarHBondContact O-N 3.28Å; A2398-L2400 VanDerWaalsContact O-N 3.13Å
2401	Q	37	Very low	50.3	Low	164.6 Å²	164.6	118.1 Å²	118.1	77%	0.769	70%	0.695	S	S	*	*			trans	-108.8	129.2	158.2	-155.5	130.3	-9.1	0	0	109.4	R2399	R2399-Q2401 PolarHBondContact O-N 2.87Å
2402	T	41.2	Very low	52.6	Low	115.4 Å²	115.4	112.8 Å²	112.8	71%	0.708	68%	0.675	S	S	*	*			trans	-65.2	138.3	171	43.5	0	0	0	0	109.9	I2404	T2402-I2404 VanDerWaalsContact C-N 3.33Å; T2402-I2404 PolarHBondContact O-N 3.15Å
2403	P	46.7	Very low	55	Low	113 Å²	113	111.6 Å²	111.6	73%	0.734	67%	0.668	S	S	*	*			trans	-65.1	117.2	169.2	27.9	-32.3	0	0	0	108.2	V2405	P2403-V2405 HydrophobicContact CG-CG2 4.37Å; P2403-V2405 PolarHBondContact O-N 3.21Å; P2403-V2405 VanDerWaalsContact O-N 3.13Å
2404	I	50.1	Low	57.3	Low	137.8 Å²	137.8	113.3 Å²	113.3	71%	0.707	66%	0.655	S	S	*	*			trans	-69.4	102.6	170.3	-61.5	173.7	0	0	0	106	T2402 D2406	T2402-I2404 VanDerWaalsContact C-N 3.33Å; T2402-I2404 PolarHBondContact O-N 3.15Å; I2404-D2406 VanDerWaalsContact C-N 3.27Å; I2404-D2406 PolarHBondContact O-N 3.01Å
2405	V	60.2	Low	59.7	Low	82.6 Å²	82.6	111.7 Å²	111.7	50%	0.501	63%	0.634	S	S	.	*			trans	-74.9	108	171.9	-176.7	0	0	0	0	106.4	P2403 E2407 T2409 L2410	P2403-V2405 HydrophobicContact CG-CG2 4.37Å; P2403-V2405 PolarHBondContact O-N 3.21Å; P2403-V2405 VanDerWaalsContact O-N 3.13Å; V2405-E2407 PolarHBondContact O-N 3.26Å; V2405-T2409 VanDerWaalsContact CG1-OG1 3.28Å; V2405-T2409 WeakPolarHBondContact CG1-OG1 3.42Å; V2405-L2410 HydrophobicContact CB-CD1 4.28Å; V2405-L2410 HydrophobicContact CB-CG 4.42Å; V2405-L2410 HydrophobicContact CG1-CB 4.23Å; V2405-L2410 HydrophobicContact CG1-CD1 4.18Å; V2405-L2410 HydrophobicContact CG1-CD2 4.2Å; V2405-L2410 HydrophobicContact CG1-CG 3.82Å
2406	D	68.4	Low	62.3	Low	92.2 Å²	92.2	108.8 Å²	108.8	49%	0.493	61%	0.611	S	S	.	*			trans	-55.5	134.6	-176.1	-84.3	-28.8	0	0	0	110	I2404 A2408 T2409 L2410 K3003 R3007	I2404-D2406 VanDerWaalsContact C-N 3.27Å; I2404-D2406 PolarHBondContact O-N 3.01Å; D2406-A2408 HydrophobicContact CB-CB 4.43Å; D2406-A2408 CarbonylContact O-C 3.56Å; D2406-A2408 PolarHBondContact O-N 2.96Å; D2406-A2408 VanDerWaalsContact O-N 3.09Å; D2406-T2409 HydrophobicContact CB-CG2 4.3Å; D2406-T2409 PolarHBondContact N-OG1 2.9Å; D2406-T2409 WeakPolarHBondContact O-CA 3.33Å; D2406-T2409 WeakPolarHBondContact O-CB 3.39Å; D2406-T2409 PolarHBondContact O-N 3.19Å; D2406-T2409 PolarHBondContact O-OG1 3.27Å; D2406-L2410 PolarHBondContact O-N 3.15Å; D2406-L2410 VanDerWaalsContact O-N 3.09Å; D2406-K3003 IonicContact OD1-NZ 2.96Å; D2406-K3003 PolarHBondContact OD1-NZ 3.38Å; D2406-K3003 WeakPolarHBondContact OD2-CD 3.38Å; D2406-K3003 WeakPolarHBondContact OD2-CE 3.41Å; D2406-K3003 IonicContact OD2-NZ 2.72Å; D2406-K3003 PolarHBondContact OD2-NZ 2.72Å; D2406-R3007 VanDerWaalsContact CG-NH2 3.31Å; D2406-R3007 IonicContact OD2-CZ 2.67Å; D2406-R3007 IonicContact OD2-NH2 3.37Å; D2406-R3007 PolarHBondContact OD2-NH2 3.47Å
2407	E	75.7	Confident	64.6	Low	140.8 Å²	140.8	105.9 Å²	105.9	66%	0.658	59%	0.594	S	S	*	*	H	α-helix	trans	-56.7	-31	-177.1	-174.7	156.1	-167.2	0	0	111.9	V2405 T2409 L2410 A2411 R2414	V2405-E2407 PolarHBondContact O-N 3.26Å; E2407-T2409 VanDerWaalsContact C-N 3.31Å; E2407-T2409 PolarHBondContact O-N 3.24Å; E2407-L2410 PolarHBondContact O-N 3.23Å; E2407-A2411 VanDerWaalsContact O-CB 3.28Å; E2407-A2411 WeakPolarHBondContact O-CB 3.36Å; E2407-A2411 PolarHBondContact O-N 3.27Å; E2407-R2414 IonicContact OE1-CZ 2.98Å; E2407-R2414 VanDerWaalsContact OE1-CZ 3.3Å; E2407-R2414 IonicContact OE1-NH1 2.65Å; E2407-R2414 PolarHBondContact OE1-NH1 2.76Å; E2407-R2414 IonicContact OE1-NH2 2.75Å; E2407-R2414 PolarHBondContact OE1-NH2 3.33Å; E2407-R2414 IonicContact OE2-NH2 3.27Å
2408	A	75.9	Confident	67.3	Low	61.8 Å²	61.8	105.6 Å²	105.6	51%	0.511	57%	0.574	S	S	.	*	H	α-helix	trans	-60.4	-34.9	171.9	0	0	0	0	0	113.8	D2406 L2410 A2411 L2412	D2406-A2408 HydrophobicContact CB-CB 4.43Å; D2406-A2408 CarbonylContact O-C 3.56Å; D2406-A2408 PolarHBondContact O-N 2.96Å; D2406-A2408 VanDerWaalsContact O-N 3.09Å; A2408-L2410 PolarHBondContact O-N 3.2Å; A2408-A2411 PolarHBondContact O-N 3.45Å; A2408-L2412 WeakPolarHBondContact O-CB 3.28Å; A2408-L2412 WeakPolarHBondContact O-CD1 3.48Å; A2408-L2412 PolarHBondContact O-N 3.13Å; A2408-L2412 VanDerWaalsContact O-N 3.09Å
2409	T	76.4	Confident	69.6	Low	62.6 Å²	62.6	103.5 Å²	103.5	38%	0.384	55%	0.553	S	S	.	*	H	α-helix	trans	-75.9	-38.7	176.6	59.1	0	0	0	0	111.9	V2405 D2406 E2407 A2411 L2412 D2413 R3007	V2405-T2409 VanDerWaalsContact CG1-OG1 3.28Å; V2405-T2409 WeakPolarHBondContact CG1-OG1 3.42Å; D2406-T2409 HydrophobicContact CB-CG2 4.3Å; D2406-T2409 PolarHBondContact N-OG1 2.9Å; D2406-T2409 WeakPolarHBondContact O-CA 3.33Å; D2406-T2409 WeakPolarHBondContact O-CB 3.39Å; D2406-T2409 PolarHBondContact O-N 3.19Å; D2406-T2409 PolarHBondContact O-OG1 3.27Å; E2407-T2409 VanDerWaalsContact C-N 3.31Å; E2407-T2409 PolarHBondContact O-N 3.24Å; T2409-A2411 VanDerWaalsContact C-N 3.34Å; T2409-L2412 WeakPolarHBondContact O-CB 3.35Å; T2409-L2412 PolarHBondContact O-N 3.13Å; T2409-D2413 WeakPolarHBondContact O-CB 3.38Å; T2409-D2413 PolarHBondContact O-N 2.98Å; T2409-D2413 VanDerWaalsContact O-N 3.11Å; T2409-R3007 HydrophobicContact CG2-CG 4.03Å
2410	L	80.3	Confident	72.3	Confident	84.4 Å²	84.4	95.4 Å²	95.4	44%	0.442	53%	0.53	S	S	.	.	H	α-helix	trans	-66.3	-38.6	172.7	-80.9	169.4	0	0	0	111.9	V2405 D2406 E2407 A2408 L2412 D2413 R2414	V2405-L2410 HydrophobicContact CB-CD1 4.28Å; V2405-L2410 HydrophobicContact CB-CG 4.42Å; V2405-L2410 HydrophobicContact CG1-CB 4.23Å; V2405-L2410 HydrophobicContact CG1-CD1 4.18Å; V2405-L2410 HydrophobicContact CG1-CD2 4.2Å; V2405-L2410 HydrophobicContact CG1-CG 3.82Å; D2406-L2410 PolarHBondContact O-N 3.15Å; D2406-L2410 VanDerWaalsContact O-N 3.09Å; E2407-L2410 PolarHBondContact O-N 3.23Å; A2408-L2410 PolarHBondContact O-N 3.2Å; L2410-L2412 VanDerWaalsContact C-N 3.29Å; L2410-L2412 PolarHBondContact O-N 3.39Å; L2410-D2413 PolarHBondContact O-N 3.32Å; L2410-R2414 WeakPolarHBondContact O-CB 3.34Å; L2410-R2414 WeakPolarHBondContact O-CD 3.17Å; L2410-R2414 VanDerWaalsContact O-CG 3.27Å; L2410-R2414 WeakPolarHBondContact O-CG 3.38Å; L2410-R2414 PolarHBondContact O-N 3.23Å
2411	A	81.5	Confident	74.8	Confident	50 Å²	50	90.4 Å²	90.4	41%	0.413	51%	0.512	S	S	.	.	H	α-helix	trans	-65.6	-38.8	174.2	0	0	0	0	0	112.1	E2407 A2408 T2409 R2414 A2415	E2407-A2411 VanDerWaalsContact O-CB 3.28Å; E2407-A2411 WeakPolarHBondContact O-CB 3.36Å; E2407-A2411 PolarHBondContact O-N 3.27Å; A2408-A2411 PolarHBondContact O-N 3.45Å; T2409-A2411 VanDerWaalsContact C-N 3.34Å; A2411-R2414 PolarHBondContact O-N 2.95Å; A2411-A2415 VanDerWaalsContact O-CB 3.27Å; A2411-A2415 WeakPolarHBondContact O-CB 3.32Å; A2411-A2415 PolarHBondContact O-N 3.08Å
2412	L	83.7	Confident	77.5	Confident	83.8 Å²	83.8	87.7 Å²	87.7	44%	0.439	50%	0.498	S	S	.	.	H	α-helix	trans	-67.5	-42.9	175.6	-163.6	65.6	0	0	0	111.9	A2408 T2409 L2410 R2414 A2415 V2416 R3007 A3010	A2408-L2412 WeakPolarHBondContact O-CB 3.28Å; A2408-L2412 WeakPolarHBondContact O-CD1 3.48Å; A2408-L2412 PolarHBondContact O-N 3.13Å; A2408-L2412 VanDerWaalsContact O-N 3.09Å; T2409-L2412 WeakPolarHBondContact O-CB 3.35Å; T2409-L2412 PolarHBondContact O-N 3.13Å; L2410-L2412 VanDerWaalsContact C-N 3.29Å; L2410-L2412 PolarHBondContact O-N 3.39Å; L2412-R2414 VanDerWaalsContact C-N 3.32Å; L2412-R2414 PolarHBondContact O-N 2.92Å; L2412-A2415 CarbonylContact O-C 3.58Å; L2412-A2415 PolarHBondContact O-N 3.29Å; L2412-A2415 VanDerWaalsContact O-N 3.11Å; L2412-V2416 HydrophobicContact CD1-CG2 4.31Å; L2412-V2416 HydrophobicContact CG-CG2 4.47Å; L2412-V2416 WeakPolarHBondContact O-CB 3.31Å; L2412-V2416 VanDerWaalsContact O-CG2 3.32Å; L2412-V2416 WeakPolarHBondContact O-CG2 3.4Å; L2412-V2416 PolarHBondContact O-N 3.09Å; L2412-R3007 HydrophobicContact CD2-CB 3.97Å; L2412-R3007 HydrophobicContact CD2-CG 4.11Å; L2412-R3007 WeakPolarHBondContact CD2-O 3.49Å; L2412-A3010 HydrophobicContact CD2-CB 3.72Å; L2412-A3010 HydrophobicContact CG-CB 3.8Å
2413	D	85.8	Confident	79.9	Confident	95 Å²	95	85.1 Å²	85.1	51%	0.508	48%	0.479	S	S	.	.	H	α-helix	trans	-66.5	-39	177.3	-131.6	34.1	0	0	0	111.8	T2409 L2410 A2415 V2416 T2417	T2409-D2413 WeakPolarHBondContact O-CB 3.38Å; T2409-D2413 PolarHBondContact O-N 2.98Å; T2409-D2413 VanDerWaalsContact O-N 3.11Å; L2410-D2413 PolarHBondContact O-N 3.32Å; D2413-A2415 VanDerWaalsContact C-N 3.32Å; D2413-A2415 PolarHBondContact O-N 3.35Å; D2413-V2416 PolarHBondContact O-N 3.12Å; D2413-T2417 VanDerWaalsContact O-CB 3.32Å; D2413-T2417 WeakPolarHBondContact O-CB 3.26Å; D2413-T2417 WeakPolarHBondContact O-CG2 3.43Å; D2413-T2417 PolarHBondContact O-N 3.11Å; D2413-T2417 PolarHBondContact O-OG1 3.08Å
2414	R	86.3	Confident	82	Confident	166 Å²	166	83.8 Å²	83.8	63%	0.626	47%	0.466	S	S	*	.	H	α-helix	trans	-59.4	-45.3	168.8	-88.9	175.1	-173.9	160.8	1.3	111.8	E2407 L2410 A2411 L2412 V2416 T2417 E2418	E2407-R2414 IonicContact OE1-CZ 2.98Å; E2407-R2414 VanDerWaalsContact OE1-CZ 3.3Å; E2407-R2414 IonicContact OE1-NH1 2.65Å; E2407-R2414 PolarHBondContact OE1-NH1 2.76Å; E2407-R2414 IonicContact OE1-NH2 2.75Å; E2407-R2414 PolarHBondContact OE1-NH2 3.33Å; E2407-R2414 IonicContact OE2-NH2 3.27Å; L2410-R2414 WeakPolarHBondContact O-CB 3.34Å; L2410-R2414 WeakPolarHBondContact O-CD 3.17Å; L2410-R2414 VanDerWaalsContact O-CG 3.27Å; L2410-R2414 WeakPolarHBondContact O-CG 3.38Å; L2410-R2414 PolarHBondContact O-N 3.23Å; A2411-R2414 PolarHBondContact O-N 2.95Å; L2412-R2414 VanDerWaalsContact C-N 3.32Å; L2412-R2414 PolarHBondContact O-N 2.92Å; R2414-V2416 VanDerWaalsContact C-N 3.31Å; R2414-V2416 PolarHBondContact O-N 3.43Å; R2414-T2417 WeakPolarHBondContact CA-OG1 3.37Å; R2414-T2417 PolarHBondContact O-N 3.3Å; R2414-T2417 PolarHBondContact O-OG1 3.08Å; R2414-T2417 VanDerWaalsContact O-OG1 3.11Å; R2414-E2418 VanDerWaalsContact O-CB 3.24Å; R2414-E2418 WeakPolarHBondContact O-CB 3.44Å; R2414-E2418 PolarHBondContact O-N 3.18Å
2415	A	85.8	Confident	84	Confident	41.8 Å²	41.8	80.3 Å²	80.3	35%	0.345	45%	0.454	S	S	.	.	H	α-helix	trans	-66.8	-35.3	179.1	0	0	0	0	0	112.9	A2411 L2412 D2413 S2419	A2411-A2415 VanDerWaalsContact O-CB 3.27Å; A2411-A2415 WeakPolarHBondContact O-CB 3.32Å; A2411-A2415 PolarHBondContact O-N 3.08Å; L2412-A2415 CarbonylContact O-C 3.58Å; L2412-A2415 PolarHBondContact O-N 3.29Å; L2412-A2415 VanDerWaalsContact O-N 3.11Å; D2413-A2415 VanDerWaalsContact C-N 3.32Å; D2413-A2415 PolarHBondContact O-N 3.35Å; A2415-S2419 VanDerWaalsContact O-CB 3.26Å; A2415-S2419 WeakPolarHBondContact O-CB 3.33Å; A2415-S2419 PolarHBondContact O-N 3.16Å; A2415-S2419 PolarHBondContact O-OG 2.99Å
2416	V	89.3	Confident	85.6	Confident	55.4 Å²	55.4	79 Å²	79	34%	0.336	44%	0.444	S	S	.	.	H	α-helix	trans	-65.9	-48.1	172.2	169.7	0	0	0	0	110.4	L2412 D2413 R2414 E2418 S2419 T2420 A3010 A3014	L2412-V2416 HydrophobicContact CD1-CG2 4.31Å; L2412-V2416 HydrophobicContact CG-CG2 4.47Å; L2412-V2416 WeakPolarHBondContact O-CB 3.31Å; L2412-V2416 VanDerWaalsContact O-CG2 3.32Å; L2412-V2416 WeakPolarHBondContact O-CG2 3.4Å; L2412-V2416 PolarHBondContact O-N 3.09Å; D2413-V2416 PolarHBondContact O-N 3.12Å; R2414-V2416 VanDerWaalsContact C-N 3.31Å; R2414-V2416 PolarHBondContact O-N 3.43Å; V2416-E2418 PolarHBondContact O-N 3.19Å; V2416-S2419 CarbonylContact O-C 3.55Å; V2416-S2419 WeakPolarHBondContact O-CA 3.43Å; V2416-S2419 WeakPolarHBondContact O-CB 3.32Å; V2416-S2419 PolarHBondContact O-N 3.24Å; V2416-S2419 VanDerWaalsContact O-N 3.11Å; V2416-T2420 WeakPolarHBondContact O-CG2 3.39Å; V2416-T2420 PolarHBondContact O-N 3.04Å; V2416-T2420 PolarHBondContact O-OG1 3.12Å; V2416-A3010 HydrophobicContact CG2-CB 4.14Å; V2416-A3010 VanDerWaalsContact CG2-O 3.31Å; V2416-A3010 WeakPolarHBondContact CG2-O 3.45Å; V2416-A3014 HydrophobicContact CG2-CB 4.07Å
2417	T	89.2	Confident	86.7	Confident	79.6 Å²	79.6	77.6 Å²	77.6	49%	0.488	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-38	179.4	13.1	0	0	0	0	112.9	D2413 R2414 S2419 T2420 A2421	D2413-T2417 VanDerWaalsContact O-CB 3.32Å; D2413-T2417 WeakPolarHBondContact O-CB 3.26Å; D2413-T2417 WeakPolarHBondContact O-CG2 3.43Å; D2413-T2417 PolarHBondContact O-N 3.11Å; D2413-T2417 PolarHBondContact O-OG1 3.08Å; R2414-T2417 WeakPolarHBondContact CA-OG1 3.37Å; R2414-T2417 PolarHBondContact O-N 3.3Å; R2414-T2417 PolarHBondContact O-OG1 3.08Å; R2414-T2417 VanDerWaalsContact O-OG1 3.11Å; T2417-S2419 VanDerWaalsContact C-N 3.31Å; T2417-S2419 PolarHBondContact O-N 3.06Å; T2417-T2420 VanDerWaalsContact C-OG1 3.3Å; T2417-T2420 VanDerWaalsContact CA-OG1 3.28Å; T2417-T2420 WeakPolarHBondContact CA-OG1 3.38Å; T2417-T2420 PolarHBondContact O-N 3.17Å; T2417-T2420 PolarHBondContact O-OG1 2.98Å; T2417-T2420 VanDerWaalsContact O-OG1 3.05Å; T2417-A2421 VanDerWaalsContact O-CB 3.32Å; T2417-A2421 WeakPolarHBondContact O-CB 3.27Å; T2417-A2421 PolarHBondContact O-N 3.2Å
2418	E	89.5	Confident	87.5	Confident	99 Å²	99	73.8 Å²	73.8	46%	0.463	43%	0.429	S	S	.	.	H	α-helix	trans	-66.4	-37.4	172.7	-164.2	-163.6	160.1	0	0	111.2	R2414 V2416 T2420 A2421 K2422	R2414-E2418 VanDerWaalsContact O-CB 3.24Å; R2414-E2418 WeakPolarHBondContact O-CB 3.44Å; R2414-E2418 PolarHBondContact O-N 3.18Å; V2416-E2418 PolarHBondContact O-N 3.19Å; E2418-T2420 VanDerWaalsContact C-N 3.31Å; E2418-T2420 PolarHBondContact O-N 3.45Å; E2418-A2421 PolarHBondContact O-N 3.19Å; E2418-K2422 VanDerWaalsContact CD-CE 3.41Å; E2418-K2422 HydrophobicContact CG-CD 4.43Å; E2418-K2422 WeakPolarHBondContact O-CB 3.41Å; E2418-K2422 WeakPolarHBondContact O-CD 3.39Å; E2418-K2422 VanDerWaalsContact O-CG 3.27Å; E2418-K2422 WeakPolarHBondContact O-CG 3.38Å; E2418-K2422 PolarHBondContact O-N 3.18Å; E2418-K2422 WeakPolarHBondContact OE1-CE 3.34Å; E2418-K2422 IonicContact OE1-NZ 3.1Å; E2418-K2422 PolarHBondContact OE1-NZ 3.21Å; E2418-K2422 IonicContact OE2-NZ 3.65Å; E2418-K2422 PolarHBondContact OE2-NZ 3.4Å
2419	S	86.8	Confident	88.3	Confident	51 Å²	51	75.8 Å²	75.8	36%	0.357	43%	0.428	S	S	.	.	H	α-helix	trans	-69.7	-35.6	176.9	-61.7	0	0	0	0	112.8	A2415 V2416 T2417 K2422 L2423	A2415-S2419 VanDerWaalsContact O-CB 3.26Å; A2415-S2419 WeakPolarHBondContact O-CB 3.33Å; A2415-S2419 PolarHBondContact O-N 3.16Å; A2415-S2419 PolarHBondContact O-OG 2.99Å; V2416-S2419 CarbonylContact O-C 3.55Å; V2416-S2419 WeakPolarHBondContact O-CA 3.43Å; V2416-S2419 WeakPolarHBondContact O-CB 3.32Å; V2416-S2419 PolarHBondContact O-N 3.24Å; V2416-S2419 VanDerWaalsContact O-N 3.11Å; T2417-S2419 VanDerWaalsContact C-N 3.31Å; T2417-S2419 PolarHBondContact O-N 3.06Å; S2419-K2422 PolarHBondContact O-N 3.18Å; S2419-L2423 VanDerWaalsContact O-CB 3.26Å; S2419-L2423 WeakPolarHBondContact O-CB 3.39Å; S2419-L2423 PolarHBondContact O-N 3.28Å; S2419-L2423 VanDerWaalsContact O-N 3.14Å
2420	T	90.3	Very high	89.1	Confident	60.4 Å²	60.4	75 Å²	75	37%	0.371	42%	0.421	S	S	.	.	H	α-helix	trans	-69.6	-44.2	172	51.9	0	0	0	0	111.2	V2416 T2417 E2418 K2422 L2423 D2424	V2416-T2420 WeakPolarHBondContact O-CG2 3.39Å; V2416-T2420 PolarHBondContact O-N 3.04Å; V2416-T2420 PolarHBondContact O-OG1 3.12Å; T2417-T2420 VanDerWaalsContact C-OG1 3.3Å; T2417-T2420 VanDerWaalsContact CA-OG1 3.28Å; T2417-T2420 WeakPolarHBondContact CA-OG1 3.38Å; T2417-T2420 PolarHBondContact O-N 3.17Å; T2417-T2420 PolarHBondContact O-OG1 2.98Å; T2417-T2420 VanDerWaalsContact O-OG1 3.05Å; E2418-T2420 VanDerWaalsContact C-N 3.31Å; E2418-T2420 PolarHBondContact O-N 3.45Å; T2420-K2422 VanDerWaalsContact C-N 3.31Å; T2420-K2422 PolarHBondContact O-N 3.22Å; T2420-L2423 CarbonylContact O-C 3.58Å; T2420-L2423 WeakPolarHBondContact O-CA 3.26Å; T2420-L2423 WeakPolarHBondContact O-CB 3.28Å; T2420-L2423 PolarHBondContact O-N 3.13Å; T2420-L2423 VanDerWaalsContact O-N 3.14Å; T2420-D2424 WeakPolarHBondContact O-CB 3.35Å; T2420-D2424 VanDerWaalsContact O-CG 3.28Å; T2420-D2424 PolarHBondContact O-N 3.15Å; T2420-D2424 VanDerWaalsContact O-OD2 3.13Å
2421	A	91.1	Very high	89.6	Confident	60.8 Å²	60.8	75.4 Å²	75.4	50%	0.502	43%	0.426	S	S	.	.	H	α-helix	trans	-59.8	-39.4	176	0	0	0	0	0	112.7	T2417 E2418 D2424 S2425	T2417-A2421 VanDerWaalsContact O-CB 3.32Å; T2417-A2421 WeakPolarHBondContact O-CB 3.27Å; T2417-A2421 PolarHBondContact O-N 3.2Å; E2418-A2421 PolarHBondContact O-N 3.19Å; A2421-D2424 PolarHBondContact O-N 2.95Å; A2421-S2425 WeakPolarHBondContact O-CB 3.29Å; A2421-S2425 PolarHBondContact O-N 3.21Å
2422	K	92.3	Very high	90.2	Very high	108.2 Å²	108.2	76.6 Å²	76.6	47%	0.47	43%	0.432	S	S	.	.	H	α-helix	trans	-64	-43.4	172.1	-75.5	169.1	-179	170.2	0	112.1	E2418 S2419 T2420 D2424 S2425 I2426	E2418-K2422 VanDerWaalsContact CD-CE 3.41Å; E2418-K2422 HydrophobicContact CG-CD 4.43Å; E2418-K2422 WeakPolarHBondContact O-CB 3.41Å; E2418-K2422 WeakPolarHBondContact O-CD 3.39Å; E2418-K2422 VanDerWaalsContact O-CG 3.27Å; E2418-K2422 WeakPolarHBondContact O-CG 3.38Å; E2418-K2422 PolarHBondContact O-N 3.18Å; E2418-K2422 WeakPolarHBondContact OE1-CE 3.34Å; E2418-K2422 IonicContact OE1-NZ 3.1Å; E2418-K2422 PolarHBondContact OE1-NZ 3.21Å; E2418-K2422 IonicContact OE2-NZ 3.65Å; E2418-K2422 PolarHBondContact OE2-NZ 3.4Å; S2419-K2422 PolarHBondContact O-N 3.18Å; T2420-K2422 VanDerWaalsContact C-N 3.31Å; T2420-K2422 PolarHBondContact O-N 3.22Å; K2422-D2424 VanDerWaalsContact C-N 3.3Å; K2422-D2424 PolarHBondContact O-N 3.45Å; K2422-S2425 PolarHBondContact O-N 3.26Å; K2422-I2426 WeakPolarHBondContact O-CB 3.37Å; K2422-I2426 VanDerWaalsContact O-CD1 3.31Å; K2422-I2426 WeakPolarHBondContact O-CD1 3.29Å; K2422-I2426 VanDerWaalsContact O-CG1 3.28Å; K2422-I2426 WeakPolarHBondContact O-CG1 3.4Å; K2422-I2426 PolarHBondContact O-N 3.13Å
2423	L	91.5	Very high	90.6	Very high	61 Å²	61	75.4 Å²	75.4	32%	0.319	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-42.2	176.8	178.9	59.9	0	0	0	111.7	S2419 T2420 S2425 I2426 N2427 A3020 A3021 A3024	S2419-L2423 VanDerWaalsContact O-CB 3.26Å; S2419-L2423 WeakPolarHBondContact O-CB 3.39Å; S2419-L2423 PolarHBondContact O-N 3.28Å; S2419-L2423 VanDerWaalsContact O-N 3.14Å; T2420-L2423 CarbonylContact O-C 3.58Å; T2420-L2423 WeakPolarHBondContact O-CA 3.26Å; T2420-L2423 WeakPolarHBondContact O-CB 3.28Å; T2420-L2423 PolarHBondContact O-N 3.13Å; T2420-L2423 VanDerWaalsContact O-N 3.14Å; L2423-S2425 VanDerWaalsContact C-N 3.34Å; L2423-S2425 PolarHBondContact O-N 3.22Å; L2423-I2426 CarbonylContact O-C 3.56Å; L2423-I2426 WeakPolarHBondContact O-CB 3.42Å; L2423-I2426 PolarHBondContact O-N 3.1Å; L2423-I2426 VanDerWaalsContact O-N 3.15Å; L2423-N2427 WeakPolarHBondContact O-CB 3.19Å; L2423-N2427 VanDerWaalsContact O-CG 3.27Å; L2423-N2427 PolarHBondContact O-N 3.14Å; L2423-N2427 PolarHBondContact O-ND2 2.98Å; L2423-N2427 PolarHBondContact O-OD1 3.25Å; L2423-A3020 HydrophobicContact CD1-CB 3.99Å; L2423-A3020 HydrophobicContact CD2-CB 3.84Å; L2423-A3021 HydrophobicContact CD1-CB 4.39Å; L2423-A3024 HydrophobicContact CD1-CB 4.28Å
2424	D	91.9	Very high	91	Very high	86.6 Å²	86.6	77.7 Å²	77.7	46%	0.463	43%	0.429	S	S	.	.	H	α-helix	trans	-72.1	-34.7	-179.9	-67.6	-31.3	0	0	0	112.4	Q2376 T2420 A2421 K2422 I2426 N2427 A2428	Q2376-D2424 PolarHBondContact NE2-OD1 2.93Å; Q2376-D2424 PolarHBondContact NE2-OD2 3.31Å; T2420-D2424 WeakPolarHBondContact O-CB 3.35Å; T2420-D2424 VanDerWaalsContact O-CG 3.28Å; T2420-D2424 PolarHBondContact O-N 3.15Å; T2420-D2424 VanDerWaalsContact O-OD2 3.13Å; A2421-D2424 PolarHBondContact O-N 2.95Å; K2422-D2424 VanDerWaalsContact C-N 3.3Å; K2422-D2424 PolarHBondContact O-N 3.45Å; D2424-I2426 VanDerWaalsContact C-N 3.32Å; D2424-I2426 PolarHBondContact O-N 2.8Å; D2424-N2427 PolarHBondContact O-N 2.86Å; D2424-N2427 PolarHBondContact OD1-ND2 3.15Å; D2424-A2428 WeakPolarHBondContact O-CB 3.44Å; D2424-A2428 PolarHBondContact O-N 3.11Å
2425	S	92.8	Very high	91.3	Very high	62.8 Å²	62.8	72.8 Å²	72.8	44%	0.439	42%	0.42	S	S	.	.	H	α-helix	trans	-60.6	-42.5	168.3	-176.1	0	0	0	0	112.3	A2421 K2422 L2423 N2427 A2428 Q2429	A2421-S2425 WeakPolarHBondContact O-CB 3.29Å; A2421-S2425 PolarHBondContact O-N 3.21Å; K2422-S2425 PolarHBondContact O-N 3.26Å; L2423-S2425 VanDerWaalsContact C-N 3.34Å; L2423-S2425 PolarHBondContact O-N 3.22Å; S2425-N2427 VanDerWaalsContact C-N 3.33Å; S2425-N2427 PolarHBondContact O-N 3.19Å; S2425-A2428 WeakPolarHBondContact O-CB 3.48Å; S2425-A2428 PolarHBondContact O-N 3.17Å; S2425-A2428 VanDerWaalsContact O-N 3.12Å; S2425-Q2429 VanDerWaalsContact O-CG 3.28Å; S2425-Q2429 WeakPolarHBondContact O-CG 3.34Å; S2425-Q2429 PolarHBondContact O-N 3.31Å; S2425-Q2429 VanDerWaalsContact O-N 3.12Å; S2425-Q2429 PolarHBondContact O-NE2 3.04Å; S2425-Q2429 PolarHBondContact OG-NE2 2.85Å
2426	I	92.7	Very high	91.7	Very high	56.4 Å²	56.4	75.2 Å²	75.2	29%	0.289	43%	0.425	S	S	.	.	H	α-helix	trans	-67.9	-40	175.9	-66.6	162	0	0	0	110.7	K2422 L2423 D2424 A2428 Q2429 I2430 A3021 A3024 R3025	K2422-I2426 WeakPolarHBondContact O-CB 3.37Å; K2422-I2426 VanDerWaalsContact O-CD1 3.31Å; K2422-I2426 WeakPolarHBondContact O-CD1 3.29Å; K2422-I2426 VanDerWaalsContact O-CG1 3.28Å; K2422-I2426 WeakPolarHBondContact O-CG1 3.4Å; K2422-I2426 PolarHBondContact O-N 3.13Å; L2423-I2426 CarbonylContact O-C 3.56Å; L2423-I2426 WeakPolarHBondContact O-CB 3.42Å; L2423-I2426 PolarHBondContact O-N 3.1Å; L2423-I2426 VanDerWaalsContact O-N 3.15Å; D2424-I2426 VanDerWaalsContact C-N 3.32Å; D2424-I2426 PolarHBondContact O-N 2.8Å; I2426-A2428 VanDerWaalsContact C-N 3.32Å; I2426-A2428 PolarHBondContact O-N 3.01Å; I2426-Q2429 WeakPolarHBondContact O-CB 3.36Å; I2426-Q2429 PolarHBondContact O-N 3.03Å; I2426-I2430 HydrophobicContact CG2-CD1 3.91Å; I2426-I2430 HydrophobicContact CG2-CG1 4.39Å; I2426-I2430 WeakPolarHBondContact O-CB 3.35Å; I2426-I2430 VanDerWaalsContact O-CG1 3.28Å; I2426-I2430 WeakPolarHBondContact O-CG1 3.4Å; I2426-I2430 PolarHBondContact O-N 3.02Å; I2426-A3021 HydrophobicContact CD1-CB 4.01Å; I2426-A3024 HydrophobicContact CB-CB 4.44Å; I2426-A3024 HydrophobicContact CG2-CB 3.59Å; I2426-R3025 HydrophobicContact CD1-CG 4.06Å; I2426-R3025 HydrophobicContact CG2-CG 4.49Å
2427	N	92.3	Very high	91.7	Very high	61.2 Å²	61.2	74 Å²	74	33%	0.327	42%	0.421	S	S	.	.	H	α-helix	trans	-61.2	-41	175.2	-70.5	-34	0	0	0	111.6	L2423 D2424 S2425 Q2429 I2430 V2431	L2423-N2427 WeakPolarHBondContact O-CB 3.19Å; L2423-N2427 VanDerWaalsContact O-CG 3.27Å; L2423-N2427 PolarHBondContact O-N 3.14Å; L2423-N2427 PolarHBondContact O-ND2 2.98Å; L2423-N2427 PolarHBondContact O-OD1 3.25Å; D2424-N2427 PolarHBondContact O-N 2.86Å; D2424-N2427 PolarHBondContact OD1-ND2 3.15Å; S2425-N2427 VanDerWaalsContact C-N 3.33Å; S2425-N2427 PolarHBondContact O-N 3.19Å; N2427-Q2429 VanDerWaalsContact C-N 3.32Å; N2427-Q2429 PolarHBondContact O-N 2.95Å; N2427-I2430 WeakPolarHBondContact O-CB 3.44Å; N2427-I2430 PolarHBondContact O-N 3.07Å; N2427-V2431 WeakPolarHBondContact O-CG2 3.38Å; N2427-V2431 PolarHBondContact O-N 3.09Å
2428	A	92	Very high	91.9	Very high	62.4 Å²	62.4	76.8 Å²	76.8	52%	0.516	43%	0.428	S	S	.	.	H	α-helix	trans	-63.3	-42.5	175.1	0	0	0	0	0	112.3	D2424 S2425 I2426 I2430 V2431 S2432	D2424-A2428 WeakPolarHBondContact O-CB 3.44Å; D2424-A2428 PolarHBondContact O-N 3.11Å; S2425-A2428 WeakPolarHBondContact O-CB 3.48Å; S2425-A2428 PolarHBondContact O-N 3.17Å; S2425-A2428 VanDerWaalsContact O-N 3.12Å; I2426-A2428 VanDerWaalsContact C-N 3.32Å; I2426-A2428 PolarHBondContact O-N 3.01Å; A2428-I2430 VanDerWaalsContact C-N 3.34Å; A2428-I2430 PolarHBondContact O-N 3.18Å; A2428-V2431 PolarHBondContact O-N 3.05Å; A2428-V2431 VanDerWaalsContact O-N 3.13Å; A2428-S2432 PolarHBondContact O-N 3.04Å; A2428-S2432 VanDerWaalsContact O-N 3.13Å
2429	Q	93.4	Very high	92.1	Very high	103.6 Å²	103.6	77.4 Å²	77.4	48%	0.484	43%	0.431	S	S	.	.	H	α-helix	trans	-62.7	-41.3	173.8	-68.6	172.4	33.5	0	0	111.9	S2425 I2426 N2427 V2431 S2432 V2433	S2425-Q2429 VanDerWaalsContact O-CG 3.28Å; S2425-Q2429 WeakPolarHBondContact O-CG 3.34Å; S2425-Q2429 PolarHBondContact O-N 3.31Å; S2425-Q2429 VanDerWaalsContact O-N 3.12Å; S2425-Q2429 PolarHBondContact O-NE2 3.04Å; S2425-Q2429 PolarHBondContact OG-NE2 2.85Å; I2426-Q2429 WeakPolarHBondContact O-CB 3.36Å; I2426-Q2429 PolarHBondContact O-N 3.03Å; N2427-Q2429 VanDerWaalsContact C-N 3.32Å; N2427-Q2429 PolarHBondContact O-N 2.95Å; Q2429-V2431 VanDerWaalsContact C-N 3.3Å; Q2429-V2431 PolarHBondContact O-N 3.06Å; Q2429-S2432 WeakPolarHBondContact O-CB 3.32Å; Q2429-S2432 PolarHBondContact O-N 3.07Å; Q2429-S2432 VanDerWaalsContact O-N 3.12Å; Q2429-V2433 WeakPolarHBondContact O-CB 3.41Å; Q2429-V2433 WeakPolarHBondContact O-CG2 3.41Å; Q2429-V2433 PolarHBondContact O-N 3.17Å
2430	I	91.6	Very high	92.5	Very high	45.4 Å²	45.4	77.4 Å²	77.4	23%	0.233	43%	0.427	C	S	.	.	H	α-helix	trans	-61.2	-37.5	175.1	-72.5	167.8	0	0	0	111.6	I2426 N2427 A2428 S2432 V2433 R2434 A3024 R3028 L3031	I2426-I2430 HydrophobicContact CG2-CD1 3.91Å; I2426-I2430 HydrophobicContact CG2-CG1 4.39Å; I2426-I2430 WeakPolarHBondContact O-CB 3.35Å; I2426-I2430 VanDerWaalsContact O-CG1 3.28Å; I2426-I2430 WeakPolarHBondContact O-CG1 3.4Å; I2426-I2430 PolarHBondContact O-N 3.02Å; N2427-I2430 WeakPolarHBondContact O-CB 3.44Å; N2427-I2430 PolarHBondContact O-N 3.07Å; A2428-I2430 VanDerWaalsContact C-N 3.34Å; A2428-I2430 PolarHBondContact O-N 3.18Å; I2430-S2432 VanDerWaalsContact C-N 3.34Å; I2430-S2432 PolarHBondContact O-N 3.34Å; I2430-V2433 PolarHBondContact O-N 3.32Å; I2430-R2434 HydrophobicContact CG2-CG 4.33Å; I2430-R2434 WeakPolarHBondContact O-CB 3.36Å; I2430-R2434 WeakPolarHBondContact O-CD 3.37Å; I2430-R2434 VanDerWaalsContact O-CG 3.29Å; I2430-R2434 WeakPolarHBondContact O-CG 3.36Å; I2430-R2434 PolarHBondContact O-N 3.17Å; I2430-R2434 VanDerWaalsContact O-N 3.11Å; I2430-A3024 HydrophobicContact CD1-CB 3.84Å; I2430-A3024 WeakPolarHBondContact CD1-O 3.43Å; I2430-R3028 HydrophobicContact CG1-CB 3.94Å; I2430-L3031 HydrophobicContact CG2-CD1 3.84Å
2431	V	92.5	Very high	92.6	Very high	93.2 Å²	93.2	79.4 Å²	79.4	57%	0.565	43%	0.432	S	S	*	.	H	α-helix	trans	-66.6	-44.8	174.4	171.8	0	0	0	0	111	N2427 A2428 Q2429 V2433 R2434 S2435	N2427-V2431 WeakPolarHBondContact O-CG2 3.38Å; N2427-V2431 PolarHBondContact O-N 3.09Å; A2428-V2431 PolarHBondContact O-N 3.05Å; A2428-V2431 VanDerWaalsContact O-N 3.13Å; Q2429-V2431 VanDerWaalsContact C-N 3.3Å; Q2429-V2431 PolarHBondContact O-N 3.06Å; V2431-V2433 PolarHBondContact O-N 3.02Å; V2431-R2434 WeakPolarHBondContact O-CB 3.27Å; V2431-R2434 PolarHBondContact O-N 2.96Å; V2431-R2434 VanDerWaalsContact O-N 3.12Å; V2431-S2435 PolarHBondContact O-N 3.01Å; V2431-S2435 VanDerWaalsContact O-N 3.13Å; V2431-S2435 PolarHBondContact O-OG 3.07Å
2432	S	92.6	Very high	92.6	Very high	74.8 Å²	74.8	79.6 Å²	79.6	52%	0.523	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-45.1	177.6	-171.3	0	0	0	0	112.8	A2428 Q2429 I2430 R2434 S2435 E2436	A2428-S2432 PolarHBondContact O-N 3.04Å; A2428-S2432 VanDerWaalsContact O-N 3.13Å; Q2429-S2432 WeakPolarHBondContact O-CB 3.32Å; Q2429-S2432 PolarHBondContact O-N 3.07Å; Q2429-S2432 VanDerWaalsContact O-N 3.12Å; I2430-S2432 VanDerWaalsContact C-N 3.34Å; I2430-S2432 PolarHBondContact O-N 3.34Å; S2432-R2434 VanDerWaalsContact C-N 3.28Å; S2432-R2434 PolarHBondContact O-N 3.25Å; S2432-S2435 WeakPolarHBondContact CA-OG 3.33Å; S2432-S2435 PolarHBondContact O-N 3Å; S2432-S2435 VanDerWaalsContact O-N 3.14Å; S2432-S2435 PolarHBondContact O-OG 3.35Å; S2432-E2436 PolarHBondContact O-N 3.1Å; S2432-E2436 VanDerWaalsContact O-N 3.1Å
2433	V	93.2	Very high	92.7	Very high	59.6 Å²	59.6	78.1 Å²	78.1	36%	0.361	42%	0.424	S	S	.	.	H	α-helix	trans	-68.4	-29.6	177.5	174.8	0	0	0	0	111.6	Q2429 I2430 V2431 E2436 A2437 L3031 E3032 V3035	Q2429-V2433 WeakPolarHBondContact O-CB 3.41Å; Q2429-V2433 WeakPolarHBondContact O-CG2 3.41Å; Q2429-V2433 PolarHBondContact O-N 3.17Å; I2430-V2433 PolarHBondContact O-N 3.32Å; V2431-V2433 PolarHBondContact O-N 3.02Å; V2433-E2436 PolarHBondContact O-N 3.46Å; V2433-A2437 VanDerWaalsContact O-CB 3.27Å; V2433-A2437 WeakPolarHBondContact O-CB 3.34Å; V2433-A2437 PolarHBondContact O-N 3.08Å; V2433-A2437 VanDerWaalsContact O-N 3.07Å; V2433-L3031 HydrophobicContact CG1-CB 3.75Å; V2433-E3032 HydrophobicContact CG1-CG 4.14Å; V2433-E3032 HydrophobicContact CG2-CG 4.32Å; V2433-V3035 HydrophobicContact CG1-CG2 3.88Å
2434	R	93.3	Very high	92.8	Very high	142.4 Å²	142.4	77.9 Å²	77.9	54%	0.537	42%	0.423	S	S	.	.	H	α-helix	trans	-69.6	-39	172.6	-77.5	171.2	-178.3	178	3	112.6	I2430 V2431 S2432 A2437 Q2438 E3027 L3031	I2430-R2434 HydrophobicContact CG2-CG 4.33Å; I2430-R2434 WeakPolarHBondContact O-CB 3.36Å; I2430-R2434 WeakPolarHBondContact O-CD 3.37Å; I2430-R2434 VanDerWaalsContact O-CG 3.29Å; I2430-R2434 WeakPolarHBondContact O-CG 3.36Å; I2430-R2434 PolarHBondContact O-N 3.17Å; I2430-R2434 VanDerWaalsContact O-N 3.11Å; V2431-R2434 WeakPolarHBondContact O-CB 3.27Å; V2431-R2434 PolarHBondContact O-N 2.96Å; V2431-R2434 VanDerWaalsContact O-N 3.12Å; S2432-R2434 VanDerWaalsContact C-N 3.28Å; S2432-R2434 PolarHBondContact O-N 3.25Å; R2434-A2437 PolarHBondContact O-N 3.09Å; R2434-Q2438 WeakPolarHBondContact O-CG 3.38Å; R2434-Q2438 PolarHBondContact O-N 3.16Å; R2434-Q2438 VanDerWaalsContact O-N 3.1Å; R2434-E3027 IonicContact CZ-OE1 3.24Å; R2434-E3027 IonicContact NE-OE1 3.65Å; R2434-E3027 PolarHBondContact NE-OE1 3.09Å; R2434-E3027 IonicContact NH2-OE1 2.79Å; R2434-E3027 PolarHBondContact NH2-OE1 2.87Å; R2434-E3027 IonicContact NH2-OE2 3.47Å; R2434-E3027 PolarHBondContact NH2-OE2 2.99Å; R2434-L3031 HydrophobicContact CG-CD1 3.85Å; R2434-L3031 HydrophobicContact CG-CD2 4.16Å
2435	S	93.4	Very high	92.8	Very high	63 Å²	63	77.7 Å²	77.7	44%	0.441	42%	0.422	S	S	.	.	H	α-helix	trans	-66.7	-41.7	174.4	35.6	0	0	0	0	111.9	V2431 S2432 A2437 Q2438 E2439	V2431-S2435 PolarHBondContact O-N 3.01Å; V2431-S2435 VanDerWaalsContact O-N 3.13Å; V2431-S2435 PolarHBondContact O-OG 3.07Å; S2432-S2435 WeakPolarHBondContact CA-OG 3.33Å; S2432-S2435 PolarHBondContact O-N 3Å; S2432-S2435 VanDerWaalsContact O-N 3.14Å; S2432-S2435 PolarHBondContact O-OG 3.35Å; S2435-A2437 VanDerWaalsContact C-N 3.33Å; S2435-A2437 PolarHBondContact O-N 3.31Å; S2435-Q2438 PolarHBondContact O-N 3.11Å; S2435-Q2438 VanDerWaalsContact O-N 3.13Å; S2435-E2439 PolarHBondContact O-N 3.15Å
2436	E	93.4	Very high	92.8	Very high	92.4 Å²	92.4	78 Å²	78	43%	0.432	42%	0.424	S	S	.	.	H	α-helix	trans	-60.1	-43.5	173.4	-173.2	-175.9	179.5	0	0	111.6	S2432 V2433 Q2438 E2439 L2440 V3035 K3039	S2432-E2436 PolarHBondContact O-N 3.1Å; S2432-E2436 VanDerWaalsContact O-N 3.1Å; V2433-E2436 PolarHBondContact O-N 3.46Å; E2436-Q2438 VanDerWaalsContact C-N 3.33Å; E2436-Q2438 PolarHBondContact O-N 2.97Å; E2436-E2439 PolarHBondContact O-N 3.02Å; E2436-L2440 HydrophobicContact CG-CD1 4.24Å; E2436-L2440 WeakPolarHBondContact O-CB 3.2Å; E2436-L2440 VanDerWaalsContact O-CG 3.3Å; E2436-L2440 WeakPolarHBondContact O-CG 3.34Å; E2436-L2440 PolarHBondContact O-N 3.15Å; E2436-V3035 HydrophobicContact CG-CG1 4.13Å; E2436-V3035 HydrophobicContact CG-CG2 4.37Å; E2436-K3039 WeakPolarHBondContact OE1-CE 3.42Å; E2436-K3039 IonicContact OE1-NZ 2.79Å; E2436-K3039 PolarHBondContact OE1-NZ 3.48Å
2437	A	90.6	Very high	92.7	Very high	31 Å²	31	78.6 Å²	78.6	26%	0.256	43%	0.427	S	S	.	.	H	α-helix	trans	-62.4	-40.3	176	0	0	0	0	0	112.8	V2433 R2434 S2435 L2440 E2441 V3035 L3038	V2433-A2437 VanDerWaalsContact O-CB 3.27Å; V2433-A2437 WeakPolarHBondContact O-CB 3.34Å; V2433-A2437 PolarHBondContact O-N 3.08Å; V2433-A2437 VanDerWaalsContact O-N 3.07Å; R2434-A2437 PolarHBondContact O-N 3.09Å; S2435-A2437 VanDerWaalsContact C-N 3.33Å; S2435-A2437 PolarHBondContact O-N 3.31Å; A2437-L2440 PolarHBondContact O-N 3.1Å; A2437-E2441 WeakPolarHBondContact O-CB 3.44Å; A2437-E2441 WeakPolarHBondContact O-CG 3.31Å; A2437-E2441 PolarHBondContact O-N 3.29Å; A2437-V3035 HydrophobicContact CB-CG2 3.93Å; A2437-L3038 HydrophobicContact CB-CD1 4.1Å
2438	Q	92.7	Very high	92.7	Very high	137 Å²	137	80.8 Å²	80.8	64%	0.64	43%	0.434	S	S	*	.	H	α-helix	trans	-68.2	-36.4	176.1	-74.8	-178.1	-37.5	0	0	112.5	R2434 S2435 E2436 E2441 S2442	R2434-Q2438 WeakPolarHBondContact O-CG 3.38Å; R2434-Q2438 PolarHBondContact O-N 3.16Å; R2434-Q2438 VanDerWaalsContact O-N 3.1Å; S2435-Q2438 PolarHBondContact O-N 3.11Å; S2435-Q2438 VanDerWaalsContact O-N 3.13Å; E2436-Q2438 VanDerWaalsContact C-N 3.33Å; E2436-Q2438 PolarHBondContact O-N 2.97Å; Q2438-E2441 PolarHBondContact O-N 3.09Å; Q2438-S2442 PolarHBondContact O-N 3.13Å; Q2438-S2442 VanDerWaalsContact O-N 3.08Å
2439	E	93.6	Very high	92.6	Very high	111.6 Å²	111.6	80.2 Å²	80.2	52%	0.521	43%	0.426	S	S	.	.	H	α-helix	trans	-64.7	-47.1	173.5	-163.8	-169.2	146.9	0	0	110.9	S2435 E2436 E2441 S2442 Q2443	S2435-E2439 PolarHBondContact O-N 3.15Å; E2436-E2439 PolarHBondContact O-N 3.02Å; E2439-E2441 VanDerWaalsContact C-N 3.32Å; E2439-E2441 PolarHBondContact O-N 3.1Å; E2439-S2442 WeakPolarHBondContact O-CA 3.37Å; E2439-S2442 WeakPolarHBondContact O-CB 3.41Å; E2439-S2442 PolarHBondContact O-N 3.06Å; E2439-S2442 VanDerWaalsContact O-N 3.16Å; E2439-S2442 PolarHBondContact O-OG 3.08Å; E2439-Q2443 VanDerWaalsContact O-CG 3.29Å; E2439-Q2443 WeakPolarHBondContact O-CG 3.39Å; E2439-Q2443 PolarHBondContact O-N 3.12Å; E2439-Q2443 PolarHBondContact OE1-NE2 3.31Å
2440	L	94.4	Very high	92.5	Very high	51.2 Å²	51.2	79 Å²	79	27%	0.268	42%	0.42	S	S	.	.	H	α-helix	trans	-61.2	-38.3	176.2	-69.9	170.2	0	0	0	112.1	E2436 A2437 S2442 Q2443 I2444 V3035 L3038 K3039	E2436-L2440 HydrophobicContact CG-CD1 4.24Å; E2436-L2440 WeakPolarHBondContact O-CB 3.2Å; E2436-L2440 VanDerWaalsContact O-CG 3.3Å; E2436-L2440 WeakPolarHBondContact O-CG 3.34Å; E2436-L2440 PolarHBondContact O-N 3.15Å; A2437-L2440 PolarHBondContact O-N 3.1Å; L2440-S2442 VanDerWaalsContact C-N 3.31Å; L2440-S2442 PolarHBondContact O-N 3.19Å; L2440-Q2443 PolarHBondContact O-N 2.92Å; L2440-I2444 VanDerWaalsContact O-CB 3.31Å; L2440-I2444 WeakPolarHBondContact O-CB 3.36Å; L2440-I2444 WeakPolarHBondContact O-CD1 3.37Å; L2440-I2444 VanDerWaalsContact O-CG1 3.27Å; L2440-I2444 WeakPolarHBondContact O-CG1 3.39Å; L2440-I2444 PolarHBondContact O-N 3.18Å; L2440-V3035 HydrophobicContact CD1-CG1 3.9Å; L2440-L3038 HydrophobicContact CB-CB 4Å; L2440-L3038 HydrophobicContact CB-CD1 4.24Å; L2440-L3038 HydrophobicContact CD1-CB 4.09Å; L2440-K3039 HydrophobicContact CD1-CD 4.46Å; L2440-K3039 HydrophobicContact CD1-CG 3.71Å; L2440-K3039 HydrophobicContact CD2-CG 4Å
2441	E	92.7	Very high	92.2	Very high	103.2 Å²	103.2	80.7 Å²	80.7	48%	0.482	43%	0.43	S	S	.	.	H	α-helix	trans	-63.7	-38.4	172.7	-78	-178.2	-178.2	0	0	112.5	A2437 Q2438 E2439 I2444 N2445 R3034 L3038	A2437-E2441 WeakPolarHBondContact O-CB 3.44Å; A2437-E2441 WeakPolarHBondContact O-CG 3.31Å; A2437-E2441 PolarHBondContact O-N 3.29Å; Q2438-E2441 PolarHBondContact O-N 3.09Å; E2439-E2441 VanDerWaalsContact C-N 3.32Å; E2439-E2441 PolarHBondContact O-N 3.1Å; E2441-I2444 PolarHBondContact O-N 3.1Å; E2441-N2445 WeakPolarHBondContact O-CB 3.25Å; E2441-N2445 VanDerWaalsContact O-CG 3.28Å; E2441-N2445 PolarHBondContact O-N 3.23Å; E2441-N2445 PolarHBondContact O-ND2 3.04Å; E2441-N2445 VanDerWaalsContact O-ND2 3.11Å; E2441-R3034 VanDerWaalsContact CD-NH2 3.31Å; E2441-R3034 IonicContact OE1-CZ 3.6Å; E2441-R3034 IonicContact OE1-NE 2.72Å; E2441-R3034 PolarHBondContact OE1-NE 3.46Å; E2441-R3034 IonicContact OE1-NH2 2.7Å; E2441-R3034 PolarHBondContact OE1-NH2 2.82Å; E2441-R3034 IonicContact OE2-NH2 3.49Å; E2441-R3034 PolarHBondContact OE2-NH2 3.32Å; E2441-R3034 VanDerWaalsContact OE2-NH2 3.12Å; E2441-L3038 HydrophobicContact CG-CD1 3.84Å; E2441-L3038 HydrophobicContact CG-CD2 3.59Å; E2441-L3038 HydrophobicContact CG-CG 4.37Å
2442	S	92.7	Very high	91.9	Very high	64.2 Å²	64.2	79.8 Å²	79.8	45%	0.449	43%	0.427	S	S	.	.	H	α-helix	trans	-67.3	-42.3	175.7	81.6	0	0	0	0	112	Q2438 E2439 L2440 I2444 N2445 S2446	Q2438-S2442 PolarHBondContact O-N 3.13Å; Q2438-S2442 VanDerWaalsContact O-N 3.08Å; E2439-S2442 WeakPolarHBondContact O-CA 3.37Å; E2439-S2442 WeakPolarHBondContact O-CB 3.41Å; E2439-S2442 PolarHBondContact O-N 3.06Å; E2439-S2442 VanDerWaalsContact O-N 3.16Å; E2439-S2442 PolarHBondContact O-OG 3.08Å; L2440-S2442 VanDerWaalsContact C-N 3.31Å; L2440-S2442 PolarHBondContact O-N 3.19Å; S2442-I2444 VanDerWaalsContact C-N 3.32Å; S2442-I2444 PolarHBondContact O-N 3.35Å; S2442-N2445 PolarHBondContact O-N 2.94Å; S2442-N2445 VanDerWaalsContact O-N 3.16Å; S2442-S2446 WeakPolarHBondContact O-CB 3.46Å; S2442-S2446 PolarHBondContact O-N 3Å
2443	Q	94.4	Very high	91.6	Very high	77.8 Å²	77.8	82 Å²	82	36%	0.364	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-45.2	174.2	-66.7	177.8	15.5	0	0	111.2	E2439 L2440 N2445 S2446 L2447 F3042	E2439-Q2443 VanDerWaalsContact O-CG 3.29Å; E2439-Q2443 WeakPolarHBondContact O-CG 3.39Å; E2439-Q2443 PolarHBondContact O-N 3.12Å; E2439-Q2443 PolarHBondContact OE1-NE2 3.31Å; L2440-Q2443 PolarHBondContact O-N 2.92Å; Q2443-N2445 VanDerWaalsContact C-N 3.31Å; Q2443-N2445 PolarHBondContact O-N 3.28Å; Q2443-S2446 WeakPolarHBondContact O-CB 3.35Å; Q2443-S2446 PolarHBondContact O-N 3.12Å; Q2443-S2446 VanDerWaalsContact O-N 3.07Å; Q2443-L2447 WeakPolarHBondContact O-CB 3.25Å; Q2443-L2447 WeakPolarHBondContact O-CG 3.32Å; Q2443-L2447 PolarHBondContact O-N 3.16Å; Q2443-F3042 HydrophobicContact CB-CD2 4.03Å; Q2443-F3042 HydrophobicContact CB-CE2 3.9Å; Q2443-F3042 VanDerWaalsContact OE1-CE2 3.28Å
2444	I	92.1	Very high	91.1	Very high	55.6 Å²	55.6	84.5 Å²	84.5	29%	0.285	43%	0.431	S	S	.	.	H	α-helix	trans	-60.5	-39	175.8	-78.1	164.5	0	0	0	111.7	L2440 E2441 S2442 L2447 K2448 L3038 Q3041 F3042 R3045	L2440-I2444 VanDerWaalsContact O-CB 3.31Å; L2440-I2444 WeakPolarHBondContact O-CB 3.36Å; L2440-I2444 WeakPolarHBondContact O-CD1 3.37Å; L2440-I2444 VanDerWaalsContact O-CG1 3.27Å; L2440-I2444 WeakPolarHBondContact O-CG1 3.39Å; L2440-I2444 PolarHBondContact O-N 3.18Å; E2441-I2444 PolarHBondContact O-N 3.1Å; S2442-I2444 VanDerWaalsContact C-N 3.32Å; S2442-I2444 PolarHBondContact O-N 3.35Å; I2444-L2447 PolarHBondContact O-N 2.93Å; I2444-K2448 HydrophobicContact CG2-CD 4.2Å; I2444-K2448 VanDerWaalsContact CG2-CE 3.43Å; I2444-K2448 WeakPolarHBondContact O-CB 3.34Å; I2444-K2448 VanDerWaalsContact O-CG 3.26Å; I2444-K2448 WeakPolarHBondContact O-CG 3.41Å; I2444-K2448 PolarHBondContact O-N 2.84Å; I2444-L3038 HydrophobicContact CD1-CB 4.01Å; I2444-L3038 HydrophobicContact CD1-CD2 3.61Å; I2444-L3038 HydrophobicContact CD1-CG 4.43Å; I2444-L3038 WeakPolarHBondContact CD1-O 3.44Å; I2444-Q3041 HydrophobicContact CD1-CB 3.94Å; I2444-Q3041 HydrophobicContact CG1-CB 4.47Å; I2444-F3042 HydrophobicContact CD1-CB 4.5Å; I2444-F3042 HydrophobicContact CG1-CB 4.29Å; I2444-R3045 PolarHBondContact O-NH1 2.61Å; I2444-R3045 VanDerWaalsContact O-NH1 3.07Å
2445	N	91.8	Very high	90.5	Very high	83 Å²	83	82.8 Å²	82.8	44%	0.444	43%	0.429	S	S	.	.	H	α-helix	trans	-74.1	-34.4	177.7	-71	-33.2	0	0	0	112.4	E2441 S2442 Q2443 K2448 S2449	E2441-N2445 WeakPolarHBondContact O-CB 3.25Å; E2441-N2445 VanDerWaalsContact O-CG 3.28Å; E2441-N2445 PolarHBondContact O-N 3.23Å; E2441-N2445 PolarHBondContact O-ND2 3.04Å; E2441-N2445 VanDerWaalsContact O-ND2 3.11Å; S2442-N2445 PolarHBondContact O-N 2.94Å; S2442-N2445 VanDerWaalsContact O-N 3.16Å; Q2443-N2445 VanDerWaalsContact C-N 3.31Å; Q2443-N2445 PolarHBondContact O-N 3.28Å; N2445-K2448 WeakPolarHBondContact O-CB 3.43Å; N2445-K2448 PolarHBondContact O-N 3.26Å; N2445-K2448 PolarHBondContact OD1-NZ 3.21Å; N2445-K2448 VanDerWaalsContact OD1-NZ 3.11Å; N2445-S2449 PolarHBondContact O-N 3.08Å; N2445-S2449 VanDerWaalsContact O-N 3.1Å
2446	S	93	Very high	89.8	Confident	68.8 Å²	68.8	84.1 Å²	84.1	48%	0.481	43%	0.429	S	S	.	.	H	α-helix	trans	-60	-52.7	170.1	-172.3	0	0	0	0	111.2	S2442 Q2443 K2448 S2449 E2450	S2442-S2446 WeakPolarHBondContact O-CB 3.46Å; S2442-S2446 PolarHBondContact O-N 3Å; Q2443-S2446 WeakPolarHBondContact O-CB 3.35Å; Q2443-S2446 PolarHBondContact O-N 3.12Å; Q2443-S2446 VanDerWaalsContact O-N 3.07Å; S2446-K2448 VanDerWaalsContact C-N 3.3Å; S2446-K2448 PolarHBondContact O-N 2.93Å; S2446-S2449 WeakPolarHBondContact O-CA 3.36Å; S2446-S2449 WeakPolarHBondContact O-CB 3.35Å; S2446-S2449 PolarHBondContact O-N 2.92Å; S2446-S2449 VanDerWaalsContact O-N 3.09Å; S2446-S2449 PolarHBondContact O-OG 3.24Å; S2446-E2450 PolarHBondContact O-N 3.05Å; S2446-E2450 VanDerWaalsContact O-N 3.07Å
2447	L	91.7	Very high	89.1	Confident	69.8 Å²	69.8	84.2 Å²	84.2	37%	0.365	43%	0.431	S	S	.	.	H	α-helix	trans	-61.7	-35	177.9	-68.9	172.9	0	0	0	113	Q2443 I2444 S2449 E2450 L2451 F3042 R3045 I3049	Q2443-L2447 WeakPolarHBondContact O-CB 3.25Å; Q2443-L2447 WeakPolarHBondContact O-CG 3.32Å; Q2443-L2447 PolarHBondContact O-N 3.16Å; I2444-L2447 PolarHBondContact O-N 2.93Å; L2447-S2449 VanDerWaalsContact C-N 3.3Å; L2447-S2449 PolarHBondContact O-N 3.13Å; L2447-E2450 CarbonylContact O-C 3.57Å; L2447-E2450 WeakPolarHBondContact O-CA 3.36Å; L2447-E2450 WeakPolarHBondContact O-CB 3.37Å; L2447-E2450 PolarHBondContact O-N 3.17Å; L2447-L2451 VanDerWaalsContact O-CB 3.28Å; L2447-L2451 WeakPolarHBondContact O-CB 3.4Å; L2447-L2451 WeakPolarHBondContact O-CG 3.34Å; L2447-L2451 PolarHBondContact O-N 3.16Å; L2447-F3042 HydrophobicContact CD1-CD2 3.43Å; L2447-F3042 VanDerWaalsContact CD1-CD2 3.43Å; L2447-F3042 HydrophobicContact CD1-CE2 3.58Å; L2447-F3042 HydrophobicContact CD1-CG 4.28Å; L2447-F3042 HydrophobicContact CG-CE2 4.45Å; L2447-R3045 HydrophobicContact CB-CB 4.31Å; L2447-R3045 HydrophobicContact CD1-CB 4.18Å; L2447-I3049 HydrophobicContact CB-CD1 4.3Å; L2447-I3049 HydrophobicContact CD2-CD1 3.61Å
2448	K	92.5	Very high	88.4	Confident	107.4 Å²	107.4	85.8 Å²	85.8	47%	0.467	44%	0.437	S	S	.	.	H	α-helix	trans	-63.2	-40.6	171	-76.2	171	-170.5	163.4	0	111.8	I2444 N2445 S2446 E2450 L2451 S2452	I2444-K2448 HydrophobicContact CG2-CD 4.2Å; I2444-K2448 VanDerWaalsContact CG2-CE 3.43Å; I2444-K2448 WeakPolarHBondContact O-CB 3.34Å; I2444-K2448 VanDerWaalsContact O-CG 3.26Å; I2444-K2448 WeakPolarHBondContact O-CG 3.41Å; I2444-K2448 PolarHBondContact O-N 2.84Å; N2445-K2448 WeakPolarHBondContact O-CB 3.43Å; N2445-K2448 PolarHBondContact O-N 3.26Å; N2445-K2448 PolarHBondContact OD1-NZ 3.21Å; N2445-K2448 VanDerWaalsContact OD1-NZ 3.11Å; S2446-K2448 VanDerWaalsContact C-N 3.3Å; S2446-K2448 PolarHBondContact O-N 2.93Å; K2448-E2450 VanDerWaalsContact C-N 3.31Å; K2448-E2450 PolarHBondContact O-N 3.25Å; K2448-L2451 PolarHBondContact O-N 3.24Å; K2448-S2452 VanDerWaalsContact O-CB 3.31Å; K2448-S2452 WeakPolarHBondContact O-CB 3.31Å; K2448-S2452 PolarHBondContact O-N 3.14Å; K2448-S2452 VanDerWaalsContact O-N 3.16Å; K2448-S2452 PolarHBondContact O-OG 3.37Å
2449	S	90.1	Very high	87.4	Confident	50.2 Å²	50.2	84.6 Å²	84.6	35%	0.351	44%	0.435	S	S	.	.	H	α-helix	trans	-65.9	-33.7	176.8	86.4	0	0	0	0	112	N2445 S2446 L2447 S2452 K2453	N2445-S2449 PolarHBondContact O-N 3.08Å; N2445-S2449 VanDerWaalsContact O-N 3.1Å; S2446-S2449 WeakPolarHBondContact O-CA 3.36Å; S2446-S2449 WeakPolarHBondContact O-CB 3.35Å; S2446-S2449 PolarHBondContact O-N 2.92Å; S2446-S2449 VanDerWaalsContact O-N 3.09Å; S2446-S2449 PolarHBondContact O-OG 3.24Å; L2447-S2449 VanDerWaalsContact C-N 3.3Å; L2447-S2449 PolarHBondContact O-N 3.13Å; S2449-S2452 WeakPolarHBondContact O-CB 3.26Å; S2449-S2452 PolarHBondContact O-N 3.29Å; S2449-K2453 VanDerWaalsContact C-NZ 3.33Å; S2449-K2453 VanDerWaalsContact O-CE 3.23Å; S2449-K2453 WeakPolarHBondContact O-CE 2.95Å; S2449-K2453 WeakPolarHBondContact O-CG 3.4Å; S2449-K2453 PolarHBondContact O-N 3.06Å; S2449-K2453 VanDerWaalsContact O-N 3.09Å; S2449-K2453 PolarHBondContact O-NZ 2.79Å; S2449-K2453 PolarHBondContact OG-NZ 3.06Å
2450	E	90	Very high	86	Confident	77.2 Å²	77.2	87.3 Å²	87.3	36%	0.361	44%	0.441	S	S	.	.	H	α-helix	trans	-74.5	-45.5	176.9	-145.5	-175.5	165.5	0	0	111.7	S2446 L2447 K2448 S2452 K2453 Y2454 I3049	S2446-E2450 PolarHBondContact O-N 3.05Å; S2446-E2450 VanDerWaalsContact O-N 3.07Å; L2447-E2450 CarbonylContact O-C 3.57Å; L2447-E2450 WeakPolarHBondContact O-CA 3.36Å; L2447-E2450 WeakPolarHBondContact O-CB 3.37Å; L2447-E2450 PolarHBondContact O-N 3.17Å; K2448-E2450 VanDerWaalsContact C-N 3.31Å; K2448-E2450 PolarHBondContact O-N 3.25Å; E2450-S2452 VanDerWaalsContact C-N 3.27Å; E2450-S2452 PolarHBondContact O-N 3.13Å; E2450-K2453 CarbonylContact O-C 3.58Å; E2450-K2453 WeakPolarHBondContact O-CA 3.45Å; E2450-K2453 WeakPolarHBondContact O-CB 3.41Å; E2450-K2453 PolarHBondContact O-N 3.08Å; E2450-Y2454 HydrophobicContact CB-CE2 4.42Å; E2450-Y2454 HydrophobicContact CG-CD2 4.12Å; E2450-Y2454 HydrophobicContact CG-CE2 3.69Å; E2450-Y2454 VanDerWaalsContact O-CD2 3.25Å; E2450-Y2454 WeakPolarHBondContact O-CD2 3.36Å; E2450-Y2454 PolarHBondContact O-N 3.01Å; E2450-Y2454 VanDerWaalsContact O-N 3.1Å; E2450-Y2454 WeakPolarHBondContact OE1-CE2 3.4Å; E2450-Y2454 VanDerWaalsContact OE1-CZ 3.3Å; E2450-Y2454 PolarHBondContact OE1-OH 3.33Å; E2450-I3049 HydrophobicContact CB-CD1 3.79Å; E2450-I3049 WeakPolarHBondContact OE2-CD1 3.44Å
2451	L	85.8	Confident	84	Confident	81.8 Å²	81.8	87.2 Å²	87.2	43%	0.428	45%	0.452	S	S	.	.	H	α-helix	trans	-57.6	-38.1	171.8	-138.6	156.9	0	0	0	111.7	L2447 K2448 K2453 Y2454 Q2455 R3045 L3048 I3049	L2447-L2451 VanDerWaalsContact O-CB 3.28Å; L2447-L2451 WeakPolarHBondContact O-CB 3.4Å; L2447-L2451 WeakPolarHBondContact O-CG 3.34Å; L2447-L2451 PolarHBondContact O-N 3.16Å; K2448-L2451 PolarHBondContact O-N 3.24Å; L2451-K2453 VanDerWaalsContact C-N 3.31Å; L2451-K2453 PolarHBondContact O-N 3.31Å; L2451-Y2454 PolarHBondContact O-N 3.02Å; L2451-Q2455 HydrophobicContact CD2-CB 4.48Å; L2451-Q2455 VanDerWaalsContact O-CB 3.29Å; L2451-Q2455 WeakPolarHBondContact O-CB 3.36Å; L2451-Q2455 PolarHBondContact O-N 3.28Å; L2451-R3045 HydrophobicContact CD1-CB 4Å; L2451-R3045 HydrophobicContact CD1-CG 3.95Å; L2451-L3048 HydrophobicContact CD2-CB 3.96Å; L2451-I3049 HydrophobicContact CD1-CG1 4.44Å; L2451-I3049 HydrophobicContact CD2-CG1 3.54Å; L2451-I3049 HydrophobicContact CG-CD1 4.15Å; L2451-I3049 HydrophobicContact CG-CG1 3.64Å
2452	S	86.4	Confident	81.8	Confident	73.6 Å²	73.6	85.5 Å²	85.5	52%	0.515	45%	0.452	S	S	.	.	H	α-helix	trans	-63.7	-38.8	173.7	-154.3	0	0	0	0	112.6	K2448 S2449 E2450 Q2455 E2456	K2448-S2452 VanDerWaalsContact O-CB 3.31Å; K2448-S2452 WeakPolarHBondContact O-CB 3.31Å; K2448-S2452 PolarHBondContact O-N 3.14Å; K2448-S2452 VanDerWaalsContact O-N 3.16Å; K2448-S2452 PolarHBondContact O-OG 3.37Å; S2449-S2452 WeakPolarHBondContact O-CB 3.26Å; S2449-S2452 PolarHBondContact O-N 3.29Å; E2450-S2452 VanDerWaalsContact C-N 3.27Å; E2450-S2452 PolarHBondContact O-N 3.13Å; S2452-Q2455 PolarHBondContact O-N 3.05Å; S2452-E2456 WeakPolarHBondContact O-CB 3.4Å; S2452-E2456 PolarHBondContact O-N 3.04Å
2453	K	86.1	Confident	79.6	Confident	122 Å²	122	87.2 Å²	87.2	53%	0.53	46%	0.461	S	S	.	.	H	α-helix	trans	-65.5	-45.1	174.1	-66.2	165.3	-170.5	157.8	0	111.1	S2449 E2450 L2451 Q2455 E2456 I2457	S2449-K2453 VanDerWaalsContact C-NZ 3.33Å; S2449-K2453 VanDerWaalsContact O-CE 3.23Å; S2449-K2453 WeakPolarHBondContact O-CE 2.95Å; S2449-K2453 WeakPolarHBondContact O-CG 3.4Å; S2449-K2453 PolarHBondContact O-N 3.06Å; S2449-K2453 VanDerWaalsContact O-N 3.09Å; S2449-K2453 PolarHBondContact O-NZ 2.79Å; S2449-K2453 PolarHBondContact OG-NZ 3.06Å; E2450-K2453 CarbonylContact O-C 3.58Å; E2450-K2453 WeakPolarHBondContact O-CA 3.45Å; E2450-K2453 WeakPolarHBondContact O-CB 3.41Å; E2450-K2453 PolarHBondContact O-N 3.08Å; L2451-K2453 VanDerWaalsContact C-N 3.31Å; L2451-K2453 PolarHBondContact O-N 3.31Å; K2453-Q2455 VanDerWaalsContact C-N 3.35Å; K2453-Q2455 PolarHBondContact O-N 3.06Å; K2453-E2456 CarbonylContact O-C 3.59Å; K2453-E2456 WeakPolarHBondContact O-CB 3.29Å; K2453-E2456 PolarHBondContact O-N 3.16Å; K2453-I2457 WeakPolarHBondContact O-CB 3.45Å; K2453-I2457 WeakPolarHBondContact O-CD1 3.3Å; K2453-I2457 VanDerWaalsContact O-CG1 3.26Å; K2453-I2457 WeakPolarHBondContact O-CG1 3.34Å; K2453-I2457 PolarHBondContact O-N 3.09Å
2454	Y	82.3	Confident	77.1	Confident	112.2 Å²	112.2	88.4 Å²	88.4	44%	0.44	47%	0.474	S	S	.	.	H	α-helix	trans	-64.4	-39.9	175.8	-72.8	-62.5	0	0	0	112.1	E2450 L2451 E2456 I2457 V2458 I3049 W3052 L3056	E2450-Y2454 HydrophobicContact CB-CE2 4.42Å; E2450-Y2454 HydrophobicContact CG-CD2 4.12Å; E2450-Y2454 HydrophobicContact CG-CE2 3.69Å; E2450-Y2454 VanDerWaalsContact O-CD2 3.25Å; E2450-Y2454 WeakPolarHBondContact O-CD2 3.36Å; E2450-Y2454 PolarHBondContact O-N 3.01Å; E2450-Y2454 VanDerWaalsContact O-N 3.1Å; E2450-Y2454 WeakPolarHBondContact OE1-CE2 3.4Å; E2450-Y2454 VanDerWaalsContact OE1-CZ 3.3Å; E2450-Y2454 PolarHBondContact OE1-OH 3.33Å; L2451-Y2454 PolarHBondContact O-N 3.02Å; Y2454-E2456 VanDerWaalsContact C-N 3.31Å; Y2454-E2456 PolarHBondContact O-N 3Å; Y2454-I2457 HydrophobicContact CD1-CD1 4.28Å; Y2454-I2457 CarbonylContact O-C 3.58Å; Y2454-I2457 WeakPolarHBondContact O-CA 3.47Å; Y2454-I2457 WeakPolarHBondContact O-CB 3.42Å; Y2454-I2457 PolarHBondContact O-N 3.18Å; Y2454-V2458 WeakPolarHBondContact O-CB 3.43Å; Y2454-V2458 VanDerWaalsContact O-CG2 3.3Å; Y2454-V2458 WeakPolarHBondContact O-CG2 3.47Å; Y2454-V2458 PolarHBondContact O-N 3.12Å; Y2454-I3049 HydrophobicContact CD2-CG2 4.31Å; Y2454-I3049 HydrophobicContact CE2-CG2 3.76Å; Y2454-W3052 WeakPolarHBondContact O-CZ3 3.33Å; Y2454-L3056 HydrophobicContact CD1-CD1 3.66Å; Y2454-L3056 HydrophobicContact CE1-CD1 4.18Å
2455	Q	80.3	Confident	74.6	Confident	106.6 Å²	106.6	92.3 Å²	92.3	50%	0.498	49%	0.494	S	S	.	.	H	α-helix	trans	-62.8	-39.5	174.3	-170.1	135.8	13.6	0	0	111.6	L2451 S2452 K2453 V2458 N2459 W3052	L2451-Q2455 HydrophobicContact CD2-CB 4.48Å; L2451-Q2455 VanDerWaalsContact O-CB 3.29Å; L2451-Q2455 WeakPolarHBondContact O-CB 3.36Å; L2451-Q2455 PolarHBondContact O-N 3.28Å; S2452-Q2455 PolarHBondContact O-N 3.05Å; K2453-Q2455 VanDerWaalsContact C-N 3.35Å; K2453-Q2455 PolarHBondContact O-N 3.06Å; Q2455-V2458 PolarHBondContact O-N 3.09Å; Q2455-N2459 PolarHBondContact NE2-OD1 2.72Å; Q2455-N2459 VanDerWaalsContact NE2-OD1 3.16Å; Q2455-N2459 WeakPolarHBondContact O-CB 3.33Å; Q2455-N2459 PolarHBondContact O-N 3.24Å; Q2455-N2459 PolarHBondContact O-ND2 3.13Å; Q2455-N2459 VanDerWaalsContact O-ND2 3.11Å; Q2455-N2459 PolarHBondContact O-OD1 2.89Å; Q2455-W3052 VanDerWaalsContact CA-CZ3 3.43Å; Q2455-W3052 HydrophobicContact CB-CH2 4.08Å; Q2455-W3052 HydrophobicContact CB-CZ3 4.2Å; Q2455-W3052 HydrophobicContact CG-CH2 4.12Å
2456	E	79.2	Confident	72	Confident	90 Å²	90	92.4 Å²	92.4	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-65.5	-40.7	173.4	-170.8	177.1	-172.2	0	0	112.2	S2452 K2453 Y2454 V2458 N2459 R2460	S2452-E2456 WeakPolarHBondContact O-CB 3.4Å; S2452-E2456 PolarHBondContact O-N 3.04Å; K2453-E2456 CarbonylContact O-C 3.59Å; K2453-E2456 WeakPolarHBondContact O-CB 3.29Å; K2453-E2456 PolarHBondContact O-N 3.16Å; Y2454-E2456 VanDerWaalsContact C-N 3.31Å; Y2454-E2456 PolarHBondContact O-N 3Å; E2456-V2458 VanDerWaalsContact C-N 3.31Å; E2456-V2458 PolarHBondContact O-N 3.3Å; E2456-N2459 PolarHBondContact O-N 2.95Å; E2456-R2460 VanDerWaalsContact CD-CZ 3.47Å; E2456-R2460 HydrophobicContact CG-CG 4.24Å; E2456-R2460 VanDerWaalsContact CG-NE 3.34Å; E2456-R2460 VanDerWaalsContact O-CB 3.29Å; E2456-R2460 WeakPolarHBondContact O-CB 3.49Å; E2456-R2460 VanDerWaalsContact O-CG 3.27Å; E2456-R2460 WeakPolarHBondContact O-CG 3.4Å; E2456-R2460 PolarHBondContact O-N 3.24Å; E2456-R2460 VanDerWaalsContact O-N 3.13Å; E2456-R2460 IonicContact OE1-CZ 3.11Å; E2456-R2460 IonicContact OE1-NE 3.17Å; E2456-R2460 PolarHBondContact OE1-NE 2.88Å; E2456-R2460 VanDerWaalsContact OE1-NE 3.1Å; E2456-R2460 IonicContact OE1-NH1 3.9Å; E2456-R2460 PolarHBondContact OE1-NH1 2.93Å; E2456-R2460 IonicContact OE1-NH2 2.97Å; E2456-R2460 PolarHBondContact OE1-NH2 2.99Å; E2456-R2460 IonicContact OE2-CZ 3.73Å; E2456-R2460 IonicContact OE2-NE 3.79Å; E2456-R2460 IonicContact OE2-NH2 3.01Å; E2456-R2460 PolarHBondContact OE2-NH2 3.17Å
2457	I	78.3	Confident	69.5	Low	93.2 Å²	93.2	92.9 Å²	92.9	48%	0.478	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-42.1	174.7	-67.7	163.8	0	0	0	111	K2453 Y2454 N2459 R2460 G2461 L3056	K2453-I2457 WeakPolarHBondContact O-CB 3.45Å; K2453-I2457 WeakPolarHBondContact O-CD1 3.3Å; K2453-I2457 VanDerWaalsContact O-CG1 3.26Å; K2453-I2457 WeakPolarHBondContact O-CG1 3.34Å; K2453-I2457 PolarHBondContact O-N 3.09Å; Y2454-I2457 HydrophobicContact CD1-CD1 4.28Å; Y2454-I2457 CarbonylContact O-C 3.58Å; Y2454-I2457 WeakPolarHBondContact O-CA 3.47Å; Y2454-I2457 WeakPolarHBondContact O-CB 3.42Å; Y2454-I2457 PolarHBondContact O-N 3.18Å; I2457-N2459 VanDerWaalsContact C-N 3.34Å; I2457-N2459 PolarHBondContact O-N 3.29Å; I2457-R2460 PolarHBondContact O-N 2.99Å; I2457-G2461 VanDerWaalsContact O-CA 3.23Å; I2457-G2461 WeakPolarHBondContact O-CA 3.18Å; I2457-G2461 PolarHBondContact O-N 3.21Å; I2457-G2461 VanDerWaalsContact O-N 3.11Å; I2457-L3056 HydrophobicContact CG2-CD1 4.44Å; I2457-L3056 HydrophobicContact CG2-CD2 4.09Å
2458	V	75.6	Confident	66.9	Low	65.4 Å²	65.4	93.6 Å²	93.6	40%	0.396	51%	0.513	S	S	.	.	H	α-helix	trans	-64.6	-40.4	175.5	170.1	0	0	0	0	111.3	Y2454 Q2455 E2456 R2460 G2461 S2462 W3052 L3056	Y2454-V2458 WeakPolarHBondContact O-CB 3.43Å; Y2454-V2458 VanDerWaalsContact O-CG2 3.3Å; Y2454-V2458 WeakPolarHBondContact O-CG2 3.47Å; Y2454-V2458 PolarHBondContact O-N 3.12Å; Q2455-V2458 PolarHBondContact O-N 3.09Å; E2456-V2458 VanDerWaalsContact C-N 3.31Å; E2456-V2458 PolarHBondContact O-N 3.3Å; V2458-R2460 VanDerWaalsContact C-N 3.31Å; V2458-R2460 PolarHBondContact O-N 3.22Å; V2458-G2461 PolarHBondContact O-N 3.09Å; V2458-G2461 VanDerWaalsContact O-N 3.12Å; V2458-S2462 WeakPolarHBondContact O-CB 3.43Å; V2458-S2462 PolarHBondContact O-N 2.87Å; V2458-W3052 HydrophobicContact CB-CH2 4.48Å; V2458-W3052 HydrophobicContact CB-CZ3 3.78Å; V2458-W3052 HydrophobicContact CG1-CZ3 4.42Å; V2458-W3052 HydrophobicContact CG2-CE3 3.82Å; V2458-W3052 HydrophobicContact CG2-CH2 4.49Å; V2458-W3052 HydrophobicContact CG2-CZ3 3.47Å; V2458-W3052 VanDerWaalsContact CG2-CZ3 3.47Å; V2458-L3056 HydrophobicContact CG2-CD2 3.87Å; V2458-L3056 HydrophobicContact CG2-CG 4.36Å
2459	N	71.8	Confident	64.1	Low	112.2 Å²	112.2	97.4 Å²	97.4	60%	0.6	53%	0.526	S	S	*	.	H	α-helix	trans	-67	-34.2	176.5	-70.2	-16.5	0	0	0	112.8	Q2455 E2456 I2457 G2461	Q2455-N2459 PolarHBondContact NE2-OD1 2.72Å; Q2455-N2459 VanDerWaalsContact NE2-OD1 3.16Å; Q2455-N2459 WeakPolarHBondContact O-CB 3.33Å; Q2455-N2459 PolarHBondContact O-N 3.24Å; Q2455-N2459 PolarHBondContact O-ND2 3.13Å; Q2455-N2459 VanDerWaalsContact O-ND2 3.11Å; Q2455-N2459 PolarHBondContact O-OD1 2.89Å; E2456-N2459 PolarHBondContact O-N 2.95Å; I2457-N2459 VanDerWaalsContact C-N 3.34Å; I2457-N2459 PolarHBondContact O-N 3.29Å; N2459-G2461 VanDerWaalsContact C-N 3.35Å
2460	R	64.1	Low	61.5	Low	168.6 Å²	168.6	98.1 Å²	98.1	64%	0.636	53%	0.531	S	S	*	.	H	α-helix	trans	-78.2	-26.7	175.4	-70.2	177.9	-176.5	-173.2	7.3	113.2	E2456 I2457 V2458 S2462 I2465 D2478	E2456-R2460 VanDerWaalsContact CD-CZ 3.47Å; E2456-R2460 HydrophobicContact CG-CG 4.24Å; E2456-R2460 VanDerWaalsContact CG-NE 3.34Å; E2456-R2460 VanDerWaalsContact O-CB 3.29Å; E2456-R2460 WeakPolarHBondContact O-CB 3.49Å; E2456-R2460 VanDerWaalsContact O-CG 3.27Å; E2456-R2460 WeakPolarHBondContact O-CG 3.4Å; E2456-R2460 PolarHBondContact O-N 3.24Å; E2456-R2460 VanDerWaalsContact O-N 3.13Å; E2456-R2460 IonicContact OE1-CZ 3.11Å; E2456-R2460 IonicContact OE1-NE 3.17Å; E2456-R2460 PolarHBondContact OE1-NE 2.88Å; E2456-R2460 VanDerWaalsContact OE1-NE 3.1Å; E2456-R2460 IonicContact OE1-NH1 3.9Å; E2456-R2460 PolarHBondContact OE1-NH1 2.93Å; E2456-R2460 IonicContact OE1-NH2 2.97Å; E2456-R2460 PolarHBondContact OE1-NH2 2.99Å; E2456-R2460 IonicContact OE2-CZ 3.73Å; E2456-R2460 IonicContact OE2-NE 3.79Å; E2456-R2460 IonicContact OE2-NH2 3.01Å; E2456-R2460 PolarHBondContact OE2-NH2 3.17Å; I2457-R2460 PolarHBondContact O-N 2.99Å; V2458-R2460 VanDerWaalsContact C-N 3.31Å; V2458-R2460 PolarHBondContact O-N 3.22Å; R2460-S2462 PolarHBondContact O-N 2.69Å; R2460-I2465 WeakPolarHBondContact O-CD1 3.48Å; R2460-I2465 VanDerWaalsContact O-CG1 3.31Å; R2460-I2465 WeakPolarHBondContact O-CG1 3.41Å; R2460-I2465 WeakPolarHBondContact O-CG2 3.37Å; R2460-D2478 IonicContact NH2-OD2 3.36Å
2461	G	53.9	Low	58.8	Low	48.6 Å²	48.6	102.8 Å²	102.8	50%	0.501	56%	0.558	S	S	.	*	H	α-helix	trans	-93	3.2	-177.6	0	0	0	0	0	115	I2457 V2458 N2459 P2463	I2457-G2461 VanDerWaalsContact O-CA 3.23Å; I2457-G2461 WeakPolarHBondContact O-CA 3.18Å; I2457-G2461 PolarHBondContact O-N 3.21Å; I2457-G2461 VanDerWaalsContact O-N 3.11Å; V2458-G2461 PolarHBondContact O-N 3.09Å; V2458-G2461 VanDerWaalsContact O-N 3.12Å; N2459-G2461 VanDerWaalsContact C-N 3.35Å; G2461-P2463 WeakPolarHBondContact O-CD 3.44Å
2462	S	46.2	Very low	56.4	Low	67.8 Å²	67.8	102.4 Å²	102.4	47%	0.474	56%	0.562	S	S	.	*			trans	-84.4	116.4	-176.5	-177	0	0	0	0	111.8	V2458 R2460 V2464 I2465	V2458-S2462 WeakPolarHBondContact O-CB 3.43Å; V2458-S2462 PolarHBondContact O-N 2.87Å; R2460-S2462 PolarHBondContact O-N 2.69Å; S2462-V2464 VanDerWaalsContact C-N 3.34Å; S2462-V2464 PolarHBondContact O-N 3.22Å; S2462-V2464 WeakPolarHBondContact OG-CB 3.25Å; S2462-V2464 VanDerWaalsContact OG-CG2 3.22Å; S2462-V2464 WeakPolarHBondContact OG-CG2 3.34Å; S2462-V2464 PolarHBondContact OG-N 3.01Å; S2462-I2465 WeakPolarHBondContact O-CG1 3.45Å; S2462-I2465 PolarHBondContact O-N 3.15Å
2463	P	45.3	Very low	53.9	Low	99.4 Å²	99.4	106.4 Å²	106.4	65%	0.645	58%	0.575	S	S	*	*			trans	-64.5	72.4	174.7	17.4	-21.7	0	0	0	112.3	G2461 I2465 S2466 S2467	G2461-P2463 WeakPolarHBondContact O-CD 3.44Å; P2463-I2465 VanDerWaalsContact C-N 3.3Å; P2463-I2465 VanDerWaalsContact O-CG1 3.22Å; P2463-I2465 WeakPolarHBondContact O-CG1 3.44Å; P2463-I2465 PolarHBondContact O-N 3.02Å; P2463-I2465 VanDerWaalsContact O-N 3.1Å; P2463-S2466 CarbonylContact O-C 3.58Å; P2463-S2466 WeakPolarHBondContact O-CA 3.41Å; P2463-S2466 PolarHBondContact O-N 3.08Å; P2463-S2466 PolarHBondContact O-OG 2.97Å; P2463-S2467 WeakPolarHBondContact O-CB 3.41Å; P2463-S2467 PolarHBondContact O-N 3.21Å
2464	V	42.8	Very low	51.3	Low	103.8 Å²	103.8	109.9 Å²	109.9	63%	0.629	59%	0.585	S	S	*	*			trans	-71.7	67.7	-176.2	-177.1	0	0	0	0	111.6	S2462 S2466 S2467 P2468	S2462-V2464 VanDerWaalsContact C-N 3.34Å; S2462-V2464 PolarHBondContact O-N 3.22Å; S2462-V2464 WeakPolarHBondContact OG-CB 3.25Å; S2462-V2464 VanDerWaalsContact OG-CG2 3.22Å; S2462-V2464 WeakPolarHBondContact OG-CG2 3.34Å; S2462-V2464 PolarHBondContact OG-N 3.01Å; V2464-S2466 VanDerWaalsContact CG1-OG 3.28Å; V2464-S2466 WeakPolarHBondContact CG1-OG 3.48Å; V2464-S2466 PolarHBondContact O-N 3.05Å; V2464-S2467 WeakPolarHBondContact CA-OG 3.39Å; V2464-S2467 PolarHBondContact O-N 3.1Å; V2464-S2467 PolarHBondContact O-OG 3.12Å; V2464-P2468 WeakPolarHBondContact O-CD 3.34Å
2465	I	39.1	Very low	49	Very low	137.2 Å²	137.2	110.9 Å²	110.9	70%	0.704	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-1.8	-176.7	-37.5	174.2	0	0	0	113.7	R2460 S2462 P2463 S2467 P2468	R2460-I2465 WeakPolarHBondContact O-CD1 3.48Å; R2460-I2465 VanDerWaalsContact O-CG1 3.31Å; R2460-I2465 WeakPolarHBondContact O-CG1 3.41Å; R2460-I2465 WeakPolarHBondContact O-CG2 3.37Å; S2462-I2465 WeakPolarHBondContact O-CG1 3.45Å; S2462-I2465 PolarHBondContact O-N 3.15Å; P2463-I2465 VanDerWaalsContact C-N 3.3Å; P2463-I2465 VanDerWaalsContact O-CG1 3.22Å; P2463-I2465 WeakPolarHBondContact O-CG1 3.44Å; P2463-I2465 PolarHBondContact O-N 3.02Å; P2463-I2465 VanDerWaalsContact O-N 3.1Å; I2465-S2467 PolarHBondContact O-N 3.29Å; I2465-P2468 HydrophobicContact CG2-CG 3.99Å
2466	S	37	Very low	46.7	Very low	85.6 Å²	85.6	113 Å²	113	60%	0.599	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	13.2	178.2	65.5	0	0	0	0	113.9	P2463 V2464 P2468 Y2469 S2470	P2463-S2466 CarbonylContact O-C 3.58Å; P2463-S2466 WeakPolarHBondContact O-CA 3.41Å; P2463-S2466 PolarHBondContact O-N 3.08Å; P2463-S2466 PolarHBondContact O-OG 2.97Å; V2464-S2466 VanDerWaalsContact CG1-OG 3.28Å; V2464-S2466 WeakPolarHBondContact CG1-OG 3.48Å; V2464-S2466 PolarHBondContact O-N 3.05Å; S2466-P2468 VanDerWaalsContact C-CD 3.49Å; S2466-P2468 VanDerWaalsContact O-CD 3.3Å; S2466-P2468 WeakPolarHBondContact O-CD 3.44Å; S2466-Y2469 CarbonylContact O-C 3.16Å; S2466-Y2469 WeakPolarHBondContact O-CA 3.17Å; S2466-Y2469 PolarHBondContact O-N 2.85Å; S2466-S2470 WeakPolarHBondContact O-CB 3.43Å; S2466-S2470 PolarHBondContact O-N 3.35Å; S2466-S2470 VanDerWaalsContact O-N 3.15Å
2467	S	40.2	Very low	44.7	Very low	78.8 Å²	78.8	112.5 Å²	112.5	55%	0.551	62%	0.624	S	S	*	*			trans	-82.7	-15.6	-178.2	57.5	0	0	0	0	116	P2463 V2464 I2465 Y2469 S2470	P2463-S2467 WeakPolarHBondContact O-CB 3.41Å; P2463-S2467 PolarHBondContact O-N 3.21Å; V2464-S2467 WeakPolarHBondContact CA-OG 3.39Å; V2464-S2467 PolarHBondContact O-N 3.1Å; V2464-S2467 PolarHBondContact O-OG 3.12Å; I2465-S2467 PolarHBondContact O-N 3.29Å; S2467-Y2469 PolarHBondContact O-N 3.3Å; S2467-Y2469 VanDerWaalsContact O-N 3.12Å; S2467-S2470 PolarHBondContact O-N 2.98Å; S2467-S2470 VanDerWaalsContact O-N 3.17Å
2468	P	37.2	Very low	42.8	Very low	85 Å²	85	114.3 Å²	114.3	55%	0.552	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-74	4.8	-178.9	21.2	-23.9	0	0	0	114.2	V2464 I2465 S2466 N2547	V2464-P2468 WeakPolarHBondContact O-CD 3.34Å; I2465-P2468 HydrophobicContact CG2-CG 3.99Å; S2466-P2468 VanDerWaalsContact C-CD 3.49Å; S2466-P2468 VanDerWaalsContact O-CD 3.3Å; S2466-P2468 WeakPolarHBondContact O-CD 3.44Å; P2468-N2547 WeakPolarHBondContact CB-OD1 3.37Å; P2468-N2547 WeakPolarHBondContact CG-OD1 3.46Å
2469	Y	34	Very low	40.9	Very low	186 Å²	186	119.1 Å²	119.1	73%	0.729	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-121.4	25.8	-178.5	-57.7	-69	0	0	0	114.5	S2466 S2467 K2545	S2466-Y2469 CarbonylContact O-C 3.16Å; S2466-Y2469 WeakPolarHBondContact O-CA 3.17Å; S2466-Y2469 PolarHBondContact O-N 2.85Å; S2467-Y2469 PolarHBondContact O-N 3.3Å; S2467-Y2469 VanDerWaalsContact O-N 3.12Å; Y2469-K2545 HydrophobicContact CE2-CB 4.38Å; Y2469-K2545 HydrophobicContact CE2-CD 4.03Å; Y2469-K2545 WeakPolarHBondContact OH-CD 3.07Å
2470	S	35.7	Very low	39.4	Very low	66 Å²	66	118.5 Å²	118.5	46%	0.462	65%	0.647	S	S	.	*			trans	-110.6	115	173.7	167.9	0	0	0	0	111.6	S2466 S2467 S2472	S2466-S2470 WeakPolarHBondContact O-CB 3.43Å; S2466-S2470 PolarHBondContact O-N 3.35Å; S2466-S2470 VanDerWaalsContact O-N 3.15Å; S2467-S2470 PolarHBondContact O-N 2.98Å; S2467-S2470 VanDerWaalsContact O-N 3.17Å; S2470-S2472 VanDerWaalsContact C-N 3.26Å; S2470-S2472 PolarHBondContact O-N 3.06Å; S2470-S2472 VanDerWaalsContact O-N 3.09Å; S2470-S2472 WeakPolarHBondContact OG-CA 3.37Å; S2470-S2472 VanDerWaalsContact OG-CB 3.28Å; S2470-S2472 WeakPolarHBondContact OG-CB 3.41Å; S2470-S2472 PolarHBondContact OG-N 3.03Å; S2470-S2472 VanDerWaalsContact OG-N 3.16Å; S2470-S2472 PolarHBondContact OG-O 3.5Å; S2470-S2472 PolarHBondContact OG-OG 3.22Å
2471	L	33.3	Very low	38.6	Very low	175.6 Å²	175.6	117.2 Å²	117.2	92%	0.919	65%	0.652	S	S	*	*			trans	-77.6	22.7	170.6	-67.1	175.4	0	0	0	113	I2473	L2471-I2473 PolarHBondContact O-N 3.08Å
2472	S	34.7	Very low	38.2	Very low	73.6 Å²	73.6	121.2 Å²	121.2	52%	0.515	66%	0.662	S	S	.	*			trans	-85.4	99.8	169.4	-58.5	0	0	0	0	110.2	S2470 R2474 R2611	S2470-S2472 VanDerWaalsContact C-N 3.26Å; S2470-S2472 PolarHBondContact O-N 3.06Å; S2470-S2472 VanDerWaalsContact O-N 3.09Å; S2470-S2472 WeakPolarHBondContact OG-CA 3.37Å; S2470-S2472 VanDerWaalsContact OG-CB 3.28Å; S2470-S2472 WeakPolarHBondContact OG-CB 3.41Å; S2470-S2472 PolarHBondContact OG-N 3.03Å; S2470-S2472 VanDerWaalsContact OG-N 3.16Å; S2470-S2472 PolarHBondContact OG-O 3.5Å; S2470-S2472 PolarHBondContact OG-OG 3.22Å; S2472-R2474 VanDerWaalsContact C-N 3.32Å; S2472-R2474 PolarHBondContact O-N 3.11Å; S2472-R2611 PolarHBondContact OG-NH1 3.49Å; S2472-R2611 PolarHBondContact OG-NH2 3.42Å
2473	I	35	Very low	38.1	Very low	156.6 Å²	156.6	122.3 Å²	122.3	80%	0.803	66%	0.663	S	S	*	*			trans	-64.4	103.2	170.2	-58.9	173.4	0	0	0	108.4	L2471 N2475	L2471-I2473 PolarHBondContact O-N 3.08Å; I2473-N2475 PolarHBondContact O-N 2.72Å
2474	R	31.2	Very low	38.2	Very low	194.8 Å²	194.8	125.6 Å²	125.6	74%	0.735	67%	0.667	S	S	*	*			trans	-116.7	99.2	177	-83.6	-177.9	174.9	-179.6	-1.6	111.5	S2472	S2472-R2474 VanDerWaalsContact C-N 3.32Å; S2472-R2474 PolarHBondContact O-N 3.11Å
2475	N	33.6	Very low	38.7	Very low	133.4 Å²	133.4	123.8 Å²	123.8	71%	0.713	66%	0.663	S	S	*	*			trans	167.8	86.8	158.7	-81.7	4.8	0	0	0	111.4	I2473 A2477	I2473-N2475 PolarHBondContact O-N 2.72Å; N2475-A2477 PolarHBondContact O-N 3.02Å; N2475-A2477 VanDerWaalsContact O-N 3.1Å
2476	N	32.7	Very low	38.8	Very low	151.2 Å²	151.2	122.9 Å²	122.9	81%	0.809	65%	0.654	S	S	*	*			trans	-109.6	83.8	151.5	-75.6	-0.8	0	0	0	110.8	D2478	N2476-D2478 VanDerWaalsContact C-N 3.27Å; N2476-D2478 PolarHBondContact O-N 3.14Å
2477	A	37.9	Very low	39.4	Very low	80 Å²	80	122.2 Å²	122.2	66%	0.661	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-30.2	177.9	0	0	0	0	0	112.2	N2475 F2479	N2475-A2477 PolarHBondContact O-N 3.02Å; N2475-A2477 VanDerWaalsContact O-N 3.1Å; A2477-F2479 PolarHBondContact O-N 3.06Å
2478	D	37.1	Very low	39.9	Very low	130.2 Å²	130.2	121.6 Å²	121.6	70%	0.696	64%	0.637	S	S	*	*			trans	-78.4	16.8	-179.1	-52	-32.7	0	0	0	115.5	R2460 N2476 D2480	R2460-D2478 IonicContact NH2-OD2 3.36Å; N2476-D2478 VanDerWaalsContact C-N 3.27Å; N2476-D2478 PolarHBondContact O-N 3.14Å; D2478-D2480 PolarHBondContact O-N 2.79Å
2479	F	36.8	Very low	40.5	Very low	166.8 Å²	166.8	125.2 Å²	125.2	73%	0.732	64%	0.643	S	S	*	*			trans	-115.9	76.5	172.1	-98.2	-86.5	0	0	0	112.1	A2477 L2481 F2486	A2477-F2479 PolarHBondContact O-N 3.06Å; F2479-L2481 HydrophobicContact CB-CD1 4.16Å; F2479-L2481 HydrophobicContact CD1-CD1 4.17Å; F2479-L2481 WeakPolarHBondContact O-CD1 3.21Å; F2479-L2481 PolarHBondContact O-N 3.14Å; F2479-L2481 VanDerWaalsContact O-N 3.12Å; F2479-F2486 HydrophobicContact CD1-CE1 4.47Å; F2479-F2486 HydrophobicContact CE1-CE1 4.33Å; F2479-F2486 HydrophobicContact CZ-CZ 4.44Å
2480	D	39.9	Very low	40.7	Very low	99.4 Å²	99.4	123.4 Å²	123.4	53%	0.532	64%	0.64	S	S	.	*			trans	-77.9	96.9	175.3	-177.4	18.1	0	0	0	111.8	D2478 N2482 N2483	D2478-D2480 PolarHBondContact O-N 2.79Å; D2480-N2482 PolarHBondContact O-N 3.08Å; D2480-N2482 VanDerWaalsContact O-N 3.11Å; D2480-N2482 VanDerWaalsContact OD1-CB 3.25Å; D2480-N2482 WeakPolarHBondContact OD1-CB 3.35Å; D2480-N2482 PolarHBondContact OD1-N 3.04Å; D2480-N2482 VanDerWaalsContact OD1-N 3.12Å; D2480-N2482 PolarHBondContact OD1-ND2 3.2Å; D2480-N2483 HydrophobicContact CB-CB 4.03Å; D2480-N2483 WeakPolarHBondContact O-CB 3.49Å; D2480-N2483 PolarHBondContact O-N 3.17Å; D2480-N2483 VanDerWaalsContact O-N 3.1Å; D2480-N2483 WeakPolarHBondContact OD2-CB 3.46Å; D2480-N2483 PolarHBondContact OD2-N 3.02Å
2481	L	47.7	Very low	41.3	Very low	140.8 Å²	140.8	126 Å²	126	74%	0.737	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-9.6	176.9	-84.5	90.6	0	0	0	113.7	F2479 N2483 I2624	F2479-L2481 HydrophobicContact CB-CD1 4.16Å; F2479-L2481 HydrophobicContact CD1-CD1 4.17Å; F2479-L2481 WeakPolarHBondContact O-CD1 3.21Å; F2479-L2481 PolarHBondContact O-N 3.14Å; F2479-L2481 VanDerWaalsContact O-N 3.12Å; L2481-N2483 VanDerWaalsContact C-N 3.31Å; L2481-N2483 PolarHBondContact O-N 3.31Å; L2481-I2624 HydrophobicContact CD2-CD1 3.86Å
2482	N	45.4	Very low	41.6	Very low	132.4 Å²	132.4	125.5 Å²	125.5	71%	0.708	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-16.4	175.4	-64.7	-62.3	0	0	0	112.9	D2480 K2484	D2480-N2482 PolarHBondContact O-N 3.08Å; D2480-N2482 VanDerWaalsContact O-N 3.11Å; D2480-N2482 VanDerWaalsContact OD1-CB 3.25Å; D2480-N2482 WeakPolarHBondContact OD1-CB 3.35Å; D2480-N2482 PolarHBondContact OD1-N 3.04Å; D2480-N2482 VanDerWaalsContact OD1-N 3.12Å; D2480-N2482 PolarHBondContact OD1-ND2 3.2Å; N2482-K2484 VanDerWaalsContact C-N 3.29Å; N2482-K2484 PolarHBondContact O-N 3.23Å
2483	N	43.8	Very low	41.9	Very low	90.8 Å²	90.8	128.3 Å²	128.3	49%	0.486	64%	0.643	S	S	.	*			trans	-73.6	90.4	-179.2	-165.3	-24.2	0	0	0	111.8	D2480 L2481 A2485 F2486 V2487	D2480-N2483 HydrophobicContact CB-CB 4.03Å; D2480-N2483 WeakPolarHBondContact O-CB 3.49Å; D2480-N2483 PolarHBondContact O-N 3.17Å; D2480-N2483 VanDerWaalsContact O-N 3.1Å; D2480-N2483 WeakPolarHBondContact OD2-CB 3.46Å; D2480-N2483 PolarHBondContact OD2-N 3.02Å; L2481-N2483 VanDerWaalsContact C-N 3.31Å; L2481-N2483 PolarHBondContact O-N 3.31Å; N2483-A2485 PolarHBondContact O-N 3.25Å; N2483-A2485 VanDerWaalsContact OD1-CB 3.25Å; N2483-A2485 WeakPolarHBondContact OD1-CB 3.37Å; N2483-A2485 PolarHBondContact OD1-N 3.32Å; N2483-A2485 VanDerWaalsContact OD1-N 3.11Å; N2483-F2486 HydrophobicContact CB-CB 4.3Å; N2483-F2486 WeakPolarHBondContact O-CB 3.44Å; N2483-F2486 PolarHBondContact O-N 3.14Å; N2483-F2486 PolarHBondContact OD1-N 3.08Å; N2483-V2487 PolarHBondContact O-N 3.13Å
2484	K	48.1	Very low	42	Very low	170.6 Å²	170.6	127.4 Å²	127.4	74%	0.742	64%	0.64	S	S	*	*	H	α-helix	trans	-49.9	-22.6	177.1	-74.8	179.1	177.3	173.5	0	114	N2482 N2488	N2482-K2484 VanDerWaalsContact C-N 3.29Å; N2482-K2484 PolarHBondContact O-N 3.23Å; K2484-N2488 VanDerWaalsContact O-CB 3.28Å; K2484-N2488 WeakPolarHBondContact O-CB 3.3Å; K2484-N2488 PolarHBondContact O-N 3.18Å; K2484-N2488 PolarHBondContact O-ND2 2.88Å
2485	A	52.2	Low	42.2	Very low	64.2 Å²	64.2	124.8 Å²	124.8	53%	0.531	64%	0.641	S	S	.	*	H	α-helix	trans	-68	-38.3	176.9	0	0	0	0	0	112.9	N2483 N2488 K2489	N2483-A2485 PolarHBondContact O-N 3.25Å; N2483-A2485 VanDerWaalsContact OD1-CB 3.25Å; N2483-A2485 WeakPolarHBondContact OD1-CB 3.37Å; N2483-A2485 PolarHBondContact OD1-N 3.32Å; N2483-A2485 VanDerWaalsContact OD1-N 3.11Å; A2485-N2488 PolarHBondContact O-N 2.95Å; A2485-K2489 VanDerWaalsContact O-CB 3.31Å; A2485-K2489 WeakPolarHBondContact O-CB 3.42Å; A2485-K2489 PolarHBondContact O-N 3.2Å
2486	F	42.1	Very low	42.3	Very low	118.4 Å²	118.4	129.4 Å²	129.4	52%	0.519	65%	0.648	S	S	.	*	H	α-helix	trans	-69.5	-47.6	-178.7	-167	-92.5	0	0	0	111.6	F2479 N2483 N2488 K2489 F2490	F2479-F2486 HydrophobicContact CD1-CE1 4.47Å; F2479-F2486 HydrophobicContact CE1-CE1 4.33Å; F2479-F2486 HydrophobicContact CZ-CZ 4.44Å; N2483-F2486 HydrophobicContact CB-CB 4.3Å; N2483-F2486 WeakPolarHBondContact O-CB 3.44Å; N2483-F2486 PolarHBondContact O-N 3.14Å; N2483-F2486 PolarHBondContact OD1-N 3.08Å; F2486-N2488 VanDerWaalsContact C-N 3.3Å; F2486-N2488 PolarHBondContact O-N 3.03Å; F2486-K2489 PolarHBondContact O-N 3.19Å; F2486-K2489 VanDerWaalsContact O-N 3.09Å; F2486-F2490 HydrophobicContact CD1-CD2 4.16Å; F2486-F2490 HydrophobicContact CD1-CE2 4.36Å; F2486-F2490 AromaticContact CE1-CD2 3.83Å; F2486-F2490 HydrophobicContact CE1-CD2 3.83Å; F2486-F2490 AromaticContact CE1-CE2 3.6Å; F2486-F2490 HydrophobicContact CE1-CE2 3.93Å; F2486-F2490 HydrophobicContact CZ-CD2 4.29Å; F2486-F2490 AromaticContact CZ-CE2 3.84Å; F2486-F2490 HydrophobicContact CZ-CE2 4.03Å; F2486-F2490 WeakPolarHBondContact O-CB 3.4Å; F2486-F2490 PolarHBondContact O-N 2.98Å
2487	V	48.9	Very low	42.4	Very low	71.8 Å²	71.8	131.4 Å²	131.4	44%	0.435	65%	0.65	S	S	.	*	H	α-helix	trans	-59.7	-41.9	175.1	178.3	0	0	0	0	111	N2483 K2489 F2490 L2491	N2483-V2487 PolarHBondContact O-N 3.13Å; V2487-K2489 VanDerWaalsContact C-N 3.32Å; V2487-K2489 PolarHBondContact O-N 3.04Å; V2487-F2490 PolarHBondContact O-N 3.22Å; V2487-L2491 HydrophobicContact CG1-CD1 3.81Å; V2487-L2491 HydrophobicContact CG1-CG 4.47Å; V2487-L2491 WeakPolarHBondContact O-CB 3.38Å; V2487-L2491 VanDerWaalsContact O-CG 3.29Å; V2487-L2491 WeakPolarHBondContact O-CG 3.34Å; V2487-L2491 PolarHBondContact O-N 3.01Å
2488	N	50.1	Low	42.1	Very low	66.2 Å²	66.2	134.1 Å²	134.1	35%	0.354	66%	0.658	S	S	.	*	H	α-helix	trans	-63.9	-32.9	173.2	-92.4	-89.7	0	0	0	113.3	K2484 A2485 F2486 F2490 L2491 R2492	K2484-N2488 VanDerWaalsContact O-CB 3.28Å; K2484-N2488 WeakPolarHBondContact O-CB 3.3Å; K2484-N2488 PolarHBondContact O-N 3.18Å; K2484-N2488 PolarHBondContact O-ND2 2.88Å; A2485-N2488 PolarHBondContact O-N 2.95Å; F2486-N2488 VanDerWaalsContact C-N 3.3Å; F2486-N2488 PolarHBondContact O-N 3.03Å; N2488-F2490 VanDerWaalsContact C-N 3.32Å; N2488-F2490 PolarHBondContact O-N 3.48Å; N2488-L2491 PolarHBondContact O-N 2.91Å; N2488-R2492 VanDerWaalsContact O-CB 3.25Å; N2488-R2492 WeakPolarHBondContact O-CB 3.37Å; N2488-R2492 VanDerWaalsContact O-CD 3.31Å; N2488-R2492 WeakPolarHBondContact O-CD 3.39Å; N2488-R2492 WeakPolarHBondContact O-CG 3.41Å; N2488-R2492 PolarHBondContact O-N 3.31Å; N2488-R2492 VanDerWaalsContact O-N 3.1Å; N2488-R2492 PolarHBondContact O-NE 3.35Å; N2488-R2492 VanDerWaalsContact OD1-CZ 3.32Å; N2488-R2492 PolarHBondContact OD1-NE 3.13Å; N2488-R2492 VanDerWaalsContact OD1-NE 3.1Å; N2488-R2492 PolarHBondContact OD1-NH2 3.24Å; N2488-R2492 VanDerWaalsContact OD1-NH2 3.13Å
2489	K	50	Low	41.9	Very low	159.8 Å²	159.8	132.2 Å²	132.2	70%	0.695	66%	0.66	S	S	*	*	H	α-helix	trans	-74.9	-36	-179.9	-159.7	171	-175	179.2	0	111.8	A2485 F2486 V2487 N2493	A2485-K2489 VanDerWaalsContact O-CB 3.31Å; A2485-K2489 WeakPolarHBondContact O-CB 3.42Å; A2485-K2489 PolarHBondContact O-N 3.2Å; F2486-K2489 PolarHBondContact O-N 3.19Å; F2486-K2489 VanDerWaalsContact O-N 3.09Å; V2487-K2489 VanDerWaalsContact C-N 3.32Å; V2487-K2489 PolarHBondContact O-N 3.04Å; K2489-N2493 WeakPolarHBondContact O-CB 3.43Å; K2489-N2493 PolarHBondContact O-N 2.77Å; K2489-N2493 VanDerWaalsContact O-N 3.08Å
2490	F	39.2	Very low	41.7	Very low	149 Å²	149	131.5 Å²	131.5	65%	0.654	66%	0.664	S	S	*	*	H	α-helix	trans	-69.7	-42.2	172.8	-118.7	-91.6	0	0	0	112.6	F2486 V2487 N2488 R2492	F2486-F2490 HydrophobicContact CD1-CD2 4.16Å; F2486-F2490 HydrophobicContact CD1-CE2 4.36Å; F2486-F2490 AromaticContact CE1-CD2 3.83Å; F2486-F2490 HydrophobicContact CE1-CD2 3.83Å; F2486-F2490 AromaticContact CE1-CE2 3.6Å; F2486-F2490 HydrophobicContact CE1-CE2 3.93Å; F2486-F2490 HydrophobicContact CZ-CD2 4.29Å; F2486-F2490 AromaticContact CZ-CE2 3.84Å; F2486-F2490 HydrophobicContact CZ-CE2 4.03Å; F2486-F2490 WeakPolarHBondContact O-CB 3.4Å; F2486-F2490 PolarHBondContact O-N 2.98Å; V2487-F2490 PolarHBondContact O-N 3.22Å; N2488-F2490 VanDerWaalsContact C-N 3.32Å; N2488-F2490 PolarHBondContact O-N 3.48Å; F2490-R2492 VanDerWaalsContact C-N 3.27Å; F2490-R2492 PolarHBondContact O-N 3.25Å
2491	L	47.1	Very low	41.5	Very low	120.4 Å²	120.4	135.6 Å²	135.6	63%	0.63	68%	0.68	S	S	*	*	H	α-helix	trans	-75.3	-22.3	-179	-70.3	172	0	0	0	114.4	V2487 N2488 N2493 N2494 N2495	V2487-L2491 HydrophobicContact CG1-CD1 3.81Å; V2487-L2491 HydrophobicContact CG1-CG 4.47Å; V2487-L2491 WeakPolarHBondContact O-CB 3.38Å; V2487-L2491 VanDerWaalsContact O-CG 3.29Å; V2487-L2491 WeakPolarHBondContact O-CG 3.34Å; V2487-L2491 PolarHBondContact O-N 3.01Å; N2488-L2491 PolarHBondContact O-N 2.91Å; L2491-N2493 VanDerWaalsContact C-N 3.29Å; L2491-N2493 PolarHBondContact O-N 3.22Å; L2491-N2494 PolarHBondContact O-N 3.48Å; L2491-N2495 PolarHBondContact O-N 2.97Å
2492	R	40.8	Very low	40.7	Very low	165.4 Å²	165.4	133.8 Å²	133.8	62%	0.624	69%	0.686	S	S	*	*	H	α-helix	trans	-79.4	-16.7	-178.2	-76	172	-164.7	-155.6	3.2	114.6	N2488 F2490 N2494 N2495 R2496	N2488-R2492 VanDerWaalsContact O-CB 3.25Å; N2488-R2492 WeakPolarHBondContact O-CB 3.37Å; N2488-R2492 VanDerWaalsContact O-CD 3.31Å; N2488-R2492 WeakPolarHBondContact O-CD 3.39Å; N2488-R2492 WeakPolarHBondContact O-CG 3.41Å; N2488-R2492 PolarHBondContact O-N 3.31Å; N2488-R2492 VanDerWaalsContact O-N 3.1Å; N2488-R2492 PolarHBondContact O-NE 3.35Å; N2488-R2492 VanDerWaalsContact OD1-CZ 3.32Å; N2488-R2492 PolarHBondContact OD1-NE 3.13Å; N2488-R2492 VanDerWaalsContact OD1-NE 3.1Å; N2488-R2492 PolarHBondContact OD1-NH2 3.24Å; N2488-R2492 VanDerWaalsContact OD1-NH2 3.13Å; F2490-R2492 VanDerWaalsContact C-N 3.27Å; F2490-R2492 PolarHBondContact O-N 3.25Å; R2492-N2494 VanDerWaalsContact C-N 3.32Å; R2492-N2494 PolarHBondContact O-N 3.29Å; R2492-N2495 PolarHBondContact O-N 2.98Å; R2492-R2496 WeakPolarHBondContact O-CB 3.09Å; R2492-R2496 VanDerWaalsContact O-CG 3.32Å; R2492-R2496 WeakPolarHBondContact O-CG 3.32Å; R2492-R2496 PolarHBondContact O-N 3.45Å
2493	N	39.6	Very low	40.1	Very low	131.4 Å²	131.4	131.1 Å²	131.1	70%	0.703	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-80	-15.2	-176.5	-85.8	7.1	0	0	0	114.9	K2489 L2491	K2489-N2493 WeakPolarHBondContact O-CB 3.43Å; K2489-N2493 PolarHBondContact O-N 2.77Å; K2489-N2493 VanDerWaalsContact O-N 3.08Å; L2491-N2493 VanDerWaalsContact C-N 3.29Å; L2491-N2493 PolarHBondContact O-N 3.22Å
2494	N	38	Very low	39.6	Very low	138.8 Å²	138.8	135.2 Å²	135.2	74%	0.742	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-92.3	-5	179.8	-72.8	-14.5	0	0	0	114.2	L2491 R2492	L2491-N2494 PolarHBondContact O-N 3.48Å; R2492-N2494 VanDerWaalsContact C-N 3.32Å; R2492-N2494 PolarHBondContact O-N 3.29Å
2495	N	36	Very low	38.9	Very low	140.4 Å²	140.4	133.3 Å²	133.3	75%	0.751	70%	0.696	S	S	*	*			trans	-117.2	37.5	-175.5	-81.9	-15.8	0	0	0	113.9	L2491 R2492 K2497	L2491-N2495 PolarHBondContact O-N 2.97Å; R2492-N2495 PolarHBondContact O-N 2.98Å; N2495-K2497 PolarHBondContact O-N 3.38Å
2496	R	35.1	Very low	37.9	Very low	228.8 Å²	228.8	140.7 Å²	140.7	86%	0.863	71%	0.712	S	S	*	*			trans	-131.9	92.5	166.9	-89.4	172.7	177.4	-165.6	-2.6	112.8	R2492	R2492-R2496 WeakPolarHBondContact O-CB 3.09Å; R2492-R2496 VanDerWaalsContact O-CG 3.32Å; R2492-R2496 WeakPolarHBondContact O-CG 3.32Å; R2492-R2496 PolarHBondContact O-N 3.45Å
2497	K	34.3	Very low	37.4	Very low	194.8 Å²	194.8	138.3 Å²	138.3	85%	0.847	72%	0.72	S	S	*	*			trans	-133.4	124.3	161.9	-74.7	178.5	178.5	179.2	0	110.5	N2495	N2495-K2497 PolarHBondContact O-N 3.38Å
2498	T	32.4	Very low	36.5	Very low	136.2 Å²	136.2	141.3 Å²	141.3	84%	0.836	74%	0.739	S	S	*	*			trans	69.8	100.2	138.8	59.6	0	0	0	0	113.6
2499	A	32.3	Very low	35.7	Very low	89.4 Å²	89.4	143.9 Å²	143.9	74%	0.739	76%	0.758	S	S	*	*				-163.9	129.2	111	0	0	0	0	0	110.6
2500	N	32.4	Very low	34.9	Very low	152.4 Å²	152.4	142.7 Å²	142.7	82%	0.815	76%	0.763	S	S	*	*			trans	-126.4	147.7	164.2	-77.4	-27.1	0	0	0	113
2501	Q	36.2	Very low	34.6	Very low	185.2 Å²	185.2	142.4 Å²	142.4	87%	0.865	77%	0.768	S	S	*	*			trans	72.7	131.3	164.1	-52.8	179.9	20.1	0	0	117.1
2502	A	31.4	Very low	33.9	Very low	104 Å²	104	140.6 Å²	140.6	86%	0.86	77%	0.771	S	S	*	*			cis	108.6	142.6	43.9	0	0	0	0	0	115.8
2503	G	32.3	Very low	33.7	Very low	74.2 Å²	74.2	141.6 Å²	141.6	77%	0.765	78%	0.782	S	S	*	*			trans	120.9	104.2	157.9	0	0	0	0	0	116.7
2504	K	33.2	Very low	33.4	Very low	177.2 Å²	177.2	143.2 Å²	143.2	77%	0.77	79%	0.786	S	S	*	*			trans	5.9	139.9	151.9	-76.3	175.1	159.8	-117.5	0	115.9
2505	E	33	Very low	33.1	Very low	132 Å²	132	141.1 Å²	141.1	62%	0.617	79%	0.787	S	S	*	*				106.9	144.5	97.5	-84.6	156.9	-159.7	0	0	114.8
2506	Y	31.8	Very low	33	Very low	219.4 Å²	219.4	140.3 Å²	140.3	86%	0.86	79%	0.787	S	S	*	*			trans	104.5	141.9	158.2	-69.4	-79.4	0	0	0	114.5
2507	G	30.3	Very low	33	Very low	68.4 Å²	68.4	136.2 Å²	136.2	71%	0.705	78%	0.782	S	S	*	*			trans	179.7	135.3	159.9	0	0	0	0	0	115	T2509	G2507-T2509 PolarHBondContact O-N 2.96Å
2508	T	30.9	Very low	33	Very low	133.8 Å²	133.8	130.5 Å²	130.5	82%	0.821	76%	0.764	S	S	*	*			trans	175.4	121.8	167.5	14.8	0	0	0	0	114
2509	T	32.4	Very low	33.6	Very low	121.8 Å²	121.8	133.2 Å²	133.2	75%	0.747	77%	0.768	S	S	*	*			trans	53.7	105.7	144.1	56.7	0	0	0	0	116.6	G2507 D2511	G2507-T2509 PolarHBondContact O-N 2.96Å; T2509-D2511 PolarHBondContact O-N 2.96Å
2510	V	35	Very low	33.8	Very low	134.4 Å²	134.4	133.5 Å²	133.5	82%	0.815	76%	0.764	S	S	*	*			trans	-126.8	100.2	148.5	-118.5	0	0	0	0	112.6	A2512	V2510-A2512 PolarHBondContact O-N 3.19Å; V2510-A2512 VanDerWaalsContact O-N 3.08Å
2511	D	31.1	Very low	34.2	Very low	141.8 Å²	141.8	132.8 Å²	132.8	76%	0.758	76%	0.76	S	S	*	*			trans	-84.7	99.5	171.8	-72.9	-53.1	0	0	0	112.1	T2509 H2513	T2509-D2511 PolarHBondContact O-N 2.96Å; D2511-H2513 VanDerWaalsContact C-N 3.27Å; D2511-H2513 PolarHBondContact O-N 3.12Å
2512	A	34.2	Very low	34.2	Very low	82.6 Å²	82.6	128.6 Å²	128.6	68%	0.683	75%	0.748	S	S	*	*			trans	-99	98.2	171.2	0	0	0	0	0	109.8	V2510 Q2514	V2510-A2512 PolarHBondContact O-N 3.19Å; V2510-A2512 VanDerWaalsContact O-N 3.08Å; A2512-Q2514 VanDerWaalsContact C-N 3.27Å; A2512-Q2514 PolarHBondContact O-N 3.07Å
2513	H	35	Very low	34.7	Very low	187.6 Å²	187.6	131.8 Å²	131.8	87%	0.869	74%	0.74	S	S	*	*			trans	-63.4	84.2	173.9	-71.9	-60.9	0	0	0	111.5	D2511 A2515	D2511-H2513 VanDerWaalsContact C-N 3.27Å; D2511-H2513 PolarHBondContact O-N 3.12Å; H2513-A2515 VanDerWaalsContact C-N 3.3Å; H2513-A2515 PolarHBondContact O-N 3.07Å
2514	Q	33.9	Very low	34.8	Very low	164.4 Å²	164.4	133.5 Å²	133.5	77%	0.768	74%	0.735	S	S	*	*			trans	-78.3	106.7	177.4	-162.9	166.8	24.8	0	0	109.2	A2512 V2516	A2512-Q2514 VanDerWaalsContact C-N 3.27Å; A2512-Q2514 PolarHBondContact O-N 3.07Å; Q2514-V2516 VanDerWaalsContact C-N 3.31Å; Q2514-V2516 HydrophobicContact CG-CG2 3.88Å; Q2514-V2516 PolarHBondContact O-N 3.19Å
2515	A	31.4	Very low	35	Very low	94.6 Å²	94.6	130 Å²	130	78%	0.782	73%	0.725	S	S	*	*			trans	-68.2	90.9	178.6	0	0	0	0	0	110.6	H2513 L2517	H2513-A2515 VanDerWaalsContact C-N 3.3Å; H2513-A2515 PolarHBondContact O-N 3.07Å; A2515-L2517 PolarHBondContact O-N 3.18Å; A2515-L2517 VanDerWaalsContact O-N 3.11Å
2516	V	34.4	Very low	35.3	Very low	122.8 Å²	122.8	128.4 Å²	128.4	74%	0.744	72%	0.72	S	S	*	*			trans	-67.4	107	176.2	179.9	0	0	0	0	108.8	Q2514	Q2514-V2516 VanDerWaalsContact C-N 3.31Å; Q2514-V2516 HydrophobicContact CG-CG2 3.88Å; Q2514-V2516 PolarHBondContact O-N 3.19Å
2517	L	35.6	Very low	35.5	Very low	144 Å²	144	125.9 Å²	125.9	75%	0.754	71%	0.71	S	S	*	*			trans	-62.3	138.5	167.4	-76.8	153.9	0	0	0	109.3	A2515 Q2519	A2515-L2517 PolarHBondContact O-N 3.18Å; A2515-L2517 VanDerWaalsContact O-N 3.11Å; L2517-Q2519 PolarHBondContact O-N 2.97Å
2518	P	34.8	Very low	35.9	Very low	73.6 Å²	73.6	125.7 Å²	125.7	48%	0.478	70%	0.702	S	S	.	*			trans	-63.5	131.7	178.6	27.5	-34.7	0	0	0	110.1	S2520 L2521	P2518-S2520 CarbonylContact O-C 3.52Å; P2518-S2520 PolarHBondContact O-N 3.18Å; P2518-S2520 VanDerWaalsContact O-N 3.13Å; P2518-L2521 HydrophobicContact CG-CD2 4.43Å
2519	Q	43.6	Very low	36.2	Very low	193.2 Å²	193.2	128.3 Å²	128.3	90%	0.903	70%	0.697	S	S	*	*	S	Bend	trans	-63.2	-12.1	-178.5	-71	-178.6	-18	0	0	113.9	L2517	L2517-Q2519 PolarHBondContact O-N 2.97Å
2520	S	36	Very low	36.6	Very low	95.8 Å²	95.8	127.5 Å²	127.5	67%	0.67	69%	0.694	S	S	*	*	S	Bend	trans	-130.5	128.3	165.3	52.8	0	0	0	0	109.5	P2518	P2518-S2520 CarbonylContact O-C 3.52Å; P2518-S2520 PolarHBondContact O-N 3.18Å; P2518-S2520 VanDerWaalsContact O-N 3.13Å
2521	L	42	Very low	36.8	Very low	138.4 Å²	138.4	126.6 Å²	126.6	73%	0.725	68%	0.684	S	S	*	*			trans	-76.6	143.6	167.2	-69.9	171	0	0	0	109	P2518	P2518-L2521 HydrophobicContact CG-CD2 4.43Å
2522	P	36.4	Very low	37.2	Very low	96 Å²	96	124.4 Å²	124.4	62%	0.623	68%	0.678	S	S	*	*			trans	-60.2	148.9	170.9	17.9	-22.1	0	0	0	110.5	V2524	P2522-V2524 WeakPolarHBondContact O-CG2 3.35Å; P2522-V2524 PolarHBondContact O-N 3.09Å
2523	Y	40.9	Very low	37.4	Very low	172.4 Å²	172.4	126.8 Å²	126.8	68%	0.676	68%	0.679	S	S	*	*			trans	-60	104.8	-177.9	174.7	-113.7	0	0	0	111.5	N2525 D2526	Y2523-N2525 PolarHBondContact O-N 2.9Å; Y2523-D2526 WeakPolarHBondContact CE2-OD1 3.43Å; Y2523-D2526 WeakPolarHBondContact CE2-OD2 3.47Å; Y2523-D2526 PolarHBondContact OH-OD1 3.09Å; Y2523-D2526 PolarHBondContact OH-OD2 3.05Å; Y2523-D2526 VanDerWaalsContact OH-OD2 3.11Å
2524	V	35.8	Very low	37.6	Very low	110 Å²	110	122.4 Å²	122.4	67%	0.667	67%	0.669	S	S	*	*			trans	-89.9	125.1	177.7	179.7	0	0	0	0	109.3	P2522 D2526	P2522-V2524 WeakPolarHBondContact O-CG2 3.35Å; P2522-V2524 PolarHBondContact O-N 3.09Å; V2524-D2526 PolarHBondContact O-N 3.09Å; V2524-D2526 VanDerWaalsContact O-N 3.13Å
2525	N	36.6	Very low	37.9	Very low	103.8 Å²	103.8	120.9 Å²	120.9	56%	0.555	67%	0.665	S	S	*	*			trans	-47.1	117	-179.8	-163.3	22.2	0	0	0	113.7	Y2523 Y2527 A2528	Y2523-N2525 PolarHBondContact O-N 2.9Å; N2525-Y2527 PolarHBondContact O-N 2.97Å; N2525-Y2527 VanDerWaalsContact OD1-CD2 3.32Å; N2525-Y2527 WeakPolarHBondContact OD1-CD2 3.27Å; N2525-Y2527 VanDerWaalsContact OD1-CE2 3.3Å; N2525-Y2527 WeakPolarHBondContact OD1-CE2 3.44Å; N2525-Y2527 PolarHBondContact OD1-N 2.9Å; N2525-A2528 PolarHBondContact O-N 2.91Å; N2525-A2528 VanDerWaalsContact O-N 3.12Å
2526	D	38.8	Very low	38	Very low	97.8 Å²	97.8	120.9 Å²	120.9	52%	0.523	66%	0.659	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.1	-1.1	-171.4	-69.2	-49	0	0	0	116.4	Y2523 V2524 R2557	Y2523-D2526 WeakPolarHBondContact CE2-OD1 3.43Å; Y2523-D2526 WeakPolarHBondContact CE2-OD2 3.47Å; Y2523-D2526 PolarHBondContact OH-OD1 3.09Å; Y2523-D2526 PolarHBondContact OH-OD2 3.05Å; Y2523-D2526 VanDerWaalsContact OH-OD2 3.11Å; V2524-D2526 PolarHBondContact O-N 3.09Å; V2524-D2526 VanDerWaalsContact O-N 3.13Å; D2526-R2557 VanDerWaalsContact CA-NH2 3.26Å; D2526-R2557 VanDerWaalsContact CB-CZ 3.44Å; D2526-R2557 VanDerWaalsContact CB-NH2 3.34Å; D2526-R2557 VanDerWaalsContact O-CZ 3.31Å; D2526-R2557 PolarHBondContact O-NE 3.44Å; D2526-R2557 VanDerWaalsContact O-NE 3.15Å; D2526-R2557 PolarHBondContact O-NH2 2.82Å; D2526-R2557 IonicContact OD1-CZ 3.71Å; D2526-R2557 IonicContact OD1-NH1 2.8Å; D2526-R2557 PolarHBondContact OD1-NH1 3.43Å; D2526-R2557 IonicContact OD1-NH2 2.65Å; D2526-R2557 PolarHBondContact OD1-NH2 2.86Å; D2526-R2557 IonicContact OD2-CZ 3.59Å; D2526-R2557 VanDerWaalsContact OD2-CZ 3.22Å; D2526-R2557 IonicContact OD2-NH1 3.31Å; D2526-R2557 PolarHBondContact OD2-NH1 3.27Å; D2526-R2557 IonicContact OD2-NH2 3.46Å; D2526-R2557 PolarHBondContact OD2-NH2 3.01Å
2527	Y	37.5	Very low	37.9	Very low	166.4 Å²	166.4	119.7 Å²	119.7	65%	0.653	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	5.7	-173.2	-65.3	-90.1	0	0	0	114.6	N2525 W2529 F2556 R2604	N2525-Y2527 PolarHBondContact O-N 2.97Å; N2525-Y2527 VanDerWaalsContact OD1-CD2 3.32Å; N2525-Y2527 WeakPolarHBondContact OD1-CD2 3.27Å; N2525-Y2527 VanDerWaalsContact OD1-CE2 3.3Å; N2525-Y2527 WeakPolarHBondContact OD1-CE2 3.44Å; N2525-Y2527 PolarHBondContact OD1-N 2.9Å; Y2527-W2529 PolarHBondContact O-N 3.14Å; Y2527-F2556 HydrophobicContact CD1-CB 4.27Å; Y2527-F2556 HydrophobicContact CD1-CG 4.28Å; Y2527-F2556 HydrophobicContact CE1-CB 3.76Å; Y2527-F2556 AromaticContact CE1-CD1 3.92Å; Y2527-F2556 HydrophobicContact CE1-CD1 3.92Å; Y2527-F2556 AromaticContact CE1-CD2 3.49Å; Y2527-F2556 HydrophobicContact CE1-CD2 3.49Å; Y2527-F2556 VanDerWaalsContact CE1-CD2 3.49Å; Y2527-F2556 HydrophobicContact CE1-CE1 4.39Å; Y2527-F2556 HydrophobicContact CE1-CE2 4Å; Y2527-F2556 AromaticContact CE1-CG 3.43Å; Y2527-F2556 HydrophobicContact CE1-CG 3.43Å; Y2527-F2556 VanDerWaalsContact CE1-CG 3.43Å; Y2527-F2556 HydrophobicContact CE1-CZ 4.42Å; Y2527-F2556 AromaticContact CZ-CD2 3.72Å; Y2527-F2556 WeakPolarHBondContact OH-CD2 3.32Å; Y2527-F2556 WeakPolarHBondContact OH-CE2 3.34Å; Y2527-R2604 PolarHBondContact O-NH2 3.03Å
2528	A	37.5	Very low	37.8	Very low	64 Å²	64	120.1 Å²	120.1	53%	0.529	66%	0.658	S	S	.	*			trans	-91.2	109.4	179.4	0	0	0	0	0	112.7	N2525 L2531	N2525-A2528 PolarHBondContact O-N 2.91Å; N2525-A2528 VanDerWaalsContact O-N 3.12Å; A2528-L2531 WeakPolarHBondContact O-CD1 3.38Å
2529	W	38	Very low	38	Very low	188 Å²	188	125.5 Å²	125.5	71%	0.712	68%	0.677	S	S	*	*			trans	-105.7	144.7	170.6	-83	82.9	0	0	0	111.9	Y2527 L2531	Y2527-W2529 PolarHBondContact O-N 3.14Å; W2529-L2531 HydrophobicContact CD2-CD1 4.22Å; W2529-L2531 HydrophobicContact CE3-CD1 4.1Å; W2529-L2531 HydrophobicContact CG-CD1 4.21Å; W2529-L2531 HydrophobicContact CZ2-CD1 4.22Å; W2529-L2531 HydrophobicContact CZ3-CD1 4.12Å; W2529-L2531 HydrophobicContact CZ3-CG 4.26Å; W2529-L2531 PolarHBondContact O-N 3.3Å
2530	P	40.8	Very low	37.4	Very low	105.4 Å²	105.4	124 Å²	124	68%	0.684	67%	0.668	S	S	*	*				-86.5	149.3	86.6	15.1	-7.8	0	0	0	112.2
2531	L	37.6	Very low	37.2	Very low	116.4 Å²	116.4	123.4 Å²	123.4	61%	0.609	66%	0.664	S	S	*	*			trans	-70.9	143.6	167.5	-77	79.2	0	0	0	110	A2528 W2529 D2533 I2535	A2528-L2531 WeakPolarHBondContact O-CD1 3.38Å; W2529-L2531 HydrophobicContact CD2-CD1 4.22Å; W2529-L2531 HydrophobicContact CE3-CD1 4.1Å; W2529-L2531 HydrophobicContact CG-CD1 4.21Å; W2529-L2531 HydrophobicContact CZ2-CD1 4.22Å; W2529-L2531 HydrophobicContact CZ3-CD1 4.12Å; W2529-L2531 HydrophobicContact CZ3-CG 4.26Å; W2529-L2531 PolarHBondContact O-N 3.3Å; L2531-D2533 PolarHBondContact O-N 2.93Å; L2531-I2535 HydrophobicContact CD2-CD1 3.98Å; L2531-I2535 HydrophobicContact CD2-CG2 4.3Å
2532	P	39.9	Very low	37	Very low	96 Å²	96	121.3 Å²	121.3	62%	0.623	66%	0.661	S	S	*	*			trans	-62.9	142.2	169.1	-20.8	33.4	0	0	0	112	S2534 I2535	P2532-S2534 WeakPolarHBondContact CB-OG 3.19Å; P2532-S2534 PolarHBondContact O-N 3.04Å; P2532-S2534 VanDerWaalsContact O-N 3.17Å; P2532-S2534 PolarHBondContact O-OG 2.87Å; P2532-S2534 VanDerWaalsContact O-OG 3.13Å; P2532-I2535 PolarHBondContact O-N 2.94Å; P2532-I2535 VanDerWaalsContact O-N 3.15Å
2533	D	39.1	Very low	37	Very low	132 Å²	132	124.7 Å²	124.7	71%	0.706	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	12.5	-174.9	-61.6	-61.7	0	0	0	114.9	L2531 I2535 S2536 R2557 R2564	L2531-D2533 PolarHBondContact O-N 2.93Å; D2533-I2535 PolarHBondContact O-N 3.18Å; D2533-I2535 VanDerWaalsContact O-N 3.08Å; D2533-S2536 VanDerWaalsContact O-CB 3.31Å; D2533-S2536 WeakPolarHBondContact O-CB 3.48Å; D2533-S2536 PolarHBondContact O-N 3.07Å; D2533-S2536 PolarHBondContact O-OG 3.19Å; D2533-R2557 IonicContact OD2-CZ 2.82Å; D2533-R2557 VanDerWaalsContact OD2-CZ 3.32Å; D2533-R2557 IonicContact OD2-NH1 3.38Å; D2533-R2557 PolarHBondContact OD2-NH1 2.92Å; D2533-R2557 IonicContact OD2-NH2 3.15Å; D2533-R2557 PolarHBondContact OD2-NH2 2.72Å; D2533-R2564 VanDerWaalsContact CG-NH1 3.32Å; D2533-R2564 IonicContact OD1-CZ 3.5Å; D2533-R2564 IonicContact OD1-NH1 3.42Å; D2533-R2564 PolarHBondContact OD1-NH1 3.2Å; D2533-R2564 IonicContact OD1-NH2 3.34Å; D2533-R2564 PolarHBondContact OD1-NH2 3.25Å; D2533-R2564 IonicContact OD2-CZ 3.4Å; D2533-R2564 IonicContact OD2-NH1 2.66Å; D2533-R2564 IonicContact OD2-NH2 3.56Å; D2533-R2564 PolarHBondContact OD2-NH2 2.99Å
2534	S	39.5	Very low	36.9	Very low	95.6 Å²	95.6	123.1 Å²	123.1	67%	0.669	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	0.8	-172.8	59.8	0	0	0	0	115.9	P2532	P2532-S2534 WeakPolarHBondContact CB-OG 3.19Å; P2532-S2534 PolarHBondContact O-N 3.04Å; P2532-S2534 VanDerWaalsContact O-N 3.17Å; P2532-S2534 PolarHBondContact O-OG 2.87Å; P2532-S2534 VanDerWaalsContact O-OG 3.13Å
2535	I	38.9	Very low	37	Very low	132.2 Å²	132.2	125 Å²	125	68%	0.678	67%	0.666	S	S	*	*	S	Bend	trans	-108.1	14.8	177.5	-54	179.6	0	0	0	111.8	L2531 P2532 D2533 C2537	L2531-I2535 HydrophobicContact CD2-CD1 3.98Å; L2531-I2535 HydrophobicContact CD2-CG2 4.3Å; P2532-I2535 PolarHBondContact O-N 2.94Å; P2532-I2535 VanDerWaalsContact O-N 3.15Å; D2533-I2535 PolarHBondContact O-N 3.18Å; D2533-I2535 VanDerWaalsContact O-N 3.08Å; I2535-C2537 PolarHBondContact O-N 3.06Å; I2535-C2537 VanDerWaalsContact O-N 3.08Å
2536	S	34.9	Very low	37.1	Very low	95 Å²	95	128.5 Å²	128.5	66%	0.664	68%	0.679	S	S	*	*			trans	-83	81.2	171.7	54.1	0	0	0	0	112.2	D2533 N2538	D2533-S2536 VanDerWaalsContact O-CB 3.31Å; D2533-S2536 WeakPolarHBondContact O-CB 3.48Å; D2533-S2536 PolarHBondContact O-N 3.07Å; D2533-S2536 PolarHBondContact O-OG 3.19Å; S2536-N2538 VanDerWaalsContact C-N 3.26Å; S2536-N2538 PolarHBondContact O-N 3.37Å
2537	C	32.2	Very low	36.9	Very low	98.2 Å²	98.2	129.8 Å²	129.8	66%	0.664	69%	0.686	S	S	*	*			trans	-89	49.5	-176.1	-165.8	0	0	0	0	113.4	I2535 K2545	I2535-C2537 PolarHBondContact O-N 3.06Å; I2535-C2537 VanDerWaalsContact O-N 3.08Å; C2537-K2545 WeakPolarHBondContact SG-CE 3.5Å
2538	N	34	Very low	36.8	Very low	152.2 Å²	152.2	129.4 Å²	129.4	81%	0.814	69%	0.692	S	S	*	*	S	Bend	trans	-133.9	35.2	-179.6	-92.8	-19.5	0	0	0	113.4	S2536	S2536-N2538 VanDerWaalsContact C-N 3.26Å; S2536-N2538 PolarHBondContact O-N 3.37Å
2539	Q	37.7	Very low	37.1	Very low	186.2 Å²	186.2	132 Å²	132	87%	0.87	70%	0.701	S	S	*	*	S	Bend	trans	-148.7	26.4	178	-74.6	-175.8	17.4	0	0	115.6
2540	F	31.8	Very low	37.5	Very low	161.2 Å²	161.2	129.9 Å²	129.9	71%	0.707	70%	0.703	S	S	*	*			trans	-116.3	117	169.5	-82.3	-72.1	0	0	0	112.3	Q2544	F2540-Q2544 VanDerWaalsContact CD1-OE1 3.29Å
2541	S	32.3	Very low	37.8	Very low	85 Å²	85	129.6 Å²	129.6	59%	0.594	70%	0.701	S	S	*	*			trans	-68.1	156.1	176.3	-173.4	0	0	0	0	111.7	E2543 Q2544	S2541-E2543 VanDerWaalsContact C-N 3.29Å; S2541-E2543 PolarHBondContact O-N 3.11Å; S2541-E2543 VanDerWaalsContact O-N 3.12Å; S2541-Q2544 PolarHBondContact O-N 2.84Å; S2541-Q2544 VanDerWaalsContact O-N 3.14Å
2542	S	36.4	Very low	38.3	Very low	94.4 Å²	94.4	132 Å²	132	66%	0.66	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-15.7	8.4	175.1	39.1	0	0	0	0	116.3	Q2544	S2542-Q2544 PolarHBondContact O-N 3.15Å
2543	E	37.1	Very low	38.7	Very low	165.6 Å²	165.6	130.8 Å²	130.8	77%	0.774	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-39.8	1.7	166.2	-61.1	-174.1	152.8	0	0	116.4	S2541 K2545 Q2546	S2541-E2543 VanDerWaalsContact C-N 3.29Å; S2541-E2543 PolarHBondContact O-N 3.11Å; S2541-E2543 VanDerWaalsContact O-N 3.12Å; E2543-K2545 VanDerWaalsContact C-N 3.33Å; E2543-K2545 PolarHBondContact O-N 3.09Å; E2543-Q2546 PolarHBondContact O-N 3.03Å
2544	Q	39	Very low	39.5	Very low	138.8 Å²	138.8	126.7 Å²	126.7	65%	0.649	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-83.7	24.4	167.2	-81.6	178.7	0.9	0	0	114.8	F2540 S2541 S2542 Q2546 N2547	F2540-Q2544 VanDerWaalsContact CD1-OE1 3.29Å; S2541-Q2544 PolarHBondContact O-N 2.84Å; S2541-Q2544 VanDerWaalsContact O-N 3.14Å; S2542-Q2544 PolarHBondContact O-N 3.15Å; Q2544-Q2546 VanDerWaalsContact C-N 3.31Å; Q2544-Q2546 PolarHBondContact O-N 3.12Å; Q2544-N2547 PolarHBondContact O-N 3.32Å
2545	K	36.7	Very low	40.6	Very low	150 Å²	150	124.9 Å²	124.9	65%	0.652	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-56.9	3.5	168	-70.5	-178.3	176.2	176.6	0	114.1	Y2469 C2537 E2543 N2547	Y2469-K2545 HydrophobicContact CE2-CB 4.38Å; Y2469-K2545 HydrophobicContact CE2-CD 4.03Å; Y2469-K2545 WeakPolarHBondContact OH-CD 3.07Å; C2537-K2545 WeakPolarHBondContact SG-CE 3.5Å; E2543-K2545 VanDerWaalsContact C-N 3.33Å; E2543-K2545 PolarHBondContact O-N 3.09Å; K2545-N2547 PolarHBondContact O-N 3.01Å
2546	Q	38.5	Very low	41.6	Very low	177.6 Å²	177.6	125.7 Å²	125.7	83%	0.83	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-42.3	15.8	170.9	-61.5	-173.7	-1.2	0	0	114.9	E2543 Q2544	E2543-Q2546 PolarHBondContact O-N 3.03Å; Q2544-Q2546 VanDerWaalsContact C-N 3.31Å; Q2544-Q2546 PolarHBondContact O-N 3.12Å
2547	N	36.2	Very low	42.8	Very low	125.6 Å²	125.6	127.4 Å²	127.4	67%	0.672	66%	0.656	S	S	*	*			trans	-122.1	35.7	170	-81.2	-28	0	0	0	112.8	I2196 P2468 Q2544 K2545 V2549	I2196-N2547 HydrophobicContact CB-CB 4.04Å; I2196-N2547 HydrophobicContact CG2-CB 3.69Å; P2468-N2547 WeakPolarHBondContact CB-OD1 3.37Å; P2468-N2547 WeakPolarHBondContact CG-OD1 3.46Å; Q2544-N2547 PolarHBondContact O-N 3.32Å; K2545-N2547 PolarHBondContact O-N 3.01Å; N2547-V2549 VanDerWaalsContact C-N 3.35Å; N2547-V2549 PolarHBondContact O-N 3.02Å
2548	M	35.7	Very low	44.3	Very low	157.8 Å²	157.8	125.8 Å²	125.8	78%	0.777	64%	0.64	S	S	*	*			trans	-83.1	108.3	177.1	-68.4	-148.8	76.7	0	0	111.3	L2550	M2548-L2550 VanDerWaalsContact C-N 3.35Å; M2548-L2550 PolarHBondContact O-N 3.34Å; M2548-L2550 VanDerWaalsContact O-N 3.09Å
2549	V	42.1	Very low	45.8	Very low	119.2 Å²	119.2	122.6 Å²	122.6	72%	0.722	62%	0.623	S	S	*	*			trans	-65.3	104	168.5	-179.9	0	0	0	0	108.3	N2547 P2551	N2547-V2549 VanDerWaalsContact C-N 3.35Å; N2547-V2549 PolarHBondContact O-N 3.02Å; V2549-P2551 VanDerWaalsContact O-CD 3.23Å; V2549-P2551 WeakPolarHBondContact O-CD 3.48Å
2550	L	46.7	Very low	47.3	Very low	143.4 Å²	143.4	118.2 Å²	118.2	75%	0.751	61%	0.611	S	S	*	*			trans	-51.6	127.1	173.8	-77.7	152.4	0	0	0	109.7	M2548 K2552	M2548-L2550 VanDerWaalsContact C-N 3.35Å; M2548-L2550 PolarHBondContact O-N 3.34Å; M2548-L2550 VanDerWaalsContact O-N 3.09Å; L2550-K2552 PolarHBondContact O-N 3.2Å; L2550-K2552 VanDerWaalsContact O-N 3.07Å
2551	P	47.4	Very low	49	Very low	98.2 Å²	98.2	116.1 Å²	116.1	64%	0.638	60%	0.603	S	S	*	*			trans	-63.3	113.8	-177.6	25	-33.1	0	0	0	109.1	V2549 S2553 P2560	V2549-P2551 VanDerWaalsContact O-CD 3.23Å; V2549-P2551 WeakPolarHBondContact O-CD 3.48Å; P2551-S2553 PolarHBondContact O-N 3.19Å; P2551-S2553 VanDerWaalsContact O-N 3.1Å; P2551-P2560 HydrophobicContact CB-CG 4.35Å
2552	K	47.9	Very low	50.6	Low	167.2 Å²	167.2	114.2 Å²	114.2	73%	0.727	59%	0.586	S	S	*	*			trans	-54.9	120.8	-178.1	-67.8	179.9	-179.3	178	0	109.4	L2550 S2554	L2550-K2552 PolarHBondContact O-N 3.2Å; L2550-K2552 VanDerWaalsContact O-N 3.07Å; K2552-S2554 VanDerWaalsContact C-N 3.35Å; K2552-S2554 PolarHBondContact O-N 3.18Å; K2552-S2554 VanDerWaalsContact O-N 3.16Å
2553	S	48.8	Very low	52.1	Low	72.2 Å²	72.2	113 Å²	113	51%	0.505	57%	0.572	S	S	.	*			trans	-66.2	102.3	176.3	52	0	0	0	0	109.5	P2551 L2555 R2557	P2551-S2553 PolarHBondContact O-N 3.19Å; P2551-S2553 VanDerWaalsContact O-N 3.1Å; S2553-L2555 PolarHBondContact O-N 3.28Å; S2553-R2557 CarbonylContact C-O 3.57Å; S2553-R2557 WeakPolarHBondContact CA-O 3.48Å
2554	S	56.3	Low	53.7	Low	44.6 Å²	44.6	112.6 Å²	112.6	31%	0.312	56%	0.563	S	S	.	*			trans	-88.2	143.6	172.4	169.6	0	0	0	0	108.6	K2552 F2556 R2557	K2552-S2554 VanDerWaalsContact C-N 3.35Å; K2552-S2554 PolarHBondContact O-N 3.18Å; K2552-S2554 VanDerWaalsContact O-N 3.16Å; S2554-F2556 PolarHBondContact O-N 3.02Å; S2554-F2556 VanDerWaalsContact O-N 3.1Å; S2554-F2556 PolarHBondContact OG-N 3.12Å; S2554-R2557 PolarHBondContact N-O 3.21Å; S2554-R2557 CarbonylContact O-C 3.59Å; S2554-R2557 WeakPolarHBondContact O-CB 3.48Å; S2554-R2557 PolarHBondContact O-N 3.19Å; S2554-R2557 PolarHBondContact OG-N 3.22Å
2555	L	62.4	Low	55.1	Low	58.8 Å²	58.8	109.3 Å²	109.3	31%	0.308	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-29.5	175.8	-169.8	93.3	0	0	0	111.7	S2553 R2557 L2558 L2563 Y2578 P2597 L2630 F2633 L2637	S2553-L2555 PolarHBondContact O-N 3.28Å; L2555-R2557 PolarHBondContact O-N 2.91Å; L2555-L2558 HydrophobicContact CD1-CD1 3.53Å; L2555-L2558 HydrophobicContact CD1-CG 4.38Å; L2555-L2558 HydrophobicContact CG-CD1 4.09Å; L2555-L2558 VanDerWaalsContact O-CB 3.25Å; L2555-L2558 WeakPolarHBondContact O-CB 3.39Å; L2555-L2558 WeakPolarHBondContact O-CG 3.46Å; L2555-L2558 PolarHBondContact O-N 3.32Å; L2555-L2563 HydrophobicContact CD2-CD1 4.3Å; L2555-L2563 HydrophobicContact CG-CD1 4.15Å; L2555-L2563 WeakPolarHBondContact O-CD1 3.27Å; L2555-Y2578 HydrophobicContact CD1-CD2 4.17Å; L2555-Y2578 HydrophobicContact CD2-CD2 4.41Å; L2555-Y2578 HydrophobicContact CD2-CE1 4.35Å; L2555-Y2578 WeakPolarHBondContact CD2-OH 3.22Å; L2555-Y2578 WeakPolarHBondContact CG-OH 3.21Å; L2555-Y2578 PolarHBondContact O-OH 3.45Å; L2555-P2597 HydrophobicContact CD1-CB 4.11Å; L2555-P2597 HydrophobicContact CD2-CB 3.88Å; L2555-P2597 HydrophobicContact CD2-CG 3.78Å; L2555-P2597 HydrophobicContact CG-CB 4.42Å; L2555-L2630 HydrophobicContact CD1-CD1 3.49Å; L2555-L2630 VanDerWaalsContact CD1-CD1 3.49Å; L2555-F2633 HydrophobicContact CD2-CD1 3.66Å; L2555-F2633 HydrophobicContact CD2-CE1 3.52Å; L2555-L2637 HydrophobicContact CD2-CD1 4.04Å
2556	F	59.1	Low	56.6	Low	149 Å²	149	103.8 Å²	103.8	65%	0.654	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.7	178.4	-53.5	-69.9	0	0	0	114.6	Y2527 S2554 L2563 Y2578	Y2527-F2556 HydrophobicContact CD1-CB 4.27Å; Y2527-F2556 HydrophobicContact CD1-CG 4.28Å; Y2527-F2556 HydrophobicContact CE1-CB 3.76Å; Y2527-F2556 AromaticContact CE1-CD1 3.92Å; Y2527-F2556 HydrophobicContact CE1-CD1 3.92Å; Y2527-F2556 AromaticContact CE1-CD2 3.49Å; Y2527-F2556 HydrophobicContact CE1-CD2 3.49Å; Y2527-F2556 VanDerWaalsContact CE1-CD2 3.49Å; Y2527-F2556 HydrophobicContact CE1-CE1 4.39Å; Y2527-F2556 HydrophobicContact CE1-CE2 4Å; Y2527-F2556 AromaticContact CE1-CG 3.43Å; Y2527-F2556 HydrophobicContact CE1-CG 3.43Å; Y2527-F2556 VanDerWaalsContact CE1-CG 3.43Å; Y2527-F2556 HydrophobicContact CE1-CZ 4.42Å; Y2527-F2556 AromaticContact CZ-CD2 3.72Å; Y2527-F2556 WeakPolarHBondContact OH-CD2 3.32Å; Y2527-F2556 WeakPolarHBondContact OH-CE2 3.34Å; S2554-F2556 PolarHBondContact O-N 3.02Å; S2554-F2556 VanDerWaalsContact O-N 3.1Å; S2554-F2556 PolarHBondContact OG-N 3.12Å; F2556-L2563 HydrophobicContact CD1-CD1 4.38Å; F2556-Y2578 WeakPolarHBondContact CA-OH 3.25Å; F2556-Y2578 HydrophobicContact CD1-CE1 4.39Å; F2556-Y2578 WeakPolarHBondContact CD1-OH 3.36Å; F2556-Y2578 HydrophobicContact CE1-CE1 4.49Å; F2556-Y2578 PolarHBondContact N-OH 2.73Å
2557	R	61.1	Low	58.2	Low	131.2 Å²	131.2	99.7 Å²	99.7	50%	0.495	51%	0.511	S	S	.	.			trans	-104.6	86.7	172	-74.6	-174.2	170.3	-171.8	-3	110.5	D2526 D2533 S2553 S2554 L2555	D2526-R2557 VanDerWaalsContact CA-NH2 3.26Å; D2526-R2557 VanDerWaalsContact CB-CZ 3.44Å; D2526-R2557 VanDerWaalsContact CB-NH2 3.34Å; D2526-R2557 VanDerWaalsContact O-CZ 3.31Å; D2526-R2557 PolarHBondContact O-NE 3.44Å; D2526-R2557 VanDerWaalsContact O-NE 3.15Å; D2526-R2557 PolarHBondContact O-NH2 2.82Å; D2526-R2557 IonicContact OD1-CZ 3.71Å; D2526-R2557 IonicContact OD1-NH1 2.8Å; D2526-R2557 PolarHBondContact OD1-NH1 3.43Å; D2526-R2557 IonicContact OD1-NH2 2.65Å; D2526-R2557 PolarHBondContact OD1-NH2 2.86Å; D2526-R2557 IonicContact OD2-CZ 3.59Å; D2526-R2557 VanDerWaalsContact OD2-CZ 3.22Å; D2526-R2557 IonicContact OD2-NH1 3.31Å; D2526-R2557 PolarHBondContact OD2-NH1 3.27Å; D2526-R2557 IonicContact OD2-NH2 3.46Å; D2526-R2557 PolarHBondContact OD2-NH2 3.01Å; D2533-R2557 IonicContact OD2-CZ 2.82Å; D2533-R2557 VanDerWaalsContact OD2-CZ 3.32Å; D2533-R2557 IonicContact OD2-NH1 3.38Å; D2533-R2557 PolarHBondContact OD2-NH1 2.92Å; D2533-R2557 IonicContact OD2-NH2 3.15Å; D2533-R2557 PolarHBondContact OD2-NH2 2.72Å; S2553-R2557 CarbonylContact C-O 3.57Å; S2553-R2557 WeakPolarHBondContact CA-O 3.48Å; S2554-R2557 PolarHBondContact N-O 3.21Å; S2554-R2557 CarbonylContact O-C 3.59Å; S2554-R2557 WeakPolarHBondContact O-CB 3.48Å; S2554-R2557 PolarHBondContact O-N 3.19Å; S2554-R2557 PolarHBondContact OG-N 3.22Å; L2555-R2557 PolarHBondContact O-N 2.91Å
2558	L	63.1	Low	59.8	Low	62.6 Å²	62.6	98.7 Å²	98.7	33%	0.328	51%	0.505	S	S	.	.			trans	-61	140.4	169.5	-63.2	179.4	0	0	0	110.1	L2555 N2562 L2563 I2575 Y2578	L2555-L2558 HydrophobicContact CD1-CD1 3.53Å; L2555-L2558 HydrophobicContact CD1-CG 4.38Å; L2555-L2558 HydrophobicContact CG-CD1 4.09Å; L2555-L2558 VanDerWaalsContact O-CB 3.25Å; L2555-L2558 WeakPolarHBondContact O-CB 3.39Å; L2555-L2558 WeakPolarHBondContact O-CG 3.46Å; L2555-L2558 PolarHBondContact O-N 3.32Å; L2558-N2562 HydrophobicContact CB-CB 4.42Å; L2558-N2562 HydrophobicContact CD2-CB 4.41Å; L2558-L2563 HydrophobicContact CB-CB 4.11Å; L2558-L2563 HydrophobicContact CB-CD1 4.43Å; L2558-L2563 HydrophobicContact CD1-CB 4.47Å; L2558-I2575 HydrophobicContact CD1-CD1 4.23Å; L2558-I2575 HydrophobicContact CD1-CG1 4.02Å; L2558-I2575 HydrophobicContact CD1-CG2 3.92Å; L2558-I2575 HydrophobicContact CD2-CB 4.38Å; L2558-I2575 HydrophobicContact CD2-CD1 4.05Å; L2558-I2575 HydrophobicContact CD2-CG1 4.01Å; L2558-I2575 HydrophobicContact CD2-CG2 3.48Å; L2558-I2575 VanDerWaalsContact CD2-CG2 3.44Å; L2558-I2575 HydrophobicContact CG-CG2 4.32Å; L2558-Y2578 HydrophobicContact CD2-CE2 4.21Å
2559	N	65	Low	61.4	Low	85.4 Å²	85.4	92.7 Å²	92.7	46%	0.457	48%	0.479	S	S	.	.			trans	-50.6	133.6	167.4	176.6	-39.8	0	0	0	109.1	H2561 N2562 L2563	N2559-H2561 PolarHBondContact O-N 3.32Å; N2559-H2561 VanDerWaalsContact OD1-CB 3.31Å; N2559-H2561 WeakPolarHBondContact OD1-CB 3.33Å; N2559-H2561 PolarHBondContact OD1-N 2.88Å; N2559-H2561 VanDerWaalsContact OD1-N 3.14Å; N2559-N2562 HydrophobicContact CB-CB 4.44Å; N2559-N2562 CarbonylContact O-C 3.56Å; N2559-N2562 WeakPolarHBondContact O-CA 3.44Å; N2559-N2562 PolarHBondContact O-N 3.06Å; N2559-L2563 WeakPolarHBondContact O-CB 3.04Å; N2559-L2563 PolarHBondContact O-N 3.28Å
2560	P	69.4	Low	62.5	Low	95.4 Å²	95.4	89.9 Å²	89.9	62%	0.619	47%	0.468	S	S	*	.	H	α-helix	trans	-51.5	-30.7	-178	-11.4	9.8	0	0	0	114.6	P2551 R2564	P2551-P2560 HydrophobicContact CB-CG 4.35Å; P2560-R2564 VanDerWaalsContact O-CB 3.28Å; P2560-R2564 WeakPolarHBondContact O-CB 3.44Å; P2560-R2564 PolarHBondContact O-N 3.08Å
2561	H	66.7	Low	63.3	Low	116.2 Å²	116.2	85.6 Å²	85.6	54%	0.538	46%	0.459	S	S	.	.	H	α-helix	trans	-65.3	-48.4	172.6	-174.2	-73.5	0	0	0	112.2	N2559 L2563 R2564 L2565	N2559-H2561 PolarHBondContact O-N 3.32Å; N2559-H2561 VanDerWaalsContact OD1-CB 3.31Å; N2559-H2561 WeakPolarHBondContact OD1-CB 3.33Å; N2559-H2561 PolarHBondContact OD1-N 2.88Å; N2559-H2561 VanDerWaalsContact OD1-N 3.14Å; H2561-L2563 VanDerWaalsContact C-N 3.31Å; H2561-L2563 PolarHBondContact O-N 3.41Å; H2561-R2564 WeakPolarHBondContact O-CB 3.28Å; H2561-R2564 PolarHBondContact O-N 3.14Å; H2561-R2564 VanDerWaalsContact O-N 3.14Å; H2561-L2565 VanDerWaalsContact CE1-CD1 3.47Å; H2561-L2565 WeakPolarHBondContact CE1-CD1 3.17Å; H2561-L2565 WeakPolarHBondContact O-CB 3.49Å; H2561-L2565 WeakPolarHBondContact O-CG 3.38Å; H2561-L2565 PolarHBondContact O-N 3.06Å
2562	N	66	Low	63.9	Low	45 Å²	45	90.3 Å²	90.3	24%	0.241	46%	0.464	C	S	.	.	H	α-helix	trans	-69.2	-35.4	178	-65.5	-4.3	0	0	0	111.5	L2558 N2559 L2565 T2566	L2558-N2562 HydrophobicContact CB-CB 4.42Å; L2558-N2562 HydrophobicContact CD2-CB 4.41Å; N2559-N2562 HydrophobicContact CB-CB 4.44Å; N2559-N2562 CarbonylContact O-C 3.56Å; N2559-N2562 WeakPolarHBondContact O-CA 3.44Å; N2559-N2562 PolarHBondContact O-N 3.06Å; N2562-L2565 PolarHBondContact O-N 3Å; N2562-T2566 VanDerWaalsContact O-CB 3.31Å; N2562-T2566 WeakPolarHBondContact O-CB 3.35Å; N2562-T2566 WeakPolarHBondContact O-CG2 3.47Å; N2562-T2566 PolarHBondContact O-N 3.25Å; N2562-T2566 PolarHBondContact O-OG1 3.13Å
2563	L	69.7	Low	64.5	Low	69.4 Å²	69.4	90.8 Å²	90.8	36%	0.363	46%	0.462	S	S	.	.	H	α-helix	trans	-61.8	-47.4	171.9	-177.2	130	0	0	0	110.8	L2555 F2556 L2558 N2559 H2561 L2565 T2566 I2567	L2555-L2563 HydrophobicContact CD2-CD1 4.3Å; L2555-L2563 HydrophobicContact CG-CD1 4.15Å; L2555-L2563 WeakPolarHBondContact O-CD1 3.27Å; F2556-L2563 HydrophobicContact CD1-CD1 4.38Å; L2558-L2563 HydrophobicContact CB-CB 4.11Å; L2558-L2563 HydrophobicContact CB-CD1 4.43Å; L2558-L2563 HydrophobicContact CD1-CB 4.47Å; N2559-L2563 WeakPolarHBondContact O-CB 3.04Å; N2559-L2563 PolarHBondContact O-N 3.28Å; H2561-L2563 VanDerWaalsContact C-N 3.31Å; H2561-L2563 PolarHBondContact O-N 3.41Å; L2563-L2565 VanDerWaalsContact C-N 3.33Å; L2563-L2565 PolarHBondContact O-N 2.83Å; L2563-T2566 WeakPolarHBondContact CA-OG1 3.47Å; L2563-T2566 PolarHBondContact O-N 3.15Å; L2563-T2566 VanDerWaalsContact O-N 3.12Å; L2563-T2566 PolarHBondContact O-OG1 3.34Å; L2563-T2566 VanDerWaalsContact O-OG1 3.1Å; L2563-I2567 HydrophobicContact CD2-CD1 3.58Å; L2563-I2567 HydrophobicContact CD2-CG1 4.5Å; L2563-I2567 HydrophobicContact CG-CD1 3.97Å; L2563-I2567 WeakPolarHBondContact O-CB 3.4Å; L2563-I2567 WeakPolarHBondContact O-CD1 3.43Å; L2563-I2567 VanDerWaalsContact O-CG1 3.3Å; L2563-I2567 WeakPolarHBondContact O-CG1 3.38Å; L2563-I2567 PolarHBondContact O-N 3.19Å
2564	R	69.8	Low	65.1	Low	157.2 Å²	157.2	94 Å²	94	59%	0.593	47%	0.469	S	S	*	.	H	α-helix	trans	-60.1	-43.9	174.7	-173.1	177.2	-177.5	172.1	2.4	111.6	D2533 P2560 H2561 T2566 I2567 L2568	D2533-R2564 VanDerWaalsContact CG-NH1 3.32Å; D2533-R2564 IonicContact OD1-CZ 3.5Å; D2533-R2564 IonicContact OD1-NH1 3.42Å; D2533-R2564 PolarHBondContact OD1-NH1 3.2Å; D2533-R2564 IonicContact OD1-NH2 3.34Å; D2533-R2564 PolarHBondContact OD1-NH2 3.25Å; D2533-R2564 IonicContact OD2-CZ 3.4Å; D2533-R2564 IonicContact OD2-NH1 2.66Å; D2533-R2564 IonicContact OD2-NH2 3.56Å; D2533-R2564 PolarHBondContact OD2-NH2 2.99Å; P2560-R2564 VanDerWaalsContact O-CB 3.28Å; P2560-R2564 WeakPolarHBondContact O-CB 3.44Å; P2560-R2564 PolarHBondContact O-N 3.08Å; H2561-R2564 WeakPolarHBondContact O-CB 3.28Å; H2561-R2564 PolarHBondContact O-N 3.14Å; H2561-R2564 VanDerWaalsContact O-N 3.14Å; R2564-T2566 VanDerWaalsContact C-N 3.34Å; R2564-T2566 PolarHBondContact O-N 3.34Å; R2564-I2567 PolarHBondContact O-N 3.12Å; R2564-L2568 HydrophobicContact CG-CD1 3.89Å; R2564-L2568 HydrophobicContact CG-CG 4.38Å; R2564-L2568 VanDerWaalsContact O-CB 3.27Å; R2564-L2568 WeakPolarHBondContact O-CB 3.37Å; R2564-L2568 VanDerWaalsContact O-CG 3.25Å; R2564-L2568 WeakPolarHBondContact O-CG 3.43Å; R2564-L2568 PolarHBondContact O-N 3.1Å
2565	L	68.7	Low	65.4	Low	70.2 Å²	70.2	95.4 Å²	95.4	37%	0.368	47%	0.472	S	S	.	.	H	α-helix	trans	-64.3	-38.9	175.5	-73.3	174.8	0	0	0	112.9	H2561 N2562 L2563 L2568 S2569	H2561-L2565 VanDerWaalsContact CE1-CD1 3.47Å; H2561-L2565 WeakPolarHBondContact CE1-CD1 3.17Å; H2561-L2565 WeakPolarHBondContact O-CB 3.49Å; H2561-L2565 WeakPolarHBondContact O-CG 3.38Å; H2561-L2565 PolarHBondContact O-N 3.06Å; N2562-L2565 PolarHBondContact O-N 3Å; L2563-L2565 VanDerWaalsContact C-N 3.33Å; L2563-L2565 PolarHBondContact O-N 2.83Å; L2565-L2568 PolarHBondContact O-N 2.96Å; L2565-S2569 WeakPolarHBondContact O-CB 3.44Å; L2565-S2569 PolarHBondContact O-N 3.04Å; L2565-S2569 VanDerWaalsContact O-N 3.11Å; L2565-S2569 PolarHBondContact O-OG 2.97Å
2566	T	68.9	Low	65.1	Low	33.8 Å²	33.8	97.6 Å²	97.6	21%	0.207	49%	0.49	C	S	.	.	H	α-helix	trans	-67.8	-42.9	177.4	-41.5	0	0	0	0	111	N2562 L2563 R2564 L2568 S2569 A2570 G2571 I2575 L2630 A2634	N2562-T2566 VanDerWaalsContact O-CB 3.31Å; N2562-T2566 WeakPolarHBondContact O-CB 3.35Å; N2562-T2566 WeakPolarHBondContact O-CG2 3.47Å; N2562-T2566 PolarHBondContact O-N 3.25Å; N2562-T2566 PolarHBondContact O-OG1 3.13Å; L2563-T2566 WeakPolarHBondContact CA-OG1 3.47Å; L2563-T2566 PolarHBondContact O-N 3.15Å; L2563-T2566 VanDerWaalsContact O-N 3.12Å; L2563-T2566 PolarHBondContact O-OG1 3.34Å; L2563-T2566 VanDerWaalsContact O-OG1 3.1Å; R2564-T2566 VanDerWaalsContact C-N 3.34Å; R2564-T2566 PolarHBondContact O-N 3.34Å; T2566-L2568 PolarHBondContact O-N 3.33Å; T2566-S2569 WeakPolarHBondContact CA-OG 3.06Å; T2566-S2569 CarbonylContact O-C 3.54Å; T2566-S2569 PolarHBondContact O-N 3.15Å; T2566-S2569 VanDerWaalsContact O-N 3.11Å; T2566-S2569 PolarHBondContact O-OG 3.27Å; T2566-A2570 VanDerWaalsContact O-CB 3.3Å; T2566-A2570 WeakPolarHBondContact O-CB 3.33Å; T2566-A2570 PolarHBondContact O-N 3.24Å; T2566-G2571 PolarHBondContact O-N 3.2Å; T2566-I2575 HydrophobicContact CG2-CD1 4.26Å; T2566-I2575 HydrophobicContact CG2-CG1 4.2Å; T2566-L2630 HydrophobicContact CG2-CD1 4.5Å; T2566-A2634 HydrophobicContact CG2-CB 4.06Å
2567	I	71.9	Confident	65	Low	90.8 Å²	90.8	93.8 Å²	93.8	47%	0.466	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-47.4	174.6	-68.3	169	0	0	0	111.1	L2563 R2564 S2569 A2570 G2571 L2637 R2638	L2563-I2567 HydrophobicContact CD2-CD1 3.58Å; L2563-I2567 HydrophobicContact CD2-CG1 4.5Å; L2563-I2567 HydrophobicContact CG-CD1 3.97Å; L2563-I2567 WeakPolarHBondContact O-CB 3.4Å; L2563-I2567 WeakPolarHBondContact O-CD1 3.43Å; L2563-I2567 VanDerWaalsContact O-CG1 3.3Å; L2563-I2567 WeakPolarHBondContact O-CG1 3.38Å; L2563-I2567 PolarHBondContact O-N 3.19Å; R2564-I2567 PolarHBondContact O-N 3.12Å; I2567-S2569 VanDerWaalsContact C-N 3.28Å; I2567-S2569 PolarHBondContact O-N 3.26Å; I2567-S2569 VanDerWaalsContact O-N 3.08Å; I2567-A2570 WeakPolarHBondContact O-CA 3.25Å; I2567-A2570 PolarHBondContact O-N 3.21Å; I2567-G2571 PolarHBondContact O-N 3.48Å; I2567-L2637 HydrophobicContact CD1-CB 4.11Å; I2567-L2637 HydrophobicContact CD1-CD1 3.75Å; I2567-L2637 HydrophobicContact CG1-CB 4.05Å; I2567-L2637 HydrophobicContact CG1-CD1 4.02Å; I2567-L2637 HydrophobicContact CG2-CB 4.47Å; I2567-R2638 HydrophobicContact CG2-CB 3.85Å; I2567-R2638 HydrophobicContact CG2-CG 4.23Å; I2567-R2638 PolarHBondContact O-NH1 2.96Å
2568	L	69.9	Low	64.9	Low	104.2 Å²	104.2	91.4 Å²	91.4	55%	0.546	48%	0.483	S	S	.	.	H	α-helix	trans	-64.9	-21.4	177	-72.2	173	0	0	0	113.3	R2564 L2565 T2566 A2570 R2572 R2638	R2564-L2568 HydrophobicContact CG-CD1 3.89Å; R2564-L2568 HydrophobicContact CG-CG 4.38Å; R2564-L2568 VanDerWaalsContact O-CB 3.27Å; R2564-L2568 WeakPolarHBondContact O-CB 3.37Å; R2564-L2568 VanDerWaalsContact O-CG 3.25Å; R2564-L2568 WeakPolarHBondContact O-CG 3.43Å; R2564-L2568 PolarHBondContact O-N 3.1Å; L2565-L2568 PolarHBondContact O-N 2.96Å; T2566-L2568 PolarHBondContact O-N 3.33Å; L2568-A2570 VanDerWaalsContact C-N 3.32Å; L2568-R2572 WeakPolarHBondContact O-CD 3.37Å; L2568-R2572 WeakPolarHBondContact O-CG 3.33Å; L2568-R2572 VanDerWaalsContact O-CZ 3.25Å; L2568-R2572 PolarHBondContact O-N 2.91Å; L2568-R2572 PolarHBondContact O-NE 2.87Å; L2568-R2572 PolarHBondContact O-NH2 3.5Å; L2568-R2638 VanDerWaalsContact C-NH1 3.3Å; L2568-R2638 PolarHBondContact O-NH1 2.94Å
2569	S	68.6	Low	64.6	Low	31.8 Å²	31.8	90.8 Å²	90.8	22%	0.222	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-6.1	173.3	81.8	0	0	0	0	113.6	L2565 T2566 I2567 G2571 R2572 R2573	L2565-S2569 WeakPolarHBondContact O-CB 3.44Å; L2565-S2569 PolarHBondContact O-N 3.04Å; L2565-S2569 VanDerWaalsContact O-N 3.11Å; L2565-S2569 PolarHBondContact O-OG 2.97Å; T2566-S2569 WeakPolarHBondContact CA-OG 3.06Å; T2566-S2569 CarbonylContact O-C 3.54Å; T2566-S2569 PolarHBondContact O-N 3.15Å; T2566-S2569 VanDerWaalsContact O-N 3.11Å; T2566-S2569 PolarHBondContact O-OG 3.27Å; I2567-S2569 VanDerWaalsContact C-N 3.28Å; I2567-S2569 PolarHBondContact O-N 3.26Å; I2567-S2569 VanDerWaalsContact O-N 3.08Å; S2569-G2571 PolarHBondContact O-N 3.21Å; S2569-G2571 VanDerWaalsContact O-N 3.13Å; S2569-R2572 VanDerWaalsContact O-CB 3.25Å; S2569-R2572 WeakPolarHBondContact O-CB 3.33Å; S2569-R2572 VanDerWaalsContact O-CG 3.27Å; S2569-R2572 WeakPolarHBondContact O-CG 3.44Å; S2569-R2572 PolarHBondContact O-N 2.96Å; S2569-R2573 WeakPolarHBondContact OG-CB 3.46Å; S2569-R2573 PolarHBondContact OG-N 3.39Å
2570	A	65.8	Low	64.3	Low	60.4 Å²	60.4	89.4 Å²	89.4	50%	0.499	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	8.7	35.7	-178.2	0	0	0	0	0	112.6	T2566 I2567 L2568 R2572 R2573 A2634 V2635 R2638	T2566-A2570 VanDerWaalsContact O-CB 3.3Å; T2566-A2570 WeakPolarHBondContact O-CB 3.33Å; T2566-A2570 PolarHBondContact O-N 3.24Å; I2567-A2570 WeakPolarHBondContact O-CA 3.25Å; I2567-A2570 PolarHBondContact O-N 3.21Å; L2568-A2570 VanDerWaalsContact C-N 3.32Å; A2570-R2572 VanDerWaalsContact C-N 3.3Å; A2570-R2572 PolarHBondContact O-N 2.98Å; A2570-R2572 VanDerWaalsContact O-N 3.13Å; A2570-R2573 PolarHBondContact O-N 3.15Å; A2570-A2634 VanDerWaalsContact CB-C 3.42Å; A2570-A2634 HydrophobicContact CB-CB 3.35Å; A2570-V2635 HydrophobicContact CB-CG2 4Å; A2570-R2638 PolarHBondContact O-NH1 3.07Å
2571	G	62.1	Low	63.8	Low	54.6 Å²	54.6	90.8 Å²	90.8	56%	0.563	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	-1.3	-176.9	0	0	0	0	0	115.4	T2566 I2567 S2569 R2573 R2596	T2566-G2571 PolarHBondContact O-N 3.2Å; I2567-G2571 PolarHBondContact O-N 3.48Å; S2569-G2571 PolarHBondContact O-N 3.21Å; S2569-G2571 VanDerWaalsContact O-N 3.13Å; G2571-R2573 VanDerWaalsContact C-N 3.3Å; G2571-R2573 PolarHBondContact O-N 3.03Å; G2571-R2596 PolarHBondContact O-NH1 3.09Å; G2571-R2596 VanDerWaalsContact O-NH1 3.12Å
2572	R	61.6	Low	63.2	Low	196.4 Å²	196.4	91.6 Å²	91.6	74%	0.741	48%	0.475	S	S	*	.			trans	-77	-9.6	177.1	-63.2	-179	-170.9	179.5	5.1	114	L2568 S2569 A2570	L2568-R2572 WeakPolarHBondContact O-CD 3.37Å; L2568-R2572 WeakPolarHBondContact O-CG 3.33Å; L2568-R2572 VanDerWaalsContact O-CZ 3.25Å; L2568-R2572 PolarHBondContact O-N 2.91Å; L2568-R2572 PolarHBondContact O-NE 2.87Å; L2568-R2572 PolarHBondContact O-NH2 3.5Å; S2569-R2572 VanDerWaalsContact O-CB 3.25Å; S2569-R2572 WeakPolarHBondContact O-CB 3.33Å; S2569-R2572 VanDerWaalsContact O-CG 3.27Å; S2569-R2572 WeakPolarHBondContact O-CG 3.44Å; S2569-R2572 PolarHBondContact O-N 2.96Å; A2570-R2572 VanDerWaalsContact C-N 3.3Å; A2570-R2572 PolarHBondContact O-N 2.98Å; A2570-R2572 VanDerWaalsContact O-N 3.13Å
2573	R	59.9	Low	62.5	Low	177 Å²	177	95.7 Å²	95.7	67%	0.668	49%	0.491	S	S	*	.	S	Bend	trans	-100.7	132.2	172.2	-72.1	-178.6	174.1	-169.2	-2.1	110	S2569 A2570 G2571 I2575 R2596	S2569-R2573 WeakPolarHBondContact OG-CB 3.46Å; S2569-R2573 PolarHBondContact OG-N 3.39Å; A2570-R2573 PolarHBondContact O-N 3.15Å; G2571-R2573 VanDerWaalsContact C-N 3.3Å; G2571-R2573 PolarHBondContact O-N 3.03Å; R2573-I2575 PolarHBondContact O-N 3.32Å; R2573-R2596 PolarHBondContact O-NH1 3.27Å
2574	E	60.4	Low	61.6	Low	140.6 Å²	140.6	99.5 Å²	99.5	66%	0.657	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-63.6	137.9	171.1	-63	-170.6	151.9	0	0	110.2	P2576 V2580	E2574-P2576 VanDerWaalsContact O-CD 3.28Å; E2574-P2576 WeakPolarHBondContact O-CD 3.48Å; E2574-V2580 HydrophobicContact CG-CG2 4.16Å; E2574-V2580 WeakPolarHBondContact OE1-CB 3.39Å; E2574-V2580 VanDerWaalsContact OE1-CG2 3.3Å; E2574-V2580 WeakPolarHBondContact OE1-CG2 3.38Å
2575	I	62.9	Low	60.6	Low	73.8 Å²	73.8	96.9 Å²	96.9	38%	0.378	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-75.2	125.3	178.2	-65.3	168.2	0	0	0	107.3	L2558 T2566 R2573 G2577 Y2578	L2558-I2575 HydrophobicContact CD1-CD1 4.23Å; L2558-I2575 HydrophobicContact CD1-CG1 4.02Å; L2558-I2575 HydrophobicContact CD1-CG2 3.92Å; L2558-I2575 HydrophobicContact CD2-CB 4.38Å; L2558-I2575 HydrophobicContact CD2-CD1 4.05Å; L2558-I2575 HydrophobicContact CD2-CG1 4.01Å; L2558-I2575 HydrophobicContact CD2-CG2 3.48Å; L2558-I2575 VanDerWaalsContact CD2-CG2 3.44Å; L2558-I2575 HydrophobicContact CG-CG2 4.32Å; T2566-I2575 HydrophobicContact CG2-CD1 4.26Å; T2566-I2575 HydrophobicContact CG2-CG1 4.2Å; R2573-I2575 PolarHBondContact O-N 3.32Å; I2575-G2577 PolarHBondContact O-N 3.11Å; I2575-G2577 VanDerWaalsContact O-N 3.08Å; I2575-Y2578 HydrophobicContact CB-CD2 4.44Å; I2575-Y2578 HydrophobicContact CG2-CD2 3.67Å; I2575-Y2578 HydrophobicContact CG2-CE2 4.38Å; I2575-Y2578 HydrophobicContact CG2-CG 4.24Å; I2575-Y2578 VanDerWaalsContact O-CB 3.31Å; I2575-Y2578 WeakPolarHBondContact O-CB 3.34Å; I2575-Y2578 PolarHBondContact O-N 3.05Å
2576	P	55.6	Low	59.9	Low	105.2 Å²	105.2	98 Å²	98	68%	0.683	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	118.6	177.9	-27.1	35.9	0	0	0	111.6	E2574	E2574-P2576 VanDerWaalsContact O-CD 3.28Å; E2574-P2576 WeakPolarHBondContact O-CD 3.48Å
2577	G	58.6	Low	59.1	Low	67.6 Å²	67.6	104.1 Å²	104.1	70%	0.697	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.2	-6.4	-175.1	0	0	0	0	0	115.6	I2575 D2579 N2598	I2575-G2577 PolarHBondContact O-N 3.11Å; I2575-G2577 VanDerWaalsContact O-N 3.08Å; G2577-D2579 PolarHBondContact O-N 3.39Å; G2577-D2579 VanDerWaalsContact O-N 3.16Å; G2577-N2598 WeakPolarHBondContact CA-ND2 3.47Å; G2577-N2598 PolarHBondContact O-N 2.72Å
2578	Y	57.7	Low	58.3	Low	81.4 Å²	81.4	103.4 Å²	103.4	32%	0.319	54%	0.537	S	S	.	.			trans	-90.1	119.8	168.5	-163.2	-98.6	0	0	0	110.2	L2555 F2556 L2558 I2575 V2580 K2583 S2595 R2596 P2597	L2555-Y2578 HydrophobicContact CD1-CD2 4.17Å; L2555-Y2578 HydrophobicContact CD2-CD2 4.41Å; L2555-Y2578 HydrophobicContact CD2-CE1 4.35Å; L2555-Y2578 WeakPolarHBondContact CD2-OH 3.22Å; L2555-Y2578 WeakPolarHBondContact CG-OH 3.21Å; L2555-Y2578 PolarHBondContact O-OH 3.45Å; F2556-Y2578 WeakPolarHBondContact CA-OH 3.25Å; F2556-Y2578 HydrophobicContact CD1-CE1 4.39Å; F2556-Y2578 WeakPolarHBondContact CD1-OH 3.36Å; F2556-Y2578 HydrophobicContact CE1-CE1 4.49Å; F2556-Y2578 PolarHBondContact N-OH 2.73Å; L2558-Y2578 HydrophobicContact CD2-CE2 4.21Å; I2575-Y2578 HydrophobicContact CB-CD2 4.44Å; I2575-Y2578 HydrophobicContact CG2-CD2 3.67Å; I2575-Y2578 HydrophobicContact CG2-CE2 4.38Å; I2575-Y2578 HydrophobicContact CG2-CG 4.24Å; I2575-Y2578 VanDerWaalsContact O-CB 3.31Å; I2575-Y2578 WeakPolarHBondContact O-CB 3.34Å; I2575-Y2578 PolarHBondContact O-N 3.05Å; Y2578-V2580 HydrophobicContact CD1-CG2 4.27Å; Y2578-V2580 HydrophobicContact CE1-CB 4.49Å; Y2578-V2580 HydrophobicContact CE1-CG2 3.96Å; Y2578-V2580 PolarHBondContact O-N 3.47Å; Y2578-K2583 VanDerWaalsContact OH-CD 3.25Å; Y2578-K2583 WeakPolarHBondContact OH-CD 3.33Å; Y2578-K2583 PolarHBondContact OH-NZ 2.79Å; Y2578-S2595 PolarHBondContact OH-O 3.47Å; Y2578-R2596 CarbonylContact C-O 3.51Å; Y2578-R2596 HydrophobicContact CE1-CG 3.8Å; Y2578-R2596 VanDerWaalsContact CE1-NE 3.27Å; Y2578-R2596 HydrophobicContact CE2-CG 4.41Å; Y2578-R2596 VanDerWaalsContact OH-CG 3.24Å; Y2578-R2596 WeakPolarHBondContact OH-CG 3.47Å; Y2578-P2597 HydrophobicContact CD1-CB 4.19Å; Y2578-P2597 HydrophobicContact CE1-CB 4.03Å
2579	D	58.4	Low	57.4	Low	50.2 Å²	50.2	104.8 Å²	104.8	27%	0.268	55%	0.545	S	S	.	.			trans	-105.7	117.1	-179.8	179.7	-30.6	0	0	0	109.4	G2577 E2581 K2582 S2595 R2596	G2577-D2579 PolarHBondContact O-N 3.39Å; G2577-D2579 VanDerWaalsContact O-N 3.16Å; D2579-E2581 VanDerWaalsContact C-N 3.31Å; D2579-E2581 PolarHBondContact O-N 3.4Å; D2579-E2581 WeakPolarHBondContact OD1-CA 3.35Å; D2579-E2581 WeakPolarHBondContact OD1-CB 3.29Å; D2579-E2581 PolarHBondContact OD1-N 3.02Å; D2579-K2582 HydrophobicContact CB-CB 4.27Å; D2579-K2582 HydrophobicContact CB-CD 4.02Å; D2579-K2582 HydrophobicContact CB-CG 4.13Å; D2579-K2582 WeakPolarHBondContact O-CB 3.48Å; D2579-K2582 PolarHBondContact O-N 2.8Å; D2579-K2582 WeakPolarHBondContact OD1-CB 3.09Å; D2579-K2582 WeakPolarHBondContact OD1-CG 3.26Å; D2579-K2582 PolarHBondContact OD1-N 3.15Å; D2579-K2582 WeakPolarHBondContact OD2-CD 3.18Å; D2579-K2582 WeakPolarHBondContact OD2-CE 3.33Å; D2579-K2582 WeakPolarHBondContact OD2-CG 3.4Å; D2579-K2582 IonicContact OD2-NZ 3.01Å; D2579-K2582 PolarHBondContact OD2-NZ 3.17Å; D2579-S2595 CarbonylContact O-C 3.48Å; D2579-S2595 WeakPolarHBondContact O-CA 3.34Å; D2579-S2595 WeakPolarHBondContact O-CB 3.5Å; D2579-R2596 PolarHBondContact N-O 2.78Å; D2579-R2596 PolarHBondContact O-N 3.21Å
2580	V	58.4	Low	56.8	Low	55.2 Å²	55.2	109.7 Å²	109.7	34%	0.335	56%	0.559	S	S	.	*	S	Bend	trans	-70.7	-28.8	-177.4	-178.1	0	0	0	0	111.6	E2574 Y2578 K2582 K2583 R2584 S2595	E2574-V2580 HydrophobicContact CG-CG2 4.16Å; E2574-V2580 WeakPolarHBondContact OE1-CB 3.39Å; E2574-V2580 VanDerWaalsContact OE1-CG2 3.3Å; E2574-V2580 WeakPolarHBondContact OE1-CG2 3.38Å; Y2578-V2580 HydrophobicContact CD1-CG2 4.27Å; Y2578-V2580 HydrophobicContact CE1-CB 4.49Å; Y2578-V2580 HydrophobicContact CE1-CG2 3.96Å; Y2578-V2580 PolarHBondContact O-N 3.47Å; V2580-K2582 VanDerWaalsContact C-N 3.29Å; V2580-K2582 PolarHBondContact O-N 2.75Å; V2580-K2583 WeakPolarHBondContact O-CB 3.09Å; V2580-K2583 PolarHBondContact O-N 3.15Å; V2580-K2583 VanDerWaalsContact O-N 3.13Å; V2580-R2584 PolarHBondContact O-N 3.03Å; V2580-S2595 WeakPolarHBondContact CG1-OG 3.49Å; V2580-S2595 WeakPolarHBondContact CG2-OG 3.33Å; V2580-S2595 PolarHBondContact O-OG 2.88Å
2581	E	57.2	Low	56.3	Low	126 Å²	126	113.4 Å²	113.4	59%	0.589	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-76.1	-33.8	-176.6	-54.9	-154.8	136.5	0	0	112	D2579 K2583 R2584 L2585	D2579-E2581 VanDerWaalsContact C-N 3.31Å; D2579-E2581 PolarHBondContact O-N 3.4Å; D2579-E2581 WeakPolarHBondContact OD1-CA 3.35Å; D2579-E2581 WeakPolarHBondContact OD1-CB 3.29Å; D2579-E2581 PolarHBondContact OD1-N 3.02Å; E2581-K2583 PolarHBondContact O-N 3.16Å; E2581-K2583 VanDerWaalsContact O-N 3.15Å; E2581-R2584 CarbonylContact O-C 3.5Å; E2581-R2584 WeakPolarHBondContact O-CA 3.4Å; E2581-R2584 WeakPolarHBondContact O-CB 3.33Å; E2581-R2584 PolarHBondContact O-N 3.05Å; E2581-R2584 IonicContact OE1-NH1 3.08Å; E2581-R2584 PolarHBondContact OE1-NH1 3.43Å; E2581-L2585 WeakPolarHBondContact O-CG 3.36Å; E2581-L2585 PolarHBondContact O-N 3.17Å
2582	K	54.4	Low	55.6	Low	133.2 Å²	133.2	117.4 Å²	117.4	58%	0.579	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-61.2	-13.5	173.3	-71.3	-178.2	-178.5	88	0	113.9	D2579 V2580 S2586 R2596	D2579-K2582 HydrophobicContact CB-CB 4.27Å; D2579-K2582 HydrophobicContact CB-CD 4.02Å; D2579-K2582 HydrophobicContact CB-CG 4.13Å; D2579-K2582 WeakPolarHBondContact O-CB 3.48Å; D2579-K2582 PolarHBondContact O-N 2.8Å; D2579-K2582 WeakPolarHBondContact OD1-CB 3.09Å; D2579-K2582 WeakPolarHBondContact OD1-CG 3.26Å; D2579-K2582 PolarHBondContact OD1-N 3.15Å; D2579-K2582 WeakPolarHBondContact OD2-CD 3.18Å; D2579-K2582 WeakPolarHBondContact OD2-CE 3.33Å; D2579-K2582 WeakPolarHBondContact OD2-CG 3.4Å; D2579-K2582 IonicContact OD2-NZ 3.01Å; D2579-K2582 PolarHBondContact OD2-NZ 3.17Å; V2580-K2582 VanDerWaalsContact C-N 3.29Å; V2580-K2582 PolarHBondContact O-N 2.75Å; K2582-S2586 PolarHBondContact O-N 3.28Å; K2582-S2586 VanDerWaalsContact O-N 3.11Å; K2582-S2586 PolarHBondContact O-OG 3.46Å; K2582-R2596 WeakPolarHBondContact O-CD 3.13Å; K2582-R2596 PolarHBondContact O-NE 3.01Å; K2582-R2596 PolarHBondContact O-NH1 2.87Å
2583	K	52.3	Low	55.2	Low	130.2 Å²	130.2	114 Å²	114	57%	0.566	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-83.5	-19.8	170.8	-133.2	-173.8	-179.2	-179.7	0	113.6	Y2578 V2580 E2581 L2585 S2586 W2590 P2593 S2595	Y2578-K2583 VanDerWaalsContact OH-CD 3.25Å; Y2578-K2583 WeakPolarHBondContact OH-CD 3.33Å; Y2578-K2583 PolarHBondContact OH-NZ 2.79Å; V2580-K2583 WeakPolarHBondContact O-CB 3.09Å; V2580-K2583 PolarHBondContact O-N 3.15Å; V2580-K2583 VanDerWaalsContact O-N 3.13Å; E2581-K2583 PolarHBondContact O-N 3.16Å; E2581-K2583 VanDerWaalsContact O-N 3.15Å; K2583-L2585 PolarHBondContact O-N 3.13Å; K2583-S2586 PolarHBondContact O-OG 3.33Å; K2583-S2586 VanDerWaalsContact O-OG 3.1Å; K2583-W2590 VanDerWaalsContact NZ-CZ2 3.35Å; K2583-W2590 VanDerWaalsContact NZ-CZ3 3.34Å; K2583-P2593 VanDerWaalsContact CE-O 3.27Å; K2583-P2593 WeakPolarHBondContact CE-O 3.39Å; K2583-P2593 PolarHBondContact NZ-O 3.45Å; K2583-S2595 WeakPolarHBondContact CD-O 3.49Å
2584	R	50.5	Low	54.8	Low	149 Å²	149	108.5 Å²	108.5	56%	0.562	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-31.2	177	-65.1	-170.1	135.5	101.6	1.6	112.9	V2580 E2581 S2586 V2792	V2580-R2584 PolarHBondContact O-N 3.03Å; E2581-R2584 CarbonylContact O-C 3.5Å; E2581-R2584 WeakPolarHBondContact O-CA 3.4Å; E2581-R2584 WeakPolarHBondContact O-CB 3.33Å; E2581-R2584 PolarHBondContact O-N 3.05Å; E2581-R2584 IonicContact OE1-NH1 3.08Å; E2581-R2584 PolarHBondContact OE1-NH1 3.43Å; R2584-S2586 PolarHBondContact O-N 3.03Å; R2584-S2586 VanDerWaalsContact O-N 3.17Å; R2584-V2792 VanDerWaalsContact O-CG1 3.28Å; R2584-V2792 WeakPolarHBondContact O-CG1 3.23Å
2585	L	49.2	Very low	54.6	Low	102.8 Å²	102.8	105.1 Å²	105.1	54%	0.538	55%	0.552	S	S	.	*			trans	-69.5	85.4	175.6	-65.2	169.9	0	0	0	112.7	E2581 K2583 Q2587 V2588	E2581-L2585 WeakPolarHBondContact O-CG 3.36Å; E2581-L2585 PolarHBondContact O-N 3.17Å; K2583-L2585 PolarHBondContact O-N 3.13Å; L2585-Q2587 HydrophobicContact CB-CB 4.12Å; L2585-Q2587 HydrophobicContact CB-CG 4.44Å; L2585-Q2587 PolarHBondContact O-N 3.09Å; L2585-Q2587 VanDerWaalsContact O-N 3.1Å; L2585-V2588 HydrophobicContact CB-CB 4.26Å; L2585-V2588 HydrophobicContact CB-CG2 3.61Å; L2585-V2588 HydrophobicContact CD1-CG2 3.72Å; L2585-V2588 HydrophobicContact CG-CG2 4.31Å; L2585-V2588 CarbonylContact O-C 3.57Å; L2585-V2588 PolarHBondContact O-N 2.88Å
2586	S	53.8	Low	54.3	Low	94 Å²	94	107.3 Å²	107.3	66%	0.657	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-3.5	168.5	52.2	0	0	0	0	113.2	K2582 K2583 R2584 V2588 W2790	K2582-S2586 PolarHBondContact O-N 3.28Å; K2582-S2586 VanDerWaalsContact O-N 3.11Å; K2582-S2586 PolarHBondContact O-OG 3.46Å; K2583-S2586 PolarHBondContact O-OG 3.33Å; K2583-S2586 VanDerWaalsContact O-OG 3.1Å; R2584-S2586 PolarHBondContact O-N 3.03Å; R2584-S2586 VanDerWaalsContact O-N 3.17Å; S2586-V2588 VanDerWaalsContact C-N 3.26Å; S2586-V2588 PolarHBondContact O-N 2.98Å; S2586-W2790 WeakPolarHBondContact OG-CZ3 3.13Å
2587	Q	52.6	Low	54.5	Low	161.6 Å²	161.6	104.8 Å²	104.8	76%	0.755	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-9.3	179.4	-95.3	171.5	-6.2	0	0	113.7	L2585 N2589 W2790	L2585-Q2587 HydrophobicContact CB-CB 4.12Å; L2585-Q2587 HydrophobicContact CB-CG 4.44Å; L2585-Q2587 PolarHBondContact O-N 3.09Å; L2585-Q2587 VanDerWaalsContact O-N 3.1Å; Q2587-N2589 PolarHBondContact O-N 3.2Å; Q2587-W2790 HydrophobicContact CB-CE3 4.42Å; Q2587-W2790 HydrophobicContact CB-CH2 4.36Å; Q2587-W2790 HydrophobicContact CB-CZ3 3.78Å; Q2587-W2790 HydrophobicContact CG-CE3 4.18Å; Q2587-W2790 HydrophobicContact CG-CH2 3.76Å; Q2587-W2790 HydrophobicContact CG-CZ2 4.48Å; Q2587-W2790 HydrophobicContact CG-CZ3 3.58Å
2588	V	53.7	Low	54.9	Low	76.4 Å²	76.4	105.5 Å²	105.5	46%	0.463	53%	0.528	S	S	.	.	S	Bend	trans	-84.8	102.1	174.9	178.5	0	0	0	0	108.9	L2585 S2586 W2590 R2596	L2585-V2588 HydrophobicContact CB-CB 4.26Å; L2585-V2588 HydrophobicContact CB-CG2 3.61Å; L2585-V2588 HydrophobicContact CD1-CG2 3.72Å; L2585-V2588 HydrophobicContact CG-CG2 4.31Å; L2585-V2588 CarbonylContact O-C 3.57Å; L2585-V2588 PolarHBondContact O-N 2.88Å; S2586-V2588 VanDerWaalsContact C-N 3.26Å; S2586-V2588 PolarHBondContact O-N 2.98Å; V2588-W2590 PolarHBondContact O-N 3.13Å; V2588-R2596 PolarHBondContact O-NH2 3.08Å
2589	N	51.8	Low	55.5	Low	132.4 Å²	132.4	106.5 Å²	106.5	71%	0.708	53%	0.534	S	S	*	.			trans	-61.7	113.2	177.2	-171.3	36.8	0	0	0	111	Q2587 L2591	Q2587-N2589 PolarHBondContact O-N 3.2Å; N2589-L2591 WeakPolarHBondContact O-CD2 3.39Å; N2589-L2591 WeakPolarHBondContact O-CG 3.03Å; N2589-L2591 PolarHBondContact O-N 3.16Å
2590	W	55.3	Low	55.9	Low	135.6 Å²	135.6	105.9 Å²	105.9	51%	0.514	54%	0.536	S	S	.	.			trans	-72.5	118.3	-179.7	-137.9	-73.7	0	0	0	109.5	K2583 V2588 Y2592 S2594 R2596 P2597	K2583-W2590 VanDerWaalsContact NZ-CZ2 3.35Å; K2583-W2590 VanDerWaalsContact NZ-CZ3 3.34Å; V2588-W2590 PolarHBondContact O-N 3.13Å; W2590-Y2592 VanDerWaalsContact C-N 3.27Å; W2590-Y2592 HydrophobicContact CZ2-CD2 4.25Å; W2590-Y2592 PolarHBondContact O-N 3.12Å; W2590-Y2592 VanDerWaalsContact O-N 3.14Å; W2590-S2594 PolarHBondContact NE1-O 3.2Å; W2590-R2596 HydrophobicContact CB-CB 4.49Å; W2590-R2596 VanDerWaalsContact CD1-NE 3.29Å; W2590-R2596 HydrophobicContact CD2-CB 3.77Å; W2590-R2596 HydrophobicContact CD2-CG 4.03Å; W2590-R2596 HydrophobicContact CE3-CB 4.22Å; W2590-R2596 HydrophobicContact CE3-CG 4.23Å; W2590-R2596 HydrophobicContact CG-CB 3.91Å; W2590-R2596 HydrophobicContact CG-CG 4.07Å; W2590-R2596 HydrophobicContact CH2-CG 4.35Å; W2590-R2596 HydrophobicContact CZ2-CB 4.44Å; W2590-R2596 HydrophobicContact CZ2-CG 4.34Å; W2590-R2596 HydrophobicContact CZ3-CG 4.27Å; W2590-R2596 VanDerWaalsContact NE1-NE 3.14Å; W2590-P2597 HydrophobicContact CZ2-CG 4.27Å
2591	L	56.8	Low	56.2	Low	137.2 Å²	137.2	107.8 Å²	107.8	72%	0.718	54%	0.541	S	S	*	.	S	Bend	trans	-73	9.5	-170.1	-69.3	153.8	0	0	0	114.5	N2589 F2605	N2589-L2591 WeakPolarHBondContact O-CD2 3.39Å; N2589-L2591 WeakPolarHBondContact O-CG 3.03Å; N2589-L2591 PolarHBondContact O-N 3.16Å; L2591-F2605 HydrophobicContact CB-CE1 3.88Å; L2591-F2605 HydrophobicContact CB-CZ 4.34Å; L2591-F2605 WeakPolarHBondContact O-CE1 3.47Å; L2591-F2605 WeakPolarHBondContact O-CE2 3.45Å; L2591-F2605 WeakPolarHBondContact O-CZ 3.45Å
2592	Y	47.3	Very low	56.7	Low	138.8 Å²	138.8	104.3 Å²	104.3	54%	0.544	53%	0.53	S	S	.	.	S	Bend	trans	-115.5	142.4	178.5	-93.1	-93.8	0	0	0	110.9	W2590 S2594 P2597 C2602 F2605 R2606	W2590-Y2592 VanDerWaalsContact C-N 3.27Å; W2590-Y2592 HydrophobicContact CZ2-CD2 4.25Å; W2590-Y2592 PolarHBondContact O-N 3.12Å; W2590-Y2592 VanDerWaalsContact O-N 3.14Å; Y2592-S2594 PolarHBondContact O-N 3.21Å; Y2592-S2594 VanDerWaalsContact O-N 3.14Å; Y2592-P2597 HydrophobicContact CD1-CB 4.16Å; Y2592-P2597 HydrophobicContact CD1-CG 4.44Å; Y2592-P2597 HydrophobicContact CD2-CB 4.38Å; Y2592-P2597 HydrophobicContact CD2-CG 3.79Å; Y2592-P2597 HydrophobicContact CE2-CG 4.38Å; Y2592-P2597 HydrophobicContact CG-CB 3.9Å; Y2592-P2597 HydrophobicContact CG-CG 3.81Å; Y2592-C2602 HydrophobicContact CE1-CB 4.3Å; Y2592-F2605 HydrophobicContact CD1-CB 3.84Å; Y2592-F2605 AromaticContact CD1-CD1 3.63Å; Y2592-F2605 HydrophobicContact CD1-CD1 3.63Å; Y2592-F2605 HydrophobicContact CD1-CE1 4.42Å; Y2592-F2605 AromaticContact CD1-CG 3.83Å; Y2592-F2605 HydrophobicContact CD1-CG 3.83Å; Y2592-F2605 HydrophobicContact CE1-CB 3.8Å; Y2592-F2605 AromaticContact CE1-CD1 3.38Å; Y2592-F2605 HydrophobicContact CE1-CD1 3.38Å; Y2592-F2605 HydrophobicContact CE1-CE1 4.29Å; Y2592-F2605 AromaticContact CE1-CG 3.88Å; Y2592-F2605 HydrophobicContact CE1-CG 3.88Å; Y2592-R2606 PolarHBondContact OH-NE 2.9Å
2593	P	51.8	Low	57.5	Low	126.4 Å²	126.4	100.1 Å²	100.1	82%	0.821	51%	0.51	S	S	*	.	S	Bend	trans	-74.9	11.8	-177.8	32.2	-37.1	0	0	0	114	K2583	K2583-P2593 VanDerWaalsContact CE-O 3.27Å; K2583-P2593 WeakPolarHBondContact CE-O 3.39Å; K2583-P2593 PolarHBondContact NZ-O 3.45Å
2594	S	52.3	Low	58.2	Low	60.8 Å²	60.8	100.6 Å²	100.6	43%	0.425	51%	0.509	S	S	.	.	S	Bend	trans	-109.8	151.6	177.7	58.8	0	0	0	0	111	W2590 Y2592 R2596 P2597 E2601	W2590-S2594 PolarHBondContact NE1-O 3.2Å; Y2592-S2594 PolarHBondContact O-N 3.21Å; Y2592-S2594 VanDerWaalsContact O-N 3.14Å; S2594-R2596 VanDerWaalsContact C-N 3.27Å; S2594-R2596 PolarHBondContact O-N 3.18Å; S2594-P2597 WeakPolarHBondContact O-CD 3.39Å; S2594-P2597 WeakPolarHBondContact OG-CA 3.4Å; S2594-E2601 WeakPolarHBondContact CB-OE2 3.29Å; S2594-E2601 PolarHBondContact OG-OE2 3.06Å
2595	S	55.1	Low	59.1	Low	68.8 Å²	68.8	98.6 Å²	98.6	48%	0.481	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-55.5	142.1	166.8	-16	0	0	0	0	111.3	Y2578 D2579 V2580 K2583 P2597	Y2578-S2595 PolarHBondContact OH-O 3.47Å; D2579-S2595 CarbonylContact O-C 3.48Å; D2579-S2595 WeakPolarHBondContact O-CA 3.34Å; D2579-S2595 WeakPolarHBondContact O-CB 3.5Å; V2580-S2595 WeakPolarHBondContact CG1-OG 3.49Å; V2580-S2595 WeakPolarHBondContact CG2-OG 3.33Å; V2580-S2595 PolarHBondContact O-OG 2.88Å; K2583-S2595 WeakPolarHBondContact CD-O 3.49Å; S2595-P2597 VanDerWaalsContact O-CD 3.28Å; S2595-P2597 WeakPolarHBondContact O-CD 3.42Å; S2595-P2597 VanDerWaalsContact O-N 3.1Å
2596	R	58.4	Low	60.1	Low	121.2 Å²	121.2	100.7 Å²	100.7	46%	0.457	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-73	115.5	167.4	-84.2	-175.8	179.2	179.7	0.9	108	G2571 R2573 Y2578 D2579 K2582 V2588 W2590 S2594 N2598	G2571-R2596 PolarHBondContact O-NH1 3.09Å; G2571-R2596 VanDerWaalsContact O-NH1 3.12Å; R2573-R2596 PolarHBondContact O-NH1 3.27Å; Y2578-R2596 CarbonylContact C-O 3.51Å; Y2578-R2596 HydrophobicContact CE1-CG 3.8Å; Y2578-R2596 VanDerWaalsContact CE1-NE 3.27Å; Y2578-R2596 HydrophobicContact CE2-CG 4.41Å; Y2578-R2596 VanDerWaalsContact OH-CG 3.24Å; Y2578-R2596 WeakPolarHBondContact OH-CG 3.47Å; D2579-R2596 PolarHBondContact N-O 2.78Å; D2579-R2596 PolarHBondContact O-N 3.21Å; K2582-R2596 WeakPolarHBondContact O-CD 3.13Å; K2582-R2596 PolarHBondContact O-NE 3.01Å; K2582-R2596 PolarHBondContact O-NH1 2.87Å; V2588-R2596 PolarHBondContact O-NH2 3.08Å; W2590-R2596 HydrophobicContact CB-CB 4.49Å; W2590-R2596 VanDerWaalsContact CD1-NE 3.29Å; W2590-R2596 HydrophobicContact CD2-CB 3.77Å; W2590-R2596 HydrophobicContact CD2-CG 4.03Å; W2590-R2596 HydrophobicContact CE3-CB 4.22Å; W2590-R2596 HydrophobicContact CE3-CG 4.23Å; W2590-R2596 HydrophobicContact CG-CB 3.91Å; W2590-R2596 HydrophobicContact CG-CG 4.07Å; W2590-R2596 HydrophobicContact CH2-CG 4.35Å; W2590-R2596 HydrophobicContact CZ2-CB 4.44Å; W2590-R2596 HydrophobicContact CZ2-CG 4.34Å; W2590-R2596 HydrophobicContact CZ3-CG 4.27Å; W2590-R2596 VanDerWaalsContact NE1-NE 3.14Å; S2594-R2596 VanDerWaalsContact C-N 3.27Å; S2594-R2596 PolarHBondContact O-N 3.18Å; R2596-N2598 PolarHBondContact O-N 3.2Å
2597	P	60	Low	60.9	Low	52.6 Å²	52.6	99.2 Å²	99.2	34%	0.342	49%	0.489	S	S	.	.			trans	-61.8	132.4	177.2	25.6	-33.7	0	0	0	109.4	L2555 Y2578 W2590 Y2592 S2594 S2595 E2601 C2602	L2555-P2597 HydrophobicContact CD1-CB 4.11Å; L2555-P2597 HydrophobicContact CD2-CB 3.88Å; L2555-P2597 HydrophobicContact CD2-CG 3.78Å; L2555-P2597 HydrophobicContact CG-CB 4.42Å; Y2578-P2597 HydrophobicContact CD1-CB 4.19Å; Y2578-P2597 HydrophobicContact CE1-CB 4.03Å; W2590-P2597 HydrophobicContact CZ2-CG 4.27Å; Y2592-P2597 HydrophobicContact CD1-CB 4.16Å; Y2592-P2597 HydrophobicContact CD1-CG 4.44Å; Y2592-P2597 HydrophobicContact CD2-CB 4.38Å; Y2592-P2597 HydrophobicContact CD2-CG 3.79Å; Y2592-P2597 HydrophobicContact CE2-CG 4.38Å; Y2592-P2597 HydrophobicContact CG-CB 3.9Å; Y2592-P2597 HydrophobicContact CG-CG 3.81Å; S2594-P2597 WeakPolarHBondContact O-CD 3.39Å; S2594-P2597 WeakPolarHBondContact OG-CA 3.4Å; S2595-P2597 VanDerWaalsContact O-CD 3.28Å; S2595-P2597 WeakPolarHBondContact O-CD 3.42Å; S2595-P2597 VanDerWaalsContact O-N 3.1Å; P2597-E2601 VanDerWaalsContact CA-OE2 3.27Å; P2597-E2601 WeakPolarHBondContact CA-OE2 3.27Å; P2597-E2601 HydrophobicContact CB-CB 4.06Å; P2597-C2602 VanDerWaalsContact CG-SG 3.52Å; P2597-C2602 PolarHBondContact O-SG 2.88Å; P2597-C2602 VanDerWaalsContact O-SG 3.33Å
2598	N	66.3	Low	61.8	Low	82.4 Å²	82.4	95.2 Å²	95.2	44%	0.441	48%	0.479	S	S	.	.			trans	-62.5	159.6	174.4	147.1	5.1	0	0	0	109.5	G2577 R2596 A2600 E2601 C2602	G2577-N2598 WeakPolarHBondContact CA-ND2 3.47Å; G2577-N2598 PolarHBondContact O-N 2.72Å; R2596-N2598 PolarHBondContact O-N 3.2Å; N2598-A2600 VanDerWaalsContact C-N 3.33Å; N2598-A2600 PolarHBondContact O-N 2.94Å; N2598-A2600 WeakPolarHBondContact OD1-CA 3.12Å; N2598-A2600 WeakPolarHBondContact OD1-CB 3.38Å; N2598-A2600 PolarHBondContact OD1-N 3.02Å; N2598-E2601 HydrophobicContact CB-CB 4.34Å; N2598-E2601 HydrophobicContact CB-CG 4.05Å; N2598-E2601 WeakPolarHBondContact CB-OE2 3.45Å; N2598-E2601 PolarHBondContact N-OE2 3.07Å; N2598-E2601 PolarHBondContact ND2-OE1 2.84Å; N2598-E2601 WeakPolarHBondContact O-CA 3.45Å; N2598-E2601 WeakPolarHBondContact O-CB 3.07Å; N2598-E2601 PolarHBondContact O-N 3.09Å; N2598-E2601 VanDerWaalsContact O-N 3.15Å; N2598-E2601 PolarHBondContact OD1-N 3.45Å; N2598-C2602 WeakPolarHBondContact O-CB 3.38Å; N2598-C2602 PolarHBondContact O-N 3.32Å; N2598-C2602 PolarHBondContact O-SG 2.94Å
2599	F	69.8	Low	62.4	Low	101 Å²	101	96.5 Å²	96.5	44%	0.443	48%	0.48	S	S	.	.	H	α-helix	trans	-55.2	-40.3	174.3	179.2	-102.1	0	0	0	111.4	E2601 C2602 W2603 T2639 L2640 C2643	F2599-E2601 VanDerWaalsContact C-N 3.31Å; F2599-E2601 PolarHBondContact O-N 3.28Å; F2599-C2602 WeakPolarHBondContact O-CB 3.24Å; F2599-C2602 PolarHBondContact O-N 2.99Å; F2599-W2603 HydrophobicContact CE1-CB 4.47Å; F2599-W2603 HydrophobicContact CE1-CD2 4.48Å; F2599-W2603 HydrophobicContact CE1-CE3 4.35Å; F2599-W2603 HydrophobicContact CE2-CE3 4.41Å; F2599-W2603 HydrophobicContact CZ-CD2 4.36Å; F2599-W2603 AromaticContact CZ-CE3 3.87Å; F2599-W2603 HydrophobicContact CZ-CE3 3.98Å; F2599-W2603 HydrophobicContact CZ-CZ3 4.41Å; F2599-W2603 WeakPolarHBondContact O-CB 3.34Å; F2599-W2603 PolarHBondContact O-N 3.26Å; F2599-T2639 HydrophobicContact CE2-CG2 4.02Å; F2599-L2640 HydrophobicContact CE1-CD1 3.96Å; F2599-L2640 HydrophobicContact CZ-CD1 4.15Å; F2599-C2643 HydrophobicContact CE1-CB 4.27Å; F2599-C2643 HydrophobicContact CE2-CB 4.25Å; F2599-C2643 VanDerWaalsContact CE2-SG 3.56Å; F2599-C2643 HydrophobicContact CZ-CB 4.09Å; F2599-C2643 VanDerWaalsContact CZ-SG 3.58Å
2600	A	66.5	Low	63.2	Low	38 Å²	38	91.5 Å²	91.5	31%	0.314	45%	0.453	S	S	.	.	H	α-helix	trans	-62	-39.3	176.9	0	0	0	0	0	113.5	N2598 R2604 L2712	N2598-A2600 VanDerWaalsContact C-N 3.33Å; N2598-A2600 PolarHBondContact O-N 2.94Å; N2598-A2600 WeakPolarHBondContact OD1-CA 3.12Å; N2598-A2600 WeakPolarHBondContact OD1-CB 3.38Å; N2598-A2600 PolarHBondContact OD1-N 3.02Å; A2600-R2604 VanDerWaalsContact O-CB 3.28Å; A2600-R2604 WeakPolarHBondContact O-CB 3.35Å; A2600-R2604 WeakPolarHBondContact O-CD 3.35Å; A2600-R2604 VanDerWaalsContact O-CG 3.26Å; A2600-R2604 WeakPolarHBondContact O-CG 3.33Å; A2600-R2604 PolarHBondContact O-N 3.13Å; A2600-L2712 HydrophobicContact CB-CD2 3.86Å
2601	E	64.5	Low	63.3	Low	96.4 Å²	96.4	93.6 Å²	93.6	45%	0.45	46%	0.461	S	S	.	.	H	α-helix	trans	-72.6	-45.9	175.2	-70.6	168.3	162.7	0	0	111.3	S2594 P2597 N2598 F2599 W2603 R2604 F2605	S2594-E2601 WeakPolarHBondContact CB-OE2 3.29Å; S2594-E2601 PolarHBondContact OG-OE2 3.06Å; P2597-E2601 VanDerWaalsContact CA-OE2 3.27Å; P2597-E2601 WeakPolarHBondContact CA-OE2 3.27Å; P2597-E2601 HydrophobicContact CB-CB 4.06Å; N2598-E2601 HydrophobicContact CB-CB 4.34Å; N2598-E2601 HydrophobicContact CB-CG 4.05Å; N2598-E2601 WeakPolarHBondContact CB-OE2 3.45Å; N2598-E2601 PolarHBondContact N-OE2 3.07Å; N2598-E2601 PolarHBondContact ND2-OE1 2.84Å; N2598-E2601 WeakPolarHBondContact O-CA 3.45Å; N2598-E2601 WeakPolarHBondContact O-CB 3.07Å; N2598-E2601 PolarHBondContact O-N 3.09Å; N2598-E2601 VanDerWaalsContact O-N 3.15Å; N2598-E2601 PolarHBondContact OD1-N 3.45Å; F2599-E2601 VanDerWaalsContact C-N 3.31Å; F2599-E2601 PolarHBondContact O-N 3.28Å; E2601-W2603 VanDerWaalsContact C-N 3.27Å; E2601-W2603 PolarHBondContact O-N 3.07Å; E2601-R2604 PolarHBondContact O-N 2.9Å; E2601-F2605 VanDerWaalsContact O-CB 3.24Å; E2601-F2605 WeakPolarHBondContact O-CB 3.32Å; E2601-F2605 PolarHBondContact O-N 3.2Å
2602	C	67.4	Low	63.2	Low	50.6 Å²	50.6	92.1 Å²	92.1	34%	0.342	45%	0.452	S	S	.	.	H	α-helix	trans	-56.4	-42.4	173	-74.7	0	0	0	0	111.5	Y2592 P2597 N2598 F2599 R2606	Y2592-C2602 HydrophobicContact CE1-CB 4.3Å; P2597-C2602 VanDerWaalsContact CG-SG 3.52Å; P2597-C2602 PolarHBondContact O-SG 2.88Å; P2597-C2602 VanDerWaalsContact O-SG 3.33Å; N2598-C2602 WeakPolarHBondContact O-CB 3.38Å; N2598-C2602 PolarHBondContact O-N 3.32Å; N2598-C2602 PolarHBondContact O-SG 2.94Å; F2599-C2602 WeakPolarHBondContact O-CB 3.24Å; F2599-C2602 PolarHBondContact O-N 2.99Å; C2602-R2606 VanDerWaalsContact O-CB 3.3Å; C2602-R2606 WeakPolarHBondContact O-CB 3.26Å; C2602-R2606 VanDerWaalsContact O-CG 3.28Å; C2602-R2606 WeakPolarHBondContact O-CG 3.27Å; C2602-R2606 PolarHBondContact O-N 3.04Å; C2602-R2606 VanDerWaalsContact O-N 3.13Å
2603	W	71.2	Confident	63.2	Low	45 Å²	45	90.9 Å²	90.9	17%	0.17	46%	0.455	C	S	.	.	H	α-helix	trans	-67.2	-52.5	178.7	-176.9	-102.2	0	0	0	112	F2599 E2601 F2605 R2606 L2607 L2636 L2640	F2599-W2603 HydrophobicContact CE1-CB 4.47Å; F2599-W2603 HydrophobicContact CE1-CD2 4.48Å; F2599-W2603 HydrophobicContact CE1-CE3 4.35Å; F2599-W2603 HydrophobicContact CE2-CE3 4.41Å; F2599-W2603 HydrophobicContact CZ-CD2 4.36Å; F2599-W2603 AromaticContact CZ-CE3 3.87Å; F2599-W2603 HydrophobicContact CZ-CE3 3.98Å; F2599-W2603 HydrophobicContact CZ-CZ3 4.41Å; F2599-W2603 WeakPolarHBondContact O-CB 3.34Å; F2599-W2603 PolarHBondContact O-N 3.26Å; E2601-W2603 VanDerWaalsContact C-N 3.27Å; E2601-W2603 PolarHBondContact O-N 3.07Å; W2603-F2605 VanDerWaalsContact C-N 3.32Å; W2603-F2605 PolarHBondContact O-N 3.16Å; W2603-R2606 PolarHBondContact O-N 2.97Å; W2603-R2606 VanDerWaalsContact O-N 3.14Å; W2603-L2607 HydrophobicContact CG-CD1 4.44Å; W2603-L2607 HydrophobicContact CZ2-CD1 4.41Å; W2603-L2607 HydrophobicContact CZ2-CD2 4.3Å; W2603-L2607 HydrophobicContact CZ2-CG 4.48Å; W2603-L2607 VanDerWaalsContact NE1-CD1 3.33Å; W2603-L2607 WeakPolarHBondContact O-CB 3.37Å; W2603-L2607 WeakPolarHBondContact O-CG 3.42Å; W2603-L2607 PolarHBondContact O-N 3.18Å; W2603-L2636 HydrophobicContact CE3-CD2 4.1Å; W2603-L2636 VanDerWaalsContact CH2-C 3.44Å; W2603-L2636 HydrophobicContact CH2-CB 3.79Å; W2603-L2636 HydrophobicContact CH2-CD2 4.43Å; W2603-L2636 VanDerWaalsContact CH2-O 3.25Å; W2603-L2636 WeakPolarHBondContact CH2-O 3.39Å; W2603-L2636 HydrophobicContact CZ3-CB 3.8Å; W2603-L2636 HydrophobicContact CZ3-CD2 3.9Å; W2603-L2636 HydrophobicContact CZ3-CG 4.4Å; W2603-L2636 VanDerWaalsContact CZ3-O 3.28Å; W2603-L2636 WeakPolarHBondContact CZ3-O 3.39Å; W2603-L2640 HydrophobicContact CE3-CB 4.35Å; W2603-L2640 HydrophobicContact CH2-CB 3.48Å; W2603-L2640 VanDerWaalsContact CH2-CB 3.49Å; W2603-L2640 HydrophobicContact CH2-CD2 4.06Å; W2603-L2640 HydrophobicContact CH2-CG 4.34Å; W2603-L2640 HydrophobicContact CZ2-CB 4.09Å; W2603-L2640 HydrophobicContact CZ2-CD2 3.82Å; W2603-L2640 HydrophobicContact CZ2-CG 4.4Å; W2603-L2640 HydrophobicContact CZ3-CB 3.8Å
2604	R	68.4	Low	62.8	Low	141.4 Å²	141.4	89.9 Å²	89.9	53%	0.534	45%	0.45	S	S	.	.	H	α-helix	trans	-59.2	-41.9	176.7	-75	174.6	111.3	108.5	3.3	111.9	Y2527 A2600 E2601 L2607 S2608 F2710	Y2527-R2604 PolarHBondContact O-NH2 3.03Å; A2600-R2604 VanDerWaalsContact O-CB 3.28Å; A2600-R2604 WeakPolarHBondContact O-CB 3.35Å; A2600-R2604 WeakPolarHBondContact O-CD 3.35Å; A2600-R2604 VanDerWaalsContact O-CG 3.26Å; A2600-R2604 WeakPolarHBondContact O-CG 3.33Å; A2600-R2604 PolarHBondContact O-N 3.13Å; E2601-R2604 PolarHBondContact O-N 2.9Å; R2604-L2607 PolarHBondContact O-N 3.13Å; R2604-S2608 VanDerWaalsContact O-CB 3.31Å; R2604-S2608 WeakPolarHBondContact O-CB 3.33Å; R2604-S2608 PolarHBondContact O-N 3.27Å; R2604-S2608 PolarHBondContact O-OG 2.92Å; R2604-F2710 PolarHBondContact NH1-O 3.16Å
2605	F	69.2	Low	62.2	Low	108 Å²	108	97 Å²	97	47%	0.474	47%	0.469	S	S	.	.	H	α-helix	trans	-63.7	-45.5	175	-179.6	-96.4	0	0	0	111.6	L2591 Y2592 E2601 W2603 L2607 S2608 Q2609	L2591-F2605 HydrophobicContact CB-CE1 3.88Å; L2591-F2605 HydrophobicContact CB-CZ 4.34Å; L2591-F2605 WeakPolarHBondContact O-CE1 3.47Å; L2591-F2605 WeakPolarHBondContact O-CE2 3.45Å; L2591-F2605 WeakPolarHBondContact O-CZ 3.45Å; Y2592-F2605 HydrophobicContact CD1-CB 3.84Å; Y2592-F2605 AromaticContact CD1-CD1 3.63Å; Y2592-F2605 HydrophobicContact CD1-CD1 3.63Å; Y2592-F2605 HydrophobicContact CD1-CE1 4.42Å; Y2592-F2605 AromaticContact CD1-CG 3.83Å; Y2592-F2605 HydrophobicContact CD1-CG 3.83Å; Y2592-F2605 HydrophobicContact CE1-CB 3.8Å; Y2592-F2605 AromaticContact CE1-CD1 3.38Å; Y2592-F2605 HydrophobicContact CE1-CD1 3.38Å; Y2592-F2605 HydrophobicContact CE1-CE1 4.29Å; Y2592-F2605 AromaticContact CE1-CG 3.88Å; Y2592-F2605 HydrophobicContact CE1-CG 3.88Å; E2601-F2605 VanDerWaalsContact O-CB 3.24Å; E2601-F2605 WeakPolarHBondContact O-CB 3.32Å; E2601-F2605 PolarHBondContact O-N 3.2Å; W2603-F2605 VanDerWaalsContact C-N 3.32Å; W2603-F2605 PolarHBondContact O-N 3.16Å; F2605-L2607 VanDerWaalsContact C-N 3.32Å; F2605-L2607 PolarHBondContact O-N 3.03Å; F2605-S2608 WeakPolarHBondContact CA-OG 3.27Å; F2605-S2608 PolarHBondContact O-N 3.22Å; F2605-S2608 PolarHBondContact O-OG 3.23Å; F2605-S2608 VanDerWaalsContact O-OG 3.08Å; F2605-Q2609 HydrophobicContact CD1-CG 4.37Å; F2605-Q2609 VanDerWaalsContact CD1-NE2 3.31Å; F2605-Q2609 HydrophobicContact CE1-CG 4.23Å; F2605-Q2609 HydrophobicContact CZ-CG 4.33Å; F2605-Q2609 VanDerWaalsContact CZ-NE2 3.28Å; F2605-Q2609 VanDerWaalsContact O-CG 3.27Å; F2605-Q2609 WeakPolarHBondContact O-CG 3.44Å; F2605-Q2609 PolarHBondContact O-N 3.13Å; F2605-Q2609 PolarHBondContact O-NE2 3.43Å
2606	R	69	Low	61.5	Low	147 Å²	147	102 Å²	102	56%	0.555	49%	0.485	S	S	*	.	H	α-helix	trans	-64.7	-39	177.1	-76.3	-107.8	179.1	-164.6	0.3	112.7	Y2592 C2602 W2603 S2608 Q2609 I2610 L2636	Y2592-R2606 PolarHBondContact OH-NE 2.9Å; C2602-R2606 VanDerWaalsContact O-CB 3.3Å; C2602-R2606 WeakPolarHBondContact O-CB 3.26Å; C2602-R2606 VanDerWaalsContact O-CG 3.28Å; C2602-R2606 WeakPolarHBondContact O-CG 3.27Å; C2602-R2606 PolarHBondContact O-N 3.04Å; C2602-R2606 VanDerWaalsContact O-N 3.13Å; W2603-R2606 PolarHBondContact O-N 2.97Å; W2603-R2606 VanDerWaalsContact O-N 3.14Å; R2606-S2608 VanDerWaalsContact C-N 3.31Å; R2606-S2608 PolarHBondContact O-N 3.01Å; R2606-Q2609 PolarHBondContact O-N 3Å; R2606-Q2609 VanDerWaalsContact O-N 3.13Å; R2606-I2610 WeakPolarHBondContact O-CG1 3.43Å; R2606-I2610 PolarHBondContact O-N 2.86Å; R2606-L2636 HydrophobicContact CB-CD1 3.97Å; R2606-L2636 HydrophobicContact CB-CD2 3.83Å; R2606-L2636 HydrophobicContact CB-CG 4.38Å; R2606-L2636 VanDerWaalsContact CD-CD2 3.45Å; R2606-L2636 HydrophobicContact CG-CD2 4.32Å
2607	L	72	Confident	60.8	Low	62.4 Å²	62.4	104.9 Å²	104.9	33%	0.327	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-41.1	171.9	-72.7	-179.9	0	0	0	112.1	W2603 R2604 F2605 Q2609 I2610 F2633 L2636	W2603-L2607 HydrophobicContact CG-CD1 4.44Å; W2603-L2607 HydrophobicContact CZ2-CD1 4.41Å; W2603-L2607 HydrophobicContact CZ2-CD2 4.3Å; W2603-L2607 HydrophobicContact CZ2-CG 4.48Å; W2603-L2607 VanDerWaalsContact NE1-CD1 3.33Å; W2603-L2607 WeakPolarHBondContact O-CB 3.37Å; W2603-L2607 WeakPolarHBondContact O-CG 3.42Å; W2603-L2607 PolarHBondContact O-N 3.18Å; R2604-L2607 PolarHBondContact O-N 3.13Å; F2605-L2607 VanDerWaalsContact C-N 3.32Å; F2605-L2607 PolarHBondContact O-N 3.03Å; L2607-Q2609 PolarHBondContact O-N 3.11Å; L2607-Q2609 VanDerWaalsContact O-N 3.17Å; L2607-I2610 HydrophobicContact CD2-CD1 4.03Å; L2607-I2610 WeakPolarHBondContact O-CB 3.39Å; L2607-I2610 PolarHBondContact O-N 3.2Å; L2607-I2610 VanDerWaalsContact O-N 3.1Å; L2607-F2633 HydrophobicContact CD2-CD2 4.18Å; L2607-F2633 HydrophobicContact CD2-CE2 4.17Å; L2607-L2636 HydrophobicContact CD2-CD1 4.02Å; L2607-L2636 HydrophobicContact CG-CD1 4.24Å
2608	S	71.3	Confident	59.7	Low	76.4 Å²	76.4	107.8 Å²	107.8	53%	0.534	51%	0.513	S	S	.	.	H	α-helix	trans	-67.9	-16.4	179.4	72.3	0	0	0	0	114.5	R2604 F2605 R2606 I2610	R2604-S2608 VanDerWaalsContact O-CB 3.31Å; R2604-S2608 WeakPolarHBondContact O-CB 3.33Å; R2604-S2608 PolarHBondContact O-N 3.27Å; R2604-S2608 PolarHBondContact O-OG 2.92Å; F2605-S2608 WeakPolarHBondContact CA-OG 3.27Å; F2605-S2608 PolarHBondContact O-N 3.22Å; F2605-S2608 PolarHBondContact O-OG 3.23Å; F2605-S2608 VanDerWaalsContact O-OG 3.08Å; R2606-S2608 VanDerWaalsContact C-N 3.31Å; R2606-S2608 PolarHBondContact O-N 3.01Å; S2608-I2610 VanDerWaalsContact C-N 3.3Å
2609	Q	66.6	Low	58.5	Low	104.2 Å²	104.2	110.3 Å²	110.3	49%	0.487	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-16.9	171.3	-64.2	-77.2	-7.5	0	0	113	F2605 R2606 L2607 R2611	F2605-Q2609 HydrophobicContact CD1-CG 4.37Å; F2605-Q2609 VanDerWaalsContact CD1-NE2 3.31Å; F2605-Q2609 HydrophobicContact CE1-CG 4.23Å; F2605-Q2609 HydrophobicContact CZ-CG 4.33Å; F2605-Q2609 VanDerWaalsContact CZ-NE2 3.28Å; F2605-Q2609 VanDerWaalsContact O-CG 3.27Å; F2605-Q2609 WeakPolarHBondContact O-CG 3.44Å; F2605-Q2609 PolarHBondContact O-N 3.13Å; F2605-Q2609 PolarHBondContact O-NE2 3.43Å; R2606-Q2609 PolarHBondContact O-N 3Å; R2606-Q2609 VanDerWaalsContact O-N 3.13Å; L2607-Q2609 PolarHBondContact O-N 3.11Å; L2607-Q2609 VanDerWaalsContact O-N 3.17Å; Q2609-R2611 VanDerWaalsContact C-N 3.32Å; Q2609-R2611 PolarHBondContact O-N 3.2Å
2610	I	67.3	Low	57	Low	27.8 Å²	27.8	113.3 Å²	113.3	14%	0.143	54%	0.542	C	S	.	.			trans	-81.1	80.8	177	-52.4	172.4	0	0	0	108.6	R2606 L2607 S2608 M2612 D2629 N2632 F2633 L2636	R2606-I2610 WeakPolarHBondContact O-CG1 3.43Å; R2606-I2610 PolarHBondContact O-N 2.86Å; L2607-I2610 HydrophobicContact CD2-CD1 4.03Å; L2607-I2610 WeakPolarHBondContact O-CB 3.39Å; L2607-I2610 PolarHBondContact O-N 3.2Å; L2607-I2610 VanDerWaalsContact O-N 3.1Å; S2608-I2610 VanDerWaalsContact C-N 3.3Å; I2610-M2612 HydrophobicContact CG2-CE 4.23Å; I2610-M2612 PolarHBondContact O-N 3.02Å; I2610-M2612 VanDerWaalsContact O-N 3.1Å; I2610-D2629 HydrophobicContact CG2-CB 4.31Å; I2610-N2632 HydrophobicContact CD1-CB 4.2Å; I2610-N2632 HydrophobicContact CG1-CB 4.39Å; I2610-F2633 HydrophobicContact CD1-CB 4.02Å; I2610-F2633 HydrophobicContact CD1-CD2 3.97Å; I2610-F2633 HydrophobicContact CD1-CG 4.4Å; I2610-F2633 HydrophobicContact CG2-CB 4.32Å; I2610-F2633 HydrophobicContact CG2-CD2 4.31Å; I2610-L2636 HydrophobicContact CD1-CD1 3.61Å; I2610-L2636 VanDerWaalsContact CD1-CD1 3.49Å; I2610-L2636 HydrophobicContact CD1-CG 4.46Å; I2610-L2636 HydrophobicContact CG1-CD1 4.3Å
2611	R	57.4	Low	55.8	Low	180.2 Å²	180.2	118 Å²	118	68%	0.68	56%	0.562	S	S	*	*			trans	-79.2	94.3	172	-68.8	-173.3	-178.2	173.8	1.5	108.9	S2472 Q2609 N2613	S2472-R2611 PolarHBondContact OG-NH1 3.49Å; S2472-R2611 PolarHBondContact OG-NH2 3.42Å; Q2609-R2611 VanDerWaalsContact C-N 3.32Å; Q2609-R2611 PolarHBondContact O-N 3.2Å; R2611-N2613 VanDerWaalsContact C-N 3.3Å; R2611-N2613 PolarHBondContact O-N 2.85Å; R2611-N2613 PolarHBondContact O-ND2 3.3Å
2612	M	55.2	Low	54.7	Low	105.4 Å²	105.4	120.1 Å²	120.1	52%	0.519	58%	0.576	S	S	.	*			trans	-56.7	102.4	162.1	-68	-65.9	-176.5	0	0	108.2	I2610 S2614 F2626 D2629 F2633	I2610-M2612 HydrophobicContact CG2-CE 4.23Å; I2610-M2612 PolarHBondContact O-N 3.02Å; I2610-M2612 VanDerWaalsContact O-N 3.1Å; M2612-S2614 PolarHBondContact O-N 3.11Å; M2612-F2626 HydrophobicContact CE-CE2 4.21Å; M2612-F2626 HydrophobicContact SD-CD2 3.97Å; M2612-F2626 HydrophobicContact SD-CE2 3.79Å; M2612-D2629 HydrophobicContact SD-CB 4.29Å; M2612-F2633 HydrophobicContact CE-CB 4.34Å
2613	N	46.6	Very low	53.4	Low	113.6 Å²	113.6	124.7 Å²	124.7	61%	0.607	60%	0.598	S	S	*	*			trans	-65.3	102.5	-178.8	-75	-46.8	0	0	0	109.6	R2611 Y2615 S2625 D2629	R2611-N2613 VanDerWaalsContact C-N 3.3Å; R2611-N2613 PolarHBondContact O-N 2.85Å; R2611-N2613 PolarHBondContact O-ND2 3.3Å; N2613-Y2615 PolarHBondContact O-N 3.36Å; N2613-S2625 PolarHBondContact ND2-OG 3.07Å; N2613-S2625 VanDerWaalsContact ND2-OG 3.13Å; N2613-D2629 PolarHBondContact ND2-OD2 3.25Å; N2613-D2629 VanDerWaalsContact ND2-OD2 3.13Å
2614	S	43.7	Very low	52.3	Low	104.4 Å²	104.4	129 Å²	129	73%	0.73	62%	0.622	S	S	*	*			trans	-63.5	124	178.8	146	0	0	0	0	110.1	M2612 Q2616	M2612-S2614 PolarHBondContact O-N 3.11Å; S2614-Q2616 VanDerWaalsContact C-N 3.33Å; S2614-Q2616 PolarHBondContact O-N 3.17Å
2615	Y	40.7	Very low	51.4	Low	211 Å²	211	125.1 Å²	125.1	83%	0.827	62%	0.617	S	S	*	*			trans	-11.7	78.1	176	-95.1	-86.8	0	0	0	114.1	N2613 K2617	N2613-Y2615 PolarHBondContact O-N 3.36Å; Y2615-K2617 VanDerWaalsContact C-N 3.3Å; Y2615-K2617 HydrophobicContact CD1-CG 4.38Å; Y2615-K2617 HydrophobicContact CE1-CB 4.36Å; Y2615-K2617 HydrophobicContact CE1-CD 4.43Å; Y2615-K2617 HydrophobicContact CE1-CG 4.11Å; Y2615-K2617 PolarHBondContact O-N 3.07Å; Y2615-K2617 VanDerWaalsContact O-N 3.1Å
2616	Q	40.2	Very low	50.4	Low	172.2 Å²	172.2	126.7 Å²	126.7	81%	0.805	62%	0.624	S	S	*	*			trans	-81.3	102.5	159.7	-167.8	164.9	17.3	0	0	107.3	S2614 D2618	S2614-Q2616 VanDerWaalsContact C-N 3.33Å; S2614-Q2616 PolarHBondContact O-N 3.17Å; Q2616-D2618 VanDerWaalsContact C-N 3.29Å; Q2616-D2618 HydrophobicContact CG-CB 4.34Å; Q2616-D2618 WeakPolarHBondContact CG-OD2 3.26Å; Q2616-D2618 PolarHBondContact O-N 3.07Å; Q2616-D2618 VanDerWaalsContact O-N 3.12Å
2617	K	42.8	Very low	49.8	Very low	182 Å²	182	122 Å²	122	79%	0.791	62%	0.621	S	S	*	*			trans	-71.5	9.3	-174.9	-149.6	178.4	176.3	-176.1	0	112.5	Y2615	Y2615-K2617 VanDerWaalsContact C-N 3.3Å; Y2615-K2617 HydrophobicContact CD1-CG 4.38Å; Y2615-K2617 HydrophobicContact CE1-CB 4.36Å; Y2615-K2617 HydrophobicContact CE1-CD 4.43Å; Y2615-K2617 HydrophobicContact CE1-CG 4.11Å; Y2615-K2617 PolarHBondContact O-N 3.07Å; Y2615-K2617 VanDerWaalsContact O-N 3.1Å
2618	D	38.4	Very low	49.3	Very low	113.4 Å²	113.4	123.8 Å²	123.8	61%	0.606	63%	0.63	S	S	*	*	S	Bend	trans	-126.8	129.1	-169.8	-47.9	-50.4	0	0	0	112.1	Q2616	Q2616-D2618 VanDerWaalsContact C-N 3.29Å; Q2616-D2618 HydrophobicContact CG-CB 4.34Å; Q2616-D2618 WeakPolarHBondContact CG-OD2 3.26Å; Q2616-D2618 PolarHBondContact O-N 3.07Å; Q2616-D2618 VanDerWaalsContact O-N 3.12Å
2619	N	39.7	Very low	48.9	Very low	136 Å²	136	121.6 Å²	121.6	73%	0.727	61%	0.612	S	S	*	*			trans	73.9	89.2	169.7	-51.8	-58.3	0	0	0	117.6	N2621	N2619-N2621 PolarHBondContact O-N 2.99Å
2620	H	38.1	Very low	49.2	Very low	163.2 Å²	163.2	120.5 Å²	120.5	76%	0.756	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	15	114.4	148.5	-69.1	-78.6	0	0	0	118.6	N2622	H2620-N2622 PolarHBondContact O-N 3.05Å
2621	N	42.1	Very low	49.4	Very low	138.2 Å²	138.2	121.6 Å²	121.6	74%	0.739	62%	0.62	S	S	*	*			trans	96	-1	155.9	-58.3	-9	0	0	0	118.3	N2619 N2623	N2619-N2621 PolarHBondContact O-N 2.99Å; N2621-N2623 VanDerWaalsContact C-N 3.25Å; N2621-N2623 PolarHBondContact O-N 3.23Å
2622	N	40.6	Very low	50.1	Low	139.4 Å²	139.4	116.5 Å²	116.5	75%	0.745	61%	0.606	S	S	*	*			trans	-104	47.5	179.1	-74.7	-35	0	0	0	114.3	H2620 I2624	H2620-N2622 PolarHBondContact O-N 3.05Å; N2622-I2624 VanDerWaalsContact C-N 3.3Å; N2622-I2624 PolarHBondContact O-N 3.05Å; N2622-I2624 VanDerWaalsContact O-N 3.13Å
2623	N	41.9	Very low	51	Low	148.2 Å²	148.2	114.7 Å²	114.7	79%	0.793	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	35.1	-176	-74.3	-8.2	0	0	0	115	N2621	N2621-N2623 VanDerWaalsContact C-N 3.25Å; N2621-N2623 PolarHBondContact O-N 3.23Å
2624	I	47.4	Very low	52.5	Low	134.4 Å²	134.4	110.8 Å²	110.8	69%	0.689	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-28	-175.9	-60.6	175.4	0	0	0	114.9	L2481 N2622 F2626 G2627 L2628	L2481-I2624 HydrophobicContact CD2-CD1 3.86Å; N2622-I2624 VanDerWaalsContact C-N 3.3Å; N2622-I2624 PolarHBondContact O-N 3.05Å; N2622-I2624 VanDerWaalsContact O-N 3.13Å; I2624-F2626 PolarHBondContact O-N 3Å; I2624-G2627 PolarHBondContact O-N 2.94Å; I2624-L2628 HydrophobicContact CG2-CD1 4.23Å
2625	S	50.2	Low	54.1	Low	60.4 Å²	60.4	109.5 Å²	109.5	42%	0.422	57%	0.567	S	S	.	*	H	α-helix	trans	-62.8	-42.1	-173.1	35.4	0	0	0	0	114.1	N2613 G2627 L2628 D2629	N2613-S2625 PolarHBondContact ND2-OG 3.07Å; N2613-S2625 VanDerWaalsContact ND2-OG 3.13Å; S2625-G2627 VanDerWaalsContact C-N 3.29Å; S2625-G2627 PolarHBondContact O-N 3.13Å; S2625-G2627 VanDerWaalsContact O-N 3.15Å; S2625-L2628 WeakPolarHBondContact O-CA 3.47Å; S2625-L2628 WeakPolarHBondContact O-CB 3.34Å; S2625-L2628 PolarHBondContact O-N 3.2Å; S2625-D2629 VanDerWaalsContact C-OD2 3.22Å; S2625-D2629 PolarHBondContact O-N 3.01Å; S2625-D2629 PolarHBondContact OG-OD2 2.86Å
2626	F	48	Very low	56.1	Low	141.6 Å²	141.6	100.4 Å²	100.4	62%	0.621	53%	0.532	S	S	*	.	H	α-helix	trans	-57.4	-33.2	-172.2	-164.5	-94.7	0	0	0	113.8	M2612 I2624 L2628 D2629 L2630	M2612-F2626 HydrophobicContact CE-CE2 4.21Å; M2612-F2626 HydrophobicContact SD-CD2 3.97Å; M2612-F2626 HydrophobicContact SD-CE2 3.79Å; I2624-F2626 PolarHBondContact O-N 3Å; F2626-L2628 VanDerWaalsContact C-N 3.32Å; F2626-L2628 PolarHBondContact O-N 3.27Å; F2626-D2629 PolarHBondContact O-N 2.94Å; F2626-L2630 HydrophobicContact CE1-CD2 4.01Å; F2626-L2630 HydrophobicContact CZ-CD2 4.44Å; F2626-L2630 VanDerWaalsContact O-CB 3.26Å; F2626-L2630 WeakPolarHBondContact O-CB 3.48Å; F2626-L2630 PolarHBondContact O-N 3.12Å
2627	G	55.2	Low	57.9	Low	46.8 Å²	46.8	95 Å²	95	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-70.3	-32.8	177.4	0	0	0	0	0	113.6	I2624 S2625 S2631	I2624-G2627 PolarHBondContact O-N 2.94Å; S2625-G2627 VanDerWaalsContact C-N 3.29Å; S2625-G2627 PolarHBondContact O-N 3.13Å; S2625-G2627 VanDerWaalsContact O-N 3.15Å; G2627-S2631 VanDerWaalsContact O-CB 3.27Å; G2627-S2631 WeakPolarHBondContact O-CB 3.37Å; G2627-S2631 PolarHBondContact O-N 3.11Å; G2627-S2631 VanDerWaalsContact O-N 3.07Å; G2627-S2631 PolarHBondContact O-OG 3.1Å
2628	L	61.1	Low	59.5	Low	100.6 Å²	100.6	90.9 Å²	90.9	53%	0.527	49%	0.488	S	S	.	.	H	α-helix	trans	-73.6	-44.6	178.8	-157.4	66.6	0	0	0	111	I2624 S2625 F2626 L2630 S2631 N2632	I2624-L2628 HydrophobicContact CG2-CD1 4.23Å; S2625-L2628 WeakPolarHBondContact O-CA 3.47Å; S2625-L2628 WeakPolarHBondContact O-CB 3.34Å; S2625-L2628 PolarHBondContact O-N 3.2Å; F2626-L2628 VanDerWaalsContact C-N 3.32Å; F2626-L2628 PolarHBondContact O-N 3.27Å; L2628-L2630 VanDerWaalsContact C-N 3.35Å; L2628-L2630 PolarHBondContact O-N 2.96Å; L2628-S2631 WeakPolarHBondContact CA-OG 3.4Å; L2628-S2631 PolarHBondContact O-N 3.15Å; L2628-S2631 VanDerWaalsContact O-N 3.16Å; L2628-S2631 PolarHBondContact O-OG 3.05Å; L2628-S2631 VanDerWaalsContact O-OG 3.12Å; L2628-N2632 VanDerWaalsContact O-CB 3.32Å; L2628-N2632 WeakPolarHBondContact O-CB 3.47Å; L2628-N2632 VanDerWaalsContact O-CG 3.25Å; L2628-N2632 PolarHBondContact O-N 2.9Å; L2628-N2632 PolarHBondContact O-ND2 3.1Å
2629	D	64.8	Low	61.3	Low	30.2 Å²	30.2	88.3 Å²	88.3	16%	0.161	48%	0.476	C	S	.	.	H	α-helix	trans	-64.3	-42.2	178.7	-65.2	-43.7	0	0	0	111.7	I2610 M2612 N2613 S2625 F2626 S2631 N2632 F2633	I2610-D2629 HydrophobicContact CG2-CB 4.31Å; M2612-D2629 HydrophobicContact SD-CB 4.29Å; N2613-D2629 PolarHBondContact ND2-OD2 3.25Å; N2613-D2629 VanDerWaalsContact ND2-OD2 3.13Å; S2625-D2629 VanDerWaalsContact C-OD2 3.22Å; S2625-D2629 PolarHBondContact O-N 3.01Å; S2625-D2629 PolarHBondContact OG-OD2 2.86Å; F2626-D2629 PolarHBondContact O-N 2.94Å; D2629-S2631 VanDerWaalsContact C-N 3.34Å; D2629-S2631 PolarHBondContact O-N 2.89Å; D2629-N2632 PolarHBondContact O-N 2.89Å; D2629-F2633 WeakPolarHBondContact O-CB 3.42Å; D2629-F2633 PolarHBondContact O-N 3.2Å
2630	L	71.4	Confident	63.1	Low	80.6 Å²	80.6	84.3 Å²	84.3	42%	0.422	46%	0.455	S	S	.	.	H	α-helix	trans	-65.3	-39.9	174.4	-173.6	65.8	0	0	0	112.4	L2555 T2566 F2626 L2628 F2633 A2634	L2555-L2630 HydrophobicContact CD1-CD1 3.49Å; L2555-L2630 VanDerWaalsContact CD1-CD1 3.49Å; T2566-L2630 HydrophobicContact CG2-CD1 4.5Å; F2626-L2630 HydrophobicContact CE1-CD2 4.01Å; F2626-L2630 HydrophobicContact CZ-CD2 4.44Å; F2626-L2630 VanDerWaalsContact O-CB 3.26Å; F2626-L2630 WeakPolarHBondContact O-CB 3.48Å; F2626-L2630 PolarHBondContact O-N 3.12Å; L2628-L2630 VanDerWaalsContact C-N 3.35Å; L2628-L2630 PolarHBondContact O-N 2.96Å; L2630-F2633 HydrophobicContact CD1-CD1 4.45Å; L2630-F2633 WeakPolarHBondContact O-CB 3.44Å; L2630-F2633 PolarHBondContact O-N 3.05Å; L2630-A2634 VanDerWaalsContact O-CB 3.28Å; L2630-A2634 WeakPolarHBondContact O-CB 3.34Å; L2630-A2634 PolarHBondContact O-N 2.9Å
2631	S	71.5	Confident	64.9	Low	52.8 Å²	52.8	81.6 Å²	81.6	37%	0.369	44%	0.438	S	S	.	.	H	α-helix	trans	-68.2	-37.9	176.5	68.9	0	0	0	0	112.4	G2627 L2628 D2629 F2633 A2634 V2635	G2627-S2631 VanDerWaalsContact O-CB 3.27Å; G2627-S2631 WeakPolarHBondContact O-CB 3.37Å; G2627-S2631 PolarHBondContact O-N 3.11Å; G2627-S2631 VanDerWaalsContact O-N 3.07Å; G2627-S2631 PolarHBondContact O-OG 3.1Å; L2628-S2631 WeakPolarHBondContact CA-OG 3.4Å; L2628-S2631 PolarHBondContact O-N 3.15Å; L2628-S2631 VanDerWaalsContact O-N 3.16Å; L2628-S2631 PolarHBondContact O-OG 3.05Å; L2628-S2631 VanDerWaalsContact O-OG 3.12Å; D2629-S2631 VanDerWaalsContact C-N 3.34Å; D2629-S2631 PolarHBondContact O-N 2.89Å; S2631-F2633 VanDerWaalsContact C-N 3.32Å; S2631-F2633 PolarHBondContact O-N 3.14Å; S2631-A2634 PolarHBondContact O-N 3.09Å; S2631-V2635 WeakPolarHBondContact O-CB 3.29Å; S2631-V2635 VanDerWaalsContact O-CG2 3.29Å; S2631-V2635 WeakPolarHBondContact O-CG2 3.39Å; S2631-V2635 PolarHBondContact O-N 3.39Å
2632	N	71.6	Confident	66.3	Low	71.8 Å²	71.8	80.3 Å²	80.3	38%	0.384	43%	0.427	S	S	.	.	H	α-helix	trans	-62	-43.9	172.3	-76.8	-43.2	0	0	0	111.3	I2610 L2628 D2629 A2634 V2635 L2636	I2610-N2632 HydrophobicContact CD1-CB 4.2Å; I2610-N2632 HydrophobicContact CG1-CB 4.39Å; L2628-N2632 VanDerWaalsContact O-CB 3.32Å; L2628-N2632 WeakPolarHBondContact O-CB 3.47Å; L2628-N2632 VanDerWaalsContact O-CG 3.25Å; L2628-N2632 PolarHBondContact O-N 2.9Å; L2628-N2632 PolarHBondContact O-ND2 3.1Å; D2629-N2632 PolarHBondContact O-N 2.89Å; N2632-A2634 PolarHBondContact O-N 3.17Å; N2632-V2635 PolarHBondContact O-N 2.94Å; N2632-L2636 WeakPolarHBondContact O-CD1 3.49Å; N2632-L2636 VanDerWaalsContact O-CG 3.23Å; N2632-L2636 WeakPolarHBondContact O-CG 3.42Å; N2632-L2636 PolarHBondContact O-N 3.16Å
2633	F	76	Confident	67.6	Low	67.2 Å²	67.2	76.9 Å²	76.9	30%	0.295	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-43.6	175.6	-175.5	-111.3	0	0	0	112.3	L2555 L2607 I2610 M2612 D2629 L2630 S2631 V2635 L2636 L2637	L2555-F2633 HydrophobicContact CD2-CD1 3.66Å; L2555-F2633 HydrophobicContact CD2-CE1 3.52Å; L2607-F2633 HydrophobicContact CD2-CD2 4.18Å; L2607-F2633 HydrophobicContact CD2-CE2 4.17Å; I2610-F2633 HydrophobicContact CD1-CB 4.02Å; I2610-F2633 HydrophobicContact CD1-CD2 3.97Å; I2610-F2633 HydrophobicContact CD1-CG 4.4Å; I2610-F2633 HydrophobicContact CG2-CB 4.32Å; I2610-F2633 HydrophobicContact CG2-CD2 4.31Å; M2612-F2633 HydrophobicContact CE-CB 4.34Å; D2629-F2633 WeakPolarHBondContact O-CB 3.42Å; D2629-F2633 PolarHBondContact O-N 3.2Å; L2630-F2633 HydrophobicContact CD1-CD1 4.45Å; L2630-F2633 WeakPolarHBondContact O-CB 3.44Å; L2630-F2633 PolarHBondContact O-N 3.05Å; S2631-F2633 VanDerWaalsContact C-N 3.32Å; S2631-F2633 PolarHBondContact O-N 3.14Å; F2633-V2635 PolarHBondContact O-N 3.11Å; F2633-L2636 WeakPolarHBondContact O-CB 3.42Å; F2633-L2636 PolarHBondContact O-N 3.05Å; F2633-L2636 VanDerWaalsContact O-N 3.14Å; F2633-L2637 HydrophobicContact CD1-CD1 4Å; F2633-L2637 HydrophobicContact CD1-CG 4.34Å; F2633-L2637 HydrophobicContact CE1-CD1 3.52Å; F2633-L2637 VanDerWaalsContact CE1-CD1 3.49Å; F2633-L2637 HydrophobicContact CE1-CD2 4.14Å; F2633-L2637 HydrophobicContact CE1-CG 4.08Å; F2633-L2637 HydrophobicContact CE2-CD1 4.36Å; F2633-L2637 HydrophobicContact CE2-CD2 4.48Å; F2633-L2637 HydrophobicContact CE2-CG 4.34Å; F2633-L2637 HydrophobicContact CZ-CD1 3.93Å; F2633-L2637 HydrophobicContact CZ-CD2 4.23Å; F2633-L2637 HydrophobicContact CZ-CG 4.12Å; F2633-L2637 WeakPolarHBondContact O-CG 3.23Å; F2633-L2637 PolarHBondContact O-N 3.19Å
2634	A	77.2	Confident	69	Low	33.2 Å²	33.2	72.4 Å²	72.4	27%	0.274	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-37.2	176.9	0	0	0	0	0	112.8	V2319 T2566 A2570 L2630 S2631 N2632 L2636 L2637 R2638	V2319-A2634 HydrophobicContact CG2-CB 3.87Å; T2566-A2634 HydrophobicContact CG2-CB 4.06Å; A2570-A2634 VanDerWaalsContact CB-C 3.42Å; A2570-A2634 HydrophobicContact CB-CB 3.35Å; L2630-A2634 VanDerWaalsContact O-CB 3.28Å; L2630-A2634 WeakPolarHBondContact O-CB 3.34Å; L2630-A2634 PolarHBondContact O-N 2.9Å; S2631-A2634 PolarHBondContact O-N 3.09Å; N2632-A2634 PolarHBondContact O-N 3.17Å; A2634-L2636 VanDerWaalsContact C-N 3.32Å; A2634-L2636 PolarHBondContact O-N 3.33Å; A2634-L2637 PolarHBondContact O-N 2.97Å; A2634-R2638 VanDerWaalsContact O-CB 3.28Å; A2634-R2638 WeakPolarHBondContact O-CB 3.35Å; A2634-R2638 PolarHBondContact O-N 3.14Å
2635	V	78	Confident	70.1	Confident	76.6 Å²	76.6	72.8 Å²	72.8	46%	0.464	38%	0.382	S	S	.	.	H	α-helix	trans	-64.5	-39	172.2	166.8	0	0	0	0	111	A2570 S2631 N2632 F2633 R2638 T2639	A2570-V2635 HydrophobicContact CB-CG2 4Å; S2631-V2635 WeakPolarHBondContact O-CB 3.29Å; S2631-V2635 VanDerWaalsContact O-CG2 3.29Å; S2631-V2635 WeakPolarHBondContact O-CG2 3.39Å; S2631-V2635 PolarHBondContact O-N 3.39Å; N2632-V2635 PolarHBondContact O-N 2.94Å; F2633-V2635 PolarHBondContact O-N 3.11Å; V2635-R2638 WeakPolarHBondContact O-CB 3.44Å; V2635-R2638 PolarHBondContact O-N 3.11Å; V2635-T2639 WeakPolarHBondContact O-CB 3.32Å; V2635-T2639 WeakPolarHBondContact O-CG2 3.4Å; V2635-T2639 PolarHBondContact O-N 2.88Å; V2635-T2639 PolarHBondContact O-OG1 3.08Å
2636	L	81.3	Confident	70.9	Confident	18.8 Å²	18.8	73.9 Å²	73.9	10%	0.098	38%	0.377	C	S	.	.	H	α-helix	trans	-64.5	-52.9	173.5	-73.8	170.4	0	0	0	111.1	W2603 R2606 L2607 I2610 N2632 F2633 A2634 R2638 T2639 L2640	W2603-L2636 HydrophobicContact CE3-CD2 4.1Å; W2603-L2636 VanDerWaalsContact CH2-C 3.44Å; W2603-L2636 HydrophobicContact CH2-CB 3.79Å; W2603-L2636 HydrophobicContact CH2-CD2 4.43Å; W2603-L2636 VanDerWaalsContact CH2-O 3.25Å; W2603-L2636 WeakPolarHBondContact CH2-O 3.39Å; W2603-L2636 HydrophobicContact CZ3-CB 3.8Å; W2603-L2636 HydrophobicContact CZ3-CD2 3.9Å; W2603-L2636 HydrophobicContact CZ3-CG 4.4Å; W2603-L2636 VanDerWaalsContact CZ3-O 3.28Å; W2603-L2636 WeakPolarHBondContact CZ3-O 3.39Å; R2606-L2636 HydrophobicContact CB-CD1 3.97Å; R2606-L2636 HydrophobicContact CB-CD2 3.83Å; R2606-L2636 HydrophobicContact CB-CG 4.38Å; R2606-L2636 VanDerWaalsContact CD-CD2 3.45Å; R2606-L2636 HydrophobicContact CG-CD2 4.32Å; L2607-L2636 HydrophobicContact CD2-CD1 4.02Å; L2607-L2636 HydrophobicContact CG-CD1 4.24Å; I2610-L2636 HydrophobicContact CD1-CD1 3.61Å; I2610-L2636 VanDerWaalsContact CD1-CD1 3.49Å; I2610-L2636 HydrophobicContact CD1-CG 4.46Å; I2610-L2636 HydrophobicContact CG1-CD1 4.3Å; N2632-L2636 WeakPolarHBondContact O-CD1 3.49Å; N2632-L2636 VanDerWaalsContact O-CG 3.23Å; N2632-L2636 WeakPolarHBondContact O-CG 3.42Å; N2632-L2636 PolarHBondContact O-N 3.16Å; F2633-L2636 WeakPolarHBondContact O-CB 3.42Å; F2633-L2636 PolarHBondContact O-N 3.05Å; F2633-L2636 VanDerWaalsContact O-N 3.14Å; A2634-L2636 VanDerWaalsContact C-N 3.32Å; A2634-L2636 PolarHBondContact O-N 3.33Å; L2636-R2638 VanDerWaalsContact C-N 3.3Å; L2636-R2638 PolarHBondContact O-N 2.95Å; L2636-R2638 VanDerWaalsContact O-N 3.09Å; L2636-T2639 CarbonylContact O-C 3.55Å; L2636-T2639 WeakPolarHBondContact O-CA 3.41Å; L2636-T2639 VanDerWaalsContact O-CB 3.29Å; L2636-T2639 WeakPolarHBondContact O-CB 3.39Å; L2636-T2639 PolarHBondContact O-N 3.21Å; L2636-T2639 VanDerWaalsContact O-N 3.09Å; L2636-T2639 PolarHBondContact O-OG1 2.99Å; L2636-L2640 PolarHBondContact O-N 3.18Å
2637	L	79.3	Confident	71.8	Confident	59.2 Å²	59.2	73.4 Å²	73.4	31%	0.31	38%	0.38	S	S	.	.	H	α-helix	trans	-54	-41.1	176.4	-73.1	-178.2	0	0	0	112.3	L2555 I2567 F2633 A2634 T2639 L2640 W2641 M2863 L2866 L2867	L2555-L2637 HydrophobicContact CD2-CD1 4.04Å; I2567-L2637 HydrophobicContact CD1-CB 4.11Å; I2567-L2637 HydrophobicContact CD1-CD1 3.75Å; I2567-L2637 HydrophobicContact CG1-CB 4.05Å; I2567-L2637 HydrophobicContact CG1-CD1 4.02Å; I2567-L2637 HydrophobicContact CG2-CB 4.47Å; F2633-L2637 HydrophobicContact CD1-CD1 4Å; F2633-L2637 HydrophobicContact CD1-CG 4.34Å; F2633-L2637 HydrophobicContact CE1-CD1 3.52Å; F2633-L2637 VanDerWaalsContact CE1-CD1 3.49Å; F2633-L2637 HydrophobicContact CE1-CD2 4.14Å; F2633-L2637 HydrophobicContact CE1-CG 4.08Å; F2633-L2637 HydrophobicContact CE2-CD1 4.36Å; F2633-L2637 HydrophobicContact CE2-CD2 4.48Å; F2633-L2637 HydrophobicContact CE2-CG 4.34Å; F2633-L2637 HydrophobicContact CZ-CD1 3.93Å; F2633-L2637 HydrophobicContact CZ-CD2 4.23Å; F2633-L2637 HydrophobicContact CZ-CG 4.12Å; F2633-L2637 WeakPolarHBondContact O-CG 3.23Å; F2633-L2637 PolarHBondContact O-N 3.19Å; A2634-L2637 PolarHBondContact O-N 2.97Å; L2637-T2639 VanDerWaalsContact C-N 3.34Å; L2637-T2639 PolarHBondContact O-N 2.99Å; L2637-L2640 WeakPolarHBondContact O-CB 3.43Å; L2637-L2640 PolarHBondContact O-N 3.31Å; L2637-W2641 WeakPolarHBondContact O-CB 3.3Å; L2637-W2641 PolarHBondContact O-N 3.24Å; L2637-M2863 HydrophobicContact CD2-CE 4.11Å; L2637-M2863 HydrophobicContact CD2-SD 4.44Å; L2637-L2866 HydrophobicContact CD1-CD1 4.29Å; L2637-L2867 HydrophobicContact CB-CD1 3.67Å
2638	R	75.2	Confident	72.2	Confident	97 Å²	97	74.8 Å²	74.8	37%	0.366	38%	0.377	S	S	.	.	H	α-helix	trans	-65.6	-37.6	174.3	-169.2	178.6	-159.9	100	0.6	112.5	I2567 L2568 A2570 A2634 V2635 L2636 L2640 W2641 H2642 L2867	I2567-R2638 HydrophobicContact CG2-CB 3.85Å; I2567-R2638 HydrophobicContact CG2-CG 4.23Å; I2567-R2638 PolarHBondContact O-NH1 2.96Å; L2568-R2638 VanDerWaalsContact C-NH1 3.3Å; L2568-R2638 PolarHBondContact O-NH1 2.94Å; A2570-R2638 PolarHBondContact O-NH1 3.07Å; A2634-R2638 VanDerWaalsContact O-CB 3.28Å; A2634-R2638 WeakPolarHBondContact O-CB 3.35Å; A2634-R2638 PolarHBondContact O-N 3.14Å; V2635-R2638 WeakPolarHBondContact O-CB 3.44Å; V2635-R2638 PolarHBondContact O-N 3.11Å; L2636-R2638 VanDerWaalsContact C-N 3.3Å; L2636-R2638 PolarHBondContact O-N 2.95Å; L2636-R2638 VanDerWaalsContact O-N 3.09Å; R2638-L2640 PolarHBondContact O-N 3.26Å; R2638-W2641 WeakPolarHBondContact O-CB 3.49Å; R2638-W2641 PolarHBondContact O-N 3.05Å; R2638-H2642 WeakPolarHBondContact CG-NE2 3.32Å; R2638-H2642 PolarHBondContact NE-NE2 3.36Å; R2638-H2642 PolarHBondContact NH2-NE2 2.86Å; R2638-H2642 PolarHBondContact O-CD2 2.98Å; R2638-H2642 PolarHBondContact O-N 3.02Å; R2638-H2642 VanDerWaalsContact O-N 3.09Å; R2638-L2867 HydrophobicContact CB-CD1 3.83Å; R2638-L2867 HydrophobicContact CG-CD1 4.42Å
2639	T	76.1	Confident	72.3	Confident	58 Å²	58	72.2 Å²	72.2	36%	0.356	36%	0.363	S	S	.	.	H	α-helix	trans	-64.6	-43.2	174.1	-40.6	0	0	0	0	111.3	F2599 V2635 L2636 L2637 W2641 H2642 C2643	F2599-T2639 HydrophobicContact CE2-CG2 4.02Å; V2635-T2639 WeakPolarHBondContact O-CB 3.32Å; V2635-T2639 WeakPolarHBondContact O-CG2 3.4Å; V2635-T2639 PolarHBondContact O-N 2.88Å; V2635-T2639 PolarHBondContact O-OG1 3.08Å; L2636-T2639 CarbonylContact O-C 3.55Å; L2636-T2639 WeakPolarHBondContact O-CA 3.41Å; L2636-T2639 VanDerWaalsContact O-CB 3.29Å; L2636-T2639 WeakPolarHBondContact O-CB 3.39Å; L2636-T2639 PolarHBondContact O-N 3.21Å; L2636-T2639 VanDerWaalsContact O-N 3.09Å; L2636-T2639 PolarHBondContact O-OG1 2.99Å; L2637-T2639 VanDerWaalsContact C-N 3.34Å; L2637-T2639 PolarHBondContact O-N 2.99Å; T2639-W2641 VanDerWaalsContact C-N 3.33Å; T2639-W2641 PolarHBondContact O-N 3.48Å; T2639-H2642 CarbonylContact O-C 3.22Å; T2639-H2642 PolarHBondContact O-N 3.02Å; T2639-C2643 WeakPolarHBondContact O-CB 3.35Å; T2639-C2643 PolarHBondContact O-N 2.93Å; T2639-C2643 PolarHBondContact O-SG 3.11Å; T2639-C2643 VanDerWaalsContact O-SG 3.33Å
2640	L	78.2	Confident	72.1	Confident	52.6 Å²	52.6	75.8 Å²	75.8	28%	0.275	38%	0.381	S	S	.	.	H	α-helix	trans	-61.2	-44.9	173.3	174.8	63.4	0	0	0	111.4	F2599 W2603 L2636 L2637 R2638 H2642 C2643 I2644 M2863	F2599-L2640 HydrophobicContact CE1-CD1 3.96Å; F2599-L2640 HydrophobicContact CZ-CD1 4.15Å; W2603-L2640 HydrophobicContact CE3-CB 4.35Å; W2603-L2640 HydrophobicContact CH2-CB 3.48Å; W2603-L2640 VanDerWaalsContact CH2-CB 3.49Å; W2603-L2640 HydrophobicContact CH2-CD2 4.06Å; W2603-L2640 HydrophobicContact CH2-CG 4.34Å; W2603-L2640 HydrophobicContact CZ2-CB 4.09Å; W2603-L2640 HydrophobicContact CZ2-CD2 3.82Å; W2603-L2640 HydrophobicContact CZ2-CG 4.4Å; W2603-L2640 HydrophobicContact CZ3-CB 3.8Å; L2636-L2640 PolarHBondContact O-N 3.18Å; L2637-L2640 WeakPolarHBondContact O-CB 3.43Å; L2637-L2640 PolarHBondContact O-N 3.31Å; R2638-L2640 PolarHBondContact O-N 3.26Å; L2640-H2642 VanDerWaalsContact C-N 3.29Å; L2640-H2642 PolarHBondContact O-N 3.29Å; L2640-C2643 WeakPolarHBondContact O-CB 3.3Å; L2640-C2643 PolarHBondContact O-N 3.07Å; L2640-I2644 HydrophobicContact CD1-CD1 4.17Å; L2640-I2644 HydrophobicContact CD1-CG1 4.2Å; L2640-I2644 HydrophobicContact CG-CD1 4.05Å; L2640-I2644 HydrophobicContact CG-CG1 4.46Å; L2640-I2644 WeakPolarHBondContact O-CG1 3.44Å; L2640-I2644 PolarHBondContact O-N 2.89Å; L2640-I2644 VanDerWaalsContact O-N 3.08Å; L2640-M2863 HydrophobicContact CD2-CE 3.73Å; L2640-M2863 HydrophobicContact CG-CE 4.34Å
2641	W	75.9	Confident	71.6	Confident	105.8 Å²	105.8	76.8 Å²	76.8	40%	0.401	39%	0.39	S	S	.	.	H	α-helix	trans	-57.7	-37.6	176.3	-170.7	55	0	0	0	112.6	A2311 T2312 L2637 R2638 T2639 R2645 W2646 P2869	A2311-W2641 HydrophobicContact CB-CZ2 4.18Å; T2312-W2641 HydrophobicContact CG2-CH2 3.9Å; T2312-W2641 HydrophobicContact CG2-CZ2 4.42Å; T2312-W2641 HydrophobicContact CG2-CZ3 4.33Å; L2637-W2641 WeakPolarHBondContact O-CB 3.3Å; L2637-W2641 PolarHBondContact O-N 3.24Å; R2638-W2641 WeakPolarHBondContact O-CB 3.49Å; R2638-W2641 PolarHBondContact O-N 3.05Å; T2639-W2641 VanDerWaalsContact C-N 3.33Å; T2639-W2641 PolarHBondContact O-N 3.48Å; W2641-R2645 WeakPolarHBondContact O-CB 3.39Å; W2641-R2645 PolarHBondContact O-N 3.03Å; W2641-W2646 AromaticContact CD1-CE2 3.84Å; W2641-W2646 AromaticContact CD1-CZ2 3.48Å; W2641-W2646 VanDerWaalsContact CD1-CZ2 3.48Å; W2641-W2646 AromaticContact CD1-NE1 3.75Å; W2641-W2646 AromaticContact CD2-CE2 3.95Å; W2641-W2646 HydrophobicContact CD2-CH2 4.18Å; W2641-W2646 AromaticContact CD2-CZ2 3.5Å; W2641-W2646 HydrophobicContact CD2-CZ2 3.5Å; W2641-W2646 VanDerWaalsContact CD2-CZ2 3.43Å; W2641-W2646 AromaticContact CD2-NE1 3.91Å; W2641-W2646 AromaticContact CE2-CE2 3.73Å; W2641-W2646 AromaticContact CE2-CH2 3.99Å; W2641-W2646 AromaticContact CE2-CZ2 3.52Å; W2641-W2646 AromaticContact CE2-NE1 3.74Å; W2641-W2646 HydrophobicContact CE3-CH2 4.11Å; W2641-W2646 AromaticContact CE3-CZ2 3.61Å; W2641-W2646 HydrophobicContact CE3-CZ2 3.61Å; W2641-W2646 AromaticContact CG-CZ2 3.96Å; W2641-W2646 HydrophobicContact CG-CZ2 4.21Å; W2641-W2646 AromaticContact CG-NE1 3.93Å; W2641-W2646 AromaticContact CH2-CH2 3.7Å; W2641-W2646 HydrophobicContact CH2-CH2 3.7Å; W2641-W2646 AromaticContact CH2-CZ2 3.77Å; W2641-W2646 HydrophobicContact CH2-CZ2 3.77Å; W2641-W2646 HydrophobicContact CH2-CZ3 4.31Å; W2641-W2646 AromaticContact CZ2-CE2 3.98Å; W2641-W2646 AromaticContact CZ2-CH2 3.7Å; W2641-W2646 HydrophobicContact CZ2-CH2 3.97Å; W2641-W2646 AromaticContact CZ2-CZ2 3.67Å; W2641-W2646 HydrophobicContact CZ2-CZ2 3.67Å; W2641-W2646 HydrophobicContact CZ2-CZ3 4.33Å; W2641-W2646 AromaticContact CZ3-CH2 3.78Å; W2641-W2646 HydrophobicContact CZ3-CH2 3.78Å; W2641-W2646 AromaticContact CZ3-CZ2 3.74Å; W2641-W2646 HydrophobicContact CZ3-CZ2 3.74Å; W2641-W2646 AromaticContact NE1-CE2 3.71Å; W2641-W2646 AromaticContact NE1-CZ2 3.7Å; W2641-W2646 AromaticContact NE1-NE1 3.63Å; W2641-W2646 PolarHBondContact O-NE1 3.01Å; W2641-P2869 HydrophobicContact CH2-CB 3.92Å; W2641-P2869 HydrophobicContact CZ2-CB 3.95Å
2642	H	70.5	Confident	71	Confident	112 Å²	112	82.7 Å²	82.7	52%	0.519	41%	0.411	S	S	.	.	H	α-helix	trans	-79.1	-20.4	173.9	-69.3	-59.1	0	0	0	114.2	R2638 T2639 L2640 R2645 W2646	R2638-H2642 WeakPolarHBondContact CG-NE2 3.32Å; R2638-H2642 PolarHBondContact NE-NE2 3.36Å; R2638-H2642 PolarHBondContact NH2-NE2 2.86Å; R2638-H2642 PolarHBondContact O-CD2 2.98Å; R2638-H2642 PolarHBondContact O-N 3.02Å; R2638-H2642 VanDerWaalsContact O-N 3.09Å; T2639-H2642 CarbonylContact O-C 3.22Å; T2639-H2642 PolarHBondContact O-N 3.02Å; L2640-H2642 VanDerWaalsContact C-N 3.29Å; L2640-H2642 PolarHBondContact O-N 3.29Å; H2642-R2645 PolarHBondContact O-N 3.5Å; H2642-W2646 PolarHBondContact O-N 2.83Å
2643	C	69.6	Low	70.3	Confident	67.6 Å²	67.6	81.8 Å²	81.8	46%	0.457	41%	0.409	S	S	.	.	H	α-helix	trans	-81.4	-26.1	174.3	-71.2	0	0	0	0	112.8	F2599 T2639 L2640 R2645 W2646 D2647	F2599-C2643 HydrophobicContact CE1-CB 4.27Å; F2599-C2643 HydrophobicContact CE2-CB 4.25Å; F2599-C2643 VanDerWaalsContact CE2-SG 3.56Å; F2599-C2643 HydrophobicContact CZ-CB 4.09Å; F2599-C2643 VanDerWaalsContact CZ-SG 3.58Å; T2639-C2643 WeakPolarHBondContact O-CB 3.35Å; T2639-C2643 PolarHBondContact O-N 2.93Å; T2639-C2643 PolarHBondContact O-SG 3.11Å; T2639-C2643 VanDerWaalsContact O-SG 3.33Å; L2640-C2643 WeakPolarHBondContact O-CB 3.3Å; L2640-C2643 PolarHBondContact O-N 3.07Å; C2643-R2645 VanDerWaalsContact C-N 3.33Å; C2643-R2645 PolarHBondContact O-N 3.38Å; C2643-W2646 WeakPolarHBondContact O-CB 3.43Å; C2643-W2646 PolarHBondContact O-N 3.41Å; C2643-W2646 VanDerWaalsContact O-N 3.16Å; C2643-D2647 PolarHBondContact O-N 3.5Å
2644	I	71.3	Confident	69.5	Low	53.8 Å²	53.8	83.7 Å²	83.7	28%	0.276	42%	0.422	S	S	.	.	S	Bend	trans	-71.5	121.5	173	-67.9	164.6	0	0	0	109	L2640 W2646 D2647 D2648 I2649	L2640-I2644 HydrophobicContact CD1-CD1 4.17Å; L2640-I2644 HydrophobicContact CD1-CG1 4.2Å; L2640-I2644 HydrophobicContact CG-CD1 4.05Å; L2640-I2644 HydrophobicContact CG-CG1 4.46Å; L2640-I2644 WeakPolarHBondContact O-CG1 3.44Å; L2640-I2644 PolarHBondContact O-N 2.89Å; L2640-I2644 VanDerWaalsContact O-N 3.08Å; I2644-W2646 VanDerWaalsContact C-N 3.3Å; I2644-W2646 HydrophobicContact CB-CD2 4.49Å; I2644-W2646 HydrophobicContact CB-CZ2 4.21Å; I2644-W2646 HydrophobicContact CD1-CH2 4.36Å; I2644-W2646 HydrophobicContact CD1-CZ2 3.96Å; I2644-W2646 HydrophobicContact CG2-CD2 3.81Å; I2644-W2646 VanDerWaalsContact CG2-CE2 3.48Å; I2644-W2646 HydrophobicContact CG2-CE3 4.26Å; I2644-W2646 HydrophobicContact CG2-CG 4.16Å; I2644-W2646 HydrophobicContact CG2-CH2 4.31Å; I2644-W2646 HydrophobicContact CG2-CZ2 3.91Å; I2644-W2646 HydrophobicContact CG2-CZ3 4.27Å; I2644-W2646 VanDerWaalsContact O-CD1 3.23Å; I2644-W2646 PolarHBondContact O-N 3.28Å; I2644-W2646 VanDerWaalsContact O-N 3.09Å; I2644-D2647 CarbonylContact O-C 3.53Å; I2644-D2647 WeakPolarHBondContact O-CA 3.44Å; I2644-D2647 VanDerWaalsContact O-CB 3.24Å; I2644-D2647 WeakPolarHBondContact O-CB 3.47Å; I2644-D2647 PolarHBondContact O-N 3.34Å; I2644-D2648 VanDerWaalsContact O-CG 3.32Å; I2644-D2648 PolarHBondContact O-N 3.24Å; I2644-I2649 HydrophobicContact CG2-CD1 3.63Å
2645	R	69.7	Low	68.4	Low	141.2 Å²	141.2	91.5 Å²	91.5	53%	0.533	45%	0.45	S	S	.	.			trans	-74.2	76.1	169.1	-88.4	-175.2	-177.3	-176	-0.2	110.1	W2641 H2642 C2643 D2647 D2648 I2649 E2851	W2641-R2645 WeakPolarHBondContact O-CB 3.39Å; W2641-R2645 PolarHBondContact O-N 3.03Å; H2642-R2645 PolarHBondContact O-N 3.5Å; C2643-R2645 VanDerWaalsContact C-N 3.33Å; C2643-R2645 PolarHBondContact O-N 3.38Å; R2645-D2647 VanDerWaalsContact C-N 3.35Å; R2645-D2647 PolarHBondContact O-N 2.9Å; R2645-D2647 VanDerWaalsContact O-N 3.17Å; R2645-D2648 HydrophobicContact CB-CB 3.96Å; R2645-D2648 VanDerWaalsContact CD-CG 3.47Å; R2645-D2648 WeakPolarHBondContact CD-OD2 3.37Å; R2645-D2648 IonicContact CZ-OD2 2.88Å; R2645-D2648 IonicContact NE-OD2 3.05Å; R2645-D2648 IonicContact NH1-OD1 3.25Å; R2645-D2648 PolarHBondContact NH1-OD1 3Å; R2645-D2648 IonicContact NH1-OD2 2.95Å; R2645-D2648 PolarHBondContact NH1-OD2 2.78Å; R2645-D2648 PolarHBondContact O-N 3.27Å; R2645-I2649 HydrophobicContact CG-CD1 4.39Å; R2645-I2649 WeakPolarHBondContact O-CB 3.37Å; R2645-I2649 VanDerWaalsContact O-CD1 3.29Å; R2645-I2649 WeakPolarHBondContact O-CD1 3.3Å; R2645-I2649 VanDerWaalsContact O-CG1 3.3Å; R2645-I2649 WeakPolarHBondContact O-CG1 3.39Å; R2645-I2649 PolarHBondContact O-N 3.05Å; R2645-E2851 VanDerWaalsContact CZ-CD 3.42Å; R2645-E2851 IonicContact CZ-OE1 3.23Å; R2645-E2851 IonicContact CZ-OE2 3.43Å; R2645-E2851 VanDerWaalsContact CZ-OE2 3.22Å; R2645-E2851 IonicContact NH1-OE1 3.13Å; R2645-E2851 PolarHBondContact NH1-OE1 3.03Å; R2645-E2851 IonicContact NH1-OE2 2.73Å; R2645-E2851 PolarHBondContact NH1-OE2 2.93Å; R2645-E2851 IonicContact NH2-OE1 3.95Å; R2645-E2851 IonicContact NH2-OE2 2.58Å; R2645-E2851 PolarHBondContact NH2-OE2 2.69Å
2646	W	67.4	Low	67.4	Low	84 Å²	84	92.7 Å²	92.7	32%	0.318	45%	0.454	S	S	.	.	H	α-helix	trans	-61.1	-34.4	175.8	-69.8	99.7	0	0	0	111.9	W2641 H2642 C2643 I2644 D2648 I2649 M2650 I2859 M2863	W2641-W2646 AromaticContact CD1-CE2 3.84Å; W2641-W2646 AromaticContact CD1-CZ2 3.48Å; W2641-W2646 VanDerWaalsContact CD1-CZ2 3.48Å; W2641-W2646 AromaticContact CD1-NE1 3.75Å; W2641-W2646 AromaticContact CD2-CE2 3.95Å; W2641-W2646 HydrophobicContact CD2-CH2 4.18Å; W2641-W2646 AromaticContact CD2-CZ2 3.5Å; W2641-W2646 HydrophobicContact CD2-CZ2 3.5Å; W2641-W2646 VanDerWaalsContact CD2-CZ2 3.43Å; W2641-W2646 AromaticContact CD2-NE1 3.91Å; W2641-W2646 AromaticContact CE2-CE2 3.73Å; W2641-W2646 AromaticContact CE2-CH2 3.99Å; W2641-W2646 AromaticContact CE2-CZ2 3.52Å; W2641-W2646 AromaticContact CE2-NE1 3.74Å; W2641-W2646 HydrophobicContact CE3-CH2 4.11Å; W2641-W2646 AromaticContact CE3-CZ2 3.61Å; W2641-W2646 HydrophobicContact CE3-CZ2 3.61Å; W2641-W2646 AromaticContact CG-CZ2 3.96Å; W2641-W2646 HydrophobicContact CG-CZ2 4.21Å; W2641-W2646 AromaticContact CG-NE1 3.93Å; W2641-W2646 AromaticContact CH2-CH2 3.7Å; W2641-W2646 HydrophobicContact CH2-CH2 3.7Å; W2641-W2646 AromaticContact CH2-CZ2 3.77Å; W2641-W2646 HydrophobicContact CH2-CZ2 3.77Å; W2641-W2646 HydrophobicContact CH2-CZ3 4.31Å; W2641-W2646 AromaticContact CZ2-CE2 3.98Å; W2641-W2646 AromaticContact CZ2-CH2 3.7Å; W2641-W2646 HydrophobicContact CZ2-CH2 3.97Å; W2641-W2646 AromaticContact CZ2-CZ2 3.67Å; W2641-W2646 HydrophobicContact CZ2-CZ2 3.67Å; W2641-W2646 HydrophobicContact CZ2-CZ3 4.33Å; W2641-W2646 AromaticContact CZ3-CH2 3.78Å; W2641-W2646 HydrophobicContact CZ3-CH2 3.78Å; W2641-W2646 AromaticContact CZ3-CZ2 3.74Å; W2641-W2646 HydrophobicContact CZ3-CZ2 3.74Å; W2641-W2646 AromaticContact NE1-CE2 3.71Å; W2641-W2646 AromaticContact NE1-CZ2 3.7Å; W2641-W2646 AromaticContact NE1-NE1 3.63Å; W2641-W2646 PolarHBondContact O-NE1 3.01Å; H2642-W2646 PolarHBondContact O-N 2.83Å; C2643-W2646 WeakPolarHBondContact O-CB 3.43Å; C2643-W2646 PolarHBondContact O-N 3.41Å; C2643-W2646 VanDerWaalsContact O-N 3.16Å; I2644-W2646 VanDerWaalsContact C-N 3.3Å; I2644-W2646 HydrophobicContact CB-CD2 4.49Å; I2644-W2646 HydrophobicContact CB-CZ2 4.21Å; I2644-W2646 HydrophobicContact CD1-CH2 4.36Å; I2644-W2646 HydrophobicContact CD1-CZ2 3.96Å; I2644-W2646 HydrophobicContact CG2-CD2 3.81Å; I2644-W2646 VanDerWaalsContact CG2-CE2 3.48Å; I2644-W2646 HydrophobicContact CG2-CE3 4.26Å; I2644-W2646 HydrophobicContact CG2-CG 4.16Å; I2644-W2646 HydrophobicContact CG2-CH2 4.31Å; I2644-W2646 HydrophobicContact CG2-CZ2 3.91Å; I2644-W2646 HydrophobicContact CG2-CZ3 4.27Å; I2644-W2646 VanDerWaalsContact O-CD1 3.23Å; I2644-W2646 PolarHBondContact O-N 3.28Å; I2644-W2646 VanDerWaalsContact O-N 3.09Å; W2646-D2648 VanDerWaalsContact C-N 3.28Å; W2646-D2648 PolarHBondContact O-N 2.81Å; W2646-I2649 CarbonylContact O-C 3.09Å; W2646-I2649 PolarHBondContact O-N 2.92Å; W2646-I2649 VanDerWaalsContact O-N 3.09Å; W2646-M2650 HydrophobicContact CB-CG 4.32Å; W2646-M2650 HydrophobicContact CE3-CE 3.95Å; W2646-M2650 HydrophobicContact CZ3-CE 4.11Å; W2646-M2650 VanDerWaalsContact O-CB 3.31Å; W2646-M2650 WeakPolarHBondContact O-CB 3.42Å; W2646-M2650 WeakPolarHBondContact O-CG 3.39Å; W2646-M2650 PolarHBondContact O-N 3.12Å; W2646-I2859 HydrophobicContact CH2-CG2 4.45Å; W2646-M2863 HydrophobicContact CH2-CE 4.22Å
2647	D	65.8	Low	66.3	Low	131.2 Å²	131.2	95.3 Å²	95.3	70%	0.702	47%	0.467	S	S	*	.	H	α-helix	trans	-62.7	-45	175.8	-63.9	-46.2	0	0	0	112	C2643 I2644 R2645 I2649 M2650 V2651	C2643-D2647 PolarHBondContact O-N 3.5Å; I2644-D2647 CarbonylContact O-C 3.53Å; I2644-D2647 WeakPolarHBondContact O-CA 3.44Å; I2644-D2647 VanDerWaalsContact O-CB 3.24Å; I2644-D2647 WeakPolarHBondContact O-CB 3.47Å; I2644-D2647 PolarHBondContact O-N 3.34Å; R2645-D2647 VanDerWaalsContact C-N 3.35Å; R2645-D2647 PolarHBondContact O-N 2.9Å; R2645-D2647 VanDerWaalsContact O-N 3.17Å; D2647-I2649 VanDerWaalsContact C-N 3.34Å; D2647-I2649 PolarHBondContact O-N 3Å; D2647-I2649 VanDerWaalsContact O-N 3.08Å; D2647-M2650 CarbonylContact O-C 3.56Å; D2647-M2650 WeakPolarHBondContact O-CA 3.49Å; D2647-M2650 PolarHBondContact O-N 3.27Å; D2647-M2650 VanDerWaalsContact O-N 3.09Å; D2647-V2651 VanDerWaalsContact O-CG2 3.28Å; D2647-V2651 WeakPolarHBondContact O-CG2 3.41Å; D2647-V2651 PolarHBondContact O-N 3.15Å
2648	D	63.7	Low	65.3	Low	76.8 Å²	76.8	94.6 Å²	94.6	41%	0.411	47%	0.467	S	S	.	.	H	α-helix	trans	-67.1	-20.1	177.2	-66.4	-1	0	0	0	113.2	I2644 R2645 W2646 L2856	I2644-D2648 VanDerWaalsContact O-CG 3.32Å; I2644-D2648 PolarHBondContact O-N 3.24Å; R2645-D2648 HydrophobicContact CB-CB 3.96Å; R2645-D2648 VanDerWaalsContact CD-CG 3.47Å; R2645-D2648 WeakPolarHBondContact CD-OD2 3.37Å; R2645-D2648 IonicContact CZ-OD2 2.88Å; R2645-D2648 IonicContact NE-OD2 3.05Å; R2645-D2648 IonicContact NH1-OD1 3.25Å; R2645-D2648 PolarHBondContact NH1-OD1 3Å; R2645-D2648 IonicContact NH1-OD2 2.95Å; R2645-D2648 PolarHBondContact NH1-OD2 2.78Å; R2645-D2648 PolarHBondContact O-N 3.27Å; W2646-D2648 VanDerWaalsContact C-N 3.28Å; W2646-D2648 PolarHBondContact O-N 2.81Å; D2648-L2856 HydrophobicContact CB-CD1 3.67Å; D2648-L2856 WeakPolarHBondContact O-CB 3.35Å
2649	I	64.5	Low	64.7	Low	46.6 Å²	46.6	92.1 Å²	92.1	24%	0.239	46%	0.462	C	S	.	.	H	α-helix	trans	-97	-27.9	-178.7	-68.2	173.7	0	0	0	112	I2644 R2645 W2646 D2647 V2651 L2856 I2859 G2860	I2644-I2649 HydrophobicContact CG2-CD1 3.63Å; R2645-I2649 HydrophobicContact CG-CD1 4.39Å; R2645-I2649 WeakPolarHBondContact O-CB 3.37Å; R2645-I2649 VanDerWaalsContact O-CD1 3.29Å; R2645-I2649 WeakPolarHBondContact O-CD1 3.3Å; R2645-I2649 VanDerWaalsContact O-CG1 3.3Å; R2645-I2649 WeakPolarHBondContact O-CG1 3.39Å; R2645-I2649 PolarHBondContact O-N 3.05Å; W2646-I2649 CarbonylContact O-C 3.09Å; W2646-I2649 PolarHBondContact O-N 2.92Å; W2646-I2649 VanDerWaalsContact O-N 3.09Å; D2647-I2649 VanDerWaalsContact C-N 3.34Å; D2647-I2649 PolarHBondContact O-N 3Å; D2647-I2649 VanDerWaalsContact O-N 3.08Å; I2649-V2651 VanDerWaalsContact C-N 3.31Å; I2649-L2856 HydrophobicContact CD1-CD2 4.48Å; I2649-L2856 HydrophobicContact CG1-CB 3.87Å; I2649-L2856 HydrophobicContact CG1-CD2 4.03Å; I2649-L2856 HydrophobicContact CG1-CG 4.46Å; I2649-L2856 HydrophobicContact CG2-CB 4.29Å; I2649-L2856 HydrophobicContact CG2-CD1 3.98Å; I2649-L2856 HydrophobicContact CG2-CD2 3.82Å; I2649-L2856 HydrophobicContact CG2-CG 4.25Å; I2649-I2859 HydrophobicContact CD1-CG2 3.87Å; I2649-G2860 WeakPolarHBondContact O-CA 3.37Å
2650	M	59.4	Low	63.9	Low	106 Å²	106	95 Å²	95	52%	0.522	47%	0.471	S	S	.	.	H	α-helix	trans	-95.1	16.3	178.2	-61.1	-75.2	133.9	0	0	112	W2646 D2647 E2652 L2856	W2646-M2650 HydrophobicContact CB-CG 4.32Å; W2646-M2650 HydrophobicContact CE3-CE 3.95Å; W2646-M2650 HydrophobicContact CZ3-CE 4.11Å; W2646-M2650 VanDerWaalsContact O-CB 3.31Å; W2646-M2650 WeakPolarHBondContact O-CB 3.42Å; W2646-M2650 WeakPolarHBondContact O-CG 3.39Å; W2646-M2650 PolarHBondContact O-N 3.12Å; D2647-M2650 CarbonylContact O-C 3.56Å; D2647-M2650 WeakPolarHBondContact O-CA 3.49Å; D2647-M2650 PolarHBondContact O-N 3.27Å; D2647-M2650 VanDerWaalsContact O-N 3.09Å; M2650-E2652 PolarHBondContact O-N 3.29Å; M2650-E2652 VanDerWaalsContact O-N 3.11Å; M2650-L2856 HydrophobicContact CE-CB 4.37Å
2651	V	62.1	Low	63	Low	101.6 Å²	101.6	94.3 Å²	94.3	62%	0.616	47%	0.468	S	S	*	.	S	Bend	trans	-56.8	117.2	166.8	172.6	0	0	0	0	108.6	D2647 I2649 P2653 W2857	D2647-V2651 VanDerWaalsContact O-CG2 3.28Å; D2647-V2651 WeakPolarHBondContact O-CG2 3.41Å; D2647-V2651 PolarHBondContact O-N 3.15Å; I2649-V2651 VanDerWaalsContact C-N 3.31Å; V2651-P2653 VanDerWaalsContact O-CD 3.26Å; V2651-P2653 WeakPolarHBondContact O-CD 3.31Å; V2651-P2653 VanDerWaalsContact O-N 3.14Å; V2651-W2857 WeakPolarHBondContact O-CB 3.48Å
2652	E	57.3	Low	62.1	Low	174.8 Å²	174.8	94.7 Å²	94.7	82%	0.817	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-58.8	127.2	179.1	-67.4	-177.1	162.2	0	0	110.6	M2650	M2650-E2652 PolarHBondContact O-N 3.29Å; M2650-E2652 VanDerWaalsContact O-N 3.11Å
2653	P	58	Low	61.4	Low	53.6 Å²	53.6	94.8 Å²	94.8	35%	0.348	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-70.4	141.9	175.5	29.1	-34.3	0	0	0	111	V2651 K2655 C2658 P2666 W2857	V2651-P2653 VanDerWaalsContact O-CD 3.26Å; V2651-P2653 WeakPolarHBondContact O-CD 3.31Å; V2651-P2653 VanDerWaalsContact O-N 3.14Å; P2653-K2655 VanDerWaalsContact C-N 3.32Å; P2653-K2655 PolarHBondContact O-N 3.02Å; P2653-C2658 HydrophobicContact CB-CB 4.01Å; P2653-C2658 HydrophobicContact CG-CB 3.88Å; P2653-P2666 HydrophobicContact CG-CB 3.85Å; P2653-P2666 HydrophobicContact CG-CG 4.3Å; P2653-W2857 HydrophobicContact CB-CD2 3.73Å; P2653-W2857 HydrophobicContact CB-CE3 3.91Å; P2653-W2857 HydrophobicContact CB-CG 4.24Å; P2653-W2857 HydrophobicContact CB-CH2 3.99Å; P2653-W2857 HydrophobicContact CB-CZ2 3.83Å; P2653-W2857 HydrophobicContact CB-CZ3 4.05Å; P2653-W2857 HydrophobicContact CG-CD2 4.44Å; P2653-W2857 HydrophobicContact CG-CE3 4.27Å; P2653-W2857 HydrophobicContact CG-CH2 4.41Å; P2653-W2857 HydrophobicContact CG-CZ3 4.27Å
2654	D	58.3	Low	60.8	Low	106.4 Å²	106.4	94.2 Å²	94.2	57%	0.569	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-52.2	124.9	177.7	-63.2	-53	0	0	0	112.3	D2656 I2657 C2658 K2670	D2654-D2656 VanDerWaalsContact C-N 3.29Å; D2654-D2656 PolarHBondContact O-N 3.11Å; D2654-D2656 VanDerWaalsContact O-N 3.09Å; D2654-I2657 HydrophobicContact CB-CB 4.22Å; D2654-I2657 HydrophobicContact CB-CD1 4.07Å; D2654-I2657 HydrophobicContact CB-CG1 4.17Å; D2654-I2657 CarbonylContact O-C 3.53Å; D2654-I2657 WeakPolarHBondContact O-CA 3.45Å; D2654-I2657 WeakPolarHBondContact O-CB 3.43Å; D2654-I2657 PolarHBondContact O-N 2.86Å; D2654-C2658 WeakPolarHBondContact O-CB 3.37Å; D2654-C2658 PolarHBondContact O-N 2.81Å; D2654-C2658 VanDerWaalsContact O-N 3.08Å; D2654-K2670 IonicContact OD2-NZ 3.56Å; D2654-K2670 PolarHBondContact OD2-NZ 3.43Å
2655	K	54.4	Low	60.2	Low	198.8 Å²	198.8	98.1 Å²	98.1	86%	0.864	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.3	-4.3	-172.9	-62.6	177.2	-178	174.1	0	114	P2653 I2657	P2653-K2655 VanDerWaalsContact C-N 3.32Å; P2653-K2655 PolarHBondContact O-N 3.02Å; K2655-I2657 VanDerWaalsContact C-N 3.29Å; K2655-I2657 PolarHBondContact O-N 2.97Å
2656	D	56.9	Low	59.8	Low	100 Å²	100	93.7 Å²	93.7	54%	0.535	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	7.8	-179.8	-62.3	-24.6	0	0	0	112.7	D2654 F2668 K2670 T2671 R2699	D2654-D2656 VanDerWaalsContact C-N 3.29Å; D2654-D2656 PolarHBondContact O-N 3.11Å; D2654-D2656 VanDerWaalsContact O-N 3.09Å; D2656-F2668 HydrophobicContact CB-CB 4.06Å; D2656-F2668 HydrophobicContact CB-CD1 4.41Å; D2656-K2670 VanDerWaalsContact OD1-CA 3.32Å; D2656-K2670 WeakPolarHBondContact OD1-CA 3.44Å; D2656-K2670 WeakPolarHBondContact OD1-CB 3.46Å; D2656-K2670 VanDerWaalsContact OD1-CD 3.32Å; D2656-K2670 WeakPolarHBondContact OD1-CD 3.31Å; D2656-K2670 WeakPolarHBondContact OD1-CG 3.38Å; D2656-K2670 IonicContact OD1-NZ 3.74Å; D2656-K2670 VanDerWaalsContact OD2-CB 3.3Å; D2656-K2670 WeakPolarHBondContact OD2-CB 3.34Å; D2656-K2670 VanDerWaalsContact OD2-CD 3.23Å; D2656-K2670 WeakPolarHBondContact OD2-CD 3.37Å; D2656-K2670 WeakPolarHBondContact OD2-CG 3.47Å; D2656-T2671 PolarHBondContact OD1-N 2.84Å; D2656-T2671 PolarHBondContact OD1-OG1 3.14Å; D2656-R2699 IonicContact OD2-CZ 3.3Å; D2656-R2699 IonicContact OD2-NH1 2.66Å; D2656-R2699 PolarHBondContact OD2-NH1 3.3Å
2657	I	59.4	Low	59.6	Low	74.8 Å²	74.8	90.1 Å²	90.1	38%	0.384	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	9.8	-174.6	-57.8	178.2	0	0	0	110.6	D2654 K2655 V2659 F2668 R2669 T2671 W2857	D2654-I2657 HydrophobicContact CB-CB 4.22Å; D2654-I2657 HydrophobicContact CB-CD1 4.07Å; D2654-I2657 HydrophobicContact CB-CG1 4.17Å; D2654-I2657 CarbonylContact O-C 3.53Å; D2654-I2657 WeakPolarHBondContact O-CA 3.45Å; D2654-I2657 WeakPolarHBondContact O-CB 3.43Å; D2654-I2657 PolarHBondContact O-N 2.86Å; K2655-I2657 VanDerWaalsContact C-N 3.29Å; K2655-I2657 PolarHBondContact O-N 2.97Å; I2657-V2659 HydrophobicContact CG2-CG2 3.91Å; I2657-V2659 PolarHBondContact O-N 3.29Å; I2657-F2668 HydrophobicContact CG2-CD2 3.24Å; I2657-F2668 HydrophobicContact CG2-CE2 3.39Å; I2657-F2668 VanDerWaalsContact CG2-CE2 3.41Å; I2657-F2668 HydrophobicContact CG2-CG 4.13Å; I2657-F2668 HydrophobicContact CG2-CZ 4.33Å; I2657-R2669 HydrophobicContact CB-CB 4.49Å; I2657-R2669 PolarHBondContact N-O 3.27Å; I2657-R2669 PolarHBondContact O-N 3.04Å; I2657-T2671 HydrophobicContact CD1-CG2 4.01Å; I2657-W2857 HydrophobicContact CG2-CZ2 4.39Å
2658	C	58.4	Low	59.6	Low	43.4 Å²	43.4	85.9 Å²	85.9	29%	0.293	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	122.9	179.6	-172.5	0	0	0	0	112	P2653 D2654 P2666 C2667 W2857	P2653-C2658 HydrophobicContact CB-CB 4.01Å; P2653-C2658 HydrophobicContact CG-CB 3.88Å; D2654-C2658 WeakPolarHBondContact O-CB 3.37Å; D2654-C2658 PolarHBondContact O-N 2.81Å; D2654-C2658 VanDerWaalsContact O-N 3.08Å; C2658-P2666 VanDerWaalsContact SG-CA 3.58Å; C2658-P2666 WeakPolarHBondContact SG-CB 3.32Å; C2658-C2667 WeakPolarHBondContact CA-O 3.47Å; C2658-W2857 HydrophobicContact CB-CH2 4.45Å
2659	V	62.1	Low	59.8	Low	44.4 Å²	44.4	85 Å²	85	27%	0.269	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.3	172.6	172.7	0	0	0	0	110.1	I2657 P2666 C2667 R2669	I2657-V2659 HydrophobicContact CG2-CG2 3.91Å; I2657-V2659 PolarHBondContact O-N 3.29Å; V2659-P2666 CarbonylContact O-C 3.49Å; V2659-P2666 WeakPolarHBondContact O-CA 3.46Å; V2659-C2667 PolarHBondContact N-O 3.22Å; V2659-C2667 VanDerWaalsContact N-O 3.13Å; V2659-C2667 WeakPolarHBondContact O-CB 3.48Å; V2659-C2667 PolarHBondContact O-N 3.13Å; V2659-C2667 VanDerWaalsContact O-O 3.08Å; V2659-C2667 PolarHBondContact O-SG 3.35Å; V2659-C2667 VanDerWaalsContact O-SG 3.36Å; V2659-R2669 HydrophobicContact CB-CB 4.05Å; V2659-R2669 HydrophobicContact CB-CG 4.11Å; V2659-R2669 HydrophobicContact CG2-CB 4.03Å; V2659-R2669 HydrophobicContact CG2-CG 4.23Å
2660	H	59.6	Low	60	Low	119.6 Å²	119.6	87.6 Å²	87.6	55%	0.554	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	133.4	175.6	-64.2	88	0	0	0	110.6	R2665	H2660-R2665 CarbonylContact C-O 3.5Å; H2660-R2665 VanDerWaalsContact CA-O 3.29Å; H2660-R2665 WeakPolarHBondContact CA-O 3.3Å
2661	D	58	Low	60.3	Low	37.8 Å²	37.8	85.5 Å²	85.5	20%	0.202	45%	0.454	C	S	.	.			trans	-66	167.6	168.3	-145.6	2.4	0	0	0	111.7	N2663 G2664 R2665 C2667 R2700	D2661-N2663 PolarHBondContact O-N 3.15Å; D2661-N2663 WeakPolarHBondContact OD1-CA 3.12Å; D2661-N2663 WeakPolarHBondContact OD1-CB 3.46Å; D2661-N2663 PolarHBondContact OD1-N 2.97Å; D2661-N2663 PolarHBondContact OD2-N 2.92Å; D2661-G2664 PolarHBondContact O-N 3.06Å; D2661-R2665 HydrophobicContact CB-CB 4.4Å; D2661-R2665 WeakPolarHBondContact CB-O 3.46Å; D2661-R2665 PolarHBondContact N-O 3.21Å; D2661-R2665 VanDerWaalsContact N-O 3.11Å; D2661-R2665 WeakPolarHBondContact OD1-CB 3.31Å; D2661-R2665 PolarHBondContact OD1-N 3.1Å; D2661-R2665 VanDerWaalsContact OD1-N 3.1Å; D2661-C2667 PolarHBondContact N-SG 3.38Å; D2661-C2667 PolarHBondContact OD1-SG 3.41Å; D2661-R2700 VanDerWaalsContact CG-CZ 3.47Å; D2661-R2700 VanDerWaalsContact CG-NH2 3.27Å; D2661-R2700 IonicContact OD1-CZ 2.96Å; D2661-R2700 IonicContact OD1-NE 3.11Å; D2661-R2700 PolarHBondContact OD1-NE 3.48Å; D2661-R2700 IonicContact OD1-NH1 3.33Å; D2661-R2700 PolarHBondContact OD1-NH1 2.83Å; D2661-R2700 IonicContact OD1-NH2 3.06Å; D2661-R2700 PolarHBondContact OD1-NH2 3.08Å; D2661-R2700 WeakPolarHBondContact OD2-CD 3.49Å; D2661-R2700 IonicContact OD2-CZ 3.27Å; D2661-R2700 IonicContact OD2-NE 3.41Å; D2661-R2700 PolarHBondContact OD2-NE 3.17Å; D2661-R2700 IonicContact OD2-NH1 3.22Å; D2661-R2700 PolarHBondContact OD2-NH1 3.15Å; D2661-R2700 IonicContact OD2-NH2 3.03Å; D2661-R2700 PolarHBondContact OD2-NH2 3.34Å
2662	S	58.2	Low	60.3	Low	114.2 Å²	114.2	82.9 Å²	82.9	80%	0.799	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-22	172.3	57.8	0	0	0	0	114.2	G2664	S2662-G2664 VanDerWaalsContact C-N 3.31Å; S2662-G2664 PolarHBondContact O-N 2.93Å
2663	N	55.5	Low	60.3	Low	114.8 Å²	114.8	81.2 Å²	81.2	61%	0.614	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	14.5	-178.7	-59.3	-3.9	0	0	0	112.6	D2661 R2665	D2661-N2663 PolarHBondContact O-N 3.15Å; D2661-N2663 WeakPolarHBondContact OD1-CA 3.12Å; D2661-N2663 WeakPolarHBondContact OD1-CB 3.46Å; D2661-N2663 PolarHBondContact OD1-N 2.97Å; D2661-N2663 PolarHBondContact OD2-N 2.92Å; N2663-R2665 VanDerWaalsContact C-N 3.28Å; N2663-R2665 HydrophobicContact CB-CG 4.38Å; N2663-R2665 PolarHBondContact O-N 3.1Å
2664	G	57.8	Low	60.2	Low	54.6 Å²	54.6	83 Å²	83	56%	0.563	44%	0.439	S	S	*	.	S	Bend	trans	69.1	16.1	179.7	0	0	0	0	0	114.6	D2661 S2662	D2661-G2664 PolarHBondContact O-N 3.06Å; S2662-G2664 VanDerWaalsContact C-N 3.31Å; S2662-G2664 PolarHBondContact O-N 2.93Å
2665	R	57.7	Low	59.9	Low	135.6 Å²	135.6	84.3 Å²	84.3	51%	0.512	45%	0.446	S	S	.	.			trans	-95.9	131.4	-177.8	-62.4	-178.4	-179.4	-167.6	-2.2	110.4	H2660 D2661 N2663 C2667 S2865	H2660-R2665 CarbonylContact C-O 3.5Å; H2660-R2665 VanDerWaalsContact CA-O 3.29Å; H2660-R2665 WeakPolarHBondContact CA-O 3.3Å; D2661-R2665 HydrophobicContact CB-CB 4.4Å; D2661-R2665 WeakPolarHBondContact CB-O 3.46Å; D2661-R2665 PolarHBondContact N-O 3.21Å; D2661-R2665 VanDerWaalsContact N-O 3.11Å; D2661-R2665 WeakPolarHBondContact OD1-CB 3.31Å; D2661-R2665 PolarHBondContact OD1-N 3.1Å; D2661-R2665 VanDerWaalsContact OD1-N 3.1Å; N2663-R2665 VanDerWaalsContact C-N 3.28Å; N2663-R2665 HydrophobicContact CB-CG 4.38Å; N2663-R2665 PolarHBondContact O-N 3.1Å; R2665-C2667 PolarHBondContact O-N 3.15Å; R2665-C2667 PolarHBondContact O-SG 3.16Å; R2665-S2865 VanDerWaalsContact NH1-CB 3.28Å
2666	P	61.4	Low	59.6	Low	49.6 Å²	49.6	80.1 Å²	80.1	32%	0.322	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	133	174.9	26.9	-33.7	0	0	0	110.5	P2653 C2658 V2659 V2861	P2653-P2666 HydrophobicContact CG-CB 3.85Å; P2653-P2666 HydrophobicContact CG-CG 4.3Å; C2658-P2666 VanDerWaalsContact SG-CA 3.58Å; C2658-P2666 WeakPolarHBondContact SG-CB 3.32Å; V2659-P2666 CarbonylContact O-C 3.49Å; V2659-P2666 WeakPolarHBondContact O-CA 3.46Å; P2666-V2861 HydrophobicContact CG-CG1 4.33Å; P2666-V2861 HydrophobicContact CG-CG2 3.84Å
2667	C	62.8	Low	59.3	Low	7.8 Å²	7.8	82.8 Å²	82.8	5%	0.053	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	149.2	-179.7	23.2	0	0	0	0	110	C2658 V2659 D2661 R2665 R2669 V2698 R2700	C2658-C2667 WeakPolarHBondContact CA-O 3.47Å; V2659-C2667 PolarHBondContact N-O 3.22Å; V2659-C2667 VanDerWaalsContact N-O 3.13Å; V2659-C2667 WeakPolarHBondContact O-CB 3.48Å; V2659-C2667 PolarHBondContact O-N 3.13Å; V2659-C2667 VanDerWaalsContact O-O 3.08Å; V2659-C2667 PolarHBondContact O-SG 3.35Å; V2659-C2667 VanDerWaalsContact O-SG 3.36Å; D2661-C2667 PolarHBondContact N-SG 3.38Å; D2661-C2667 PolarHBondContact OD1-SG 3.41Å; R2665-C2667 PolarHBondContact O-N 3.15Å; R2665-C2667 PolarHBondContact O-SG 3.16Å; C2667-R2669 PolarHBondContact O-N 3.29Å; C2667-V2698 HydrophobicContact CB-CG1 3.61Å; C2667-V2698 VanDerWaalsContact CB-CG1 3.4Å; C2667-V2698 WeakPolarHBondContact SG-CG1 3.39Å; C2667-R2700 HydrophobicContact CB-CG 4.23Å; C2667-R2700 PolarHBondContact SG-NH2 2.87Å
2668	F	65.5	Low	58.8	Low	42 Å²	42	86.1 Å²	86.1	18%	0.184	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	117.6	178.6	-151.6	-87.5	0	0	0	109.5	D2656 I2657 K2670 V2698 R2699 F2855 W2857 E2858 V2861	D2656-F2668 HydrophobicContact CB-CB 4.06Å; D2656-F2668 HydrophobicContact CB-CD1 4.41Å; I2657-F2668 HydrophobicContact CG2-CD2 3.24Å; I2657-F2668 HydrophobicContact CG2-CE2 3.39Å; I2657-F2668 VanDerWaalsContact CG2-CE2 3.41Å; I2657-F2668 HydrophobicContact CG2-CG 4.13Å; I2657-F2668 HydrophobicContact CG2-CZ 4.33Å; F2668-K2670 HydrophobicContact CD1-CB 4.38Å; F2668-K2670 HydrophobicContact CE1-CB 3.64Å; F2668-K2670 HydrophobicContact CZ-CB 4.22Å; F2668-V2698 CarbonylContact O-C 3.57Å; F2668-V2698 VanDerWaalsContact O-CA 3.28Å; F2668-V2698 WeakPolarHBondContact O-CA 3.28Å; F2668-R2699 HydrophobicContact CB-CB 4.19Å; F2668-R2699 HydrophobicContact CB-CG 3.9Å; F2668-R2699 HydrophobicContact CD1-CB 3.96Å; F2668-R2699 HydrophobicContact CD1-CG 3.99Å; F2668-R2699 VanDerWaalsContact CD1-NE 3.26Å; F2668-R2699 HydrophobicContact CG-CB 4.38Å; F2668-R2699 HydrophobicContact CG-CG 4.2Å; F2668-R2699 PolarHBondContact N-O 3.17Å; F2668-R2699 PolarHBondContact O-N 3.13Å; F2668-F2855 AromaticContact CD2-CD2 3.89Å; F2668-F2855 HydrophobicContact CD2-CD2 3.89Å; F2668-F2855 AromaticContact CD2-CE2 3.68Å; F2668-F2855 HydrophobicContact CD2-CE2 3.68Å; F2668-F2855 HydrophobicContact CE2-CD2 4.06Å; F2668-F2855 AromaticContact CE2-CE2 3.36Å; F2668-F2855 HydrophobicContact CE2-CE2 3.9Å; F2668-F2855 HydrophobicContact CE2-CZ 4.06Å; F2668-F2855 HydrophobicContact CZ-CE2 4.23Å; F2668-W2857 HydrophobicContact CB-CH2 3.86Å; F2668-W2857 HydrophobicContact CB-CZ2 4.09Å; F2668-W2857 AromaticContact CD2-CZ2 3.99Å; F2668-W2857 HydrophobicContact CD2-CZ2 4.19Å; F2668-W2857 HydrophobicContact CG-CZ2 4.27Å; F2668-E2858 WeakPolarHBondContact CB-OE1 3.47Å; F2668-V2861 HydrophobicContact CD2-CG2 3.89Å; F2668-V2861 HydrophobicContact CE2-CB 4.08Å; F2668-V2861 HydrophobicContact CE2-CG1 4.08Å; F2668-V2861 HydrophobicContact CE2-CG2 3.36Å; F2668-V2861 HydrophobicContact CZ-CG2 4.24Å
2669	R	68.5	Low	58.3	Low	59.6 Å²	59.6	90.8 Å²	90.8	23%	0.225	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	113.3	171.2	-162.7	179.7	-176.8	-166	1.2	108.8	I2657 V2659 C2667 T2671 Y2696 S2697 V2698	I2657-R2669 HydrophobicContact CB-CB 4.49Å; I2657-R2669 PolarHBondContact N-O 3.27Å; I2657-R2669 PolarHBondContact O-N 3.04Å; V2659-R2669 HydrophobicContact CB-CB 4.05Å; V2659-R2669 HydrophobicContact CB-CG 4.11Å; V2659-R2669 HydrophobicContact CG2-CB 4.03Å; V2659-R2669 HydrophobicContact CG2-CG 4.23Å; C2667-R2669 PolarHBondContact O-N 3.29Å; R2669-T2671 PolarHBondContact O-N 2.84Å; R2669-Y2696 HydrophobicContact CB-CG 4.49Å; R2669-Y2696 VanDerWaalsContact CD-CG 3.46Å; R2669-Y2696 HydrophobicContact CG-CD2 3.75Å; R2669-Y2696 HydrophobicContact CG-CE2 4.18Å; R2669-Y2696 HydrophobicContact CG-CG 4.04Å; R2669-Y2696 VanDerWaalsContact CZ-CE1 3.42Å; R2669-Y2696 VanDerWaalsContact NE-CE1 3.33Å; R2669-Y2696 VanDerWaalsContact NE-CE2 3.34Å; R2669-Y2696 VanDerWaalsContact NE-CG 3.25Å; R2669-Y2696 VanDerWaalsContact NE-CZ 3.32Å; R2669-Y2696 VanDerWaalsContact NH2-CD1 3.29Å; R2669-Y2696 PolarHBondContact NH2-OH 2.95Å; R2669-Y2696 VanDerWaalsContact NH2-OH 3.11Å; R2669-S2697 CarbonylContact C-O 3.54Å; R2669-S2697 WeakPolarHBondContact CA-O 3.34Å; R2669-V2698 HydrophobicContact CB-CG2 4.29Å
2670	K	68.1	Low	57.4	Low	99.4 Å²	99.4	96.7 Å²	96.7	43%	0.432	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.2	166.3	171.5	165.6	-173.2	175.2	0	108.9	D2654 D2656 F2668 L2672 Y2696 S2697	D2654-K2670 IonicContact OD2-NZ 3.56Å; D2654-K2670 PolarHBondContact OD2-NZ 3.43Å; D2656-K2670 VanDerWaalsContact OD1-CA 3.32Å; D2656-K2670 WeakPolarHBondContact OD1-CA 3.44Å; D2656-K2670 WeakPolarHBondContact OD1-CB 3.46Å; D2656-K2670 VanDerWaalsContact OD1-CD 3.32Å; D2656-K2670 WeakPolarHBondContact OD1-CD 3.31Å; D2656-K2670 WeakPolarHBondContact OD1-CG 3.38Å; D2656-K2670 IonicContact OD1-NZ 3.74Å; D2656-K2670 VanDerWaalsContact OD2-CB 3.3Å; D2656-K2670 WeakPolarHBondContact OD2-CB 3.34Å; D2656-K2670 VanDerWaalsContact OD2-CD 3.23Å; D2656-K2670 WeakPolarHBondContact OD2-CD 3.37Å; D2656-K2670 WeakPolarHBondContact OD2-CG 3.47Å; F2668-K2670 HydrophobicContact CD1-CB 4.38Å; F2668-K2670 HydrophobicContact CE1-CB 3.64Å; F2668-K2670 HydrophobicContact CZ-CB 4.22Å; K2670-L2672 PolarHBondContact O-N 3.02Å; K2670-Y2696 CarbonylContact O-C 3.39Å; K2670-Y2696 VanDerWaalsContact O-CA 3.29Å; K2670-Y2696 WeakPolarHBondContact O-CA 3.44Å; K2670-S2697 WeakPolarHBondContact CB-OG 3.28Å; K2670-S2697 PolarHBondContact N-O 3.03Å; K2670-S2697 PolarHBondContact O-N 3.18Å; K2670-S2697 PolarHBondContact O-OG 3Å; K2670-S2697 VanDerWaalsContact O-OG 3.06Å
2671	T	66.8	Low	57	Low	61.8 Å²	61.8	96.6 Å²	96.6	38%	0.379	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	134.6	167.8	39.5	0	0	0	0	109.7	D2656 I2657 R2669 K2694 P2695	D2656-T2671 PolarHBondContact OD1-N 2.84Å; D2656-T2671 PolarHBondContact OD1-OG1 3.14Å; I2657-T2671 HydrophobicContact CD1-CG2 4.01Å; R2669-T2671 PolarHBondContact O-N 2.84Å; T2671-K2694 HydrophobicContact CG2-CB 3.78Å; T2671-K2694 HydrophobicContact CG2-CD 4.23Å; T2671-P2695 WeakPolarHBondContact CA-O 3.37Å
2672	L	62.1	Low	56.2	Low	48.4 Å²	48.4	102.5 Å²	102.5	25%	0.253	56%	0.557	S	S	.	*			trans	-95.5	115.8	172.8	-60.6	-179.7	0	0	0	107.9	K2670 I2674 P2695 T2722 Y2724 P2725	K2670-L2672 PolarHBondContact O-N 3.02Å; L2672-I2674 PolarHBondContact O-N 3.16Å; L2672-P2695 HydrophobicContact CB-CB 4.45Å; L2672-P2695 HydrophobicContact CB-CG 4.3Å; L2672-P2695 WeakPolarHBondContact CB-O 3.49Å; L2672-P2695 PolarHBondContact N-O 2.98Å; L2672-P2695 VanDerWaalsContact O-CG 3.31Å; L2672-P2695 WeakPolarHBondContact O-CG 3.41Å; L2672-T2722 HydrophobicContact CD1-CG2 3.46Å; L2672-T2722 VanDerWaalsContact CD1-CG2 3.46Å; L2672-T2722 HydrophobicContact CG-CG2 4.45Å; L2672-Y2724 HydrophobicContact CD1-CD1 4.42Å; L2672-Y2724 HydrophobicContact CD1-CE1 4.29Å; L2672-Y2724 HydrophobicContact CD2-CE1 4.48Å; L2672-P2725 HydrophobicContact CD1-CG 4.29Å
2673	N	57.6	Low	55.6	Low	139 Å²	139	102.7 Å²	102.7	74%	0.743	55%	0.553	S	S	*	*			trans	-68.8	113.8	157.3	-66.5	11.2	0	0	0	106
2674	I	56.1	Low	54.7	Low	91.8 Å²	91.8	102.9 Å²	102.9	47%	0.471	56%	0.564	S	S	.	*			trans	-86.4	136.3	154	-59.5	-179.7	0	0	0	104.8	L2672 D2676 P2695 Y2724	L2672-I2674 PolarHBondContact O-N 3.16Å; I2674-D2676 WeakPolarHBondContact CB-OD2 3.11Å; I2674-D2676 HydrophobicContact CG2-CB 4.32Å; I2674-D2676 VanDerWaalsContact CG2-CG 3.41Å; I2674-D2676 VanDerWaalsContact CG2-OD1 3.29Å; I2674-D2676 WeakPolarHBondContact CG2-OD1 3.43Å; I2674-D2676 WeakPolarHBondContact CG2-OD2 3.45Å; I2674-D2676 PolarHBondContact O-N 3Å; I2674-P2695 HydrophobicContact CD1-CB 4.44Å; I2674-P2695 HydrophobicContact CD1-CG 3.76Å; I2674-P2695 HydrophobicContact CG1-CG 3.97Å; I2674-Y2724 HydrophobicContact CD1-CD1 4.21Å; I2674-Y2724 HydrophobicContact CD1-CE1 4.07Å
2675	D	51.8	Low	53.6	Low	133.6 Å²	133.6	103.7 Å²	103.7	71%	0.714	57%	0.572	S	S	*	*			trans	-60.7	84.5	175.5	-47.9	-51.1	0	0	0	109.5	D2677 R2803	D2675-D2677 VanDerWaalsContact C-N 3.29Å; D2675-D2677 PolarHBondContact O-N 3.28Å; D2675-R2803 IonicContact OD2-CZ 3.85Å; D2675-R2803 IonicContact OD2-NH1 2.67Å; D2675-R2803 IonicContact OD2-NH2 2.67Å; D2675-R2803 PolarHBondContact OD2-NH2 2.89Å
2676	D	46.9	Very low	52.6	Low	109.6 Å²	109.6	101.2 Å²	101.2	59%	0.586	58%	0.58	S	S	*	*			trans	-101.2	94.4	160.8	-84.4	-34.6	0	0	0	106.9	I2674 D2678 R2727	I2674-D2676 WeakPolarHBondContact CB-OD2 3.11Å; I2674-D2676 HydrophobicContact CG2-CB 4.32Å; I2674-D2676 VanDerWaalsContact CG2-CG 3.41Å; I2674-D2676 VanDerWaalsContact CG2-OD1 3.29Å; I2674-D2676 WeakPolarHBondContact CG2-OD1 3.43Å; I2674-D2676 WeakPolarHBondContact CG2-OD2 3.45Å; I2674-D2676 PolarHBondContact O-N 3Å; D2676-D2678 PolarHBondContact O-N 3.05Å; D2676-R2727 IonicContact OD1-CZ 2.9Å; D2676-R2727 IonicContact OD1-NH1 3.76Å; D2676-R2727 IonicContact OD1-NH2 3.66Å; D2676-R2727 PolarHBondContact OD1-NH2 3.14Å; D2676-R2727 IonicContact OD2-CZ 2.9Å; D2676-R2727 IonicContact OD2-NH2 3.11Å; D2676-R2727 PolarHBondContact OD2-NH2 3.08Å
2677	D	50.5	Low	51.3	Low	156 Å²	156	105 Å²	105	83%	0.834	61%	0.608	S	S	*	*			trans	-82.4	62.7	173.6	-72.8	-60.6	0	0	0	111.4	D2675 D2679	D2675-D2677 VanDerWaalsContact C-N 3.29Å; D2675-D2677 PolarHBondContact O-N 3.28Å; D2677-D2679 PolarHBondContact O-N 2.85Å
2678	D	50	Low	50.1	Low	145 Å²	145	108.1 Å²	108.1	78%	0.775	64%	0.641	S	S	*	*			trans	-131.2	109.1	178.6	-76.2	-34.8	0	0	0	113.1	D2676	D2676-D2678 PolarHBondContact O-N 3.05Å
2679	D	46.6	Very low	48.8	Very low	142.2 Å²	142.2	117.1 Å²	117.1	76%	0.76	67%	0.674	S	S	*	*			trans	1	119.8	164.5	-70.2	-38.7	0	0	0	118.9	D2677 V2681	D2677-D2679 PolarHBondContact O-N 2.85Å; D2679-V2681 HydrophobicContact CB-CG2 4Å; D2679-V2681 PolarHBondContact O-N 2.98Å; D2679-V2681 VanDerWaalsContact OD1-CG2 3.28Å; D2679-V2681 WeakPolarHBondContact OD1-CG2 3.19Å
2680	D	44.9	Very low	47.6	Very low	167.6 Å²	167.6	120.3 Å²	120.3	90%	0.896	69%	0.691	S	S	*	*			trans	-5.5	82.9	148.8	-77.3	-26.6	0	0	0	116.3
2681	V	50.8	Low	46.8	Very low	117.4 Å²	117.4	120.5 Å²	120.5	71%	0.712	70%	0.697	S	S	*	*			trans	-136.9	99.4	162.2	-124.9	0	0	0	0	112.4	D2679 V2683	D2679-V2681 HydrophobicContact CB-CG2 4Å; D2679-V2681 PolarHBondContact O-N 2.98Å; D2679-V2681 VanDerWaalsContact OD1-CG2 3.28Å; D2679-V2681 WeakPolarHBondContact OD1-CG2 3.19Å; V2681-V2683 VanDerWaalsContact C-N 3.29Å; V2681-V2683 HydrophobicContact CB-CG2 4.34Å; V2681-V2683 HydrophobicContact CG1-CG2 3.75Å; V2681-V2683 PolarHBondContact O-N 3.1Å
2682	D	40.5	Very low	46.2	Very low	163 Å²	163	123.2 Å²	123.2	87%	0.872	71%	0.709	S	S	*	*			trans	-72.1	80.4	176	-111.1	-32.6	0	0	0	112.2	S2684	D2682-S2684 PolarHBondContact O-N 3.26Å; D2682-S2684 PolarHBondContact O-OG 2.86Å
2683	V	45.6	Very low	45.9	Very low	118.4 Å²	118.4	126 Å²	126	72%	0.718	72%	0.724	S	S	*	*			trans	-98.8	71.6	171.8	-169.3	0	0	0	0	110.5	V2681 G2685	V2681-V2683 VanDerWaalsContact C-N 3.29Å; V2681-V2683 HydrophobicContact CB-CG2 4.34Å; V2681-V2683 HydrophobicContact CG1-CG2 3.75Å; V2681-V2683 PolarHBondContact O-N 3.1Å; V2683-G2685 VanDerWaalsContact C-N 3.34Å; V2683-G2685 PolarHBondContact O-N 3.14Å
2684	S	36.4	Very low	46.3	Very low	118.8 Å²	118.8	124.1 Å²	124.1	83%	0.831	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	91.5	173.4	-32.5	0	0	0	0	111.1	D2682	D2682-S2684 PolarHBondContact O-N 3.26Å; D2682-S2684 PolarHBondContact O-OG 2.86Å
2685	G	34.5	Very low	46.9	Very low	72 Å²	72	120.9 Å²	120.9	74%	0.742	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	177.1	23.5	175.8	0	0	0	0	0	117.2	V2683 S2687	V2683-G2685 VanDerWaalsContact C-N 3.34Å; V2683-G2685 PolarHBondContact O-N 3.14Å; G2685-S2687 PolarHBondContact O-N 2.86Å
2686	A	36.5	Very low	47.8	Very low	81.8 Å²	81.8	117.9 Å²	117.9	68%	0.676	67%	0.674	S	S	*	*			trans	-116.3	65.5	175.6	0	0	0	0	0	115.2	G2688	A2686-G2688 PolarHBondContact O-N 3.19Å
2687	S	35.8	Very low	49.1	Very low	130.8 Å²	130.8	113.2 Å²	113.2	92%	0.915	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	111.8	170.1	-137.1	0	0	0	0	113.5	G2685	G2685-S2687 PolarHBondContact O-N 2.86Å
2688	G	37.3	Very low	50.3	Low	71.8 Å²	71.8	106.5 Å²	106.5	74%	0.74	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-172.7	32.4	174.1	0	0	0	0	0	117.4	A2686	A2686-G2688 PolarHBondContact O-N 3.19Å
2689	R	37.2	Very low	51.6	Low	231 Å²	231	102.3 Å²	102.3	87%	0.872	59%	0.587	S	S	*	*	S	Bend	trans	-160.1	58	178.5	-73.3	178.5	-175.5	-108.5	2.1	113
2690	H	43.3	Very low	53	Low	127.8 Å²	127.8	100.1 Å²	100.1	59%	0.592	57%	0.568	S	S	*	*			trans	-158.8	48.5	-177	-108.3	-50.3	0	0	0	116.2	D2692 N2693 K2694	H2690-D2692 VanDerWaalsContact C-N 3.29Å; H2690-D2692 IonicContact CE1-OD2 2.6Å; H2690-D2692 IonicContact CG-OD2 3.61Å; H2690-D2692 IonicContact ND1-OD2 3.11Å; H2690-D2692 PolarHBondContact ND1-OD2 2.81Å; H2690-N2693 PolarHBondContact CE1-ND2 3.45Å; H2690-N2693 PolarHBondContact NE2-ND2 3.17Å; H2690-K2694 VanDerWaalsContact O-CE 3.27Å; H2690-K2694 WeakPolarHBondContact O-CE 3.21Å
2691	D	51	Low	54.5	Low	102.6 Å²	102.6	93.9 Å²	93.9	55%	0.549	54%	0.535	S	S	.	.	S	Bend	trans	-96.5	-15.7	166.7	-101.1	-32.5	0	0	0	113.1	N2693 K2694	D2691-N2693 VanDerWaalsContact C-N 3.29Å; D2691-N2693 PolarHBondContact O-N 3.19Å; D2691-K2694 PolarHBondContact O-N 3.11Å; D2691-K2694 WeakPolarHBondContact OD1-CD 3.34Å; D2691-K2694 VanDerWaalsContact OD1-CE 3.31Å; D2691-K2694 WeakPolarHBondContact OD1-CE 3.3Å; D2691-K2694 IonicContact OD1-NZ 2.92Å; D2691-K2694 PolarHBondContact OD1-NZ 3.03Å
2692	D	54.4	Low	55.8	Low	118.8 Å²	118.8	91.3 Å²	91.3	64%	0.635	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.6	-177.6	-58.1	-57.1	0	0	0	113.8	H2690 K2694	H2690-D2692 VanDerWaalsContact C-N 3.29Å; H2690-D2692 IonicContact CE1-OD2 2.6Å; H2690-D2692 IonicContact CG-OD2 3.61Å; H2690-D2692 IonicContact ND1-OD2 3.11Å; H2690-D2692 PolarHBondContact ND1-OD2 2.81Å; D2692-K2694 VanDerWaalsContact C-N 3.3Å; D2692-K2694 PolarHBondContact O-N 2.99Å
2693	N	57	Low	57.5	Low	106.2 Å²	106.2	87.7 Å²	87.7	57%	0.568	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	1.5	-176.4	-71.1	-13	0	0	0	114	H2690 D2691 P2725	H2690-N2693 PolarHBondContact CE1-ND2 3.45Å; H2690-N2693 PolarHBondContact NE2-ND2 3.17Å; D2691-N2693 VanDerWaalsContact C-N 3.29Å; D2691-N2693 PolarHBondContact O-N 3.19Å; N2693-P2725 VanDerWaalsContact O-CG 3.29Å; N2693-P2725 WeakPolarHBondContact O-CG 3.25Å
2694	K	64.4	Low	59.2	Low	100 Å²	100	84.6 Å²	84.6	44%	0.435	48%	0.476	S	S	.	.	S	Bend	trans	-84.7	131.3	177.5	-67.9	172.9	-177.6	165.4	0	110.2	T2671 H2690 D2691 D2692 Y2696	T2671-K2694 HydrophobicContact CG2-CB 3.78Å; T2671-K2694 HydrophobicContact CG2-CD 4.23Å; H2690-K2694 VanDerWaalsContact O-CE 3.27Å; H2690-K2694 WeakPolarHBondContact O-CE 3.21Å; D2691-K2694 PolarHBondContact O-N 3.11Å; D2691-K2694 WeakPolarHBondContact OD1-CD 3.34Å; D2691-K2694 VanDerWaalsContact OD1-CE 3.31Å; D2691-K2694 WeakPolarHBondContact OD1-CE 3.3Å; D2691-K2694 IonicContact OD1-NZ 2.92Å; D2691-K2694 PolarHBondContact OD1-NZ 3.03Å; D2692-K2694 VanDerWaalsContact C-N 3.3Å; D2692-K2694 PolarHBondContact O-N 2.99Å; K2694-Y2696 WeakPolarHBondContact O-CD1 3.45Å
2695	P	69.3	Low	61.1	Low	25.4 Å²	25.4	83 Å²	83	17%	0.165	46%	0.455	C	S	.	.			trans	-63.3	144.1	176.6	27	-32.7	0	0	0	110.6	T2671 L2672 I2674 T2723 Y2724 P2725	T2671-P2695 WeakPolarHBondContact CA-O 3.37Å; L2672-P2695 HydrophobicContact CB-CB 4.45Å; L2672-P2695 HydrophobicContact CB-CG 4.3Å; L2672-P2695 WeakPolarHBondContact CB-O 3.49Å; L2672-P2695 PolarHBondContact N-O 2.98Å; L2672-P2695 VanDerWaalsContact O-CG 3.31Å; L2672-P2695 WeakPolarHBondContact O-CG 3.41Å; I2674-P2695 HydrophobicContact CD1-CB 4.44Å; I2674-P2695 HydrophobicContact CD1-CG 3.76Å; I2674-P2695 HydrophobicContact CG1-CG 3.97Å; P2695-T2723 WeakPolarHBondContact CA-O 3.23Å; P2695-Y2724 HydrophobicContact CB-CD1 3.63Å; P2695-Y2724 VanDerWaalsContact CB-CD1 3.43Å; P2695-Y2724 HydrophobicContact CB-CE1 4.04Å; P2695-Y2724 HydrophobicContact CB-CG 4.36Å; P2695-Y2724 HydrophobicContact CG-CD1 4.32Å; P2695-Y2724 HydrophobicContact CG-CE1 4.43Å; P2695-P2725 HydrophobicContact CB-CG 3.99Å
2696	Y	71	Confident	63	Low	69.8 Å²	69.8	82.3 Å²	82.3	27%	0.274	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	149	-173.8	63.2	-88.5	0	0	0	112.1	R2669 K2670 K2694 V2698 T2722 T2723 P2725	R2669-Y2696 HydrophobicContact CB-CG 4.49Å; R2669-Y2696 VanDerWaalsContact CD-CG 3.46Å; R2669-Y2696 HydrophobicContact CG-CD2 3.75Å; R2669-Y2696 HydrophobicContact CG-CE2 4.18Å; R2669-Y2696 HydrophobicContact CG-CG 4.04Å; R2669-Y2696 VanDerWaalsContact CZ-CE1 3.42Å; R2669-Y2696 VanDerWaalsContact NE-CE1 3.33Å; R2669-Y2696 VanDerWaalsContact NE-CE2 3.34Å; R2669-Y2696 VanDerWaalsContact NE-CG 3.25Å; R2669-Y2696 VanDerWaalsContact NE-CZ 3.32Å; R2669-Y2696 VanDerWaalsContact NH2-CD1 3.29Å; R2669-Y2696 PolarHBondContact NH2-OH 2.95Å; R2669-Y2696 VanDerWaalsContact NH2-OH 3.11Å; K2670-Y2696 CarbonylContact O-C 3.39Å; K2670-Y2696 VanDerWaalsContact O-CA 3.29Å; K2670-Y2696 WeakPolarHBondContact O-CA 3.44Å; K2694-Y2696 WeakPolarHBondContact O-CD1 3.45Å; Y2696-V2698 HydrophobicContact CD2-CG2 3.82Å; Y2696-V2698 HydrophobicContact CE2-CG2 3.81Å; Y2696-T2722 CarbonylContact O-C 3.52Å; Y2696-T2722 WeakPolarHBondContact O-CA 3.27Å; Y2696-T2723 WeakPolarHBondContact CD1-OG1 3.32Å; Y2696-T2723 WeakPolarHBondContact CD2-OG1 3.32Å; Y2696-T2723 VanDerWaalsContact CE1-OG1 3.27Å; Y2696-T2723 WeakPolarHBondContact CE1-OG1 3.44Å; Y2696-T2723 HydrophobicContact CE2-CG2 4.44Å; Y2696-T2723 VanDerWaalsContact CE2-OG1 3.23Å; Y2696-T2723 WeakPolarHBondContact CE2-OG1 3.27Å; Y2696-T2723 PolarHBondContact N-O 3.03Å; Y2696-T2723 VanDerWaalsContact N-O 3.12Å; Y2696-T2723 PolarHBondContact O-N 3.16Å; Y2696-T2723 PolarHBondContact O-OG1 3.22Å; Y2696-P2725 VanDerWaalsContact O-CD 3.28Å; Y2696-P2725 WeakPolarHBondContact O-CD 3.47Å; Y2696-P2725 WeakPolarHBondContact O-CG 3.46Å
2697	S	74.5	Confident	64.5	Low	10.8 Å²	10.8	82.8 Å²	82.8	8%	0.076	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.3	173.7	60.4	0	0	0	0	110.3	R2669 K2670 T2721 T2722 T2723	R2669-S2697 CarbonylContact C-O 3.54Å; R2669-S2697 WeakPolarHBondContact CA-O 3.34Å; K2670-S2697 WeakPolarHBondContact CB-OG 3.28Å; K2670-S2697 PolarHBondContact N-O 3.03Å; K2670-S2697 PolarHBondContact O-N 3.18Å; K2670-S2697 PolarHBondContact O-OG 3Å; K2670-S2697 VanDerWaalsContact O-OG 3.06Å; S2697-T2721 CarbonylContact C-O 3.51Å; S2697-T2721 VanDerWaalsContact CA-O 3.32Å; S2697-T2721 WeakPolarHBondContact CA-O 3.38Å; S2697-T2722 WeakPolarHBondContact CB-OG1 3.43Å; S2697-T2723 WeakPolarHBondContact CA-O 3.42Å
2698	V	74.9	Confident	66.1	Low	14.8 Å²	14.8	79.7 Å²	79.7	9%	0.09	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.8	176.9	175.9	0	0	0	0	109.3	C2667 F2668 R2669 Y2696 R2700 I2720 T2721 T2722 T2723	C2667-V2698 HydrophobicContact CB-CG1 3.61Å; C2667-V2698 VanDerWaalsContact CB-CG1 3.4Å; C2667-V2698 WeakPolarHBondContact SG-CG1 3.39Å; F2668-V2698 CarbonylContact O-C 3.57Å; F2668-V2698 VanDerWaalsContact O-CA 3.28Å; F2668-V2698 WeakPolarHBondContact O-CA 3.28Å; R2669-V2698 HydrophobicContact CB-CG2 4.29Å; Y2696-V2698 HydrophobicContact CD2-CG2 3.82Å; Y2696-V2698 HydrophobicContact CE2-CG2 3.81Å; V2698-R2700 HydrophobicContact CG1-CG 4.39Å; V2698-I2720 CarbonylContact O-C 3.58Å; V2698-I2720 VanDerWaalsContact O-CA 3.31Å; V2698-I2720 WeakPolarHBondContact O-CA 3.25Å; V2698-T2721 WeakPolarHBondContact CB-OG1 3.22Å; V2698-T2721 PolarHBondContact N-O 3.03Å; V2698-T2721 PolarHBondContact O-N 3.09Å; V2698-T2721 PolarHBondContact O-OG1 2.81Å; V2698-T2722 CarbonylContact O-C 3.5Å; V2698-T2722 WeakPolarHBondContact O-CA 3.49Å; V2698-T2723 PolarHBondContact N-O 2.98Å; V2698-T2723 PolarHBondContact O-N 2.74Å
2699	R	77.2	Confident	67.4	Low	57.6 Å²	57.6	86.5 Å²	86.5	22%	0.217	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.9	179.6	-75.4	-178.2	166	174.5	-5.3	111.7	D2656 F2668 V2718 R2719 I2720 T2721 T2722 E2845 M2849 A2853 V2854 E2858	D2656-R2699 IonicContact OD2-CZ 3.3Å; D2656-R2699 IonicContact OD2-NH1 2.66Å; D2656-R2699 PolarHBondContact OD2-NH1 3.3Å; F2668-R2699 HydrophobicContact CB-CB 4.19Å; F2668-R2699 HydrophobicContact CB-CG 3.9Å; F2668-R2699 HydrophobicContact CD1-CB 3.96Å; F2668-R2699 HydrophobicContact CD1-CG 3.99Å; F2668-R2699 VanDerWaalsContact CD1-NE 3.26Å; F2668-R2699 HydrophobicContact CG-CB 4.38Å; F2668-R2699 HydrophobicContact CG-CG 4.2Å; F2668-R2699 PolarHBondContact N-O 3.17Å; F2668-R2699 PolarHBondContact O-N 3.13Å; R2699-V2718 HydrophobicContact CB-CG1 3.83Å; R2699-V2718 HydrophobicContact CG-CG1 4.01Å; R2699-R2719 CarbonylContact C-O 3.57Å; R2699-R2719 WeakPolarHBondContact CA-O 3.29Å; R2699-I2720 HydrophobicContact CB-CG1 4.09Å; R2699-I2720 HydrophobicContact CB-CG2 4.36Å; R2699-I2720 HydrophobicContact CG-CG1 4.3Å; R2699-I2720 HydrophobicContact CG-CG2 4.44Å; R2699-T2721 CarbonylContact C-O 3.58Å; R2699-T2721 WeakPolarHBondContact CA-O 3.39Å; R2699-T2722 HydrophobicContact CG-CG2 4Å; R2699-T2722 WeakPolarHBondContact CG-OG1 3.44Å; R2699-E2845 IonicContact NH2-OE2 3.51Å; R2699-M2849 VanDerWaalsContact NH1-CE 3.33Å; R2699-A2853 VanDerWaalsContact CZ-O 3.28Å; R2699-A2853 PolarHBondContact NH1-O 3.44Å; R2699-A2853 PolarHBondContact NH2-O 2.93Å; R2699-V2854 VanDerWaalsContact NH2-CA 3.28Å; R2699-V2854 VanDerWaalsContact NH2-CG2 3.33Å; R2699-E2858 IonicContact CZ-OE1 3.55Å; R2699-E2858 VanDerWaalsContact CZ-OE1 3.23Å; R2699-E2858 IonicContact CZ-OE2 3.79Å; R2699-E2858 VanDerWaalsContact NE-CD 3.32Å; R2699-E2858 IonicContact NE-OE1 3.09Å; R2699-E2858 PolarHBondContact NE-OE1 3.33Å; R2699-E2858 IonicContact NE-OE2 3.18Å; R2699-E2858 PolarHBondContact NE-OE2 3.13Å; R2699-E2858 IonicContact NH2-OE1 3.44Å; R2699-E2858 PolarHBondContact NH2-OE1 3Å; R2699-E2858 VanDerWaalsContact NH2-OE1 3.13Å; R2699-E2858 IonicContact NH2-OE2 2.71Å; R2699-E2858 PolarHBondContact NH2-OE2 3.23Å
2700	R	75.4	Confident	68.5	Low	95.8 Å²	95.8	81.6 Å²	81.6	36%	0.362	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	138.3	176.3	-68.8	-178.6	-151.7	148.1	-1.3	111.1	D2661 C2667 V2698 V2718 R2719 I2720 T2721	D2661-R2700 VanDerWaalsContact CG-CZ 3.47Å; D2661-R2700 VanDerWaalsContact CG-NH2 3.27Å; D2661-R2700 IonicContact OD1-CZ 2.96Å; D2661-R2700 IonicContact OD1-NE 3.11Å; D2661-R2700 PolarHBondContact OD1-NE 3.48Å; D2661-R2700 IonicContact OD1-NH1 3.33Å; D2661-R2700 PolarHBondContact OD1-NH1 2.83Å; D2661-R2700 IonicContact OD1-NH2 3.06Å; D2661-R2700 PolarHBondContact OD1-NH2 3.08Å; D2661-R2700 WeakPolarHBondContact OD2-CD 3.49Å; D2661-R2700 IonicContact OD2-CZ 3.27Å; D2661-R2700 IonicContact OD2-NE 3.41Å; D2661-R2700 PolarHBondContact OD2-NE 3.17Å; D2661-R2700 IonicContact OD2-NH1 3.22Å; D2661-R2700 PolarHBondContact OD2-NH1 3.15Å; D2661-R2700 IonicContact OD2-NH2 3.03Å; D2661-R2700 PolarHBondContact OD2-NH2 3.34Å; C2667-R2700 HydrophobicContact CB-CG 4.23Å; C2667-R2700 PolarHBondContact SG-NH2 2.87Å; V2698-R2700 HydrophobicContact CG1-CG 4.39Å; R2700-V2718 CarbonylContact O-C 3.56Å; R2700-V2718 WeakPolarHBondContact O-CA 3.37Å; R2700-R2719 PolarHBondContact N-O 2.97Å; R2700-R2719 PolarHBondContact O-N 2.93Å; R2700-I2720 CarbonylContact O-C 3.55Å; R2700-I2720 WeakPolarHBondContact O-CA 3.3Å; R2700-T2721 PolarHBondContact N-O 3.32Å; R2700-T2721 PolarHBondContact O-N 2.99Å; R2700-T2721 PolarHBondContact O-OG1 3.37Å
2701	I	78.2	Confident	69.5	Low	38.2 Å²	38.2	83.6 Å²	83.6	20%	0.196	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	138.2	167.4	-57.6	169.9	0	0	0	109	I2704 Y2716 V2718 R2719 I2720 V2854 W2857 E2858 I2859 F2862	I2701-I2704 HydrophobicContact CG2-CD1 4.43Å; I2701-I2704 HydrophobicContact CG2-CG1 4.27Å; I2701-Y2716 HydrophobicContact CD1-CD1 4.04Å; I2701-Y2716 HydrophobicContact CD1-CE1 4.44Å; I2701-Y2716 HydrophobicContact CG2-CD1 4Å; I2701-V2718 HydrophobicContact CB-CG1 4.36Å; I2701-V2718 HydrophobicContact CD1-CG1 3.93Å; I2701-V2718 HydrophobicContact CG1-CG1 3.84Å; I2701-V2718 HydrophobicContact CG1-CG2 4.45Å; I2701-V2718 HydrophobicContact CG2-CG1 3.64Å; I2701-R2719 WeakPolarHBondContact CA-O 3.31Å; I2701-I2720 HydrophobicContact CG1-CG1 4.31Å; I2701-V2854 HydrophobicContact CD1-CG1 3.7Å; I2701-V2854 HydrophobicContact CG1-CG1 4.25Å; I2701-W2857 HydrophobicContact CD1-CD2 4.43Å; I2701-W2857 HydrophobicContact CD1-CH2 4.13Å; I2701-W2857 HydrophobicContact CD1-CZ2 3.97Å; I2701-W2857 HydrophobicContact CD1-CZ3 4.43Å; I2701-E2858 HydrophobicContact CD1-CB 3.99Å; I2701-E2858 WeakPolarHBondContact CD1-O 3.16Å; I2701-E2858 HydrophobicContact CG1-CB 4.31Å; I2701-I2859 HydrophobicContact CD1-CB 4.38Å; I2701-I2859 HydrophobicContact CD1-CG1 3.82Å; I2701-F2862 HydrophobicContact CB-CB 3.98Å; I2701-F2862 HydrophobicContact CB-CD2 3.73Å; I2701-F2862 HydrophobicContact CB-CE2 4.42Å; I2701-F2862 HydrophobicContact CB-CG 3.89Å; I2701-F2862 HydrophobicContact CD1-CB 4.09Å; I2701-F2862 HydrophobicContact CG2-CB 4.24Å; I2701-F2862 HydrophobicContact CG2-CD1 4.05Å; I2701-F2862 HydrophobicContact CG2-CD2 3.6Å; I2701-F2862 HydrophobicContact CG2-CE1 4.31Å; I2701-F2862 HydrophobicContact CG2-CE2 3.89Å; I2701-F2862 HydrophobicContact CG2-CG 3.67Å; I2701-F2862 HydrophobicContact CG2-CZ 4.24Å; I2701-F2862 WeakPolarHBondContact O-CD2 3.44Å
2702	V	76.6	Confident	69.9	Low	62.4 Å²	62.4	83.8 Å²	83.8	38%	0.378	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	-34.4	-179.2	174.7	0	0	0	0	112.4	K2717 R2719 T2721 F2862	V2702-K2717 PolarHBondContact N-O 3.12Å; V2702-R2719 HydrophobicContact CB-CB 4.44Å; V2702-R2719 HydrophobicContact CG2-CB 3.55Å; V2702-R2719 VanDerWaalsContact CG2-CB 3.44Å; V2702-R2719 HydrophobicContact CG2-CG 4.41Å; V2702-R2719 PolarHBondContact N-O 3.48Å; V2702-T2721 HydrophobicContact CB-CG2 4.24Å; V2702-T2721 HydrophobicContact CG2-CG2 3.59Å; V2702-T2721 VanDerWaalsContact CG2-OG1 3.29Å; V2702-T2721 WeakPolarHBondContact CG2-OG1 3.32Å; V2702-F2862 WeakPolarHBondContact O-CE2 3.12Å
2703	E	77.3	Confident	70.3	Confident	87.4 Å²	87.4	83.8 Å²	83.8	41%	0.408	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	151.8	-173	-152.9	179.8	147.7	0	0	110.2	K2717 R2719 W2848	E2703-K2717 HydrophobicContact CB-CB 3.56Å; E2703-K2717 HydrophobicContact CB-CD 3.81Å; E2703-K2717 HydrophobicContact CB-CG 4.37Å; E2703-K2717 HydrophobicContact CG-CD 4.36Å; E2703-K2717 PolarHBondContact N-O 2.96Å; E2703-K2717 PolarHBondContact O-N 3.07Å; E2703-K2717 VanDerWaalsContact OE2-CD 3.27Å; E2703-K2717 WeakPolarHBondContact OE2-CD 3.36Å; E2703-K2717 WeakPolarHBondContact OE2-CE 3.28Å; E2703-K2717 IonicContact OE2-NZ 2.99Å; E2703-K2717 PolarHBondContact OE2-NZ 2.98Å; E2703-R2719 HydrophobicContact CB-CB 3.81Å; E2703-R2719 PolarHBondContact O-N 3.07Å; E2703-R2719 IonicContact OE1-NH1 3.18Å; E2703-R2719 IonicContact OE2-CZ 3.62Å; E2703-R2719 IonicContact OE2-NE 2.71Å; E2703-R2719 IonicContact OE2-NH1 3.44Å; E2703-R2719 PolarHBondContact OE2-NH1 2.89Å; E2703-W2848 HydrophobicContact CB-CH2 4.24Å; E2703-W2848 HydrophobicContact CG-CH2 4.37Å
2704	I	80.6	Confident	71	Confident	53.2 Å²	53.2	79.3 Å²	79.3	27%	0.273	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	121.1	176.1	-58.4	179.6	0	0	0	107.9	I2701 P2706 W2711 A2714 Y2716 F2862 M2863	I2701-I2704 HydrophobicContact CG2-CD1 4.43Å; I2701-I2704 HydrophobicContact CG2-CG1 4.27Å; I2704-P2706 WeakPolarHBondContact O-CD 3.46Å; I2704-W2711 HydrophobicContact CG2-CZ3 4.16Å; I2704-A2714 HydrophobicContact CG2-CB 3.78Å; I2704-Y2716 HydrophobicContact CD1-CD1 4.12Å; I2704-Y2716 HydrophobicContact CD1-CE1 3.83Å; I2704-Y2716 HydrophobicContact CG1-CD1 3.88Å; I2704-Y2716 HydrophobicContact CG1-CE1 3.96Å; I2704-Y2716 HydrophobicContact CG2-CD1 3.45Å; I2704-Y2716 VanDerWaalsContact CG2-CD1 3.45Å; I2704-Y2716 HydrophobicContact CG2-CE1 4.36Å; I2704-Y2716 HydrophobicContact CG2-CG 4.17Å; I2704-F2862 HydrophobicContact CD1-CD1 3.85Å; I2704-F2862 HydrophobicContact CD1-CE1 3.49Å; I2704-F2862 VanDerWaalsContact CD1-CE1 3.47Å; I2704-F2862 HydrophobicContact CG1-CD1 4.29Å; I2704-F2862 HydrophobicContact CG1-CE1 3.65Å; I2704-F2862 HydrophobicContact CG1-CZ 4.29Å; I2704-M2863 HydrophobicContact CD1-CE 4.19Å
2705	Q	76.2	Confident	71.7	Confident	84.4 Å²	84.4	76.8 Å²	76.8	39%	0.394	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	112	175.5	-175.9	179.7	35	0	0	109.6	L2707 A2714 N2715 K2717 W2848	Q2705-L2707 PolarHBondContact O-N 3.02Å; Q2705-A2714 CarbonylContact O-C 3.58Å; Q2705-A2714 VanDerWaalsContact O-CA 3.27Å; Q2705-A2714 WeakPolarHBondContact O-CA 3.35Å; Q2705-N2715 HydrophobicContact CB-CB 4.33Å; Q2705-N2715 PolarHBondContact N-O 3.07Å; Q2705-N2715 PolarHBondContact O-N 3.09Å; Q2705-K2717 HydrophobicContact CB-CB 4.44Å; Q2705-K2717 PolarHBondContact N-O 3.48Å; Q2705-K2717 PolarHBondContact O-N 2.89Å; Q2705-W2848 HydrophobicContact CB-CE3 4.37Å; Q2705-W2848 HydrophobicContact CB-CH2 3.64Å; Q2705-W2848 HydrophobicContact CB-CZ3 3.5Å; Q2705-W2848 VanDerWaalsContact CB-CZ3 3.49Å
2706	P	73.9	Confident	72.2	Confident	57.6 Å²	57.6	77.2 Å²	77.2	37%	0.374	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	128.5	171.7	28.9	-34.1	0	0	0	110.3	I2704 W2711 Y2716	I2704-P2706 WeakPolarHBondContact O-CD 3.46Å; P2706-W2711 HydrophobicContact CB-CD2 3.68Å; P2706-W2711 HydrophobicContact CB-CE3 4.15Å; P2706-W2711 HydrophobicContact CB-CG 3.87Å; P2706-W2711 HydrophobicContact CB-CZ2 4.13Å; P2706-W2711 HydrophobicContact CG-CD2 4.17Å; P2706-W2711 HydrophobicContact CG-CH2 4.27Å; P2706-W2711 HydrophobicContact CG-CZ2 3.77Å; P2706-Y2716 HydrophobicContact CB-CD1 4.46Å; P2706-Y2716 HydrophobicContact CB-CE1 4.1Å
2707	L	69.5	Low	72.7	Confident	92.6 Å²	92.6	75.9 Å²	75.9	49%	0.485	35%	0.353	S	S	.	.	S	Bend	trans	-88.8	-8.9	177.1	-72.9	172.7	0	0	0	112.5	Q2705 Q2713 K2717 W2848	Q2705-L2707 PolarHBondContact O-N 3.02Å; L2707-Q2713 HydrophobicContact CB-CB 4.16Å; L2707-Q2713 HydrophobicContact CD1-CB 4.25Å; L2707-Q2713 PolarHBondContact N-O 3.21Å; L2707-K2717 HydrophobicContact CD1-CB 4.38Å; L2707-W2848 HydrophobicContact CD1-CH2 3.56Å; L2707-W2848 HydrophobicContact CD1-CZ3 3.7Å
2708	D	68.1	Low	73	Confident	65.6 Å²	65.6	75.5 Å²	75.5	35%	0.351	35%	0.35	S	S	.	.	S	Bend	trans	-126.2	148.3	177	178.1	36.8	0	0	0	112.6	F2710 W2711	D2708-F2710 PolarHBondContact O-N 3.08Å; D2708-F2710 VanDerWaalsContact O-N 3.1Å; D2708-F2710 WeakPolarHBondContact OD1-CD2 3.17Å; D2708-F2710 WeakPolarHBondContact OD2-CA 3.21Å; D2708-F2710 VanDerWaalsContact OD2-CB 3.31Å; D2708-F2710 WeakPolarHBondContact OD2-CB 3.33Å; D2708-F2710 WeakPolarHBondContact OD2-CD2 3.26Å; D2708-F2710 PolarHBondContact OD2-N 3.21Å; D2708-F2710 VanDerWaalsContact OD2-N 3.15Å; D2708-W2711 PolarHBondContact O-N 2.89Å
2709	R	65.7	Low	73.3	Confident	214 Å²	214	79.1 Å²	79.1	81%	0.808	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-20	179	-170.3	178.2	-177.3	-177.6	1.6	113
2710	F	59.1	Low	73.5	Confident	129.4 Å²	129.4	77.6 Å²	77.6	57%	0.568	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	4.8	-177.8	-52.7	-71.1	0	0	0	114.1	R2604 D2708 L2712	R2604-F2710 PolarHBondContact NH1-O 3.16Å; D2708-F2710 PolarHBondContact O-N 3.08Å; D2708-F2710 VanDerWaalsContact O-N 3.1Å; D2708-F2710 WeakPolarHBondContact OD1-CD2 3.17Å; D2708-F2710 WeakPolarHBondContact OD2-CA 3.21Å; D2708-F2710 VanDerWaalsContact OD2-CB 3.31Å; D2708-F2710 WeakPolarHBondContact OD2-CB 3.33Å; D2708-F2710 WeakPolarHBondContact OD2-CD2 3.26Å; D2708-F2710 PolarHBondContact OD2-N 3.21Å; D2708-F2710 VanDerWaalsContact OD2-N 3.15Å; F2710-L2712 HydrophobicContact CB-CD1 4.14Å; F2710-L2712 HydrophobicContact CB-CG 3.99Å; F2710-L2712 PolarHBondContact O-N 3.05Å; F2710-L2712 VanDerWaalsContact O-N 3.09Å
2711	W	64.5	Low	73.6	Confident	168.8 Å²	168.8	74.3 Å²	74.3	64%	0.639	35%	0.348	S	S	*	.			trans	47.8	40.8	-179.8	-68.9	62.4	0	0	0	113	I2704 P2706 D2708 Q2713	I2704-W2711 HydrophobicContact CG2-CZ3 4.16Å; P2706-W2711 HydrophobicContact CB-CD2 3.68Å; P2706-W2711 HydrophobicContact CB-CE3 4.15Å; P2706-W2711 HydrophobicContact CB-CG 3.87Å; P2706-W2711 HydrophobicContact CB-CZ2 4.13Å; P2706-W2711 HydrophobicContact CG-CD2 4.17Å; P2706-W2711 HydrophobicContact CG-CH2 4.27Å; P2706-W2711 HydrophobicContact CG-CZ2 3.77Å; D2708-W2711 PolarHBondContact O-N 2.89Å; W2711-Q2713 VanDerWaalsContact C-N 3.31Å; W2711-Q2713 PolarHBondContact O-N 2.92Å; W2711-Q2713 VanDerWaalsContact O-N 3.15Å
2712	L	59.5	Low	73.6	Confident	106.8 Å²	106.8	73.1 Å²	73.1	56%	0.559	34%	0.343	S	S	*	.	S	Bend	trans	-76.1	-6.1	-179.5	-67.8	172.8	0	0	0	114.2	A2600 F2710	A2600-L2712 HydrophobicContact CB-CD2 3.86Å; F2710-L2712 HydrophobicContact CB-CD1 4.14Å; F2710-L2712 HydrophobicContact CB-CG 3.99Å; F2710-L2712 PolarHBondContact O-N 3.05Å; F2710-L2712 VanDerWaalsContact O-N 3.09Å
2713	Q	64	Low	73.5	Confident	119 Å²	119	71.5 Å²	71.5	56%	0.556	33%	0.333	S	S	*	.	S	Bend	trans	-144.9	132.7	170.3	-71.1	-178.6	-21.8	0	0	107.6	L2707 W2711 N2715	L2707-Q2713 HydrophobicContact CB-CB 4.16Å; L2707-Q2713 HydrophobicContact CD1-CB 4.25Å; L2707-Q2713 PolarHBondContact N-O 3.21Å; W2711-Q2713 VanDerWaalsContact C-N 3.31Å; W2711-Q2713 PolarHBondContact O-N 2.92Å; W2711-Q2713 VanDerWaalsContact O-N 3.15Å; Q2713-N2715 PolarHBondContact O-N 3.22Å; Q2713-N2715 VanDerWaalsContact O-N 3.12Å
2714	A	71.3	Confident	73.1	Confident	11.8 Å²	11.8	71.6 Å²	71.6	10%	0.098	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138.3	177.1	0	0	0	0	0	111.5	I2704 Q2705 Y2716 E2851	I2704-A2714 HydrophobicContact CG2-CB 3.78Å; Q2705-A2714 CarbonylContact O-C 3.58Å; Q2705-A2714 VanDerWaalsContact O-CA 3.27Å; Q2705-A2714 WeakPolarHBondContact O-CA 3.35Å; A2714-Y2716 HydrophobicContact CB-CD2 4.34Å; A2714-Y2716 HydrophobicContact CB-CE2 4.08Å; A2714-Y2716 WeakPolarHBondContact O-CD2 2.79Å; A2714-Y2716 PolarHBondContact O-N 3.32Å; A2714-E2851 HydrophobicContact CB-CB 4.39Å; A2714-E2851 PolarHBondContact N-OE2 3.11Å; A2714-E2851 PolarHBondContact O-N 3.24Å
2715	N	77.9	Confident	72.2	Confident	48.4 Å²	48.4	71.2 Å²	71.2	26%	0.259	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	134.5	162.7	-77.4	-27.3	0	0	0	109	Q2705 Q2713 W2848 M2849	Q2705-N2715 HydrophobicContact CB-CB 4.33Å; Q2705-N2715 PolarHBondContact N-O 3.07Å; Q2705-N2715 PolarHBondContact O-N 3.09Å; Q2713-N2715 PolarHBondContact O-N 3.22Å; Q2713-N2715 VanDerWaalsContact O-N 3.12Å; N2715-W2848 HydrophobicContact CB-CE3 3.89Å; N2715-W2848 HydrophobicContact CB-CZ3 4.35Å; N2715-M2849 CarbonylContact C-O 3.52Å; N2715-M2849 WeakPolarHBondContact CA-O 3.45Å
2716	Y	80	Confident	71.1	Confident	32.6 Å²	32.6	69.4 Å²	69.4	13%	0.128	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.4	177.9	-65.2	-92.3	0	0	0	109	I2701 I2704 P2706 A2714 V2718 M2849 E2851 V2854 I2859	I2701-Y2716 HydrophobicContact CD1-CD1 4.04Å; I2701-Y2716 HydrophobicContact CD1-CE1 4.44Å; I2701-Y2716 HydrophobicContact CG2-CD1 4Å; I2704-Y2716 HydrophobicContact CD1-CD1 4.12Å; I2704-Y2716 HydrophobicContact CD1-CE1 3.83Å; I2704-Y2716 HydrophobicContact CG1-CD1 3.88Å; I2704-Y2716 HydrophobicContact CG1-CE1 3.96Å; I2704-Y2716 HydrophobicContact CG2-CD1 3.45Å; I2704-Y2716 VanDerWaalsContact CG2-CD1 3.45Å; I2704-Y2716 HydrophobicContact CG2-CE1 4.36Å; I2704-Y2716 HydrophobicContact CG2-CG 4.17Å; P2706-Y2716 HydrophobicContact CB-CD1 4.46Å; P2706-Y2716 HydrophobicContact CB-CE1 4.1Å; A2714-Y2716 HydrophobicContact CB-CD2 4.34Å; A2714-Y2716 HydrophobicContact CB-CE2 4.08Å; A2714-Y2716 WeakPolarHBondContact O-CD2 2.79Å; A2714-Y2716 PolarHBondContact O-N 3.32Å; Y2716-V2718 PolarHBondContact O-N 3.17Å; Y2716-M2849 PolarHBondContact N-O 3.07Å; Y2716-M2849 PolarHBondContact O-N 3.12Å; Y2716-E2851 HydrophobicContact CD2-CB 4.42Å; Y2716-E2851 HydrophobicContact CE2-CB 3.94Å; Y2716-E2851 HydrophobicContact CE2-CG 4.05Å; Y2716-V2854 HydrophobicContact CD2-CG2 4.09Å; Y2716-V2854 HydrophobicContact CG-CG2 4.21Å; Y2716-I2859 HydrophobicContact CD1-CG1 4.33Å; Y2716-I2859 HydrophobicContact CE1-CD1 4.07Å; Y2716-I2859 HydrophobicContact CE1-CG1 3.88Å; Y2716-I2859 HydrophobicContact CE1-CG2 4.18Å; Y2716-I2859 HydrophobicContact CE2-CD1 4.21Å
2717	K	82.9	Confident	70	Confident	42.6 Å²	42.6	76.3 Å²	76.3	19%	0.185	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	111.7	170.9	-162.3	-175.8	-177.6	-159.9	0	108	V2702 E2703 Q2705 L2707 E2846 W2848	V2702-K2717 PolarHBondContact N-O 3.12Å; E2703-K2717 HydrophobicContact CB-CB 3.56Å; E2703-K2717 HydrophobicContact CB-CD 3.81Å; E2703-K2717 HydrophobicContact CB-CG 4.37Å; E2703-K2717 HydrophobicContact CG-CD 4.36Å; E2703-K2717 PolarHBondContact N-O 2.96Å; E2703-K2717 PolarHBondContact O-N 3.07Å; E2703-K2717 VanDerWaalsContact OE2-CD 3.27Å; E2703-K2717 WeakPolarHBondContact OE2-CD 3.36Å; E2703-K2717 WeakPolarHBondContact OE2-CE 3.28Å; E2703-K2717 IonicContact OE2-NZ 2.99Å; E2703-K2717 PolarHBondContact OE2-NZ 2.98Å; Q2705-K2717 HydrophobicContact CB-CB 4.44Å; Q2705-K2717 PolarHBondContact N-O 3.48Å; Q2705-K2717 PolarHBondContact O-N 2.89Å; L2707-K2717 HydrophobicContact CD1-CB 4.38Å; K2717-E2846 VanDerWaalsContact CE-CD 3.46Å; K2717-E2846 WeakPolarHBondContact CE-OE2 3.35Å; K2717-E2846 HydrophobicContact CG-CB 4.42Å; K2717-E2846 IonicContact NZ-OE1 3.78Å; K2717-E2846 PolarHBondContact NZ-OE1 3.32Å; K2717-E2846 IonicContact NZ-OE2 3Å; K2717-E2846 PolarHBondContact NZ-OE2 2.95Å; K2717-W2848 HydrophobicContact CB-CD2 4.08Å; K2717-W2848 HydrophobicContact CB-CE3 3.77Å; K2717-W2848 HydrophobicContact CB-CH2 3.79Å; K2717-W2848 HydrophobicContact CB-CZ2 4.08Å; K2717-W2848 HydrophobicContact CB-CZ3 3.81Å; K2717-W2848 HydrophobicContact CD-CH2 4.29Å; K2717-W2848 HydrophobicContact CD-CZ2 3.93Å; K2717-W2848 HydrophobicContact CG-CD2 4.17Å; K2717-W2848 HydrophobicContact CG-CE3 4.37Å; K2717-W2848 HydrophobicContact CG-CH2 4.33Å; K2717-W2848 HydrophobicContact CG-CZ2 4.11Å; K2717-W2848 HydrophobicContact CG-CZ3 4.46Å
2718	V	80.8	Confident	68.8	Low	2.6 Å²	2.6	76.5 Å²	76.5	2%	0.016	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.8	-176.6	-178.1	0	0	0	0	108.9	R2699 R2700 I2701 Y2716 I2720 E2846 K2847 M2849 V2854	R2699-V2718 HydrophobicContact CB-CG1 3.83Å; R2699-V2718 HydrophobicContact CG-CG1 4.01Å; R2700-V2718 CarbonylContact O-C 3.56Å; R2700-V2718 WeakPolarHBondContact O-CA 3.37Å; I2701-V2718 HydrophobicContact CB-CG1 4.36Å; I2701-V2718 HydrophobicContact CD1-CG1 3.93Å; I2701-V2718 HydrophobicContact CG1-CG1 3.84Å; I2701-V2718 HydrophobicContact CG1-CG2 4.45Å; I2701-V2718 HydrophobicContact CG2-CG1 3.64Å; Y2716-V2718 PolarHBondContact O-N 3.17Å; V2718-I2720 HydrophobicContact CG1-CG1 4.2Å; V2718-E2846 WeakPolarHBondContact O-CA 3.35Å; V2718-K2847 PolarHBondContact N-O 3.08Å; V2718-K2847 PolarHBondContact O-N 3.2Å; V2718-M2849 HydrophobicContact CB-CG 4.33Å; V2718-M2849 HydrophobicContact CB-SD 3.96Å; V2718-M2849 HydrophobicContact CG1-SD 4.2Å; V2718-M2849 HydrophobicContact CG2-CB 4.13Å; V2718-M2849 HydrophobicContact CG2-CG 4.09Å; V2718-M2849 HydrophobicContact CG2-SD 3.8Å; V2718-V2854 HydrophobicContact CG2-CG2 4.21Å
2719	R	80.5	Confident	67.4	Low	91 Å²	91	80.9 Å²	80.9	34%	0.343	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	123.7	170.8	-176.3	179.3	-69.9	175.6	-2.9	108.9	R2699 R2700 I2701 V2702 E2703 T2721 V2844 E2845 E2846	R2699-R2719 CarbonylContact C-O 3.57Å; R2699-R2719 WeakPolarHBondContact CA-O 3.29Å; R2700-R2719 PolarHBondContact N-O 2.97Å; R2700-R2719 PolarHBondContact O-N 2.93Å; I2701-R2719 WeakPolarHBondContact CA-O 3.31Å; V2702-R2719 HydrophobicContact CB-CB 4.44Å; V2702-R2719 HydrophobicContact CG2-CB 3.55Å; V2702-R2719 VanDerWaalsContact CG2-CB 3.44Å; V2702-R2719 HydrophobicContact CG2-CG 4.41Å; V2702-R2719 PolarHBondContact N-O 3.48Å; E2703-R2719 HydrophobicContact CB-CB 3.81Å; E2703-R2719 PolarHBondContact O-N 3.07Å; E2703-R2719 IonicContact OE1-NH1 3.18Å; E2703-R2719 IonicContact OE2-CZ 3.62Å; E2703-R2719 IonicContact OE2-NE 2.71Å; E2703-R2719 IonicContact OE2-NH1 3.44Å; E2703-R2719 PolarHBondContact OE2-NH1 2.89Å; R2719-T2721 HydrophobicContact CG-CG2 4.23Å; R2719-V2844 HydrophobicContact CG-CG1 3.58Å; R2719-E2845 CarbonylContact C-O 3.47Å; R2719-E2845 WeakPolarHBondContact CA-O 3.44Å; R2719-E2846 HydrophobicContact CB-CG 4.2Å; R2719-E2846 HydrophobicContact CG-CG 4.22Å; R2719-E2846 IonicContact CZ-OE1 2.96Å; R2719-E2846 VanDerWaalsContact CZ-OE1 3.27Å; R2719-E2846 IonicContact NE-OE1 3.31Å; R2719-E2846 PolarHBondContact NE-OE1 3.17Å; R2719-E2846 IonicContact NH2-OE1 3.28Å; R2719-E2846 PolarHBondContact NH2-OE1 2.98Å
2720	I	80.5	Confident	66.1	Low	26 Å²	26	75.8 Å²	75.8	13%	0.133	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.2	178.4	-51.5	177.7	0	0	0	107.1	V2698 R2699 R2700 I2701 V2718 V2844 E2845 K2847	V2698-I2720 CarbonylContact O-C 3.58Å; V2698-I2720 VanDerWaalsContact O-CA 3.31Å; V2698-I2720 WeakPolarHBondContact O-CA 3.25Å; R2699-I2720 HydrophobicContact CB-CG1 4.09Å; R2699-I2720 HydrophobicContact CB-CG2 4.36Å; R2699-I2720 HydrophobicContact CG-CG1 4.3Å; R2699-I2720 HydrophobicContact CG-CG2 4.44Å; R2700-I2720 CarbonylContact O-C 3.55Å; R2700-I2720 WeakPolarHBondContact O-CA 3.3Å; I2701-I2720 HydrophobicContact CG1-CG1 4.31Å; V2718-I2720 HydrophobicContact CG1-CG1 4.2Å; I2720-V2844 CarbonylContact O-C 3.58Å; I2720-V2844 WeakPolarHBondContact O-CA 3.28Å; I2720-E2845 HydrophobicContact CB-CB 4.4Å; I2720-E2845 PolarHBondContact N-O 3.06Å; I2720-E2845 PolarHBondContact O-N 3.03Å; I2720-K2847 HydrophobicContact CD1-CB 4.19Å
2721	T	79.3	Confident	65.2	Low	25 Å²	25	74.6 Å²	74.6	15%	0.153	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	111	174.9	56.7	0	0	0	0	108.9	S2697 V2698 R2699 R2700 V2702 R2719 V2842 S2843 V2844	S2697-T2721 CarbonylContact C-O 3.51Å; S2697-T2721 VanDerWaalsContact CA-O 3.32Å; S2697-T2721 WeakPolarHBondContact CA-O 3.38Å; V2698-T2721 WeakPolarHBondContact CB-OG1 3.22Å; V2698-T2721 PolarHBondContact N-O 3.03Å; V2698-T2721 PolarHBondContact O-N 3.09Å; V2698-T2721 PolarHBondContact O-OG1 2.81Å; R2699-T2721 CarbonylContact C-O 3.58Å; R2699-T2721 WeakPolarHBondContact CA-O 3.39Å; R2700-T2721 PolarHBondContact N-O 3.32Å; R2700-T2721 PolarHBondContact O-N 2.99Å; R2700-T2721 PolarHBondContact O-OG1 3.37Å; V2702-T2721 HydrophobicContact CB-CG2 4.24Å; V2702-T2721 HydrophobicContact CG2-CG2 3.59Å; V2702-T2721 VanDerWaalsContact CG2-OG1 3.29Å; V2702-T2721 WeakPolarHBondContact CG2-OG1 3.32Å; R2719-T2721 HydrophobicContact CG-CG2 4.23Å; T2721-V2842 HydrophobicContact CG2-CG1 4.16Å; T2721-S2843 CarbonylContact C-O 3.45Å; T2721-S2843 WeakPolarHBondContact CA-O 3.27Å; T2721-V2844 HydrophobicContact CG2-CG1 4.24Å; T2721-V2844 HydrophobicContact CG2-CG2 4.15Å
2722	T	78.1	Confident	63.9	Low	14.2 Å²	14.2	78.1 Å²	78.1	9%	0.087	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	127	174.1	-57.1	0	0	0	0	109.4	L2672 Y2696 S2697 V2698 R2699 Y2724 V2842 S2843	L2672-T2722 HydrophobicContact CD1-CG2 3.46Å; L2672-T2722 VanDerWaalsContact CD1-CG2 3.46Å; L2672-T2722 HydrophobicContact CG-CG2 4.45Å; Y2696-T2722 CarbonylContact O-C 3.52Å; Y2696-T2722 WeakPolarHBondContact O-CA 3.27Å; S2697-T2722 WeakPolarHBondContact CB-OG1 3.43Å; V2698-T2722 CarbonylContact O-C 3.5Å; V2698-T2722 WeakPolarHBondContact O-CA 3.49Å; R2699-T2722 HydrophobicContact CG-CG2 4Å; R2699-T2722 WeakPolarHBondContact CG-OG1 3.44Å; T2722-Y2724 HydrophobicContact CG2-CD2 4.29Å; T2722-Y2724 HydrophobicContact CG2-CE1 4.34Å; T2722-Y2724 HydrophobicContact CG2-CE2 3.79Å; T2722-V2842 CarbonylContact O-C 3.56Å; T2722-V2842 VanDerWaalsContact O-CA 3.29Å; T2722-V2842 WeakPolarHBondContact O-CA 3.37Å; T2722-V2842 WeakPolarHBondContact O-CG1 3.25Å; T2722-S2843 VanDerWaalsContact CB-OG 3.23Å; T2722-S2843 WeakPolarHBondContact CB-OG 3.38Å; T2722-S2843 PolarHBondContact N-O 3.28Å; T2722-S2843 PolarHBondContact O-N 3Å; T2722-S2843 PolarHBondContact O-OG 3.12Å; T2722-S2843 PolarHBondContact OG1-OG 3.29Å
2723	T	73.5	Confident	62.8	Low	28.8 Å²	28.8	84 Å²	84	18%	0.177	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	119.8	179.7	51.3	0	0	0	0	109.9	P2695 Y2696 S2697 V2698 P2725 V2842	P2695-T2723 WeakPolarHBondContact CA-O 3.23Å; Y2696-T2723 WeakPolarHBondContact CD1-OG1 3.32Å; Y2696-T2723 WeakPolarHBondContact CD2-OG1 3.32Å; Y2696-T2723 VanDerWaalsContact CE1-OG1 3.27Å; Y2696-T2723 WeakPolarHBondContact CE1-OG1 3.44Å; Y2696-T2723 HydrophobicContact CE2-CG2 4.44Å; Y2696-T2723 VanDerWaalsContact CE2-OG1 3.23Å; Y2696-T2723 WeakPolarHBondContact CE2-OG1 3.27Å; Y2696-T2723 PolarHBondContact N-O 3.03Å; Y2696-T2723 VanDerWaalsContact N-O 3.12Å; Y2696-T2723 PolarHBondContact O-N 3.16Å; Y2696-T2723 PolarHBondContact O-OG1 3.22Å; S2697-T2723 WeakPolarHBondContact CA-O 3.42Å; V2698-T2723 PolarHBondContact N-O 2.98Å; V2698-T2723 PolarHBondContact O-N 2.74Å; T2723-P2725 WeakPolarHBondContact O-CD 3.27Å; T2723-V2842 HydrophobicContact CG2-CG1 4.13Å; T2723-V2842 HydrophobicContact CG2-CG2 4.09Å
2724	Y	70	Confident	61.7	Low	89.8 Å²	89.8	89.6 Å²	89.6	35%	0.352	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	123.2	171.2	-61.4	-83	0	0	0	109.4	L2672 I2674 P2695 T2722 A2726 N2840 E2841	L2672-Y2724 HydrophobicContact CD1-CD1 4.42Å; L2672-Y2724 HydrophobicContact CD1-CE1 4.29Å; L2672-Y2724 HydrophobicContact CD2-CE1 4.48Å; I2674-Y2724 HydrophobicContact CD1-CD1 4.21Å; I2674-Y2724 HydrophobicContact CD1-CE1 4.07Å; P2695-Y2724 HydrophobicContact CB-CD1 3.63Å; P2695-Y2724 VanDerWaalsContact CB-CD1 3.43Å; P2695-Y2724 HydrophobicContact CB-CE1 4.04Å; P2695-Y2724 HydrophobicContact CB-CG 4.36Å; P2695-Y2724 HydrophobicContact CG-CD1 4.32Å; P2695-Y2724 HydrophobicContact CG-CE1 4.43Å; T2722-Y2724 HydrophobicContact CG2-CD2 4.29Å; T2722-Y2724 HydrophobicContact CG2-CE1 4.34Å; T2722-Y2724 HydrophobicContact CG2-CE2 3.79Å; Y2724-A2726 PolarHBondContact O-N 3.22Å; Y2724-N2840 WeakPolarHBondContact O-CB 3.31Å; Y2724-E2841 HydrophobicContact CD2-CB 4.28Å; Y2724-E2841 WeakPolarHBondContact CD2-O 3.21Å; Y2724-E2841 PolarHBondContact N-O 3.09Å
2725	P	61.2	Low	60	Low	44.4 Å²	44.4	98.9 Å²	98.9	29%	0.288	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-69.2	133.6	174.6	28.4	-31.7	0	0	0	109.4	L2672 N2693 P2695 Y2696 T2723 R2727	L2672-P2725 HydrophobicContact CD1-CG 4.29Å; N2693-P2725 VanDerWaalsContact O-CG 3.29Å; N2693-P2725 WeakPolarHBondContact O-CG 3.25Å; P2695-P2725 HydrophobicContact CB-CG 3.99Å; Y2696-P2725 VanDerWaalsContact O-CD 3.28Å; Y2696-P2725 WeakPolarHBondContact O-CD 3.47Å; Y2696-P2725 WeakPolarHBondContact O-CG 3.46Å; T2723-P2725 WeakPolarHBondContact O-CD 3.27Å; P2725-R2727 PolarHBondContact O-N 3.03Å; P2725-R2727 VanDerWaalsContact O-N 3.12Å
2726	A	53.7	Low	57.9	Low	47 Å²	47	100.8 Å²	100.8	39%	0.388	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-61.1	122.5	-179.3	0	0	0	0	0	111.2	Y2724 S2728 Q2838 N2840	Y2724-A2726 PolarHBondContact O-N 3.22Å; A2726-S2728 PolarHBondContact O-N 3.25Å; A2726-S2728 VanDerWaalsContact O-N 3.09Å; A2726-Q2838 HydrophobicContact CB-CB 3.71Å; A2726-Q2838 HydrophobicContact CB-CG 3.81Å; A2726-N2840 WeakPolarHBondContact CB-OD1 3.32Å; A2726-N2840 PolarHBondContact N-OD1 3.16Å; A2726-N2840 VanDerWaalsContact N-OD1 3.07Å
2727	R	49.7	Very low	55.8	Low	201 Å²	201	103.6 Å²	103.6	76%	0.758	52%	0.522	S	S	*	.			trans	-59.1	110	171.1	-80	-171.1	174.7	-166.1	0.6	108.6	D2676 P2725 N2729	D2676-R2727 IonicContact OD1-CZ 2.9Å; D2676-R2727 IonicContact OD1-NH1 3.76Å; D2676-R2727 IonicContact OD1-NH2 3.66Å; D2676-R2727 PolarHBondContact OD1-NH2 3.14Å; D2676-R2727 IonicContact OD2-CZ 2.9Å; D2676-R2727 IonicContact OD2-NH2 3.11Å; D2676-R2727 PolarHBondContact OD2-NH2 3.08Å; P2725-R2727 PolarHBondContact O-N 3.03Å; P2725-R2727 VanDerWaalsContact O-N 3.12Å; R2727-N2729 PolarHBondContact O-N 3.19Å
2728	S	43.5	Very low	53.6	Low	98 Å²	98	110.5 Å²	110.5	69%	0.685	55%	0.554	S	S	*	*			trans	-72.1	107.8	175.5	69.9	0	0	0	0	109.3	A2726 S2730	A2726-S2728 PolarHBondContact O-N 3.25Å; A2726-S2728 VanDerWaalsContact O-N 3.09Å; S2728-S2730 PolarHBondContact O-N 3.18Å
2729	N	39	Very low	51.5	Low	157.4 Å²	157.4	115.6 Å²	115.6	84%	0.842	59%	0.59	S	S	*	*			trans	-68.9	79.3	173	-84.3	-18.9	0	0	0	109.8	R2727 S2731	R2727-N2729 PolarHBondContact O-N 3.19Å; N2729-S2731 VanDerWaalsContact C-N 3.26Å; N2729-S2731 PolarHBondContact O-N 3.05Å; N2729-S2731 PolarHBondContact O-OG 3.09Å
2730	S	39.2	Very low	49.5	Very low	108.2 Å²	108.2	115.9 Å²	115.9	76%	0.757	61%	0.606	S	S	*	*			trans	-82.1	77	176.4	-167.1	0	0	0	0	110.3	S2728 R2732	S2728-S2730 PolarHBondContact O-N 3.18Å; S2730-R2732 PolarHBondContact O-N 3.01Å; S2730-R2732 VanDerWaalsContact O-N 3.09Å
2731	S	39.6	Very low	47.6	Very low	102.8 Å²	102.8	120.9 Å²	120.9	72%	0.719	63%	0.634	S	S	*	*			trans	-67.1	105	169.6	153.4	0	0	0	0	112.1	N2729 R2733	N2729-S2731 VanDerWaalsContact C-N 3.26Å; N2729-S2731 PolarHBondContact O-N 3.05Å; N2729-S2731 PolarHBondContact O-OG 3.09Å; S2731-R2733 PolarHBondContact O-N 3.35Å; S2731-R2733 VanDerWaalsContact O-N 3.13Å
2732	R	38.1	Very low	45.5	Very low	242 Å²	242	131.2 Å²	131.2	91%	0.913	67%	0.669	S	S	*	*			trans	-75.7	85.5	155.6	-87.4	-178.2	180	177.5	1.1	108.9	S2730 R2734	S2730-R2732 PolarHBondContact O-N 3.01Å; S2730-R2732 VanDerWaalsContact O-N 3.09Å; R2732-R2734 PolarHBondContact O-N 3.07Å
2733	R	36.2	Very low	43.5	Very low	232.2 Å²	232.2	134 Å²	134	88%	0.876	70%	0.701	S	S	*	*			trans	-89	91.7	170.6	-167.5	-179.8	-175.8	-162.6	0.9	109.3	S2731 K2735	S2731-R2733 PolarHBondContact O-N 3.35Å; S2731-R2733 VanDerWaalsContact O-N 3.13Å; R2733-K2735 PolarHBondContact O-N 3.13Å; R2733-K2735 VanDerWaalsContact O-N 3.1Å
2734	R	39.8	Very low	41.7	Very low	235.8 Å²	235.8	144.3 Å²	144.3	89%	0.89	74%	0.737	S	S	*	*			trans	-70.2	121.9	176.5	-77.7	173	175	171.9	-2.9	107.6	R2732 A2736	R2732-R2734 PolarHBondContact O-N 3.07Å; R2734-A2736 PolarHBondContact O-N 2.87Å; R2734-A2736 VanDerWaalsContact O-N 3.1Å
2735	K	35.7	Very low	40.1	Very low	206.8 Å²	206.8	144.3 Å²	144.3	90%	0.899	75%	0.75	S	S	*	*			trans	-96.1	100.9	174.2	-151.3	179.9	179.4	-176	0	107.9	R2733 A2737	R2733-K2735 PolarHBondContact O-N 3.13Å; R2733-K2735 VanDerWaalsContact O-N 3.1Å; K2735-A2737 PolarHBondContact O-N 3.25Å
2736	A	34.7	Very low	39.1	Very low	88.4 Å²	88.4	147.2 Å²	147.2	73%	0.731	77%	0.767	S	S	*	*			trans	-88.3	134.7	159	0	0	0	0	0	110.2	R2734 E2738	R2734-A2736 PolarHBondContact O-N 2.87Å; R2734-A2736 VanDerWaalsContact O-N 3.1Å; A2736-E2738 PolarHBondContact O-N 2.8Å
2737	A	36.3	Very low	38.3	Very low	92.6 Å²	92.6	156.4 Å²	156.4	77%	0.765	79%	0.792	S	S	*	*			trans	48.9	115.2	159.6	0	0	0	0	0	114.6	K2735	K2735-A2737 PolarHBondContact O-N 3.25Å
2738	E	35.3	Very low	37.5	Very low	185.8 Å²	185.8	150.2 Å²	150.2	87%	0.868	79%	0.79	S	S	*	*			trans	-160.7	147.5	130.1	-94.9	177.6	-172.8	0	0	113.5	A2736 S2740	A2736-E2738 PolarHBondContact O-N 2.8Å; E2738-S2740 WeakPolarHBondContact OE2-CB 3.47Å; E2738-S2740 PolarHBondContact OE2-OG 2.6Å
2739	S	38.3	Very low	37.5	Very low	109.4 Å²	109.4	151.5 Å²	151.5	77%	0.765	80%	0.796	S	S	*	*			trans	-136.7	158.6	-163.4	57.9	0	0	0	0	112.4
2740	S	38.7	Very low	37.1	Very low	97.6 Å²	97.6	149.2 Å²	149.2	68%	0.683	79%	0.792	S	S	*	*			trans	171	129.7	162	72.4	0	0	0	0	114.4	E2738	E2738-S2740 WeakPolarHBondContact OE2-CB 3.47Å; E2738-S2740 PolarHBondContact OE2-OG 2.6Å
2741	N	39	Very low	36.8	Very low	132.4 Å²	132.4	150.8 Å²	150.8	71%	0.708	79%	0.791	S	S	*	*				114.9	118.8	129.4	-93.7	-58.4	0	0	0	117.5
2742	R	36.4	Very low	36.7	Very low	240 Å²	240	153.1 Å²	153.1	91%	0.906	79%	0.79	S	S	*	*			trans	67	133.4	150	-55.4	173.2	-174.8	-171.1	-1.2	118
2743	G	35	Very low	36.5	Very low	73 Å²	73	148.1 Å²	148.1	75%	0.753	78%	0.781	S	S	*	*			cis	160.9	124.7	-25.4	0	0	0	0	0	114.5
2744	R	35.7	Very low	36.6	Very low	244.8 Å²	244.8	142.3 Å²	142.3	92%	0.924	78%	0.777	S	S	*	*			trans	74	122.7	152.3	-131.1	-175	-171.5	177.5	2.9	113.1
2745	S	36.9	Very low	36.7	Very low	91.4 Å²	91.4	136.7 Å²	136.7	64%	0.639	77%	0.771	S	S	*	*			cis	-178.5	137.8	43.9	-164.5	0	0	0	0	113.9
2746	T	40.8	Very low	36.6	Very low	103.6 Å²	103.6	135.6 Å²	135.6	64%	0.636	77%	0.769	S	S	*	*			trans	95	125.3	136	27.2	0	0	0	0	118.1
2747	R	36.1	Very low	37.1	Very low	242.2 Å²	242.2	136.5 Å²	136.5	91%	0.914	77%	0.767	S	S	*	*			trans	81.5	152.3	134.3	-66.5	163.1	-176.5	-177	-0.2	115.7
2748	G	33.3	Very low	37	Very low	70.2 Å²	70.2	139.3 Å²	139.3	72%	0.724	77%	0.769	S	S	*	*			cis	-152	-179.7	9.5	0	0	0	0	0	112.6
2749	P	43.1	Very low	37	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	77%	0.765	S	S	*	*			trans	-126.9	-175.2	-155.8	42.2	-27.8	0	0	0	115.7
2750	C	30.8	Very low	36.8	Very low	111 Å²	111	138 Å²	138	75%	0.75	76%	0.762	S	S	*	*			trans	125.4	139.9	158.2	-90.1	0	0	0	0	113.5
2751	L	34.1	Very low	36.6	Very low	140.4 Å²	140.4	139.3 Å²	139.3	74%	0.735	77%	0.766	S	S	*	*				85.2	129.1	53.9	-98.1	125.2	0	0	0	113.2
2752	Q	35.7	Very low	36.4	Very low	152.2 Å²	152.2	138 Å²	138	71%	0.711	77%	0.767	S	S	*	*				151.3	165.1	102.3	-105.4	171.3	-38.4	0	0	111.8
2753	D	34.9	Very low	36.3	Very low	136.6 Å²	136.6	137.2 Å²	137.2	73%	0.73	76%	0.764	S	S	*	*			trans	102.5	149.9	133.5	-70.1	-30.6	0	0	0	115.5
2754	S	38.2	Very low	36.2	Very low	111 Å²	111	144.5 Å²	144.5	78%	0.776	77%	0.769	S	S	*	*				85.3	159.1	68.7	-104.7	0	0	0	0	114.5
2755	P	41.1	Very low	36.2	Very low	117 Å²	117	142.4 Å²	142.4	76%	0.76	77%	0.766	S	S	*	*				-127.2	175.2	-52.9	40.2	-25.4	0	0	0	115.6
2756	E	34.6	Very low	36	Very low	184.4 Å²	184.4	141.2 Å²	141.2	86%	0.862	77%	0.769	S	S	*	*			trans	-92.6	165.7	156.3	-78.8	-154.7	138.7	0	0	116.3
2757	P	43.9	Very low	35.7	Very low	106 Å²	106	147.6 Å²	147.6	69%	0.688	78%	0.782	S	S	*	*			trans	-122	176.3	-137.9	39.5	-25.6	0	0	0	114.9
2758	D	35.8	Very low	35.5	Very low	152 Å²	152	147.7 Å²	147.7	81%	0.813	78%	0.782	S	S	*	*			trans	177.1	137.3	163.4	-78.5	-35.2	0	0	0	114.5
2759	E	33.8	Very low	35.5	Very low	169 Å²	169	148.2 Å²	148.2	79%	0.79	79%	0.787	S	S	*	*				-157.9	135.7	58	-93	-139.6	108.5	0	0	115.1
2760	S	34.8	Very low	35	Very low	99.2 Å²	99.2	145.7 Å²	145.7	69%	0.694	78%	0.784	S	S	*	*			trans	92.7	108.2	141.3	-68.3	0	0	0	0	120.1
2761	T	34.5	Very low	35.2	Very low	124.6 Å²	124.6	149 Å²	149	76%	0.764	79%	0.788	S	S	*	*			trans	64.9	123.4	131.7	65	0	0	0	0	117.1	R2763	T2761-R2763 VanDerWaalsContact C-N 3.3Å; T2761-R2763 PolarHBondContact O-N 3.05Å
2762	S	34.4	Very low	35.1	Very low	106 Å²	106	153.5 Å²	153.5	74%	0.741	80%	0.795	S	S	*	*				145.9	123.6	97.9	114	0	0	0	0	115	R2764	S2762-R2764 PolarHBondContact O-N 3.21Å
2763	R	35.1	Very low	34.9	Very low	221.6 Å²	221.6	152.9 Å²	152.9	84%	0.836	80%	0.797	S	S	*	*				-154.3	104.2	104.9	-102.6	168.5	-167.9	-157.3	3.3	115.1	T2761 K2765	T2761-R2763 VanDerWaalsContact C-N 3.3Å; T2761-R2763 PolarHBondContact O-N 3.05Å; R2763-K2765 PolarHBondContact O-N 2.76Å; R2763-K2765 VanDerWaalsContact O-N 3.07Å
2764	R	33.6	Very low	35	Very low	227.8 Å²	227.8	151 Å²	151	86%	0.86	80%	0.8	S	S	*	*			trans	38	124.7	145	-75.6	178.8	174	179.4	-1.2	115	S2762	S2762-R2764 PolarHBondContact O-N 3.21Å
2765	K	34.9	Very low	34.9	Very low	199.2 Å²	199.2	154.6 Å²	154.6	87%	0.866	81%	0.805	S	S	*	*				99.5	101.5	68.7	-133.6	176.3	-178.5	175.9	0	112.5	R2763	R2763-K2765 PolarHBondContact O-N 2.76Å; R2763-K2765 VanDerWaalsContact O-N 3.07Å
2766	G	32.1	Very low	34.7	Very low	67.8 Å²	67.8	152.5 Å²	152.5	70%	0.699	81%	0.805	S	S	*	*				128.2	117.8	111.8	0	0	0	0	0	115.6
2767	R	34.9	Very low	34.7	Very low	237.4 Å²	237.4	147.4 Å²	147.4	90%	0.896	80%	0.801	S	S	*	*			trans	90	128.7	143.3	-83.1	177.8	177.2	-164.1	-2.3	115.8
2768	R	32.8	Very low	34.6	Very low	245 Å²	245	152.1 Å²	152.1	93%	0.925	81%	0.811	S	S	*	*				122	134.3	119.9	-75.7	174	177	-171.2	-1.7	112.9
2769	G	31.8	Very low	35.3	Very low	79.6 Å²	79.6	150.3 Å²	150.3	82%	0.821	80%	0.802	S	S	*	*			trans	170.8	143.7	169.5	0	0	0	0	0	114.8
2770	G	32.3	Very low	36.3	Very low	72 Å²	72	148.1 Å²	148.1	74%	0.742	80%	0.801	S	S	*	*			trans	103.3	88.9	177.2	0	0	0	0	0	113.3	R2772	G2770-R2772 PolarHBondContact O-N 3.37Å
2771	Q	35.3	Very low	37.5	Very low	180.4 Å²	180.4	150.1 Å²	150.1	84%	0.843	81%	0.805	S	S	*	*				-25.1	121.1	122.4	-76	-166.2	-24.1	0	0	110.9	N2773	Q2771-N2773 PolarHBondContact O-N 3.17Å
2772	R	32.9	Very low	38.6	Very low	234.6 Å²	234.6	150.9 Å²	150.9	89%	0.885	80%	0.795	S	S	*	*			trans	-122.8	121.3	157.4	-83.3	-174.8	173.3	176.9	-3.6	110.2	G2770 A2774	G2770-R2772 PolarHBondContact O-N 3.37Å; R2772-A2774 PolarHBondContact O-N 2.86Å
2773	N	31.7	Very low	39.9	Very low	139.4 Å²	139.4	149.8 Å²	149.8	75%	0.745	78%	0.781	S	S	*	*			trans	-57.4	126.7	162.2	-68.7	-18.5	0	0	0	112	Q2771 Q2775	Q2771-N2773 PolarHBondContact O-N 3.17Å; N2773-Q2775 PolarHBondContact O-N 3.33Å
2774	A	37	Very low	41	Very low	97.2 Å²	97.2	142.5 Å²	142.5	80%	0.803	76%	0.762	S	S	*	*			trans	-138.7	105.5	157.1	0	0	0	0	0	108	R2772 G2776	R2772-A2774 PolarHBondContact O-N 2.86Å; A2774-G2776 VanDerWaalsContact C-N 3.31Å; A2774-G2776 PolarHBondContact O-N 3.08Å
2775	Q	35	Very low	42	Very low	186.4 Å²	186.4	135.1 Å²	135.1	87%	0.871	75%	0.749	S	S	*	*			trans	-26.5	97.8	138.9	-75.1	155.7	-37.2	0	0	112.1	N2773	N2773-Q2775 PolarHBondContact O-N 3.33Å
2776	G	36.7	Very low	43	Very low	73.4 Å²	73.4	130.6 Å²	130.6	76%	0.757	74%	0.738	S	S	*	*			trans	-119.8	100.7	167.2	0	0	0	0	0	111.6	A2774 K2778	A2774-G2776 VanDerWaalsContact C-N 3.31Å; A2774-G2776 PolarHBondContact O-N 3.08Å; G2776-K2778 PolarHBondContact O-N 3.24Å
2777	G	36.4	Very low	44.2	Very low	76.8 Å²	76.8	132.2 Å²	132.2	79%	0.792	73%	0.731	S	S	*	*			trans	-21	116.8	176.3	0	0	0	0	0	114.8	D2779	G2777-D2779 PolarHBondContact O-N 3.37Å
2778	K	41.2	Very low	45.2	Very low	204.8 Å²	204.8	126.2 Å²	126.2	89%	0.89	71%	0.713	S	S	*	*			trans	-93.4	107.4	141.6	-71.7	-172.2	177.6	-174.9	0	108.4	G2776 P2780	G2776-K2778 PolarHBondContact O-N 3.24Å; K2778-P2780 WeakPolarHBondContact O-CD 3.44Å
2779	D	49.4	Very low	45.4	Very low	114.8 Å²	114.8	116.8 Å²	116.8	61%	0.614	69%	0.692	S	S	*	*			trans	-71.3	122.4	170.9	-146	-30.9	0	0	0	108.8	G2777 D2781 Y2782	G2777-D2779 PolarHBondContact O-N 3.37Å; D2779-D2781 PolarHBondContact O-N 3.17Å; D2779-D2781 WeakPolarHBondContact OD1-CB 3.33Å; D2779-D2781 PolarHBondContact OD1-N 3.17Å; D2779-Y2782 WeakPolarHBondContact O-CB 3.48Å; D2779-Y2782 PolarHBondContact O-N 3.22Å; D2779-Y2782 VanDerWaalsContact O-N 3.09Å
2780	P	54.5	Low	46	Very low	121.2 Å²	121.2	122.9 Å²	122.9	79%	0.787	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-19	179.1	9.2	-7.8	0	0	0	113.2	K2778	K2778-P2780 WeakPolarHBondContact O-CD 3.44Å
2781	D	60.5	Low	46.6	Very low	142.8 Å²	142.8	128.7 Å²	128.7	76%	0.764	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	4.2	-175.7	-64.7	-24.2	0	0	0	113.2	D2779 D2783	D2779-D2781 PolarHBondContact O-N 3.17Å; D2779-D2781 WeakPolarHBondContact OD1-CB 3.33Å; D2779-D2781 PolarHBondContact OD1-N 3.17Å; D2781-D2783 VanDerWaalsContact C-N 3.34Å; D2781-D2783 PolarHBondContact O-N 3.05Å; D2781-D2783 VanDerWaalsContact O-N 3.09Å
2782	Y	58.3	Low	46.7	Very low	141.6 Å²	141.6	125 Å²	125	56%	0.555	68%	0.679	S	S	*	*			trans	-72.8	90.5	177.3	-172.4	-96.3	0	0	0	111.7	D2779 P2784 D2787 E2788	D2779-Y2782 WeakPolarHBondContact O-CB 3.48Å; D2779-Y2782 PolarHBondContact O-N 3.22Å; D2779-Y2782 VanDerWaalsContact O-N 3.09Å; Y2782-P2784 HydrophobicContact CE1-CB 4.3Å; Y2782-P2784 VanDerWaalsContact O-CD 3.3Å; Y2782-P2784 WeakPolarHBondContact O-CD 3.3Å; Y2782-D2787 WeakPolarHBondContact CA-OD2 3.38Å; Y2782-D2787 HydrophobicContact CD2-CB 4.13Å; Y2782-D2787 VanDerWaalsContact CD2-OD2 3.24Å; Y2782-D2787 WeakPolarHBondContact CD2-OD2 3.42Å; Y2782-D2787 HydrophobicContact CE2-CB 3.77Å; Y2782-E2788 VanDerWaalsContact OH-CG 3.29Å; Y2782-E2788 WeakPolarHBondContact OH-CG 3.37Å; Y2782-E2788 PolarHBondContact OH-OE1 2.76Å
2783	D	61.4	Low	46.9	Very low	83 Å²	83	117.2 Å²	117.2	44%	0.444	67%	0.672	S	S	.	*			trans	-92.7	108.4	170.4	-175.3	-4.3	0	0	0	110	D2781 A2785 V2786 D2787	D2781-D2783 VanDerWaalsContact C-N 3.34Å; D2781-D2783 PolarHBondContact O-N 3.05Å; D2781-D2783 VanDerWaalsContact O-N 3.09Å; D2783-A2785 PolarHBondContact O-N 3.13Å; D2783-A2785 VanDerWaalsContact O-N 3.09Å; D2783-A2785 VanDerWaalsContact OD1-CB 3.28Å; D2783-A2785 WeakPolarHBondContact OD1-CB 3.3Å; D2783-A2785 PolarHBondContact OD1-N 3.07Å; D2783-V2786 HydrophobicContact CB-CB 4.26Å; D2783-V2786 HydrophobicContact CB-CG2 3.98Å; D2783-V2786 WeakPolarHBondContact O-CA 3.31Å; D2783-V2786 PolarHBondContact O-N 3.32Å; D2783-V2786 VanDerWaalsContact O-N 3.14Å; D2783-D2787 PolarHBondContact N-OD2 2.92Å; D2783-D2787 PolarHBondContact O-N 3.12Å
2784	P	57.9	Low	47.2	Very low	66.8 Å²	66.8	115.9 Å²	115.9	43%	0.434	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	-15.9	178	26.9	-34.7	0	0	0	113.4	Y2782 V2786 D2787 E2788 V2792	Y2782-P2784 HydrophobicContact CE1-CB 4.3Å; Y2782-P2784 VanDerWaalsContact O-CD 3.3Å; Y2782-P2784 WeakPolarHBondContact O-CD 3.3Å; P2784-V2786 VanDerWaalsContact C-N 3.35Å; P2784-V2786 PolarHBondContact O-N 3.42Å; P2784-D2787 PolarHBondContact O-N 3.46Å; P2784-E2788 HydrophobicContact CB-CG 4.42Å; P2784-E2788 WeakPolarHBondContact O-CB 3.27Å; P2784-E2788 WeakPolarHBondContact O-CG 3.44Å; P2784-E2788 PolarHBondContact O-N 3.21Å; P2784-V2792 VanDerWaalsContact O-CG2 3.27Å; P2784-V2792 WeakPolarHBondContact O-CG2 3.32Å
2785	A	54.2	Low	47.2	Very low	73.4 Å²	73.4	116.4 Å²	116.4	61%	0.607	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-16.5	172.5	0	0	0	0	0	113.6	D2783	D2783-A2785 PolarHBondContact O-N 3.13Å; D2783-A2785 VanDerWaalsContact O-N 3.09Å; D2783-A2785 VanDerWaalsContact OD1-CB 3.28Å; D2783-A2785 WeakPolarHBondContact OD1-CB 3.3Å; D2783-A2785 PolarHBondContact OD1-N 3.07Å
2786	V	56.9	Low	47	Very low	104.8 Å²	104.8	113.8 Å²	113.8	64%	0.635	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-46.5	179.6	179.4	0	0	0	0	111.5	D2783 P2784 G2789	D2783-V2786 HydrophobicContact CB-CB 4.26Å; D2783-V2786 HydrophobicContact CB-CG2 3.98Å; D2783-V2786 WeakPolarHBondContact O-CA 3.31Å; D2783-V2786 PolarHBondContact O-N 3.32Å; D2783-V2786 VanDerWaalsContact O-N 3.14Å; P2784-V2786 VanDerWaalsContact C-N 3.35Å; P2784-V2786 PolarHBondContact O-N 3.42Å; V2786-G2789 WeakPolarHBondContact O-CA 3.47Å; V2786-G2789 PolarHBondContact O-N 3.31Å
2787	D	57.5	Low	46.9	Very low	100.6 Å²	100.6	115.4 Å²	115.4	54%	0.538	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.5	-26.3	-172.3	-87.3	-21.9	0	0	0	113.7	Y2782 D2783 P2784 G2789	Y2782-D2787 WeakPolarHBondContact CA-OD2 3.38Å; Y2782-D2787 HydrophobicContact CD2-CB 4.13Å; Y2782-D2787 VanDerWaalsContact CD2-OD2 3.24Å; Y2782-D2787 WeakPolarHBondContact CD2-OD2 3.42Å; Y2782-D2787 HydrophobicContact CE2-CB 3.77Å; D2783-D2787 PolarHBondContact N-OD2 2.92Å; D2783-D2787 PolarHBondContact O-N 3.12Å; P2784-D2787 PolarHBondContact O-N 3.46Å; D2787-G2789 VanDerWaalsContact C-N 3.26Å; D2787-G2789 PolarHBondContact O-N 2.96Å
2788	E	56.2	Low	46.7	Very low	111.6 Å²	111.6	117.1 Å²	117.1	52%	0.521	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.6	17.3	171.4	-68	-146.5	169.1	0	0	113.1	Y2782 P2784 W2790 R2791	Y2782-E2788 VanDerWaalsContact OH-CG 3.29Å; Y2782-E2788 WeakPolarHBondContact OH-CG 3.37Å; Y2782-E2788 PolarHBondContact OH-OE1 2.76Å; P2784-E2788 HydrophobicContact CB-CG 4.42Å; P2784-E2788 WeakPolarHBondContact O-CB 3.27Å; P2784-E2788 WeakPolarHBondContact O-CG 3.44Å; P2784-E2788 PolarHBondContact O-N 3.21Å; E2788-W2790 PolarHBondContact O-N 3.04Å; E2788-R2791 HydrophobicContact CB-CB 4.27Å; E2788-R2791 VanDerWaalsContact CD-CD 3.44Å; E2788-R2791 PolarHBondContact O-N 3.1Å; E2788-R2791 VanDerWaalsContact O-N 3.12Å; E2788-R2791 IonicContact OE1-CZ 2.7Å; E2788-R2791 IonicContact OE1-NE 3.8Å; E2788-R2791 IonicContact OE1-NH1 2.9Å; E2788-R2791 PolarHBondContact OE1-NH1 3.23Å; E2788-R2791 WeakPolarHBondContact OE2-CD 3.47Å; E2788-R2791 IonicContact OE2-NH1 3.64Å
2789	G	36.8	Very low	46.3	Very low	47.8 Å²	47.8	118.9 Å²	118.9	49%	0.493	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-45.3	65.5	175.5	0	0	0	0	0	115.7	V2786 D2787 R2791	V2786-G2789 WeakPolarHBondContact O-CA 3.47Å; V2786-G2789 PolarHBondContact O-N 3.31Å; D2787-G2789 VanDerWaalsContact C-N 3.26Å; D2787-G2789 PolarHBondContact O-N 2.96Å; G2789-R2791 VanDerWaalsContact C-N 3.28Å; G2789-R2791 PolarHBondContact O-N 2.81Å; G2789-R2791 VanDerWaalsContact O-N 3.11Å
2790	W	43.8	Very low	45.5	Very low	207.2 Å²	207.2	125.1 Å²	125.1	79%	0.785	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.6	16.6	170.8	-36.4	78.8	0	0	0	115.5	S2586 Q2587 E2788	S2586-W2790 WeakPolarHBondContact OG-CZ3 3.13Å; Q2587-W2790 HydrophobicContact CB-CE3 4.42Å; Q2587-W2790 HydrophobicContact CB-CH2 4.36Å; Q2587-W2790 HydrophobicContact CB-CZ3 3.78Å; Q2587-W2790 HydrophobicContact CG-CE3 4.18Å; Q2587-W2790 HydrophobicContact CG-CH2 3.76Å; Q2587-W2790 HydrophobicContact CG-CZ2 4.48Å; Q2587-W2790 HydrophobicContact CG-CZ3 3.58Å; E2788-W2790 PolarHBondContact O-N 3.04Å
2791	R	44.2	Very low	44.5	Very low	195 Å²	195	128.5 Å²	128.5	74%	0.736	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	-1.8	174.2	-79	-178.5	-179.4	-123.5	0.9	115	E2788 G2789 G2793 D2852	E2788-R2791 HydrophobicContact CB-CB 4.27Å; E2788-R2791 VanDerWaalsContact CD-CD 3.44Å; E2788-R2791 PolarHBondContact O-N 3.1Å; E2788-R2791 VanDerWaalsContact O-N 3.12Å; E2788-R2791 IonicContact OE1-CZ 2.7Å; E2788-R2791 IonicContact OE1-NE 3.8Å; E2788-R2791 IonicContact OE1-NH1 2.9Å; E2788-R2791 PolarHBondContact OE1-NH1 3.23Å; E2788-R2791 WeakPolarHBondContact OE2-CD 3.47Å; E2788-R2791 IonicContact OE2-NH1 3.64Å; G2789-R2791 VanDerWaalsContact C-N 3.28Å; G2789-R2791 PolarHBondContact O-N 2.81Å; G2789-R2791 VanDerWaalsContact O-N 3.11Å; R2791-G2793 PolarHBondContact O-N 2.85Å; R2791-D2852 IonicContact NH2-OD1 3.96Å
2792	V	38.8	Very low	43.1	Very low	101.2 Å²	101.2	127.3 Å²	127.3	61%	0.613	69%	0.689	S	S	*	*			trans	-96.2	105.8	178	-108.9	0	0	0	0	112.7	R2584 P2784 V2794	R2584-V2792 VanDerWaalsContact O-CG1 3.28Å; R2584-V2792 WeakPolarHBondContact O-CG1 3.23Å; P2784-V2792 VanDerWaalsContact O-CG2 3.27Å; P2784-V2792 WeakPolarHBondContact O-CG2 3.32Å; V2792-V2794 VanDerWaalsContact C-N 3.32Å; V2792-V2794 HydrophobicContact CB-CG2 4.33Å; V2792-V2794 HydrophobicContact CG1-CG2 3.6Å; V2792-V2794 PolarHBondContact O-N 3.27Å
2793	G	35.7	Very low	41.9	Very low	71.2 Å²	71.2	131.9 Å²	131.9	73%	0.734	71%	0.705	S	S	*	*			trans	-101.2	59.1	-175.4	0	0	0	0	0	115.8	R2791	R2791-G2793 PolarHBondContact O-N 2.85Å
2794	V	38.3	Very low	40.6	Very low	112.2 Å²	112.2	133.7 Å²	133.7	68%	0.68	72%	0.719	S	S	*	*			trans	-115.2	129.5	172.4	-177.2	0	0	0	0	110	V2792 C2796	V2792-V2794 VanDerWaalsContact C-N 3.32Å; V2792-V2794 HydrophobicContact CB-CG2 4.33Å; V2792-V2794 HydrophobicContact CG1-CG2 3.6Å; V2792-V2794 PolarHBondContact O-N 3.27Å; V2794-C2796 PolarHBondContact O-N 3.14Å; V2794-C2796 VanDerWaalsContact O-N 3.16Å
2795	P	38.1	Very low	39.4	Very low	108.2 Å²	108.2	137.5 Å²	137.5	70%	0.703	74%	0.736	S	S	*	*			trans	-76.2	110.6	179.9	4	4.4	0	0	0	112.1	S2797	P2795-S2797 VanDerWaalsContact C-N 3.3Å; P2795-S2797 PolarHBondContact O-N 3.1Å
2796	C	30.9	Very low	38.4	Very low	131 Å²	131	143.2 Å²	143.2	89%	0.885	75%	0.747	S	S	*	*			trans	-76.1	69	174.2	-71	0	0	0	0	112.2	V2794 S2798	V2794-C2796 PolarHBondContact O-N 3.14Å; V2794-C2796 VanDerWaalsContact O-N 3.16Å; C2796-S2798 PolarHBondContact O-N 3.24Å
2797	S	33.9	Very low	37.3	Very low	107.2 Å²	107.2	148.8 Å²	148.8	75%	0.75	76%	0.757	S	S	*	*			trans	-81.7	113.6	173.3	144.3	0	0	0	0	111.9	P2795	P2795-S2797 VanDerWaalsContact C-N 3.3Å; P2795-S2797 PolarHBondContact O-N 3.1Å
2798	S	31.5	Very low	36.2	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	76%	0.763	S	S	*	*			trans	66.7	71.9	170.4	-167.1	0	0	0	0	117.3	C2796	C2796-S2798 PolarHBondContact O-N 3.24Å
2799	R	34	Very low	35.2	Very low	242.6 Å²	242.6	154.1 Å²	154.1	92%	0.915	78%	0.781	S	S	*	*			trans	-145.3	58.9	152.3	-132.6	176.3	-160.2	-150.8	2.5	115.7
2800	R	31.7	Very low	35	Very low	245.6 Å²	245.6	155.4 Å²	155.4	93%	0.927	79%	0.794	S	S	*	*			trans	-112.7	81.1	165.1	-89.3	-175.1	178	-152.1	0.7	111.8
2801	Q	33.8	Very low	34.5	Very low	191 Å²	191	157.3 Å²	157.3	89%	0.893	80%	0.801	S	S	*	*	S	Bend	trans	-159	111.6	163.9	-100.3	170.2	6	0	0	110.4
2802	S	32.1	Very low	34	Very low	117.5 Å²	117.5	153 Å²	153	82%	0.822	80%	0.8	S	S	*	*	S	Bend	trans	124.8	77.2	171.4	-165.6	0	0	0	0	113
2803	R	31.5	Very low	33.9	Very low	239.5 Å²	239.5	153.6 Å²	153.6	90%	0.904	81%	0.809	S	S	*	*	S	Bend	trans	-162.7	49.9	158.4	-123.1	-179.6	-178.9	-173.3	0.1	112	D2675	D2675-R2803 IonicContact OD2-CZ 3.85Å; D2675-R2803 IonicContact OD2-NH1 2.67Å; D2675-R2803 IonicContact OD2-NH2 2.67Å; D2675-R2803 PolarHBondContact OD2-NH2 2.89Å
2804	T	35.1	Very low	34	Very low	121 Å²	121	162 Å²	162	74%	0.742	82%	0.819	S	S	*	*			trans	-146.8	146.3	163.3	36.9	0	0	0	0	108.5
2805	N	32	Very low	33.8	Very low	146 Å²	146	160.2 Å²	160.2	78%	0.781	82%	0.823	S	S	*	*			trans	64.3	108.3	176.4	-51.2	-13.1	0	0	0	115.3
2806	F	33	Very low	33.7	Very low	192 Å²	192	160.8 Å²	160.8	84%	0.842	83%	0.83	S	S	*	*				-141.4	139.1	66.1	-105.7	-99.5	0	0	0	111.4
2807	R	33.7	Very low	34	Very low	223.5 Å²	223.5	163.1 Å²	163.1	84%	0.843	83%	0.825	S	S	*	*			trans	-50.8	126.1	158.4	-70.1	-174.6	179.5	-157	0.2	113.6
2808	S	35.6	Very low	34.2	Very low	94.5 Å²	94.5	162.7 Å²	162.7	66%	0.661	82%	0.822	S	S	*	*				169.3	158.1	113.1	-118.5	0	0	0	0	113
2809	Y	33.8	Very low	34.6	Very low	229.5 Å²	229.5	163.2 Å²	163.2	90%	0.9	82%	0.815	S	S	*	*			trans	67	144.5	168.4	-55.4	-76.1	0	0	0	115.8
2810	G	32.5	Very low	35	Very low	73.75 Å²	73.75	156.7 Å²	156.7	76%	0.76	81%	0.807	S	S	*	*				150.6	108	-93.4	0	0	0	0	0	112.2
2811	R	33.5	Very low	35.5	Very low	248.5 Å²	248.5	152.3 Å²	152.3	94%	0.938	80%	0.802	S	S	*	*			trans	56.3	131.6	163.2	-115.5	-175.2	-174.6	-134.7	1.5	114.3
2812	S	33.6	Very low	36.2	Very low	103 Å²	103	150.5 Å²	150.5	72%	0.72	80%	0.798	S	S	*	*				95.3	118.1	126.3	-173.7	0	0	0	0	115.3
2813	S	37.8	Very low	36.7	Very low	115.75 Å²	115.75	152.4 Å²	152.4	81%	0.809	80%	0.8	S	S	*	*			trans	178.2	155.6	133.4	-86.7	0	0	0	0	112.8
2814	R	37	Very low	37.2	Very low	245.75 Å²	245.75	144.4 Å²	144.4	93%	0.927	79%	0.792	S	S	*	*				-146.7	135.2	-97.2	-139	174.9	176.5	178.4	-3.1	110.7
2815	G	34	Very low	37.4	Very low	74.75 Å²	74.75	146.3 Å²	146.3	77%	0.771	80%	0.797	S	S	*	*			trans	122.3	147.7	167.2	0	0	0	0	0	112.8
2816	S	37.7	Very low	37.9	Very low	122 Å²	122	145.4 Å²	145.4	85%	0.853	80%	0.797	S	S	*	*			cis	147.7	147.6	11.8	-173.5	0	0	0	0	113
2817	F	36.6	Very low	38.1	Very low	178.25 Å²	178.25	144.8 Å²	144.8	78%	0.782	80%	0.797	S	S	*	*			trans	149.8	161.3	160.1	-144.5	-111.7	0	0	0	114.4	D2819	F2817-D2819 HydrophobicContact CD1-CB 3.72Å; F2817-D2819 HydrophobicContact CE1-CB 3.6Å; F2817-D2819 VanDerWaalsContact CE1-CG 3.45Å; F2817-D2819 WeakPolarHBondContact CE1-OD2 3.24Å; F2817-D2819 HydrophobicContact CZ-CB 4.45Å
2818	C	38.7	Very low	38.1	Very low	99.75 Å²	99.75	143.3 Å²	143.3	67%	0.674	80%	0.797	S	S	*	*			trans	-146.6	178.4	-158.2	-3.2	0	0	0	0	110.4
2819	D	38.2	Very low	38.1	Very low	122.25 Å²	122.25	144.7 Å²	144.7	65%	0.654	81%	0.805	S	S	*	*			cis	147.3	144.2	25.1	-89.4	-30.1	0	0	0	110.7	F2817	F2817-D2819 HydrophobicContact CD1-CB 3.72Å; F2817-D2819 HydrophobicContact CE1-CB 3.6Å; F2817-D2819 VanDerWaalsContact CE1-CG 3.45Å; F2817-D2819 WeakPolarHBondContact CE1-OD2 3.24Å; F2817-D2819 HydrophobicContact CZ-CB 4.45Å
2820	S	42.5	Very low	38.1	Very low	106.25 Å²	106.25	137.6 Å²	137.6	74%	0.743	80%	0.802	S	S	*	*			cis	172.6	151	22.7	-67.3	0	0	0	0	111.1
2821	D	42	Very low	38.1	Very low	154 Å²	154	137.7 Å²	137.7	82%	0.824	80%	0.802	S	S	*	*			trans	-94.9	175.8	-178.2	-63.2	-63.5	0	0	0	114.7
2822	D	48.8	Very low	38.2	Very low	152 Å²	152	137.1 Å²	137.1	81%	0.813	80%	0.8	S	S	*	*			trans	-157	151.2	-151.1	-154	-5.5	0	0	0	110.7	G2824	D2822-G2824 VanDerWaalsContact C-N 3.33Å; D2822-G2824 PolarHBondContact O-N 3.42Å
2823	D	43.3	Very low	38.2	Very low	159 Å²	159	142.6 Å²	142.6	85%	0.85	81%	0.805	S	S	*	*			trans	-45.7	130.5	176.9	-80.8	-44.2	0	0	0	116.4	D2825	D2823-D2825 PolarHBondContact O-N 3.08Å; D2823-D2825 VanDerWaalsContact O-N 3.15Å
2824	G	41.6	Very low	37.9	Very low	71.5 Å²	71.5	143.8 Å²	143.8	74%	0.737	80%	0.803	S	S	*	*			trans	-162.3	100.2	170.1	0	0	0	0	0	115.6	D2822 T2826	D2822-G2824 VanDerWaalsContact C-N 3.33Å; D2822-G2824 PolarHBondContact O-N 3.42Å; G2824-T2826 PolarHBondContact O-N 2.85Å; G2824-T2826 VanDerWaalsContact O-N 3.16Å
2825	D	39.3	Very low	38	Very low	159.25 Å²	159.25	140 Å²	140	85%	0.852	80%	0.8	S	S	*	*			trans	-47.3	131	169.9	-77.8	-41.6	0	0	0	115.4	D2823	D2823-D2825 PolarHBondContact O-N 3.08Å; D2823-D2825 VanDerWaalsContact O-N 3.15Å
2826	T	42	Very low	38.1	Very low	128.75 Å²	128.75	145.5 Å²	145.5	79%	0.79	81%	0.805	S	S	*	*				170.2	122.4	128.5	-25.7	0	0	0	0	114.8	G2824	G2824-T2826 PolarHBondContact O-N 2.85Å; G2824-T2826 VanDerWaalsContact O-N 3.16Å
2827	E	37.9	Very low	38	Very low	178.25 Å²	178.25	144.6 Å²	144.6	83%	0.833	80%	0.799	S	S	*	*			trans	-22.5	156.2	154.6	-56.8	-174.7	139.2	0	0	118.2
2828	F	33	Very low	38.1	Very low	193 Å²	193	143.8 Å²	143.8	85%	0.846	80%	0.798	S	S	*	*				94.7	97.5	53.3	-158.6	-99.1	0	0	0	118
2829	C	37	Very low	38.1	Very low	124 Å²	124	149.9 Å²	149.9	84%	0.838	81%	0.807	S	S	*	*			trans	-162.6	128.7	151.8	-94.7	0	0	0	0	112.3
2830	G	33.2	Very low	38.7	Very low	80.75 Å²	80.75	148.8 Å²	148.8	83%	0.832	80%	0.801	S	S	*	*				-145.7	120.6	-89.1	0	0	0	0	0	114.3
2831	G	32.5	Very low	39	Very low	74.25 Å²	74.25	150.8 Å²	150.8	77%	0.765	80%	0.798	S	S	*	*			trans	162.3	121.6	175.4	0	0	0	0	0	114.9
2832	R	36.1	Very low	40.2	Very low	236.75 Å²	236.75	147.3 Å²	147.3	89%	0.893	78%	0.783	S	S	*	*			trans	135.4	116.6	148	-66.2	-175.1	-177.5	-125.8	-1.1	115
2833	R	32.9	Very low	41.2	Very low	218.25 Å²	218.25	142.7 Å²	142.7	82%	0.824	76%	0.762	S	S	*	*			trans	-47.8	151.6	148.9	-70.9	178.2	-125	161.1	-2	114
2834	D	32.4	Very low	42.9	Very low	141.25 Å²	141.25	139.2 Å²	139.2	76%	0.755	75%	0.747	S	S	*	*			trans	68.6	101.8	151.9	-48.1	-30.6	0	0	0	117.6
2835	L	37.7	Very low	44.7	Very low	166.25 Å²	166.25	140.2 Å²	140.2	87%	0.87	73%	0.732	S	S	*	*			trans	-135.4	84.8	130	-95	150	0	0	0	112.4	S2837	L2835-S2837 PolarHBondContact O-N 3.35Å
2836	Q	36.1	Very low	46.8	Very low	189.25 Å²	189.25	136.4 Å²	136.4	88%	0.884	71%	0.709	S	S	*	*			trans	-74.5	102.5	166.4	-78.4	137.5	-11.6	0	0	111	Q2838	Q2836-Q2838 PolarHBondContact O-N 3.4Å
2837	S	36.5	Very low	48.6	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	69%	0.693	S	S	*	*			trans	-117.9	130.6	159.5	-167.7	0	0	0	0	110.4	L2835 R2839	L2835-S2837 PolarHBondContact O-N 3.35Å; S2837-R2839 VanDerWaalsContact C-N 3.34Å; S2837-R2839 PolarHBondContact O-N 2.96Å
2838	Q	37.8	Very low	50.6	Low	161 Å²	161	132.3 Å²	132.3	75%	0.752	67%	0.674	S	S	*	*			trans	-40.8	97.8	178.4	-65.5	176	-2	0	0	113.7	A2726 Q2836 N2840	A2726-Q2838 HydrophobicContact CB-CB 3.71Å; A2726-Q2838 HydrophobicContact CB-CG 3.81Å; Q2836-Q2838 PolarHBondContact O-N 3.4Å; Q2838-N2840 PolarHBondContact O-N 3.25Å
2839	R	38.9	Very low	52.6	Low	228 Å²	228	125 Å²	125	86%	0.86	64%	0.643	S	S	*	*			trans	-80.2	110.2	166.5	-95.9	-178.9	177.5	163.5	-0.2	109.4	S2837 E2841	S2837-R2839 VanDerWaalsContact C-N 3.34Å; S2837-R2839 PolarHBondContact O-N 2.96Å; R2839-E2841 PolarHBondContact O-N 3.22Å; R2839-E2841 VanDerWaalsContact O-N 3.15Å
2840	N	51.8	Low	54.5	Low	99.75 Å²	99.75	121.6 Å²	121.6	53%	0.533	62%	0.621	S	S	.	*			trans	-63.8	126.7	160.3	-71.4	-32.3	0	0	0	108.2	Y2724 A2726 Q2838 V2842	Y2724-N2840 WeakPolarHBondContact O-CB 3.31Å; A2726-N2840 WeakPolarHBondContact CB-OD1 3.32Å; A2726-N2840 PolarHBondContact N-OD1 3.16Å; A2726-N2840 VanDerWaalsContact N-OD1 3.07Å; Q2838-N2840 PolarHBondContact O-N 3.25Å; N2840-V2842 PolarHBondContact O-N 2.89Å
2841	E	49.4	Very low	56.4	Low	146.75 Å²	146.75	120.8 Å²	120.8	69%	0.686	60%	0.596	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.3	117.5	176.9	-68.3	-169.2	161.2	0	0	109.6	Y2724 R2839	Y2724-E2841 HydrophobicContact CD2-CB 4.28Å; Y2724-E2841 WeakPolarHBondContact CD2-O 3.21Å; Y2724-E2841 PolarHBondContact N-O 3.09Å; R2839-E2841 PolarHBondContact O-N 3.22Å; R2839-E2841 VanDerWaalsContact O-N 3.15Å
2842	V	65.9	Low	58.2	Low	81.75 Å²	81.75	123.4 Å²	123.4	50%	0.495	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.3	104.5	178.1	-172.2	0	0	0	0	108.4	T2721 T2722 T2723 N2840 V2844	T2721-V2842 HydrophobicContact CG2-CG1 4.16Å; T2722-V2842 CarbonylContact O-C 3.56Å; T2722-V2842 VanDerWaalsContact O-CA 3.29Å; T2722-V2842 WeakPolarHBondContact O-CA 3.37Å; T2722-V2842 WeakPolarHBondContact O-CG1 3.25Å; T2723-V2842 HydrophobicContact CG2-CG1 4.13Å; T2723-V2842 HydrophobicContact CG2-CG2 4.09Å; N2840-V2842 PolarHBondContact O-N 2.89Å; V2842-V2844 HydrophobicContact CG1-CG2 4.2Å; V2842-V2844 PolarHBondContact O-N 3.25Å
2843	S	71.1	Confident	59.9	Low	54.75 Å²	54.75	114 Å²	114	38%	0.383	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90	137.9	173.1	69.9	0	0	0	0	110	T2721 T2722	T2721-S2843 CarbonylContact C-O 3.45Å; T2721-S2843 WeakPolarHBondContact CA-O 3.27Å; T2722-S2843 VanDerWaalsContact CB-OG 3.23Å; T2722-S2843 WeakPolarHBondContact CB-OG 3.38Å; T2722-S2843 PolarHBondContact N-O 3.28Å; T2722-S2843 PolarHBondContact O-N 3Å; T2722-S2843 PolarHBondContact O-OG 3.12Å; T2722-S2843 PolarHBondContact OG1-OG 3.29Å
2844	V	77.2	Confident	61.8	Low	85.5 Å²	85.5	104.2 Å²	104.2	52%	0.518	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113	-177	-171.9	0	0	0	0	109.3	R2719 I2720 T2721 V2842	R2719-V2844 HydrophobicContact CG-CG1 3.58Å; I2720-V2844 CarbonylContact O-C 3.58Å; I2720-V2844 WeakPolarHBondContact O-CA 3.28Å; T2721-V2844 HydrophobicContact CG2-CG1 4.24Å; T2721-V2844 HydrophobicContact CG2-CG2 4.15Å; V2842-V2844 HydrophobicContact CG1-CG2 4.2Å; V2842-V2844 PolarHBondContact O-N 3.25Å
2845	E	80.5	Confident	63.7	Low	93 Å²	93	101.9 Å²	101.9	44%	0.435	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	140.2	174.1	-168.7	-171.2	155.2	0	0	109.1	R2699 R2719 I2720 K2847	R2699-E2845 IonicContact NH2-OE2 3.51Å; R2719-E2845 CarbonylContact C-O 3.47Å; R2719-E2845 WeakPolarHBondContact CA-O 3.44Å; I2720-E2845 HydrophobicContact CB-CB 4.4Å; I2720-E2845 PolarHBondContact N-O 3.06Å; I2720-E2845 PolarHBondContact O-N 3.03Å; E2845-K2847 WeakPolarHBondContact OE1-CD 3.44Å; E2845-K2847 IonicContact OE1-NZ 3.05Å; E2845-K2847 PolarHBondContact OE1-NZ 3.41Å; E2845-K2847 IonicContact OE2-NZ 2.75Å
2846	E	82.4	Confident	65.2	Low	78.25 Å²	78.25	97.2 Å²	97.2	37%	0.366	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.7	169.4	-64.1	-163.9	152.1	0	0	109.7	K2717 V2718 R2719	K2717-E2846 VanDerWaalsContact CE-CD 3.46Å; K2717-E2846 WeakPolarHBondContact CE-OE2 3.35Å; K2717-E2846 HydrophobicContact CG-CB 4.42Å; K2717-E2846 IonicContact NZ-OE1 3.78Å; K2717-E2846 PolarHBondContact NZ-OE1 3.32Å; K2717-E2846 IonicContact NZ-OE2 3Å; K2717-E2846 PolarHBondContact NZ-OE2 2.95Å; V2718-E2846 WeakPolarHBondContact O-CA 3.35Å; R2719-E2846 HydrophobicContact CB-CG 4.2Å; R2719-E2846 HydrophobicContact CG-CG 4.22Å; R2719-E2846 IonicContact CZ-OE1 2.96Å; R2719-E2846 VanDerWaalsContact CZ-OE1 3.27Å; R2719-E2846 IonicContact NE-OE1 3.31Å; R2719-E2846 PolarHBondContact NE-OE1 3.17Å; R2719-E2846 IonicContact NH2-OE1 3.28Å; R2719-E2846 PolarHBondContact NH2-OE1 2.98Å
2847	K	80.5	Confident	66.8	Low	105 Å²	105	90.7 Å²	90.7	46%	0.457	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135	-172	-166.5	175.3	-164.5	142	0	111.1	V2718 I2720 E2845 M2849	V2718-K2847 PolarHBondContact N-O 3.08Å; V2718-K2847 PolarHBondContact O-N 3.2Å; I2720-K2847 HydrophobicContact CD1-CB 4.19Å; E2845-K2847 WeakPolarHBondContact OE1-CD 3.44Å; E2845-K2847 IonicContact OE1-NZ 3.05Å; E2845-K2847 PolarHBondContact OE1-NZ 3.41Å; E2845-K2847 IonicContact OE2-NZ 2.75Å; K2847-M2849 HydrophobicContact CG-CG 4.47Å
2848	W	79.6	Confident	68.4	Low	116.75 Å²	116.75	88.3 Å²	88.3	44%	0.442	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	132	169.7	-69	103	0	0	0	110.3	E2703 Q2705 L2707 N2715 K2717	E2703-W2848 HydrophobicContact CB-CH2 4.24Å; E2703-W2848 HydrophobicContact CG-CH2 4.37Å; Q2705-W2848 HydrophobicContact CB-CE3 4.37Å; Q2705-W2848 HydrophobicContact CB-CH2 3.64Å; Q2705-W2848 HydrophobicContact CB-CZ3 3.5Å; Q2705-W2848 VanDerWaalsContact CB-CZ3 3.49Å; L2707-W2848 HydrophobicContact CD1-CH2 3.56Å; L2707-W2848 HydrophobicContact CD1-CZ3 3.7Å; N2715-W2848 HydrophobicContact CB-CE3 3.89Å; N2715-W2848 HydrophobicContact CB-CZ3 4.35Å; K2717-W2848 HydrophobicContact CB-CD2 4.08Å; K2717-W2848 HydrophobicContact CB-CE3 3.77Å; K2717-W2848 HydrophobicContact CB-CH2 3.79Å; K2717-W2848 HydrophobicContact CB-CZ2 4.08Å; K2717-W2848 HydrophobicContact CB-CZ3 3.81Å; K2717-W2848 HydrophobicContact CD-CH2 4.29Å; K2717-W2848 HydrophobicContact CD-CZ2 3.93Å; K2717-W2848 HydrophobicContact CG-CD2 4.17Å; K2717-W2848 HydrophobicContact CG-CE3 4.37Å; K2717-W2848 HydrophobicContact CG-CH2 4.33Å; K2717-W2848 HydrophobicContact CG-CZ2 4.11Å; K2717-W2848 HydrophobicContact CG-CZ3 4.46Å
2849	M	76	Confident	70	Confident	39 Å²	39	82.7 Å²	82.7	19%	0.192	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.3	177.4	-64.8	-175	61.4	0	0	109.6	R2699 N2715 Y2716 V2718 K2847 A2853 V2854	R2699-M2849 VanDerWaalsContact NH1-CE 3.33Å; N2715-M2849 CarbonylContact C-O 3.52Å; N2715-M2849 WeakPolarHBondContact CA-O 3.45Å; Y2716-M2849 PolarHBondContact N-O 3.07Å; Y2716-M2849 PolarHBondContact O-N 3.12Å; V2718-M2849 HydrophobicContact CB-CG 4.33Å; V2718-M2849 HydrophobicContact CB-SD 3.96Å; V2718-M2849 HydrophobicContact CG1-SD 4.2Å; V2718-M2849 HydrophobicContact CG2-CB 4.13Å; V2718-M2849 HydrophobicContact CG2-CG 4.09Å; V2718-M2849 HydrophobicContact CG2-SD 3.8Å; K2847-M2849 HydrophobicContact CG-CG 4.47Å; M2849-A2853 HydrophobicContact CB-CB 4.43Å; M2849-A2853 HydrophobicContact CE-CB 3.88Å; M2849-A2853 WeakPolarHBondContact CE-O 3.49Å; M2849-V2854 HydrophobicContact CB-CG2 4.24Å; M2849-V2854 HydrophobicContact CE-CG2 4.41Å
2850	S	76.5	Confident	71.4	Confident	54.25 Å²	54.25	72.4 Å²	72.4	38%	0.379	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	156.3	173.1	53.9	0	0	0	0	111.4	D2852 A2853 V2854	S2850-D2852 VanDerWaalsContact C-N 3.3Å; S2850-D2852 PolarHBondContact O-N 3.13Å; S2850-A2853 WeakPolarHBondContact O-CA 3.34Å; S2850-A2853 WeakPolarHBondContact O-CB 3.41Å; S2850-A2853 PolarHBondContact O-N 3.21Å; S2850-A2853 WeakPolarHBondContact OG-CB 3.35Å; S2850-A2853 PolarHBondContact OG-N 3.08Å; S2850-V2854 WeakPolarHBondContact O-CG2 3.48Å; S2850-V2854 PolarHBondContact O-N 3.37Å
2851	E	71.9	Confident	72.3	Confident	63.75 Å²	63.75	69.3 Å²	69.3	30%	0.298	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-47.8	-46.9	172.8	-170.9	172.5	-173.3	0	0	112.8	R2645 A2714 Y2716 A2853 V2854 F2855	R2645-E2851 VanDerWaalsContact CZ-CD 3.42Å; R2645-E2851 IonicContact CZ-OE1 3.23Å; R2645-E2851 IonicContact CZ-OE2 3.43Å; R2645-E2851 VanDerWaalsContact CZ-OE2 3.22Å; R2645-E2851 IonicContact NH1-OE1 3.13Å; R2645-E2851 PolarHBondContact NH1-OE1 3.03Å; R2645-E2851 IonicContact NH1-OE2 2.73Å; R2645-E2851 PolarHBondContact NH1-OE2 2.93Å; R2645-E2851 IonicContact NH2-OE1 3.95Å; R2645-E2851 IonicContact NH2-OE2 2.58Å; R2645-E2851 PolarHBondContact NH2-OE2 2.69Å; A2714-E2851 HydrophobicContact CB-CB 4.39Å; A2714-E2851 PolarHBondContact N-OE2 3.11Å; A2714-E2851 PolarHBondContact O-N 3.24Å; Y2716-E2851 HydrophobicContact CD2-CB 4.42Å; Y2716-E2851 HydrophobicContact CE2-CB 3.94Å; Y2716-E2851 HydrophobicContact CE2-CG 4.05Å; E2851-A2853 PolarHBondContact O-N 3.1Å; E2851-A2853 VanDerWaalsContact O-N 3.13Å; E2851-V2854 PolarHBondContact O-N 3.07Å; E2851-V2854 VanDerWaalsContact O-N 3.15Å; E2851-F2855 HydrophobicContact CG-CD2 3.84Å; E2851-F2855 HydrophobicContact CG-CE2 3.73Å; E2851-F2855 VanDerWaalsContact CG-CE2 3.47Å; E2851-F2855 HydrophobicContact CG-CZ 4.45Å; E2851-F2855 WeakPolarHBondContact O-CD2 3.44Å; E2851-F2855 PolarHBondContact O-N 3.48Å
2852	D	71.5	Confident	73.3	Confident	129 Å²	129	65.6 Å²	65.6	69%	0.69	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-61.1	-24.4	177.2	-62.7	-45.5	0	0	0	113.7	R2791 S2850 V2854 F2855 L2856	R2791-D2852 IonicContact NH2-OD1 3.96Å; S2850-D2852 VanDerWaalsContact C-N 3.3Å; S2850-D2852 PolarHBondContact O-N 3.13Å; D2852-V2854 VanDerWaalsContact C-N 3.31Å; D2852-V2854 PolarHBondContact O-N 3.4Å; D2852-F2855 PolarHBondContact O-N 3.14Å; D2852-L2856 HydrophobicContact CB-CD1 4.42Å; D2852-L2856 VanDerWaalsContact O-CB 3.25Å; D2852-L2856 WeakPolarHBondContact O-CB 3.39Å; D2852-L2856 WeakPolarHBondContact O-CD1 3.46Å; D2852-L2856 VanDerWaalsContact O-CG 3.3Å; D2852-L2856 WeakPolarHBondContact O-CG 3.42Å; D2852-L2856 PolarHBondContact O-N 3.26Å
2853	A	72	Confident	73.4	Confident	37.5 Å²	37.5	64.3 Å²	64.3	31%	0.31	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-89.4	-10.6	179.8	0	0	0	0	0	113.2	R2699 M2849 S2850 E2851 W2857	R2699-A2853 VanDerWaalsContact CZ-O 3.28Å; R2699-A2853 PolarHBondContact NH1-O 3.44Å; R2699-A2853 PolarHBondContact NH2-O 2.93Å; M2849-A2853 HydrophobicContact CB-CB 4.43Å; M2849-A2853 HydrophobicContact CE-CB 3.88Å; M2849-A2853 WeakPolarHBondContact CE-O 3.49Å; S2850-A2853 WeakPolarHBondContact O-CA 3.34Å; S2850-A2853 WeakPolarHBondContact O-CB 3.41Å; S2850-A2853 PolarHBondContact O-N 3.21Å; S2850-A2853 WeakPolarHBondContact OG-CB 3.35Å; S2850-A2853 PolarHBondContact OG-N 3.08Å; E2851-A2853 PolarHBondContact O-N 3.1Å; E2851-A2853 VanDerWaalsContact O-N 3.13Å; A2853-W2857 WeakPolarHBondContact O-CB 3.26Å; A2853-W2857 PolarHBondContact O-N 3.33Å; A2853-W2857 VanDerWaalsContact O-N 3.12Å
2854	V	72.7	Confident	73.1	Confident	13.5 Å²	13.5	65.3 Å²	65.3	8%	0.082	33%	0.329	C	S	.	.	S	Bend	trans	-98.9	-131.9	176.4	-178.5	0	0	0	0	109.6	R2699 I2701 Y2716 V2718 M2849 S2850 E2851 D2852 L2856 W2857 E2858 I2859	R2699-V2854 VanDerWaalsContact NH2-CA 3.28Å; R2699-V2854 VanDerWaalsContact NH2-CG2 3.33Å; I2701-V2854 HydrophobicContact CD1-CG1 3.7Å; I2701-V2854 HydrophobicContact CG1-CG1 4.25Å; Y2716-V2854 HydrophobicContact CD2-CG2 4.09Å; Y2716-V2854 HydrophobicContact CG-CG2 4.21Å; V2718-V2854 HydrophobicContact CG2-CG2 4.21Å; M2849-V2854 HydrophobicContact CB-CG2 4.24Å; M2849-V2854 HydrophobicContact CE-CG2 4.41Å; S2850-V2854 WeakPolarHBondContact O-CG2 3.48Å; S2850-V2854 PolarHBondContact O-N 3.37Å; E2851-V2854 PolarHBondContact O-N 3.07Å; E2851-V2854 VanDerWaalsContact O-N 3.15Å; D2852-V2854 VanDerWaalsContact C-N 3.31Å; D2852-V2854 PolarHBondContact O-N 3.4Å; V2854-L2856 PolarHBondContact O-N 2.96Å; V2854-W2857 WeakPolarHBondContact O-CB 3.27Å; V2854-W2857 PolarHBondContact O-N 3.02Å; V2854-E2858 HydrophobicContact CG1-CB 4.04Å; V2854-E2858 HydrophobicContact CG1-CG 4.48Å; V2854-E2858 WeakPolarHBondContact O-CG 3.48Å; V2854-E2858 PolarHBondContact O-N 3.2Å; V2854-I2859 HydrophobicContact CB-CD1 4.48Å; V2854-I2859 HydrophobicContact CG1-CD1 4.22Å; V2854-I2859 HydrophobicContact CG1-CG1 3.81Å
2855	F	71.4	Confident	72.6	Confident	92.75 Å²	92.75	64.2 Å²	64.2	41%	0.407	33%	0.325	S	S	.	.			trans	-72.2	-130.1	177.6	-78.9	-84.9	0	0	0	111.9	F2668 E2851 D2852 W2857 E2858 I2859	F2668-F2855 AromaticContact CD2-CD2 3.89Å; F2668-F2855 HydrophobicContact CD2-CD2 3.89Å; F2668-F2855 AromaticContact CD2-CE2 3.68Å; F2668-F2855 HydrophobicContact CD2-CE2 3.68Å; F2668-F2855 HydrophobicContact CE2-CD2 4.06Å; F2668-F2855 AromaticContact CE2-CE2 3.36Å; F2668-F2855 HydrophobicContact CE2-CE2 3.9Å; F2668-F2855 HydrophobicContact CE2-CZ 4.06Å; F2668-F2855 HydrophobicContact CZ-CE2 4.23Å; E2851-F2855 HydrophobicContact CG-CD2 3.84Å; E2851-F2855 HydrophobicContact CG-CE2 3.73Å; E2851-F2855 VanDerWaalsContact CG-CE2 3.47Å; E2851-F2855 HydrophobicContact CG-CZ 4.45Å; E2851-F2855 WeakPolarHBondContact O-CD2 3.44Å; E2851-F2855 PolarHBondContact O-N 3.48Å; D2852-F2855 PolarHBondContact O-N 3.14Å; F2855-W2857 VanDerWaalsContact C-N 3.29Å; F2855-W2857 HydrophobicContact CB-CD2 4.44Å; F2855-W2857 HydrophobicContact CB-CG 4.38Å; F2855-W2857 AromaticContact CD1-NE1 3.98Å; F2855-W2857 AromaticContact CG-NE1 3.92Å; F2855-W2857 PolarHBondContact O-N 3.22Å; F2855-E2858 HydrophobicContact CB-CG 4.13Å; F2855-E2858 PolarHBondContact N-OE1 2.98Å; F2855-E2858 PolarHBondContact N-OE2 3.07Å; F2855-E2858 WeakPolarHBondContact O-CB 3.36Å; F2855-E2858 PolarHBondContact O-N 3.23Å; F2855-I2859 WeakPolarHBondContact O-CB 3.34Å; F2855-I2859 WeakPolarHBondContact O-CD1 3.41Å; F2855-I2859 VanDerWaalsContact O-CG1 3.26Å; F2855-I2859 WeakPolarHBondContact O-CG1 3.21Å; F2855-I2859 PolarHBondContact O-N 3.17Å
2856	L	69.3	Low	71.8	Confident	66.75 Å²	66.75	64.7 Å²	64.7	35%	0.349	33%	0.33	S	S	.	.	H	α-helix	trans	-61.5	-35.8	-179.9	-71.6	167.7	0	0	0	112.2	D2648 I2649 M2650 D2852 V2854 E2858 I2859 G2860	D2648-L2856 HydrophobicContact CB-CD1 3.67Å; D2648-L2856 WeakPolarHBondContact O-CB 3.35Å; I2649-L2856 HydrophobicContact CD1-CD2 4.48Å; I2649-L2856 HydrophobicContact CG1-CB 3.87Å; I2649-L2856 HydrophobicContact CG1-CD2 4.03Å; I2649-L2856 HydrophobicContact CG1-CG 4.46Å; I2649-L2856 HydrophobicContact CG2-CB 4.29Å; I2649-L2856 HydrophobicContact CG2-CD1 3.98Å; I2649-L2856 HydrophobicContact CG2-CD2 3.82Å; I2649-L2856 HydrophobicContact CG2-CG 4.25Å; M2650-L2856 HydrophobicContact CE-CB 4.37Å; D2852-L2856 HydrophobicContact CB-CD1 4.42Å; D2852-L2856 VanDerWaalsContact O-CB 3.25Å; D2852-L2856 WeakPolarHBondContact O-CB 3.39Å; D2852-L2856 WeakPolarHBondContact O-CD1 3.46Å; D2852-L2856 VanDerWaalsContact O-CG 3.3Å; D2852-L2856 WeakPolarHBondContact O-CG 3.42Å; D2852-L2856 PolarHBondContact O-N 3.26Å; V2854-L2856 PolarHBondContact O-N 2.96Å; L2856-E2858 VanDerWaalsContact C-N 3.3Å; L2856-E2858 PolarHBondContact O-N 3.1Å; L2856-I2859 HydrophobicContact CD2-CD1 4.27Å; L2856-I2859 WeakPolarHBondContact O-CB 3.5Å; L2856-I2859 PolarHBondContact O-N 3.18Å; L2856-G2860 PolarHBondContact O-N 3.28Å
2857	W	69.2	Low	70.8	Confident	53.25 Å²	53.25	64.7 Å²	64.7	20%	0.202	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-38.3	173.4	123.3	-175.5	0	0	0	112.6	V2651 P2653 I2657 C2658 F2668 I2701 A2853 V2854 F2855 I2859 G2860 V2861	V2651-W2857 WeakPolarHBondContact O-CB 3.48Å; P2653-W2857 HydrophobicContact CB-CD2 3.73Å; P2653-W2857 HydrophobicContact CB-CE3 3.91Å; P2653-W2857 HydrophobicContact CB-CG 4.24Å; P2653-W2857 HydrophobicContact CB-CH2 3.99Å; P2653-W2857 HydrophobicContact CB-CZ2 3.83Å; P2653-W2857 HydrophobicContact CB-CZ3 4.05Å; P2653-W2857 HydrophobicContact CG-CD2 4.44Å; P2653-W2857 HydrophobicContact CG-CE3 4.27Å; P2653-W2857 HydrophobicContact CG-CH2 4.41Å; P2653-W2857 HydrophobicContact CG-CZ3 4.27Å; I2657-W2857 HydrophobicContact CG2-CZ2 4.39Å; C2658-W2857 HydrophobicContact CB-CH2 4.45Å; F2668-W2857 HydrophobicContact CB-CH2 3.86Å; F2668-W2857 HydrophobicContact CB-CZ2 4.09Å; F2668-W2857 AromaticContact CD2-CZ2 3.99Å; F2668-W2857 HydrophobicContact CD2-CZ2 4.19Å; F2668-W2857 HydrophobicContact CG-CZ2 4.27Å; I2701-W2857 HydrophobicContact CD1-CD2 4.43Å; I2701-W2857 HydrophobicContact CD1-CH2 4.13Å; I2701-W2857 HydrophobicContact CD1-CZ2 3.97Å; I2701-W2857 HydrophobicContact CD1-CZ3 4.43Å; A2853-W2857 WeakPolarHBondContact O-CB 3.26Å; A2853-W2857 PolarHBondContact O-N 3.33Å; A2853-W2857 VanDerWaalsContact O-N 3.12Å; V2854-W2857 WeakPolarHBondContact O-CB 3.27Å; V2854-W2857 PolarHBondContact O-N 3.02Å; F2855-W2857 VanDerWaalsContact C-N 3.29Å; F2855-W2857 HydrophobicContact CB-CD2 4.44Å; F2855-W2857 HydrophobicContact CB-CG 4.38Å; F2855-W2857 AromaticContact CD1-NE1 3.98Å; F2855-W2857 AromaticContact CG-NE1 3.92Å; F2855-W2857 PolarHBondContact O-N 3.22Å; W2857-I2859 PolarHBondContact O-N 3.19Å; W2857-G2860 CarbonylContact O-C 3.1Å; W2857-G2860 WeakPolarHBondContact O-CA 3.47Å; W2857-G2860 PolarHBondContact O-N 3.26Å; W2857-G2860 VanDerWaalsContact O-N 3.15Å; W2857-V2861 HydrophobicContact CD2-CG2 4.19Å; W2857-V2861 HydrophobicContact CE3-CG2 4.27Å; W2857-V2861 HydrophobicContact CH2-CG2 4.24Å; W2857-V2861 HydrophobicContact CZ2-CG2 4.06Å; W2857-V2861 VanDerWaalsContact O-CG2 3.3Å; W2857-V2861 WeakPolarHBondContact O-CG2 3.46Å; W2857-V2861 PolarHBondContact O-N 3.08Å
2858	E	72	Confident	69.6	Low	54.5 Å²	54.5	62.9 Å²	62.9	26%	0.255	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-40.6	175	-67.7	-176.5	169.9	0	0	111.5	F2668 R2699 I2701 V2854 F2855 L2856 G2860 V2861 F2862	F2668-E2858 WeakPolarHBondContact CB-OE1 3.47Å; R2699-E2858 IonicContact CZ-OE1 3.55Å; R2699-E2858 VanDerWaalsContact CZ-OE1 3.23Å; R2699-E2858 IonicContact CZ-OE2 3.79Å; R2699-E2858 VanDerWaalsContact NE-CD 3.32Å; R2699-E2858 IonicContact NE-OE1 3.09Å; R2699-E2858 PolarHBondContact NE-OE1 3.33Å; R2699-E2858 IonicContact NE-OE2 3.18Å; R2699-E2858 PolarHBondContact NE-OE2 3.13Å; R2699-E2858 IonicContact NH2-OE1 3.44Å; R2699-E2858 PolarHBondContact NH2-OE1 3Å; R2699-E2858 VanDerWaalsContact NH2-OE1 3.13Å; R2699-E2858 IonicContact NH2-OE2 2.71Å; R2699-E2858 PolarHBondContact NH2-OE2 3.23Å; I2701-E2858 HydrophobicContact CD1-CB 3.99Å; I2701-E2858 WeakPolarHBondContact CD1-O 3.16Å; I2701-E2858 HydrophobicContact CG1-CB 4.31Å; V2854-E2858 HydrophobicContact CG1-CB 4.04Å; V2854-E2858 HydrophobicContact CG1-CG 4.48Å; V2854-E2858 WeakPolarHBondContact O-CG 3.48Å; V2854-E2858 PolarHBondContact O-N 3.2Å; F2855-E2858 HydrophobicContact CB-CG 4.13Å; F2855-E2858 PolarHBondContact N-OE1 2.98Å; F2855-E2858 PolarHBondContact N-OE2 3.07Å; F2855-E2858 WeakPolarHBondContact O-CB 3.36Å; F2855-E2858 PolarHBondContact O-N 3.23Å; L2856-E2858 VanDerWaalsContact C-N 3.3Å; L2856-E2858 PolarHBondContact O-N 3.1Å; E2858-G2860 VanDerWaalsContact C-N 3.32Å; E2858-G2860 PolarHBondContact O-N 3.28Å; E2858-V2861 WeakPolarHBondContact O-CB 3.42Å; E2858-V2861 PolarHBondContact O-N 3.02Å; E2858-F2862 VanDerWaalsContact O-CB 3.24Å; E2858-F2862 WeakPolarHBondContact O-CB 3.28Å; E2858-F2862 PolarHBondContact O-N 3.05Å
2859	I	71	Confident	68.3	Low	42.5 Å²	42.5	62.4 Å²	62.4	22%	0.218	34%	0.343	C	S	.	.	H	α-helix	trans	-64.4	-40.4	174.1	-62.7	166.7	0	0	0	110.1	W2646 I2649 I2701 Y2716 V2854 F2855 L2856 W2857 F2862 M2863	W2646-I2859 HydrophobicContact CH2-CG2 4.45Å; I2649-I2859 HydrophobicContact CD1-CG2 3.87Å; I2701-I2859 HydrophobicContact CD1-CB 4.38Å; I2701-I2859 HydrophobicContact CD1-CG1 3.82Å; Y2716-I2859 HydrophobicContact CD1-CG1 4.33Å; Y2716-I2859 HydrophobicContact CE1-CD1 4.07Å; Y2716-I2859 HydrophobicContact CE1-CG1 3.88Å; Y2716-I2859 HydrophobicContact CE1-CG2 4.18Å; Y2716-I2859 HydrophobicContact CE2-CD1 4.21Å; V2854-I2859 HydrophobicContact CB-CD1 4.48Å; V2854-I2859 HydrophobicContact CG1-CD1 4.22Å; V2854-I2859 HydrophobicContact CG1-CG1 3.81Å; F2855-I2859 WeakPolarHBondContact O-CB 3.34Å; F2855-I2859 WeakPolarHBondContact O-CD1 3.41Å; F2855-I2859 VanDerWaalsContact O-CG1 3.26Å; F2855-I2859 WeakPolarHBondContact O-CG1 3.21Å; F2855-I2859 PolarHBondContact O-N 3.17Å; L2856-I2859 HydrophobicContact CD2-CD1 4.27Å; L2856-I2859 WeakPolarHBondContact O-CB 3.5Å; L2856-I2859 PolarHBondContact O-N 3.18Å; W2857-I2859 PolarHBondContact O-N 3.19Å; I2859-F2862 PolarHBondContact O-N 2.96Å; I2859-M2863 HydrophobicContact CG2-CE 4.48Å; I2859-M2863 HydrophobicContact CG2-CG 4.38Å; I2859-M2863 WeakPolarHBondContact O-CB 3.37Å; I2859-M2863 VanDerWaalsContact O-CG 3.27Å; I2859-M2863 WeakPolarHBondContact O-CG 3.28Å; I2859-M2863 PolarHBondContact O-N 3.23Å
2860	G	68.6	Low	67.1	Low	12.25 Å²	12.25	70.1 Å²	70.1	13%	0.126	38%	0.375	C	S	.	.	H	α-helix	trans	-60	-47	172.8	0	0	0	0	0	112.9	I2649 L2856 W2857 E2858 F2862 M2863 N2864	I2649-G2860 WeakPolarHBondContact O-CA 3.37Å; L2856-G2860 PolarHBondContact O-N 3.28Å; W2857-G2860 CarbonylContact O-C 3.1Å; W2857-G2860 WeakPolarHBondContact O-CA 3.47Å; W2857-G2860 PolarHBondContact O-N 3.26Å; W2857-G2860 VanDerWaalsContact O-N 3.15Å; E2858-G2860 VanDerWaalsContact C-N 3.32Å; E2858-G2860 PolarHBondContact O-N 3.28Å; G2860-F2862 VanDerWaalsContact C-N 3.33Å; G2860-F2862 PolarHBondContact O-N 2.89Å; G2860-M2863 PolarHBondContact O-N 3.18Å; G2860-N2864 VanDerWaalsContact O-CB 3.29Å; G2860-N2864 WeakPolarHBondContact O-CB 3.26Å; G2860-N2864 VanDerWaalsContact O-CG 3.28Å; G2860-N2864 PolarHBondContact O-N 2.98Å; G2860-N2864 VanDerWaalsContact O-N 3.09Å; G2860-N2864 PolarHBondContact O-ND2 3Å
2861	V	69.2	Low	65.6	Low	33.75 Å²	33.75	70.3 Å²	70.3	21%	0.205	38%	0.377	C	S	.	.	H	α-helix	trans	-61.5	-43.5	175.9	174.3	0	0	0	0	111.3	P2666 F2668 W2857 E2858 N2864 S2865	P2666-V2861 HydrophobicContact CG-CG1 4.33Å; P2666-V2861 HydrophobicContact CG-CG2 3.84Å; F2668-V2861 HydrophobicContact CD2-CG2 3.89Å; F2668-V2861 HydrophobicContact CE2-CB 4.08Å; F2668-V2861 HydrophobicContact CE2-CG1 4.08Å; F2668-V2861 HydrophobicContact CE2-CG2 3.36Å; F2668-V2861 HydrophobicContact CZ-CG2 4.24Å; W2857-V2861 HydrophobicContact CD2-CG2 4.19Å; W2857-V2861 HydrophobicContact CE3-CG2 4.27Å; W2857-V2861 HydrophobicContact CH2-CG2 4.24Å; W2857-V2861 HydrophobicContact CZ2-CG2 4.06Å; W2857-V2861 VanDerWaalsContact O-CG2 3.3Å; W2857-V2861 WeakPolarHBondContact O-CG2 3.46Å; W2857-V2861 PolarHBondContact O-N 3.08Å; E2858-V2861 WeakPolarHBondContact O-CB 3.42Å; E2858-V2861 PolarHBondContact O-N 3.02Å; V2861-N2864 PolarHBondContact O-N 3.25Å; V2861-S2865 VanDerWaalsContact O-CB 3.26Å; V2861-S2865 WeakPolarHBondContact O-CB 3.38Å; V2861-S2865 PolarHBondContact O-N 3.09Å; V2861-S2865 VanDerWaalsContact O-N 3.15Å; V2861-S2865 PolarHBondContact O-OG 3.23Å
2862	F	71	Confident	64.2	Low	70.25 Å²	70.25	73.8 Å²	73.8	31%	0.308	40%	0.398	S	S	.	.	H	α-helix	trans	-62.8	-48.3	176.9	177.6	-102.3	0	0	0	112.1	I2701 V2702 I2704 E2858 I2859 G2860 N2864 S2865 L2866	I2701-F2862 HydrophobicContact CB-CB 3.98Å; I2701-F2862 HydrophobicContact CB-CD2 3.73Å; I2701-F2862 HydrophobicContact CB-CE2 4.42Å; I2701-F2862 HydrophobicContact CB-CG 3.89Å; I2701-F2862 HydrophobicContact CD1-CB 4.09Å; I2701-F2862 HydrophobicContact CG2-CB 4.24Å; I2701-F2862 HydrophobicContact CG2-CD1 4.05Å; I2701-F2862 HydrophobicContact CG2-CD2 3.6Å; I2701-F2862 HydrophobicContact CG2-CE1 4.31Å; I2701-F2862 HydrophobicContact CG2-CE2 3.89Å; I2701-F2862 HydrophobicContact CG2-CG 3.67Å; I2701-F2862 HydrophobicContact CG2-CZ 4.24Å; I2701-F2862 WeakPolarHBondContact O-CD2 3.44Å; V2702-F2862 WeakPolarHBondContact O-CE2 3.12Å; I2704-F2862 HydrophobicContact CD1-CD1 3.85Å; I2704-F2862 HydrophobicContact CD1-CE1 3.49Å; I2704-F2862 VanDerWaalsContact CD1-CE1 3.47Å; I2704-F2862 HydrophobicContact CG1-CD1 4.29Å; I2704-F2862 HydrophobicContact CG1-CE1 3.65Å; I2704-F2862 HydrophobicContact CG1-CZ 4.29Å; E2858-F2862 VanDerWaalsContact O-CB 3.24Å; E2858-F2862 WeakPolarHBondContact O-CB 3.28Å; E2858-F2862 PolarHBondContact O-N 3.05Å; I2859-F2862 PolarHBondContact O-N 2.96Å; G2860-F2862 VanDerWaalsContact C-N 3.33Å; G2860-F2862 PolarHBondContact O-N 2.89Å; F2862-N2864 PolarHBondContact O-N 2.94Å; F2862-S2865 WeakPolarHBondContact O-CA 3.26Å; F2862-S2865 WeakPolarHBondContact O-CB 3.48Å; F2862-S2865 PolarHBondContact O-N 3.04Å; F2862-S2865 PolarHBondContact O-OG 2.81Å; F2862-L2866 HydrophobicContact CD1-CD1 4.1Å; F2862-L2866 HydrophobicContact CD2-CD1 4.27Å; F2862-L2866 HydrophobicContact CE1-CD1 3.51Å; F2862-L2866 VanDerWaalsContact CE1-CD1 3.46Å; F2862-L2866 HydrophobicContact CE1-CG 4.19Å; F2862-L2866 HydrophobicContact CE2-CD1 3.76Å; F2862-L2866 HydrophobicContact CG-CD1 4.42Å; F2862-L2866 HydrophobicContact CZ-CD1 3.63Å; F2862-L2866 HydrophobicContact CZ-CD2 4.46Å; F2862-L2866 HydrophobicContact CZ-CG 4.3Å; F2862-L2866 WeakPolarHBondContact O-CG 3.3Å; F2862-L2866 PolarHBondContact O-N 3.13Å; F2862-L2866 VanDerWaalsContact O-N 3.12Å
2863	M	67.2	Low	62.6	Low	53.25 Å²	53.25	76.6 Å²	76.6	26%	0.262	40%	0.4	S	S	.	.	H	α-helix	trans	-63.4	-43.4	178.1	-71.9	-64.9	-167	0	0	112.1	L2637 L2640 W2646 I2704 I2859 G2860 S2865 L2866 L2867	L2637-M2863 HydrophobicContact CD2-CE 4.11Å; L2637-M2863 HydrophobicContact CD2-SD 4.44Å; L2640-M2863 HydrophobicContact CD2-CE 3.73Å; L2640-M2863 HydrophobicContact CG-CE 4.34Å; W2646-M2863 HydrophobicContact CH2-CE 4.22Å; I2704-M2863 HydrophobicContact CD1-CE 4.19Å; I2859-M2863 HydrophobicContact CG2-CE 4.48Å; I2859-M2863 HydrophobicContact CG2-CG 4.38Å; I2859-M2863 WeakPolarHBondContact O-CB 3.37Å; I2859-M2863 VanDerWaalsContact O-CG 3.27Å; I2859-M2863 WeakPolarHBondContact O-CG 3.28Å; I2859-M2863 PolarHBondContact O-N 3.23Å; G2860-M2863 PolarHBondContact O-N 3.18Å; M2863-S2865 VanDerWaalsContact C-N 3.26Å; M2863-S2865 PolarHBondContact O-N 3.16Å; M2863-S2865 VanDerWaalsContact O-N 3.07Å; M2863-L2866 PolarHBondContact O-N 3.14Å; M2863-L2866 HydrophobicContact SD-CD1 4.31Å; M2863-L2867 CarbonylContact O-C 3.56Å; M2863-L2867 WeakPolarHBondContact O-CA 3.29Å; M2863-L2867 WeakPolarHBondContact O-CG 3.38Å; M2863-L2867 PolarHBondContact O-N 2.93Å
2864	N	66.3	Low	60.9	Low	77.5 Å²	77.5	79.7 Å²	79.7	41%	0.414	42%	0.416	S	S	.	.	H	α-helix	trans	-64.3	-22.1	175.6	-73.2	-34.1	0	0	0	113	G2860 V2861 F2862 L2867 P2868	G2860-N2864 VanDerWaalsContact O-CB 3.29Å; G2860-N2864 WeakPolarHBondContact O-CB 3.26Å; G2860-N2864 VanDerWaalsContact O-CG 3.28Å; G2860-N2864 PolarHBondContact O-N 2.98Å; G2860-N2864 VanDerWaalsContact O-N 3.09Å; G2860-N2864 PolarHBondContact O-ND2 3Å; V2861-N2864 PolarHBondContact O-N 3.25Å; F2862-N2864 PolarHBondContact O-N 2.94Å; N2864-L2867 CarbonylContact O-C 3.55Å; N2864-P2868 WeakPolarHBondContact O-CA 3.42Å
2865	S	66.9	Low	59.1	Low	62.25 Å²	62.25	84.1 Å²	84.1	44%	0.435	45%	0.446	S	S	.	.	H	α-helix	trans	-82.3	-27.3	173.3	100.2	0	0	0	0	113.8	R2665 V2861 F2862 M2863	R2665-S2865 VanDerWaalsContact NH1-CB 3.28Å; V2861-S2865 VanDerWaalsContact O-CB 3.26Å; V2861-S2865 WeakPolarHBondContact O-CB 3.38Å; V2861-S2865 PolarHBondContact O-N 3.09Å; V2861-S2865 VanDerWaalsContact O-N 3.15Å; V2861-S2865 PolarHBondContact O-OG 3.23Å; F2862-S2865 WeakPolarHBondContact O-CA 3.26Å; F2862-S2865 WeakPolarHBondContact O-CB 3.48Å; F2862-S2865 PolarHBondContact O-N 3.04Å; F2862-S2865 PolarHBondContact O-OG 2.81Å; M2863-S2865 VanDerWaalsContact C-N 3.26Å; M2863-S2865 PolarHBondContact O-N 3.16Å; M2863-S2865 VanDerWaalsContact O-N 3.07Å
2866	L	62.5	Low	57.4	Low	101.75 Å²	101.75	86.5 Å²	86.5	53%	0.533	46%	0.461	S	S	.	.	H	α-helix	trans	-86.6	-33.2	175.1	-70.2	177.2	0	0	0	112.9	L2637 F2862 M2863	L2637-L2866 HydrophobicContact CD1-CD1 4.29Å; F2862-L2866 HydrophobicContact CD1-CD1 4.1Å; F2862-L2866 HydrophobicContact CD2-CD1 4.27Å; F2862-L2866 HydrophobicContact CE1-CD1 3.51Å; F2862-L2866 VanDerWaalsContact CE1-CD1 3.46Å; F2862-L2866 HydrophobicContact CE1-CG 4.19Å; F2862-L2866 HydrophobicContact CE2-CD1 3.76Å; F2862-L2866 HydrophobicContact CG-CD1 4.42Å; F2862-L2866 HydrophobicContact CZ-CD1 3.63Å; F2862-L2866 HydrophobicContact CZ-CD2 4.46Å; F2862-L2866 HydrophobicContact CZ-CG 4.3Å; F2862-L2866 WeakPolarHBondContact O-CG 3.3Å; F2862-L2866 PolarHBondContact O-N 3.13Å; F2862-L2866 VanDerWaalsContact O-N 3.12Å; M2863-L2866 PolarHBondContact O-N 3.14Å; M2863-L2866 HydrophobicContact SD-CD1 4.31Å
2867	L	60.6	Low	55.8	Low	80 Å²	80	87.4 Å²	87.4	42%	0.419	47%	0.473	S	S	.	.	S	Bend	trans	-121.7	91.6	-178.8	-67.1	173.2	0	0	0	109.5	L2637 R2638 M2863 N2864 P2869	L2637-L2867 HydrophobicContact CB-CD1 3.67Å; R2638-L2867 HydrophobicContact CB-CD1 3.83Å; R2638-L2867 HydrophobicContact CG-CD1 4.42Å; M2863-L2867 CarbonylContact O-C 3.56Å; M2863-L2867 WeakPolarHBondContact O-CA 3.29Å; M2863-L2867 WeakPolarHBondContact O-CG 3.38Å; M2863-L2867 PolarHBondContact O-N 2.93Å; N2864-L2867 CarbonylContact O-C 3.55Å; L2867-P2869 WeakPolarHBondContact O-CD 3.47Å
2868	P	55.7	Low	54.2	Low	67 Å²	67	91.7 Å²	91.7	44%	0.435	50%	0.5	S	S	.	.			trans	-58.8	131	177.5	-13.2	19.3	0	0	0	110.7	N2864 K2870 S2871	N2864-P2868 WeakPolarHBondContact O-CA 3.42Å; P2868-K2870 PolarHBondContact O-N 2.99Å; P2868-S2871 VanDerWaalsContact O-CB 3.32Å; P2868-S2871 WeakPolarHBondContact O-CB 3.41Å; P2868-S2871 PolarHBondContact O-N 3.17Å; P2868-S2871 PolarHBondContact O-OG 3.05Å
2869	P	52.7	Low	52.4	Low	105 Å²	105	94.6 Å²	94.6	68%	0.682	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	4.7	-177	11.2	-17.6	0	0	0	113.3	W2641 L2867	W2641-P2869 HydrophobicContact CH2-CB 3.92Å; W2641-P2869 HydrophobicContact CZ2-CB 3.95Å; L2867-P2869 WeakPolarHBondContact O-CD 3.47Å
2870	K	50.3	Low	50.6	Low	201.25 Å²	201.25	97 Å²	97	88%	0.875	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	17.9	179	-56.2	-179.5	-179	179	0	114.2	P2868 N2872	P2868-K2870 PolarHBondContact O-N 2.99Å; K2870-N2872 PolarHBondContact O-N 3.3Å
2871	S	46.7	Very low	49.1	Very low	59.5 Å²	59.5	102.4 Å²	102.4	42%	0.416	58%	0.577	S	S	.	*			trans	-73.6	114.7	169.6	58.7	0	0	0	0	110.5	P2868 Y2873	P2868-S2871 VanDerWaalsContact O-CB 3.32Å; P2868-S2871 WeakPolarHBondContact O-CB 3.41Å; P2868-S2871 PolarHBondContact O-N 3.17Å; P2868-S2871 PolarHBondContact O-OG 3.05Å; S2871-Y2873 PolarHBondContact O-N 2.84Å
2872	N	42.3	Very low	47.4	Very low	136.5 Å²	136.5	105.4 Å²	105.4	73%	0.73	60%	0.6	S	S	*	*			trans	-63.3	127	166.8	-75.7	-26.9	0	0	0	108.7	K2870 P2874 P2875 I2876 Y2893	K2870-N2872 PolarHBondContact O-N 3.3Å; N2872-P2874 CarbonylContact C-O 3.51Å; N2872-P2874 CarbonylContact O-C 3.55Å; N2872-P2875 VanDerWaalsContact O-CA 3.29Å; N2872-P2875 WeakPolarHBondContact O-CA 3.47Å; N2872-I2876 HydrophobicContact CB-CD1 4.41Å; N2872-I2876 HydrophobicContact CB-CG1 4.49Å; N2872-Y2893 PolarHBondContact O-OH 3.36Å
2873	Y	36.2	Very low	45.7	Very low	188.5 Å²	188.5	111.5 Å²	111.5	74%	0.739	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-69.8	135.6	164.6	-110	-98.6	0	0	0	109.2	S2871 P2875	S2871-Y2873 PolarHBondContact O-N 2.84Å; Y2873-P2875 VanDerWaalsContact O-CD 3.28Å; Y2873-P2875 WeakPolarHBondContact O-CD 3.32Å; Y2873-P2875 VanDerWaalsContact O-N 3.13Å
2874	P	37.3	Very low	44.3	Very low	100.75 Å²	100.75	116.6 Å²	116.6	65%	0.654	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-60.1	133.1	176.8	26.3	-34.3	0	0	0	109.6	N2872 I2876	N2872-P2874 CarbonylContact C-O 3.51Å; N2872-P2874 CarbonylContact O-C 3.55Å; P2874-I2876 PolarHBondContact O-N 3.05Å; P2874-I2876 VanDerWaalsContact O-N 3.13Å
2875	P	34.3	Very low	43	Very low	107 Å²	107	119.4 Å²	119.4	70%	0.695	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-62.9	130	178.1	26.2	-33.3	0	0	0	109	N2872 Y2873 S2877	N2872-P2875 VanDerWaalsContact O-CA 3.29Å; N2872-P2875 WeakPolarHBondContact O-CA 3.47Å; Y2873-P2875 VanDerWaalsContact O-CD 3.28Å; Y2873-P2875 WeakPolarHBondContact O-CD 3.32Å; Y2873-P2875 VanDerWaalsContact O-N 3.13Å; P2875-S2877 PolarHBondContact O-N 3.22Å
2876	I	36.6	Very low	41.8	Very low	142 Å²	142	122.8 Å²	122.8	73%	0.728	69%	0.688	S	S	*	*			trans	-69.1	101.9	165.4	-58.4	174	0	0	0	105.7	N2872 P2874 D2878 V2881	N2872-I2876 HydrophobicContact CB-CD1 4.41Å; N2872-I2876 HydrophobicContact CB-CG1 4.49Å; P2874-I2876 PolarHBondContact O-N 3.05Å; P2874-I2876 VanDerWaalsContact O-N 3.13Å; I2876-D2878 PolarHBondContact O-N 3.15Å; I2876-V2881 HydrophobicContact CG2-CG2 4.32Å
2877	S	34.7	Very low	40.7	Very low	86.5 Å²	86.5	124.4 Å²	124.4	61%	0.605	70%	0.698	S	S	*	*			trans	-77.8	110.7	176.2	49.4	0	0	0	0	108.7	P2875 S2879 S2880	P2875-S2877 PolarHBondContact O-N 3.22Å; S2877-S2879 PolarHBondContact O-N 3.06Å; S2877-S2880 PolarHBondContact O-N 3.28Å; S2877-S2880 PolarHBondContact O-OG 2.94Å; S2877-S2880 VanDerWaalsContact O-OG 3.13Å
2878	D	35.4	Very low	39.7	Very low	144.5 Å²	144.5	126.3 Å²	126.3	77%	0.773	71%	0.708	S	S	*	*			trans	-59.6	76	179.2	-63.1	-56.6	0	0	0	112.5	I2876 S2880 V2881	I2876-D2878 PolarHBondContact O-N 3.15Å; D2878-S2880 PolarHBondContact O-N 3.26Å; D2878-V2881 PolarHBondContact O-N 3.21Å
2879	S	34.9	Very low	38.9	Very low	113.75 Å²	113.75	132.3 Å²	132.3	80%	0.795	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-84.9	40.7	-172.5	59.4	0	0	0	0	114.4	S2877 V2881	S2877-S2879 PolarHBondContact O-N 3.06Å; S2879-V2881 PolarHBondContact O-N 3.23Å
2880	S	33.9	Very low	38.1	Very low	93 Å²	93	132.8 Å²	132.8	65%	0.65	73%	0.729	S	S	*	*			trans	-124.1	58.6	172	64	0	0	0	0	113	S2877 D2878 S2882	S2877-S2880 PolarHBondContact O-N 3.28Å; S2877-S2880 PolarHBondContact O-OG 2.94Å; S2877-S2880 VanDerWaalsContact O-OG 3.13Å; D2878-S2880 PolarHBondContact O-N 3.26Å; S2880-S2882 PolarHBondContact O-N 3.09Å; S2880-S2882 VanDerWaalsContact O-N 3.14Å
2881	V	36.4	Very low	37.2	Very low	126.75 Å²	126.75	128.1 Å²	128.1	77%	0.768	72%	0.721	S	S	*	*			trans	-87.5	76.6	179.9	-170.5	0	0	0	0	112.1	I2876 D2878 S2879	I2876-V2881 HydrophobicContact CG2-CG2 4.32Å; D2878-V2881 PolarHBondContact O-N 3.21Å; S2879-V2881 PolarHBondContact O-N 3.23Å
2882	S	32.5	Very low	36.5	Very low	97.25 Å²	97.25	133.8 Å²	133.8	68%	0.68	74%	0.741	S	S	*	*	S	Bend	trans	-136.5	126	160.7	57.3	0	0	0	0	112.4	S2880	S2880-S2882 PolarHBondContact O-N 3.09Å; S2880-S2882 VanDerWaalsContact O-N 3.14Å
2883	K	36	Very low	36	Very low	196.75 Å²	196.75	137.4 Å²	137.4	86%	0.855	75%	0.746	S	S	*	*			trans	87.3	82.4	176.6	-57.8	-178.4	179.9	-176.7	0	115.5
2884	I	38	Very low	35.7	Very low	160.25 Å²	160.25	134.5 Å²	134.5	82%	0.822	75%	0.747	S	S	*	*			trans	-143.8	135.6	153	-67.9	174.1	0	0	0	107.1
2885	D	39.9	Very low	35.5	Very low	137 Å²	137	136.8 Å²	136.8	73%	0.733	75%	0.753	S	S	*	*			trans	-75.8	147.4	-168.1	-70.7	-69.8	0	0	0	114.2	N2887	D2885-N2887 PolarHBondContact O-N 3.18Å
2886	P	39.8	Very low	35.2	Very low	133.5 Å²	133.5	136.4 Å²	136.4	87%	0.867	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	21.1	-170.3	33.9	-38.9	0	0	0	114.9
2887	N	40.5	Very low	34.9	Very low	135.75 Å²	135.75	134.7 Å²	134.7	73%	0.726	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	-7.7	-164.6	-128	-4.8	0	0	0	115.7	D2885 K2889	D2885-N2887 PolarHBondContact O-N 3.18Å; N2887-K2889 PolarHBondContact O-N 2.88Å
2888	D	39.7	Very low	34.6	Very low	120.75 Å²	120.75	141.6 Å²	141.6	65%	0.646	77%	0.766	S	S	*	*			trans	-86.3	119.6	178.4	-163	-24.5	0	0	0	111.7	T2890	D2888-T2890 PolarHBondContact O-N 3.09Å; D2888-T2890 WeakPolarHBondContact OD1-CB 3.38Å; D2888-T2890 WeakPolarHBondContact OD1-CG2 3.31Å; D2888-T2890 PolarHBondContact OD1-N 3.21Å; D2888-T2890 VanDerWaalsContact OD1-N 3.08Å; D2888-T2890 PolarHBondContact OD1-OG1 3.08Å
2889	K	38.4	Very low	34.3	Very low	192.25 Å²	192.25	142.7 Å²	142.7	84%	0.836	77%	0.771	S	S	*	*			trans	-98.2	21.6	-173.3	-66.5	178.2	179.7	170.8	0	113.3	N2887	N2887-K2889 PolarHBondContact O-N 2.88Å
2890	T	35.4	Very low	34.1	Very low	116 Å²	116	141.5 Å²	141.5	71%	0.712	77%	0.768	S	S	*	*			trans	-109.7	24.7	-165.8	12.4	0	0	0	0	115.7	D2888 Q2892	D2888-T2890 PolarHBondContact O-N 3.09Å; D2888-T2890 WeakPolarHBondContact OD1-CB 3.38Å; D2888-T2890 WeakPolarHBondContact OD1-CG2 3.31Å; D2888-T2890 PolarHBondContact OD1-N 3.21Å; D2888-T2890 VanDerWaalsContact OD1-N 3.08Å; D2888-T2890 PolarHBondContact OD1-OG1 3.08Å; T2890-Q2892 VanDerWaalsContact C-N 3.33Å; T2890-Q2892 PolarHBondContact O-N 3.05Å
2891	S	31.5	Very low	33.9	Very low	102.5 Å²	102.5	141.6 Å²	141.6	72%	0.717	78%	0.775	S	S	*	*			trans	-119.2	61.7	-179.2	-4.4	0	0	0	0	115	Y2893	S2891-Y2893 PolarHBondContact O-N 3.06Å
2892	Q	33.6	Very low	33.6	Very low	179.5 Å²	179.5	143.4 Å²	143.4	84%	0.839	78%	0.779	S	S	*	*			trans	-87.3	122.7	166.3	-77	-169.2	-18.8	0	0	111.6	T2890 V2894	T2890-Q2892 VanDerWaalsContact C-N 3.33Å; T2890-Q2892 PolarHBondContact O-N 3.05Å; Q2892-V2894 PolarHBondContact O-N 3.01Å
2893	Y	31.1	Very low	33.7	Very low	211.25 Å²	211.25	143.9 Å²	143.9	83%	0.828	78%	0.78	S	S	*	*			trans	-67.1	105.5	173.3	-74	-90.2	0	0	0	111.5	N2872 S2891 I2895	N2872-Y2893 PolarHBondContact O-OH 3.36Å; S2891-Y2893 PolarHBondContact O-N 3.06Å; Y2893-I2895 PolarHBondContact O-N 3.04Å
2894	V	30.4	Very low	33.8	Very low	126.5 Å²	126.5	140.3 Å²	140.3	77%	0.767	78%	0.777	S	S	*	*			trans	-78.3	94.3	176.7	-177.1	0	0	0	0	110.2	Q2892 S2896	Q2892-V2894 PolarHBondContact O-N 3.01Å; V2894-S2896 PolarHBondContact O-N 3.02Å; V2894-S2896 VanDerWaalsContact O-N 3.13Å
2895	I	33.3	Very low	33.5	Very low	150.75 Å²	150.75	140.3 Å²	140.3	77%	0.773	78%	0.779	S	S	*	*			trans	-65.8	117.6	163.2	-60.3	176	0	0	0	107.3	Y2893 S2897	Y2893-I2895 PolarHBondContact O-N 3.04Å; I2895-S2897 PolarHBondContact O-N 3.11Å; I2895-S2897 PolarHBondContact O-OG 3.39Å; I2895-S2897 VanDerWaalsContact O-OG 3.14Å
2896	S	28.1	Very low	33	Very low	98.25 Å²	98.25	139.4 Å²	139.4	69%	0.687	78%	0.783	S	S	*	*			trans	-64	106.3	-171.7	-126.4	0	0	0	0	112.5	V2894 R2898	V2894-S2896 PolarHBondContact O-N 3.02Å; V2894-S2896 VanDerWaalsContact O-N 3.13Å; S2896-R2898 VanDerWaalsContact C-N 3.34Å; S2896-R2898 PolarHBondContact O-N 3.29Å; S2896-R2898 VanDerWaalsContact O-N 3.09Å
2897	S	29.6	Very low	32.7	Very low	106.25 Å²	106.25	138.1 Å²	138.1	74%	0.743	78%	0.777	S	S	*	*			trans	-76.2	41.2	-172.6	-29.4	0	0	0	0	114.3	I2895 L2899 A2900	I2895-S2897 PolarHBondContact O-N 3.11Å; I2895-S2897 PolarHBondContact O-OG 3.39Å; I2895-S2897 VanDerWaalsContact O-OG 3.14Å; S2897-L2899 PolarHBondContact O-N 3.05Å; S2897-A2900 PolarHBondContact O-N 2.86Å
2898	R	28.1	Very low	32.4	Very low	230.75 Å²	230.75	136.5 Å²	136.5	87%	0.871	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	39.3	178.6	-75.9	-169.5	171.4	-163.1	-2.3	113.7	S2896	S2896-R2898 VanDerWaalsContact C-N 3.34Å; S2896-R2898 PolarHBondContact O-N 3.29Å; S2896-R2898 VanDerWaalsContact O-N 3.09Å
2899	L	29.8	Very low	32	Very low	167 Å²	167	139 Å²	139	87%	0.874	79%	0.79	S	S	*	*	S	Bend	trans	-130.7	30.7	166.4	-117.5	94.3	0	0	0	112.7	S2897	S2897-L2899 PolarHBondContact O-N 3.05Å
2900	A	29.7	Very low	31.6	Very low	88.75 Å²	88.75	133.4 Å²	133.4	73%	0.733	79%	0.787	S	S	*	*			trans	-141.6	119.2	174.1	0	0	0	0	0	110.4	S2897	S2897-A2900 PolarHBondContact O-N 2.86Å
2901	A	29.9	Very low	31.4	Very low	95.75 Å²	95.75	133.6 Å²	133.6	79%	0.791	79%	0.793	S	S	*	*			trans	140.1	86.9	-178.1	0	0	0	0	0	114.8
2902	L	31.2	Very low	31.3	Very low	164.25 Å²	164.25	133.5 Å²	133.5	86%	0.86	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-66.5	145.7	142.4	-73.4	169.9	0	0	0	111.2
2903	P	34.5	Very low	31	Very low	108.75 Å²	108.75	130.6 Å²	130.6	71%	0.706	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-72.5	141.8	177.1	31.2	-34.7	0	0	0	111.4	D2905	P2903-D2905 PolarHBondContact O-N 2.94Å
2904	P	37.6	Very low	31	Very low	121 Å²	121	124.7 Å²	124.7	79%	0.786	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-83.1	132.1	163.2	32.4	-30.2	0	0	0	110.2	S2906	P2904-S2906 VanDerWaalsContact C-N 3.29Å; P2904-S2906 PolarHBondContact O-N 3.12Å
2905	D	31.3	Very low	30.8	Very low	160.5 Å²	160.5	124.8 Å²	124.8	86%	0.858	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-70.7	141.8	174.3	-73.9	-53.5	0	0	0	112	P2903 S2907	P2903-D2905 PolarHBondContact O-N 2.94Å; D2905-S2907 PolarHBondContact O-N 3.3Å
2906	S	30	Very low	30.7	Very low	117 Å²	117	123.1 Å²	123.1	82%	0.818	79%	0.79	S	S	*	*			trans	-89.5	121.1	-173.1	61.6	0	0	0	0	113.2	P2904	P2904-S2906 VanDerWaalsContact C-N 3.29Å; P2904-S2906 PolarHBondContact O-N 3.12Å
2907	S	33.5	Very low	30.7	Very low	107.25 Å²	107.25	123.1 Å²	123.1	75%	0.75	79%	0.786	S	S	*	*			trans	-153.5	143.8	154.7	48.7	0	0	0	0	113.5	D2905	D2905-S2907 PolarHBondContact O-N 3.3Å
2908	S	34.4	Very low	30.7	Very low	102 Å²	102	123.2 Å²	123.2	71%	0.713	78%	0.783	S	S	*	*			trans	57.7	111.5	162.5	65.7	0	0	0	0	120.1
2909	N	29.7	Very low	30.8	Very low	172 Å²	172	117.9 Å²	117.9	92%	0.92	78%	0.776	S	S	*	*			trans	49.7	141.1	135.5	-55	-20.7	0	0	0	117.2
2910	G	31.5	Very low	30.9	Very low	76 Å²	76	118.3 Å²	118.3	78%	0.784	77%	0.774	S	S	*	*			trans	175.9	113.1	161.5	0	0	0	0	0	114.7
2911	S	29.9	Very low	31.1	Very low	118.75 Å²	118.75	119.8 Å²	119.8	83%	0.83	77%	0.774	S	S	*	*			trans	-42.4	135.5	173.8	55.6	0	0	0	0	117.8
2912	A	29.9	Very low	31.1	Very low	100.5 Å²	100.5	121.3 Å²	121.3	83%	0.831	77%	0.768	S	S	*	*			trans	91.5	155.8	159.4	0	0	0	0	0	114.9
2913	S	27.5	Very low	31.1	Very low	118.75 Å²	118.75	120.4 Å²	120.4	83%	0.83	76%	0.764	S	S	*	*				-171.1	142.3	-101.6	-113.8	0	0	0	0	113.5
2914	A	30.1	Very low	30.9	Very low	88.75 Å²	88.75	119.9 Å²	119.9	73%	0.733	76%	0.763	S	S	*	*			trans	129.6	133.9	146	0	0	0	0	0	116.1
2915	T	28	Very low	30.4	Very low	128 Å²	128	121.4 Å²	121.4	79%	0.785	76%	0.764	S	S	*	*				95.4	138.9	56.9	-48.9	0	0	0	0	117.2
2916	V	30.2	Very low	30.3	Very low	114.25 Å²	114.25	121.2 Å²	121.2	69%	0.692	76%	0.761	S	S	*	*			trans	93	110.7	148.6	-176.1	0	0	0	0	118.9
2917	T	28.4	Very low	30.2	Very low	98 Å²	98	120.6 Å²	120.6	60%	0.601	76%	0.757	S	S	*	*			trans	71	130.5	148.9	54	0	0	0	0	121.1
2918	T	29.2	Very low	30.4	Very low	108.5 Å²	108.5	121 Å²	121	67%	0.666	76%	0.757	S	S	*	*			trans	49.1	143.3	131.8	58.7	0	0	0	0	120.7
2919	T	30.5	Very low	30.1	Very low	120 Å²	120	120.8 Å²	120.8	74%	0.736	76%	0.755	S	S	*	*			cis	-165.3	159	35.1	22.3	0	0	0	0	112.7
2920	E	31.6	Very low	30.1	Very low	176 Å²	176	119.4 Å²	119.4	82%	0.822	75%	0.748	S	S	*	*			trans	-9.8	158.2	160.4	-62.4	172.2	178.4	0	0	115.8
2921	V	33.7	Very low	30.2	Very low	120.5 Å²	120.5	122.9 Å²	122.9	73%	0.73	75%	0.747	S	S	*	*				-145.3	133.1	83.6	-151.5	0	0	0	0	112
2922	N	31.4	Very low	30.2	Very low	126.75 Å²	126.75	125.7 Å²	125.7	68%	0.678	75%	0.747	S	S	*	*			trans	32.9	138.1	147.8	-65.4	-33.5	0	0	0	120.6
2923	N	31	Very low	30.2	Very low	144.25 Å²	144.25	124 Å²	124	77%	0.771	74%	0.74	S	S	*	*				105.3	143	91.8	-79.9	-26.5	0	0	0	116.7
2924	S	28.8	Very low	30.3	Very low	98.75 Å²	98.75	128.6 Å²	128.6	69%	0.691	74%	0.74	S	S	*	*			trans	178.4	150.4	150.9	-75.1	0	0	0	0	113.9
2925	L	27.9	Very low	30.2	Very low	152.25 Å²	152.25	130 Å²	130	80%	0.797	74%	0.739	S	S	*	*				86.8	143.3	97.8	-74	164.8	0	0	0	116.6
2926	I	29.8	Very low	30.3	Very low	156.75 Å²	156.75	130.8 Å²	130.8	80%	0.804	73%	0.734	S	S	*	*				139.6	132.2	124.2	-74	148.4	0	0	0	115.7
2927	S	26.9	Very low	30.3	Very low	105.25 Å²	105.25	132.5 Å²	132.5	74%	0.736	73%	0.732	S	S	*	*			trans	-129	-166.1	159	-53.2	0	0	0	0	112.5
2928	P	37.2	Very low	30.4	Very low	115.5 Å²	115.5	135.2 Å²	135.2	75%	0.75	74%	0.743	S	S	*	*			cis	-136	-168.3	-42.1	38.3	-17.7	0	0	0	115.1
2929	S	29.1	Very low	30.4	Very low	96.75 Å²	96.75	133.1 Å²	133.1	68%	0.677	74%	0.743	S	S	*	*			trans	95.5	153.4	152.2	71.6	0	0	0	0	120.2
2930	N	30.3	Very low	30.2	Very low	143.5 Å²	143.5	136.9 Å²	136.9	77%	0.767	75%	0.75	S	S	*	*				-168.5	153.7	122.3	-92.4	-14.4	0	0	0	113.9
2931	I	32.3	Very low	30	Very low	148.5 Å²	148.5	135 Å²	135	76%	0.762	75%	0.745	S	S	*	*				69.9	128.1	125.2	-63.9	158	0	0	0	118.5
2932	E	30.3	Very low	29.9	Very low	178.75 Å²	178.75	139.9 Å²	139.9	84%	0.835	75%	0.752	S	S	*	*				136.6	154.1	54.1	-113.1	-179.8	179.4	0	0	114.4	Y2934	E2932-Y2934 PolarHBondContact OE2-N 3.32Å
2933	G	29.9	Very low	29.8	Very low	64.75 Å²	64.75	140.7 Å²	140.7	67%	0.668	76%	0.756	S	S	*	*				147.4	141.7	62.7	0	0	0	0	0	117.1
2934	Y	28.9	Very low	29.7	Very low	215 Å²	215	136.9 Å²	136.9	84%	0.843	75%	0.751	S	S	*	*			trans	92.8	162.6	160.6	-98.1	-106.4	0	0	0	116.1	E2932	E2932-Y2934 PolarHBondContact OE2-N 3.32Å
2935	V	28.8	Very low	29.8	Very low	117.75 Å²	117.75	136 Å²	136	71%	0.714	76%	0.756	S	S	*	*				-161.8	151.5	-103.5	155.1	0	0	0	0	108.6
2936	E	29.9	Very low	30.1	Very low	144.5 Å²	144.5	137.2 Å²	137.2	68%	0.675	76%	0.758	S	S	*	*			trans	124.1	139.5	146.3	-93.4	-159.3	170.4	0	0	119.7
2937	K	30.7	Very low	30.4	Very low	150 Å²	150	134.8 Å²	134.8	65%	0.652	75%	0.753	S	S	*	*			trans	66.9	118.2	144.2	-67	174.6	-174.7	128.2	0	122.8
2938	N	30.2	Very low	30.8	Very low	155 Å²	155	139.4 Å²	139.4	83%	0.829	76%	0.759	S	S	*	*			trans	92.2	136.5	130.1	-66.9	-13.9	0	0	0	117.7
2939	G	28.2	Very low	30.5	Very low	64.5 Å²	64.5	136.8 Å²	136.8	67%	0.665	75%	0.754	S	S	*	*			trans	165.2	154.6	138.2	0	0	0	0	0	113.6
2940	F	28.1	Very low	30.6	Very low	200.75 Å²	200.75	141.4 Å²	141.4	88%	0.88	76%	0.762	S	S	*	*			trans	139.5	137.8	167.4	-84	-94.2	0	0	0	113.4
2941	L	27.3	Very low	30.6	Very low	136 Å²	136	141.8 Å²	141.8	71%	0.712	76%	0.763	S	S	*	*			cis	128.1	134.7	48.2	-157.9	96.6	0	0	0	113.5	D2943	L2941-D2943 HydrophobicContact CD2-CB 3.92Å
2942	Y	30.4	Very low	30.5	Very low	223.5 Å²	223.5	139.4 Å²	139.4	88%	0.876	76%	0.76	S	S	*	*			trans	-162.5	145.7	155.1	-107.3	-92.2	0	0	0	111.7
2943	D	29.3	Very low	30.4	Very low	143 Å²	143	137.7 Å²	137.7	77%	0.765	76%	0.757	S	S	*	*				-137	164.7	-105	-176.5	27.6	0	0	0	110.7	L2941 G2945	L2941-D2943 HydrophobicContact CD2-CB 3.92Å; D2943-G2945 PolarHBondContact O-N 2.94Å
2944	G	29.6	Very low	30.4	Very low	64.75 Å²	64.75	139.1 Å²	139.1	67%	0.668	76%	0.756	S	S	*	*			trans	92.3	130.5	161.3	0	0	0	0	0	117.6	Q2946	G2944-Q2946 PolarHBondContact O-N 3.39Å
2945	G	31.3	Very low	30.5	Very low	78.5 Å²	78.5	134.2 Å²	134.2	81%	0.809	75%	0.753	S	S	*	*			trans	138.2	114.3	146.4	0	0	0	0	0	117.1	D2943	D2943-G2945 PolarHBondContact O-N 2.94Å
2946	Q	32.8	Very low	30.6	Very low	177.75 Å²	177.75	133.9 Å²	133.9	83%	0.831	76%	0.757	S	S	*	*			trans	-127.7	144	157.8	-88.7	-79.2	-32.8	0	0	112.2	G2944 K2948	G2944-Q2946 PolarHBondContact O-N 3.39Å; Q2946-K2948 PolarHBondContact O-N 2.78Å
2947	P	37.3	Very low	30.7	Very low	106.25 Å²	106.25	131.7 Å²	131.7	69%	0.69	76%	0.757	S	S	*	*			trans	-132.3	144.1	159.1	34.8	-21.2	0	0	0	115.6
2948	K	34.1	Very low	30.7	Very low	201.5 Å²	201.5	135.7 Å²	135.7	88%	0.876	77%	0.768	S	S	*	*			trans	45.1	139.6	144.7	-56.6	169.9	-174.8	173.4	0	116.5	Q2946	Q2946-K2948 PolarHBondContact O-N 2.78Å
2949	G	31.6	Very low	30.8	Very low	62.5 Å²	62.5	133.2 Å²	133.2	64%	0.644	76%	0.763	S	S	*	*				158.1	129	70.2	0	0	0	0	0	116
2950	F	31.2	Very low	30.9	Very low	191.75 Å²	191.75	141.3 Å²	141.3	84%	0.841	77%	0.773	S	S	*	*			trans	67.9	126.1	161.9	-64.9	-82.4	0	0	0	117.8
2951	L	31.1	Very low	31.1	Very low	151.75 Å²	151.75	136 Å²	136	80%	0.795	76%	0.761	S	S	*	*				80.7	125.6	91.7	-74.5	173.2	0	0	0	115.6
2952	S	29.3	Very low	31.2	Very low	98.75 Å²	98.75	135.3 Å²	135.3	69%	0.691	76%	0.763	S	S	*	*				148.2	164.4	50.4	68.3	0	0	0	0	115.5
2953	N	29	Very low	31.2	Very low	144.25 Å²	144.25	130.7 Å²	130.7	77%	0.771	75%	0.753	S	S	*	*				43.5	131.4	127	-119.5	12.7	0	0	0	117.3
2954	S	29.2	Very low	31.1	Very low	94.25 Å²	94.25	127.5 Å²	127.5	66%	0.659	75%	0.746	S	S	*	*				61.1	140.2	84.8	-25	0	0	0	0	117.4
2955	S	31.2	Very low	31.1	Very low	110.75 Å²	110.75	130 Å²	130	77%	0.774	75%	0.754	S	S	*	*				165.5	151.4	72	-11.2	0	0	0	0	113.9
2956	S	31.6	Very low	31	Very low	112.25 Å²	112.25	130.5 Å²	130.5	79%	0.785	75%	0.75	S	S	*	*				125.7	164.3	73.3	-124.6	0	0	0	0	114.2
2957	S	30.3	Very low	31	Very low	98.5 Å²	98.5	129.3 Å²	129.3	69%	0.689	75%	0.748	S	S	*	*			cis	-157.6	153.3	-46.8	-2.5	0	0	0	0	110.5
2958	R	32.5	Very low	30.7	Very low	233.25 Å²	233.25	132.4 Å²	132.4	88%	0.88	75%	0.754	S	S	*	*			trans	82.2	117.3	160.9	-72.4	168.3	172.7	-162.2	-2.2	116.2
2959	S	31.2	Very low	30.5	Very low	103.25 Å²	103.25	128.9 Å²	128.9	72%	0.722	76%	0.755	S	S	*	*				130.6	134.7	69.3	-6.4	0	0	0	0	113.6
2960	R	30	Very low	30.5	Very low	233.75 Å²	233.75	129.3 Å²	129.3	88%	0.882	76%	0.759	S	S	*	*				125.8	113.9	75.7	-115.2	178.7	176.2	-175.9	-1.9	115.4
2961	S	32.3	Very low	30.4	Very low	89 Å²	89	131.7 Å²	131.7	62%	0.622	76%	0.762	S	S	*	*			trans	134.2	137	139.9	59.5	0	0	0	0	115.4
2962	T	30.5	Very low	30.5	Very low	122 Å²	122	131.8 Å²	131.8	75%	0.748	76%	0.762	S	S	*	*			trans	108	141.6	132.9	47.8	0	0	0	0	116.8
2963	L	30	Very low	30.5	Very low	127.25 Å²	127.25	133 Å²	133	67%	0.666	77%	0.765	S	S	*	*			trans	-50.7	152	167.2	-81.2	153.7	0	0	0	113.7
2964	A	28	Very low	30.8	Very low	75.5 Å²	75.5	132.2 Å²	132.2	62%	0.624	77%	0.765	S	S	*	*				121.6	153.1	-95.2	0	0	0	0	0	111.6
2965	S	28	Very low	30.9	Very low	117.75 Å²	117.75	134.4 Å²	134.4	82%	0.823	77%	0.769	S	S	*	*			trans	67.5	129.9	171.1	-65	0	0	0	0	113.6
2966	A	29.8	Very low	30.8	Very low	89 Å²	89	133.8 Å²	133.8	74%	0.736	77%	0.765	S	S	*	*			trans	-173.3	128.7	152.3	0	0	0	0	0	112
2967	L	32.1	Very low	30.9	Very low	152.25 Å²	152.25	140.2 Å²	140.2	80%	0.797	77%	0.772	S	S	*	*				-118.9	137.6	66.5	-75.5	167.8	0	0	0	111.7
2968	Q	31.8	Very low	31	Very low	171.75 Å²	171.75	140.3 Å²	140.3	80%	0.803	77%	0.773	S	S	*	*				68.4	142.4	129.9	-69.2	169.3	-34.7	0	0	119.7
2969	S	30.9	Very low	31	Very low	128.25 Å²	128.25	140.6 Å²	140.6	90%	0.897	77%	0.774	S	S	*	*			trans	72	120.3	164	-105.2	0	0	0	0	119.3
2970	G	30.6	Very low	31.2	Very low	70.25 Å²	70.25	140.2 Å²	140.2	72%	0.724	77%	0.771	S	S	*	*			trans	138	128.7	154.9	0	0	0	0	0	115.1
2971	R	29.3	Very low	31.5	Very low	242.5 Å²	242.5	135.9 Å²	135.9	92%	0.915	77%	0.766	S	S	*	*			trans	-5.3	123	152.9	-72.1	-177	175.6	167.5	-1.2	112	T2973	R2971-T2973 PolarHBondContact O-N 3.46Å
2972	I	33.4	Very low	31.6	Very low	154.25 Å²	154.25	138.4 Å²	138.4	79%	0.791	77%	0.772	S	S	*	*			trans	-90.4	120.4	165.8	-57.4	174.4	0	0	0	108.9	V2974	I2972-V2974 HydrophobicContact CG2-CG2 3.95Å; I2972-V2974 PolarHBondContact O-N 3.17Å
2973	T	29.6	Very low	31.9	Very low	123.5 Å²	123.5	143.4 Å²	143.4	76%	0.758	78%	0.778	S	S	*	*			trans	-110.6	107	161.3	19.5	0	0	0	0	110.8	R2971 N2975	R2971-T2973 PolarHBondContact O-N 3.46Å; T2973-N2975 PolarHBondContact O-N 3.19Å
2974	V	33.9	Very low	32	Very low	126.5 Å²	126.5	142.1 Å²	142.1	77%	0.767	78%	0.779	S	S	*	*			trans	-87.6	117.6	166.8	-101.9	0	0	0	0	110.4	I2972 S2976	I2972-V2974 HydrophobicContact CG2-CG2 3.95Å; I2972-V2974 PolarHBondContact O-N 3.17Å; V2974-S2976 PolarHBondContact O-N 3.2Å
2975	N	31.3	Very low	32.3	Very low	141.25 Å²	141.25	146.7 Å²	146.7	76%	0.755	79%	0.79	S	S	*	*				-80.9	128.2	112.1	-131.6	2.3	0	0	0	114.2	T2973 R2977	T2973-N2975 PolarHBondContact O-N 3.19Å; N2975-R2977 PolarHBondContact O-N 3.02Å; N2975-R2977 VanDerWaalsContact O-N 3.14Å
2976	S	30.3	Very low	32.7	Very low	98.5 Å²	98.5	146.2 Å²	146.2	69%	0.689	79%	0.786	S	S	*	*			trans	-15.2	138.1	164.8	-52.2	0	0	0	0	114.7	V2974 S2978	V2974-S2976 PolarHBondContact O-N 3.2Å; S2976-S2978 VanDerWaalsContact CB-OG 3.31Å; S2976-S2978 WeakPolarHBondContact CB-OG 3.39Å
2977	R	32.7	Very low	32.9	Very low	246.25 Å²	246.25	149.7 Å²	149.7	93%	0.929	79%	0.792	S	S	*	*			trans	157.1	97.5	151.7	-98.6	-173.7	173.6	-165.6	-2.6	113.7	N2975	N2975-R2977 PolarHBondContact O-N 3.02Å; N2975-R2977 VanDerWaalsContact O-N 3.14Å
2978	S	32.4	Very low	33.2	Very low	100.75 Å²	100.75	149.2 Å²	149.2	71%	0.705	79%	0.79	S	S	*	*			trans	-117.9	131	157.4	53.7	0	0	0	0	109.9	S2976 S2980	S2976-S2978 VanDerWaalsContact CB-OG 3.31Å; S2976-S2978 WeakPolarHBondContact CB-OG 3.39Å; S2978-S2980 VanDerWaalsContact C-N 3.35Å; S2978-S2980 PolarHBondContact OG-N 3.29Å; S2978-S2980 VanDerWaalsContact OG-N 3.08Å
2979	R	32.4	Very low	33.5	Very low	239 Å²	239	148.1 Å²	148.1	90%	0.902	79%	0.789	S	S	*	*			trans	-57	116	141.5	-77.2	-177.9	167.8	-179.8	-6.4	110	D2981	R2979-D2981 PolarHBondContact O-N 3.15Å
2980	S	36.6	Very low	33.9	Very low	95.5 Å²	95.5	148.9 Å²	148.9	67%	0.668	78%	0.783	S	S	*	*			trans	-140.8	128.3	147.4	48.2	0	0	0	0	107.2	S2978 D2982	S2978-S2980 VanDerWaalsContact C-N 3.35Å; S2978-S2980 PolarHBondContact OG-N 3.29Å; S2978-S2980 VanDerWaalsContact OG-N 3.08Å; S2980-D2982 PolarHBondContact O-N 3.05Å
2981	D	34.7	Very low	34.5	Very low	142.5 Å²	142.5	150.9 Å²	150.9	76%	0.762	78%	0.781	S	S	*	*			trans	-3.2	120.3	147.1	-58.6	-61.1	0	0	0	111.6	R2979 R2983	R2979-D2981 PolarHBondContact O-N 3.15Å; D2981-R2983 PolarHBondContact O-N 2.86Å
2982	D	35.7	Very low	35.4	Very low	142.75 Å²	142.75	145.2 Å²	145.2	76%	0.763	78%	0.776	S	S	*	*			trans	-125.1	136.6	139.5	-118	-36.9	0	0	0	111.3	S2980 S2984	S2980-D2982 PolarHBondContact O-N 3.05Å; D2982-S2984 WeakPolarHBondContact O-CA 3.08Å; D2982-S2984 PolarHBondContact O-N 3.21Å
2983	R	35.4	Very low	36.1	Very low	226.75 Å²	226.75	148.9 Å²	148.9	86%	0.856	78%	0.78	S	S	*	*			trans	-69.1	107.6	170.1	-69.6	171.4	-176.6	-166.8	-2.2	113.1	D2981	D2981-R2983 PolarHBondContact O-N 2.86Å
2984	S	33.4	Very low	37.2	Very low	99.75 Å²	99.75	148.5 Å²	148.5	70%	0.698	78%	0.779	S	S	*	*				45.3	121.9	125.4	42.5	0	0	0	0	117.3	D2982	D2982-S2984 WeakPolarHBondContact O-CA 3.08Å; D2982-S2984 PolarHBondContact O-N 3.21Å
2985	M	33.5	Very low	38.3	Very low	172 Å²	172	147.3 Å²	147.3	85%	0.847	77%	0.768	S	S	*	*			trans	-167.3	128.2	133.8	-83	-65.5	134.6	0	0	114.9
2986	S	37	Very low	39.9	Very low	106 Å²	106	143.5 Å²	143.5	74%	0.741	75%	0.753	S	S	*	*			trans	126.2	115.3	147	39.9	0	0	0	0	116.6	N2988	S2986-N2988 PolarHBondContact O-N 3.36Å
2987	N	34.2	Very low	41.7	Very low	163.5 Å²	163.5	144.1 Å²	144.1	87%	0.874	75%	0.754	S	S	*	*			trans	-51.5	121.9	158.7	-68.7	-34.3	0	0	0	112.3
2988	N	38.7	Very low	43.6	Very low	141 Å²	141	138.6 Å²	138.6	75%	0.754	74%	0.743	S	S	*	*			trans	-147.6	125.1	149.6	-141.6	-24.6	0	0	0	111.9	S2986 N2990	S2986-N2988 PolarHBondContact O-N 3.36Å; N2988-N2990 VanDerWaalsContact C-N 3.27Å; N2988-N2990 PolarHBondContact O-N 3.14Å; N2988-N2990 VanDerWaalsContact O-N 3.17Å
2989	I	36.7	Very low	45.7	Very low	149.75 Å²	149.75	137 Å²	137	77%	0.768	73%	0.729	S	S	*	*			trans	-89.3	83	-171.2	-56.7	176.2	0	0	0	109.3	T2991	I2989-T2991 HydrophobicContact CG2-CG2 4.2Å; I2989-T2991 PolarHBondContact O-N 3.13Å; I2989-T2991 VanDerWaalsContact O-N 3.15Å
2990	N	40.2	Very low	47.7	Very low	144.25 Å²	144.25	131.2 Å²	131.2	77%	0.771	72%	0.715	S	S	*	*			trans	-84.1	88.8	172.6	-82.3	-42.5	0	0	0	110.3	N2988 P2992	N2988-N2990 VanDerWaalsContact C-N 3.27Å; N2988-N2990 PolarHBondContact O-N 3.14Å; N2988-N2990 VanDerWaalsContact O-N 3.17Å; N2990-P2992 WeakPolarHBondContact O-CD 3.5Å
2991	T	43.2	Very low	49.6	Very low	111.75 Å²	111.75	131.1 Å²	131.1	69%	0.686	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-56.3	131.2	165.1	48.7	0	0	0	0	109.9	I2989 R2993	I2989-T2991 HydrophobicContact CG2-CG2 4.2Å; I2989-T2991 PolarHBondContact O-N 3.13Å; I2989-T2991 VanDerWaalsContact O-N 3.15Å; T2991-R2993 WeakPolarHBondContact O-CA 3.21Å; T2991-R2993 PolarHBondContact O-N 3.12Å
2992	P	47.7	Very low	51.5	Low	123.75 Å²	123.75	126.5 Å²	126.5	80%	0.804	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-64.6	118.6	-179.5	14.4	-18.2	0	0	0	110.2	N2990	N2990-P2992 WeakPolarHBondContact O-CD 3.5Å
2993	R	49.5	Very low	53.5	Low	231.5 Å²	231.5	123.9 Å²	123.9	87%	0.874	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-52.6	127.2	-174.6	-163.6	-179.5	-155.1	-131.3	6.1	109.9	T2991 L2995	T2991-R2993 WeakPolarHBondContact O-CA 3.21Å; T2991-R2993 PolarHBondContact O-N 3.12Å; R2993-L2995 PolarHBondContact O-N 3.12Å
2994	P	50.9	Low	55.6	Low	115 Å²	115	115.6 Å²	115.6	75%	0.747	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-59.2	125	-174.2	22.1	-32.8	0	0	0	110.4	S2996	P2994-S2996 PolarHBondContact O-N 2.85Å
2995	L	57.4	Low	57.9	Low	101.75 Å²	101.75	118 Å²	118	53%	0.533	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-63.5	136.6	176.6	-73.7	170.2	0	0	0	109	R2993 T2999 L3000 K3003	R2993-L2995 PolarHBondContact O-N 3.12Å; L2995-T2999 HydrophobicContact CD2-CG2 4.17Å; L2995-L3000 HydrophobicContact CB-CB 3.88Å; L2995-L3000 HydrophobicContact CB-CD1 4.32Å; L2995-L3000 HydrophobicContact CB-CG 4.45Å; L2995-K3003 HydrophobicContact CD1-CD 4.32Å
2996	S	64.7	Low	60.2	Low	62.5 Å²	62.5	112.6 Å²	112.6	44%	0.437	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-59.7	143.9	-179	71.1	0	0	0	0	110.4	P2994 N2998 T2999 L3000	P2994-S2996 PolarHBondContact O-N 2.85Å; S2996-N2998 CarbonylContact O-C 3.57Å; S2996-N2998 PolarHBondContact O-N 3.24Å; S2996-N2998 VanDerWaalsContact O-N 3.12Å; S2996-T2999 PolarHBondContact N-OG1 2.84Å; S2996-T2999 CarbonylContact O-C 3.58Å; S2996-T2999 WeakPolarHBondContact O-CA 3.44Å; S2996-T2999 PolarHBondContact O-N 3.2Å; S2996-T2999 VanDerWaalsContact O-N 3.09Å; S2996-T2999 PolarHBondContact O-OG1 3.41Å; S2996-T2999 WeakPolarHBondContact OG-CG2 3.44Å; S2996-T2999 PolarHBondContact OG-N 3.3Å; S2996-T2999 VanDerWaalsContact OG-N 3.14Å; S2996-T2999 PolarHBondContact OG-OG1 3.23Å; S2996-L3000 PolarHBondContact O-N 3.24Å
2997	P	69.3	Low	62.4	Low	109.25 Å²	109.25	113.3 Å²	113.3	71%	0.709	61%	0.61	S	S	*	*	H	α-helix	trans	-54.7	-34.2	-174.4	-29	36.2	0	0	0	113.8	T2999 L3000 E3001	P2997-T2999 VanDerWaalsContact C-N 3.32Å; P2997-T2999 PolarHBondContact O-N 3.1Å; P2997-L3000 PolarHBondContact O-N 3.19Å; P2997-E3001 WeakPolarHBondContact O-CB 3.48Å; P2997-E3001 PolarHBondContact O-N 2.98Å
2998	N	72.3	Confident	64.7	Low	132 Å²	132	109 Å²	109	71%	0.706	59%	0.592	S	S	*	*	H	α-helix	trans	-71.9	-29.3	-179.3	-85.4	-3.4	0	0	0	113.8	S2996 L3000 A3002	S2996-N2998 CarbonylContact O-C 3.57Å; S2996-N2998 PolarHBondContact O-N 3.24Å; S2996-N2998 VanDerWaalsContact O-N 3.12Å; N2998-L3000 VanDerWaalsContact C-N 3.32Å; N2998-L3000 PolarHBondContact O-N 3.39Å; N2998-A3002 VanDerWaalsContact O-CB 3.25Å; N2998-A3002 WeakPolarHBondContact O-CB 3.42Å; N2998-A3002 PolarHBondContact O-N 3.44Å
2999	T	75.3	Confident	66.9	Low	67.75 Å²	67.75	107.2 Å²	107.2	42%	0.416	58%	0.582	S	S	.	*	H	α-helix	trans	-74.2	-30.5	176.2	6.4	0	0	0	0	112	L2995 S2996 P2997 E3001 A3002 K3003	L2995-T2999 HydrophobicContact CD2-CG2 4.17Å; S2996-T2999 PolarHBondContact N-OG1 2.84Å; S2996-T2999 CarbonylContact O-C 3.58Å; S2996-T2999 WeakPolarHBondContact O-CA 3.44Å; S2996-T2999 PolarHBondContact O-N 3.2Å; S2996-T2999 VanDerWaalsContact O-N 3.09Å; S2996-T2999 PolarHBondContact O-OG1 3.41Å; S2996-T2999 WeakPolarHBondContact OG-CG2 3.44Å; S2996-T2999 PolarHBondContact OG-N 3.3Å; S2996-T2999 VanDerWaalsContact OG-N 3.14Å; S2996-T2999 PolarHBondContact OG-OG1 3.23Å; P2997-T2999 VanDerWaalsContact C-N 3.32Å; P2997-T2999 PolarHBondContact O-N 3.1Å; T2999-E3001 PolarHBondContact O-N 3.18Å; T2999-A3002 PolarHBondContact O-N 3.08Å; T2999-A3002 WeakPolarHBondContact OG1-CB 3.26Å; T2999-A3002 PolarHBondContact OG1-N 3.21Å; T2999-K3003 WeakPolarHBondContact O-CB 3.29Å; T2999-K3003 PolarHBondContact O-N 2.78Å
3000	L	75.2	Confident	69.2	Low	116.5 Å²	116.5	101.7 Å²	101.7	61%	0.61	56%	0.559	S	S	*	*	H	α-helix	trans	-65.5	-40.4	174.6	-168.1	152.5	0	0	0	110.7	L2995 S2996 P2997 N2998 K3003 A3004	L2995-L3000 HydrophobicContact CB-CB 3.88Å; L2995-L3000 HydrophobicContact CB-CD1 4.32Å; L2995-L3000 HydrophobicContact CB-CG 4.45Å; S2996-L3000 PolarHBondContact O-N 3.24Å; P2997-L3000 PolarHBondContact O-N 3.19Å; N2998-L3000 VanDerWaalsContact C-N 3.32Å; N2998-L3000 PolarHBondContact O-N 3.39Å; L3000-K3003 PolarHBondContact O-N 3.3Å; L3000-A3004 WeakPolarHBondContact O-CB 3.23Å; L3000-A3004 PolarHBondContact O-N 2.96Å
3001	E	75.9	Confident	71.3	Confident	94 Å²	94	97.4 Å²	97.4	44%	0.439	54%	0.543	S	S	.	.	H	α-helix	trans	-62.9	-42.9	174.6	-163.4	-168.2	167.6	0	0	112.2	P2997 T2999 K3003 A3004 R3005	P2997-E3001 WeakPolarHBondContact O-CB 3.48Å; P2997-E3001 PolarHBondContact O-N 2.98Å; T2999-E3001 PolarHBondContact O-N 3.18Å; E3001-K3003 VanDerWaalsContact C-N 3.31Å; E3001-K3003 PolarHBondContact O-N 3.15Å; E3001-A3004 CarbonylContact O-C 3.59Å; E3001-A3004 WeakPolarHBondContact O-CB 3.4Å; E3001-A3004 PolarHBondContact O-N 3.21Å; E3001-A3004 VanDerWaalsContact O-N 3.13Å; E3001-R3005 HydrophobicContact CG-CG 4.32Å; E3001-R3005 WeakPolarHBondContact O-CB 3.42Å; E3001-R3005 VanDerWaalsContact O-CG 3.3Å; E3001-R3005 WeakPolarHBondContact O-CG 3.42Å; E3001-R3005 PolarHBondContact O-N 3.1Å; E3001-R3005 IonicContact OE1-CZ 3.21Å; E3001-R3005 IonicContact OE1-NE 2.99Å; E3001-R3005 PolarHBondContact OE1-NE 3.24Å; E3001-R3005 IonicContact OE1-NH2 2.7Å; E3001-R3005 PolarHBondContact OE1-NH2 3.06Å; E3001-R3005 IonicContact OE2-NH2 3.49Å
3002	A	74.7	Confident	73.4	Confident	44.6667 Å²	44.6667	95 Å²	95	37%	0.369	53%	0.529	S	S	.	.	H	α-helix	trans	-61.5	-42.3	174.9	0	0	0	0	0	111.8	N2998 T2999 A3004 R3005 A3006	N2998-A3002 VanDerWaalsContact O-CB 3.25Å; N2998-A3002 WeakPolarHBondContact O-CB 3.42Å; N2998-A3002 PolarHBondContact O-N 3.44Å; T2999-A3002 PolarHBondContact O-N 3.08Å; T2999-A3002 WeakPolarHBondContact OG1-CB 3.26Å; T2999-A3002 PolarHBondContact OG1-N 3.21Å; A3002-A3004 VanDerWaalsContact C-N 3.34Å; A3002-A3004 PolarHBondContact O-N 3.15Å; A3002-R3005 PolarHBondContact O-N 3.19Å; A3002-A3006 VanDerWaalsContact O-CB 3.3Å; A3002-A3006 WeakPolarHBondContact O-CB 3.38Å; A3002-A3006 PolarHBondContact O-N 2.89Å
3003	K	78.8	Confident	75.3	Confident	89.3333 Å²	89.3333	92.8 Å²	92.8	39%	0.388	51%	0.51	S	S	.	.	H	α-helix	trans	-62	-39.6	172.8	-104.8	-178.8	175.9	-175.1	0	111.8	D2406 L2995 T2999 L3000 E3001 A3006 R3007	D2406-K3003 IonicContact OD1-NZ 2.96Å; D2406-K3003 PolarHBondContact OD1-NZ 3.38Å; D2406-K3003 WeakPolarHBondContact OD2-CD 3.38Å; D2406-K3003 WeakPolarHBondContact OD2-CE 3.41Å; D2406-K3003 IonicContact OD2-NZ 2.72Å; D2406-K3003 PolarHBondContact OD2-NZ 2.72Å; L2995-K3003 HydrophobicContact CD1-CD 4.32Å; T2999-K3003 WeakPolarHBondContact O-CB 3.29Å; T2999-K3003 PolarHBondContact O-N 2.78Å; L3000-K3003 PolarHBondContact O-N 3.3Å; E3001-K3003 VanDerWaalsContact C-N 3.31Å; E3001-K3003 PolarHBondContact O-N 3.15Å; K3003-A3006 PolarHBondContact O-N 3.07Å; K3003-R3007 WeakPolarHBondContact O-CB 3.34Å; K3003-R3007 VanDerWaalsContact O-CG 3.29Å; K3003-R3007 WeakPolarHBondContact O-CG 3.35Å; K3003-R3007 PolarHBondContact O-N 3.39Å; K3003-R3007 VanDerWaalsContact O-N 3.1Å
3004	A	79.2	Confident	77	Confident	50.6667 Å²	50.6667	83.3 Å²	83.3	42%	0.419	48%	0.481	S	S	.	.	H	α-helix	trans	-68.2	-45.3	176.9	0	0	0	0	0	112.4	L3000 E3001 A3002 A3006 R3007 S3008	L3000-A3004 WeakPolarHBondContact O-CB 3.23Å; L3000-A3004 PolarHBondContact O-N 2.96Å; E3001-A3004 CarbonylContact O-C 3.59Å; E3001-A3004 WeakPolarHBondContact O-CB 3.4Å; E3001-A3004 PolarHBondContact O-N 3.21Å; E3001-A3004 VanDerWaalsContact O-N 3.13Å; A3002-A3004 VanDerWaalsContact C-N 3.34Å; A3002-A3004 PolarHBondContact O-N 3.15Å; A3004-A3006 VanDerWaalsContact C-N 3.35Å; A3004-A3006 PolarHBondContact O-N 3.02Å; A3004-R3007 PolarHBondContact O-N 3.2Å; A3004-S3008 WeakPolarHBondContact O-CB 3.37Å; A3004-S3008 PolarHBondContact O-N 3.06Å
3005	R	81.1	Confident	78.7	Confident	151.333 Å²	151.333	80.4 Å²	80.4	57%	0.571	47%	0.467	S	S	*	.	H	α-helix	trans	-59	-45.5	174	-72	174.9	179.3	-144.5	7.7	111	E3001 A3002 R3007 S3008 I3009	E3001-R3005 HydrophobicContact CG-CG 4.32Å; E3001-R3005 WeakPolarHBondContact O-CB 3.42Å; E3001-R3005 VanDerWaalsContact O-CG 3.3Å; E3001-R3005 WeakPolarHBondContact O-CG 3.42Å; E3001-R3005 PolarHBondContact O-N 3.1Å; E3001-R3005 IonicContact OE1-CZ 3.21Å; E3001-R3005 IonicContact OE1-NE 2.99Å; E3001-R3005 PolarHBondContact OE1-NE 3.24Å; E3001-R3005 IonicContact OE1-NH2 2.7Å; E3001-R3005 PolarHBondContact OE1-NH2 3.06Å; E3001-R3005 IonicContact OE2-NH2 3.49Å; A3002-R3005 PolarHBondContact O-N 3.19Å; R3005-R3007 PolarHBondContact O-N 3.31Å; R3005-S3008 WeakPolarHBondContact O-CB 3.31Å; R3005-S3008 PolarHBondContact O-N 3.02Å; R3005-I3009 VanDerWaalsContact O-CG1 3.31Å; R3005-I3009 WeakPolarHBondContact O-CG1 3.29Å; R3005-I3009 PolarHBondContact O-N 3.12Å
3006	A	82.2	Confident	80.1	Confident	57.3333 Å²	57.3333	83.9 Å²	83.9	47%	0.474	47%	0.473	S	S	.	.	H	α-helix	trans	-61.5	-45.3	176.2	0	0	0	0	0	112.5	A3002 K3003 A3004 S3008 I3009 A3010	A3002-A3006 VanDerWaalsContact O-CB 3.3Å; A3002-A3006 WeakPolarHBondContact O-CB 3.38Å; A3002-A3006 PolarHBondContact O-N 2.89Å; K3003-A3006 PolarHBondContact O-N 3.07Å; A3004-A3006 VanDerWaalsContact C-N 3.35Å; A3004-A3006 PolarHBondContact O-N 3.02Å; A3006-S3008 VanDerWaalsContact C-N 3.33Å; A3006-S3008 PolarHBondContact O-N 3.13Å; A3006-I3009 PolarHBondContact O-N 3.25Å; A3006-A3010 WeakPolarHBondContact O-CB 3.25Å; A3006-A3010 PolarHBondContact O-N 3.14Å
3007	R	82.6	Confident	81.2	Confident	121.667 Å²	121.667	82.2 Å²	82.2	46%	0.459	46%	0.463	S	S	.	.	H	α-helix	trans	-61.7	-39.7	174.5	-72.6	175	-178.1	-169.7	1.7	112.1	D2406 T2409 L2412 K3003 A3004 R3005 A3010 A3011	D2406-R3007 VanDerWaalsContact CG-NH2 3.31Å; D2406-R3007 IonicContact OD2-CZ 2.67Å; D2406-R3007 IonicContact OD2-NH2 3.37Å; D2406-R3007 PolarHBondContact OD2-NH2 3.47Å; T2409-R3007 HydrophobicContact CG2-CG 4.03Å; L2412-R3007 HydrophobicContact CD2-CB 3.97Å; L2412-R3007 HydrophobicContact CD2-CG 4.11Å; L2412-R3007 WeakPolarHBondContact CD2-O 3.49Å; K3003-R3007 WeakPolarHBondContact O-CB 3.34Å; K3003-R3007 VanDerWaalsContact O-CG 3.29Å; K3003-R3007 WeakPolarHBondContact O-CG 3.35Å; K3003-R3007 PolarHBondContact O-N 3.39Å; K3003-R3007 VanDerWaalsContact O-N 3.1Å; A3004-R3007 PolarHBondContact O-N 3.2Å; R3005-R3007 PolarHBondContact O-N 3.31Å; R3007-A3010 PolarHBondContact O-N 3.08Å; R3007-A3011 VanDerWaalsContact O-CB 3.32Å; R3007-A3011 WeakPolarHBondContact O-CB 3.34Å; R3007-A3011 PolarHBondContact O-N 3.09Å
3008	S	82.7	Confident	81.9	Confident	72.6667 Å²	72.6667	79.6 Å²	79.6	51%	0.508	45%	0.447	S	S	.	.	H	α-helix	trans	-64.5	-42.6	176.1	-174.2	0	0	0	0	112.6	A3004 R3005 A3006 A3011 T3012	A3004-S3008 WeakPolarHBondContact O-CB 3.37Å; A3004-S3008 PolarHBondContact O-N 3.06Å; R3005-S3008 WeakPolarHBondContact O-CB 3.31Å; R3005-S3008 PolarHBondContact O-N 3.02Å; A3006-S3008 VanDerWaalsContact C-N 3.33Å; A3006-S3008 PolarHBondContact O-N 3.13Å; S3008-A3011 PolarHBondContact O-N 3.39Å; S3008-T3012 VanDerWaalsContact O-CB 3.27Å; S3008-T3012 WeakPolarHBondContact O-CB 3.43Å; S3008-T3012 WeakPolarHBondContact O-CG2 3.49Å; S3008-T3012 PolarHBondContact O-N 2.89Å; S3008-T3012 PolarHBondContact O-OG1 3.21Å
3009	I	85.6	Confident	82.7	Confident	103 Å²	103	76.4 Å²	76.4	53%	0.528	43%	0.432	S	S	.	.	H	α-helix	trans	-64.6	-44.8	175.3	-67.9	164.2	0	0	0	110.9	R3005 A3006 T3012 N3013	R3005-I3009 VanDerWaalsContact O-CG1 3.31Å; R3005-I3009 WeakPolarHBondContact O-CG1 3.29Å; R3005-I3009 PolarHBondContact O-N 3.12Å; A3006-I3009 PolarHBondContact O-N 3.25Å; I3009-T3012 WeakPolarHBondContact CA-OG1 3.09Å; I3009-T3012 WeakPolarHBondContact O-CB 3.29Å; I3009-T3012 PolarHBondContact O-N 3Å; I3009-T3012 PolarHBondContact O-OG1 3.46Å; I3009-T3012 VanDerWaalsContact O-OG1 3.06Å; I3009-N3013 WeakPolarHBondContact O-CB 3.32Å; I3009-N3013 VanDerWaalsContact O-CG 3.26Å; I3009-N3013 PolarHBondContact O-N 3.15Å; I3009-N3013 PolarHBondContact O-ND2 3.07Å
3010	A	84.4	Confident	83.3	Confident	35.3333 Å²	35.3333	75.2 Å²	75.2	29%	0.292	43%	0.43	S	S	.	.	H	α-helix	trans	-63.7	-43.7	177.4	0	0	0	0	0	112.2	L2412 V2416 A3006 R3007 T3012 N3013 A3014	L2412-A3010 HydrophobicContact CD2-CB 3.72Å; L2412-A3010 HydrophobicContact CG-CB 3.8Å; V2416-A3010 HydrophobicContact CG2-CB 4.14Å; V2416-A3010 VanDerWaalsContact CG2-O 3.31Å; V2416-A3010 WeakPolarHBondContact CG2-O 3.45Å; A3006-A3010 WeakPolarHBondContact O-CB 3.25Å; A3006-A3010 PolarHBondContact O-N 3.14Å; R3007-A3010 PolarHBondContact O-N 3.08Å; A3010-T3012 PolarHBondContact O-N 3.1Å; A3010-N3013 PolarHBondContact O-N 3.21Å; A3010-A3014 WeakPolarHBondContact O-CB 3.31Å; A3010-A3014 PolarHBondContact O-N 3.26Å
3011	A	83.8	Confident	83.9	Confident	53.3333 Å²	53.3333	70.7 Å²	70.7	44%	0.441	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-41.5	174.5	0	0	0	0	0	112.4	R3007 S3008 N3013 A3014 A3015	R3007-A3011 VanDerWaalsContact O-CB 3.32Å; R3007-A3011 WeakPolarHBondContact O-CB 3.34Å; R3007-A3011 PolarHBondContact O-N 3.09Å; S3008-A3011 PolarHBondContact O-N 3.39Å; A3011-N3013 VanDerWaalsContact C-N 3.33Å; A3011-N3013 PolarHBondContact O-N 3.05Å; A3011-A3014 PolarHBondContact O-N 3.13Å; A3011-A3015 WeakPolarHBondContact O-CB 3.29Å; A3011-A3015 PolarHBondContact O-N 3.35Å
3012	T	88.7	Confident	84.4	Confident	62.6667 Å²	62.6667	73.1 Å²	73.1	38%	0.384	41%	0.414	S	S	.	.	H	α-helix	trans	-64.7	-38.1	175.4	-31	0	0	0	0	111.9	S3008 I3009 A3010 A3015 R3016	S3008-T3012 VanDerWaalsContact O-CB 3.27Å; S3008-T3012 WeakPolarHBondContact O-CB 3.43Å; S3008-T3012 WeakPolarHBondContact O-CG2 3.49Å; S3008-T3012 PolarHBondContact O-N 2.89Å; S3008-T3012 PolarHBondContact O-OG1 3.21Å; I3009-T3012 WeakPolarHBondContact CA-OG1 3.09Å; I3009-T3012 WeakPolarHBondContact O-CB 3.29Å; I3009-T3012 PolarHBondContact O-N 3Å; I3009-T3012 PolarHBondContact O-OG1 3.46Å; I3009-T3012 VanDerWaalsContact O-OG1 3.06Å; A3010-T3012 PolarHBondContact O-N 3.1Å; T3012-A3015 PolarHBondContact O-N 3.29Å; T3012-R3016 WeakPolarHBondContact O-CB 3.39Å; T3012-R3016 VanDerWaalsContact O-CG 3.26Å; T3012-R3016 WeakPolarHBondContact O-CG 3.25Å; T3012-R3016 PolarHBondContact O-N 2.9Å
3013	N	87.3	Confident	85.2	Confident	76.6667 Å²	76.6667	79.3 Å²	79.3	41%	0.41	43%	0.428	S	S	.	.	H	α-helix	trans	-68.7	-41.3	174.7	-74.6	-16.8	0	0	0	112.2	I3009 A3010 A3011 A3015 R3016 A3017	I3009-N3013 WeakPolarHBondContact O-CB 3.32Å; I3009-N3013 VanDerWaalsContact O-CG 3.26Å; I3009-N3013 PolarHBondContact O-N 3.15Å; I3009-N3013 PolarHBondContact O-ND2 3.07Å; A3010-N3013 PolarHBondContact O-N 3.21Å; A3011-N3013 VanDerWaalsContact C-N 3.33Å; A3011-N3013 PolarHBondContact O-N 3.05Å; N3013-A3015 VanDerWaalsContact C-N 3.34Å; N3013-A3015 PolarHBondContact O-N 2.87Å; N3013-R3016 PolarHBondContact O-N 3.04Å; N3013-A3017 WeakPolarHBondContact O-CB 3.26Å; N3013-A3017 PolarHBondContact O-N 2.95Å
3014	A	84	Confident	85.7	Confident	31.6667 Å²	31.6667	76.1 Å²	76.1	26%	0.262	42%	0.419	S	S	.	.	H	α-helix	trans	-62	-39.9	173.1	0	0	0	0	0	112.1	V2416 A3010 A3011 A3017 S3018	V2416-A3014 HydrophobicContact CG2-CB 4.07Å; A3010-A3014 WeakPolarHBondContact O-CB 3.31Å; A3010-A3014 PolarHBondContact O-N 3.26Å; A3011-A3014 PolarHBondContact O-N 3.13Å; A3014-A3017 PolarHBondContact O-N 3.28Å; A3014-S3018 VanDerWaalsContact O-CB 3.25Å; A3014-S3018 WeakPolarHBondContact O-CB 3.36Å; A3014-S3018 PolarHBondContact O-N 3.24Å; A3014-S3018 PolarHBondContact O-OG 2.99Å
3015	A	86.7	Confident	86.2	Confident	55.3333 Å²	55.3333	81.6 Å²	81.6	46%	0.457	43%	0.428	S	S	.	.	H	α-helix	trans	-64.2	-44.5	173.8	0	0	0	0	0	112	A3011 T3012 N3013 S3018 V3019	A3011-A3015 WeakPolarHBondContact O-CB 3.29Å; A3011-A3015 PolarHBondContact O-N 3.35Å; T3012-A3015 PolarHBondContact O-N 3.29Å; N3013-A3015 VanDerWaalsContact C-N 3.34Å; N3013-A3015 PolarHBondContact O-N 2.87Å; A3015-S3018 WeakPolarHBondContact O-CB 3.29Å; A3015-S3018 PolarHBondContact O-N 3.44Å; A3015-V3019 WeakPolarHBondContact O-CG2 3.37Å; A3015-V3019 PolarHBondContact O-N 2.97Å
3016	R	88.3	Confident	86.6	Confident	174.667 Å²	174.667	82 Å²	82	66%	0.659	44%	0.435	S	S	*	.	H	α-helix	trans	-60.7	-45.9	174.6	-74.5	170.6	178.1	-166.2	-1.1	111.9	T3012 N3013 S3018 V3019 A3020	T3012-R3016 WeakPolarHBondContact O-CB 3.39Å; T3012-R3016 VanDerWaalsContact O-CG 3.26Å; T3012-R3016 WeakPolarHBondContact O-CG 3.25Å; T3012-R3016 PolarHBondContact O-N 2.9Å; N3013-R3016 PolarHBondContact O-N 3.04Å; R3016-S3018 VanDerWaalsContact C-N 3.32Å; R3016-S3018 PolarHBondContact O-N 3.11Å; R3016-V3019 PolarHBondContact O-N 3.12Å; R3016-A3020 WeakPolarHBondContact O-CB 3.48Å; R3016-A3020 PolarHBondContact O-N 2.97Å
3017	A	86.3	Confident	87	Confident	27.3333 Å²	27.3333	83.1 Å²	83.1	23%	0.226	43%	0.43	C	S	.	.	H	α-helix	trans	-61.1	-40.8	175	0	0	0	0	0	111.9	N3013 A3014 V3019 A3020 A3021	N3013-A3017 WeakPolarHBondContact O-CB 3.26Å; N3013-A3017 PolarHBondContact O-N 2.95Å; A3014-A3017 PolarHBondContact O-N 3.28Å; A3017-V3019 VanDerWaalsContact C-N 3.33Å; A3017-V3019 PolarHBondContact O-N 3.05Å; A3017-A3020 PolarHBondContact O-N 3.15Å; A3017-A3021 WeakPolarHBondContact O-CB 3.46Å; A3017-A3021 PolarHBondContact O-N 2.88Å
3018	S	84.5	Confident	87.4	Confident	52.6667 Å²	52.6667	82.8 Å²	82.8	37%	0.368	43%	0.429	S	S	.	.	H	α-helix	trans	-66.4	-33.4	176	-91.6	0	0	0	0	113.4	A3014 A3015 R3016 R3022	A3014-S3018 VanDerWaalsContact O-CB 3.25Å; A3014-S3018 WeakPolarHBondContact O-CB 3.36Å; A3014-S3018 PolarHBondContact O-N 3.24Å; A3014-S3018 PolarHBondContact O-OG 2.99Å; A3015-S3018 WeakPolarHBondContact O-CB 3.29Å; A3015-S3018 PolarHBondContact O-N 3.44Å; R3016-S3018 VanDerWaalsContact C-N 3.32Å; R3016-S3018 PolarHBondContact O-N 3.11Å; S3018-R3022 WeakPolarHBondContact O-CB 3.13Å; S3018-R3022 WeakPolarHBondContact O-CG 3.4Å; S3018-R3022 PolarHBondContact O-N 3.18Å; S3018-R3022 VanDerWaalsContact O-N 3.16Å; S3018-R3022 PolarHBondContact O-NE 3.16Å; S3018-R3022 VanDerWaalsContact O-NE 3.11Å; S3018-R3022 PolarHBondContact OG-NE 3.2Å; S3018-R3022 PolarHBondContact OG-NH2 3.49Å
3019	V	88.8	Confident	87.8	Confident	65.3333 Å²	65.3333	81.9 Å²	81.9	40%	0.396	43%	0.426	S	S	.	.	H	α-helix	trans	-71.8	-42.9	171.8	170.9	0	0	0	0	110.9	A3015 R3016 A3017 R3022 R3023	A3015-V3019 WeakPolarHBondContact O-CG2 3.37Å; A3015-V3019 PolarHBondContact O-N 2.97Å; R3016-V3019 PolarHBondContact O-N 3.12Å; A3017-V3019 VanDerWaalsContact C-N 3.33Å; A3017-V3019 PolarHBondContact O-N 3.05Å; V3019-R3022 PolarHBondContact O-N 3.25Å; V3019-R3023 WeakPolarHBondContact O-CB 3.46Å; V3019-R3023 WeakPolarHBondContact O-CG 3.43Å; V3019-R3023 PolarHBondContact O-N 3.06Å
3020	A	88.9	Confident	88	Confident	43.3333 Å²	43.3333	82.4 Å²	82.4	36%	0.358	43%	0.429	S	S	.	.	H	α-helix	trans	-61.2	-45.3	175.3	0	0	0	0	0	111.9	L2423 R3016 A3017 R3022 R3023 A3024	L2423-A3020 HydrophobicContact CD1-CB 3.99Å; L2423-A3020 HydrophobicContact CD2-CB 3.84Å; R3016-A3020 WeakPolarHBondContact O-CB 3.48Å; R3016-A3020 PolarHBondContact O-N 2.97Å; A3017-A3020 PolarHBondContact O-N 3.15Å; A3020-R3022 VanDerWaalsContact C-N 3.31Å; A3020-R3022 PolarHBondContact O-N 3.31Å; A3020-R3023 WeakPolarHBondContact O-CB 3.38Å; A3020-R3023 PolarHBondContact O-N 3Å; A3020-R3023 VanDerWaalsContact O-N 3.15Å; A3020-A3024 WeakPolarHBondContact O-CB 3.39Å; A3020-A3024 PolarHBondContact O-N 3.28Å
3021	A	88.3	Confident	88.4	Confident	22 Å²	22	83.1 Å²	83.1	18%	0.182	43%	0.427	C	S	.	.	H	α-helix	trans	-63.5	-35.4	177.2	0	0	0	0	0	112.6	L2423 I2426 A3017 R3025	L2423-A3021 HydrophobicContact CD1-CB 4.39Å; I2426-A3021 HydrophobicContact CD1-CB 4.01Å; A3017-A3021 WeakPolarHBondContact O-CB 3.46Å; A3017-A3021 PolarHBondContact O-N 2.88Å; A3021-R3025 VanDerWaalsContact O-CG 3.28Å; A3021-R3025 WeakPolarHBondContact O-CG 3.37Å; A3021-R3025 PolarHBondContact O-N 3.18Å; A3021-R3025 VanDerWaalsContact O-N 3.11Å
3022	R	86.2	Confident	88.8	Confident	145 Å²	145	83 Å²	83	55%	0.547	42%	0.418	S	S	.	.	H	α-helix	trans	-64.8	-47.6	171.2	-79.9	-177.6	-78.5	179.2	-3.8	111.6	S3018 V3019 A3020 A3024 R3025 F3026	S3018-R3022 WeakPolarHBondContact O-CB 3.13Å; S3018-R3022 WeakPolarHBondContact O-CG 3.4Å; S3018-R3022 PolarHBondContact O-N 3.18Å; S3018-R3022 VanDerWaalsContact O-N 3.16Å; S3018-R3022 PolarHBondContact O-NE 3.16Å; S3018-R3022 VanDerWaalsContact O-NE 3.11Å; S3018-R3022 PolarHBondContact OG-NE 3.2Å; S3018-R3022 PolarHBondContact OG-NH2 3.49Å; V3019-R3022 PolarHBondContact O-N 3.25Å; A3020-R3022 VanDerWaalsContact C-N 3.31Å; A3020-R3022 PolarHBondContact O-N 3.31Å; R3022-A3024 VanDerWaalsContact C-N 3.34Å; R3022-A3024 PolarHBondContact O-N 2.94Å; R3022-R3025 PolarHBondContact O-N 2.95Å; R3022-F3026 VanDerWaalsContact O-CD2 3.28Å; R3022-F3026 WeakPolarHBondContact O-CD2 3.35Å; R3022-F3026 PolarHBondContact O-N 3.23Å; R3022-F3026 VanDerWaalsContact O-N 3.16Å
3023	R	90.3	Very high	89	Confident	173.333 Å²	173.333	86.5 Å²	86.5	65%	0.654	43%	0.43	S	S	*	.	H	α-helix	trans	-58.4	-45.9	176.5	-99.5	176.8	178.3	165.9	2.9	112.1	V3019 A3020 R3025 F3026 E3027	V3019-R3023 WeakPolarHBondContact O-CB 3.46Å; V3019-R3023 WeakPolarHBondContact O-CG 3.43Å; V3019-R3023 PolarHBondContact O-N 3.06Å; A3020-R3023 WeakPolarHBondContact O-CB 3.38Å; A3020-R3023 PolarHBondContact O-N 3Å; A3020-R3023 VanDerWaalsContact O-N 3.15Å; R3023-R3025 VanDerWaalsContact C-N 3.32Å; R3023-R3025 PolarHBondContact O-N 3.02Å; R3023-F3026 PolarHBondContact O-N 2.72Å; R3023-F3026 VanDerWaalsContact O-N 3.13Å; R3023-E3027 HydrophobicContact CG-CG 4.42Å; R3023-E3027 IonicContact CZ-OE1 2.68Å; R3023-E3027 IonicContact NE-OE1 2.77Å; R3023-E3027 PolarHBondContact NE-OE1 3.26Å; R3023-E3027 IonicContact NH2-OE1 3.14Å; R3023-E3027 PolarHBondContact NH2-OE1 2.77Å; R3023-E3027 VanDerWaalsContact NH2-OE1 3.07Å; R3023-E3027 PolarHBondContact O-N 3.28Å
3024	A	89.4	Confident	89.2	Confident	23.6667 Å²	23.6667	89.5 Å²	89.5	20%	0.196	44%	0.435	C	S	.	.	H	α-helix	trans	-61.5	-37.7	177.6	0	0	0	0	0	112.7	L2423 I2426 I2430 A3020 R3022 E3027 R3028	L2423-A3024 HydrophobicContact CD1-CB 4.28Å; I2426-A3024 HydrophobicContact CB-CB 4.44Å; I2426-A3024 HydrophobicContact CG2-CB 3.59Å; I2430-A3024 HydrophobicContact CD1-CB 3.84Å; I2430-A3024 WeakPolarHBondContact CD1-O 3.43Å; A3020-A3024 WeakPolarHBondContact O-CB 3.39Å; A3020-A3024 PolarHBondContact O-N 3.28Å; R3022-A3024 VanDerWaalsContact C-N 3.34Å; R3022-A3024 PolarHBondContact O-N 2.94Å; A3024-E3027 PolarHBondContact O-N 3.02Å; A3024-R3028 WeakPolarHBondContact O-CB 3.46Å; A3024-R3028 PolarHBondContact O-N 3.09Å
3025	R	89.2	Confident	89.7	Confident	165.333 Å²	165.333	89.7 Å²	89.7	62%	0.624	43%	0.433	S	S	*	.	H	α-helix	trans	-64.4	-42.1	173.5	-72.4	170.8	-171.8	-173.2	2.8	112.6	I2426 A3021 R3022 R3023 R3028 A3029	I2426-R3025 HydrophobicContact CD1-CG 4.06Å; I2426-R3025 HydrophobicContact CG2-CG 4.49Å; A3021-R3025 VanDerWaalsContact O-CG 3.28Å; A3021-R3025 WeakPolarHBondContact O-CG 3.37Å; A3021-R3025 PolarHBondContact O-N 3.18Å; A3021-R3025 VanDerWaalsContact O-N 3.11Å; R3022-R3025 PolarHBondContact O-N 2.95Å; R3023-R3025 VanDerWaalsContact C-N 3.32Å; R3023-R3025 PolarHBondContact O-N 3.02Å; R3025-R3028 PolarHBondContact O-N 2.9Å; R3025-A3029 WeakPolarHBondContact O-CB 3.45Å; R3025-A3029 PolarHBondContact O-N 3.08Å
3026	F	90.4	Very high	89.9	Confident	159.667 Å²	159.667	94.3 Å²	94.3	70%	0.7	44%	0.439	S	S	*	.	H	α-helix	trans	-64.4	-42.6	174.6	-77.5	-67.9	0	0	0	112.1	R3022 R3023 R3028 A3029 L3030	R3022-F3026 VanDerWaalsContact O-CD2 3.28Å; R3022-F3026 WeakPolarHBondContact O-CD2 3.35Å; R3022-F3026 PolarHBondContact O-N 3.23Å; R3022-F3026 VanDerWaalsContact O-N 3.16Å; R3023-F3026 PolarHBondContact O-N 2.72Å; R3023-F3026 VanDerWaalsContact O-N 3.13Å; F3026-R3028 PolarHBondContact O-N 2.84Å; F3026-A3029 PolarHBondContact O-N 2.91Å; F3026-L3030 WeakPolarHBondContact O-CB 3.44Å; F3026-L3030 PolarHBondContact O-N 3.11Å; F3026-L3030 VanDerWaalsContact O-N 3.09Å
3027	E	90.2	Very high	90	Very high	80.3333 Å²	80.3333	89 Å²	89	38%	0.375	43%	0.429	S	S	.	.	H	α-helix	trans	-63	-43.5	176.5	-134.7	-170.1	155.9	0	0	111.5	R2434 R3023 A3024 A3029 L3030 L3031	R2434-E3027 IonicContact CZ-OE1 3.24Å; R2434-E3027 IonicContact NE-OE1 3.65Å; R2434-E3027 PolarHBondContact NE-OE1 3.09Å; R2434-E3027 IonicContact NH2-OE1 2.79Å; R2434-E3027 PolarHBondContact NH2-OE1 2.87Å; R2434-E3027 IonicContact NH2-OE2 3.47Å; R2434-E3027 PolarHBondContact NH2-OE2 2.99Å; R3023-E3027 HydrophobicContact CG-CG 4.42Å; R3023-E3027 IonicContact CZ-OE1 2.68Å; R3023-E3027 IonicContact NE-OE1 2.77Å; R3023-E3027 PolarHBondContact NE-OE1 3.26Å; R3023-E3027 IonicContact NH2-OE1 3.14Å; R3023-E3027 PolarHBondContact NH2-OE1 2.77Å; R3023-E3027 VanDerWaalsContact NH2-OE1 3.07Å; R3023-E3027 PolarHBondContact O-N 3.28Å; A3024-E3027 PolarHBondContact O-N 3.02Å; E3027-A3029 VanDerWaalsContact C-N 3.33Å; E3027-A3029 PolarHBondContact O-N 3.1Å; E3027-L3030 PolarHBondContact O-N 3.15Å; E3027-L3031 HydrophobicContact CG-CD1 4.12Å; E3027-L3031 WeakPolarHBondContact O-CB 3.38Å; E3027-L3031 WeakPolarHBondContact O-CG 3.41Å; E3027-L3031 PolarHBondContact O-N 3.17Å
3028	R	91.4	Very high	90.4	Very high	116 Å²	116	89.7 Å²	89.7	44%	0.438	43%	0.428	S	S	.	.	H	α-helix	trans	-58.6	-46.2	173.7	-177	-177.3	159.2	175.8	-9.4	111.8	I2430 A3024 R3025 F3026 L3030 L3031 E3032	I2430-R3028 HydrophobicContact CG1-CB 3.94Å; A3024-R3028 WeakPolarHBondContact O-CB 3.46Å; A3024-R3028 PolarHBondContact O-N 3.09Å; R3025-R3028 PolarHBondContact O-N 2.9Å; F3026-R3028 PolarHBondContact O-N 2.84Å; R3028-L3030 VanDerWaalsContact C-N 3.29Å; R3028-L3030 PolarHBondContact O-N 2.81Å; R3028-L3031 PolarHBondContact O-N 2.97Å; R3028-E3032 IonicContact CZ-OE1 2.77Å; R3028-E3032 IonicContact NE-OE1 3.08Å; R3028-E3032 PolarHBondContact NE-OE1 3.03Å; R3028-E3032 IonicContact NH2-OE1 2.83Å; R3028-E3032 PolarHBondContact NH2-OE1 3.14Å; R3028-E3032 WeakPolarHBondContact O-CG 3.22Å; R3028-E3032 PolarHBondContact O-N 3.09Å
3029	A	90.9	Very high	90.8	Very high	53 Å²	53	92.5 Å²	92.5	44%	0.438	43%	0.434	S	S	.	.	H	α-helix	trans	-61.2	-41.6	179.8	0	0	0	0	0	112.3	R3025 F3026 E3027 E3032 Q3033	R3025-A3029 WeakPolarHBondContact O-CB 3.45Å; R3025-A3029 PolarHBondContact O-N 3.08Å; F3026-A3029 PolarHBondContact O-N 2.91Å; E3027-A3029 VanDerWaalsContact C-N 3.33Å; E3027-A3029 PolarHBondContact O-N 3.1Å; A3029-E3032 PolarHBondContact O-N 3.07Å; A3029-Q3033 WeakPolarHBondContact O-CB 3.36Å; A3029-Q3033 PolarHBondContact O-N 3.11Å
3030	L	90.9	Very high	90.9	Very high	114.333 Å²	114.333	93 Å²	93	60%	0.599	44%	0.44	S	S	*	.	H	α-helix	trans	-65.4	-40.6	175.8	-173.1	126.8	0	0	0	112	F3026 E3027 R3028 Q3033 R3034	F3026-L3030 WeakPolarHBondContact O-CB 3.44Å; F3026-L3030 PolarHBondContact O-N 3.11Å; F3026-L3030 VanDerWaalsContact O-N 3.09Å; E3027-L3030 PolarHBondContact O-N 3.15Å; R3028-L3030 VanDerWaalsContact C-N 3.29Å; R3028-L3030 PolarHBondContact O-N 2.81Å; L3030-Q3033 WeakPolarHBondContact O-CB 3.44Å; L3030-Q3033 PolarHBondContact O-N 3.08Å; L3030-R3034 PolarHBondContact O-N 2.84Å
3031	L	92	Very high	90.9	Very high	49.3333 Å²	49.3333	94.9 Å²	94.9	26%	0.258	44%	0.441	S	S	.	.	H	α-helix	trans	-64.5	-43.1	174.7	-73.2	168.1	0	0	0	112	I2430 V2433 R2434 E3027 R3028 Q3033 R3034 V3035	I2430-L3031 HydrophobicContact CG2-CD1 3.84Å; V2433-L3031 HydrophobicContact CG1-CB 3.75Å; R2434-L3031 HydrophobicContact CG-CD1 3.85Å; R2434-L3031 HydrophobicContact CG-CD2 4.16Å; E3027-L3031 HydrophobicContact CG-CD1 4.12Å; E3027-L3031 WeakPolarHBondContact O-CB 3.38Å; E3027-L3031 WeakPolarHBondContact O-CG 3.41Å; E3027-L3031 PolarHBondContact O-N 3.17Å; R3028-L3031 PolarHBondContact O-N 2.97Å; L3031-Q3033 VanDerWaalsContact C-N 3.31Å; L3031-Q3033 PolarHBondContact O-N 3.23Å; L3031-R3034 WeakPolarHBondContact O-CB 3.47Å; L3031-R3034 PolarHBondContact O-N 3.25Å; L3031-R3034 VanDerWaalsContact O-N 3.14Å; L3031-V3035 WeakPolarHBondContact O-CG2 3.31Å; L3031-V3035 PolarHBondContact O-N 3.04Å
3032	E	92.4	Very high	91.1	Very high	51.6667 Å²	51.6667	97.6 Å²	97.6	24%	0.241	45%	0.449	C	S	.	.	H	α-helix	trans	-63.7	-36	174.4	-69.3	-177.2	-162.8	0	0	112.3	V2433 R3028 A3029 R3034 V3035 R3036	V2433-E3032 HydrophobicContact CG1-CG 4.14Å; V2433-E3032 HydrophobicContact CG2-CG 4.32Å; R3028-E3032 IonicContact CZ-OE1 2.77Å; R3028-E3032 IonicContact NE-OE1 3.08Å; R3028-E3032 PolarHBondContact NE-OE1 3.03Å; R3028-E3032 IonicContact NH2-OE1 2.83Å; R3028-E3032 PolarHBondContact NH2-OE1 3.14Å; R3028-E3032 WeakPolarHBondContact O-CG 3.22Å; R3028-E3032 PolarHBondContact O-N 3.09Å; A3029-E3032 PolarHBondContact O-N 3.07Å; E3032-R3034 VanDerWaalsContact C-N 3.34Å; E3032-V3035 PolarHBondContact O-N 2.93Å; E3032-R3036 VanDerWaalsContact CB-NH1 3.28Å; E3032-R3036 WeakPolarHBondContact O-CB 3.19Å; E3032-R3036 VanDerWaalsContact O-CG 3.31Å; E3032-R3036 WeakPolarHBondContact O-CG 3.42Å; E3032-R3036 PolarHBondContact O-N 3.08Å; E3032-R3036 IonicContact OE2-CZ 2.83Å; E3032-R3036 IonicContact OE2-NH1 3.24Å; E3032-R3036 PolarHBondContact OE2-NH1 3.38Å; E3032-R3036 IonicContact OE2-NH2 2.93Å; E3032-R3036 PolarHBondContact OE2-NH2 2.94Å
3033	Q	92.3	Very high	91.2	Very high	135 Å²	135	94.2 Å²	94.2	63%	0.631	45%	0.446	S	S	*	.	H	α-helix	trans	-63.6	-40.7	173.1	-172.4	178.5	-1.1	0	0	111.5	A3029 L3030 L3031 R3036 S3037	A3029-Q3033 WeakPolarHBondContact O-CB 3.36Å; A3029-Q3033 PolarHBondContact O-N 3.11Å; L3030-Q3033 WeakPolarHBondContact O-CB 3.44Å; L3030-Q3033 PolarHBondContact O-N 3.08Å; L3031-Q3033 VanDerWaalsContact C-N 3.31Å; L3031-Q3033 PolarHBondContact O-N 3.23Å; Q3033-R3036 PolarHBondContact O-N 3.07Å; Q3033-S3037 WeakPolarHBondContact O-CB 3.45Å; Q3033-S3037 PolarHBondContact O-N 3.18Å
3034	R	92.2	Very high	90.9	Very high	140 Å²	140	89 Å²	89	53%	0.528	44%	0.436	S	S	.	.	H	α-helix	trans	-61.9	-44.9	172.5	-173.6	176.6	180	165.6	-4.5	111.5	E2441 L3030 L3031 E3032 R3036 S3037 L3038	E2441-R3034 VanDerWaalsContact CD-NH2 3.31Å; E2441-R3034 IonicContact OE1-CZ 3.6Å; E2441-R3034 IonicContact OE1-NE 2.72Å; E2441-R3034 PolarHBondContact OE1-NE 3.46Å; E2441-R3034 IonicContact OE1-NH2 2.7Å; E2441-R3034 PolarHBondContact OE1-NH2 2.82Å; E2441-R3034 IonicContact OE2-NH2 3.49Å; E2441-R3034 PolarHBondContact OE2-NH2 3.32Å; E2441-R3034 VanDerWaalsContact OE2-NH2 3.12Å; L3030-R3034 PolarHBondContact O-N 2.84Å; L3031-R3034 WeakPolarHBondContact O-CB 3.47Å; L3031-R3034 PolarHBondContact O-N 3.25Å; L3031-R3034 VanDerWaalsContact O-N 3.14Å; E3032-R3034 VanDerWaalsContact C-N 3.34Å; R3034-R3036 PolarHBondContact O-N 2.97Å; R3034-S3037 WeakPolarHBondContact O-CB 3.08Å; R3034-S3037 PolarHBondContact O-N 2.99Å; R3034-L3038 HydrophobicContact CG-CD1 4.09Å; R3034-L3038 HydrophobicContact CG-CG 4.37Å; R3034-L3038 WeakPolarHBondContact O-CB 3Å; R3034-L3038 VanDerWaalsContact O-CG 3.31Å; R3034-L3038 WeakPolarHBondContact O-CG 3.45Å; R3034-L3038 PolarHBondContact O-N 3.28Å
3035	V	94	Very high	90.9	Very high	35.6667 Å²	35.6667	92.1 Å²	92.1	22%	0.216	44%	0.443	C	S	.	.	H	α-helix	trans	-60.6	-43.9	175.6	168.3	0	0	0	0	111.9	V2433 E2436 A2437 L2440 L3031 E3032 S3037 L3038 K3039	V2433-V3035 HydrophobicContact CG1-CG2 3.88Å; E2436-V3035 HydrophobicContact CG-CG1 4.13Å; E2436-V3035 HydrophobicContact CG-CG2 4.37Å; A2437-V3035 HydrophobicContact CB-CG2 3.93Å; L2440-V3035 HydrophobicContact CD1-CG1 3.9Å; L3031-V3035 WeakPolarHBondContact O-CG2 3.31Å; L3031-V3035 PolarHBondContact O-N 3.04Å; E3032-V3035 PolarHBondContact O-N 2.93Å; V3035-S3037 VanDerWaalsContact C-N 3.33Å; V3035-S3037 PolarHBondContact O-N 3.1Å; V3035-L3038 PolarHBondContact O-N 3.01Å; V3035-K3039 HydrophobicContact CG1-CD 4.14Å; V3035-K3039 WeakPolarHBondContact O-CB 3.13Å; V3035-K3039 WeakPolarHBondContact O-CG 3.41Å; V3035-K3039 PolarHBondContact O-N 3.11Å
3036	R	91.5	Very high	90.9	Very high	153.667 Å²	153.667	90.7 Å²	90.7	58%	0.58	44%	0.442	S	S	*	.	H	α-helix	trans	-59.9	-42.7	175	-71	171.2	-172.8	109.2	10.1	111.6	E3032 Q3033 R3034 K3039 S3040	E3032-R3036 VanDerWaalsContact CB-NH1 3.28Å; E3032-R3036 WeakPolarHBondContact O-CB 3.19Å; E3032-R3036 VanDerWaalsContact O-CG 3.31Å; E3032-R3036 WeakPolarHBondContact O-CG 3.42Å; E3032-R3036 PolarHBondContact O-N 3.08Å; E3032-R3036 IonicContact OE2-CZ 2.83Å; E3032-R3036 IonicContact OE2-NH1 3.24Å; E3032-R3036 PolarHBondContact OE2-NH1 3.38Å; E3032-R3036 IonicContact OE2-NH2 2.93Å; E3032-R3036 PolarHBondContact OE2-NH2 2.94Å; Q3033-R3036 PolarHBondContact O-N 3.07Å; R3034-R3036 PolarHBondContact O-N 2.97Å; R3036-K3039 PolarHBondContact O-N 3.05Å; R3036-S3040 PolarHBondContact O-N 3.05Å
3037	S	90.5	Very high	90.8	Very high	63.3333 Å²	63.3333	91 Å²	91	44%	0.443	44%	0.438	S	S	.	.	H	α-helix	trans	-63.1	-46.2	174.8	-177.1	0	0	0	0	112.5	Q3033 R3034 V3035 K3039 S3040 Q3041	Q3033-S3037 WeakPolarHBondContact O-CB 3.45Å; Q3033-S3037 PolarHBondContact O-N 3.18Å; R3034-S3037 WeakPolarHBondContact O-CB 3.08Å; R3034-S3037 PolarHBondContact O-N 2.99Å; V3035-S3037 VanDerWaalsContact C-N 3.33Å; V3035-S3037 PolarHBondContact O-N 3.1Å; S3037-K3039 PolarHBondContact O-N 3.19Å; S3037-S3040 WeakPolarHBondContact O-CB 3.38Å; S3037-S3040 PolarHBondContact O-N 3.07Å; S3037-Q3041 WeakPolarHBondContact O-CG 3.43Å; S3037-Q3041 PolarHBondContact O-N 3.18Å
3038	L	92.9	Very high	90.5	Very high	40 Å²	40	91.4 Å²	91.4	21%	0.209	44%	0.443	C	S	.	.	H	α-helix	trans	-61.8	-43.7	177.5	-73.1	166.2	0	0	0	112	A2437 L2440 E2441 I2444 R3034 V3035 S3040 Q3041 F3042	A2437-L3038 HydrophobicContact CB-CD1 4.1Å; L2440-L3038 HydrophobicContact CB-CB 4Å; L2440-L3038 HydrophobicContact CB-CD1 4.24Å; L2440-L3038 HydrophobicContact CD1-CB 4.09Å; E2441-L3038 HydrophobicContact CG-CD1 3.84Å; E2441-L3038 HydrophobicContact CG-CD2 3.59Å; E2441-L3038 HydrophobicContact CG-CG 4.37Å; I2444-L3038 HydrophobicContact CD1-CB 4.01Å; I2444-L3038 HydrophobicContact CD1-CD2 3.61Å; I2444-L3038 HydrophobicContact CD1-CG 4.43Å; I2444-L3038 WeakPolarHBondContact CD1-O 3.44Å; R3034-L3038 HydrophobicContact CG-CD1 4.09Å; R3034-L3038 HydrophobicContact CG-CG 4.37Å; R3034-L3038 WeakPolarHBondContact O-CB 3Å; R3034-L3038 VanDerWaalsContact O-CG 3.31Å; R3034-L3038 WeakPolarHBondContact O-CG 3.45Å; R3034-L3038 PolarHBondContact O-N 3.28Å; V3035-L3038 PolarHBondContact O-N 3.01Å; L3038-S3040 VanDerWaalsContact C-N 3.31Å; L3038-S3040 PolarHBondContact O-N 3.14Å; L3038-Q3041 PolarHBondContact O-N 3.29Å; L3038-F3042 WeakPolarHBondContact O-CB 3.11Å; L3038-F3042 PolarHBondContact O-N 2.97Å
3039	K	93.7	Very high	90.2	Very high	113.333 Å²	113.333	88.3 Å²	88.3	49%	0.493	43%	0.434	S	S	.	.	H	α-helix	trans	-59.2	-41.5	175.1	-101	174.1	-178.5	174.3	0	111.8	E2436 L2440 V3035 R3036 S3037 F3042 C3043	E2436-K3039 WeakPolarHBondContact OE1-CE 3.42Å; E2436-K3039 IonicContact OE1-NZ 2.79Å; E2436-K3039 PolarHBondContact OE1-NZ 3.48Å; L2440-K3039 HydrophobicContact CD1-CD 4.46Å; L2440-K3039 HydrophobicContact CD1-CG 3.71Å; L2440-K3039 HydrophobicContact CD2-CG 4Å; V3035-K3039 HydrophobicContact CG1-CD 4.14Å; V3035-K3039 WeakPolarHBondContact O-CB 3.13Å; V3035-K3039 WeakPolarHBondContact O-CG 3.41Å; V3035-K3039 PolarHBondContact O-N 3.11Å; R3036-K3039 PolarHBondContact O-N 3.05Å; S3037-K3039 PolarHBondContact O-N 3.19Å; K3039-F3042 PolarHBondContact O-N 3.21Å; K3039-C3043 PolarHBondContact O-N 2.96Å; K3039-C3043 PolarHBondContact O-SG 3.16Å; K3039-C3043 VanDerWaalsContact O-SG 3.41Å
3040	S	90.5	Very high	89.9	Confident	75 Å²	75	92.4 Å²	92.4	52%	0.524	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-43.5	173.9	-170.2	0	0	0	0	112.5	R3036 S3037 L3038 F3042 C3043 S3044	R3036-S3040 PolarHBondContact O-N 3.05Å; S3037-S3040 WeakPolarHBondContact O-CB 3.38Å; S3037-S3040 PolarHBondContact O-N 3.07Å; L3038-S3040 VanDerWaalsContact C-N 3.31Å; L3038-S3040 PolarHBondContact O-N 3.14Å; S3040-F3042 PolarHBondContact O-N 3.29Å; S3040-C3043 PolarHBondContact O-N 3.02Å; S3040-S3044 VanDerWaalsContact O-CB 3.32Å; S3040-S3044 WeakPolarHBondContact O-CB 3.26Å; S3040-S3044 PolarHBondContact O-N 3.07Å; S3040-S3044 PolarHBondContact O-OG 3.25Å
3041	Q	89.7	Confident	89.5	Confident	83 Å²	83	91.3 Å²	91.3	39%	0.388	44%	0.437	S	S	.	.	H	α-helix	trans	-64	-40.3	176.5	-72.7	-173.5	32.2	0	0	112.6	I2444 S3037 L3038 S3044 R3045	I2444-Q3041 HydrophobicContact CD1-CB 3.94Å; I2444-Q3041 HydrophobicContact CG1-CB 4.47Å; S3037-Q3041 WeakPolarHBondContact O-CG 3.43Å; S3037-Q3041 PolarHBondContact O-N 3.18Å; L3038-Q3041 PolarHBondContact O-N 3.29Å; Q3041-S3044 PolarHBondContact O-N 3.14Å; Q3041-R3045 WeakPolarHBondContact O-CB 3.28Å; Q3041-R3045 WeakPolarHBondContact O-CG 3.22Å; Q3041-R3045 PolarHBondContact O-N 2.82Å
3042	F	91.7	Very high	89	Confident	79.6667 Å²	79.6667	93.6 Å²	93.6	35%	0.349	44%	0.442	S	S	.	.	H	α-helix	trans	-62.3	-49.1	176.3	178.7	-95.7	0	0	0	111.3	Q2443 I2444 L2447 L3038 K3039 S3040 S3044 R3045 K3046	Q2443-F3042 HydrophobicContact CB-CD2 4.03Å; Q2443-F3042 HydrophobicContact CB-CE2 3.9Å; Q2443-F3042 VanDerWaalsContact OE1-CE2 3.28Å; I2444-F3042 HydrophobicContact CD1-CB 4.5Å; I2444-F3042 HydrophobicContact CG1-CB 4.29Å; L2447-F3042 HydrophobicContact CD1-CD2 3.43Å; L2447-F3042 VanDerWaalsContact CD1-CD2 3.43Å; L2447-F3042 HydrophobicContact CD1-CE2 3.58Å; L2447-F3042 HydrophobicContact CD1-CG 4.28Å; L2447-F3042 HydrophobicContact CG-CE2 4.45Å; L3038-F3042 WeakPolarHBondContact O-CB 3.11Å; L3038-F3042 PolarHBondContact O-N 2.97Å; K3039-F3042 PolarHBondContact O-N 3.21Å; S3040-F3042 PolarHBondContact O-N 3.29Å; F3042-S3044 VanDerWaalsContact C-N 3.31Å; F3042-S3044 PolarHBondContact O-N 3.1Å; F3042-R3045 PolarHBondContact O-N 3.03Å; F3042-K3046 HydrophobicContact CE1-CD 4.32Å; F3042-K3046 HydrophobicContact CZ-CD 4.46Å; F3042-K3046 WeakPolarHBondContact O-CB 3.3Å; F3042-K3046 PolarHBondContact O-N 2.86Å
3043	C	88.2	Confident	88.6	Confident	72.3333 Å²	72.3333	93.2 Å²	93.2	49%	0.489	45%	0.448	S	S	.	.	H	α-helix	trans	-59.8	-41.3	175.6	-70.1	0	0	0	0	112.4	K3039 S3040 K3046 R3047	K3039-C3043 PolarHBondContact O-N 2.96Å; K3039-C3043 PolarHBondContact O-SG 3.16Å; K3039-C3043 VanDerWaalsContact O-SG 3.41Å; S3040-C3043 PolarHBondContact O-N 3.02Å; C3043-K3046 PolarHBondContact O-N 2.78Å; C3043-R3047 WeakPolarHBondContact O-CB 3.3Å; C3043-R3047 WeakPolarHBondContact O-CG 3.29Å; C3043-R3047 PolarHBondContact O-N 3.14Å; C3043-R3047 VanDerWaalsContact O-N 3.1Å
3044	S	85.1	Confident	88.1	Confident	63.6667 Å²	63.6667	92 Å²	92	45%	0.445	44%	0.44	S	S	.	.	H	α-helix	trans	-64.3	-45.6	176.4	-63.6	0	0	0	0	112.5	S3040 Q3041 F3042 R3047 L3048	S3040-S3044 VanDerWaalsContact O-CB 3.32Å; S3040-S3044 WeakPolarHBondContact O-CB 3.26Å; S3040-S3044 PolarHBondContact O-N 3.07Å; S3040-S3044 PolarHBondContact O-OG 3.25Å; Q3041-S3044 PolarHBondContact O-N 3.14Å; F3042-S3044 VanDerWaalsContact C-N 3.31Å; F3042-S3044 PolarHBondContact O-N 3.1Å; S3044-R3047 PolarHBondContact O-N 2.99Å; S3044-L3048 WeakPolarHBondContact O-CG 3.18Å; S3044-L3048 PolarHBondContact O-N 3.25Å
3045	R	88.7	Confident	87.5	Confident	90 Å²	90	87.8 Å²	87.8	34%	0.34	43%	0.433	S	S	.	.	H	α-helix	trans	-64.7	-39.8	176.2	-73.8	-175.2	-176.9	130.8	9.5	112.3	I2444 L2447 L2451 Q3041 F3042 R3047 L3048 I3049	I2444-R3045 PolarHBondContact O-NH1 2.61Å; I2444-R3045 VanDerWaalsContact O-NH1 3.07Å; L2447-R3045 HydrophobicContact CB-CB 4.31Å; L2447-R3045 HydrophobicContact CD1-CB 4.18Å; L2451-R3045 HydrophobicContact CD1-CB 4Å; L2451-R3045 HydrophobicContact CD1-CG 3.95Å; Q3041-R3045 WeakPolarHBondContact O-CB 3.28Å; Q3041-R3045 WeakPolarHBondContact O-CG 3.22Å; Q3041-R3045 PolarHBondContact O-N 2.82Å; F3042-R3045 PolarHBondContact O-N 3.03Å; R3045-R3047 VanDerWaalsContact C-N 3.3Å; R3045-R3047 PolarHBondContact O-N 2.91Å; R3045-L3048 WeakPolarHBondContact O-CB 3.35Å; R3045-L3048 PolarHBondContact O-N 3.08Å; R3045-L3048 VanDerWaalsContact O-N 3.14Å; R3045-I3049 WeakPolarHBondContact O-CG1 3.22Å; R3045-I3049 PolarHBondContact O-N 3.12Å
3046	K	89.5	Confident	86.9	Confident	135.333 Å²	135.333	88.6 Å²	88.6	59%	0.588	44%	0.436	S	S	*	.	H	α-helix	trans	-62.7	-36.7	175.2	-169.7	171	-177.4	174.6	0	112.3	F3042 C3043 I3049 F3050	F3042-K3046 HydrophobicContact CE1-CD 4.32Å; F3042-K3046 HydrophobicContact CZ-CD 4.46Å; F3042-K3046 WeakPolarHBondContact O-CB 3.3Å; F3042-K3046 PolarHBondContact O-N 2.86Å; C3043-K3046 PolarHBondContact O-N 2.78Å; K3046-I3049 PolarHBondContact O-N 3.33Å; K3046-F3050 WeakPolarHBondContact O-CB 3.31Å; K3046-F3050 PolarHBondContact O-N 3.14Å; K3046-F3050 VanDerWaalsContact O-N 3.14Å
3047	R	87.3	Confident	86.4	Confident	166.667 Å²	166.667	83.8 Å²	83.8	63%	0.629	43%	0.428	S	S	*	.	H	α-helix	trans	-67.3	-40.4	171.8	-101.7	175.2	-149.7	176.8	0.1	112.5	C3043 S3044 R3045 F3050 N3051	C3043-R3047 WeakPolarHBondContact O-CB 3.3Å; C3043-R3047 WeakPolarHBondContact O-CG 3.29Å; C3043-R3047 PolarHBondContact O-N 3.14Å; C3043-R3047 VanDerWaalsContact O-N 3.1Å; S3044-R3047 PolarHBondContact O-N 2.99Å; R3045-R3047 VanDerWaalsContact C-N 3.3Å; R3045-R3047 PolarHBondContact O-N 2.91Å; R3047-F3050 PolarHBondContact O-N 3.14Å; R3047-N3051 WeakPolarHBondContact O-CB 3.47Å; R3047-N3051 VanDerWaalsContact O-CG 3.29Å; R3047-N3051 PolarHBondContact O-N 3.07Å; R3047-N3051 PolarHBondContact O-OD1 3.23Å
3048	L	84.3	Confident	85.8	Confident	89 Å²	89	84.2 Å²	84.2	47%	0.466	43%	0.426	S	S	.	.	H	α-helix	trans	-61.8	-47.3	174.8	-71.2	172.1	0	0	0	111.6	L2451 S3044 R3045 F3050 N3051 W3052	L2451-L3048 HydrophobicContact CD2-CB 3.96Å; S3044-L3048 WeakPolarHBondContact O-CG 3.18Å; S3044-L3048 PolarHBondContact O-N 3.25Å; R3045-L3048 WeakPolarHBondContact O-CB 3.35Å; R3045-L3048 PolarHBondContact O-N 3.08Å; R3045-L3048 VanDerWaalsContact O-N 3.14Å; L3048-F3050 VanDerWaalsContact C-N 3.3Å; L3048-F3050 PolarHBondContact O-N 3.12Å; L3048-N3051 PolarHBondContact O-N 3.27Å; L3048-N3051 VanDerWaalsContact O-N 3.11Å; L3048-W3052 WeakPolarHBondContact O-CB 3.4Å; L3048-W3052 PolarHBondContact O-N 3.03Å
3049	I	86.3	Confident	85.2	Confident	51.3333 Å²	51.3333	85.4 Å²	85.4	26%	0.263	43%	0.432	S	S	.	.	H	α-helix	trans	-58.2	-42.9	176.2	-66.5	175.7	0	0	0	111.2	L2447 E2450 L2451 Y2454 R3045 K3046 W3052 A3053	L2447-I3049 HydrophobicContact CB-CD1 4.3Å; L2447-I3049 HydrophobicContact CD2-CD1 3.61Å; E2450-I3049 HydrophobicContact CB-CD1 3.79Å; E2450-I3049 WeakPolarHBondContact OE2-CD1 3.44Å; L2451-I3049 HydrophobicContact CD1-CG1 4.44Å; L2451-I3049 HydrophobicContact CD2-CG1 3.54Å; L2451-I3049 HydrophobicContact CG-CD1 4.15Å; L2451-I3049 HydrophobicContact CG-CG1 3.64Å; Y2454-I3049 HydrophobicContact CD2-CG2 4.31Å; Y2454-I3049 HydrophobicContact CE2-CG2 3.76Å; R3045-I3049 WeakPolarHBondContact O-CG1 3.22Å; R3045-I3049 PolarHBondContact O-N 3.12Å; K3046-I3049 PolarHBondContact O-N 3.33Å; I3049-W3052 PolarHBondContact O-N 2.93Å; I3049-A3053 VanDerWaalsContact O-CB 3.29Å; I3049-A3053 WeakPolarHBondContact O-CB 3.38Å; I3049-A3053 PolarHBondContact O-N 3.09Å
3050	F	84.4	Confident	84.4	Confident	139 Å²	139	81.9 Å²	81.9	61%	0.61	42%	0.424	S	S	*	.	H	α-helix	trans	-64.6	-42	177.3	-171.4	-95.1	0	0	0	112.7	K3046 R3047 L3048 W3052 A3053 K3054	K3046-F3050 WeakPolarHBondContact O-CB 3.31Å; K3046-F3050 PolarHBondContact O-N 3.14Å; K3046-F3050 VanDerWaalsContact O-N 3.14Å; R3047-F3050 PolarHBondContact O-N 3.14Å; L3048-F3050 VanDerWaalsContact C-N 3.3Å; L3048-F3050 PolarHBondContact O-N 3.12Å; F3050-W3052 VanDerWaalsContact C-N 3.34Å; F3050-W3052 PolarHBondContact O-N 2.94Å; F3050-A3053 PolarHBondContact O-N 3.2Å; F3050-K3054 WeakPolarHBondContact O-CB 3.37Å; F3050-K3054 PolarHBondContact O-N 3.12Å
3051	N	82.3	Confident	84	Confident	91.3333 Å²	91.3333	81.2 Å²	81.2	49%	0.488	42%	0.416	S	S	.	.	H	α-helix	trans	-64.8	-39.3	175.7	-71.8	-0.6	0	0	0	112.1	R3047 L3048 K3054 S3055	R3047-N3051 WeakPolarHBondContact O-CB 3.47Å; R3047-N3051 VanDerWaalsContact O-CG 3.29Å; R3047-N3051 PolarHBondContact O-N 3.07Å; R3047-N3051 PolarHBondContact O-OD1 3.23Å; L3048-N3051 PolarHBondContact O-N 3.27Å; L3048-N3051 VanDerWaalsContact O-N 3.11Å; N3051-K3054 WeakPolarHBondContact O-CB 3.4Å; N3051-K3054 PolarHBondContact O-N 3.13Å; N3051-S3055 WeakPolarHBondContact O-CB 3.12Å; N3051-S3055 PolarHBondContact O-N 2.85Å
3052	W	81.6	Confident	83.3	Confident	97.3333 Å²	97.3333	81.8 Å²	81.8	37%	0.369	42%	0.422	S	S	.	.	H	α-helix	trans	-68.7	-44.1	177	-111.3	61.8	0	0	0	112	Y2454 Q2455 V2458 L3048 I3049 F3050 K3054 S3055 L3056	Y2454-W3052 WeakPolarHBondContact O-CZ3 3.33Å; Q2455-W3052 VanDerWaalsContact CA-CZ3 3.43Å; Q2455-W3052 HydrophobicContact CB-CH2 4.08Å; Q2455-W3052 HydrophobicContact CB-CZ3 4.2Å; Q2455-W3052 HydrophobicContact CG-CH2 4.12Å; V2458-W3052 HydrophobicContact CB-CH2 4.48Å; V2458-W3052 HydrophobicContact CB-CZ3 3.78Å; V2458-W3052 HydrophobicContact CG1-CZ3 4.42Å; V2458-W3052 HydrophobicContact CG2-CE3 3.82Å; V2458-W3052 HydrophobicContact CG2-CH2 4.49Å; V2458-W3052 HydrophobicContact CG2-CZ3 3.47Å; V2458-W3052 VanDerWaalsContact CG2-CZ3 3.47Å; L3048-W3052 WeakPolarHBondContact O-CB 3.4Å; L3048-W3052 PolarHBondContact O-N 3.03Å; I3049-W3052 PolarHBondContact O-N 2.93Å; F3050-W3052 VanDerWaalsContact C-N 3.34Å; F3050-W3052 PolarHBondContact O-N 2.94Å; W3052-K3054 VanDerWaalsContact C-N 3.29Å; W3052-K3054 PolarHBondContact O-N 3.22Å; W3052-S3055 WeakPolarHBondContact O-CA 3.37Å; W3052-S3055 WeakPolarHBondContact O-CB 3.3Å; W3052-S3055 PolarHBondContact O-N 3.07Å; W3052-L3056 HydrophobicContact CD2-CD1 4.07Å; W3052-L3056 HydrophobicContact CE3-CD1 4.25Å; W3052-L3056 HydrophobicContact CH2-CD1 4.07Å; W3052-L3056 HydrophobicContact CZ2-CD1 3.87Å; W3052-L3056 HydrophobicContact CZ3-CD1 4.25Å; W3052-L3056 WeakPolarHBondContact O-CB 3.37Å; W3052-L3056 WeakPolarHBondContact O-CG 3.12Å; W3052-L3056 PolarHBondContact O-N 3.13Å
3053	A	83	Confident	82.6	Confident	43 Å²	43	84.1 Å²	84.1	36%	0.355	43%	0.434	S	S	.	.	H	α-helix	trans	-61.1	-38.1	173	0	0	0	0	0	111.9	I3049 F3050 L3056 A3057	I3049-A3053 VanDerWaalsContact O-CB 3.29Å; I3049-A3053 WeakPolarHBondContact O-CB 3.38Å; I3049-A3053 PolarHBondContact O-N 3.09Å; F3050-A3053 PolarHBondContact O-N 3.2Å; A3053-L3056 PolarHBondContact O-N 2.79Å; A3053-A3057 WeakPolarHBondContact O-CB 3.44Å; A3053-A3057 PolarHBondContact O-N 2.89Å; A3053-A3057 VanDerWaalsContact O-N 3.09Å
3054	K	83.5	Confident	82.1	Confident	108.667 Å²	108.667	84.6 Å²	84.6	47%	0.472	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-47.5	171.1	-172.9	-170	174.7	-162.5	0	111.5	F3050 N3051 W3052 L3056 A3057 D3058	F3050-K3054 WeakPolarHBondContact O-CB 3.37Å; F3050-K3054 PolarHBondContact O-N 3.12Å; N3051-K3054 WeakPolarHBondContact O-CB 3.4Å; N3051-K3054 PolarHBondContact O-N 3.13Å; W3052-K3054 VanDerWaalsContact C-N 3.29Å; W3052-K3054 PolarHBondContact O-N 3.22Å; K3054-L3056 VanDerWaalsContact C-N 3.29Å; K3054-L3056 PolarHBondContact O-N 3.26Å; K3054-A3057 CarbonylContact O-C 3.53Å; K3054-A3057 WeakPolarHBondContact O-CA 3.37Å; K3054-A3057 WeakPolarHBondContact O-CB 3.33Å; K3054-A3057 PolarHBondContact O-N 3.06Å; K3054-A3057 VanDerWaalsContact O-N 3.11Å; K3054-D3058 VanDerWaalsContact CE-OD2 3.25Å; K3054-D3058 WeakPolarHBondContact CE-OD2 3.41Å; K3054-D3058 IonicContact NZ-OD2 2.8Å; K3054-D3058 PolarHBondContact NZ-OD2 3.04Å; K3054-D3058 VanDerWaalsContact NZ-OD2 3.12Å; K3054-D3058 WeakPolarHBondContact O-CB 3.47Å; K3054-D3058 PolarHBondContact O-N 3.13Å
3055	S	79.4	Confident	81.7	Confident	53 Å²	53	86.1 Å²	86.1	37%	0.371	43%	0.429	S	S	.	.	H	α-helix	trans	-60.7	-37.3	178.5	-167.8	0	0	0	0	112.5	N3051 W3052 D3058 I3059	N3051-S3055 WeakPolarHBondContact O-CB 3.12Å; N3051-S3055 PolarHBondContact O-N 2.85Å; W3052-S3055 WeakPolarHBondContact O-CA 3.37Å; W3052-S3055 WeakPolarHBondContact O-CB 3.3Å; W3052-S3055 PolarHBondContact O-N 3.07Å; S3055-D3058 PolarHBondContact O-N 3.15Å; S3055-I3059 WeakPolarHBondContact O-CB 3.26Å; S3055-I3059 WeakPolarHBondContact O-CD1 3.43Å; S3055-I3059 VanDerWaalsContact O-CG1 3.23Å; S3055-I3059 WeakPolarHBondContact O-CG1 3.34Å; S3055-I3059 PolarHBondContact O-N 3.2Å
3056	L	80.5	Confident	80.9	Confident	52.6667 Å²	52.6667	83.3 Å²	83.3	28%	0.276	43%	0.428	S	S	.	.	H	α-helix	trans	-68	-37.9	174	-74.2	169.6	0	0	0	112	Y2454 I2457 V2458 W3052 A3053 K3054 I3059 A3060	Y2454-L3056 HydrophobicContact CD1-CD1 3.66Å; Y2454-L3056 HydrophobicContact CE1-CD1 4.18Å; I2457-L3056 HydrophobicContact CG2-CD1 4.44Å; I2457-L3056 HydrophobicContact CG2-CD2 4.09Å; V2458-L3056 HydrophobicContact CG2-CD2 3.87Å; V2458-L3056 HydrophobicContact CG2-CG 4.36Å; W3052-L3056 HydrophobicContact CD2-CD1 4.07Å; W3052-L3056 HydrophobicContact CE3-CD1 4.25Å; W3052-L3056 HydrophobicContact CH2-CD1 4.07Å; W3052-L3056 HydrophobicContact CZ2-CD1 3.87Å; W3052-L3056 HydrophobicContact CZ3-CD1 4.25Å; W3052-L3056 WeakPolarHBondContact O-CB 3.37Å; W3052-L3056 WeakPolarHBondContact O-CG 3.12Å; W3052-L3056 PolarHBondContact O-N 3.13Å; A3053-L3056 PolarHBondContact O-N 2.79Å; K3054-L3056 VanDerWaalsContact C-N 3.29Å; K3054-L3056 PolarHBondContact O-N 3.26Å; L3056-I3059 PolarHBondContact O-N 3.03Å; L3056-A3060 WeakPolarHBondContact O-CB 3.45Å; L3056-A3060 PolarHBondContact O-N 3.09Å
3057	A	80.8	Confident	80	Confident	51.3333 Å²	51.3333	79 Å²	79	42%	0.424	42%	0.418	S	S	.	.	H	α-helix	trans	-66.5	-40.6	172.8	0	0	0	0	0	112.1	A3053 K3054 I3059 A3060 V3061	A3053-A3057 WeakPolarHBondContact O-CB 3.44Å; A3053-A3057 PolarHBondContact O-N 2.89Å; A3053-A3057 VanDerWaalsContact O-N 3.09Å; K3054-A3057 CarbonylContact O-C 3.53Å; K3054-A3057 WeakPolarHBondContact O-CA 3.37Å; K3054-A3057 WeakPolarHBondContact O-CB 3.33Å; K3054-A3057 PolarHBondContact O-N 3.06Å; K3054-A3057 VanDerWaalsContact O-N 3.11Å; A3057-I3059 VanDerWaalsContact C-N 3.33Å; A3057-I3059 PolarHBondContact O-N 3.06Å; A3057-A3060 CarbonylContact O-C 3.59Å; A3057-A3060 PolarHBondContact O-N 3.18Å; A3057-V3061 WeakPolarHBondContact O-CB 3.44Å; A3057-V3061 VanDerWaalsContact O-CG2 3.28Å; A3057-V3061 WeakPolarHBondContact O-CG2 3.38Å; A3057-V3061 PolarHBondContact O-N 2.94Å
3058	D	79.2	Confident	79	Confident	73 Å²	73	74.5 Å²	74.5	39%	0.39	40%	0.404	S	S	.	.	H	α-helix	trans	-66.7	-37.5	177	-71.5	-32.9	0	0	0	111.4	K3054 S3055 V3061 N3062	K3054-D3058 VanDerWaalsContact CE-OD2 3.25Å; K3054-D3058 WeakPolarHBondContact CE-OD2 3.41Å; K3054-D3058 IonicContact NZ-OD2 2.8Å; K3054-D3058 PolarHBondContact NZ-OD2 3.04Å; K3054-D3058 VanDerWaalsContact NZ-OD2 3.12Å; K3054-D3058 WeakPolarHBondContact O-CB 3.47Å; K3054-D3058 PolarHBondContact O-N 3.13Å; S3055-D3058 PolarHBondContact O-N 3.15Å; D3058-V3061 PolarHBondContact O-N 2.79Å; D3058-N3062 WeakPolarHBondContact O-CB 3.42Å; D3058-N3062 VanDerWaalsContact O-CG 3.24Å; D3058-N3062 PolarHBondContact O-N 3.3Å; D3058-N3062 PolarHBondContact O-ND2 3.16Å; D3058-N3062 VanDerWaalsContact O-ND2 3.13Å
3059	I	79.1	Confident	78	Confident	64.6667 Å²	64.6667	77 Å²	77	33%	0.332	41%	0.413	S	S	.	.	H	α-helix	trans	-62	-54.4	170.2	-71	163	0	0	0	110.4	S3055 L3056 A3057 V3061 N3062 E3063	S3055-I3059 WeakPolarHBondContact O-CB 3.26Å; S3055-I3059 WeakPolarHBondContact O-CD1 3.43Å; S3055-I3059 VanDerWaalsContact O-CG1 3.23Å; S3055-I3059 WeakPolarHBondContact O-CG1 3.34Å; S3055-I3059 PolarHBondContact O-N 3.2Å; L3056-I3059 PolarHBondContact O-N 3.03Å; A3057-I3059 VanDerWaalsContact C-N 3.33Å; A3057-I3059 PolarHBondContact O-N 3.06Å; I3059-V3061 VanDerWaalsContact C-N 3.28Å; I3059-V3061 PolarHBondContact O-N 3.11Å; I3059-V3061 VanDerWaalsContact O-N 3.14Å; I3059-N3062 CarbonylContact O-C 3.55Å; I3059-N3062 WeakPolarHBondContact O-CA 3.39Å; I3059-N3062 WeakPolarHBondContact O-CB 3.43Å; I3059-N3062 PolarHBondContact O-N 2.97Å; I3059-E3063 HydrophobicContact CG2-CG 4.4Å; I3059-E3063 WeakPolarHBondContact O-CB 3.44Å; I3059-E3063 PolarHBondContact O-N 3.3Å
3060	A	77.6	Confident	76.8	Confident	40 Å²	40	78.4 Å²	78.4	33%	0.331	42%	0.421	S	S	.	.	H	α-helix	trans	-60	-33.9	-179.7	0	0	0	0	0	112.7	L3056 A3057 N3062 E3063 I3064	L3056-A3060 WeakPolarHBondContact O-CB 3.45Å; L3056-A3060 PolarHBondContact O-N 3.09Å; A3057-A3060 CarbonylContact O-C 3.59Å; A3057-A3060 PolarHBondContact O-N 3.18Å; A3060-N3062 VanDerWaalsContact C-N 3.3Å; A3060-N3062 PolarHBondContact O-N 3.13Å; A3060-E3063 CarbonylContact O-C 3.6Å; A3060-E3063 PolarHBondContact O-N 2.99Å; A3060-I3064 WeakPolarHBondContact O-CB 3.21Å; A3060-I3064 WeakPolarHBondContact O-CD1 3.26Å; A3060-I3064 VanDerWaalsContact O-CG1 3.28Å; A3060-I3064 WeakPolarHBondContact O-CG1 3.34Å; A3060-I3064 PolarHBondContact O-N 2.95Å
3061	V	80.9	Confident	75.7	Confident	60 Å²	60	73.9 Å²	73.9	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-69.5	-32.3	173.7	163	0	0	0	0	112.1	A3057 D3058 I3059 I3064 K3065	A3057-V3061 WeakPolarHBondContact O-CB 3.44Å; A3057-V3061 VanDerWaalsContact O-CG2 3.28Å; A3057-V3061 WeakPolarHBondContact O-CG2 3.38Å; A3057-V3061 PolarHBondContact O-N 2.94Å; D3058-V3061 PolarHBondContact O-N 2.79Å; I3059-V3061 VanDerWaalsContact C-N 3.28Å; I3059-V3061 PolarHBondContact O-N 3.11Å; I3059-V3061 VanDerWaalsContact O-N 3.14Å; V3061-I3064 VanDerWaalsContact C-N 3.28Å; V3061-I3064 CarbonylContact O-C 3.58Å; V3061-I3064 VanDerWaalsContact O-CA 3.31Å; V3061-I3064 WeakPolarHBondContact O-CA 3.29Å; V3061-I3064 PolarHBondContact O-N 3.32Å; V3061-K3065 HydrophobicContact CG1-CD 4.13Å; V3061-K3065 VanDerWaalsContact CG1-CE 3.43Å; V3061-K3065 WeakPolarHBondContact O-CB 3.16Å; V3061-K3065 WeakPolarHBondContact O-CD 3.39Å; V3061-K3065 VanDerWaalsContact O-CG 3.27Å; V3061-K3065 WeakPolarHBondContact O-CG 3.4Å; V3061-K3065 PolarHBondContact O-N 3.15Å; V3061-K3065 VanDerWaalsContact O-N 3.15Å
3062	N	76.8	Confident	74.7	Confident	95 Å²	95	75.7 Å²	75.7	51%	0.508	41%	0.41	S	S	.	.	H	α-helix	trans	-79	-35.1	175.3	-68.5	-25.2	0	0	0	112	D3058 I3059 A3060 I3064 K3065 G3066	D3058-N3062 WeakPolarHBondContact O-CB 3.42Å; D3058-N3062 VanDerWaalsContact O-CG 3.24Å; D3058-N3062 PolarHBondContact O-N 3.3Å; D3058-N3062 PolarHBondContact O-ND2 3.16Å; D3058-N3062 VanDerWaalsContact O-ND2 3.13Å; I3059-N3062 CarbonylContact O-C 3.55Å; I3059-N3062 WeakPolarHBondContact O-CA 3.39Å; I3059-N3062 WeakPolarHBondContact O-CB 3.43Å; I3059-N3062 PolarHBondContact O-N 2.97Å; A3060-N3062 VanDerWaalsContact C-N 3.3Å; A3060-N3062 PolarHBondContact O-N 3.13Å; N3062-I3064 PolarHBondContact O-N 3.49Å; N3062-I3064 VanDerWaalsContact O-N 3.16Å; N3062-K3065 PolarHBondContact O-N 2.98Å; N3062-K3065 PolarHBondContact OD1-NZ 3.02Å; N3062-G3066 PolarHBondContact O-N 3.07Å; N3062-G3066 VanDerWaalsContact O-N 3.08Å
3063	E	76.4	Confident	73.4	Confident	128.333 Å²	128.333	73.4 Å²	73.4	60%	0.6	41%	0.412	S	S	*	.	H	α-helix	trans	-63	-26.5	164.5	-66.4	-177	156.9	0	0	112	I3059 A3060 K3065 G3066 A3067	I3059-E3063 HydrophobicContact CG2-CG 4.4Å; I3059-E3063 WeakPolarHBondContact O-CB 3.44Å; I3059-E3063 PolarHBondContact O-N 3.3Å; A3060-E3063 CarbonylContact O-C 3.6Å; A3060-E3063 PolarHBondContact O-N 2.99Å; E3063-K3065 VanDerWaalsContact C-N 3.31Å; E3063-K3065 PolarHBondContact O-N 2.88Å; E3063-G3066 PolarHBondContact O-N 2.96Å; E3063-G3066 VanDerWaalsContact O-N 3.13Å; E3063-A3067 WeakPolarHBondContact O-CB 3.46Å; E3063-A3067 PolarHBondContact O-N 3.2Å
3064	I	77.3	Confident	72.1	Confident	83 Å²	83	75.6 Å²	75.6	43%	0.426	42%	0.417	S	S	.	.	H	α-helix	trans	-83.1	-21.9	172.2	-76.2	168.2	0	0	0	111.1	A3060 V3061 N3062 Q3068	A3060-I3064 WeakPolarHBondContact O-CB 3.21Å; A3060-I3064 WeakPolarHBondContact O-CD1 3.26Å; A3060-I3064 VanDerWaalsContact O-CG1 3.28Å; A3060-I3064 WeakPolarHBondContact O-CG1 3.34Å; A3060-I3064 PolarHBondContact O-N 2.95Å; V3061-I3064 VanDerWaalsContact C-N 3.28Å; V3061-I3064 CarbonylContact O-C 3.58Å; V3061-I3064 VanDerWaalsContact O-CA 3.31Å; V3061-I3064 WeakPolarHBondContact O-CA 3.29Å; V3061-I3064 PolarHBondContact O-N 3.32Å; N3062-I3064 PolarHBondContact O-N 3.49Å; N3062-I3064 VanDerWaalsContact O-N 3.16Å; I3064-Q3068 WeakPolarHBondContact O-CB 3.28Å; I3064-Q3068 WeakPolarHBondContact O-CG 3.33Å; I3064-Q3068 PolarHBondContact O-N 3.17Å
3065	K	77	Confident	70.9	Confident	95.3333 Å²	95.3333	77.1 Å²	77.1	41%	0.414	42%	0.424	S	S	.	.	H	α-helix	trans	-87.3	-47	175.6	-73	167.4	-169.3	162.9	0	113.3	V3061 N3062 E3063 A3067 Q3068 Q3069	V3061-K3065 HydrophobicContact CG1-CD 4.13Å; V3061-K3065 VanDerWaalsContact CG1-CE 3.43Å; V3061-K3065 WeakPolarHBondContact O-CB 3.16Å; V3061-K3065 WeakPolarHBondContact O-CD 3.39Å; V3061-K3065 VanDerWaalsContact O-CG 3.27Å; V3061-K3065 WeakPolarHBondContact O-CG 3.4Å; V3061-K3065 PolarHBondContact O-N 3.15Å; V3061-K3065 VanDerWaalsContact O-N 3.15Å; N3062-K3065 PolarHBondContact O-N 2.98Å; N3062-K3065 PolarHBondContact OD1-NZ 3.02Å; E3063-K3065 VanDerWaalsContact C-N 3.31Å; E3063-K3065 PolarHBondContact O-N 2.88Å; K3065-A3067 PolarHBondContact O-N 3.42Å; K3065-Q3068 PolarHBondContact O-N 3.08Å; K3065-Q3068 VanDerWaalsContact O-N 3.12Å; K3065-Q3069 WeakPolarHBondContact O-CG 3.24Å; K3065-Q3069 PolarHBondContact O-N 3.33Å; K3065-Q3069 VanDerWaalsContact O-N 3.16Å
3066	G	71.4	Confident	69.5	Low	30.3333 Å²	30.3333	77.9 Å²	77.9	31%	0.313	43%	0.429	S	S	.	.	H	α-helix	trans	-62.3	-47.4	-177.5	0	0	0	0	0	112.1	N3062 E3063 Q3068 Q3069 I3070	N3062-G3066 PolarHBondContact O-N 3.07Å; N3062-G3066 VanDerWaalsContact O-N 3.08Å; E3063-G3066 PolarHBondContact O-N 2.96Å; E3063-G3066 VanDerWaalsContact O-N 3.13Å; G3066-Q3068 VanDerWaalsContact C-N 3.27Å; G3066-Q3068 PolarHBondContact O-N 2.93Å; G3066-Q3069 WeakPolarHBondContact O-CB 3.42Å; G3066-Q3069 PolarHBondContact O-N 3Å; G3066-Q3069 VanDerWaalsContact O-N 3.14Å; G3066-I3070 WeakPolarHBondContact O-CG1 3.48Å; G3066-I3070 PolarHBondContact O-N 3.14Å
3067	A	69.9	Low	68.1	Low	46 Å²	46	80.6 Å²	80.6	38%	0.38	44%	0.444	S	S	.	.	H	α-helix	trans	-51.7	-41.7	172	0	0	0	0	0	113.6	E3063 K3065 Q3069 I3070 S3071	E3063-A3067 WeakPolarHBondContact O-CB 3.46Å; E3063-A3067 PolarHBondContact O-N 3.2Å; K3065-A3067 PolarHBondContact O-N 3.42Å; A3067-Q3069 VanDerWaalsContact C-N 3.27Å; A3067-Q3069 PolarHBondContact O-N 3.22Å; A3067-I3070 HydrophobicContact CB-CD1 3.66Å; A3067-I3070 PolarHBondContact O-N 3.18Å; A3067-S3071 WeakPolarHBondContact O-CB 3.4Å; A3067-S3071 PolarHBondContact O-N 3.05Å; A3067-S3071 VanDerWaalsContact O-N 3.14Å; A3067-S3071 PolarHBondContact O-OG 3.21Å
3068	Q	67.2	Low	66.5	Low	72.6667 Å²	72.6667	83.5 Å²	83.5	34%	0.34	45%	0.449	S	S	.	.	H	α-helix	trans	-70.1	-25.6	178.7	-92.3	-172.4	18.9	0	0	114	I3064 K3065 G3066 I3070 S3071 K3072	I3064-Q3068 WeakPolarHBondContact O-CB 3.28Å; I3064-Q3068 WeakPolarHBondContact O-CG 3.33Å; I3064-Q3068 PolarHBondContact O-N 3.17Å; K3065-Q3068 PolarHBondContact O-N 3.08Å; K3065-Q3068 VanDerWaalsContact O-N 3.12Å; G3066-Q3068 VanDerWaalsContact C-N 3.27Å; G3066-Q3068 PolarHBondContact O-N 2.93Å; Q3068-I3070 PolarHBondContact O-N 2.82Å; Q3068-S3071 PolarHBondContact O-N 3.33Å; Q3068-S3071 PolarHBondContact O-OG 3.24Å; Q3068-K3072 VanDerWaalsContact O-CD 3.26Å; Q3068-K3072 WeakPolarHBondContact O-CD 3.13Å; Q3068-K3072 WeakPolarHBondContact O-CE 3.46Å; Q3068-K3072 WeakPolarHBondContact O-CG 3.3Å; Q3068-K3072 PolarHBondContact O-N 3.1Å
3069	Q	62.6	Low	65	Low	140 Å²	140	85.9 Å²	85.9	65%	0.654	46%	0.461	S	S	*	.	H	α-helix	trans	-72.8	-40.5	175.2	-68.9	-177.1	-4.2	0	0	111.2	K3065 G3066 A3067 S3071 K3072 A3073	K3065-Q3069 WeakPolarHBondContact O-CG 3.24Å; K3065-Q3069 PolarHBondContact O-N 3.33Å; K3065-Q3069 VanDerWaalsContact O-N 3.16Å; G3066-Q3069 WeakPolarHBondContact O-CB 3.42Å; G3066-Q3069 PolarHBondContact O-N 3Å; G3066-Q3069 VanDerWaalsContact O-N 3.14Å; A3067-Q3069 VanDerWaalsContact C-N 3.27Å; A3067-Q3069 PolarHBondContact O-N 3.22Å; Q3069-S3071 VanDerWaalsContact C-N 3.32Å; Q3069-S3071 PolarHBondContact O-N 3.09Å; Q3069-K3072 WeakPolarHBondContact O-CB 3.42Å; Q3069-K3072 PolarHBondContact O-N 2.99Å; Q3069-A3073 PolarHBondContact O-N 3.2Å; Q3069-A3073 VanDerWaalsContact O-N 3.11Å
3070	I	62.8	Low	63.5	Low	82 Å²	82	86.5 Å²	86.5	42%	0.421	47%	0.472	S	S	.	.	H	α-helix	trans	-60.2	-48.9	175.8	-63.7	148.3	0	0	0	110.7	G3066 A3067 Q3068 K3072 A3073 D3074	G3066-I3070 WeakPolarHBondContact O-CG1 3.48Å; G3066-I3070 PolarHBondContact O-N 3.14Å; A3067-I3070 HydrophobicContact CB-CD1 3.66Å; A3067-I3070 PolarHBondContact O-N 3.18Å; Q3068-I3070 PolarHBondContact O-N 2.82Å; I3070-K3072 PolarHBondContact O-N 2.91Å; I3070-A3073 WeakPolarHBondContact O-CA 3.28Å; I3070-A3073 WeakPolarHBondContact O-CB 3.4Å; I3070-A3073 PolarHBondContact O-N 3Å; I3070-A3073 VanDerWaalsContact O-N 3.08Å; I3070-D3074 WeakPolarHBondContact CG2-OD2 3.39Å; I3070-D3074 VanDerWaalsContact O-CG 3.28Å; I3070-D3074 PolarHBondContact O-N 3.09Å
3071	S	60	Low	62.1	Low	44 Å²	44	88.5 Å²	88.5	31%	0.308	48%	0.483	S	S	.	.	H	α-helix	trans	-64.4	-7.7	176.6	70	0	0	0	0	115.7	A3067 Q3068 Q3069 K3075	A3067-S3071 WeakPolarHBondContact O-CB 3.4Å; A3067-S3071 PolarHBondContact O-N 3.05Å; A3067-S3071 VanDerWaalsContact O-N 3.14Å; A3067-S3071 PolarHBondContact O-OG 3.21Å; Q3068-S3071 PolarHBondContact O-N 3.33Å; Q3068-S3071 PolarHBondContact O-OG 3.24Å; Q3069-S3071 VanDerWaalsContact C-N 3.32Å; Q3069-S3071 PolarHBondContact O-N 3.09Å; S3071-K3075 VanDerWaalsContact O-CD 3.3Å; S3071-K3075 WeakPolarHBondContact O-CD 3.38Å; S3071-K3075 WeakPolarHBondContact O-CE 3.34Å; S3071-K3075 WeakPolarHBondContact O-CG 3.3Å
3072	K	61.1	Low	60.6	Low	130.333 Å²	130.333	92.3 Å²	92.3	57%	0.567	50%	0.495	S	S	*	.	H	α-helix	trans	-97.5	-35.7	170.5	-69.4	170.8	-179.1	174	0	111.1	Q3068 Q3069 I3070 D3074 K3075 S3076	Q3068-K3072 VanDerWaalsContact O-CD 3.26Å; Q3068-K3072 WeakPolarHBondContact O-CD 3.13Å; Q3068-K3072 WeakPolarHBondContact O-CE 3.46Å; Q3068-K3072 WeakPolarHBondContact O-CG 3.3Å; Q3068-K3072 PolarHBondContact O-N 3.1Å; Q3069-K3072 WeakPolarHBondContact O-CB 3.42Å; Q3069-K3072 PolarHBondContact O-N 2.99Å; I3070-K3072 PolarHBondContact O-N 2.91Å; K3072-D3074 PolarHBondContact O-N 2.87Å; K3072-K3075 PolarHBondContact O-N 2.71Å; K3072-S3076 PolarHBondContact O-N 2.78Å; K3072-S3076 PolarHBondContact O-OG 2.89Å
3073	A	54.5	Low	59.1	Low	48.3333 Å²	48.3333	96.3 Å²	96.3	40%	0.399	51%	0.508	S	S	.	.	H	α-helix	trans	-66.9	-43.2	175.2	0	0	0	0	0	112.8	Q3069 I3070 K3075 S3076 N3077	Q3069-A3073 PolarHBondContact O-N 3.2Å; Q3069-A3073 VanDerWaalsContact O-N 3.11Å; I3070-A3073 WeakPolarHBondContact O-CA 3.28Å; I3070-A3073 WeakPolarHBondContact O-CB 3.4Å; I3070-A3073 PolarHBondContact O-N 3Å; I3070-A3073 VanDerWaalsContact O-N 3.08Å; A3073-K3075 VanDerWaalsContact C-N 3.28Å; A3073-K3075 PolarHBondContact O-N 2.93Å; A3073-S3076 WeakPolarHBondContact CA-OG 3.48Å; A3073-S3076 WeakPolarHBondContact O-CB 3.18Å; A3073-S3076 PolarHBondContact O-N 3.18Å; A3073-S3076 PolarHBondContact O-OG 3.04Å; A3073-N3077 PolarHBondContact O-N 3.37Å
3074	D	56	Low	57.2	Low	88.6667 Å²	88.6667	97.3 Å²	97.3	47%	0.474	52%	0.516	S	S	.	.	H	α-helix	trans	-58.2	-40.2	179.4	-60.9	-31.6	0	0	0	111.5	I3070 K3072 S3076 N3077 E3078	I3070-D3074 WeakPolarHBondContact CG2-OD2 3.39Å; I3070-D3074 VanDerWaalsContact O-CG 3.28Å; I3070-D3074 PolarHBondContact O-N 3.09Å; K3072-D3074 PolarHBondContact O-N 2.87Å; D3074-S3076 VanDerWaalsContact C-N 3.32Å; D3074-S3076 PolarHBondContact O-N 3.14Å; D3074-N3077 PolarHBondContact O-N 3.16Å; D3074-E3078 PolarHBondContact O-N 3.19Å
3075	K	58.2	Low	55.4	Low	141 Å²	141	101.6 Å²	101.6	61%	0.613	54%	0.535	S	S	*	.	H	α-helix	trans	-70.3	-21.4	178.8	-66.1	179.5	-177.7	175.7	0	113.8	S3071 K3072 A3073 N3079	S3071-K3075 VanDerWaalsContact O-CD 3.3Å; S3071-K3075 WeakPolarHBondContact O-CD 3.38Å; S3071-K3075 WeakPolarHBondContact O-CE 3.34Å; S3071-K3075 WeakPolarHBondContact O-CG 3.3Å; K3072-K3075 PolarHBondContact O-N 2.71Å; A3073-K3075 VanDerWaalsContact C-N 3.28Å; A3073-K3075 PolarHBondContact O-N 2.93Å; K3075-N3079 WeakPolarHBondContact O-CB 3.47Å; K3075-N3079 PolarHBondContact O-N 3.03Å; K3075-N3079 PolarHBondContact O-ND2 3.19Å
3076	S	51.3	Low	53.6	Low	69 Å²	69	105.6 Å²	105.6	48%	0.483	56%	0.555	S	S	.	*	H	α-helix	trans	-79.2	-32.4	171.1	32.6	0	0	0	0	112.7	K3072 A3073 D3074 N3079 S3080	K3072-S3076 PolarHBondContact O-N 2.78Å; K3072-S3076 PolarHBondContact O-OG 2.89Å; A3073-S3076 WeakPolarHBondContact CA-OG 3.48Å; A3073-S3076 WeakPolarHBondContact O-CB 3.18Å; A3073-S3076 PolarHBondContact O-N 3.18Å; A3073-S3076 PolarHBondContact O-OG 3.04Å; D3074-S3076 VanDerWaalsContact C-N 3.32Å; D3074-S3076 PolarHBondContact O-N 3.14Å; S3076-N3079 PolarHBondContact O-N 3.16Å; S3076-S3080 WeakPolarHBondContact O-CB 3.41Å; S3076-S3080 PolarHBondContact O-N 3.02Å; S3076-S3080 VanDerWaalsContact O-N 3.08Å; S3076-S3080 PolarHBondContact O-OG 2.9Å
3077	N	49.8	Very low	51.9	Low	109.667 Å²	109.667	109 Å²	109	59%	0.586	57%	0.574	S	S	*	*	H	α-helix	trans	-77	-36	179.8	-83.3	-12.1	0	0	0	113.1	A3073 D3074 N3079 S3080 S3081	A3073-N3077 PolarHBondContact O-N 3.37Å; D3074-N3077 PolarHBondContact O-N 3.16Å; N3077-N3079 VanDerWaalsContact C-N 3.26Å; N3077-N3079 PolarHBondContact O-N 3.05Å; N3077-N3079 VanDerWaalsContact O-N 3.11Å; N3077-S3080 PolarHBondContact O-N 2.98Å; N3077-S3080 PolarHBondContact O-OG 2.74Å; N3077-S3081 WeakPolarHBondContact O-CB 3.48Å; N3077-S3081 PolarHBondContact O-N 3.02Å; N3077-S3081 VanDerWaalsContact O-N 3.1Å; N3077-S3081 PolarHBondContact O-OG 3Å
3078	E	47	Very low	50.2	Low	112.667 Å²	112.667	112.3 Å²	112.3	53%	0.526	59%	0.594	S	S	.	*	H	α-helix	trans	-58.7	-31.9	174.5	-82.4	-156.7	89.7	0	0	113.3	D3074 S3080 K3082	D3074-E3078 PolarHBondContact O-N 3.19Å; E3078-S3080 VanDerWaalsContact C-N 3.33Å; E3078-K3082 WeakPolarHBondContact O-CB 3.41Å; E3078-K3082 VanDerWaalsContact O-CD 3.26Å; E3078-K3082 WeakPolarHBondContact O-CD 3.33Å; E3078-K3082 WeakPolarHBondContact O-CG 3.16Å; E3078-K3082 PolarHBondContact O-N 2.83Å; E3078-K3082 IonicContact OE1-NZ 3.27Å; E3078-K3082 PolarHBondContact OE1-NZ 2.97Å
3079	N	48.5	Very low	48.6	Very low	122 Å²	122	115.3 Å²	115.3	65%	0.652	62%	0.618	S	S	*	*	H	α-helix	trans	-81.8	-20.4	-178.6	-73.3	-39.2	0	0	0	113.7	K3075 S3076 N3077	K3075-N3079 WeakPolarHBondContact O-CB 3.47Å; K3075-N3079 PolarHBondContact O-N 3.03Å; K3075-N3079 PolarHBondContact O-ND2 3.19Å; S3076-N3079 PolarHBondContact O-N 3.16Å; N3077-N3079 VanDerWaalsContact C-N 3.26Å; N3077-N3079 PolarHBondContact O-N 3.05Å; N3077-N3079 VanDerWaalsContact O-N 3.11Å
3080	S	47	Very low	47.3	Very low	78.6667 Å²	78.6667	117.9 Å²	117.9	55%	0.55	63%	0.63	S	S	*	*	H	α-helix	trans	-82.1	-38.7	173.9	-34	0	0	0	0	112.1	S3076 N3077 E3078 K3082 K3083 L3084	S3076-S3080 WeakPolarHBondContact O-CB 3.41Å; S3076-S3080 PolarHBondContact O-N 3.02Å; S3076-S3080 VanDerWaalsContact O-N 3.08Å; S3076-S3080 PolarHBondContact O-OG 2.9Å; N3077-S3080 PolarHBondContact O-N 2.98Å; N3077-S3080 PolarHBondContact O-OG 2.74Å; E3078-S3080 VanDerWaalsContact C-N 3.33Å; S3080-K3082 VanDerWaalsContact C-N 3.3Å; S3080-K3082 PolarHBondContact O-N 3.2Å; S3080-K3083 PolarHBondContact O-N 3.11Å; S3080-K3083 VanDerWaalsContact O-N 3.1Å; S3080-L3084 PolarHBondContact O-N 3.27Å
3081	S	49.3	Very low	45.7	Very low	81.3333 Å²	81.3333	124.6 Å²	124.6	57%	0.569	65%	0.65	S	S	*	*	H	α-helix	trans	-67.9	-27.6	-177.2	-54	0	0	0	0	113.1	N3077 K3083 L3084 E3085	N3077-S3081 WeakPolarHBondContact O-CB 3.48Å; N3077-S3081 PolarHBondContact O-N 3.02Å; N3077-S3081 VanDerWaalsContact O-N 3.1Å; N3077-S3081 PolarHBondContact O-OG 3Å; S3081-K3083 PolarHBondContact O-N 2.95Å; S3081-K3083 VanDerWaalsContact O-N 3.08Å; S3081-L3084 PolarHBondContact O-N 2.93Å; S3081-L3084 VanDerWaalsContact O-N 3.1Å; S3081-E3085 PolarHBondContact O-N 3.33Å
3082	K	49.4	Very low	44.5	Very low	139.333 Å²	139.333	129.6 Å²	129.6	61%	0.606	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	4.9	179	-67.7	171	-170.6	166.7	0	113.9	E3078 S3080	E3078-K3082 WeakPolarHBondContact O-CB 3.41Å; E3078-K3082 VanDerWaalsContact O-CD 3.26Å; E3078-K3082 WeakPolarHBondContact O-CD 3.33Å; E3078-K3082 WeakPolarHBondContact O-CG 3.16Å; E3078-K3082 PolarHBondContact O-N 2.83Å; E3078-K3082 IonicContact OE1-NZ 3.27Å; E3078-K3082 PolarHBondContact OE1-NZ 2.97Å; S3080-K3082 VanDerWaalsContact C-N 3.3Å; S3080-K3082 PolarHBondContact O-N 3.2Å
3083	K	44	Very low	43.2	Very low	179.667 Å²	179.667	130.8 Å²	130.8	78%	0.781	68%	0.675	S	S	*	*	H	α-helix	trans	-115.9	1.8	-178.8	-154.1	177.8	-179.8	-178.2	0	113.9	S3080 S3081	S3080-K3083 PolarHBondContact O-N 3.11Å; S3080-K3083 VanDerWaalsContact O-N 3.1Å; S3081-K3083 PolarHBondContact O-N 2.95Å; S3081-K3083 VanDerWaalsContact O-N 3.08Å
3084	L	37.7	Very low	42.1	Very low	148.333 Å²	148.333	135.4 Å²	135.4	78%	0.777	69%	0.688	S	S	*	*	S	Bend	trans	-117.9	3.8	-177.6	-150.2	70.9	0	0	0	113.9	S3080 S3081 Q3086 S3087	S3080-L3084 PolarHBondContact O-N 3.27Å; S3081-L3084 PolarHBondContact O-N 2.93Å; S3081-L3084 VanDerWaalsContact O-N 3.1Å; L3084-Q3086 VanDerWaalsContact C-N 3.25Å; L3084-Q3086 PolarHBondContact O-N 2.69Å; L3084-S3087 PolarHBondContact O-OG 2.89Å
3085	E	38.4	Very low	41.2	Very low	173.667 Å²	173.667	138.6 Å²	138.6	81%	0.812	70%	0.7	S	S	*	*	S	Bend	trans	-105.4	20.5	174	-69.3	-168.2	125.2	0	0	113.1	S3081	S3081-E3085 PolarHBondContact O-N 3.33Å
3086	Q	40.3	Very low	39.7	Very low	180 Å²	180	138.3 Å²	138.3	84%	0.841	71%	0.711	S	S	*	*	S	Bend	trans	-125.2	27.5	-178.2	-86.6	-179.5	3.2	0	0	114.5	L3084	L3084-Q3086 VanDerWaalsContact C-N 3.25Å; L3084-Q3086 PolarHBondContact O-N 2.69Å
3087	S	34.6	Very low	38.7	Very low	102.667 Å²	102.667	138.5 Å²	138.5	72%	0.718	72%	0.723	S	S	*	*	S	Bend	trans	-149.7	53	-179.2	53.9	0	0	0	0	115.3	L3084	L3084-S3087 PolarHBondContact O-OG 2.89Å
3088	S	34.9	Very low	37.9	Very low	113.333 Å²	113.333	140.6 Å²	140.6	79%	0.793	73%	0.729	S	S	*	*			trans	-161.9	57.3	163	51.4	0	0	0	0	115.2
3089	T	33.9	Very low	37.4	Very low	136.667 Å²	136.667	142.7 Å²	142.7	84%	0.838	74%	0.737	S	S	*	*			trans	-130.5	99.1	168.9	29.3	0	0	0	0	112.8
3090	Q	34.1	Very low	36.5	Very low	195.333 Å²	195.333	144.2 Å²	144.2	91%	0.913	74%	0.744	S	S	*	*			trans	177.4	125	160.8	-111.6	172.7	5	0	0	114.1
3091	R	29	Very low	36.1	Very low	221.333 Å²	221.333	145.4 Å²	145.4	84%	0.835	75%	0.75	S	S	*	*			trans	-129.6	151.9	163.4	-83.2	-173	174.1	-170.8	-0.7	108.5
3092	H	34.9	Very low	35.2	Very low	149 Å²	149	147.9 Å²	147.9	69%	0.69	76%	0.756	S	S	*	*			trans	92.2	113.4	156	-64.1	-75.7	0	0	0	115.5
3093	H	33.6	Very low	34.4	Very low	156.667 Å²	156.667	148.1 Å²	148.1	73%	0.725	76%	0.759	S	S	*	*				92.4	143	110.2	-91.1	-82.2	0	0	0	119.8
3094	H	32.2	Very low	33.9	Very low	144.333 Å²	144.333	147.5 Å²	147.5	67%	0.668	76%	0.756	S	S	*	*			trans	66.2	153	161.2	-90.1	-57.6	0	0	0	117.7
3095	Q	36.3	Very low	33.6	Very low	156.333 Å²	156.333	145.4 Å²	145.4	73%	0.731	75%	0.754	S	S	*	*			trans	100.2	141.1	136.7	-88.6	168.6	11.6	0	0	116.5
3096	T	28.2	Very low	33.4	Very low	135.333 Å²	135.333	147.6 Å²	147.6	83%	0.83	76%	0.755	S	S	*	*			trans	69.3	135.4	141.9	47.7	0	0	0	0	116.7
3097	G	30.1	Very low	33.1	Very low	72.3333 Å²	72.3333	143.1 Å²	143.1	75%	0.746	74%	0.743	S	S	*	*			trans	142.8	148.2	153.3	0	0	0	0	0	114.8
3098	E	32.8	Very low	33	Very low	152.667 Å²	152.667	144.6 Å²	144.6	71%	0.713	74%	0.743	S	S	*	*			trans	90.4	135	134.4	-83.1	-133.1	118.7	0	0	118.7
3099	K	36	Very low	32.9	Very low	156.667 Å²	156.667	145.7 Å²	145.7	68%	0.681	74%	0.739	S	S	*	*			trans	67.4	103.7	138.5	-69.2	164.6	-176.4	147.9	0	122.5
3100	L	30.5	Very low	32.8	Very low	154.333 Å²	154.333	144.4 Å²	144.4	81%	0.808	73%	0.73	S	S	*	*				24.7	159.8	120.7	-69.6	164.7	0	0	0	118.6	I3102	L3100-I3102 HydrophobicContact CD2-CD1 4.04Å; L3100-I3102 HydrophobicContact CD2-CG1 3.91Å
3101	P	37.7	Very low	32.7	Very low	104.333 Å²	104.333	141.6 Å²	141.6	68%	0.677	72%	0.721	S	S	*	*			cis	-131.9	-171.6	-13.8	31.6	-9.5	0	0	0	113.6
3102	I	29.7	Very low	32.9	Very low	133.333 Å²	133.333	138.3 Å²	138.3	68%	0.684	72%	0.715	S	S	*	*				97.3	125.3	120.9	-75	166.4	0	0	0	115.9	L3100	L3100-I3102 HydrophobicContact CD2-CD1 4.04Å; L3100-I3102 HydrophobicContact CD2-CG1 3.91Å
3103	Q	33.2	Very low	32.7	Very low	144.333 Å²	144.333	137.5 Å²	137.5	67%	0.674	72%	0.716	S	S	*	*				178.4	153.7	108.3	-82.4	-171.6	21	0	0	113.1
3104	K	33.4	Very low	32.5	Very low	167 Å²	167	136.2 Å²	136.2	73%	0.726	71%	0.714	S	S	*	*				69.2	121.4	87.6	-88.9	164.6	-174.4	161.4	0	115.8
3105	S	31.4	Very low	32.5	Very low	103 Å²	103	138.2 Å²	138.2	72%	0.72	72%	0.721	S	S	*	*				95.1	163.8	83.6	39.2	0	0	0	0	115.2
3106	R	34.1	Very low	32.2	Very low	220.667 Å²	220.667	135.3 Å²	135.3	83%	0.833	72%	0.718	S	S	*	*				153	127.2	100.5	-100.2	-176.7	171.8	168.9	-3.4	110.1
3107	S	34.3	Very low	32.3	Very low	86 Å²	86	133.7 Å²	133.7	60%	0.601	71%	0.712	S	S	*	*				63.4	149.8	82.8	80.8	0	0	0	0	116.2
3108	N	32.9	Very low	32.2	Very low	133.667 Å²	133.667	135.9 Å²	135.9	72%	0.715	71%	0.711	S	S	*	*			cis	160.8	158.6	10.7	-100	-0.4	0	0	0	113
3109	I	32.9	Very low	32	Very low	137.333 Å²	137.333	133.5 Å²	133.5	70%	0.704	71%	0.711	S	S	*	*				93.2	142.3	120.1	-89.1	164.3	0	0	0	115.7
3110	V	31.6	Very low	31.8	Very low	107.667 Å²	107.667	130.8 Å²	130.8	65%	0.653	71%	0.712	S	S	*	*			cis	85.7	135.3	35.4	164.8	0	0	0	0	112.5
3111	N	33	Very low	31.8	Very low	137 Å²	137	128.2 Å²	128.2	73%	0.733	71%	0.707	S	S	*	*			trans	157.6	118.3	131.3	-75.3	-32.7	0	0	0	113.6
3112	Q	32.5	Very low	31.4	Very low	152.333 Å²	152.333	128.4 Å²	128.4	71%	0.712	71%	0.711	S	S	*	*				-148.9	157.6	75.5	-96.2	-169	56.1	0	0	112.1
3113	L	31.3	Very low	31.5	Very low	132.333 Å²	132.333	126.9 Å²	126.9	69%	0.693	71%	0.712	S	S	*	*			trans	90.6	127.3	136.4	-98	136.3	0	0	0	117.1
3114	N	29.1	Very low	31.3	Very low	128.667 Å²	128.667	125.6 Å²	125.6	69%	0.688	71%	0.714	S	S	*	*			trans	37.5	139.7	143.3	-64	-25.7	0	0	0	119.5
3115	K	31.4	Very low	31.2	Very low	187.333 Å²	187.333	124.7 Å²	124.7	81%	0.814	72%	0.717	S	S	*	*				172.7	145.3	94.7	-101.3	164.8	-176	179.7	0	113.7
3116	S	30.3	Very low	31.5	Very low	95.6667 Å²	95.6667	126.8 Å²	126.8	67%	0.669	72%	0.719	S	S	*	*				42.4	118.9	116.3	65.9	0	0	0	0	117.7
3117	S	30.1	Very low	31.6	Very low	100.333 Å²	100.333	121.2 Å²	121.2	70%	0.702	71%	0.711	S	S	*	*			cis	159.4	-175.4	29.6	54.2	0	0	0	0	113.2
3118	T	29.2	Very low	31.8	Very low	119.333 Å²	119.333	125.9 Å²	125.9	73%	0.732	72%	0.72	S	S	*	*				85.2	133.6	118.8	21.3	0	0	0	0	117.3
3119	S	28.6	Very low	32	Very low	101.333 Å²	101.333	128.3 Å²	128.3	71%	0.709	73%	0.725	S	S	*	*				161.3	178.8	111.9	58	0	0	0	0	113.4
3120	S	30.1	Very low	32.1	Very low	100 Å²	100	131.1 Å²	131.1	70%	0.699	73%	0.732	S	S	*	*				76.1	150.4	123.2	65.9	0	0	0	0	116.1
3121	S	31	Very low	32.4	Very low	101 Å²	101	133.7 Å²	133.7	71%	0.706	74%	0.74	S	S	*	*			cis	168.4	140.4	43.2	28.6	0	0	0	0	114.5
3122	S	30.2	Very low	32.5	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	74%	0.739	S	S	*	*				71.3	132.7	114.8	-88.6	0	0	0	0	119
3123	S	30.6	Very low	32.5	Very low	100.667 Å²	100.667	135.1 Å²	135.1	70%	0.704	75%	0.75	S	S	*	*			trans	100.9	155.2	139.5	68.8	0	0	0	0	116.8
3124	T	30.3	Very low	32.9	Very low	117 Å²	117	134.4 Å²	134.4	72%	0.718	75%	0.753	S	S	*	*				103.9	136.3	114.2	-53.9	0	0	0	0	117.6
3125	L	31.3	Very low	32.9	Very low	149.333 Å²	149.333	133.8 Å²	133.8	78%	0.782	76%	0.758	S	S	*	*				103.3	141.6	127	-74.7	175.9	0	0	0	117.1
3126	L	35.8	Very low	33	Very low	146.667 Å²	146.667	134.1 Å²	134.1	77%	0.768	76%	0.759	S	S	*	*				-60.4	167.6	112.5	-71.2	169.6	0	0	0	114.4
3127	P	37.4	Very low	33.1	Very low	102.667 Å²	102.667	135.2 Å²	135.2	67%	0.667	76%	0.762	S	S	*	*			trans	-142.2	167.3	149.6	38.3	-20.3	0	0	0	116.8
3128	K	37.5	Very low	33.3	Very low	184 Å²	184	139.2 Å²	139.2	80%	0.8	77%	0.767	S	S	*	*			trans	107.4	133.9	140.6	-76	152	-174.8	170.1	0	116.2
3129	K	37	Very low	33.5	Very low	184.667 Å²	184.667	139.3 Å²	139.3	80%	0.803	76%	0.763	S	S	*	*				90.1	137	75.3	-82.9	170.6	177.5	-177.5	0	112.3	I3131	K3129-I3131 HydrophobicContact CD-CD1 4.47Å; K3129-I3131 HydrophobicContact CG-CD1 4.26Å
3130	K	36.6	Very low	33.9	Very low	196 Å²	196	140.6 Å²	140.6	85%	0.852	76%	0.762	S	S	*	*				-128.7	164.3	55.3	-79.8	-175.2	175.5	-178.8	0	115.3
3131	I	37.2	Very low	34	Very low	162.667 Å²	162.667	141.2 Å²	141.2	83%	0.834	76%	0.762	S	S	*	*			trans	108.2	133.8	168.4	-58.1	157	0	0	0	113.9	K3129	K3129-I3131 HydrophobicContact CD-CD1 4.47Å; K3129-I3131 HydrophobicContact CG-CD1 4.26Å
3132	G	34.8	Very low	34.1	Very low	69 Å²	69	141.8 Å²	141.8	71%	0.711	76%	0.761	S	S	*	*			cis	146.6	158	13.4	0	0	0	0	0	118
3133	R	32.7	Very low	34.1	Very low	250 Å²	250	142.3 Å²	142.3	94%	0.943	76%	0.76	S	S	*	*			trans	-75.9	163.6	161.7	-98.1	-174.7	174.3	-171.5	-0.9	116.3
3134	P	39.5	Very low	34.2	Very low	116.333 Å²	116.333	143.3 Å²	143.3	76%	0.755	76%	0.761	S	S	*	*			trans	-126.8	-177.1	-179.4	41.9	-27	0	0	0	116.3
3135	C	29.8	Very low	34.3	Very low	116.333 Å²	116.333	143.2 Å²	143.2	79%	0.786	76%	0.761	S	S	*	*			trans	-156.7	147.6	163.1	-63.6	0	0	0	0	111.4
3136	K	32.4	Very low	34.3	Very low	193.667 Å²	193.667	141.4 Å²	141.4	84%	0.842	76%	0.756	S	S	*	*				158.6	154.4	68.9	-106.9	176.7	-179.6	-176	0	113.1
3137	T	33	Very low	34	Very low	118.667 Å²	118.667	139.7 Å²	139.7	73%	0.728	75%	0.752	S	S	*	*			trans	-73.5	155.4	150.6	44.2	0	0	0	0	114.4
3138	K	34.5	Very low	33.7	Very low	184.333 Å²	184.333	140.3 Å²	140.3	80%	0.801	75%	0.754	S	S	*	*				165.7	156.6	63.8	-97.3	-163.6	178	-170.5	0	112.8
3139	N	34	Very low	33.4	Very low	121 Å²	121	137.1 Å²	137.1	65%	0.647	75%	0.75	S	S	*	*			trans	20.5	150.4	155.7	-63.4	37.8	0	0	0	116.2
3140	D	35.7	Very low	33	Very low	129.333 Å²	129.333	133.3 Å²	133.3	69%	0.692	75%	0.747	S	S	*	*				171.9	150.8	53.2	-81.5	-29.9	0	0	0	116
3141	T	33.3	Very low	32.9	Very low	112.667 Å²	112.667	128.9 Å²	128.9	69%	0.691	74%	0.74	S	S	*	*				59	128.5	102.5	-62.4	0	0	0	0	115.3
3142	T	32.5	Very low	32.7	Very low	114.667 Å²	114.667	126.9 Å²	126.9	70%	0.703	74%	0.736	S	S	*	*				163.2	139.7	69.2	-32.6	0	0	0	0	116.3
3143	T	30.3	Very low	32.6	Very low	118 Å²	118	130 Å²	130	72%	0.724	74%	0.736	S	S	*	*			trans	32.1	144.6	143.6	28.5	0	0	0	0	123.1
3144	V	33	Very low	32.8	Very low	121.333 Å²	121.333	126.7 Å²	126.7	74%	0.735	73%	0.729	S	S	*	*				119.8	135.5	112.9	178.5	0	0	0	0	115.7
3145	T	31.4	Very low	32.5	Very low	115 Å²	115	129.4 Å²	129.4	71%	0.706	73%	0.729	S	S	*	*			trans	52.4	155.4	134.7	2.5	0	0	0	0	116.4
3146	T	31.4	Very low	32.9	Very low	111.667 Å²	111.667	129.7 Å²	129.7	69%	0.685	72%	0.722	S	S	*	*			cis	172	146.1	-5.1	18.7	0	0	0	0	111.7
3147	T	30.2	Very low	32.9	Very low	112.333 Å²	112.333	126.5 Å²	126.5	69%	0.689	72%	0.715	S	S	*	*				80.2	158.2	89	49.8	0	0	0	0	116
3148	T	30.5	Very low	33	Very low	114.667 Å²	114.667	126.5 Å²	126.5	70%	0.703	71%	0.714	S	S	*	*				87.1	131.7	113	28.6	0	0	0	0	118.8
3149	T	30.8	Very low	32.9	Very low	117 Å²	117	127.6 Å²	127.6	72%	0.718	72%	0.715	S	S	*	*				93.8	131.7	107.8	32.4	0	0	0	0	119.9
3150	S	29.9	Very low	32.8	Very low	104.333 Å²	104.333	129.7 Å²	129.7	73%	0.73	72%	0.72	S	S	*	*				53.9	154	128.5	75.9	0	0	0	0	120.6
3151	S	33.5	Very low	32.7	Very low	103.667 Å²	103.667	133.2 Å²	133.2	73%	0.725	73%	0.729	S	S	*	*				161	156.9	126	61.3	0	0	0	0	112.8
3152	T	33.4	Very low	32.6	Very low	120 Å²	120	138.3 Å²	138.3	74%	0.736	74%	0.736	S	S	*	*			trans	-157.1	169.2	176.3	54.1	0	0	0	0	112.4
3153	N	33.3	Very low	32.7	Very low	134.333 Å²	134.333	138.8 Å²	138.8	72%	0.718	74%	0.739	S	S	*	*			trans	124	150.2	168.9	-92.3	-55.1	0	0	0	116
3154	K	36.9	Very low	32.9	Very low	182 Å²	182	141.7 Å²	141.7	79%	0.791	74%	0.742	S	S	*	*				89.6	141.6	121.9	-92.8	173.2	-177.7	176.3	0	117.8
3155	K	33.7	Very low	32.8	Very low	172.333 Å²	172.333	147.2 Å²	147.2	75%	0.749	75%	0.749	S	S	*	*			trans	-177.9	151.1	138.6	-89.4	-173.7	167.5	-163	0	115.4
3156	N	36.4	Very low	32.9	Very low	122.333 Å²	122.333	150.9 Å²	150.9	65%	0.654	76%	0.755	S	S	*	*			trans	109.3	130.4	135.2	-74.7	18.7	0	0	0	115.9
3157	D	33.4	Very low	32.9	Very low	127.667 Å²	127.667	152.4 Å²	152.4	68%	0.683	76%	0.757	S	S	*	*				94.1	116.7	66.3	-73.6	-28.1	0	0	0	115
3158	V	34.7	Very low	32.9	Very low	118.333 Å²	118.333	152.6 Å²	152.6	72%	0.717	76%	0.759	S	S	*	*				98.9	131.1	105.7	171.7	0	0	0	0	115.3
3159	Y	32.3	Very low	33	Very low	207.667 Å²	207.667	152.2 Å²	152.2	81%	0.814	76%	0.758	S	S	*	*			trans	91.6	125	155.6	-86.5	-85.6	0	0	0	118.2
3160	H	31.5	Very low	32.8	Very low	164.333 Å²	164.333	152.2 Å²	152.2	76%	0.761	76%	0.758	S	S	*	*				69.5	125.1	87.2	-86.2	-42.6	0	0	0	116.1
3161	K	35.6	Very low	32.7	Very low	202.333 Å²	202.333	156.5 Å²	156.5	88%	0.88	76%	0.764	S	S	*	*			trans	-164.8	136.3	135.9	-99.7	153.1	-173.5	173.8	0	108
3162	R	29.4	Very low	32.5	Very low	220.333 Å²	220.333	156.8 Å²	156.8	83%	0.831	77%	0.766	S	S	*	*			cis	122.8	125.6	26.3	-166.2	-168.2	-178	-176.1	2.2	112.8
3163	T	35.2	Very low	32.7	Very low	124.333 Å²	124.333	156.7 Å²	156.7	76%	0.763	77%	0.768	S	S	*	*			trans	107.9	147.5	176.2	46.8	0	0	0	0	114
3164	K	33.8	Very low	32.5	Very low	180 Å²	180	155.3 Å²	155.3	78%	0.783	77%	0.768	S	S	*	*			cis	-130.1	145.7	4.8	-81.1	167.1	-174	172.7	0	112.7
3165	R	32.4	Very low	32.2	Very low	236 Å²	236	151.8 Å²	151.8	89%	0.891	77%	0.767	S	S	*	*			trans	5	151	140.2	-72.2	169	-177.6	175.9	-1.7	116.8	I3167	R3165-I3167 HydrophobicContact CB-CD1 4.05Å; R3165-I3167 HydrophobicContact CG-CD1 4.48Å
3166	K	31.8	Very low	32.1	Very low	193 Å²	193	148.9 Å²	148.9	84%	0.839	77%	0.768	S	S	*	*				-157.3	142.7	119.8	-146.8	-173.2	173.3	-172.1	0	109.6
3167	I	33.3	Very low	31.9	Very low	142.667 Å²	142.667	147.7 Å²	147.7	73%	0.732	78%	0.775	S	S	*	*			trans	126.3	127.6	134	-84.2	160.5	0	0	0	114.4	R3165	R3165-I3167 HydrophobicContact CB-CD1 4.05Å; R3165-I3167 HydrophobicContact CG-CD1 4.48Å
3168	T	29.6	Very low	31.9	Very low	116.333 Å²	116.333	146.1 Å²	146.1	71%	0.714	78%	0.78	S	S	*	*			trans	-22.4	169.4	162.6	25.8	0	0	0	0	117
3169	P	31.9	Very low	31.8	Very low	107.333 Å²	107.333	145.7 Å²	145.7	70%	0.697	78%	0.782	S	S	*	*			cis	-122.1	167	-29.9	33.5	-18	0	0	0	114.5
3170	T	27	Very low	31.9	Very low	117 Å²	117	140.9 Å²	140.9	72%	0.718	78%	0.779	S	S	*	*			trans	87.6	150.1	153.2	31.7	0	0	0	0	120.7
3171	F	27	Very low	32	Very low	194.333 Å²	194.333	138.1 Å²	138.1	85%	0.852	78%	0.778	S	S	*	*			trans	59.7	139.9	160.1	-81.7	-89.7	0	0	0	120.3
3172	S	30.9	Very low	31.9	Very low	109.667 Å²	109.667	134 Å²	134	77%	0.767	78%	0.775	S	S	*	*			trans	-58.4	164.4	164.9	-34.2	0	0	0	0	115
3173	P	37.2	Very low	32.3	Very low	118.333 Å²	118.333	126.5 Å²	126.5	77%	0.768	77%	0.766	S	S	*	*			trans	-128	164.3	170.2	35.5	-21.4	0	0	0	114
3174	S	29	Very low	32.5	Very low	104 Å²	104	127.7 Å²	127.7	73%	0.727	77%	0.768	S	S	*	*			trans	-159.9	163.2	172	56	0	0	0	0	113.8
3175	S	31	Very low	32.7	Very low	110.333 Å²	110.333	126.1 Å²	126.1	77%	0.772	77%	0.768	S	S	*	*			trans	66.8	139.6	164.1	70.6	0	0	0	0	119.2
3176	S	31.4	Very low	32.9	Very low	110.333 Å²	110.333	121.5 Å²	121.5	77%	0.772	76%	0.756	S	S	*	*			cis	161.8	158.3	17.1	52.6	0	0	0	0	115
3177	A	32.5	Very low	33.1	Very low	96.3333 Å²	96.3333	117.8 Å²	117.8	80%	0.796	75%	0.746	S	S	*	*			trans	105.2	171.8	145	0	0	0	0	0	116.1
3178	A	32.4	Very low	33.2	Very low	94.6667 Å²	94.6667	118.5 Å²	118.5	78%	0.782	74%	0.744	S	S	*	*			trans	98.6	132.9	144.9	0	0	0	0	0	118.1
3179	S	32.4	Very low	33.4	Very low	110.667 Å²	110.667	120 Å²	120	77%	0.774	75%	0.748	S	S	*	*			trans	154.8	144.5	135	49.3	0	0	0	0	113.9
3180	S	33.7	Very low	33.9	Very low	106 Å²	106	119.2 Å²	119.2	74%	0.741	74%	0.742	S	S	*	*			cis	163.5	158.6	-6.2	52.5	0	0	0	0	112.5
3181	S	35	Very low	34.2	Very low	105.667 Å²	105.667	120.5 Å²	120.5	74%	0.739	75%	0.745	S	S	*	*			cis	161.9	160.7	19.5	34.2	0	0	0	0	112.6
3182	S	33.9	Very low	34.3	Very low	116 Å²	116	118.1 Å²	118.1	81%	0.811	74%	0.74	S	S	*	*			cis	-172.9	156.8	-3.5	50.5	0	0	0	0	113
3183	G	37.3	Very low	34.4	Very low	62.6667 Å²	62.6667	120.4 Å²	120.4	65%	0.646	74%	0.742	S	S	*	*			trans	124.8	78.4	175.9	0	0	0	0	0	115.4
3184	D	38.7	Very low	34.1	Very low	150.333 Å²	150.333	121.1 Å²	121.1	80%	0.804	74%	0.739	S	S	*	*				73	135.6	76.3	-47.7	-25	0	0	0	115.3
3185	D	38.4	Very low	34.2	Very low	147.333 Å²	147.333	122.5 Å²	122.5	79%	0.788	74%	0.739	S	S	*	*			cis	176	155.3	39.4	-106.9	-24.4	0	0	0	119
3186	E	37	Very low	34.2	Very low	137.667 Å²	137.667	126 Å²	126	64%	0.643	74%	0.74	S	S	*	*			trans	34.5	132.1	150.6	-65	-123	115.4	0	0	121.9	K3188	E3186-K3188 VanDerWaalsContact CD-NZ 3.25Å; E3186-K3188 IonicContact OE1-NZ 3.29Å; E3186-K3188 PolarHBondContact OE1-NZ 2.93Å; E3186-K3188 IonicContact OE2-NZ 3.07Å; E3186-K3188 PolarHBondContact OE2-NZ 3.1Å
3187	N	34.8	Very low	34.3	Very low	116.333 Å²	116.333	129 Å²	129	62%	0.622	74%	0.742	S	S	*	*			cis	109.8	141.2	37.2	-131.4	-21.7	0	0	0	116.5
3188	K	36.8	Very low	34.2	Very low	157.333 Å²	157.333	129.2 Å²	129.2	68%	0.684	74%	0.737	S	S	*	*				173.6	110.2	121.7	-99.5	140.4	-159.7	148.7	0	117.2	E3186	E3186-K3188 VanDerWaalsContact CD-NZ 3.25Å; E3186-K3188 IonicContact OE1-NZ 3.29Å; E3186-K3188 PolarHBondContact OE1-NZ 2.93Å; E3186-K3188 IonicContact OE2-NZ 3.07Å; E3186-K3188 PolarHBondContact OE2-NZ 3.1Å
3189	N	32.6	Very low	34.1	Very low	148.667 Å²	148.667	131.5 Å²	131.5	80%	0.795	74%	0.736	S	S	*	*				29.7	178.3	124.2	-115.6	-8.3	0	0	0	117.4
3190	P	42.1	Very low	34.1	Very low	89 Å²	89	134.7 Å²	134.7	58%	0.578	74%	0.739	S	S	*	*			cis	-134.3	-176.2	-47.3	40.7	-21.4	0	0	0	115.3
3191	N	33.7	Very low	33.9	Very low	145 Å²	145	134.3 Å²	134.3	78%	0.775	74%	0.736	S	S	*	*			trans	161.1	151.2	133.2	-84.7	-36.8	0	0	0	112.7
3192	L	28.9	Very low	33.6	Very low	144.667 Å²	144.667	137.1 Å²	137.1	76%	0.757	74%	0.738	S	S	*	*			trans	-48.8	141.9	-163.3	-96.5	92	0	0	0	116.2
3193	I	34.6	Very low	33.3	Very low	157.667 Å²	157.667	138.1 Å²	138.1	81%	0.809	73%	0.733	S	S	*	*			trans	163.9	150	138	-90.5	158.9	0	0	0	113.6
3194	N	30.4	Very low	32.8	Very low	132 Å²	132	143 Å²	143	71%	0.706	74%	0.744	S	S	*	*			trans	-108.5	166.1	-140.8	-85.8	-40.8	0	0	0	116.5
3195	N	30.7	Very low	32.4	Very low	134.667 Å²	134.667	139.8 Å²	139.8	72%	0.72	74%	0.738	S	S	*	*			trans	66.4	142	142.5	-74.4	-45.6	0	0	0	121
3196	K	31.5	Very low	31.9	Very low	183 Å²	183	140 Å²	140	80%	0.796	74%	0.739	S	S	*	*			cis	161	167.3	49.7	-120.7	172	-175.3	175.9	0	112.9
3197	Q	32.6	Very low	31.4	Very low	174 Å²	174	140.6 Å²	140.6	81%	0.813	75%	0.747	S	S	*	*			trans	-154.6	155	165.6	-84.5	159.4	-27.2	0	0	113.9
3198	S	30.3	Very low	31.1	Very low	99 Å²	99	146.6 Å²	146.6	69%	0.692	76%	0.761	S	S	*	*				157.9	143.5	121.7	46.8	0	0	0	0	116.4
3199	N	30	Very low	30.7	Very low	144.333 Å²	144.333	146.5 Å²	146.5	77%	0.772	77%	0.766	S	S	*	*			trans	46.1	144	153.8	-54	-20.1	0	0	0	115.5
3200	Q	32.5	Very low	30.5	Very low	177.667 Å²	177.667	145.3 Å²	145.3	83%	0.83	77%	0.766	S	S	*	*			cis	-158	157.2	31.7	-102.6	172.3	-11.3	0	0	107.4
3201	S	29.3	Very low	29.8	Very low	97.5 Å²	97.5	152.1 Å²	152.1	68%	0.682	78%	0.781	S	S	*	*			cis	123.5	149.3	38.6	62	0	0	0	0	111.9
3202	E	29.3	Very low	29.6	Very low	164 Å²	164	154.5 Å²	154.5	77%	0.766	78%	0.784	S	S	*	*				-86.6	156	107.4	-78.7	-167.2	128.6	0	0	118.3
3203	L	28.2	Very low	29.6	Very low	136.5 Å²	136.5	153.2 Å²	153.2	72%	0.715	79%	0.787	S	S	*	*				126.4	110.1	75.5	-90.3	166.7	0	0	0	115.5
3204	L	27.5	Very low	29.5	Very low	165.5 Å²	165.5	150 Å²	150	87%	0.866	79%	0.785	S	S	*	*				149.9	140.8	126	-86.2	-176.6	0	0	0	114
3205	A	28.8	Very low	29.5	Very low	84.5 Å²	84.5	151.2 Å²	151.2	70%	0.698	79%	0.79	S	S	*	*			trans	56.1	134.2	159	0	0	0	0	0	120.1
3206	N	28.8	Very low	29.6	Very low	151 Å²	151	151.4 Å²	151.4	81%	0.807	79%	0.791	S	S	*	*			trans	138.8	102.2	148.5	-87.1	-44.1	0	0	0	117.2
3207	N	27.1	Very low	29.7	Very low	150.5 Å²	150.5	149.8 Å²	149.8	81%	0.805	79%	0.786	S	S	*	*			trans	-8.4	118.1	142.6	-77.5	-57.1	0	0	0	115.8
3208	R	27.3	Very low	29.9	Very low	242 Å²	242	148.9 Å²	148.9	91%	0.913	78%	0.782	S	S	*	*			trans	142.2	149.5	155.5	-86.9	165.9	-172.8	-158.5	1.3	116.5
3209	I	29	Very low	30	Very low	154.5 Å²	154.5	151.2 Å²	151.2	79%	0.792	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-93.3	139.1	-168.9	-59.2	154.9	0	0	0	110.9
3210	P	28.5	Very low	30.4	Very low	123.5 Å²	123.5	149 Å²	149	80%	0.802	77%	0.767	S	S	*	*			trans	-107.8	156.8	144.1	34	-28	0	0	0	112.7
3211	R	27.2	Very low	30.5	Very low	232 Å²	232	147.8 Å²	147.8	88%	0.875	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-103.6	148.2	-173.6	-70.1	171	163.8	172.2	-7.1	112.6
3212	K	30.1	Very low	30.7	Very low	196 Å²	196	149.7 Å²	149.7	85%	0.852	76%	0.761	S	S	*	*	S	Bend	trans	82.7	137.5	153.4	-66.5	-174.4	174.7	-178.7	0	118.6
3213	S	28.7	Very low	30.8	Very low	117.5 Å²	117.5	145.8 Å²	145.8	82%	0.822	75%	0.752	S	S	*	*			trans	49	102.2	150	57.1	0	0	0	0	119.9
3214	A	30.8	Very low	31.1	Very low	91 Å²	91	146.2 Å²	146.2	75%	0.752	75%	0.748	S	S	*	*	S	Bend	trans	-165.7	29.8	133.9	0	0	0	0	0	113.1	N3216	A3214-N3216 PolarHBondContact O-N 3.27Å
3215	L	32.2	Very low	31.3	Very low	155.5 Å²	155.5	146.4 Å²	146.4	81%	0.814	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-113.3	17.5	178.6	-83.3	-179.1	0	0	0	114.9	H3217	L3215-H3217 PolarHBondContact O-N 2.96Å
3216	N	32.7	Very low	31.6	Very low	140.5 Å²	140.5	147.4 Å²	147.4	75%	0.751	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-83.3	32.2	177	-75.2	-7.6	0	0	0	112.5	A3214 F3219 I3220	A3214-N3216 PolarHBondContact O-N 3.27Å; N3216-F3219 HydrophobicContact CB-CE2 4.27Å; N3216-I3220 WeakPolarHBondContact O-CD1 3.3Å
3217	H	33	Very low	31.8	Very low	149.5 Å²	149.5	147.7 Å²	147.7	69%	0.692	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-122.5	-9.8	-178.4	-147.7	-108.4	0	0	0	116.7	L3215 F3219	L3215-H3217 PolarHBondContact O-N 2.96Å; H3217-F3219 PolarHBondContact O-N 2.96Å
3218	E	36.9	Very low	32	Very low	155 Å²	155	146.5 Å²	146.5	72%	0.724	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-5.1	170	-80.3	-75.4	97.9	0	0	111.8	I3220 K3221 L3222	E3218-I3220 PolarHBondContact O-N 3.38Å; E3218-K3221 WeakPolarHBondContact O-CB 3.43Å; E3218-K3221 PolarHBondContact O-N 2.78Å; E3218-K3221 IonicContact OE1-NZ 3.1Å; E3218-K3221 PolarHBondContact OE1-NZ 3.37Å; E3218-K3221 VanDerWaalsContact OE1-NZ 3.11Å; E3218-L3222 PolarHBondContact O-N 3.18Å
3219	F	31.9	Very low	32.3	Very low	147 Å²	147	141.3 Å²	141.3	65%	0.645	72%	0.719	S	S	*	*	H	α-helix	trans	-65.6	-121.6	177.9	-103.5	-75.2	0	0	0	112	N3216 H3217 K3221 L3222 S3223	N3216-F3219 HydrophobicContact CB-CE2 4.27Å; H3217-F3219 PolarHBondContact O-N 2.96Å; F3219-K3221 VanDerWaalsContact C-N 3.32Å; F3219-K3221 PolarHBondContact O-N 3.28Å; F3219-L3222 PolarHBondContact O-N 3.06Å; F3219-S3223 WeakPolarHBondContact O-CB 3.33Å; F3219-S3223 PolarHBondContact O-N 2.98Å
3220	I	39.6	Very low	32.6	Very low	98 Å²	98	141.5 Å²	141.5	50%	0.503	72%	0.722	S	S	.	*	H	α-helix	trans	-5.1	10.8	161.2	-54.3	168.4	0	0	0	113.9	N3216 E3218 K3224	N3216-I3220 WeakPolarHBondContact O-CD1 3.3Å; E3218-I3220 PolarHBondContact O-N 3.38Å; I3220-K3224 HydrophobicContact CG2-CD 3.95Å; I3220-K3224 VanDerWaalsContact CG2-CE 3.43Å; I3220-K3224 HydrophobicContact CG2-CG 4.26Å; I3220-K3224 WeakPolarHBondContact O-CG 3.43Å; I3220-K3224 PolarHBondContact O-N 3.47Å
3221	K	33.4	Very low	32.5	Very low	152.5 Å²	152.5	146.4 Å²	146.4	66%	0.663	73%	0.725	S	S	*	*	H	α-helix	trans	-97.1	-34.8	168.1	-77.2	177.8	-176.9	167.3	0	114.4	E3218 F3219 K3224 K3225	E3218-K3221 WeakPolarHBondContact O-CB 3.43Å; E3218-K3221 PolarHBondContact O-N 2.78Å; E3218-K3221 IonicContact OE1-NZ 3.1Å; E3218-K3221 PolarHBondContact OE1-NZ 3.37Å; E3218-K3221 VanDerWaalsContact OE1-NZ 3.11Å; F3219-K3221 VanDerWaalsContact C-N 3.32Å; F3219-K3221 PolarHBondContact O-N 3.28Å; K3221-K3224 PolarHBondContact O-N 2.78Å; K3221-K3225 WeakPolarHBondContact O-CB 3.17Å; K3221-K3225 PolarHBondContact O-N 3.47Å
3222	L	33.6	Very low	32.6	Very low	137 Å²	137	142 Å²	142	72%	0.717	72%	0.718	S	S	*	*	H	α-helix	trans	-83.5	-35.1	-178.9	-78.4	158.2	0	0	0	113.7	E3218 F3219 K3224 K3225 T3226	E3218-L3222 PolarHBondContact O-N 3.18Å; F3219-L3222 PolarHBondContact O-N 3.06Å; L3222-K3224 VanDerWaalsContact C-N 3.33Å; L3222-K3224 PolarHBondContact O-N 2.88Å; L3222-K3225 PolarHBondContact O-N 2.92Å; L3222-T3226 PolarHBondContact O-N 3.37Å; L3222-T3226 VanDerWaalsContact O-N 3.15Å; L3222-T3226 PolarHBondContact O-OG1 3.05Å
3223	S	32.7	Very low	32.5	Very low	82 Å²	82	138.6 Å²	138.6	57%	0.573	71%	0.714	S	S	*	*	H	α-helix	trans	-71.1	-22.5	178.9	-174.4	0	0	0	0	113.9	F3219 K3225 T3226 Q3227	F3219-S3223 WeakPolarHBondContact O-CB 3.33Å; F3219-S3223 PolarHBondContact O-N 2.98Å; S3223-K3225 PolarHBondContact O-N 3.49Å; S3223-T3226 PolarHBondContact O-N 3.5Å; S3223-T3226 PolarHBondContact O-OG1 2.88Å; S3223-T3226 VanDerWaalsContact O-OG1 3.08Å; S3223-Q3227 PolarHBondContact O-N 3.35Å
3224	K	33.3	Very low	32.5	Very low	145 Å²	145	141.8 Å²	141.8	63%	0.63	72%	0.718	S	S	*	*	H	α-helix	trans	-87.4	-13.3	179.3	-73	-176.6	176.6	-179	0	113.7	I3220 K3221 L3222 N3228	I3220-K3224 HydrophobicContact CG2-CD 3.95Å; I3220-K3224 VanDerWaalsContact CG2-CE 3.43Å; I3220-K3224 HydrophobicContact CG2-CG 4.26Å; I3220-K3224 WeakPolarHBondContact O-CG 3.43Å; I3220-K3224 PolarHBondContact O-N 3.47Å; K3221-K3224 PolarHBondContact O-N 2.78Å; L3222-K3224 VanDerWaalsContact C-N 3.33Å; L3222-K3224 PolarHBondContact O-N 2.88Å; K3224-N3228 PolarHBondContact O-N 3.31Å
3225	K	32.7	Very low	32.4	Very low	169.5 Å²	169.5	146.8 Å²	146.8	74%	0.737	72%	0.723	S	S	*	*	H	α-helix	trans	-90.6	-13.3	-176.9	-150.4	171.2	-175.5	-179.8	0	114	K3221 L3222 S3223	K3221-K3225 WeakPolarHBondContact O-CB 3.17Å; K3221-K3225 PolarHBondContact O-N 3.47Å; L3222-K3225 PolarHBondContact O-N 2.92Å; S3223-K3225 PolarHBondContact O-N 3.49Å
3226	T	34.2	Very low	32.3	Very low	105.5 Å²	105.5	147.2 Å²	147.2	65%	0.647	73%	0.725	S	S	*	*	H	α-helix	trans	-106.1	-9.5	-179	41.9	0	0	0	0	114.6	L3222 S3223 N3230	L3222-T3226 PolarHBondContact O-N 3.37Å; L3222-T3226 VanDerWaalsContact O-N 3.15Å; L3222-T3226 PolarHBondContact O-OG1 3.05Å; S3223-T3226 PolarHBondContact O-N 3.5Å; S3223-T3226 PolarHBondContact O-OG1 2.88Å; S3223-T3226 VanDerWaalsContact O-OG1 3.08Å; T3226-N3230 PolarHBondContact O-ND2 3Å
3227	Q	33.2	Very low	32.3	Very low	157 Å²	157	145.5 Å²	145.5	73%	0.734	72%	0.724	S	S	*	*	H	α-helix	trans	-97.7	-13.7	173	-75.6	-171.4	-27	0	0	113.9	S3223	S3223-Q3227 PolarHBondContact O-N 3.35Å
3228	N	31.9	Very low	32.2	Very low	125 Å²	125	145.9 Å²	145.9	67%	0.668	73%	0.729	S	S	*	*	H	α-helix	trans	-90.2	-17.9	-176.2	-101.5	15.5	0	0	0	114.5	K3224 N3230 R3231	K3224-N3228 PolarHBondContact O-N 3.31Å; N3228-N3230 VanDerWaalsContact C-N 3.33Å; N3228-N3230 PolarHBondContact O-N 3.09Å; N3228-R3231 PolarHBondContact O-N 3.4Å
3229	N	32.9	Very low	31.9	Very low	133.5 Å²	133.5	147.6 Å²	147.6	71%	0.714	74%	0.735	S	S	*	*	H	α-helix	trans	-90.8	61.8	175.6	-73.7	9.8	0	0	0	111.4
3230	N	34.4	Very low	32.1	Very low	159 Å²	159	149.5 Å²	149.5	85%	0.85	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	177.4	16.7	178.5	-60.6	-28.7	0	0	0	115.8	T3226 N3228	T3226-N3230 PolarHBondContact O-ND2 3Å; N3228-N3230 VanDerWaalsContact C-N 3.33Å; N3228-N3230 PolarHBondContact O-N 3.09Å
3231	R	26.9	Very low	31.8	Very low	226 Å²	226	150.4 Å²	150.4	85%	0.853	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	33.6	172	-160.7	174.3	175.5	172.5	-0.3	114.4	N3228	N3228-R3231 PolarHBondContact O-N 3.4Å
3232	L	28.8	Very low	31.7	Very low	139 Å²	139	152.8 Å²	152.8	73%	0.728	77%	0.771	S	S	*	*			trans	-129.5	138.3	169.1	-69.9	169	0	0	0	108.4
3233	T	29.4	Very low	31.6	Very low	126.5 Å²	126.5	154.4 Å²	154.4	78%	0.776	77%	0.772	S	S	*	*	S	Bend		65	63.6	128.6	69.9	0	0	0	0	116.8
3234	M	28.6	Very low	31.7	Very low	183 Å²	183	155.9 Å²	155.9	90%	0.901	77%	0.774	S	S	*	*	S	Bend	trans	-156.5	102.2	135.9	-99.7	-60.6	-165.9	0	0	112.8
3235	K	27.8	Very low	31.8	Very low	196.5 Å²	196.5	153.3 Å²	153.3	85%	0.854	77%	0.773	S	S	*	*			trans	-137.6	121.1	169.8	-78.8	161.8	-178	175.5	0	111.5
3236	L	31.2	Very low	32	Very low	163.5 Å²	163.5	151.9 Å²	151.9	86%	0.856	77%	0.774	S	S	*	*			trans	-159.3	145.9	152.7	-88.4	174.3	0	0	0	108.2
3237	S	31.3	Very low	32.3	Very low	106 Å²	106	154.4 Å²	154.4	74%	0.741	78%	0.784	S	S	*	*				-145.4	149.2	-93.7	-70.7	0	0	0	0	110.8
3238	I	32.4	Very low	32.3	Very low	156.5 Å²	156.5	153.5 Å²	153.5	80%	0.803	78%	0.784	S	S	*	*			trans	-131.1	132.5	171.6	-79.1	144.8	0	0	0	108.3
3239	K	30.5	Very low	32.4	Very low	191.5 Å²	191.5	154.9 Å²	154.9	83%	0.833	79%	0.791	S	S	*	*				78.1	130.1	111.8	-79.7	176.4	177.9	-179.3	0	116.8
3240	Q	35.7	Very low	32.2	Very low	188 Å²	188	153.9 Å²	153.9	88%	0.879	79%	0.79	S	S	*	*			trans	118.6	123.4	163.1	-69.9	169.3	10.1	0	0	110
3241	S	32.8	Very low	32.1	Very low	116.5 Å²	116.5	152.6 Å²	152.6	82%	0.815	79%	0.788	S	S	*	*			cis	143.7	157	28.6	66.7	0	0	0	0	112.9
3242	K	31.3	Very low	32.2	Very low	201.5 Å²	201.5	147.4 Å²	147.4	88%	0.876	78%	0.782	S	S	*	*				-160.1	147.6	-93.7	178.3	-177.4	177.7	-173.4	0	106.5
3243	K	31.4	Very low	32.2	Very low	171 Å²	171	148 Å²	148	74%	0.743	78%	0.784	S	S	*	*			trans	116	147.5	175.5	-82.8	-171.5	140.6	-73.6	0	109.9
3244	D	35.9	Very low	32.1	Very low	114.5 Å²	114.5	147.1 Å²	147.1	61%	0.612	78%	0.778	S	S	*	*			cis	-143.9	171.5	-3.1	-94.8	-37.7	0	0	0	110.9
3245	S	33.9	Very low	32	Very low	89 Å²	89	143.2 Å²	143.2	62%	0.622	77%	0.765	S	S	*	*			trans	-14.1	163.4	157	52.8	0	0	0	0	117.2
3246	D	38.2	Very low	32.2	Very low	141.5 Å²	141.5	141.7 Å²	141.7	76%	0.757	76%	0.761	S	S	*	*			cis	-161.3	-169.4	10.8	-88.4	-53.9	0	0	0	110.6
3247	D	39.3	Very low	32.1	Very low	157.5 Å²	157.5	138.9 Å²	138.9	84%	0.842	76%	0.755	S	S	*	*			trans	81.1	112.8	159.4	-65.4	-28.3	0	0	0	120.9
3248	D	33.3	Very low	32	Very low	139 Å²	139	139.1 Å²	139.1	74%	0.743	76%	0.756	S	S	*	*			trans	-74.4	161.5	172.9	-80.3	-55.1	0	0	0	114.7
3249	N	34	Very low	31.5	Very low	153 Å²	153	137.1 Å²	137.1	82%	0.818	76%	0.755	S	S	*	*				144.8	144.7	129.5	-86.5	-70.8	0	0	0	116.9
3250	T	29.4	Very low	31.5	Very low	112 Å²	112	133.4 Å²	133.4	69%	0.687	75%	0.753	S	S	*	*				-155.6	125	-97.7	-72.2	0	0	0	0	107
3251	T	32.8	Very low	31.1	Very low	133 Å²	133	131.1 Å²	131.1	82%	0.816	75%	0.753	S	S	*	*			trans	-163.9	130.9	147.5	1.1	0	0	0	0	113.8
3252	T	28	Very low	31	Very low	115.5 Å²	115.5	129.7 Å²	129.7	71%	0.709	75%	0.748	S	S	*	*			trans	-21.4	136.5	158.5	41.6	0	0	0	0	116.5
3253	I	29.5	Very low	31	Very low	153 Å²	153	125.4 Å²	125.4	79%	0.785	74%	0.743	S	S	*	*				133.3	102.3	95.4	-77.5	160.3	0	0	0	112.3
3254	T	27.5	Very low	31.1	Very low	106.5 Å²	106.5	123.9 Å²	123.9	65%	0.653	75%	0.748	S	S	*	*			trans	97.5	135.4	132.2	42.3	0	0	0	0	112.6
3255	T	26.8	Very low	30.9	Very low	102 Å²	102	123.7 Å²	123.7	63%	0.626	76%	0.756	S	S	*	*			cis	129.6	123.3	27.1	44.6	0	0	0	0	113.7
3256	H	32.2	Very low	31.1	Very low	164 Å²	164	125.5 Å²	125.5	76%	0.759	77%	0.765	S	S	*	*			trans	148.3	143.2	158.6	-42.3	-67.9	0	0	0	111.5
3257	S	27.9	Very low	30.8	Very low	105.5 Å²	105.5	122 Å²	122	74%	0.738	76%	0.762	S	S	*	*			cis	136.9	111.2	-10.1	-69.9	0	0	0	0	111.6
3258	S	29	Very low	30.5	Very low	109.5 Å²	109.5	123.1 Å²	123.1	77%	0.766	77%	0.768	S	S	*	*			trans	123.6	127.7	155.9	37.9	0	0	0	0	113.6
3259	C	22.8	Very low	30.4	Very low	116 Å²	116	119.5 Å²	119.5	78%	0.784	76%	0.763	S	S	*	*				13.7	129.7	105.4	69.3	0	0	0	0	118.3
3260	S	30.5	Very low	30.3	Very low	112 Å²	112	119.3 Å²	119.3	78%	0.783	76%	0.762	S	S	*	*				176	147.3	124.8	-78.1	0	0	0	0	112.8
3261	T	27	Very low	30.4	Very low	141.5 Å²	141.5	120.5 Å²	120.5	87%	0.868	76%	0.764	S	S	*	*			trans	-24.1	137.3	164.1	49.8	0	0	0	0	116.5
3262	A	31.1	Very low	30.3	Very low	86.5 Å²	86.5	124.7 Å²	124.7	72%	0.715	77%	0.767	S	S	*	*				-159.8	148.3	75.2	0	0	0	0	0	109.5
3263	S	30.6	Very low	30.6	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	77%	0.771	S	S	*	*				74.7	115.4	96	68.2	0	0	0	0	116.7
3264	T	33.3	Very low	30.6	Very low	139.5 Å²	139.5	127.8 Å²	127.8	86%	0.856	78%	0.775	S	S	*	*				-146.4	123.5	82.4	-36.9	0	0	0	0	110.6
3265	S	32.2	Very low	30.8	Very low	112 Å²	112	129.5 Å²	129.5	78%	0.783	78%	0.78	S	S	*	*			trans	-103	172.1	165.1	-46.1	0	0	0	0	108.9
3266	P	38.5	Very low	31	Very low	125.5 Å²	125.5	132 Å²	132	82%	0.815	79%	0.788	S	S	*	*				-118.8	172.9	55	22.1	-4.3	0	0	0	112.7
3267	G	30.5	Very low	30.8	Very low	67.5 Å²	67.5	134.3 Å²	134.3	70%	0.696	79%	0.791	S	S	*	*			cis	115.4	130.1	11.3	0	0	0	0	0	111.5
3268	L	33.8	Very low	31.1	Very low	182 Å²	182	137.7 Å²	137.7	95%	0.953	80%	0.796	S	S	*	*				142.5	156.2	92.7	-56.8	162.3	0	0	0	112
3269	G	31.6	Very low	31.2	Very low	62.5 Å²	62.5	140.1 Å²	140.1	64%	0.644	80%	0.795	S	S	*	*				154.4	116.3	-90.6	0	0	0	0	0	110
3270	D	30.3	Very low	31.7	Very low	149 Å²	149	144 Å²	144	80%	0.797	80%	0.799	S	S	*	*			trans	-20.7	163.6	145.4	-45.3	-49.1	0	0	0	114.4
3271	D	32.4	Very low	31.8	Very low	136.5 Å²	136.5	143.5 Å²	143.5	73%	0.73	80%	0.795	S	S	*	*				139.2	147.4	85.4	-89.9	-32.7	0	0	0	114.1
3272	Y	31.2	Very low	32.1	Very low	222 Å²	222	143.3 Å²	143.3	87%	0.871	79%	0.793	S	S	*	*			trans	101.1	121.6	135.6	-81.7	-87.8	0	0	0	116.8
3273	E	33.5	Very low	32.2	Very low	173 Å²	173	143.7 Å²	143.7	81%	0.808	80%	0.797	S	S	*	*			trans	-112.1	117.5	158.5	-104.7	175.4	164.1	0	0	114.1	N3275	E3273-N3275 PolarHBondContact O-N 3.21Å; E3273-N3275 VanDerWaalsContact O-N 3.11Å
3274	N	29.9	Very low	32.4	Very low	161.5 Å²	161.5	144.5 Å²	144.5	86%	0.864	80%	0.8	S	S	*	*			trans	-67	99	160.5	-94.1	-42.8	0	0	0	109.5
3275	N	31.3	Very low	32.4	Very low	140.5 Å²	140.5	144.2 Å²	144.2	75%	0.751	80%	0.798	S	S	*	*			trans	-151.5	120.6	163.4	-112.6	-43.3	0	0	0	113.2	E3273	E3273-N3275 PolarHBondContact O-N 3.21Å; E3273-N3275 VanDerWaalsContact O-N 3.11Å
3276	I	31.6	Very low	32.5	Very low	155.5 Å²	155.5	147.7 Å²	147.7	80%	0.797	80%	0.799	S	S	*	*			trans	-107	107	175.7	-59.3	177.7	0	0	0	110.1	Q3278	I3276-Q3278 PolarHBondContact O-N 3.45Å
3277	Y	28.7	Very low	32.4	Very low	211.5 Å²	211.5	148.1 Å²	148.1	83%	0.829	80%	0.799	S	S	*	*			trans	-94.5	134.9	159.5	-101.2	-98.8	0	0	0	110.4
3278	Q	33.1	Very low	32.5	Very low	178 Å²	178	152 Å²	152	83%	0.832	80%	0.804	S	S	*	*			trans	126.7	142.2	153.8	-82.4	-179.6	75.3	0	0	113.6	I3276	I3276-Q3278 PolarHBondContact O-N 3.45Å
3279	Q	32.1	Very low	32.6	Very low	160.5 Å²	160.5	154.8 Å²	154.8	75%	0.75	80%	0.802	S	S	*	*				-146.1	153.4	124.7	-81.9	170.7	17.8	0	0	112.2
3280	K	32.6	Very low	32.7	Very low	198 Å²	198	156.6 Å²	156.6	86%	0.861	81%	0.805	S	S	*	*			trans	145.8	113.6	144.4	-101.6	167.8	-175.9	171.1	0	116
3281	S	32.5	Very low	33	Very low	100 Å²	100	155.4 Å²	155.4	70%	0.699	80%	0.802	S	S	*	*			trans	-0.9	130	158.4	59.2	0	0	0	0	118.8
3282	T	33.7	Very low	33	Very low	137 Å²	137	154.1 Å²	154.1	84%	0.84	80%	0.8	S	S	*	*			trans	149.5	125.3	135.7	49.8	0	0	0	0	116.1
3283	A	32.3	Very low	33.2	Very low	96.5 Å²	96.5	149 Å²	149	80%	0.798	79%	0.792	S	S	*	*			trans	2.1	161.5	159.9	0	0	0	0	0	118.4
3284	P	34.7	Very low	33.3	Very low	126.5 Å²	126.5	149.5 Å²	149.5	82%	0.821	79%	0.791	S	S	*	*			trans	-135.2	159.4	160.2	39.3	-25.7	0	0	0	116.6
3285	T	34.3	Very low	33.4	Very low	132 Å²	132	147.7 Å²	147.7	81%	0.81	79%	0.786	S	S	*	*			trans	-141	151.9	175.1	33.8	0	0	0	0	112.6
3286	K	34	Very low	33.7	Very low	186.5 Å²	186.5	150.5 Å²	150.5	81%	0.811	79%	0.792	S	S	*	*				-88.4	145	-116.9	-87	-178.6	-177.3	178.7	0	113.4
3287	T	36.6	Very low	33.6	Very low	133 Å²	133	153.5 Å²	153.5	82%	0.816	79%	0.793	S	S	*	*			trans	134.8	155.7	147.4	40.8	0	0	0	0	114.7
3288	N	33.3	Very low	33.8	Very low	150 Å²	150	151.4 Å²	151.4	80%	0.802	80%	0.795	S	S	*	*				-131.5	147.8	-98	-83.7	-28.4	0	0	0	112.7
3289	R	35.6	Very low	33.7	Very low	240.5 Å²	240.5	150 Å²	150	91%	0.908	79%	0.786	S	S	*	*			trans	135	142.4	131.2	-153.7	175.6	-168.4	167.2	3.4	116.2
3290	S	32.3	Very low	33.8	Very low	101.5 Å²	101.5	149.7 Å²	149.7	71%	0.71	78%	0.784	S	S	*	*				-127.9	178.5	-113.7	118.6	0	0	0	0	109.9
3291	V	36.6	Very low	33.7	Very low	122 Å²	122	148.4 Å²	148.4	74%	0.739	78%	0.782	S	S	*	*			trans	131.4	126.6	146.8	164.8	0	0	0	0	115.6
3292	T	34.3	Very low	33.7	Very low	110.5 Å²	110.5	147.7 Å²	147.7	68%	0.678	78%	0.777	S	S	*	*				119.9	136.5	-126.1	57.7	0	0	0	0	117.6
3293	T	33.5	Very low	33.7	Very low	114.5 Å²	114.5	147.1 Å²	147.1	70%	0.702	77%	0.773	S	S	*	*				60.7	127.1	127.5	47.8	0	0	0	0	123.7
3294	K	35.5	Very low	33.6	Very low	184 Å²	184	148.7 Å²	148.7	80%	0.8	77%	0.768	S	S	*	*				126.3	100.4	127.6	-82.6	165.8	-178.6	172.8	0	116
3295	T	33.8	Very low	33.7	Very low	122.5 Å²	122.5	147.6 Å²	147.6	75%	0.752	76%	0.764	S	S	*	*				54.5	107.6	77.4	67.5	0	0	0	0	119.3
3296	K	35.9	Very low	33.6	Very low	200.5 Å²	200.5	148.9 Å²	148.9	87%	0.872	77%	0.765	S	S	*	*				179.7	120.4	129.1	-96.7	164.2	-176.8	-178.4	0	107.5
3297	R	29.6	Very low	33.6	Very low	218 Å²	218	144.6 Å²	144.6	82%	0.823	76%	0.764	S	S	*	*				68.1	101.2	56	-170.1	-167	-176.8	-172.2	3	113.7
3298	L	34.2	Very low	33.5	Very low	166.5 Å²	166.5	143.5 Å²	143.5	87%	0.872	76%	0.762	S	S	*	*			trans	-166.2	158.9	133.7	-95.8	171.7	0	0	0	109.5
3299	K	31.5	Very low	33.3	Very low	149 Å²	149	144.1 Å²	144.1	65%	0.648	76%	0.76	S	S	*	*				-137.1	139.2	-118.2	-94.5	-159.5	171.7	-165.9	0	109.1	E3301	K3299-E3301 IonicContact NZ-OE1 3.73Å
3300	H	32.6	Very low	33.2	Very low	154 Å²	154	141.4 Å²	141.4	71%	0.713	76%	0.758	S	S	*	*			trans	117.7	156.7	134.4	-90.5	-112	0	0	0	113.5
3301	E	31.3	Very low	33.1	Very low	172 Å²	172	143.3 Å²	143.3	80%	0.804	76%	0.76	S	S	*	*				-146.6	130.7	77.3	-146.1	142.6	-156.8	0	0	106.6	K3299	K3299-E3301 IonicContact NZ-OE1 3.73Å
3302	S	32.9	Very low	32.8	Very low	85 Å²	85	148 Å²	148	59%	0.594	77%	0.766	S	S	*	*				150.9	101.3	102.7	66.4	0	0	0	0	114
3303	T	32.5	Very low	32.4	Very low	124 Å²	124	147.3 Å²	147.3	76%	0.761	77%	0.766	S	S	*	*			trans	140.3	127.3	160.4	57.8	0	0	0	0	114.8
3304	N	31.2	Very low	32.3	Very low	131 Å²	131	147.7 Å²	147.7	70%	0.701	77%	0.768	S	S	*	*				71.2	128.4	94.9	-53.1	1.1	0	0	0	115.6
3305	S	35.8	Very low	31.9	Very low	103 Å²	103	145 Å²	145	72%	0.72	77%	0.767	S	S	*	*				-161.6	140.3	62.1	5.8	0	0	0	0	111.6
3306	D	33.5	Very low	31.8	Very low	158.5 Å²	158.5	147.2 Å²	147.2	85%	0.848	77%	0.769	S	S	*	*				139.3	-161.5	57	-62.1	-35.9	0	0	0	117.2
3307	A	33.1	Very low	31.5	Very low	96 Å²	96	143.2 Å²	143.2	79%	0.793	77%	0.766	S	S	*	*				-135.7	176.5	-84.3	0	0	0	0	0	112.9
3308	S	34.2	Very low	31.8	Very low	110.5 Å²	110.5	139.2 Å²	139.2	77%	0.773	76%	0.76	S	S	*	*			trans	-117.5	158.5	157.6	42.8	0	0	0	0	113.9
3309	E	29.1	Very low	31.8	Very low	162 Å²	162	140.6 Å²	140.6	76%	0.757	76%	0.758	S	S	*	*				-127.6	155.2	85.6	-91.7	169.5	176	0	0	110.3
3310	H	34.6	Very low	31.6	Very low	185 Å²	185	139 Å²	139	86%	0.856	77%	0.766	S	S	*	*			trans	-166.7	131.7	137.6	-108.3	-74.9	0	0	0	112.7
3311	N	30	Very low	32	Very low	141 Å²	141	137.7 Å²	137.7	75%	0.754	77%	0.771	S	S	*	*			trans	-91.3	152.8	172.8	-64.9	-80.9	0	0	0	110.9
3312	Y	29.5	Very low	31.8	Very low	220 Å²	220	141.3 Å²	141.3	86%	0.863	78%	0.777	S	S	*	*			trans	-148.8	144.4	143	-141.1	-103	0	0	0	112.4	V3314	Y3312-V3314 HydrophobicContact CD1-CG2 3.62Å; Y3312-V3314 HydrophobicContact CE1-CG2 3.86Å
3313	S	25.6	Very low	32	Very low	96.5 Å²	96.5	142.7 Å²	142.7	68%	0.675	79%	0.787	S	S	*	*			trans	-119.5	133.3	174.8	120	0	0	0	0	109.4
3314	V	31.9	Very low	31.9	Very low	123 Å²	123	142 Å²	142	75%	0.745	79%	0.787	S	S	*	*			trans	-122.5	114.4	170.9	-176.1	0	0	0	0	109.2	Y3312 E3316	Y3312-V3314 HydrophobicContact CD1-CG2 3.62Å; Y3312-V3314 HydrophobicContact CE1-CG2 3.86Å; V3314-E3316 HydrophobicContact CG1-CB 4.33Å
3315	T	27	Very low	32.3	Very low	128 Å²	128	142.5 Å²	142.5	79%	0.785	79%	0.794	S	S	*	*			trans	-96.7	132.1	163.5	51.8	0	0	0	0	109
3316	E	31.8	Very low	32.1	Very low	168 Å²	168	143 Å²	143	79%	0.785	80%	0.798	S	S	*	*			trans	-146	150.6	162.1	-124.6	176.1	-150.4	0	0	112.2	V3314 I3318	V3314-E3316 HydrophobicContact CG1-CB 4.33Å; E3316-I3318 HydrophobicContact CB-CD1 4.38Å; E3316-I3318 HydrophobicContact CG-CD1 3.68Å
3317	S	29.9	Very low	32.2	Very low	116 Å²	116	139.5 Å²	139.5	81%	0.811	80%	0.799	S	S	*	*			trans	-144.2	108	-173.9	-67.4	0	0	0	0	110.8
3318	I	35.7	Very low	32.2	Very low	135 Å²	135	138.9 Å²	138.9	69%	0.692	80%	0.803	S	S	*	*			trans	-131.1	104.1	177.3	-65.1	139.3	0	0	0	111.8	E3316	E3316-I3318 HydrophobicContact CB-CD1 4.38Å; E3316-I3318 HydrophobicContact CG-CD1 3.68Å
3319	K	34	Very low	32.3	Very low	195 Å²	195	137.3 Å²	137.3	85%	0.848	80%	0.804	S	S	*	*			trans	32.8	126.9	138.6	-59.7	172	-178.2	171	0	120.6
3320	S	28.2	Very low	32.6	Very low	115 Å²	115	134.7 Å²	134.7	80%	0.804	80%	0.803	S	S	*	*			trans	-72.6	161.8	155.1	-32.8	0	0	0	0	112.7
3321	P	39.6	Very low	32.9	Very low	126.5 Å²	126.5	134.7 Å²	134.7	82%	0.821	80%	0.801	S	S	*	*			trans	-109.1	150.2	146.5	35.4	-27.9	0	0	0	112.2
3322	R	28.3	Very low	33.2	Very low	248.5 Å²	248.5	139.5 Å²	139.5	94%	0.938	81%	0.809	S	S	*	*			trans	-116.7	127.2	171.1	-123.6	-175.3	-178.4	-170.6	1.6	109.6
3323	S	35.8	Very low	33.5	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	80%	0.804	S	S	*	*			trans	-163.5	143.4	164.6	36.6	0	0	0	0	109.9
3324	S	31.7	Very low	34.2	Very low	109.5 Å²	109.5	133.9 Å²	133.9	77%	0.766	81%	0.813	S	S	*	*				-150.9	147.5	-109.7	49.3	0	0	0	0	108.5
3325	V	38.1	Very low	34.7	Very low	140.5 Å²	140.5	132.9 Å²	132.9	85%	0.852	81%	0.811	S	S	*	*			trans	150.5	142.9	170.8	-173.9	0	0	0	0	111.9
3326	S	33.1	Very low	35.1	Very low	114.5 Å²	114.5	134.1 Å²	134.1	80%	0.801	81%	0.813	S	S	*	*				-141	145.5	-113.2	54.9	0	0	0	0	111.9
3327	G	35.4	Very low	35.4	Very low	84 Å²	84	130.5 Å²	130.5	87%	0.866	81%	0.812	S	S	*	*			trans	118.9	152.2	166.1	0	0	0	0	0	114.2
3328	G	33.4	Very low	35.8	Very low	84.5 Å²	84.5	130.7 Å²	130.7	87%	0.871	81%	0.813	S	S	*	*			cis	158.3	101.1	-7.2	0	0	0	0	0	113.6
3329	G	35	Very low	36	Very low	77 Å²	77	127.6 Å²	127.6	79%	0.794	82%	0.815	S	S	*	*			trans	133	150.5	175	0	0	0	0	0	114.8
3330	S	35.7	Very low	36.3	Very low	107 Å²	107	125.4 Å²	125.4	75%	0.748	82%	0.818	S	S	*	*				-148.3	141.2	-91.3	-90.5	0	0	0	0	113.6
3331	K	40.6	Very low	36.7	Very low	184.5 Å²	184.5	123.5 Å²	123.5	80%	0.802	82%	0.817	S	S	*	*			trans	129.6	117.5	149.3	-82.9	160.1	-177.1	176.3	0	114.9
3332	R	36	Very low	36.6	Very low	243.5 Å²	243.5	129.2 Å²	129.2	92%	0.919	82%	0.822	S	S	*	*				73.9	130.6	108.7	-69.3	175.9	175	-172.7	-2.9	116
3333	G	36.1	Very low	37.2	Very low	74 Å²	74	124 Å²	124	76%	0.763	81%	0.812	S	S	*	*				174	140.3	81	0	0	0	0	0	112.8
3334	S	41.7	Very low	37.4	Very low	124 Å²	124	125.6 Å²	125.6	87%	0.867	81%	0.812	S	S	*	*			trans	-31.7	166.7	167.2	-54.5	0	0	0	0	117.2
3335	S	41.8	Very low	37.7	Very low	101.5 Å²	101.5	127.5 Å²	127.5	71%	0.71	81%	0.813	S	S	*	*			cis	-172.4	160.5	6.7	47.2	0	0	0	0	113.6
3336	N	35.7	Very low	37.8	Very low	153.5 Å²	153.5	126.1 Å²	126.1	82%	0.821	81%	0.81	S	S	*	*			trans	15	139.4	163.3	-54.3	-9.6	0	0	0	119.4
3337	A	38.5	Very low	38.2	Very low	92.5 Å²	92.5	127.8 Å²	127.8	76%	0.764	81%	0.81	S	S	*	*				128.3	157.6	99.9	0	0	0	0	0	112.9
3338	S	38.1	Very low	38.3	Very low	120 Å²	120	133.4 Å²	133.4	84%	0.839	81%	0.811	S	S	*	*			cis	-170.9	146.2	-26.6	-91.4	0	0	0	0	110.4
3339	G	40	Very low	38.4	Very low	69.5 Å²	69.5	133.2 Å²	133.2	72%	0.716	81%	0.809	S	S	*	*			trans	96.6	144.3	168.4	0	0	0	0	0	115.8
3340	T	38.7	Very low	38.3	Very low	150 Å²	150	133.6 Å²	133.6	92%	0.92	81%	0.813	S	S	*	*			cis	138.4	144.7	27	58.1	0	0	0	0	111.8
3341	G	36.8	Very low	38.3	Very low	75 Å²	75	132.5 Å²	132.5	77%	0.773	82%	0.819	S	S	*	*			cis	148.7	129.4	-7.3	0	0	0	0	0	114.4
3342	R	38.5	Very low	37.9	Very low	246 Å²	246	135.3 Å²	135.3	93%	0.928	82%	0.824	S	S	*	*			trans	140	130.4	165.8	-98.1	177.4	176.5	165	-0.6	118.4
3343	N	39.6	Very low	38	Very low	139 Å²	139	130 Å²	130	74%	0.743	82%	0.819	S	S	*	*			trans	-8	139.5	153.6	-66.3	-2.4	0	0	0	119.1
3344	N	40.8	Very low	37.9	Very low	148 Å²	148	135.3 Å²	135.3	79%	0.791	82%	0.821	S	S	*	*				142.6	136.8	116.1	-82	-3.3	0	0	0	118.1
3345	N	37.8	Very low	37.6	Very low	148 Å²	148	136.5 Å²	136.5	79%	0.791	82%	0.816	S	S	*	*			trans	151.1	122.4	159.4	-123.8	4.6	0	0	0	115.4
3346	S	41.1	Very low	37.3	Very low	113 Å²	113	136.4 Å²	136.4	79%	0.79	82%	0.816	S	S	*	*			trans	155.6	129.7	148	-0.4	0	0	0	0	117.4
3347	N	40.2	Very low	37.3	Very low	149.5 Å²	149.5	137 Å²	137	80%	0.799	81%	0.814	S	S	*	*			trans	177.7	151.1	165.5	-138.7	-9.1	0	0	0	117.4
3348	K	39	Very low	37.4	Very low	201 Å²	201	141.6 Å²	141.6	87%	0.874	82%	0.817	S	S	*	*			trans	76.2	149.8	167.8	-61.9	172.5	179.5	-179.7	0	117.7
3349	G	34.5	Very low	37.2	Very low	80 Å²	80	140.7 Å²	140.7	83%	0.825	81%	0.81	S	S	*	*				-149.1	-178.9	-92.1	0	0	0	0	0	111.9
3350	G	33.4	Very low	37.2	Very low	85.5 Å²	85.5	143.7 Å²	143.7	88%	0.881	81%	0.81	S	S	*	*				-139.2	168.1	-87.4	0	0	0	0	0	114
3351	G	35.4	Very low	37.2	Very low	84.5 Å²	84.5	144.2 Å²	144.2	87%	0.871	80%	0.8	S	S	*	*			trans	153.8	153.2	174.6	0	0	0	0	0	113.2
3352	R	32	Very low	37.3	Very low	242.5 Å²	242.5	147.7 Å²	147.7	92%	0.915	80%	0.8	S	S	*	*				-157	141.7	-92.5	-172.8	-172.8	-176	-166.9	3.4	110.7
3353	V	38.6	Very low	37.1	Very low	134 Å²	134	144.8 Å²	144.8	81%	0.812	80%	0.797	S	S	*	*			trans	158.7	135.8	166.5	-168.9	0	0	0	0	110.8
3354	K	34.5	Very low	36.9	Very low	184.5 Å²	184.5	142.7 Å²	142.7	80%	0.802	80%	0.799	S	S	*	*			cis	124.4	163.7	-6.3	-117.9	-166.5	173.1	-173.7	0	111.9
3355	L	34.7	Very low	36.6	Very low	148 Å²	148	141.1 Å²	141.1	78%	0.775	80%	0.797	S	S	*	*				140.3	163.6	-111.3	-92	174.7	0	0	0	109.8
3356	S	34.9	Very low	36.4	Very low	100.5 Å²	100.5	139.9 Å²	139.9	70%	0.703	80%	0.795	S	S	*	*				126.8	150.7	-96.4	53.6	0	0	0	0	112.4
3357	E	35.5	Very low	36.2	Very low	167 Å²	167	143.3 Å²	143.3	78%	0.78	80%	0.799	S	S	*	*			cis	148	-150.2	28.8	-113.8	-171.9	156.2	0	0	115.3
3358	K	40.7	Very low	36.1	Very low	188 Å²	188	139.8 Å²	139.8	82%	0.817	79%	0.786	S	S	*	*			trans	-147	145.5	167	-89.9	164.3	-175.7	154.4	0	110.3
3359	S	34.8	Very low	36.3	Very low	101.5 Å²	101.5	135.4 Å²	135.4	71%	0.71	77%	0.771	S	S	*	*				-152.9	163.3	-85.8	54.1	0	0	0	0	109.1
3360	D	40	Very low	36.6	Very low	133 Å²	133	137.2 Å²	137.2	71%	0.711	77%	0.766	S	S	*	*				-159	168.2	85.1	-116.8	-27.5	0	0	0	109.4
3361	K	38.6	Very low	36.9	Very low	160.5 Å²	160.5	136.6 Å²	136.6	70%	0.698	75%	0.748	S	S	*	*	S	Bend		-115.5	149.6	-105.2	-83.1	155	-172.1	164.4	0	110.9
3362	N	37.6	Very low	37.5	Very low	147.5 Å²	147.5	137.5 Å²	137.5	79%	0.789	74%	0.737	S	S	*	*				151.1	126	-86.4	-65.3	-20.4	0	0	0	112.2
3363	E	34.6	Very low	38.4	Very low	185.5 Å²	185.5	130.7 Å²	130.7	87%	0.867	72%	0.718	S	S	*	*				3.4	124	122.4	-58.8	171.8	161.1	0	0	114.5
3364	A	36	Very low	38.7	Very low	95 Å²	95	132.1 Å²	132.1	79%	0.785	72%	0.715	S	S	*	*				139.1	150.8	85.5	0	0	0	0	0	112
3365	P	34.6	Very low	39	Very low	114 Å²	114	130.1 Å²	130.1	74%	0.74	71%	0.714	S	S	*	*				-115.9	156.6	-88.6	36.7	-27.5	0	0	0	115.5	E3367	P3365-E3367 PolarHBondContact O-N 3.4Å
3366	T	32.8	Very low	39.4	Very low	122.5 Å²	122.5	127.1 Å²	127.1	75%	0.752	70%	0.701	S	S	*	*			trans	-115.5	72.6	165.2	54.6	0	0	0	0	112.4	S3368	T3366-S3368 PolarHBondContact O-N 2.96Å
3367	E	37.2	Very low	39.7	Very low	184.5 Å²	184.5	127 Å²	127	86%	0.862	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	78.4	169.1	-68.7	-167.6	162.6	0	0	111.8	P3365	P3365-E3367 PolarHBondContact O-N 3.4Å
3368	S	38.2	Very low	40.2	Very low	75.5 Å²	75.5	124.9 Å²	124.9	53%	0.528	70%	0.704	S	S	.	*	T	Hydrogen-bonded Turn	trans	-162.1	-11.8	178.2	54.7	0	0	0	0	114.9	T3366 T3370 S3371	T3366-S3368 PolarHBondContact O-N 2.96Å; S3368-T3370 PolarHBondContact O-N 2.92Å; S3368-S3371 PolarHBondContact O-OG 3.13Å; S3368-S3371 VanDerWaalsContact O-OG 3.06Å
3369	I	44.1	Very low	41.1	Very low	110 Å²	110	122.9 Å²	122.9	56%	0.564	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-82.8	-26.2	-171.9	-61.1	177.5	0	0	0	112.3	S3371 V3372	I3369-S3371 VanDerWaalsContact C-N 3.29Å; I3369-S3371 PolarHBondContact O-N 2.89Å; I3369-V3372 WeakPolarHBondContact O-CB 3.43Å; I3369-V3372 PolarHBondContact O-N 3.14Å
3370	T	40.9	Very low	42.3	Very low	116.5 Å²	116.5	119.8 Å²	119.8	72%	0.715	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-61.8	-29.8	-176.6	-20	0	0	0	0	113.6	S3368	S3368-T3370 PolarHBondContact O-N 2.92Å
3371	S	39.4	Very low	43.8	Very low	74.5 Å²	74.5	117.4 Å²	117.4	52%	0.521	67%	0.673	S	S	.	*	G	3₁₀ helix	trans	-80.2	-16.8	175.9	47.3	0	0	0	0	114	S3368 I3369 Q3374	S3368-S3371 PolarHBondContact O-OG 3.13Å; S3368-S3371 VanDerWaalsContact O-OG 3.06Å; I3369-S3371 VanDerWaalsContact C-N 3.29Å; I3369-S3371 PolarHBondContact O-N 2.89Å; S3371-Q3374 PolarHBondContact O-N 3.16Å
3372	V	47.5	Very low	45.9	Very low	103.5 Å²	103.5	113.8 Å²	113.8	63%	0.627	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-76.5	-30.2	-179.9	-175.7	0	0	0	0	111.2	I3369 Q3374	I3369-V3372 WeakPolarHBondContact O-CB 3.43Å; I3369-V3372 PolarHBondContact O-N 3.14Å; V3372-Q3374 VanDerWaalsContact C-N 3.27Å; V3372-Q3374 PolarHBondContact O-N 2.95Å
3373	L	52	Low	47.9	Very low	99.5 Å²	99.5	110.1 Å²	110.1	52%	0.521	64%	0.64	S	S	.	*	G	3₁₀ helix	trans	-78.3	-3.5	179.2	-68.9	173.1	0	0	0	114.4
3374	Q	44.4	Very low	50.3	Low	162 Å²	162	102 Å²	102	76%	0.757	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-102.3	-3.8	-176.8	-69.8	-176.5	-22.4	0	0	114.9	S3371 V3372	S3371-Q3374 PolarHBondContact O-N 3.16Å; V3372-Q3374 VanDerWaalsContact C-N 3.27Å; V3372-Q3374 PolarHBondContact O-N 2.95Å
3375	N	39.7	Very low	52.5	Low	143.5 Å²	143.5	101.2 Å²	101.2	77%	0.767	59%	0.588	S	S	*	*			trans	-109.2	25	177.7	-84.9	-49.8	0	0	0	113.7	S3377	N3375-S3377 PolarHBondContact O-N 3Å
3376	V	44	Very low	54.9	Low	84.5 Å²	84.5	98.2 Å²	98.2	51%	0.512	57%	0.569	S	S	.	*			trans	-76.9	98.4	171	-176.5	0	0	0	0	108.7	S3380	V3376-S3380 VanDerWaalsContact CG1-CB 3.46Å
3377	S	40.7	Very low	57.2	Low	97.5 Å²	97.5	100.3 Å²	100.3	68%	0.682	57%	0.568	S	S	*	*			trans	-56.6	152	175.1	-56.6	0	0	0	0	111.6	N3375 N3379 S3380	N3375-S3377 PolarHBondContact O-N 3Å; S3377-N3379 PolarHBondContact O-N 2.86Å; S3377-S3380 PolarHBondContact O-N 3.18Å
3378	S	46.3	Very low	59.2	Low	123.5 Å²	123.5	93.7 Å²	93.7	86%	0.864	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	18.9	-168	56.7	0	0	0	0	117.5
3379	N	59.5	Low	61.4	Low	146 Å²	146	93.1 Å²	93.1	78%	0.781	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	14.4	178.4	-87.7	-15.7	0	0	0	113	S3377	S3377-N3379 PolarHBondContact O-N 2.86Å
3380	S	60.7	Low	63.3	Low	37.5 Å²	37.5	94.5 Å²	94.5	26%	0.262	53%	0.534	S	S	.	.			trans	-62.2	134.8	171.9	54.9	0	0	0	0	111.1	V3376 S3377 V3382 P3389	V3376-S3380 VanDerWaalsContact CG1-CB 3.46Å; S3377-S3380 PolarHBondContact O-N 3.18Å; S3380-V3382 PolarHBondContact O-N 3.2Å; S3380-P3389 WeakPolarHBondContact OG-CB 3.38Å
3381	P	72	Confident	65.1	Low	82 Å²	82	91.7 Å²	91.7	53%	0.532	51%	0.514	S	S	.	.			trans	-58.3	137.7	172.4	24.3	-32.4	0	0	0	110.5	Y3383	P3381-Y3383 HydrophobicContact CB-CE2 3.87Å; P3381-Y3383 HydrophobicContact CG-CE2 3.86Å; P3381-Y3383 WeakPolarHBondContact CG-OH 3.28Å; P3381-Y3383 WeakPolarHBondContact O-CD2 3.33Å; P3381-Y3383 VanDerWaalsContact O-CE2 3.27Å; P3381-Y3383 WeakPolarHBondContact O-CE2 3.41Å
3382	V	81.9	Confident	67	Low	84.5 Å²	84.5	91.8 Å²	91.8	51%	0.512	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.6	-173.5	172	0	0	0	0	108.8	S3380 K3387	S3380-V3382 PolarHBondContact O-N 3.2Å; V3382-K3387 HydrophobicContact CG1-CB 3.71Å; V3382-K3387 HydrophobicContact CG1-CG 4.31Å; V3382-K3387 WeakPolarHBondContact CG1-O 3.28Å
3383	Y	80.3	Confident	68.5	Low	71 Å²	71	94 Å²	94	28%	0.278	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	160.6	-172.5	-60.8	-83.7	0	0	0	111.9	P3381 K3387 T3388 W3405	P3381-Y3383 HydrophobicContact CB-CE2 3.87Å; P3381-Y3383 HydrophobicContact CG-CE2 3.86Å; P3381-Y3383 WeakPolarHBondContact CG-OH 3.28Å; P3381-Y3383 WeakPolarHBondContact O-CD2 3.33Å; P3381-Y3383 VanDerWaalsContact O-CE2 3.27Å; P3381-Y3383 WeakPolarHBondContact O-CE2 3.41Å; Y3383-K3387 PolarHBondContact O-N 3.45Å; Y3383-T3388 PolarHBondContact N-O 2.86Å; Y3383-T3388 PolarHBondContact O-N 3.18Å; Y3383-W3405 HydrophobicContact CD1-CB 3.98Å
3384	C	84.5	Confident	69.9	Low	14 Å²	14	93.6 Å²	93.6	10%	0.095	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	167.2	179	-163.7	0	0	0	0	115.6	C3386 K3387 W3405 F3406 H3407 C3410	C3384-C3386 PolarHBondContact O-N 3.42Å; C3384-K3387 PolarHBondContact O-N 3.25Å; C3384-W3405 WeakPolarHBondContact CA-O 3.43Å; C3384-W3405 PolarHBondContact N-O 3.25Å; C3384-F3406 HydrophobicContact CB-CB 4.47Å; C3384-F3406 HydrophobicContact CB-CD1 4.47Å; C3384-F3406 VanDerWaalsContact SG-CA 3.57Å; C3384-H3407 PolarHBondContact SG-N 3.5Å; C3384-C3410 WeakPolarHBondContact SG-CB 3.3Å
3385	V	82.6	Confident	71.7	Confident	78 Å²	78	91.4 Å²	91.4	47%	0.473	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.2	173.3	-117	0	0	0	0	112.3	K3387 F3406	V3385-K3387 PolarHBondContact O-N 3.21Å; V3385-F3406 HydrophobicContact CG2-CD1 3.95Å; V3385-F3406 HydrophobicContact CG2-CE1 3.93Å
3386	C	85.2	Confident	73.8	Confident	51 Å²	51	86.1 Å²	86.1	35%	0.345	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-9.5	176.5	69.3	0	0	0	0	114	C3384 T3388 H3407	C3384-C3386 PolarHBondContact O-N 3.42Å; C3386-T3388 VanDerWaalsContact C-N 3.32Å; C3386-T3388 PolarHBondContact O-N 3.34Å; C3386-T3388 PolarHBondContact SG-OG1 3.19Å; C3386-H3407 VanDerWaalsContact SG-CE1 3.53Å; C3386-H3407 PolarHBondContact SG-ND1 3.39Å
3387	K	80.9	Confident	75.7	Confident	167.5 Å²	167.5	83.2 Å²	83.2	73%	0.728	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	47.4	177.8	-63.6	-177.6	-178.4	-179.9	0	113.9	V3382 Y3383 C3384 V3385	V3382-K3387 HydrophobicContact CG1-CB 3.71Å; V3382-K3387 HydrophobicContact CG1-CG 4.31Å; V3382-K3387 WeakPolarHBondContact CG1-O 3.28Å; Y3383-K3387 PolarHBondContact O-N 3.45Å; C3384-K3387 PolarHBondContact O-N 3.25Å; V3385-K3387 PolarHBondContact O-N 3.21Å
3388	T	79.3	Confident	77.8	Confident	46 Å²	46	79.9 Å²	79.9	28%	0.282	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	152.5	173.2	51.9	0	0	0	0	111.3	Y3383 C3386 H3407	Y3383-T3388 PolarHBondContact N-O 2.86Å; Y3383-T3388 PolarHBondContact O-N 3.18Å; C3386-T3388 VanDerWaalsContact C-N 3.32Å; C3386-T3388 PolarHBondContact O-N 3.34Å; C3386-T3388 PolarHBondContact SG-OG1 3.19Å; T3388-H3407 PolarHBondContact OG1-CE1 3.34Å; T3388-H3407 VanDerWaalsContact OG1-CE1 3.25Å
3389	P	83.5	Confident	79.8	Confident	62 Å²	62	74.1 Å²	74.1	40%	0.403	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	162.2	168.8	29.8	-36.6	0	0	0	110.7	S3380 N3391	S3380-P3389 WeakPolarHBondContact OG-CB 3.38Å; P3389-N3391 PolarHBondContact O-N 3.39Å; P3389-N3391 VanDerWaalsContact O-N 3.17Å
3390	Y	83.2	Confident	81	Confident	140.5 Å²	140.5	69.8 Å²	69.8	55%	0.551	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-58.7	112.6	178.1	179.2	-102.7	0	0	0	112.1	P3392 Y3396	Y3390-P3392 HydrophobicContact CE1-CB 3.88Å; Y3390-Y3396 WeakPolarHBondContact CA-OH 3.28Å; Y3390-Y3396 HydrophobicContact CD2-CD2 4.44Å; Y3390-Y3396 HydrophobicContact CD2-CE1 4.38Å; Y3390-Y3396 AromaticContact CD2-CE2 3.78Å; Y3390-Y3396 HydrophobicContact CD2-CE2 3.78Å; Y3390-Y3396 AromaticContact CD2-CZ 3.7Å; Y3390-Y3396 HydrophobicContact CE2-CD2 4.06Å; Y3390-Y3396 AromaticContact CE2-CE2 3.59Å; Y3390-Y3396 HydrophobicContact CE2-CE2 3.59Å; Y3390-Y3396 AromaticContact CE2-CZ 3.96Å
3391	N	79.2	Confident	81.8	Confident	56.5 Å²	56.5	68 Å²	68	30%	0.302	36%	0.358	S	S	.	.			trans	-106.8	113.1	171.9	178.9	-3.6	0	0	0	108.9	P3389 L3393 R3394 Y3396	P3389-N3391 PolarHBondContact O-N 3.39Å; P3389-N3391 VanDerWaalsContact O-N 3.17Å; N3391-L3393 PolarHBondContact O-N 3.17Å; N3391-L3393 VanDerWaalsContact O-N 3.13Å; N3391-L3393 WeakPolarHBondContact OD1-CB 3.21Å; N3391-L3393 PolarHBondContact OD1-N 3.01Å; N3391-R3394 PolarHBondContact O-N 2.87Å; N3391-R3394 VanDerWaalsContact O-N 3.17Å; N3391-Y3396 PolarHBondContact N-OH 3.14Å; N3391-Y3396 VanDerWaalsContact O-CE2 3.31Å; N3391-Y3396 WeakPolarHBondContact O-CE2 3.33Å; N3391-Y3396 PolarHBondContact O-OH 3.17Å
3392	P	80.3	Confident	82.3	Confident	77 Å²	77	64.8 Å²	64.8	50%	0.5	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-8.7	-177	29.5	-36.3	0	0	0	114.4	Y3390 R3394	Y3390-P3392 HydrophobicContact CE1-CB 3.88Å; P3392-R3394 VanDerWaalsContact C-N 3.28Å
3393	L	77.9	Confident	82.1	Confident	150.5 Å²	150.5	66.6 Å²	66.6	79%	0.788	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.4	175.6	-59.1	177.5	0	0	0	113.5	N3391	N3391-L3393 PolarHBondContact O-N 3.17Å; N3391-L3393 VanDerWaalsContact O-N 3.13Å; N3391-L3393 WeakPolarHBondContact OD1-CB 3.21Å; N3391-L3393 PolarHBondContact OD1-N 3.01Å
3394	R	80.9	Confident	82.2	Confident	91 Å²	91	66.1 Å²	66.1	34%	0.343	34%	0.337	S	S	.	.	S	Bend	trans	-106.2	141.3	173.6	-74.4	-173.4	162.9	173.5	-6.7	110.6	N3391 P3392 Y3396 H3407 E3409	N3391-R3394 PolarHBondContact O-N 2.87Å; N3391-R3394 VanDerWaalsContact O-N 3.17Å; P3392-R3394 VanDerWaalsContact C-N 3.28Å; R3394-Y3396 HydrophobicContact CB-CE2 4.24Å; R3394-Y3396 WeakPolarHBondContact O-CD2 3.41Å; R3394-Y3396 VanDerWaalsContact O-CE2 3.23Å; R3394-Y3396 WeakPolarHBondContact O-CE2 3.44Å; R3394-H3407 VanDerWaalsContact CD-CD2 3.43Å; R3394-H3407 WeakPolarHBondContact CD-CD2 3.3Å; R3394-E3409 IonicContact CZ-OE2 2.92Å; R3394-E3409 IonicContact NE-OE2 3.33Å; R3394-E3409 PolarHBondContact NE-OE2 3.38Å; R3394-E3409 IonicContact NH2-OE2 2.7Å; R3394-E3409 PolarHBondContact NH2-OE2 3.46Å
3395	E	82.2	Confident	82.2	Confident	115 Å²	115	71.9 Å²	71.9	54%	0.537	36%	0.357	S	S	.	.			trans	-74.9	143.7	170.1	-62.5	175.1	178.6	0	0	109.9	H3407 F3408 P3415	E3395-H3407 WeakPolarHBondContact O-CA 3.48Å; E3395-F3408 HydrophobicContact CB-CD2 3.59Å; E3395-F3408 HydrophobicContact CB-CE2 3.84Å; E3395-P3415 VanDerWaalsContact OE2-CB 3.26Å; E3395-P3415 WeakPolarHBondContact OE2-CB 3.46Å; E3395-P3415 WeakPolarHBondContact OE2-CG 3.31Å
3396	Y	84.7	Confident	82.4	Confident	33.5 Å²	33.5	68.4 Å²	68.4	13%	0.131	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.3	178.4	-63.7	-108.8	0	0	0	111	Y3390 N3391 R3394 W3405 F3406 H3407	Y3390-Y3396 WeakPolarHBondContact CA-OH 3.28Å; Y3390-Y3396 HydrophobicContact CD2-CD2 4.44Å; Y3390-Y3396 HydrophobicContact CD2-CE1 4.38Å; Y3390-Y3396 AromaticContact CD2-CE2 3.78Å; Y3390-Y3396 HydrophobicContact CD2-CE2 3.78Å; Y3390-Y3396 AromaticContact CD2-CZ 3.7Å; Y3390-Y3396 HydrophobicContact CE2-CD2 4.06Å; Y3390-Y3396 AromaticContact CE2-CE2 3.59Å; Y3390-Y3396 HydrophobicContact CE2-CE2 3.59Å; Y3390-Y3396 AromaticContact CE2-CZ 3.96Å; N3391-Y3396 PolarHBondContact N-OH 3.14Å; N3391-Y3396 VanDerWaalsContact O-CE2 3.31Å; N3391-Y3396 WeakPolarHBondContact O-CE2 3.33Å; N3391-Y3396 PolarHBondContact O-OH 3.17Å; R3394-Y3396 HydrophobicContact CB-CE2 4.24Å; R3394-Y3396 WeakPolarHBondContact O-CD2 3.41Å; R3394-Y3396 VanDerWaalsContact O-CE2 3.23Å; R3394-Y3396 WeakPolarHBondContact O-CE2 3.44Å; Y3396-W3405 HydrophobicContact CD1-CB 4.1Å; Y3396-F3406 CarbonylContact C-O 3.56Å; Y3396-F3406 WeakPolarHBondContact CA-O 3.31Å; Y3396-H3407 AromaticContact CD1-CD2 3.73Å; Y3396-H3407 AromaticContact CD1-NE2 3.84Å; Y3396-H3407 AromaticContact CE1-CD2 3.39Å; Y3396-H3407 WeakPolarHBondContact CE1-CD2 3.23Å; Y3396-H3407 AromaticContact CE1-CE1 3.9Å; Y3396-H3407 AromaticContact CE1-NE2 3.02Å; Y3396-H3407 WeakPolarHBondContact CE1-NE2 3.32Å; Y3396-H3407 AromaticContact CE2-CD2 3.97Å; Y3396-H3407 AromaticContact CE2-NE2 3.95Å; Y3396-H3407 AromaticContact CZ-CD2 3.5Å; Y3396-H3407 VanDerWaalsContact CZ-CD2 3.5Å; Y3396-H3407 AromaticContact CZ-NE2 3.07Å; Y3396-H3407 PolarHBondContact OH-NE2 2.91Å
3397	I	84.2	Confident	82.4	Confident	23 Å²	23	66 Å²	66	12%	0.118	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.8	168.2	-170.8	167	0	0	0	109.5	W3405 F3406 F3408 V3411 L3413 L3421 W3425	I3397-W3405 WeakPolarHBondContact O-CA 3.37Å; I3397-F3406 HydrophobicContact CG2-CB 4.33Å; I3397-F3406 PolarHBondContact N-O 3.29Å; I3397-F3406 PolarHBondContact O-N 2.92Å; I3397-F3408 HydrophobicContact CB-CD2 4.49Å; I3397-F3408 HydrophobicContact CB-CE1 4.46Å; I3397-F3408 HydrophobicContact CB-CE2 4Å; I3397-F3408 HydrophobicContact CB-CZ 3.97Å; I3397-V3411 HydrophobicContact CG2-CG2 4.21Å; I3397-L3413 HydrophobicContact CD1-CD1 4Å; I3397-L3413 HydrophobicContact CG2-CD1 4.28Å; I3397-L3421 HydrophobicContact CD1-CD2 3.48Å; I3397-L3421 VanDerWaalsContact CD1-CD2 3.48Å; I3397-W3425 HydrophobicContact CB-CE3 4.41Å; I3397-W3425 HydrophobicContact CB-CZ3 4.43Å; I3397-W3425 HydrophobicContact CD1-CB 3.91Å; I3397-W3425 HydrophobicContact CD1-CD2 3.62Å; I3397-W3425 HydrophobicContact CD1-CE3 3.88Å; I3397-W3425 HydrophobicContact CD1-CG 3.62Å; I3397-W3425 HydrophobicContact CG1-CD2 3.99Å; I3397-W3425 HydrophobicContact CG1-CE3 3.67Å; I3397-W3425 HydrophobicContact CG1-CG 4.37Å; I3397-W3425 HydrophobicContact CG1-CZ3 4.17Å; I3397-W3425 HydrophobicContact CG2-CD2 4.38Å; I3397-W3425 HydrophobicContact CG2-CE3 4.02Å; I3397-W3425 HydrophobicContact CG2-CH2 3.75Å; I3397-W3425 HydrophobicContact CG2-CZ2 4.15Å; I3397-W3425 HydrophobicContact CG2-CZ3 3.68Å
3398	G	85.3	Confident	82.5	Confident	27.5 Å²	27.5	59.2 Å²	59.2	28%	0.284	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	135.7	177	0	0	0	0	0	110.9	D3404	G3398-D3404 WeakPolarHBondContact CA-O 3.22Å
3399	C	88.2	Confident	82.7	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.014	31%	0.305	C	S	.	.			trans	-88.1	128.3	175.5	173.9	0	0	0	0	111.6	L3401 C3402 R3403 D3404 F3406 W3425 C3427	C3399-L3401 VanDerWaalsContact C-N 3.27Å; C3399-L3401 PolarHBondContact O-N 3.38Å; C3399-C3402 VanDerWaalsContact CB-SG 3.52Å; C3399-R3403 WeakPolarHBondContact O-CA 3.24Å; C3399-R3403 PolarHBondContact O-N 3.41Å; C3399-D3404 PolarHBondContact N-O 3.18Å; C3399-F3406 HydrophobicContact CB-CD2 4.45Å; C3399-F3406 HydrophobicContact CB-CE2 3.95Å; C3399-W3425 WeakPolarHBondContact CA-O 3.1Å; C3399-W3425 HydrophobicContact CB-CE3 3.92Å; C3399-W3425 HydrophobicContact CB-CZ3 3.67Å; C3399-C3427 HydrophobicContact CB-CB 3.88Å; C3399-C3427 PolarHBondContact SG-N 2.67Å
3400	D	84.2	Confident	82.7	Confident	55.5 Å²	55.5	62.6 Å²	62.6	30%	0.297	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-34.5	-177.1	-61.7	-68.8	0	0	0	114.1	S3424 W3425	D3400-S3424 WeakPolarHBondContact OD2-CA 2.99Å; D3400-S3424 WeakPolarHBondContact OD2-CB 2.97Å; D3400-W3425 PolarHBondContact N-O 2.94Å; D3400-W3425 PolarHBondContact OD2-N 3.5Å
3401	L	77.9	Confident	82.7	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-51.5	-176.2	-66.1	175.6	0	0	0	112.5	C3399 H3426 C3430 M3560 W3562 N3626 C3627 I3630	C3399-L3401 VanDerWaalsContact C-N 3.27Å; C3399-L3401 PolarHBondContact O-N 3.38Å; L3401-H3426 HydrophobicContact CD1-CB 4.3Å; L3401-C3430 HydrophobicContact CB-CB 4.13Å; L3401-C3430 HydrophobicContact CD1-CB 3.85Å; L3401-M3560 HydrophobicContact CB-CE 3.77Å; L3401-M3560 HydrophobicContact CB-SD 3.73Å; L3401-M3560 VanDerWaalsContact O-CE 3.32Å; L3401-M3560 WeakPolarHBondContact O-CE 3.41Å; L3401-W3562 PolarHBondContact O-NE1 2.79Å; L3401-N3626 HydrophobicContact CD2-CB 3.65Å; L3401-C3627 PolarHBondContact O-SG 3.48Å; L3401-C3627 VanDerWaalsContact O-SG 3.39Å; L3401-I3630 HydrophobicContact CD1-CD1 3.99Å; L3401-I3630 HydrophobicContact CD2-CD1 4.43Å
3402	C	80.8	Confident	82.8	Confident	13 Å²	13	58 Å²	58	9%	0.088	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-16.8	-177.8	53.8	0	0	0	0	114.1	C3399 D3404 C3427 C3430 K3559 M3560	C3399-C3402 VanDerWaalsContact CB-SG 3.52Å; C3402-D3404 PolarHBondContact O-N 3.36Å; C3402-D3404 VanDerWaalsContact O-N 3.09Å; C3402-C3427 VanDerWaalsContact SG-SG 3.67Å; C3402-C3430 PolarHBondContact SG-SG 2.78Å; C3402-K3559 HydrophobicContact CB-CB 3.81Å; C3402-K3559 HydrophobicContact CB-CD 3.94Å; C3402-K3559 HydrophobicContact CB-CG 4.44Å; C3402-M3560 VanDerWaalsContact CA-CE 3.47Å; C3402-M3560 HydrophobicContact CB-CE 3.54Å
3403	R	78.2	Confident	82.8	Confident	124 Å²	124	55.6 Å²	55.6	47%	0.468	29%	0.286	S	S	.	.			trans	59.9	11.2	-173.7	-58.8	174.6	172	163.7	-0.9	114.6	C3399 W3562 E3624	C3399-R3403 WeakPolarHBondContact O-CA 3.24Å; C3399-R3403 PolarHBondContact O-N 3.41Å; R3403-W3562 VanDerWaalsContact NH1-CE3 3.32Å; R3403-E3624 IonicContact NH2-OE1 3.07Å; R3403-E3624 PolarHBondContact NH2-OE1 2.91Å
3404	D	82.4	Confident	82.7	Confident	60 Å²	60	52.9 Å²	52.9	32%	0.321	27%	0.273	S	S	.	.			trans	-67.1	151	165.3	-76.9	-27.6	0	0	0	110.8	G3398 C3399 C3402 F3406 K3559	G3398-D3404 WeakPolarHBondContact CA-O 3.22Å; C3399-D3404 PolarHBondContact N-O 3.18Å; C3402-D3404 PolarHBondContact O-N 3.36Å; C3402-D3404 VanDerWaalsContact O-N 3.09Å; D3404-F3406 HydrophobicContact CB-CD2 4.3Å; D3404-F3406 HydrophobicContact CB-CE2 3.39Å; D3404-F3406 HydrophobicContact CB-CZ 3.57Å; D3404-F3406 WeakPolarHBondContact O-CE2 3.31Å; D3404-K3559 WeakPolarHBondContact OD2-CD 3.42Å; D3404-K3559 WeakPolarHBondContact OD2-CE 3.46Å; D3404-K3559 IonicContact OD2-NZ 2.63Å; D3404-K3559 PolarHBondContact OD2-NZ 2.99Å
3405	W	85.5	Confident	82.4	Confident	136 Å²	136	51.8 Å²	51.8	52%	0.515	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.8	176.6	-65	72.8	0	0	0	110.9	Y3383 C3384 Y3396 I3397	Y3383-W3405 HydrophobicContact CD1-CB 3.98Å; C3384-W3405 WeakPolarHBondContact CA-O 3.43Å; C3384-W3405 PolarHBondContact N-O 3.25Å; Y3396-W3405 HydrophobicContact CD1-CB 4.1Å; I3397-W3405 WeakPolarHBondContact O-CA 3.37Å
3406	F	86.4	Confident	81.9	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.9	-174	-58.8	-96.4	0	0	0	111	C3384 V3385 Y3396 I3397 C3399 D3404 V3411 W3425 C3427	C3384-F3406 HydrophobicContact CB-CB 4.47Å; C3384-F3406 HydrophobicContact CB-CD1 4.47Å; C3384-F3406 VanDerWaalsContact SG-CA 3.57Å; V3385-F3406 HydrophobicContact CG2-CD1 3.95Å; V3385-F3406 HydrophobicContact CG2-CE1 3.93Å; Y3396-F3406 CarbonylContact C-O 3.56Å; Y3396-F3406 WeakPolarHBondContact CA-O 3.31Å; I3397-F3406 HydrophobicContact CG2-CB 4.33Å; I3397-F3406 PolarHBondContact N-O 3.29Å; I3397-F3406 PolarHBondContact O-N 2.92Å; C3399-F3406 HydrophobicContact CB-CD2 4.45Å; C3399-F3406 HydrophobicContact CB-CE2 3.95Å; D3404-F3406 HydrophobicContact CB-CD2 4.3Å; D3404-F3406 HydrophobicContact CB-CE2 3.39Å; D3404-F3406 HydrophobicContact CB-CZ 3.57Å; D3404-F3406 WeakPolarHBondContact O-CE2 3.31Å; F3406-V3411 HydrophobicContact CB-CG1 3.82Å; F3406-V3411 HydrophobicContact CB-CG2 4.43Å; F3406-V3411 HydrophobicContact CD1-CG1 3.92Å; F3406-V3411 HydrophobicContact CG-CG1 4.05Å; F3406-W3425 HydrophobicContact CB-CH2 4.04Å; F3406-W3425 AromaticContact CD2-CH2 3.71Å; F3406-W3425 HydrophobicContact CD2-CH2 3.71Å; F3406-W3425 AromaticContact CD2-CZ3 3.7Å; F3406-W3425 HydrophobicContact CD2-CZ3 3.7Å; F3406-W3425 HydrophobicContact CE2-CH2 4.39Å; F3406-W3425 HydrophobicContact CE2-CZ3 4.31Å; F3406-W3425 AromaticContact CG-CH2 3.96Å; F3406-W3425 HydrophobicContact CG-CH2 3.96Å; F3406-W3425 HydrophobicContact CG-CZ3 4.36Å; F3406-C3427 HydrophobicContact CD2-CB 3.95Å; F3406-C3427 HydrophobicContact CE1-CB 4.06Å; F3406-C3427 HydrophobicContact CE2-CB 3.43Å; F3406-C3427 VanDerWaalsContact CE2-CB 3.43Å; F3406-C3427 HydrophobicContact CG-CB 4.47Å; F3406-C3427 HydrophobicContact CZ-CB 3.51Å; F3406-C3427 VanDerWaalsContact CZ-SG 3.58Å
3407	H	84.1	Confident	81.3	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	137	168.6	-52.2	112.7	0	0	0	110.1	C3384 C3386 T3388 R3394 E3395 Y3396 E3409 C3410 V3411	C3384-H3407 PolarHBondContact SG-N 3.5Å; C3386-H3407 VanDerWaalsContact SG-CE1 3.53Å; C3386-H3407 PolarHBondContact SG-ND1 3.39Å; T3388-H3407 PolarHBondContact OG1-CE1 3.34Å; T3388-H3407 VanDerWaalsContact OG1-CE1 3.25Å; R3394-H3407 VanDerWaalsContact CD-CD2 3.43Å; R3394-H3407 WeakPolarHBondContact CD-CD2 3.3Å; E3395-H3407 WeakPolarHBondContact O-CA 3.48Å; Y3396-H3407 AromaticContact CD1-CD2 3.73Å; Y3396-H3407 AromaticContact CD1-NE2 3.84Å; Y3396-H3407 AromaticContact CE1-CD2 3.39Å; Y3396-H3407 WeakPolarHBondContact CE1-CD2 3.23Å; Y3396-H3407 AromaticContact CE1-CE1 3.9Å; Y3396-H3407 AromaticContact CE1-NE2 3.02Å; Y3396-H3407 WeakPolarHBondContact CE1-NE2 3.32Å; Y3396-H3407 AromaticContact CE2-CD2 3.97Å; Y3396-H3407 AromaticContact CE2-NE2 3.95Å; Y3396-H3407 AromaticContact CZ-CD2 3.5Å; Y3396-H3407 VanDerWaalsContact CZ-CD2 3.5Å; Y3396-H3407 AromaticContact CZ-NE2 3.07Å; Y3396-H3407 PolarHBondContact OH-NE2 2.91Å; H3407-E3409 VanDerWaalsContact C-N 3.29Å; H3407-E3409 PolarHBondContact O-N 2.91Å; H3407-C3410 HydrophobicContact CB-CB 4.1Å; H3407-C3410 PolarHBondContact O-N 3.49Å; H3407-V3411 PolarHBondContact O-N 2.84Å
3408	F	83.1	Confident	80.6	Confident	24 Å²	24	55.7 Å²	55.7	11%	0.105	30%	0.301	C	S	.	.	H	α-helix	trans	-48.9	-51.1	175.7	-77.3	-102.5	0	0	0	111.5	E3395 I3397 C3410 V3411 G3412 L3413	E3395-F3408 HydrophobicContact CB-CD2 3.59Å; E3395-F3408 HydrophobicContact CB-CE2 3.84Å; I3397-F3408 HydrophobicContact CB-CD2 4.49Å; I3397-F3408 HydrophobicContact CB-CE1 4.46Å; I3397-F3408 HydrophobicContact CB-CE2 4Å; I3397-F3408 HydrophobicContact CB-CZ 3.97Å; F3408-C3410 PolarHBondContact O-N 2.79Å; F3408-C3410 VanDerWaalsContact O-N 3.16Å; F3408-V3411 PolarHBondContact O-N 3.45Å; F3408-V3411 VanDerWaalsContact O-N 3.13Å; F3408-G3412 PolarHBondContact O-N 2.86Å; F3408-G3412 VanDerWaalsContact O-N 3.17Å; F3408-L3413 CarbonylContact C-O 3.57Å; F3408-L3413 HydrophobicContact CB-CB 4.28Å; F3408-L3413 WeakPolarHBondContact CB-O 3.12Å; F3408-L3413 HydrophobicContact CD1-CB 3.8Å; F3408-L3413 HydrophobicContact CD1-CD1 4.22Å; F3408-L3413 HydrophobicContact CG-CB 4.47Å; F3408-L3413 PolarHBondContact O-N 2.9Å
3409	E	83.9	Confident	79.9	Confident	133 Å²	133	61.5 Å²	61.5	62%	0.621	33%	0.325	S	S	*	.	H	α-helix	trans	-48.7	-41	174.3	-58.3	176.1	159.3	0	0	113.5	R3394 H3407	R3394-E3409 IonicContact CZ-OE2 2.92Å; R3394-E3409 IonicContact NE-OE2 3.33Å; R3394-E3409 PolarHBondContact NE-OE2 3.38Å; R3394-E3409 IonicContact NH2-OE2 2.7Å; R3394-E3409 PolarHBondContact NH2-OE2 3.46Å; H3407-E3409 VanDerWaalsContact C-N 3.29Å; H3407-E3409 PolarHBondContact O-N 2.91Å
3410	C	83.3	Confident	79.1	Confident	46 Å²	46	68.7 Å²	68.7	31%	0.311	36%	0.357	S	S	.	.	H	α-helix	trans	-86.5	-8.6	-172.5	-67.8	0	0	0	0	114	C3384 H3407 F3408	C3384-C3410 WeakPolarHBondContact SG-CB 3.3Å; H3407-C3410 HydrophobicContact CB-CB 4.1Å; H3407-C3410 PolarHBondContact O-N 3.49Å; F3408-C3410 PolarHBondContact O-N 2.79Å; F3408-C3410 VanDerWaalsContact O-N 3.16Å
3411	V	83.2	Confident	78.3	Confident	30 Å²	30	68.4 Å²	68.4	18%	0.182	35%	0.354	C	S	.	.	H	α-helix	trans	-113.5	9.2	170.4	-69.2	0	0	0	0	112.9	I3397 F3406 H3407 F3408 L3413 W3425 P3428	I3397-V3411 HydrophobicContact CG2-CG2 4.21Å; F3406-V3411 HydrophobicContact CB-CG1 3.82Å; F3406-V3411 HydrophobicContact CB-CG2 4.43Å; F3406-V3411 HydrophobicContact CD1-CG1 3.92Å; F3406-V3411 HydrophobicContact CG-CG1 4.05Å; H3407-V3411 PolarHBondContact O-N 2.84Å; F3408-V3411 PolarHBondContact O-N 3.45Å; F3408-V3411 VanDerWaalsContact O-N 3.13Å; V3411-L3413 HydrophobicContact CG2-CD1 3.9Å; V3411-L3413 HydrophobicContact CG2-CG 4.08Å; V3411-W3425 HydrophobicContact CB-CH2 4.33Å; V3411-W3425 HydrophobicContact CB-CZ2 3.91Å; V3411-W3425 HydrophobicContact CG1-CH2 4.01Å; V3411-W3425 HydrophobicContact CG1-CZ2 4.04Å; V3411-W3425 HydrophobicContact CG2-CH2 4.04Å; V3411-W3425 HydrophobicContact CG2-CZ2 3.69Å; V3411-P3428 HydrophobicContact CG1-CG 4.3Å
3412	G	81	Confident	77.9	Confident	70 Å²	70	71 Å²	71	72%	0.722	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	27.7	175.6	0	0	0	0	0	114.2	F3408	F3408-G3412 PolarHBondContact O-N 2.86Å; F3408-G3412 VanDerWaalsContact O-N 3.17Å
3413	L	81.7	Confident	77.4	Confident	27 Å²	27	78.9 Å²	78.9	14%	0.141	42%	0.423	C	S	.	.			trans	-102.3	137.2	171.8	-61.8	172.8	0	0	0	109.5	I3397 F3408 V3411 L3421 W3425	I3397-L3413 HydrophobicContact CD1-CD1 4Å; I3397-L3413 HydrophobicContact CG2-CD1 4.28Å; F3408-L3413 CarbonylContact C-O 3.57Å; F3408-L3413 HydrophobicContact CB-CB 4.28Å; F3408-L3413 WeakPolarHBondContact CB-O 3.12Å; F3408-L3413 HydrophobicContact CD1-CB 3.8Å; F3408-L3413 HydrophobicContact CD1-CD1 4.22Å; F3408-L3413 HydrophobicContact CG-CB 4.47Å; F3408-L3413 PolarHBondContact O-N 2.9Å; V3411-L3413 HydrophobicContact CG2-CD1 3.9Å; V3411-L3413 HydrophobicContact CG2-CG 4.08Å; L3413-L3421 HydrophobicContact CD1-CD2 3.67Å; L3413-L3421 HydrophobicContact CD2-CD1 3.99Å; L3413-L3421 HydrophobicContact CD2-CD2 4.19Å; L3413-W3425 HydrophobicContact CD1-CZ2 4.4Å
3414	D	75.6	Confident	77.1	Confident	94 Å²	94	76.9 Å²	76.9	50%	0.503	43%	0.428	S	S	.	.			trans	-79.7	151.4	164.3	-97.9	-12.2	0	0	0	109.9	K3416 D3417	D3414-K3416 PolarHBondContact O-N 3.47Å; D3414-D3417 PolarHBondContact N-OD2 2.84Å; D3414-D3417 PolarHBondContact O-N 3.1Å
3415	P	74.4	Confident	77.2	Confident	68 Å²	68	75.8 Å²	75.8	44%	0.442	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-16.6	167.9	-31.6	38.4	0	0	0	115.3	E3395 S3418	E3395-P3415 VanDerWaalsContact OE2-CB 3.26Å; E3395-P3415 WeakPolarHBondContact OE2-CB 3.46Å; E3395-P3415 WeakPolarHBondContact OE2-CG 3.31Å; P3415-S3418 PolarHBondContact O-OG 2.77Å
3416	K	72.5	Confident	77	Confident	163 Å²	163	71.2 Å²	71.2	71%	0.709	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.5	-179.9	-60.2	167.5	-170.9	154.9	0	113.5	D3414	D3414-K3416 PolarHBondContact O-N 3.47Å
3417	D	72.2	Confident	76.9	Confident	40 Å²	40	71 Å²	71	21%	0.214	40%	0.403	C	S	.	.	S	Bend	trans	-91.8	-6.6	177.9	-66.5	-40.9	0	0	0	112.5	D3414 D3419 K3420 L3421	D3414-D3417 PolarHBondContact N-OD2 2.84Å; D3414-D3417 PolarHBondContact O-N 3.1Å; D3417-D3419 PolarHBondContact O-N 3.21Å; D3417-D3419 VanDerWaalsContact O-N 3.15Å; D3417-K3420 PolarHBondContact O-N 3.42Å; D3417-K3420 WeakPolarHBondContact OD1-CD 3.26Å; D3417-K3420 VanDerWaalsContact OD1-CE 3.3Å; D3417-K3420 WeakPolarHBondContact OD1-CE 3.02Å; D3417-K3420 IonicContact OD1-NZ 2.77Å; D3417-K3420 PolarHBondContact OD1-NZ 3.38Å; D3417-L3421 HydrophobicContact CB-CD1 4.32Å; D3417-L3421 WeakPolarHBondContact O-CD1 3.33Å; D3417-L3421 PolarHBondContact O-N 3.46Å
3418	S	68.9	Low	76.8	Confident	51 Å²	51	73.5 Å²	73.5	36%	0.357	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-39.2	169.7	56.9	0	0	0	0	112.8	P3415 K3420	P3415-S3418 PolarHBondContact O-OG 2.77Å; S3418-K3420 VanDerWaalsContact C-N 3.26Å; S3418-K3420 PolarHBondContact O-N 2.77Å
3419	D	71.4	Confident	76.8	Confident	148 Å²	148	75.7 Å²	75.7	79%	0.791	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.6	-175.4	-63.7	14.1	0	0	0	112.5	D3417	D3417-D3419 PolarHBondContact O-N 3.21Å; D3417-D3419 VanDerWaalsContact O-N 3.15Å
3420	K	71.4	Confident	76.7	Confident	155 Å²	155	69.5 Å²	69.5	67%	0.674	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-29.4	178.2	-55.7	177.9	-163.4	159.1	0	112.3	D3417 S3418	D3417-K3420 PolarHBondContact O-N 3.42Å; D3417-K3420 WeakPolarHBondContact OD1-CD 3.26Å; D3417-K3420 VanDerWaalsContact OD1-CE 3.3Å; D3417-K3420 WeakPolarHBondContact OD1-CE 3.02Å; D3417-K3420 IonicContact OD1-NZ 2.77Å; D3417-K3420 PolarHBondContact OD1-NZ 3.38Å; S3418-K3420 VanDerWaalsContact C-N 3.26Å; S3418-K3420 PolarHBondContact O-N 2.77Å
3421	L	67.1	Low	76.6	Confident	48 Å²	48	73.1 Å²	73.1	25%	0.251	41%	0.414	S	S	.	.	S	Bend	trans	-65.8	130.8	165.3	-88.4	61.1	0	0	0	107.8	I3397 L3413 D3417 W3425	I3397-L3421 HydrophobicContact CD1-CD2 3.48Å; I3397-L3421 VanDerWaalsContact CD1-CD2 3.48Å; L3413-L3421 HydrophobicContact CD1-CD2 3.67Å; L3413-L3421 HydrophobicContact CD2-CD1 3.99Å; L3413-L3421 HydrophobicContact CD2-CD2 4.19Å; D3417-L3421 HydrophobicContact CB-CD1 4.32Å; D3417-L3421 WeakPolarHBondContact O-CD1 3.33Å; D3417-L3421 PolarHBondContact O-N 3.46Å; L3421-W3425 HydrophobicContact CD2-CB 4.19Å; L3421-W3425 HydrophobicContact CD2-CG 3.87Å
3422	G	68.8	Low	76.4	Confident	56 Å²	56	76.4 Å²	76.4	58%	0.577	43%	0.427	S	S	*	.			trans	-76.6	-170.1	173.6	0	0	0	0	0	111.7	S3424	G3422-S3424 PolarHBondContact O-N 2.85Å
3423	D	70.2	Confident	76	Confident	178 Å²	178	73.9 Å²	73.9	95%	0.952	40%	0.399	S	S	*	.	S	Bend	trans	-63.7	1.2	179.3	-59.1	-35.4	0	0	0	114.6
3424	S	72.6	Confident	75.5	Confident	83 Å²	83	75.2 Å²	75.2	58%	0.58	41%	0.405	S	S	*	.			trans	-135	140.8	173.7	60.9	0	0	0	0	113.4	D3400 G3422	D3400-S3424 WeakPolarHBondContact OD2-CA 2.99Å; D3400-S3424 WeakPolarHBondContact OD2-CB 2.97Å; G3422-S3424 PolarHBondContact O-N 2.85Å
3425	W	83.4	Confident	75.4	Confident	37 Å²	37	74.6 Å²	74.6	14%	0.14	40%	0.401	C	S	.	.			trans	-145.7	131.5	176.5	175.5	80.6	0	0	0	112.9	I3397 C3399 D3400 F3406 V3411 L3413 L3421 C3427	I3397-W3425 HydrophobicContact CB-CE3 4.41Å; I3397-W3425 HydrophobicContact CB-CZ3 4.43Å; I3397-W3425 HydrophobicContact CD1-CB 3.91Å; I3397-W3425 HydrophobicContact CD1-CD2 3.62Å; I3397-W3425 HydrophobicContact CD1-CE3 3.88Å; I3397-W3425 HydrophobicContact CD1-CG 3.62Å; I3397-W3425 HydrophobicContact CG1-CD2 3.99Å; I3397-W3425 HydrophobicContact CG1-CE3 3.67Å; I3397-W3425 HydrophobicContact CG1-CG 4.37Å; I3397-W3425 HydrophobicContact CG1-CZ3 4.17Å; I3397-W3425 HydrophobicContact CG2-CD2 4.38Å; I3397-W3425 HydrophobicContact CG2-CE3 4.02Å; I3397-W3425 HydrophobicContact CG2-CH2 3.75Å; I3397-W3425 HydrophobicContact CG2-CZ2 4.15Å; I3397-W3425 HydrophobicContact CG2-CZ3 3.68Å; C3399-W3425 WeakPolarHBondContact CA-O 3.1Å; C3399-W3425 HydrophobicContact CB-CE3 3.92Å; C3399-W3425 HydrophobicContact CB-CZ3 3.67Å; D3400-W3425 PolarHBondContact N-O 2.94Å; D3400-W3425 PolarHBondContact OD2-N 3.5Å; F3406-W3425 HydrophobicContact CB-CH2 4.04Å; F3406-W3425 AromaticContact CD2-CH2 3.71Å; F3406-W3425 HydrophobicContact CD2-CH2 3.71Å; F3406-W3425 AromaticContact CD2-CZ3 3.7Å; F3406-W3425 HydrophobicContact CD2-CZ3 3.7Å; F3406-W3425 HydrophobicContact CE2-CH2 4.39Å; F3406-W3425 HydrophobicContact CE2-CZ3 4.31Å; F3406-W3425 AromaticContact CG-CH2 3.96Å; F3406-W3425 HydrophobicContact CG-CH2 3.96Å; F3406-W3425 HydrophobicContact CG-CZ3 4.36Å; V3411-W3425 HydrophobicContact CB-CH2 4.33Å; V3411-W3425 HydrophobicContact CB-CZ2 3.91Å; V3411-W3425 HydrophobicContact CG1-CH2 4.01Å; V3411-W3425 HydrophobicContact CG1-CZ2 4.04Å; V3411-W3425 HydrophobicContact CG2-CH2 4.04Å; V3411-W3425 HydrophobicContact CG2-CZ2 3.69Å; L3413-W3425 HydrophobicContact CD1-CZ2 4.4Å; L3421-W3425 HydrophobicContact CD2-CB 4.19Å; L3421-W3425 HydrophobicContact CD2-CG 3.87Å; W3425-C3427 HydrophobicContact CH2-CB 3.49Å; W3425-C3427 VanDerWaalsContact CH2-CB 3.49Å; W3425-C3427 HydrophobicContact CZ2-CB 4.11Å; W3425-C3427 HydrophobicContact CZ3-CB 3.87Å
3426	H	81.5	Confident	75.1	Confident	40 Å²	40	77.2 Å²	77.2	19%	0.185	41%	0.406	C	S	.	.			trans	-106.4	126.2	177.1	-58.1	170.9	0	0	0	110.4	L3401 K3431 E3434	L3401-H3426 HydrophobicContact CD1-CB 4.3Å; H3426-K3431 HydrophobicContact CB-CB 4.3Å; H3426-E3434 IonicContact CE1-OE1 2.61Å; H3426-E3434 PolarHBondContact CE1-OE1 2.88Å; H3426-E3434 IonicContact CE1-OE2 2.73Å; H3426-E3434 IonicContact CG-OE2 3.15Å; H3426-E3434 IonicContact ND1-OE1 3Å; H3426-E3434 PolarHBondContact ND1-OE1 2.84Å; H3426-E3434 IonicContact ND1-OE2 2.66Å; H3426-E3434 PolarHBondContact ND1-OE2 2.72Å
3427	C	84.3	Confident	74.6	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.377	C	S	.	.			trans	-65	159.4	173.9	76.1	0	0	0	0	111.2	C3399 C3402 F3406 W3425 D3429 C3430 K3431	C3399-C3427 HydrophobicContact CB-CB 3.88Å; C3399-C3427 PolarHBondContact SG-N 2.67Å; C3402-C3427 VanDerWaalsContact SG-SG 3.67Å; F3406-C3427 HydrophobicContact CD2-CB 3.95Å; F3406-C3427 HydrophobicContact CE1-CB 4.06Å; F3406-C3427 HydrophobicContact CE2-CB 3.43Å; F3406-C3427 VanDerWaalsContact CE2-CB 3.43Å; F3406-C3427 HydrophobicContact CG-CB 4.47Å; F3406-C3427 HydrophobicContact CZ-CB 3.51Å; F3406-C3427 VanDerWaalsContact CZ-SG 3.58Å; W3425-C3427 HydrophobicContact CH2-CB 3.49Å; W3425-C3427 VanDerWaalsContact CH2-CB 3.49Å; W3425-C3427 HydrophobicContact CZ2-CB 4.11Å; W3425-C3427 HydrophobicContact CZ3-CB 3.87Å; C3427-D3429 PolarHBondContact O-N 3.33Å; C3427-C3430 PolarHBondContact O-N 3.02Å; C3427-C3430 PolarHBondContact SG-SG 3.48Å; C3427-K3431 WeakPolarHBondContact O-CB 3.41Å; C3427-K3431 PolarHBondContact O-N 3.23Å
3428	P	82.7	Confident	74.2	Confident	52 Å²	52	74.1 Å²	74.1	34%	0.338	40%	0.399	S	S	.	.	H	α-helix	trans	-59.1	-31.7	-175.4	21.4	-33.4	0	0	0	114	V3411 Q3432	V3411-P3428 HydrophobicContact CG1-CG 4.3Å; P3428-Q3432 WeakPolarHBondContact O-CB 3.4Å; P3428-Q3432 VanDerWaalsContact O-CG 3.24Å; P3428-Q3432 WeakPolarHBondContact O-CG 3.49Å; P3428-Q3432 PolarHBondContact O-N 2.96Å; P3428-Q3432 PolarHBondContact O-NE2 3.28Å
3429	D	82.7	Confident	74	Confident	70 Å²	70	77 Å²	77	37%	0.374	41%	0.407	S	S	.	.	H	α-helix	trans	-62	-51.6	173.5	-58.8	-11.4	0	0	0	110.8	C3427 Q3432 A3433 K3559	C3427-D3429 PolarHBondContact O-N 3.33Å; D3429-Q3432 PolarHBondContact O-N 3.44Å; D3429-A3433 PolarHBondContact O-N 2.91Å; D3429-K3559 IonicContact OD2-NZ 3.59Å; D3429-K3559 PolarHBondContact OD2-NZ 3.01Å
3430	C	81.8	Confident	73.6	Confident	4 Å²	4	73.4 Å²	73.4	3%	0.027	39%	0.386	C	S	.	.	H	α-helix	trans	-69.4	-39.6	-177.4	-69.4	0	0	0	0	112	L3401 C3402 C3427 Q3432 A3433 E3434 M3560	L3401-C3430 HydrophobicContact CB-CB 4.13Å; L3401-C3430 HydrophobicContact CD1-CB 3.85Å; C3402-C3430 PolarHBondContact SG-SG 2.78Å; C3427-C3430 PolarHBondContact O-N 3.02Å; C3427-C3430 PolarHBondContact SG-SG 3.48Å; C3430-Q3432 VanDerWaalsContact C-N 3.3Å; C3430-Q3432 PolarHBondContact O-N 3.3Å; C3430-A3433 PolarHBondContact O-N 2.97Å; C3430-A3433 VanDerWaalsContact O-N 3.14Å; C3430-E3434 VanDerWaalsContact O-CB 3.28Å; C3430-E3434 WeakPolarHBondContact O-CB 3.5Å; C3430-E3434 PolarHBondContact O-N 3.45Å; C3430-M3560 WeakPolarHBondContact SG-CE 3.33Å
3431	K	81.7	Confident	73.7	Confident	121 Å²	121	69.6 Å²	69.6	53%	0.526	37%	0.373	S	S	.	.	H	α-helix	trans	-64.8	-34.7	174.4	-169.6	170.7	-176.5	173.2	0	111.9	H3426 C3427 L3435	H3426-K3431 HydrophobicContact CB-CB 4.3Å; C3427-K3431 WeakPolarHBondContact O-CB 3.41Å; C3427-K3431 PolarHBondContact O-N 3.23Å; K3431-L3435 HydrophobicContact CG-CD1 4.43Å; K3431-L3435 WeakPolarHBondContact O-CB 3.23Å; K3431-L3435 VanDerWaalsContact O-CG 3.23Å; K3431-L3435 WeakPolarHBondContact O-CG 3.44Å; K3431-L3435 PolarHBondContact O-N 3.28Å
3432	Q	79.5	Confident	74.2	Confident	99 Å²	99	69.7 Å²	69.7	46%	0.463	37%	0.37	S	S	.	.	H	α-helix	trans	-70.5	-34.8	170.5	-78.4	175.9	63	0	0	112.9	P3428 D3429 C3430 K3436	P3428-Q3432 WeakPolarHBondContact O-CB 3.4Å; P3428-Q3432 VanDerWaalsContact O-CG 3.24Å; P3428-Q3432 WeakPolarHBondContact O-CG 3.49Å; P3428-Q3432 PolarHBondContact O-N 2.96Å; P3428-Q3432 PolarHBondContact O-NE2 3.28Å; D3429-Q3432 PolarHBondContact O-N 3.44Å; C3430-Q3432 VanDerWaalsContact C-N 3.3Å; C3430-Q3432 PolarHBondContact O-N 3.3Å; Q3432-K3436 VanDerWaalsContact O-CB 3.3Å; Q3432-K3436 WeakPolarHBondContact O-CB 3.25Å; Q3432-K3436 WeakPolarHBondContact O-CD 3.35Å; Q3432-K3436 WeakPolarHBondContact O-CG 3.5Å; Q3432-K3436 PolarHBondContact O-N 2.95Å
3433	A	72.1	Confident	74.8	Confident	17 Å²	17	67.2 Å²	67.2	14%	0.14	34%	0.344	C	S	.	.	H	α-helix	trans	-68.9	-42	175.3	0	0	0	0	0	111.6	D3429 C3430 K3436 A3437 I3630	D3429-A3433 PolarHBondContact O-N 2.91Å; C3430-A3433 PolarHBondContact O-N 2.97Å; C3430-A3433 VanDerWaalsContact O-N 3.14Å; A3433-K3436 PolarHBondContact O-N 3.12Å; A3433-A3437 VanDerWaalsContact O-CB 3.28Å; A3433-A3437 WeakPolarHBondContact O-CB 3.44Å; A3433-A3437 PolarHBondContact O-N 2.73Å; A3433-I3630 HydrophobicContact CB-CG2 3.98Å
3434	E	71.7	Confident	75.4	Confident	55 Å²	55	63.4 Å²	63.4	26%	0.257	33%	0.327	S	S	.	.	H	α-helix	trans	-60.1	-47.6	172.1	179.2	178	-148.3	0	0	111.5	H3426 C3430 A3437 N3438 I3630	H3426-E3434 IonicContact CE1-OE1 2.61Å; H3426-E3434 PolarHBondContact CE1-OE1 2.88Å; H3426-E3434 IonicContact CE1-OE2 2.73Å; H3426-E3434 IonicContact CG-OE2 3.15Å; H3426-E3434 IonicContact ND1-OE1 3Å; H3426-E3434 PolarHBondContact ND1-OE1 2.84Å; H3426-E3434 IonicContact ND1-OE2 2.66Å; H3426-E3434 PolarHBondContact ND1-OE2 2.72Å; C3430-E3434 VanDerWaalsContact O-CB 3.28Å; C3430-E3434 WeakPolarHBondContact O-CB 3.5Å; C3430-E3434 PolarHBondContact O-N 3.45Å; E3434-A3437 PolarHBondContact O-N 2.83Å; E3434-N3438 PolarHBondContact O-N 3.16Å; E3434-N3438 VanDerWaalsContact O-N 3.09Å; E3434-N3438 PolarHBondContact O-ND2 3.15Å; E3434-I3630 HydrophobicContact CB-CD1 4.26Å
3435	L	72	Confident	75.8	Confident	82 Å²	82	62.2 Å²	62.2	43%	0.429	32%	0.318	S	S	.	.	H	α-helix	trans	-61.5	-48.9	173.7	-74.2	168.5	0	0	0	111.7	K3431 A3437 N3438 E3439	K3431-L3435 HydrophobicContact CG-CD1 4.43Å; K3431-L3435 WeakPolarHBondContact O-CB 3.23Å; K3431-L3435 VanDerWaalsContact O-CG 3.23Å; K3431-L3435 WeakPolarHBondContact O-CG 3.44Å; K3431-L3435 PolarHBondContact O-N 3.28Å; L3435-A3437 VanDerWaalsContact C-N 3.29Å; L3435-A3437 PolarHBondContact O-N 3.48Å; L3435-N3438 CarbonylContact O-C 3.49Å; L3435-N3438 PolarHBondContact O-N 3.5Å; L3435-N3438 VanDerWaalsContact O-N 3.11Å; L3435-E3439 VanDerWaalsContact O-CB 3.3Å; L3435-E3439 WeakPolarHBondContact O-CB 3.4Å; L3435-E3439 VanDerWaalsContact O-CG 3.26Å; L3435-E3439 WeakPolarHBondContact O-CG 3.17Å; L3435-E3439 PolarHBondContact O-N 3.06Å
3436	K	69.7	Low	75.5	Confident	122 Å²	122	66.7 Å²	66.7	53%	0.53	34%	0.335	S	S	.	.	H	α-helix	trans	-63.3	-30.7	178.5	-73.9	166.5	-175	165.4	0	113.8	Q3432 A3433	Q3432-K3436 VanDerWaalsContact O-CB 3.3Å; Q3432-K3436 WeakPolarHBondContact O-CB 3.25Å; Q3432-K3436 WeakPolarHBondContact O-CD 3.35Å; Q3432-K3436 WeakPolarHBondContact O-CG 3.5Å; Q3432-K3436 PolarHBondContact O-N 2.95Å; A3433-K3436 PolarHBondContact O-N 3.12Å
3437	A	60.6	Low	75.1	Confident	14 Å²	14	66.4 Å²	66.4	12%	0.116	34%	0.336	C	S	.	.	H	α-helix	trans	-70.3	-38.4	173.8	0	0	0	0	0	111.9	A3433 E3434 L3435 M3440 A3633	A3433-A3437 VanDerWaalsContact O-CB 3.28Å; A3433-A3437 WeakPolarHBondContact O-CB 3.44Å; A3433-A3437 PolarHBondContact O-N 2.73Å; E3434-A3437 PolarHBondContact O-N 2.83Å; L3435-A3437 VanDerWaalsContact C-N 3.29Å; L3435-A3437 PolarHBondContact O-N 3.48Å; A3437-M3440 WeakPolarHBondContact O-CE 3.49Å; A3437-A3633 HydrophobicContact CB-CB 3.54Å
3438	N	63.2	Low	74.8	Confident	124 Å²	124	70.1 Å²	70.1	66%	0.663	36%	0.36	S	S	*	.	H	α-helix	trans	-77.2	-32.2	176.4	-70.8	-48.7	0	0	0	112.8	E3434 L3435 M3440	E3434-N3438 PolarHBondContact O-N 3.16Å; E3434-N3438 VanDerWaalsContact O-N 3.09Å; E3434-N3438 PolarHBondContact O-ND2 3.15Å; L3435-N3438 CarbonylContact O-C 3.49Å; L3435-N3438 PolarHBondContact O-N 3.5Å; L3435-N3438 VanDerWaalsContact O-N 3.11Å; N3438-M3440 PolarHBondContact O-N 3.34Å
3439	E	66.7	Low	74.4	Confident	112 Å²	112	74.2 Å²	74.2	52%	0.523	37%	0.369	S	S	.	.			trans	-78.2	38.6	176.1	-70	171.5	-166.8	0	0	112.8	L3435 L3441	L3435-E3439 VanDerWaalsContact O-CB 3.3Å; L3435-E3439 WeakPolarHBondContact O-CB 3.4Å; L3435-E3439 VanDerWaalsContact O-CG 3.26Å; L3435-E3439 WeakPolarHBondContact O-CG 3.17Å; L3435-E3439 PolarHBondContact O-N 3.06Å; E3439-L3441 WeakPolarHBondContact O-CG 3.02Å; E3439-L3441 PolarHBondContact O-N 2.91Å
3440	M	62.3	Low	74.1	Confident	73 Å²	73	74.5 Å²	74.5	36%	0.36	37%	0.369	S	S	.	.			trans	-64.8	105.5	171.3	-85.4	-168.2	-87.2	0	0	109.9	A3437 N3438 Y3442 A3633	A3437-M3440 WeakPolarHBondContact O-CE 3.49Å; N3438-M3440 PolarHBondContact O-N 3.34Å; M3440-Y3442 HydrophobicContact CB-CE2 4.05Å; M3440-Y3442 WeakPolarHBondContact O-CD2 3.45Å; M3440-Y3442 WeakPolarHBondContact O-CE2 3.48Å; M3440-A3633 HydrophobicContact CE-CB 4.26Å
3441	L	73.1	Confident	73.8	Confident	75 Å²	75	79.2 Å²	79.2	39%	0.393	40%	0.399	S	S	.	.			trans	-88.7	118.1	-177.2	-56.4	-176.9	0	0	0	111.4	E3439 R3446 T3447	E3439-L3441 WeakPolarHBondContact O-CG 3.02Å; E3439-L3441 PolarHBondContact O-N 2.91Å; L3441-R3446 HydrophobicContact CB-CB 4.17Å; L3441-R3446 HydrophobicContact CD1-CB 4.14Å; L3441-T3447 CarbonylContact C-O 3.6Å; L3441-T3447 WeakPolarHBondContact CA-O 3.45Å
3442	Y	78	Confident	73.8	Confident	50 Å²	50	80 Å²	80	20%	0.196	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-96.4	165.4	179.8	-59.3	-86.2	0	0	0	111.4	M3440 R3446 T3447 W3464	M3440-Y3442 HydrophobicContact CB-CE2 4.05Å; M3440-Y3442 WeakPolarHBondContact O-CD2 3.45Å; M3440-Y3442 WeakPolarHBondContact O-CE2 3.48Å; Y3442-R3446 VanDerWaalsContact O-CA 3.26Å; Y3442-R3446 WeakPolarHBondContact O-CA 3.39Å; Y3442-R3446 PolarHBondContact O-N 3.48Å; Y3442-T3447 PolarHBondContact N-O 3.19Å; Y3442-T3447 PolarHBondContact O-N 2.9Å; Y3442-W3464 HydrophobicContact CD1-CB 3.92Å; Y3442-W3464 HydrophobicContact CD1-CG 4.25Å
3443	C	81.4	Confident	74	Confident	4 Å²	4	78.9 Å²	78.9	3%	0.027	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	169.5	174.2	-167.5	0	0	0	0	115.3	C3445 R3446 W3464 H3466 C3469	C3443-C3445 VanDerWaalsContact CB-SG 3.57Å; C3443-C3445 PolarHBondContact O-N 3.38Å; C3443-C3445 VanDerWaalsContact SG-SG 3.6Å; C3443-R3446 WeakPolarHBondContact O-CD 3.39Å; C3443-R3446 PolarHBondContact O-N 2.82Å; C3443-R3446 VanDerWaalsContact O-N 3.13Å; C3443-W3464 WeakPolarHBondContact CA-O 3.46Å; C3443-W3464 PolarHBondContact N-O 3.3Å; C3443-H3466 PolarHBondContact SG-N 3.32Å; C3443-H3466 PolarHBondContact SG-ND1 2.9Å; C3443-H3466 VanDerWaalsContact SG-ND1 3.37Å; C3443-C3469 WeakPolarHBondContact SG-CB 3.21Å
3444	V	82.3	Confident	74.5	Confident	98 Å²	98	81 Å²	81	59%	0.594	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-31.1	174.2	-175.2	0	0	0	0	111.3	R3446 Y3465	V3444-R3446 VanDerWaalsContact C-N 3.27Å; V3444-R3446 PolarHBondContact O-N 3.32Å; V3444-Y3465 HydrophobicContact CG2-CD1 3.82Å; V3444-Y3465 HydrophobicContact CG2-CE1 3.71Å
3445	C	81.6	Confident	75.3	Confident	58 Å²	58	79.8 Å²	79.8	39%	0.392	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-8.4	177.5	60	0	0	0	0	114.4	C3443 T3447 H3466	C3443-C3445 VanDerWaalsContact CB-SG 3.57Å; C3443-C3445 PolarHBondContact O-N 3.38Å; C3443-C3445 VanDerWaalsContact SG-SG 3.6Å; C3445-T3447 HydrophobicContact CB-CG2 4.37Å; C3445-T3447 PolarHBondContact O-N 3.48Å; C3445-H3466 PolarHBondContact SG-CE1 2.89Å; C3445-H3466 PolarHBondContact SG-ND1 3.4Å
3446	R	77	Confident	76	Confident	131 Å²	131	76.6 Å²	76.6	49%	0.494	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	52.9	177.6	-60.2	-63.1	-168.9	-178.1	2.9	113.4	L3441 Y3442 C3443 V3444	L3441-R3446 HydrophobicContact CB-CB 4.17Å; L3441-R3446 HydrophobicContact CD1-CB 4.14Å; Y3442-R3446 VanDerWaalsContact O-CA 3.26Å; Y3442-R3446 WeakPolarHBondContact O-CA 3.39Å; Y3442-R3446 PolarHBondContact O-N 3.48Å; C3443-R3446 WeakPolarHBondContact O-CD 3.39Å; C3443-R3446 PolarHBondContact O-N 2.82Å; C3443-R3446 VanDerWaalsContact O-N 3.13Å; V3444-R3446 VanDerWaalsContact C-N 3.27Å; V3444-R3446 PolarHBondContact O-N 3.32Å
3447	T	72	Confident	76.9	Confident	34 Å²	34	72.6 Å²	72.6	21%	0.209	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-99.2	155.9	172.9	65.3	0	0	0	0	111.1	L3441 Y3442 C3445 H3466	L3441-T3447 CarbonylContact C-O 3.6Å; L3441-T3447 WeakPolarHBondContact CA-O 3.45Å; Y3442-T3447 PolarHBondContact N-O 3.19Å; Y3442-T3447 PolarHBondContact O-N 2.9Å; C3445-T3447 HydrophobicContact CB-CG2 4.37Å; C3445-T3447 PolarHBondContact O-N 3.48Å; T3447-H3466 PolarHBondContact OG1-CE1 3.03Å
3448	P	78.3	Confident	78.2	Confident	77 Å²	77	72 Å²	72	50%	0.5	38%	0.378	S	S	.	.			trans	-61.5	169.7	166.4	28.7	-36.5	0	0	0	111.8	E3450	P3448-E3450 PolarHBondContact O-N 2.8Å
3449	Y	75.3	Confident	79.1	Confident	139 Å²	139	69.2 Å²	69.2	55%	0.545	36%	0.363	S	S	.	.			trans	-71.2	107	179.1	179	-108.5	0	0	0	112.6	P3451 Y3455	Y3449-P3451 HydrophobicContact CE1-CB 3.82Å; Y3449-P3451 WeakPolarHBondContact O-CD 3.31Å; Y3449-Y3455 HydrophobicContact CD2-CD2 4.44Å; Y3449-Y3455 AromaticContact CD2-CE2 3.85Å; Y3449-Y3455 HydrophobicContact CD2-CE2 3.85Å; Y3449-Y3455 AromaticContact CD2-CZ 3.91Å; Y3449-Y3455 HydrophobicContact CE2-CD2 4.01Å; Y3449-Y3455 AromaticContact CE2-CE2 3.69Å; Y3449-Y3455 HydrophobicContact CE2-CE2 3.69Å
3450	E	76.2	Confident	79.6	Confident	76 Å²	76	64.7 Å²	64.7	36%	0.355	35%	0.347	S	S	.	.			trans	-87.2	108.3	168.7	-62.3	175	151.6	0	0	110.3	P3448 T3452 R3453 Y3455	P3448-E3450 PolarHBondContact O-N 2.8Å; E3450-T3452 PolarHBondContact O-N 2.96Å; E3450-R3453 HydrophobicContact CB-CB 4.25Å; E3450-R3453 PolarHBondContact O-N 3.44Å; E3450-R3453 WeakPolarHBondContact OE2-CD 3.18Å; E3450-R3453 IonicContact OE2-NH1 2.77Å; E3450-R3453 PolarHBondContact OE2-NH1 3.2Å; E3450-Y3455 PolarHBondContact N-OH 2.95Å; E3450-Y3455 WeakPolarHBondContact O-CE2 3.49Å; E3450-Y3455 PolarHBondContact O-OH 3.49Å
3451	P	76	Confident	80.5	Confident	103 Å²	103	62.2 Å²	62.2	67%	0.669	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-7.8	-177.2	28.1	-36.3	0	0	0	114.3	Y3449	Y3449-P3451 HydrophobicContact CE1-CB 3.82Å; Y3449-P3451 WeakPolarHBondContact O-CD 3.31Å
3452	T	80.7	Confident	80.7	Confident	136 Å²	136	61 Å²	61	83%	0.834	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-11.4	177.2	46.9	0	0	0	0	113.9	E3450	E3450-T3452 PolarHBondContact O-N 2.96Å
3453	R	83.2	Confident	80.9	Confident	76 Å²	76	59.5 Å²	59.5	29%	0.287	33%	0.325	S	S	.	.	S	Bend	trans	-106.7	146.3	-173.3	-157.2	162.5	176.4	-161	-3.4	110.8	E3450 Y3455 H3466 E3468	E3450-R3453 HydrophobicContact CB-CB 4.25Å; E3450-R3453 PolarHBondContact O-N 3.44Å; E3450-R3453 WeakPolarHBondContact OE2-CD 3.18Å; E3450-R3453 IonicContact OE2-NH1 2.77Å; E3450-R3453 PolarHBondContact OE2-NH1 3.2Å; R3453-Y3455 HydrophobicContact CB-CE2 4.15Å; R3453-Y3455 WeakPolarHBondContact O-CD2 3.45Å; R3453-Y3455 WeakPolarHBondContact O-CE2 3.43Å; R3453-H3466 VanDerWaalsContact CD-CD2 3.49Å; R3453-H3466 WeakPolarHBondContact CD-CD2 3.45Å; R3453-H3466 PolarHBondContact NH1-CE1 2.9Å; R3453-E3468 IonicContact CZ-OE2 3.44Å; R3453-E3468 IonicContact NE-OE2 3.41Å; R3453-E3468 PolarHBondContact NE-OE2 2.97Å; R3453-E3468 IonicContact NH2-OE2 2.67Å; R3453-E3468 PolarHBondContact NH2-OE2 2.86Å
3454	V	83.6	Confident	81.2	Confident	62 Å²	62	65.2 Å²	65.2	38%	0.376	35%	0.346	S	S	.	.			trans	-75	142.4	175.3	-178.4	0	0	0	0	109.2	P3467 P3474 A3477	V3454-P3467 HydrophobicContact CB-CG 4.2Å; V3454-P3467 HydrophobicContact CG1-CG 3.9Å; V3454-P3467 WeakPolarHBondContact O-CD 3.45Å; V3454-P3474 HydrophobicContact CB-CB 4.44Å; V3454-P3474 HydrophobicContact CG2-CB 4.2Å; V3454-A3477 HydrophobicContact CG1-CB 4.5Å
3455	Y	87.8	Confident	81.5	Confident	29 Å²	29	61.5 Å²	61.5	11%	0.114	32%	0.321	C	S	.	.			trans	-129.4	148.9	171.6	-60.8	-105.4	0	0	0	110.1	Y3449 E3450 R3453 W3464 Y3465 H3466	Y3449-Y3455 HydrophobicContact CD2-CD2 4.44Å; Y3449-Y3455 AromaticContact CD2-CE2 3.85Å; Y3449-Y3455 HydrophobicContact CD2-CE2 3.85Å; Y3449-Y3455 AromaticContact CD2-CZ 3.91Å; Y3449-Y3455 HydrophobicContact CE2-CD2 4.01Å; Y3449-Y3455 AromaticContact CE2-CE2 3.69Å; Y3449-Y3455 HydrophobicContact CE2-CE2 3.69Å; E3450-Y3455 PolarHBondContact N-OH 2.95Å; E3450-Y3455 WeakPolarHBondContact O-CE2 3.49Å; E3450-Y3455 PolarHBondContact O-OH 3.49Å; R3453-Y3455 HydrophobicContact CB-CE2 4.15Å; R3453-Y3455 WeakPolarHBondContact O-CD2 3.45Å; R3453-Y3455 WeakPolarHBondContact O-CE2 3.43Å; Y3455-W3464 HydrophobicContact CD1-CB 4.13Å; Y3455-Y3465 CarbonylContact C-O 3.58Å; Y3455-Y3465 VanDerWaalsContact CA-O 3.23Å; Y3455-Y3465 WeakPolarHBondContact CA-O 3.39Å; Y3455-H3466 AromaticContact CD1-CD2 3.77Å; Y3455-H3466 AromaticContact CD1-NE2 4Å; Y3455-H3466 AromaticContact CE1-CD2 3.33Å; Y3455-H3466 WeakPolarHBondContact CE1-CD2 3.45Å; Y3455-H3466 AromaticContact CE1-NE2 3.11Å; Y3455-H3466 WeakPolarHBondContact CE1-NE2 3.41Å; Y3455-H3466 AromaticContact CZ-CD2 3.56Å; Y3455-H3466 AromaticContact CZ-NE2 3.26Å; Y3455-H3466 VanDerWaalsContact CZ-NE2 3.26Å; Y3455-H3466 PolarHBondContact OH-NE2 3.11Å; Y3455-H3466 VanDerWaalsContact OH-NE2 3.11Å
3456	I	87.9	Confident	81.8	Confident	15 Å²	15	58.7 Å²	58.7	8%	0.077	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.7	168.5	-169.5	168.1	0	0	0	108.9	W3464 Y3465 V3470 L3472 A3477 H3480 Y3484	I3456-W3464 WeakPolarHBondContact O-CA 3.26Å; I3456-Y3465 PolarHBondContact N-O 2.96Å; I3456-Y3465 PolarHBondContact O-N 2.96Å; I3456-V3470 HydrophobicContact CG2-CG2 4.17Å; I3456-L3472 HydrophobicContact CD1-CD1 3.83Å; I3456-A3477 HydrophobicContact CB-CB 4.41Å; I3456-A3477 HydrophobicContact CD1-CB 4.34Å; I3456-H3480 HydrophobicContact CD1-CB 4.35Å; I3456-Y3484 HydrophobicContact CD1-CD1 3.8Å; I3456-Y3484 HydrophobicContact CD1-CD2 3.73Å; I3456-Y3484 HydrophobicContact CD1-CE1 4.32Å; I3456-Y3484 HydrophobicContact CD1-CE2 4.26Å; I3456-Y3484 HydrophobicContact CD1-CG 3.49Å; I3456-Y3484 VanDerWaalsContact CD1-CG 3.49Å; I3456-Y3484 HydrophobicContact CG1-CD1 3.78Å; I3456-Y3484 HydrophobicContact CG1-CE1 4.35Å; I3456-Y3484 HydrophobicContact CG1-CG 3.93Å; I3456-Y3484 HydrophobicContact CG2-CD1 4.21Å; I3456-Y3484 HydrophobicContact CG2-CE1 3.92Å
3457	A	87.3	Confident	82.3	Confident	39 Å²	39	52.7 Å²	52.7	32%	0.322	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	144.6	175.9	0	0	0	0	0	110.2	W3464 Y3484	A3457-W3464 HydrophobicContact CB-CD2 4.04Å; A3457-W3464 HydrophobicContact CB-CE3 3.99Å; A3457-W3464 HydrophobicContact CB-CH2 4.41Å; A3457-W3464 HydrophobicContact CB-CZ2 4.42Å; A3457-W3464 HydrophobicContact CB-CZ3 4.19Å; A3457-Y3484 WeakPolarHBondContact O-CD1 3.47Å
3458	C	88.1	Confident	83	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.007	30%	0.297	C	S	.	.			trans	-103.6	118	179.5	167.7	0	0	0	0	112.2	G3460 C3461 D3462 E3463 Y3465 Y3484 C3486	C3458-G3460 PolarHBondContact O-N 3.06Å; C3458-G3460 PolarHBondContact SG-N 3.41Å; C3458-C3461 PolarHBondContact O-N 2.8Å; C3458-C3461 VanDerWaalsContact O-N 3.09Å; C3458-D3462 WeakPolarHBondContact O-CA 3.49Å; C3458-D3462 PolarHBondContact O-N 2.93Å; C3458-E3463 PolarHBondContact N-O 3.45Å; C3458-Y3465 HydrophobicContact CB-CD2 4.23Å; C3458-Y3465 HydrophobicContact CB-CE2 3.78Å; C3458-Y3484 CarbonylContact C-O 2.93Å; C3458-Y3484 WeakPolarHBondContact CA-O 3.26Å; C3458-Y3484 HydrophobicContact CB-CD1 4.1Å; C3458-Y3484 HydrophobicContact CB-CE1 4.25Å; C3458-C3486 HydrophobicContact CB-CB 3.95Å; C3458-C3486 PolarHBondContact SG-N 3.28Å
3459	D	83.3	Confident	83.4	Confident	66 Å²	66	55.5 Å²	55.5	35%	0.353	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-19.1	-178.4	-54.8	-64.6	0	0	0	113.8	T3483 Y3484	D3459-T3483 VanDerWaalsContact OD2-C 3.3Å; D3459-T3483 WeakPolarHBondContact OD2-CA 3.12Å; D3459-T3483 WeakPolarHBondContact OD2-CB 3.44Å; D3459-Y3484 PolarHBondContact N-O 3.4Å; D3459-Y3484 PolarHBondContact OD2-N 3.43Å
3460	G	76.2	Confident	84	Confident	17 Å²	17	49.8 Å²	49.8	18%	0.175	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-10	178.6	0	0	0	0	0	115.6	C3458 C3489 I3535	C3458-G3460 PolarHBondContact O-N 3.06Å; C3458-G3460 PolarHBondContact SG-N 3.41Å; G3460-C3489 VanDerWaalsContact C-SG 3.52Å; G3460-C3489 PolarHBondContact O-SG 2.88Å; G3460-I3535 WeakPolarHBondContact O-CD1 3.45Å
3461	C	80.7	Confident	84.3	Confident	21 Å²	21	49.4 Å²	49.4	14%	0.142	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-150.8	-10.1	179.5	61.5	0	0	0	0	115.5	C3458 E3463	C3458-C3461 PolarHBondContact O-N 2.8Å; C3458-C3461 VanDerWaalsContact O-N 3.09Å; C3461-E3463 PolarHBondContact O-N 3.43Å
3462	D	77.7	Confident	84.8	Confident	49 Å²	49	45.9 Å²	45.9	26%	0.262	26%	0.261	S	S	.	.			trans	61.9	17.8	-175.2	-49.5	-79.1	0	0	0	115.2	C3458 Y3536 K3643	C3458-D3462 WeakPolarHBondContact O-CA 3.49Å; C3458-D3462 PolarHBondContact O-N 2.93Å; D3462-Y3536 WeakPolarHBondContact OD1-CE2 3.47Å; D3462-Y3536 PolarHBondContact OD1-OH 2.88Å; D3462-Y3536 WeakPolarHBondContact OD2-CE2 3.38Å; D3462-Y3536 PolarHBondContact OD2-OH 3.22Å; D3462-K3643 IonicContact OD2-NZ 3.27Å; D3462-K3643 PolarHBondContact OD2-NZ 3.03Å
3463	E	83	Confident	85	Confident	18 Å²	18	42.2 Å²	42.2	8%	0.084	24%	0.238	C	C	.	.			trans	-83.2	144.1	171.1	-70.3	-69	-169.8	0	0	111.8	C3458 C3461 Y3465 K3640	C3458-E3463 PolarHBondContact N-O 3.45Å; C3461-E3463 PolarHBondContact O-N 3.43Å; E3463-Y3465 HydrophobicContact CB-CD2 4.5Å; E3463-Y3465 HydrophobicContact CB-CE2 3.66Å; E3463-Y3465 WeakPolarHBondContact O-CD2 3.13Å; E3463-Y3465 WeakPolarHBondContact O-CE2 3.13Å; E3463-K3640 WeakPolarHBondContact OE1-CD 3.21Å; E3463-K3640 VanDerWaalsContact OE1-CE 3.25Å; E3463-K3640 WeakPolarHBondContact OE1-CE 3.36Å; E3463-K3640 IonicContact OE1-NZ 3.03Å; E3463-K3640 PolarHBondContact OE1-NZ 2.79Å; E3463-K3640 IonicContact OE2-NZ 2.72Å; E3463-K3640 PolarHBondContact OE2-NZ 3.23Å
3464	W	87.4	Confident	85	Confident	125 Å²	125	41.4 Å²	41.4	47%	0.473	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	135.6	175.1	-62.8	79.9	0	0	0	110.5	Y3442 C3443 Y3455 I3456 A3457	Y3442-W3464 HydrophobicContact CD1-CB 3.92Å; Y3442-W3464 HydrophobicContact CD1-CG 4.25Å; C3443-W3464 WeakPolarHBondContact CA-O 3.46Å; C3443-W3464 PolarHBondContact N-O 3.3Å; Y3455-W3464 HydrophobicContact CD1-CB 4.13Å; I3456-W3464 WeakPolarHBondContact O-CA 3.26Å; A3457-W3464 HydrophobicContact CB-CD2 4.04Å; A3457-W3464 HydrophobicContact CB-CE3 3.99Å; A3457-W3464 HydrophobicContact CB-CH2 4.41Å; A3457-W3464 HydrophobicContact CB-CZ2 4.42Å; A3457-W3464 HydrophobicContact CB-CZ3 4.19Å
3465	Y	89.1	Confident	84.9	Confident	19 Å²	19	45.5 Å²	45.5	8%	0.075	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	141.1	-177.4	-61.2	-83.8	0	0	0	110.9	V3444 Y3455 I3456 C3458 E3463 V3470 C3486	V3444-Y3465 HydrophobicContact CG2-CD1 3.82Å; V3444-Y3465 HydrophobicContact CG2-CE1 3.71Å; Y3455-Y3465 CarbonylContact C-O 3.58Å; Y3455-Y3465 VanDerWaalsContact CA-O 3.23Å; Y3455-Y3465 WeakPolarHBondContact CA-O 3.39Å; I3456-Y3465 PolarHBondContact N-O 2.96Å; I3456-Y3465 PolarHBondContact O-N 2.96Å; C3458-Y3465 HydrophobicContact CB-CD2 4.23Å; C3458-Y3465 HydrophobicContact CB-CE2 3.78Å; E3463-Y3465 HydrophobicContact CB-CD2 4.5Å; E3463-Y3465 HydrophobicContact CB-CE2 3.66Å; E3463-Y3465 WeakPolarHBondContact O-CD2 3.13Å; E3463-Y3465 WeakPolarHBondContact O-CE2 3.13Å; Y3465-V3470 HydrophobicContact CD1-CG1 3.77Å; Y3465-V3470 HydrophobicContact CD2-CG1 4.46Å; Y3465-V3470 HydrophobicContact CG-CG1 3.7Å; Y3465-C3486 HydrophobicContact CD2-CB 4.13Å; Y3465-C3486 HydrophobicContact CE2-CB 3.57Å; Y3465-C3486 PolarHBondContact OH-SG 3.3Å; Y3465-C3486 VanDerWaalsContact OH-SG 3.41Å
3466	H	86.8	Confident	84.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.272	C	S	.	.			trans	-66.3	134.9	163.2	-49.8	116.4	0	0	0	108.6	C3443 C3445 T3447 R3453 Y3455 E3468 C3469 V3470	C3443-H3466 PolarHBondContact SG-N 3.32Å; C3443-H3466 PolarHBondContact SG-ND1 2.9Å; C3443-H3466 VanDerWaalsContact SG-ND1 3.37Å; C3445-H3466 PolarHBondContact SG-CE1 2.89Å; C3445-H3466 PolarHBondContact SG-ND1 3.4Å; T3447-H3466 PolarHBondContact OG1-CE1 3.03Å; R3453-H3466 VanDerWaalsContact CD-CD2 3.49Å; R3453-H3466 WeakPolarHBondContact CD-CD2 3.45Å; R3453-H3466 PolarHBondContact NH1-CE1 2.9Å; Y3455-H3466 AromaticContact CD1-CD2 3.77Å; Y3455-H3466 AromaticContact CD1-NE2 4Å; Y3455-H3466 AromaticContact CE1-CD2 3.33Å; Y3455-H3466 WeakPolarHBondContact CE1-CD2 3.45Å; Y3455-H3466 AromaticContact CE1-NE2 3.11Å; Y3455-H3466 WeakPolarHBondContact CE1-NE2 3.41Å; Y3455-H3466 AromaticContact CZ-CD2 3.56Å; Y3455-H3466 AromaticContact CZ-NE2 3.26Å; Y3455-H3466 VanDerWaalsContact CZ-NE2 3.26Å; Y3455-H3466 PolarHBondContact OH-NE2 3.11Å; Y3455-H3466 VanDerWaalsContact OH-NE2 3.11Å; H3466-E3468 PolarHBondContact O-N 3.36Å; H3466-C3469 HydrophobicContact CB-CB 4.32Å; H3466-C3469 PolarHBondContact O-N 2.85Å; H3466-V3470 PolarHBondContact O-N 2.83Å
3467	P	86.7	Confident	84.3	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.026	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-48.8	-47	178.4	-30.5	36.2	0	0	0	112.5	V3454 C3469 V3470 G3471 L3472 A3477	V3454-P3467 HydrophobicContact CB-CG 4.2Å; V3454-P3467 HydrophobicContact CG1-CG 3.9Å; V3454-P3467 WeakPolarHBondContact O-CD 3.45Å; P3467-C3469 VanDerWaalsContact C-N 3.25Å; P3467-C3469 PolarHBondContact O-N 3.21Å; P3467-V3470 CarbonylContact O-C 3.46Å; P3467-V3470 VanDerWaalsContact O-CG2 3.26Å; P3467-V3470 WeakPolarHBondContact O-CG2 3.47Å; P3467-V3470 PolarHBondContact O-N 3.2Å; P3467-G3471 PolarHBondContact O-N 3.29Å; P3467-L3472 CarbonylContact C-O 3.55Å; P3467-L3472 HydrophobicContact CB-CB 3.93Å; P3467-L3472 VanDerWaalsContact CB-O 3.26Å; P3467-L3472 WeakPolarHBondContact CB-O 3.33Å; P3467-L3472 PolarHBondContact O-N 2.81Å; P3467-L3472 VanDerWaalsContact O-O 3.07Å; P3467-A3477 HydrophobicContact CB-CB 3.89Å; P3467-A3477 HydrophobicContact CG-CB 3.45Å; P3467-A3477 VanDerWaalsContact CG-CB 3.45Å
3468	E	87.7	Confident	84	Confident	119 Å²	119	51.6 Å²	51.6	56%	0.556	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-55.1	-37.5	179.6	-61.9	159.2	170.6	0	0	113	R3453 H3466 V3470 L3472	R3453-E3468 IonicContact CZ-OE2 3.44Å; R3453-E3468 IonicContact NE-OE2 3.41Å; R3453-E3468 PolarHBondContact NE-OE2 2.97Å; R3453-E3468 IonicContact NH2-OE2 2.67Å; R3453-E3468 PolarHBondContact NH2-OE2 2.86Å; H3466-E3468 PolarHBondContact O-N 3.36Å; E3468-V3470 VanDerWaalsContact C-N 3.33Å; E3468-L3472 PolarHBondContact N-O 3.16Å
3469	C	86.9	Confident	83.5	Confident	51 Å²	51	57.3 Å²	57.3	35%	0.345	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-81.2	-11.6	-178.3	-65.2	0	0	0	0	113.7	C3443 H3466 P3467	C3443-C3469 WeakPolarHBondContact SG-CB 3.21Å; H3466-C3469 HydrophobicContact CB-CB 4.32Å; H3466-C3469 PolarHBondContact O-N 2.85Å; P3467-C3469 VanDerWaalsContact C-N 3.25Å; P3467-C3469 PolarHBondContact O-N 3.21Å
3470	V	87.1	Confident	83	Confident	20 Å²	20	58.3 Å²	58.3	12%	0.121	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-112.4	8.2	172.9	-67.6	0	0	0	0	113.1	I3456 Y3465 H3466 P3467 E3468 L3472 Y3484	I3456-V3470 HydrophobicContact CG2-CG2 4.17Å; Y3465-V3470 HydrophobicContact CD1-CG1 3.77Å; Y3465-V3470 HydrophobicContact CD2-CG1 4.46Å; Y3465-V3470 HydrophobicContact CG-CG1 3.7Å; H3466-V3470 PolarHBondContact O-N 2.83Å; P3467-V3470 CarbonylContact O-C 3.46Å; P3467-V3470 VanDerWaalsContact O-CG2 3.26Å; P3467-V3470 WeakPolarHBondContact O-CG2 3.47Å; P3467-V3470 PolarHBondContact O-N 3.2Å; E3468-V3470 VanDerWaalsContact C-N 3.33Å; V3470-L3472 HydrophobicContact CG2-CD1 4.3Å; V3470-L3472 HydrophobicContact CG2-CG 4.32Å; V3470-Y3484 VanDerWaalsContact CB-OH 3.25Å; V3470-Y3484 WeakPolarHBondContact CB-OH 3.44Å; V3470-Y3484 VanDerWaalsContact CG2-OH 3.3Å; V3470-Y3484 WeakPolarHBondContact CG2-OH 3.5Å
3471	G	84	Confident	82.7	Confident	67 Å²	67	63.7 Å²	63.7	69%	0.691	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	15.4	176.6	0	0	0	0	0	115.3	P3467	P3467-G3471 PolarHBondContact O-N 3.29Å
3472	L	85	Confident	82.4	Confident	29 Å²	29	68.5 Å²	68.5	15%	0.152	38%	0.377	C	S	.	.			trans	-100	147.4	173.7	-65	177.9	0	0	0	111	I3456 P3467 E3468 V3470 Q3476 Y3484	I3456-L3472 HydrophobicContact CD1-CD1 3.83Å; P3467-L3472 CarbonylContact C-O 3.55Å; P3467-L3472 HydrophobicContact CB-CB 3.93Å; P3467-L3472 VanDerWaalsContact CB-O 3.26Å; P3467-L3472 WeakPolarHBondContact CB-O 3.33Å; P3467-L3472 PolarHBondContact O-N 2.81Å; P3467-L3472 VanDerWaalsContact O-O 3.07Å; E3468-L3472 PolarHBondContact N-O 3.16Å; V3470-L3472 HydrophobicContact CG2-CD1 4.3Å; V3470-L3472 HydrophobicContact CG2-CG 4.32Å; L3472-Q3476 HydrophobicContact CB-CB 4.43Å; L3472-Q3476 HydrophobicContact CD2-CB 4.29Å; L3472-Y3484 HydrophobicContact CD1-CD2 4.25Å; L3472-Y3484 HydrophobicContact CD1-CE2 3.72Å
3473	T	85.8	Confident	82.5	Confident	60 Å²	60	71.4 Å²	71.4	37%	0.368	40%	0.396	S	S	.	.			trans	-74.8	155.2	162.6	72.4	0	0	0	0	110.1	E3475 Q3476 A3477	T3473-E3475 PolarHBondContact O-N 2.99Å; T3473-Q3476 PolarHBondContact O-N 3.27Å; T3473-Q3476 VanDerWaalsContact O-N 3.12Å; T3473-Q3476 VanDerWaalsContact OG1-CG 3.31Å; T3473-Q3476 WeakPolarHBondContact OG1-CG 3.4Å; T3473-Q3476 PolarHBondContact OG1-N 3.48Å; T3473-A3477 PolarHBondContact O-N 3.49Å
3474	P	83.4	Confident	82.7	Confident	58 Å²	58	71.7 Å²	71.7	38%	0.377	40%	0.397	S	S	.	.	H	α-helix	trans	-59.3	-29.6	172.6	23.3	-33.8	0	0	0	112.6	V3454 V3478	V3454-P3474 HydrophobicContact CB-CB 4.44Å; V3454-P3474 HydrophobicContact CG2-CB 4.2Å; P3474-V3478 WeakPolarHBondContact O-CG2 3.39Å; P3474-V3478 PolarHBondContact O-N 2.95Å; P3474-V3478 VanDerWaalsContact O-N 3.14Å
3475	E	82.2	Confident	82.5	Confident	148 Å²	148	69.5 Å²	69.5	69%	0.692	39%	0.394	S	S	*	.	H	α-helix	trans	-67.5	-43.1	173.3	-59.1	-177	164.7	0	0	112.1	T3473 V3478 N3479	T3473-E3475 PolarHBondContact O-N 2.99Å; E3475-V3478 PolarHBondContact O-N 3.21Å; E3475-N3479 WeakPolarHBondContact O-CB 3.48Å; E3475-N3479 PolarHBondContact O-N 2.77Å; E3475-N3479 VanDerWaalsContact O-N 3.07Å; E3475-N3479 PolarHBondContact O-ND2 3.07Å; E3475-N3479 VanDerWaalsContact O-ND2 3.16Å
3476	Q	81.2	Confident	82.5	Confident	91 Å²	91	68.6 Å²	68.6	43%	0.425	39%	0.39	S	S	.	.	H	α-helix	trans	-62.8	-43.8	174.7	-75	165.5	-17.7	0	0	111.2	L3472 T3473 V3478 N3479 H3480	L3472-Q3476 HydrophobicContact CB-CB 4.43Å; L3472-Q3476 HydrophobicContact CD2-CB 4.29Å; T3473-Q3476 PolarHBondContact O-N 3.27Å; T3473-Q3476 VanDerWaalsContact O-N 3.12Å; T3473-Q3476 VanDerWaalsContact OG1-CG 3.31Å; T3473-Q3476 WeakPolarHBondContact OG1-CG 3.4Å; T3473-Q3476 PolarHBondContact OG1-N 3.48Å; Q3476-V3478 VanDerWaalsContact C-N 3.31Å; Q3476-V3478 PolarHBondContact O-N 2.97Å; Q3476-N3479 CarbonylContact O-C 3.55Å; Q3476-N3479 PolarHBondContact O-N 2.68Å; Q3476-H3480 PolarHBondContact O-CD2 3.3Å; Q3476-H3480 PolarHBondContact O-N 3.08Å
3477	A	80.6	Confident	82.3	Confident	15 Å²	15	71.5 Å²	71.5	12%	0.124	41%	0.409	C	S	.	.	H	α-helix	trans	-61.8	-35.2	178.2	0	0	0	0	0	113.4	V3454 I3456 P3467 T3473	V3454-A3477 HydrophobicContact CG1-CB 4.5Å; I3456-A3477 HydrophobicContact CB-CB 4.41Å; I3456-A3477 HydrophobicContact CD1-CB 4.34Å; P3467-A3477 HydrophobicContact CB-CB 3.89Å; P3467-A3477 HydrophobicContact CG-CB 3.45Å; P3467-A3477 VanDerWaalsContact CG-CB 3.45Å; T3473-A3477 PolarHBondContact O-N 3.49Å
3478	V	80.5	Confident	82.1	Confident	106 Å²	106	75.2 Å²	75.2	64%	0.642	43%	0.432	S	S	*	.	H	α-helix	trans	-73.5	-27.9	173.3	170.9	0	0	0	0	112.2	P3474 E3475 Q3476	P3474-V3478 WeakPolarHBondContact O-CG2 3.39Å; P3474-V3478 PolarHBondContact O-N 2.95Å; P3474-V3478 VanDerWaalsContact O-N 3.14Å; E3475-V3478 PolarHBondContact O-N 3.21Å; Q3476-V3478 VanDerWaalsContact C-N 3.31Å; Q3476-V3478 PolarHBondContact O-N 2.97Å
3479	N	78.8	Confident	81.9	Confident	120 Å²	120	70.3 Å²	70.3	64%	0.642	41%	0.411	S	S	*	.	H	α-helix	trans	-88.3	-4.9	179.2	-67.2	-23.2	0	0	0	114.2	E3475 Q3476 T3481	E3475-N3479 WeakPolarHBondContact O-CB 3.48Å; E3475-N3479 PolarHBondContact O-N 2.77Å; E3475-N3479 VanDerWaalsContact O-N 3.07Å; E3475-N3479 PolarHBondContact O-ND2 3.07Å; E3475-N3479 VanDerWaalsContact O-ND2 3.16Å; Q3476-N3479 CarbonylContact O-C 3.55Å; Q3476-N3479 PolarHBondContact O-N 2.68Å; N3479-T3481 PolarHBondContact O-N 3.09Å; N3479-T3481 VanDerWaalsContact O-N 3.12Å
3480	H	72	Confident	81.6	Confident	87 Å²	87	70.3 Å²	70.3	40%	0.403	41%	0.41	S	S	.	.			trans	-76.3	95	173.8	-85.9	-69.9	0	0	0	110.5	I3456 Q3476 D3482	I3456-H3480 HydrophobicContact CD1-CB 4.35Å; Q3476-H3480 PolarHBondContact O-CD2 3.3Å; Q3476-H3480 PolarHBondContact O-N 3.08Å; H3480-D3482 VanDerWaalsContact C-N 3.32Å
3481	T	70.1	Confident	81.2	Confident	130 Å²	130	75 Å²	75	80%	0.798	43%	0.431	S	S	*	.			trans	-80.4	-13.1	173.7	50.4	0	0	0	0	114.2	N3479	N3479-T3481 PolarHBondContact O-N 3.09Å; N3479-T3481 VanDerWaalsContact O-N 3.12Å
3482	D	74	Confident	80.8	Confident	122 Å²	122	74.7 Å²	74.7	65%	0.652	41%	0.413	S	S	*	.	S	Bend	trans	-114.7	169.6	-166.3	-61.2	11.5	0	0	0	110.3	H3480 Y3484	H3480-D3482 VanDerWaalsContact C-N 3.32Å; D3482-Y3484 PolarHBondContact O-N 2.86Å
3483	T	80.8	Confident	79.8	Confident	110 Å²	110	76.3 Å²	76.3	68%	0.675	43%	0.427	S	S	*	.			trans	-56	125.8	-176.8	54.4	0	0	0	0	112.8	D3459	D3459-T3483 VanDerWaalsContact OD2-C 3.3Å; D3459-T3483 WeakPolarHBondContact OD2-CA 3.12Å; D3459-T3483 WeakPolarHBondContact OD2-CB 3.44Å
3484	Y	86	Confident	78.6	Confident	25 Å²	25	79 Å²	79	10%	0.098	44%	0.436	C	S	.	.			trans	-102.7	123.7	179.1	177.8	-104.1	0	0	0	111.7	I3456 A3457 C3458 D3459 V3470 L3472 D3482 C3486	I3456-Y3484 HydrophobicContact CD1-CD1 3.8Å; I3456-Y3484 HydrophobicContact CD1-CD2 3.73Å; I3456-Y3484 HydrophobicContact CD1-CE1 4.32Å; I3456-Y3484 HydrophobicContact CD1-CE2 4.26Å; I3456-Y3484 HydrophobicContact CD1-CG 3.49Å; I3456-Y3484 VanDerWaalsContact CD1-CG 3.49Å; I3456-Y3484 HydrophobicContact CG1-CD1 3.78Å; I3456-Y3484 HydrophobicContact CG1-CE1 4.35Å; I3456-Y3484 HydrophobicContact CG1-CG 3.93Å; I3456-Y3484 HydrophobicContact CG2-CD1 4.21Å; I3456-Y3484 HydrophobicContact CG2-CE1 3.92Å; A3457-Y3484 WeakPolarHBondContact O-CD1 3.47Å; C3458-Y3484 CarbonylContact C-O 2.93Å; C3458-Y3484 WeakPolarHBondContact CA-O 3.26Å; C3458-Y3484 HydrophobicContact CB-CD1 4.1Å; C3458-Y3484 HydrophobicContact CB-CE1 4.25Å; D3459-Y3484 PolarHBondContact N-O 3.4Å; D3459-Y3484 PolarHBondContact OD2-N 3.43Å; V3470-Y3484 VanDerWaalsContact CB-OH 3.25Å; V3470-Y3484 WeakPolarHBondContact CB-OH 3.44Å; V3470-Y3484 VanDerWaalsContact CG2-OH 3.3Å; V3470-Y3484 WeakPolarHBondContact CG2-OH 3.5Å; L3472-Y3484 HydrophobicContact CD1-CD2 4.25Å; L3472-Y3484 HydrophobicContact CD1-CE2 3.72Å; D3482-Y3484 PolarHBondContact O-N 2.86Å; Y3484-C3486 HydrophobicContact CE1-CB 4.17Å
3485	L	84.9	Confident	77.4	Confident	79 Å²	79	85.2 Å²	85.2	41%	0.414	45%	0.452	S	S	.	.			trans	-111.8	122.4	172.3	-62.4	-179.5	0	0	0	110.3	C3489	L3485-C3489 HydrophobicContact CB-CB 4.44Å; L3485-C3489 HydrophobicContact CD2-CB 4.42Å
3486	C	87.7	Confident	76	Confident	0 Å²	0	82.8 Å²	82.8	0%	0	45%	0.447	C	S	.	.			trans	-65.1	160.5	175.4	79	0	0	0	0	111.3	C3458 Y3465 Y3484 T3488 C3489 C3490	C3458-C3486 HydrophobicContact CB-CB 3.95Å; C3458-C3486 PolarHBondContact SG-N 3.28Å; Y3465-C3486 HydrophobicContact CD2-CB 4.13Å; Y3465-C3486 HydrophobicContact CE2-CB 3.57Å; Y3465-C3486 PolarHBondContact OH-SG 3.3Å; Y3465-C3486 VanDerWaalsContact OH-SG 3.41Å; Y3484-C3486 HydrophobicContact CE1-CB 4.17Å; C3486-T3488 PolarHBondContact O-N 3.19Å; C3486-C3489 PolarHBondContact O-N 3.39Å; C3486-C3490 PolarHBondContact O-N 3.11Å
3487	P	83.4	Confident	74.7	Confident	60 Å²	60	82.9 Å²	82.9	39%	0.39	45%	0.454	S	S	.	.	H	α-helix	trans	-53.8	-32.5	-177.5	-29	36.4	0	0	0	114.4	Q3491	P3487-Q3491 VanDerWaalsContact O-CG 3.27Å; P3487-Q3491 WeakPolarHBondContact O-CG 3.33Å; P3487-Q3491 PolarHBondContact O-N 3.28Å; P3487-Q3491 VanDerWaalsContact O-N 3.15Å; P3487-Q3491 PolarHBondContact O-NE2 2.95Å
3488	T	83	Confident	73.1	Confident	83 Å²	83	87.6 Å²	87.6	51%	0.509	48%	0.477	S	S	.	.	H	α-helix	trans	-69.1	-48	177.3	-42.8	0	0	0	0	112	C3486 C3490 Q3491 L3492	C3486-T3488 PolarHBondContact O-N 3.19Å; T3488-C3490 VanDerWaalsContact C-N 3.33Å; T3488-C3490 PolarHBondContact O-N 3.19Å; T3488-Q3491 PolarHBondContact O-N 2.94Å; T3488-L3492 PolarHBondContact O-N 3.27Å
3489	C	82.7	Confident	71.4	Confident	16 Å²	16	87.5 Å²	87.5	11%	0.108	48%	0.477	C	S	.	.	H	α-helix	trans	-66.4	-37.4	178.5	-64.2	0	0	0	0	111.7	G3460 L3485 C3486 Q3491 L3492 S3493	G3460-C3489 VanDerWaalsContact C-SG 3.52Å; G3460-C3489 PolarHBondContact O-SG 2.88Å; L3485-C3489 HydrophobicContact CB-CB 4.44Å; L3485-C3489 HydrophobicContact CD2-CB 4.42Å; C3486-C3489 PolarHBondContact O-N 3.39Å; C3489-Q3491 VanDerWaalsContact C-N 3.33Å; C3489-Q3491 PolarHBondContact O-N 2.85Å; C3489-L3492 PolarHBondContact O-N 3.05Å; C3489-S3493 PolarHBondContact O-N 3.03Å
3490	C	81.1	Confident	69.6	Low	50 Å²	50	87.7 Å²	87.7	34%	0.338	48%	0.482	S	S	.	.	H	α-helix	trans	-60.7	-41.3	174.2	-168.9	0	0	0	0	111.8	C3486 T3488 Q3494	C3486-C3490 PolarHBondContact O-N 3.11Å; T3488-C3490 VanDerWaalsContact C-N 3.33Å; T3488-C3490 PolarHBondContact O-N 3.19Å; C3490-Q3494 VanDerWaalsContact O-CG 3.32Å; C3490-Q3494 WeakPolarHBondContact O-CG 2.88Å; C3490-Q3494 PolarHBondContact O-N 3.19Å; C3490-Q3494 VanDerWaalsContact O-N 3.14Å; C3490-Q3494 PolarHBondContact SG-NE2 3.21Å
3491	Q	78	Confident	68.1	Low	118 Å²	118	89.1 Å²	89.1	55%	0.551	50%	0.497	S	S	*	.	H	α-helix	trans	-68	-38.2	174.9	-74.9	169.2	62.2	0	0	113.5	P3487 T3488 C3489 Q3494 R3495	P3487-Q3491 VanDerWaalsContact O-CG 3.27Å; P3487-Q3491 WeakPolarHBondContact O-CG 3.33Å; P3487-Q3491 PolarHBondContact O-N 3.28Å; P3487-Q3491 VanDerWaalsContact O-N 3.15Å; P3487-Q3491 PolarHBondContact O-NE2 2.95Å; T3488-Q3491 PolarHBondContact O-N 2.94Å; C3489-Q3491 VanDerWaalsContact C-N 3.33Å; C3489-Q3491 PolarHBondContact O-N 2.85Å; Q3491-Q3494 PolarHBondContact O-N 3.38Å; Q3491-R3495 PolarHBondContact O-N 2.95Å; Q3491-R3495 VanDerWaalsContact O-N 3.14Å
3492	L	74.9	Confident	66.4	Low	61 Å²	61	88 Å²	88	32%	0.319	49%	0.491	S	S	.	.	H	α-helix	trans	-63	-48.5	174.7	-101.9	66.5	0	0	0	111.1	T3488 C3489 Q3494 R3495 T3496 L3647	T3488-L3492 PolarHBondContact O-N 3.27Å; C3489-L3492 PolarHBondContact O-N 3.05Å; L3492-Q3494 VanDerWaalsContact C-N 3.32Å; L3492-Q3494 PolarHBondContact O-N 3.4Å; L3492-R3495 WeakPolarHBondContact O-CB 3.21Å; L3492-R3495 PolarHBondContact O-N 3.15Å; L3492-T3496 PolarHBondContact O-N 3.34Å; L3492-L3647 HydrophobicContact CD2-CB 3.93Å; L3492-L3647 HydrophobicContact CD2-CD2 4.1Å
3493	S	65	Low	64.5	Low	64 Å²	64	88.4 Å²	88.4	45%	0.448	50%	0.497	S	S	.	.	H	α-helix	trans	-55	-46.8	176.6	-175.9	0	0	0	0	111.7	C3489 R3495 T3496	C3489-S3493 PolarHBondContact O-N 3.03Å; S3493-R3495 VanDerWaalsContact C-N 3.29Å; S3493-R3495 PolarHBondContact O-N 2.73Å; S3493-T3496 PolarHBondContact O-N 3.23Å; S3493-T3496 PolarHBondContact O-OG1 2.98Å
3494	Q	60.3	Low	62.3	Low	116 Å²	116	89.2 Å²	89.2	54%	0.542	50%	0.503	S	S	.	.	H	α-helix	trans	-66	-21	176.5	-69.2	176	39	0	0	115.1	C3490 Q3491 L3492 T3497 N3498	C3490-Q3494 VanDerWaalsContact O-CG 3.32Å; C3490-Q3494 WeakPolarHBondContact O-CG 2.88Å; C3490-Q3494 PolarHBondContact O-N 3.19Å; C3490-Q3494 VanDerWaalsContact O-N 3.14Å; C3490-Q3494 PolarHBondContact SG-NE2 3.21Å; Q3491-Q3494 PolarHBondContact O-N 3.38Å; L3492-Q3494 VanDerWaalsContact C-N 3.32Å; L3492-Q3494 PolarHBondContact O-N 3.4Å; Q3494-T3497 PolarHBondContact O-OG1 3.48Å; Q3494-N3498 PolarHBondContact O-ND2 2.91Å
3495	R	58.6	Low	60	Low	189 Å²	189	97.2 Å²	97.2	71%	0.713	54%	0.538	S	S	*	.	H	α-helix	trans	-79.1	-36.8	174	-80.1	179.7	165.4	-164.5	-3.7	112.6	Q3491 L3492 S3493 T3497 N3498 T3499	Q3491-R3495 PolarHBondContact O-N 2.95Å; Q3491-R3495 VanDerWaalsContact O-N 3.14Å; L3492-R3495 WeakPolarHBondContact O-CB 3.21Å; L3492-R3495 PolarHBondContact O-N 3.15Å; S3493-R3495 VanDerWaalsContact C-N 3.29Å; S3493-R3495 PolarHBondContact O-N 2.73Å; R3495-T3497 VanDerWaalsContact C-N 3.31Å; R3495-T3497 PolarHBondContact O-N 3.27Å; R3495-N3498 PolarHBondContact O-N 3.27Å; R3495-T3499 PolarHBondContact O-OG1 2.97Å
3496	T	53.4	Low	57.7	Low	96 Å²	96	98.6 Å²	98.6	59%	0.589	55%	0.554	S	S	*	*	H	α-helix	trans	-65.3	-32.2	-178.6	63.5	0	0	0	0	112.9	L3492 S3493	L3492-T3496 PolarHBondContact O-N 3.34Å; S3493-T3496 PolarHBondContact O-N 3.23Å; S3493-T3496 PolarHBondContact O-OG1 2.98Å
3497	T	52	Low	55.2	Low	94 Å²	94	104.7 Å²	104.7	58%	0.577	60%	0.597	S	S	*	*	H	α-helix	trans	-76.3	-29.4	-178.8	54.2	0	0	0	0	114.5	Q3494 R3495	Q3494-T3497 PolarHBondContact O-OG1 3.48Å; R3495-T3497 VanDerWaalsContact C-N 3.31Å; R3495-T3497 PolarHBondContact O-N 3.27Å
3498	N	47.4	Very low	53.1	Low	113 Å²	113	105.6 Å²	105.6	60%	0.604	62%	0.617	S	S	*	*	H	α-helix	trans	-90.5	-11.5	-174.4	-73.7	-65.4	0	0	0	114.5	Q3494 R3495	Q3494-N3498 PolarHBondContact O-ND2 2.91Å; R3495-N3498 PolarHBondContact O-N 3.27Å
3499	T	45	Very low	51	Low	104 Å²	104	111.3 Å²	111.3	64%	0.638	64%	0.635	S	S	*	*	S	Bend	trans	-87.9	-16.7	-172.5	-51.7	0	0	0	0	113	R3495 T3501	R3495-T3499 PolarHBondContact O-OG1 2.97Å; T3499-T3501 VanDerWaalsContact C-N 3.34Å; T3499-T3501 PolarHBondContact O-N 3.34Å
3500	T	41.9	Very low	48.9	Very low	124 Å²	124	115.3 Å²	115.3	76%	0.761	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	11.7	-171.2	-33.4	0	0	0	0	114.4
3501	T	39.5	Very low	47	Very low	117 Å²	117	122.1 Å²	122.1	72%	0.718	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	8.3	-173.4	51	0	0	0	0	115.5	T3499	T3499-T3501 VanDerWaalsContact C-N 3.34Å; T3499-T3501 PolarHBondContact O-N 3.34Å
3502	T	34.2	Very low	45	Very low	108 Å²	108	126.5 Å²	126.5	66%	0.663	70%	0.704	S	S	*	*			trans	-133.9	38.1	-168.9	47.7	0	0	0	0	116.9
3503	T	34.1	Very low	43.3	Very low	129 Å²	129	129.4 Å²	129.4	79%	0.791	73%	0.729	S	S	*	*			trans	-137.4	145.8	159.4	47.3	0	0	0	0	115.1
3504	T	34.5	Very low	41.8	Very low	128 Å²	128	136.7 Å²	136.7	79%	0.785	75%	0.753	S	S	*	*	S	Bend	trans	79.1	138.8	175.1	80.5	0	0	0	0	118.7
3505	K	37.8	Very low	40.6	Very low	193 Å²	193	135 Å²	135	84%	0.839	77%	0.768	S	S	*	*			trans	75.2	61.3	163.9	-59.9	179.7	-175.4	173.3	0	119.8
3506	S	36.4	Very low	39.5	Very low	108 Å²	108	131 Å²	131	76%	0.755	77%	0.768	S	S	*	*				6.3	141.5	127.3	57.6	0	0	0	0	121.6
3507	S	36.2	Very low	38.7	Very low	127 Å²	127	133.6 Å²	133.6	89%	0.888	78%	0.778	S	S	*	*			trans	82.2	135.2	157.4	80	0	0	0	0	118.9
3508	G	39.2	Very low	37.9	Very low	80 Å²	80	138.1 Å²	138.1	83%	0.825	79%	0.79	S	S	*	*			trans	152.8	51.6	175.5	0	0	0	0	0	118.6	S3510	G3508-S3510 PolarHBondContact O-N 3.48Å
3509	K	38.2	Very low	37.3	Very low	203 Å²	203	140.5 Å²	140.5	88%	0.883	80%	0.803	S	S	*	*			trans	-43.2	131.1	178.8	-73.4	171.6	170.9	171	0	115.5
3510	S	40.1	Very low	36.8	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	81%	0.813	S	S	*	*				166.3	140.1	108.1	-76.6	0	0	0	0	117.3	G3508	G3508-S3510 PolarHBondContact O-N 3.48Å
3511	K	40.8	Very low	36.4	Very low	193 Å²	193	144.2 Å²	144.2	84%	0.839	82%	0.817	S	S	*	*			trans	36.9	112.6	143.4	-56.5	175.2	-176.1	177.1	0	118.9
3512	K	34.8	Very low	36	Very low	209 Å²	209	143.1 Å²	143.1	91%	0.909	82%	0.82	S	S	*	*				80.9	97.8	58.8	-173.4	-170.4	178.3	-178.3	0	114.6
3513	S	39.2	Very low	36.1	Very low	122 Å²	122	144.8 Å²	144.8	85%	0.853	83%	0.83	S	S	*	*			trans	-145.4	156.4	150.7	55.7	0	0	0	0	109.5
3514	K	34.3	Very low	36.2	Very low	217 Å²	217	143.9 Å²	143.9	94%	0.943	82%	0.824	S	S	*	*			trans	-109.6	145	175.7	-73.9	-177.4	174	-176	0	109.1
3515	G	35.9	Very low	36.2	Very low	82 Å²	82	145 Å²	145	85%	0.845	83%	0.831	S	S	*	*			trans	-168.4	117.6	168.8	0	0	0	0	0	111.2
3516	S	34.6	Very low	36.4	Very low	103 Å²	103	141 Å²	141	72%	0.72	82%	0.822	S	S	*	*			trans	-96.4	131.6	173.4	173	0	0	0	0	109.3
3517	N	37.2	Very low	36.2	Very low	151 Å²	151	141.8 Å²	141.8	81%	0.807	82%	0.818	S	S	*	*				-170.3	163.1	114.4	-95.5	-12.2	0	0	0	113.9
3518	K	34.1	Very low	36.4	Very low	189 Å²	189	143.8 Å²	143.8	82%	0.822	81%	0.813	S	S	*	*			trans	-67.8	144.1	179.8	-53.1	165.7	-175.9	175	0	110.7
3519	N	35	Very low	36.4	Very low	164 Å²	164	144.5 Å²	144.5	88%	0.877	80%	0.802	S	S	*	*			trans	-169.8	158.4	133.5	-97.8	-20	0	0	0	111.8
3520	H	34	Very low	36.5	Very low	185 Å²	185	138.5 Å²	138.5	86%	0.856	79%	0.79	S	S	*	*			trans	-65.3	139.6	177	-77.2	-117.3	0	0	0	111.8
3521	S	34.2	Very low	36.7	Very low	121 Å²	121	137.9 Å²	137.9	85%	0.846	79%	0.791	S	S	*	*			trans	-159.2	150.6	153.7	-84.4	0	0	0	0	111.1	V3523	S3521-V3523 PolarHBondContact O-N 3.47Å
3522	A	31.3	Very low	37	Very low	94 Å²	94	133.6 Å²	133.6	78%	0.777	78%	0.781	S	S	*	*			trans	-31.1	119.2	-172.7	0	0	0	0	0	117	T3524	A3522-T3524 PolarHBondContact O-N 2.88Å
3523	V	36.2	Very low	37.9	Very low	142 Å²	142	130.1 Å²	130.1	86%	0.861	77%	0.766	S	S	*	*			trans	-72.5	114	152	175.4	0	0	0	0	106.9	S3521	S3521-V3523 PolarHBondContact O-N 3.47Å
3524	T	36.2	Very low	38.8	Very low	110 Å²	110	126.5 Å²	126.5	68%	0.675	74%	0.739	S	S	*	*			trans	-64.2	132.2	172.4	26.9	0	0	0	0	110.3	A3522 V3526	A3522-T3524 PolarHBondContact O-N 2.88Å; T3524-V3526 PolarHBondContact O-N 2.99Å; T3524-V3526 VanDerWaalsContact O-N 3.16Å
3525	V	35.2	Very low	40.2	Very low	152 Å²	152	117.3 Å²	117.3	92%	0.921	70%	0.7	S	S	*	*			trans	-69.6	110.6	171.6	179.7	0	0	0	0	108.1
3526	V	41.2	Very low	41.6	Very low	109 Å²	109	117 Å²	117	66%	0.661	67%	0.673	S	S	*	*			trans	-118	140.6	171.6	-176.7	0	0	0	0	107	T3524 Q3528	T3524-V3526 PolarHBondContact O-N 2.99Å; T3524-V3526 VanDerWaalsContact O-N 3.16Å; V3526-Q3528 PolarHBondContact O-N 3.36Å; V3526-Q3528 VanDerWaalsContact O-N 3.14Å
3527	D	32.9	Very low	43.1	Very low	125 Å²	125	116.6 Å²	116.6	67%	0.668	66%	0.66	S	S	*	*			trans	-45.1	111.1	-165.2	-85.8	-71.5	0	0	0	116	T3529	D3527-T3529 PolarHBondContact OD1-OG1 2.84Å
3528	Q	38.8	Very low	44.5	Very low	168 Å²	168	111.4 Å²	111.4	79%	0.785	63%	0.634	S	S	*	*			trans	-90.6	-5.9	164.3	-63.6	-177.5	-2.5	0	0	112.1	V3526 A3530 A3531	V3526-Q3528 PolarHBondContact O-N 3.36Å; V3526-Q3528 VanDerWaalsContact O-N 3.14Å; Q3528-A3530 PolarHBondContact O-N 3.02Å; Q3528-A3530 VanDerWaalsContact O-N 3.13Å; Q3528-A3531 PolarHBondContact O-N 2.69Å
3529	T	39.9	Very low	46.4	Very low	96 Å²	96	107.8 Å²	107.8	59%	0.589	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-15.3	-179.1	56	0	0	0	0	114.4	D3527	D3527-T3529 PolarHBondContact OD1-OG1 2.84Å
3530	A	40.9	Very low	48.4	Very low	77 Å²	77	101.2 Å²	101.2	64%	0.636	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-18.1	178.5	0	0	0	0	0	114	Q3528	Q3528-A3530 PolarHBondContact O-N 3.02Å; Q3528-A3530 VanDerWaalsContact O-N 3.13Å
3531	A	43.8	Very low	50.5	Low	87 Å²	87	95.9 Å²	95.9	72%	0.719	57%	0.569	S	S	*	*	S	Bend	trans	-90.8	-9.6	-169.8	0	0	0	0	0	114.8	Q3528	Q3528-A3531 PolarHBondContact O-N 2.69Å
3532	T	47.7	Very low	52.7	Low	103 Å²	103	93 Å²	93	63%	0.632	55%	0.549	S	S	*	.			trans	-108.9	29.2	-171.4	60.3	0	0	0	0	113.5
3533	K	53.2	Low	55.1	Low	135 Å²	135	93.6 Å²	93.6	59%	0.587	54%	0.539	S	S	*	.			trans	-88.5	115.8	174.8	-67.9	-173.8	177.5	-177.9	0	109.9	E3537	K3533-E3537 HydrophobicContact CB-CB 4.35Å
3534	T	59	Low	57.4	Low	47 Å²	47	89.8 Å²	89.8	29%	0.288	51%	0.509	S	S	.	.			trans	-61.7	158.5	171.8	62.7	0	0	0	0	110.5	Y3536 E3537	T3534-Y3536 PolarHBondContact O-N 3.32Å; T3534-Y3536 VanDerWaalsContact O-N 3.12Å; T3534-E3537 PolarHBondContact O-N 3.42Å; T3534-E3537 PolarHBondContact OG1-OE1 3.18Å
3535	I	62.9	Low	59.7	Low	23 Å²	23	85.2 Å²	85.2	12%	0.118	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-54.6	-35.8	177.8	-70.1	177.1	0	0	0	111.4	G3460 E3537 T3538 L3600 K3643 L3647	G3460-I3535 WeakPolarHBondContact O-CD1 3.45Å; I3535-E3537 VanDerWaalsContact C-N 3.32Å; I3535-E3537 PolarHBondContact O-N 2.84Å; I3535-T3538 WeakPolarHBondContact O-CB 3.15Å; I3535-T3538 WeakPolarHBondContact O-CG2 3.36Å; I3535-T3538 PolarHBondContact O-N 3.44Å; I3535-T3538 VanDerWaalsContact O-N 3.15Å; I3535-T3538 PolarHBondContact O-OG1 2.92Å; I3535-L3600 HydrophobicContact CG2-CD2 3.97Å; I3535-K3643 HydrophobicContact CD1-CD 3.94Å; I3535-K3643 HydrophobicContact CD1-CG 4.23Å; I3535-K3643 HydrophobicContact CG2-CD 4.26Å; I3535-K3643 HydrophobicContact CG2-CG 4.09Å; I3535-L3647 HydrophobicContact CD1-CD1 4.33Å
3536	Y	65.3	Low	62.2	Low	75 Å²	75	83 Å²	83	29%	0.294	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-64.3	-31.3	178.4	-57.1	-69.4	0	0	0	113.5	D3462 T3534 T3538 T3599 L3600 G3601 K3643	D3462-Y3536 WeakPolarHBondContact OD1-CE2 3.47Å; D3462-Y3536 PolarHBondContact OD1-OH 2.88Å; D3462-Y3536 WeakPolarHBondContact OD2-CE2 3.38Å; D3462-Y3536 PolarHBondContact OD2-OH 3.22Å; T3534-Y3536 PolarHBondContact O-N 3.32Å; T3534-Y3536 VanDerWaalsContact O-N 3.12Å; Y3536-T3538 PolarHBondContact O-N 3.5Å; Y3536-T3599 VanDerWaalsContact O-CB 3.26Å; Y3536-T3599 WeakPolarHBondContact O-CB 3.48Å; Y3536-L3600 PolarHBondContact O-N 2.88Å; Y3536-L3600 VanDerWaalsContact O-N 3.1Å; Y3536-G3601 PolarHBondContact O-N 3.42Å; Y3536-K3643 PolarHBondContact OH-NZ 3.47Å
3537	E	66.5	Low	64.3	Low	96 Å²	96	81.3 Å²	81.3	45%	0.449	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-78.4	-3.3	175.8	-73.3	167.5	-134.5	0	0	113.8	K3533 T3534 I3535 N3539	K3533-E3537 HydrophobicContact CB-CB 4.35Å; T3534-E3537 PolarHBondContact O-N 3.42Å; T3534-E3537 PolarHBondContact OG1-OE1 3.18Å; I3535-E3537 VanDerWaalsContact C-N 3.32Å; I3535-E3537 PolarHBondContact O-N 2.84Å; E3537-N3539 PolarHBondContact O-N 3.21Å
3538	T	67.1	Low	66.9	Low	41 Å²	41	75.4 Å²	75.4	25%	0.252	41%	0.41	S	S	.	.	S	Bend	trans	-70.7	122.7	177.8	68.1	0	0	0	0	110.5	I3535 Y3536 R3544 L3600	I3535-T3538 WeakPolarHBondContact O-CB 3.15Å; I3535-T3538 WeakPolarHBondContact O-CG2 3.36Å; I3535-T3538 PolarHBondContact O-N 3.44Å; I3535-T3538 VanDerWaalsContact O-N 3.15Å; I3535-T3538 PolarHBondContact O-OG1 2.92Å; Y3536-T3538 PolarHBondContact O-N 3.5Å; T3538-R3544 PolarHBondContact OG1-NH1 2.92Å; T3538-L3600 PolarHBondContact O-N 3.42Å
3539	N	73.2	Confident	69.2	Low	113 Å²	113	68.3 Å²	68.3	60%	0.604	38%	0.378	S	S	*	.	B	Isolated β-bridge	trans	-58.7	141.6	178	-71	-27.8	0	0	0	110.9	E3537 T3541 K3598	E3537-N3539 PolarHBondContact O-N 3.21Å; N3539-T3541 PolarHBondContact O-N 3.18Å; N3539-K3598 WeakPolarHBondContact CA-O 3.39Å
3540	L	76.5	Confident	71.5	Confident	26 Å²	26	68.2 Å²	68.2	14%	0.136	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-76	117.3	172.8	-91.8	56.3	0	0	0	109.8	I3545 L3548 L3592 K3598 T3599 L3600	L3540-I3545 HydrophobicContact CB-CD1 4.3Å; L3540-I3545 HydrophobicContact CB-CG1 3.94Å; L3540-I3545 HydrophobicContact CD2-CG1 4.11Å; L3540-I3545 HydrophobicContact CG-CG1 4.29Å; L3540-L3548 HydrophobicContact CD2-CD1 3.87Å; L3540-L3548 HydrophobicContact CG-CD1 4.2Å; L3540-L3592 HydrophobicContact CD2-CD2 4.24Å; L3540-K3598 PolarHBondContact N-O 2.99Å; L3540-T3599 VanDerWaalsContact CD1-C 3.4Å; L3540-L3600 HydrophobicContact CD1-CB 4.01Å; L3540-L3600 HydrophobicContact CD1-CD1 4.32Å; L3540-L3600 VanDerWaalsContact CD1-N 3.28Å
3541	T	78.8	Confident	73.7	Confident	74 Å²	74	65 Å²	65	45%	0.454	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-84.5	155.8	164	60	0	0	0	0	109.5	N3539 D3543 R3544 I3545	N3539-T3541 PolarHBondContact O-N 3.18Å; T3541-D3543 PolarHBondContact O-N 3.42Å; T3541-D3543 VanDerWaalsContact O-N 3.08Å; T3541-R3544 WeakPolarHBondContact O-CA 3.35Å; T3541-R3544 WeakPolarHBondContact O-CB 3.3Å; T3541-R3544 PolarHBondContact O-N 3.37Å; T3541-R3544 WeakPolarHBondContact OG1-CG 3.39Å; T3541-I3545 PolarHBondContact O-N 3.2Å
3542	S	79.5	Confident	75.8	Confident	61 Å²	61	60.9 Å²	60.9	43%	0.427	31%	0.312	S	S	.	.	H	α-helix	trans	-52.4	-35.3	179.9	-174.4	0	0	0	0	113.2	I3545 K3546	S3542-I3545 WeakPolarHBondContact O-CB 3.46Å; S3542-I3545 PolarHBondContact O-N 3.06Å; S3542-K3546 WeakPolarHBondContact O-CE 3.4Å; S3542-K3546 WeakPolarHBondContact O-CG 3.32Å; S3542-K3546 PolarHBondContact O-N 3.46Å; S3542-K3546 WeakPolarHBondContact OG-CE 3.34Å
3543	D	82.9	Confident	77.7	Confident	105 Å²	105	59.1 Å²	59.1	56%	0.561	30%	0.296	S	S	*	.	H	α-helix	trans	-74.6	-30.3	177.7	-55.9	-52	0	0	0	113.5	T3541 K3546 K3547	T3541-D3543 PolarHBondContact O-N 3.42Å; T3541-D3543 VanDerWaalsContact O-N 3.08Å; D3543-K3546 PolarHBondContact O-N 2.74Å; D3543-K3546 IonicContact OD1-NZ 2.68Å; D3543-K3546 PolarHBondContact OD1-NZ 3.49Å; D3543-K3547 PolarHBondContact O-N 2.9Å; D3543-K3547 VanDerWaalsContact O-N 3.1Å
3544	R	83.5	Confident	79.3	Confident	62 Å²	62	57 Å²	57	23%	0.234	29%	0.289	C	S	.	.	H	α-helix	trans	-67.3	-40.8	168	-71.9	172.4	168.4	-151.8	-10.3	110.8	T3538 T3541 K3546 K3547 L3548 F3642	T3538-R3544 PolarHBondContact OG1-NH1 2.92Å; T3541-R3544 WeakPolarHBondContact O-CA 3.35Å; T3541-R3544 WeakPolarHBondContact O-CB 3.3Å; T3541-R3544 PolarHBondContact O-N 3.37Å; T3541-R3544 WeakPolarHBondContact OG1-CG 3.39Å; R3544-K3546 VanDerWaalsContact C-N 3.33Å; R3544-K3546 PolarHBondContact O-N 3.4Å; R3544-K3547 PolarHBondContact O-N 2.69Å; R3544-L3548 WeakPolarHBondContact O-CB 3.38Å; R3544-L3548 VanDerWaalsContact O-CG 3.3Å; R3544-L3548 WeakPolarHBondContact O-CG 3.48Å; R3544-L3548 PolarHBondContact O-N 3.33Å; R3544-F3642 HydrophobicContact CB-CZ 4.33Å; R3544-F3642 HydrophobicContact CG-CZ 4.4Å
3545	I	84.9	Confident	80.6	Confident	15 Å²	15	55.2 Å²	55.2	8%	0.077	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-44.2	174.8	-62.5	172.8	0	0	0	110.6	L3540 T3541 S3542 L3548 I3549 L3592 E3595	L3540-I3545 HydrophobicContact CB-CD1 4.3Å; L3540-I3545 HydrophobicContact CB-CG1 3.94Å; L3540-I3545 HydrophobicContact CD2-CG1 4.11Å; L3540-I3545 HydrophobicContact CG-CG1 4.29Å; T3541-I3545 PolarHBondContact O-N 3.2Å; S3542-I3545 WeakPolarHBondContact O-CB 3.46Å; S3542-I3545 PolarHBondContact O-N 3.06Å; I3545-L3548 PolarHBondContact O-N 3.03Å; I3545-I3549 HydrophobicContact CG2-CD1 3.82Å; I3545-I3549 HydrophobicContact CG2-CG1 4.44Å; I3545-I3549 WeakPolarHBondContact O-CG1 3.23Å; I3545-I3549 PolarHBondContact O-N 2.96Å; I3545-L3592 HydrophobicContact CG2-CB 4.45Å; I3545-L3592 HydrophobicContact CG2-CD2 4.26Å; I3545-E3595 HydrophobicContact CD1-CG 4.16Å
3546	K	86.8	Confident	81.7	Confident	104 Å²	104	56.7 Å²	56.7	45%	0.452	28%	0.283	S	S	.	.	H	α-helix	trans	-59.9	-50.2	175.3	-66	162.9	-151.9	164.6	0	112.1	S3542 D3543 R3544 L3548 I3549 N3550	S3542-K3546 WeakPolarHBondContact O-CE 3.4Å; S3542-K3546 WeakPolarHBondContact O-CG 3.32Å; S3542-K3546 PolarHBondContact O-N 3.46Å; S3542-K3546 WeakPolarHBondContact OG-CE 3.34Å; D3543-K3546 PolarHBondContact O-N 2.74Å; D3543-K3546 IonicContact OD1-NZ 2.68Å; D3543-K3546 PolarHBondContact OD1-NZ 3.49Å; R3544-K3546 VanDerWaalsContact C-N 3.33Å; R3544-K3546 PolarHBondContact O-N 3.4Å; K3546-L3548 VanDerWaalsContact C-N 3.3Å; K3546-L3548 PolarHBondContact O-N 3.39Å; K3546-I3549 PolarHBondContact O-N 3.47Å; K3546-N3550 PolarHBondContact O-N 3.41Å; K3546-N3550 PolarHBondContact O-OD1 3.43Å
3547	K	86.8	Confident	82.6	Confident	75 Å²	75	60.6 Å²	60.6	33%	0.326	30%	0.304	S	S	.	.	H	α-helix	trans	-57.2	-41.3	175.2	-79.6	-167.2	174.5	-167.1	0	112.1	D3543 R3544 N3550 L3551 F3642 E3645 N3646	D3543-K3547 PolarHBondContact O-N 2.9Å; D3543-K3547 VanDerWaalsContact O-N 3.1Å; R3544-K3547 PolarHBondContact O-N 2.69Å; K3547-N3550 PolarHBondContact O-N 2.91Å; K3547-L3551 PolarHBondContact O-N 3.1Å; K3547-F3642 HydrophobicContact CB-CD2 4.24Å; K3547-F3642 HydrophobicContact CB-CE2 3.59Å; K3547-F3642 HydrophobicContact CD-CD2 4.2Å; K3547-F3642 HydrophobicContact CD-CE2 3.74Å; K3547-F3642 HydrophobicContact CG-CE2 4.33Å; K3547-E3645 IonicContact NZ-OE2 3.81Å; K3547-E3645 PolarHBondContact NZ-OE2 2.98Å; K3547-N3646 PolarHBondContact NZ-OD1 3.16Å
3548	L	86.5	Confident	83.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-38.9	178	-70.6	173.9	0	0	0	112.5	L3540 R3544 I3545 K3546 L3551 I3552 L3592 L3600 F3603 M3639 F3642	L3540-L3548 HydrophobicContact CD2-CD1 3.87Å; L3540-L3548 HydrophobicContact CG-CD1 4.2Å; R3544-L3548 WeakPolarHBondContact O-CB 3.38Å; R3544-L3548 VanDerWaalsContact O-CG 3.3Å; R3544-L3548 WeakPolarHBondContact O-CG 3.48Å; R3544-L3548 PolarHBondContact O-N 3.33Å; I3545-L3548 PolarHBondContact O-N 3.03Å; K3546-L3548 VanDerWaalsContact C-N 3.3Å; K3546-L3548 PolarHBondContact O-N 3.39Å; L3548-L3551 HydrophobicContact CD2-CD1 4.48Å; L3548-L3551 WeakPolarHBondContact O-CB 3.38Å; L3548-L3551 PolarHBondContact O-N 2.91Å; L3548-I3552 VanDerWaalsContact O-CG1 3.26Å; L3548-I3552 WeakPolarHBondContact O-CG1 3.22Å; L3548-I3552 PolarHBondContact O-N 3.28Å; L3548-I3552 VanDerWaalsContact O-N 3.11Å; L3548-L3592 HydrophobicContact CB-CD1 4.33Å; L3548-L3592 HydrophobicContact CB-CD2 4.46Å; L3548-L3592 HydrophobicContact CD1-CD2 4.41Å; L3548-L3600 HydrophobicContact CD1-CD1 3.83Å; L3548-L3600 HydrophobicContact CD2-CD1 4.15Å; L3548-F3603 HydrophobicContact CD1-CD1 4.22Å; L3548-F3603 HydrophobicContact CD1-CG 4.48Å; L3548-F3603 HydrophobicContact CD2-CD1 4.13Å; L3548-F3603 HydrophobicContact CD2-CE1 3.76Å; L3548-F3603 HydrophobicContact CD2-CZ 4.4Å; L3548-M3639 HydrophobicContact CD2-SD 4.41Å; L3548-F3642 HydrophobicContact CD2-CD1 4.07Å; L3548-F3642 HydrophobicContact CD2-CD2 4.47Å; L3548-F3642 HydrophobicContact CD2-CE1 3.78Å; L3548-F3642 HydrophobicContact CD2-CE2 4.2Å; L3548-F3642 HydrophobicContact CD2-CG 4.41Å; L3548-F3642 HydrophobicContact CD2-CZ 3.84Å; L3548-F3642 HydrophobicContact CG-CE1 4.27Å; L3548-F3642 HydrophobicContact CG-CE2 4.34Å; L3548-F3642 HydrophobicContact CG-CZ 3.91Å
3549	I	87.7	Confident	84.1	Confident	20 Å²	20	61 Å²	61	10%	0.103	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-47.5	172.9	-71.5	164.2	0	0	0	110	I3545 K3546 L3551 I3552 E3553 L3592 K3593	I3545-I3549 HydrophobicContact CG2-CD1 3.82Å; I3545-I3549 HydrophobicContact CG2-CG1 4.44Å; I3545-I3549 WeakPolarHBondContact O-CG1 3.23Å; I3545-I3549 PolarHBondContact O-N 2.96Å; K3546-I3549 PolarHBondContact O-N 3.47Å; I3549-L3551 VanDerWaalsContact C-N 3.33Å; I3549-L3551 PolarHBondContact O-N 3.03Å; I3549-I3552 PolarHBondContact O-N 2.95Å; I3549-I3552 VanDerWaalsContact O-N 3.13Å; I3549-E3553 HydrophobicContact CG2-CG 4.31Å; I3549-E3553 WeakPolarHBondContact CG2-OE1 3.47Å; I3549-E3553 WeakPolarHBondContact O-CG 3.36Å; I3549-E3553 PolarHBondContact O-N 3.4Å; I3549-L3592 HydrophobicContact CD1-CB 4.42Å; I3549-L3592 HydrophobicContact CG1-CB 4.07Å; I3549-L3592 HydrophobicContact CG1-CD1 4.17Å; I3549-K3593 HydrophobicContact CD1-CD 4.42Å; I3549-K3593 HydrophobicContact CD1-CG 3.67Å
3550	N	88.3	Confident	84.5	Confident	94 Å²	94	55.7 Å²	55.7	50%	0.503	27%	0.274	S	S	.	.	H	α-helix	trans	-57.9	-43.6	176.4	-66.4	11.5	0	0	0	111.9	K3546 K3547 I3552 E3553 E3554	K3546-N3550 PolarHBondContact O-N 3.41Å; K3546-N3550 PolarHBondContact O-OD1 3.43Å; K3547-N3550 PolarHBondContact O-N 2.91Å; N3550-I3552 VanDerWaalsContact C-N 3.28Å; N3550-I3552 PolarHBondContact O-N 3.27Å; N3550-E3553 PolarHBondContact O-N 3.37Å; N3550-E3554 WeakPolarHBondContact O-CG 3.03Å; N3550-E3554 PolarHBondContact O-N 3.06Å
3551	L	86.9	Confident	85	Confident	10 Å²	10	54.5 Å²	54.5	5%	0.052	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-39.3	177.2	-168	165.5	0	0	0	111.7	K3547 L3548 I3549 L3555 F3635 K3638 M3639 F3642	K3547-L3551 PolarHBondContact O-N 3.1Å; L3548-L3551 HydrophobicContact CD2-CD1 4.48Å; L3548-L3551 WeakPolarHBondContact O-CB 3.38Å; L3548-L3551 PolarHBondContact O-N 2.91Å; I3549-L3551 VanDerWaalsContact C-N 3.33Å; I3549-L3551 PolarHBondContact O-N 3.03Å; L3551-L3555 HydrophobicContact CD2-CD1 3.68Å; L3551-L3555 HydrophobicContact CD2-CG 4.34Å; L3551-L3555 WeakPolarHBondContact O-CG 3.48Å; L3551-L3555 PolarHBondContact O-N 3.03Å; L3551-F3635 HydrophobicContact CD2-CD2 4.23Å; L3551-K3638 HydrophobicContact CD1-CB 4.12Å; L3551-K3638 HydrophobicContact CD2-CB 3.96Å; L3551-K3638 HydrophobicContact CG-CB 4Å; L3551-M3639 HydrophobicContact CD1-SD 4.41Å; L3551-F3642 HydrophobicContact CD1-CB 4.14Å; L3551-F3642 HydrophobicContact CD1-CG 4.5Å
3552	I	87.2	Confident	85.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-77.4	-36	178.5	-56.9	164.4	0	0	0	111.4	L3548 I3549 N3550 E3554 L3555 Q3556 L3585 V3588 I3589 L3592 F3603 M3607	L3548-I3552 VanDerWaalsContact O-CG1 3.26Å; L3548-I3552 WeakPolarHBondContact O-CG1 3.22Å; L3548-I3552 PolarHBondContact O-N 3.28Å; L3548-I3552 VanDerWaalsContact O-N 3.11Å; I3549-I3552 PolarHBondContact O-N 2.95Å; I3549-I3552 VanDerWaalsContact O-N 3.13Å; N3550-I3552 VanDerWaalsContact C-N 3.28Å; N3550-I3552 PolarHBondContact O-N 3.27Å; I3552-E3554 VanDerWaalsContact C-N 3.31Å; I3552-L3555 CarbonylContact O-C 3.26Å; I3552-L3555 PolarHBondContact O-N 3.36Å; I3552-Q3556 WeakPolarHBondContact O-CG 3.43Å; I3552-Q3556 PolarHBondContact O-N 3.28Å; I3552-L3585 HydrophobicContact CG2-CB 4.29Å; I3552-L3585 HydrophobicContact CG2-CD2 3.78Å; I3552-L3585 HydrophobicContact CG2-CG 4.05Å; I3552-V3588 HydrophobicContact CD1-CG1 3.97Å; I3552-I3589 HydrophobicContact CB-CD1 4.43Å; I3552-I3589 HydrophobicContact CB-CG1 4.17Å; I3552-I3589 HydrophobicContact CG2-CD1 3.87Å; I3552-I3589 HydrophobicContact CG2-CG1 3.63Å; I3552-L3592 HydrophobicContact CD1-CD1 3.24Å; I3552-F3603 HydrophobicContact CD1-CE2 3.59Å; I3552-F3603 HydrophobicContact CD1-CZ 3.83Å; I3552-F3603 HydrophobicContact CG1-CE2 4.4Å; I3552-F3603 HydrophobicContact CG1-CZ 4.17Å; I3552-M3607 HydrophobicContact CB-CE 4.44Å; I3552-M3607 HydrophobicContact CD1-CE 3.77Å; I3552-M3607 HydrophobicContact CG1-CE 3.55Å; I3552-M3607 HydrophobicContact CG2-CE 4.04Å
3553	E	87.8	Confident	85.5	Confident	65 Å²	65	51.1 Å²	51.1	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-67.8	-32	174.9	-69.9	176.3	-174.1	0	0	110.9	I3549 N3550 Q3557 I3589 K3593	I3549-E3553 HydrophobicContact CG2-CG 4.31Å; I3549-E3553 WeakPolarHBondContact CG2-OE1 3.47Å; I3549-E3553 WeakPolarHBondContact O-CG 3.36Å; I3549-E3553 PolarHBondContact O-N 3.4Å; N3550-E3553 PolarHBondContact O-N 3.37Å; E3553-Q3557 VanDerWaalsContact O-CG 3.31Å; E3553-Q3557 WeakPolarHBondContact O-CG 3.31Å; E3553-Q3557 PolarHBondContact O-N 2.73Å; E3553-Q3557 PolarHBondContact O-NE2 3.09Å; E3553-I3589 HydrophobicContact CG-CD1 3.79Å; E3553-K3593 IonicContact OE1-NZ 2.68Å; E3553-K3593 PolarHBondContact OE1-NZ 2.96Å
3554	E	86.5	Confident	85.5	Confident	91 Å²	91	46.3 Å²	46.3	43%	0.425	21%	0.212	S	C	.	.	H	α-helix	trans	-65.2	-43.4	165.8	-74.7	178	-161.9	0	0	112.4	N3550 I3552 Q3557 H3558 K3638	N3550-E3554 WeakPolarHBondContact O-CG 3.03Å; N3550-E3554 PolarHBondContact O-N 3.06Å; I3552-E3554 VanDerWaalsContact C-N 3.31Å; E3554-Q3557 PolarHBondContact O-N 3.2Å; E3554-H3558 PolarHBondContact O-N 3.31Å; E3554-H3558 VanDerWaalsContact O-N 3.12Å; E3554-K3638 VanDerWaalsContact OE2-CE 3.31Å; E3554-K3638 WeakPolarHBondContact OE2-CE 3.29Å; E3554-K3638 IonicContact OE2-NZ 3.99Å; E3554-K3638 PolarHBondContact OE2-NZ 3.47Å
3555	L	86.5	Confident	85.5	Confident	10 Å²	10	46 Å²	46	5%	0.052	21%	0.214	C	C	.	.	H	α-helix	trans	-66	-37.3	176	-73.4	171	0	0	0	112.1	L3551 I3552 Q3557 H3558 S3561 L3585 L3634 F3635	L3551-L3555 HydrophobicContact CD2-CD1 3.68Å; L3551-L3555 HydrophobicContact CD2-CG 4.34Å; L3551-L3555 WeakPolarHBondContact O-CG 3.48Å; L3551-L3555 PolarHBondContact O-N 3.03Å; I3552-L3555 CarbonylContact O-C 3.26Å; I3552-L3555 PolarHBondContact O-N 3.36Å; L3555-Q3557 VanDerWaalsContact C-N 3.25Å; L3555-Q3557 PolarHBondContact O-N 3.17Å; L3555-H3558 WeakPolarHBondContact O-CB 3.37Å; L3555-H3558 PolarHBondContact O-N 3.09Å; L3555-H3558 VanDerWaalsContact O-N 3.1Å; L3555-S3561 WeakPolarHBondContact O-CB 3.46Å; L3555-S3561 PolarHBondContact O-OG 2.9Å; L3555-L3585 HydrophobicContact CB-CD2 4.1Å; L3555-L3634 HydrophobicContact CD2-CB 4.31Å; L3555-F3635 HydrophobicContact CD1-CB 4.09Å; L3555-F3635 HydrophobicContact CD1-CD2 3.84Å; L3555-F3635 HydrophobicContact CD1-CG 4.45Å
3556	Q	85.6	Confident	85.1	Confident	53 Å²	53	51.7 Å²	51.7	25%	0.248	24%	0.24	C	C	.	.	H	α-helix	trans	-63.3	-30	172.7	-76.1	-171.5	-15	0	0	112.9	I3552 S3561 L3585	I3552-Q3556 WeakPolarHBondContact O-CG 3.43Å; I3552-Q3556 PolarHBondContact O-N 3.28Å; Q3556-S3561 WeakPolarHBondContact CA-OG 3.38Å; Q3556-S3561 PolarHBondContact O-OG 3.02Å; Q3556-L3585 HydrophobicContact CG-CB 3.96Å; Q3556-L3585 HydrophobicContact CG-CD2 3.57Å; Q3556-L3585 HydrophobicContact CG-CG 4.39Å
3557	Q	84.6	Confident	84.5	Confident	157 Å²	157	50.6 Å²	50.6	73%	0.734	24%	0.243	S	C	*	.	H	α-helix	trans	-81	-14.9	174.4	-71.4	168.5	62.3	0	0	113.1	E3553 E3554 L3555 K3559	E3553-Q3557 VanDerWaalsContact O-CG 3.31Å; E3553-Q3557 WeakPolarHBondContact O-CG 3.31Å; E3553-Q3557 PolarHBondContact O-N 2.73Å; E3553-Q3557 PolarHBondContact O-NE2 3.09Å; E3554-Q3557 PolarHBondContact O-N 3.2Å; L3555-Q3557 VanDerWaalsContact C-N 3.25Å; L3555-Q3557 PolarHBondContact O-N 3.17Å; Q3557-K3559 PolarHBondContact O-N 3.41Å
3558	H	83.9	Confident	83.8	Confident	60 Å²	60	48.2 Å²	48.2	28%	0.278	24%	0.235	S	C	.	.	S	Bend	trans	-69	131.4	179.1	-169.9	-110.9	0	0	0	111.6	E3554 L3555 M3560 S3561 L3634	E3554-H3558 PolarHBondContact O-N 3.31Å; E3554-H3558 VanDerWaalsContact O-N 3.12Å; L3555-H3558 WeakPolarHBondContact O-CB 3.37Å; L3555-H3558 PolarHBondContact O-N 3.09Å; L3555-H3558 VanDerWaalsContact O-N 3.1Å; H3558-M3560 WeakPolarHBondContact CE1-CG 3.47Å; H3558-M3560 PolarHBondContact O-N 3.17Å; H3558-S3561 PolarHBondContact O-N 3.45Å; H3558-S3561 PolarHBondContact O-OG 3.46Å; H3558-L3634 WeakPolarHBondContact CE1-CD1 3.16Å; H3558-L3634 WeakPolarHBondContact ND1-CD1 3.35Å
3559	K	82.5	Confident	83	Confident	87 Å²	87	52 Å²	52	38%	0.378	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-18.4	-174.2	-63.7	-173.6	179.3	-171.5	0	115.6	C3402 D3404 D3429 Q3557	C3402-K3559 HydrophobicContact CB-CB 3.81Å; C3402-K3559 HydrophobicContact CB-CD 3.94Å; C3402-K3559 HydrophobicContact CB-CG 4.44Å; D3404-K3559 WeakPolarHBondContact OD2-CD 3.42Å; D3404-K3559 WeakPolarHBondContact OD2-CE 3.46Å; D3404-K3559 IonicContact OD2-NZ 2.63Å; D3404-K3559 PolarHBondContact OD2-NZ 2.99Å; D3429-K3559 IonicContact OD2-NZ 3.59Å; D3429-K3559 PolarHBondContact OD2-NZ 3.01Å; Q3557-K3559 PolarHBondContact O-N 3.41Å
3560	M	81.5	Confident	82.2	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-11.3	-179	-50.6	-71.6	83.5	0	0	114.4	L3401 C3402 C3430 H3558 W3562 P3563 C3627 I3630 V3631	L3401-M3560 HydrophobicContact CB-CE 3.77Å; L3401-M3560 HydrophobicContact CB-SD 3.73Å; L3401-M3560 VanDerWaalsContact O-CE 3.32Å; L3401-M3560 WeakPolarHBondContact O-CE 3.41Å; C3402-M3560 VanDerWaalsContact CA-CE 3.47Å; C3402-M3560 HydrophobicContact CB-CE 3.54Å; C3430-M3560 WeakPolarHBondContact SG-CE 3.33Å; H3558-M3560 WeakPolarHBondContact CE1-CG 3.47Å; H3558-M3560 PolarHBondContact O-N 3.17Å; M3560-W3562 VanDerWaalsContact C-N 3.33Å; M3560-W3562 PolarHBondContact O-N 3.47Å; M3560-P3563 WeakPolarHBondContact O-CD 3.48Å; M3560-C3627 HydrophobicContact CB-CB 4.38Å; M3560-C3627 WeakPolarHBondContact O-CB 3.44Å; M3560-I3630 HydrophobicContact CG-CB 4.38Å; M3560-I3630 HydrophobicContact CG-CG2 3.85Å; M3560-I3630 HydrophobicContact SD-CD1 4.04Å; M3560-I3630 HydrophobicContact SD-CG2 4.47Å; M3560-V3631 HydrophobicContact CB-CG2 3.54Å
3561	S	86.3	Confident	81.3	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.007	28%	0.283	C	S	.	.			trans	-85.7	-1.5	-169.6	66.5	0	0	0	0	115	L3555 Q3556 H3558 P3563 F3564	L3555-S3561 WeakPolarHBondContact O-CB 3.46Å; L3555-S3561 PolarHBondContact O-OG 2.9Å; Q3556-S3561 WeakPolarHBondContact CA-OG 3.38Å; Q3556-S3561 PolarHBondContact O-OG 3.02Å; H3558-S3561 PolarHBondContact O-N 3.45Å; H3558-S3561 PolarHBondContact O-OG 3.46Å; S3561-P3563 VanDerWaalsContact C-N 3.29Å; S3561-P3563 WeakPolarHBondContact O-CD 3.31Å; S3561-P3563 VanDerWaalsContact O-N 3.13Å; S3561-F3564 WeakPolarHBondContact O-CB 3.28Å; S3561-F3564 WeakPolarHBondContact O-CD2 3.45Å; S3561-F3564 PolarHBondContact O-N 3.26Å
3562	W	84.7	Confident	80.6	Confident	58 Å²	58	63.2 Å²	63.2	22%	0.22	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-52.6	-29.4	178.2	66.6	-99.9	0	0	0	115.8	L3401 R3403 M3560 F3564 E3624	L3401-W3562 PolarHBondContact O-NE1 2.79Å; R3403-W3562 VanDerWaalsContact NH1-CE3 3.32Å; M3560-W3562 VanDerWaalsContact C-N 3.33Å; M3560-W3562 PolarHBondContact O-N 3.47Å; W3562-F3564 PolarHBondContact O-N 3.44Å; W3562-F3564 VanDerWaalsContact O-N 3.15Å; W3562-E3624 HydrophobicContact CH2-CB 4.44Å; W3562-E3624 VanDerWaalsContact CH2-CD 3.5Å; W3562-E3624 HydrophobicContact CH2-CG 3.58Å; W3562-E3624 WeakPolarHBondContact CH2-OE1 3.37Å; W3562-E3624 HydrophobicContact CZ3-CG 3.91Å
3563	P	84	Confident	79.8	Confident	6 Å²	6	65.1 Å²	65.1	4%	0.039	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-67.3	-11.4	175.9	-16.9	30.1	0	0	0	114.4	M3560 S3561 Y3618 E3624 C3627	M3560-P3563 WeakPolarHBondContact O-CD 3.48Å; S3561-P3563 VanDerWaalsContact C-N 3.29Å; S3561-P3563 WeakPolarHBondContact O-CD 3.31Å; S3561-P3563 VanDerWaalsContact O-N 3.13Å; P3563-Y3618 HydrophobicContact CB-CE2 4.12Å; P3563-Y3618 PolarHBondContact O-OH 2.95Å; P3563-E3624 HydrophobicContact CB-CG 4.48Å; P3563-C3627 HydrophobicContact CG-CB 3.76Å
3564	F	83.6	Confident	78.9	Confident	3 Å²	3	66.5 Å²	66.5	1%	0.013	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-117.5	-2.9	-173.2	-52.2	-86.9	0	0	0	114	S3561 W3562 N3584 L3585 L3610 F3611 S3614 T3628 V3631	S3561-F3564 WeakPolarHBondContact O-CB 3.28Å; S3561-F3564 WeakPolarHBondContact O-CD2 3.45Å; S3561-F3564 PolarHBondContact O-N 3.26Å; W3562-F3564 PolarHBondContact O-N 3.44Å; W3562-F3564 VanDerWaalsContact O-N 3.15Å; F3564-N3584 WeakPolarHBondContact O-CB 3.32Å; F3564-L3585 HydrophobicContact CB-CD1 3.34Å; F3564-L3585 HydrophobicContact CG-CD1 4.03Å; F3564-L3585 PolarHBondContact O-N 2.86Å; F3564-L3610 HydrophobicContact CB-CD2 4.41Å; F3564-L3610 HydrophobicContact CD1-CD1 3.91Å; F3564-L3610 HydrophobicContact CD1-CD2 3.74Å; F3564-L3610 HydrophobicContact CD1-CG 3.67Å; F3564-L3610 HydrophobicContact CE1-CD2 4.17Å; F3564-L3610 HydrophobicContact CE1-CG 3.98Å; F3564-L3610 HydrophobicContact CG-CD2 4.31Å; F3564-F3611 AromaticContact CE1-CD1 3.71Å; F3564-F3611 HydrophobicContact CE1-CD1 3.71Å; F3564-F3611 AromaticContact CE1-CE1 3.99Å; F3564-F3611 HydrophobicContact CE1-CE1 3.99Å; F3564-F3611 HydrophobicContact CE2-CE1 4.31Å; F3564-F3611 AromaticContact CZ-CD1 3.56Å; F3564-F3611 HydrophobicContact CZ-CD1 3.56Å; F3564-F3611 AromaticContact CZ-CE1 3.66Å; F3564-F3611 HydrophobicContact CZ-CE1 3.66Å; F3564-S3614 WeakPolarHBondContact CE1-OG 3.24Å; F3564-T3628 HydrophobicContact CE1-CG2 4.34Å; F3564-T3628 HydrophobicContact CZ-CG2 3.91Å; F3564-V3631 HydrophobicContact CE2-CB 3.89Å; F3564-V3631 HydrophobicContact CE2-CG1 4.03Å; F3564-V3631 HydrophobicContact CE2-CG2 4.07Å; F3564-V3631 HydrophobicContact CZ-CB 4.49Å
3565	I	83.2	Confident	78	Confident	55 Å²	55	67 Å²	67	28%	0.282	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-32.3	176.7	-61.6	177.8	0	0	0	110.2
3566	H	76.1	Confident	77	Confident	136 Å²	136	67.4 Å²	67.4	63%	0.63	34%	0.342	S	S	*	.	S	Bend	trans	-120.6	150.6	-178.1	-56.3	-53.5	0	0	0	111
3567	T	75.6	Confident	75.9	Confident	81 Å²	81	72.2 Å²	72.2	50%	0.497	36%	0.358	S	S	.	.			trans	-64.1	130.5	171.1	45.7	0	0	0	0	109.5	D3569 A3582 N3584	T3567-D3569 PolarHBondContact O-N 3.01Å; T3567-A3582 HydrophobicContact CG2-CB 4.12Å; T3567-N3584 VanDerWaalsContact CG2-ND2 3.26Å; T3567-N3584 WeakPolarHBondContact CG2-ND2 3.45Å; T3567-N3584 PolarHBondContact N-ND2 2.7Å
3568	P	70.9	Confident	74.8	Confident	25 Å²	25	68.6 Å²	68.6	16%	0.162	35%	0.35	C	S	.	.			trans	-62	133.3	179.2	19.9	-29.5	0	0	0	112	P3570 F3573 A3576 I3617 Y3618	P3568-P3570 WeakPolarHBondContact O-CD 3.46Å; P3568-P3570 VanDerWaalsContact O-N 3.11Å; P3568-F3573 HydrophobicContact CB-CD2 4.26Å; P3568-A3576 HydrophobicContact CB-CB 4.49Å; P3568-A3576 HydrophobicContact CG-CB 4.13Å; P3568-I3617 HydrophobicContact CB-CG2 4.12Å; P3568-I3617 HydrophobicContact CG-CD1 3.79Å; P3568-I3617 HydrophobicContact CG-CG2 4.14Å; P3568-Y3618 HydrophobicContact CB-CE1 4.22Å
3569	D	70	Confident	73.8	Confident	80 Å²	80	67.9 Å²	67.9	43%	0.428	35%	0.348	S	S	.	.			trans	-53.6	113	-179.2	-82.4	-43.4	0	0	0	111.8	T3567 L3571 K3572 F3573	T3567-D3569 PolarHBondContact O-N 3.01Å; D3569-L3571 PolarHBondContact O-N 3.37Å; D3569-K3572 HydrophobicContact CB-CB 4.09Å; D3569-K3572 HydrophobicContact CB-CD 3.93Å; D3569-K3572 HydrophobicContact CB-CG 3.94Å; D3569-K3572 PolarHBondContact O-N 3.38Å; D3569-K3572 WeakPolarHBondContact OD2-CD 3.44Å; D3569-K3572 WeakPolarHBondContact OD2-CE 3.44Å; D3569-K3572 IonicContact OD2-NZ 2.71Å; D3569-K3572 PolarHBondContact OD2-NZ 2.9Å; D3569-F3573 PolarHBondContact O-N 3.3Å; D3569-F3573 VanDerWaalsContact O-N 3.11Å
3570	P	70.8	Confident	72.4	Confident	63 Å²	63	71.1 Å²	71.1	41%	0.409	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	2.5	-179.7	-19.3	33.4	0	0	0	114	P3568 R3577	P3568-P3570 WeakPolarHBondContact O-CD 3.46Å; P3568-P3570 VanDerWaalsContact O-N 3.11Å; P3570-R3577 HydrophobicContact CB-CG 3.81Å; P3570-R3577 VanDerWaalsContact O-CZ 3.26Å; P3570-R3577 PolarHBondContact O-NE 3.04Å; P3570-R3577 PolarHBondContact O-NH2 3.41Å
3571	L	70.3	Confident	71.3	Confident	151 Å²	151	75.1 Å²	75.1	79%	0.791	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-28.3	170.9	-69.1	168	0	0	0	112.7	D3569	D3569-L3571 PolarHBondContact O-N 3.37Å
3572	K	71.9	Confident	69.8	Low	144 Å²	144	78.5 Å²	78.5	63%	0.626	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-39.5	177.4	-66	176.7	-174.3	152.5	0	111.5	D3569 P3574	D3569-K3572 HydrophobicContact CB-CB 4.09Å; D3569-K3572 HydrophobicContact CB-CD 3.93Å; D3569-K3572 HydrophobicContact CB-CG 3.94Å; D3569-K3572 PolarHBondContact O-N 3.38Å; D3569-K3572 WeakPolarHBondContact OD2-CD 3.44Å; D3569-K3572 WeakPolarHBondContact OD2-CE 3.44Å; D3569-K3572 IonicContact OD2-NZ 2.71Å; D3569-K3572 PolarHBondContact OD2-NZ 2.9Å; K3572-P3574 WeakPolarHBondContact O-CD 3.35Å
3573	F	70.2	Confident	69.1	Low	41 Å²	41	77.1 Å²	77.1	18%	0.18	42%	0.415	C	S	.	.			trans	-120.3	92.6	-176.9	-54.8	-77.7	0	0	0	110.2	P3568 D3569 M3575 A3576 I3617 Y3618	P3568-F3573 HydrophobicContact CB-CD2 4.26Å; D3569-F3573 PolarHBondContact O-N 3.3Å; D3569-F3573 VanDerWaalsContact O-N 3.11Å; F3573-M3575 PolarHBondContact O-N 3.03Å; F3573-M3575 VanDerWaalsContact O-N 3.13Å; F3573-A3576 HydrophobicContact CB-CB 4.46Å; F3573-A3576 VanDerWaalsContact O-CB 3.31Å; F3573-A3576 WeakPolarHBondContact O-CB 3.4Å; F3573-A3576 PolarHBondContact O-N 3.47Å; F3573-I3617 HydrophobicContact CB-CG2 3.66Å; F3573-I3617 HydrophobicContact CD1-CG2 4.48Å; F3573-I3617 HydrophobicContact CG-CG2 3.99Å; F3573-Y3618 HydrophobicContact CD1-CD1 4.13Å; F3573-Y3618 HydrophobicContact CD2-CD1 4.48Å; F3573-Y3618 HydrophobicContact CD2-CE1 4.11Å; F3573-Y3618 AromaticContact CE1-CD1 3.85Å; F3573-Y3618 HydrophobicContact CE1-CD1 3.85Å; F3573-Y3618 HydrophobicContact CE1-CE1 4.31Å; F3573-Y3618 HydrophobicContact CE2-CD1 4.22Å; F3573-Y3618 AromaticContact CE2-CE1 3.84Å; F3573-Y3618 HydrophobicContact CE2-CE1 3.84Å; F3573-Y3618 HydrophobicContact CG-CD1 4.44Å; F3573-Y3618 HydrophobicContact CG-CE1 4.46Å; F3573-Y3618 AromaticContact CZ-CD1 3.89Å; F3573-Y3618 HydrophobicContact CZ-CD1 3.89Å; F3573-Y3618 AromaticContact CZ-CE1 3.95Å; F3573-Y3618 HydrophobicContact CZ-CE1 3.95Å
3574	P	67.8	Low	69	Low	94 Å²	94	77.7 Å²	77.7	61%	0.61	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-57.7	-29	-177.6	-27.7	36	0	0	0	114.1	K3572 A3576 R3577	K3572-P3574 WeakPolarHBondContact O-CD 3.35Å; P3574-A3576 PolarHBondContact O-N 3.03Å; P3574-R3577 WeakPolarHBondContact O-CB 3.37Å; P3574-R3577 PolarHBondContact O-N 2.61Å; P3574-R3577 VanDerWaalsContact O-N 3.1Å
3575	M	67.7	Low	69	Low	101 Å²	101	77.7 Å²	77.7	50%	0.498	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-64.2	-24.9	177.3	-159.1	82.3	90.4	0	0	113	F3573 R3577 S3578 L3616	F3573-M3575 PolarHBondContact O-N 3.03Å; F3573-M3575 VanDerWaalsContact O-N 3.13Å; M3575-R3577 PolarHBondContact O-N 2.67Å; M3575-R3577 VanDerWaalsContact O-N 3.14Å; M3575-S3578 WeakPolarHBondContact O-CB 3.36Å; M3575-S3578 PolarHBondContact O-N 3.4Å; M3575-L3616 WeakPolarHBondContact CG-O 3.46Å
3576	A	66.7	Low	69.1	Low	19 Å²	19	77.2 Å²	77.2	16%	0.157	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-63.6	-16.5	174.5	0	0	0	0	0	113	P3568 F3573 P3574 I3617	P3568-A3576 HydrophobicContact CB-CB 4.49Å; P3568-A3576 HydrophobicContact CG-CB 4.13Å; F3573-A3576 HydrophobicContact CB-CB 4.46Å; F3573-A3576 VanDerWaalsContact O-CB 3.31Å; F3573-A3576 WeakPolarHBondContact O-CB 3.4Å; F3573-A3576 PolarHBondContact O-N 3.47Å; P3574-A3576 PolarHBondContact O-N 3.03Å; A3576-I3617 HydrophobicContact CB-CD1 4.13Å; A3576-I3617 HydrophobicContact CB-CG1 4.32Å; A3576-I3617 HydrophobicContact CB-CG2 4.18Å
3577	R	61	Low	69.4	Low	154 Å²	154	72.3 Å²	72.3	58%	0.581	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-82.9	-11.9	171.4	-57.7	-177.8	-171.6	-162.4	-1.2	114.1	P3570 P3574 M3575	P3570-R3577 HydrophobicContact CB-CG 3.81Å; P3570-R3577 VanDerWaalsContact O-CZ 3.26Å; P3570-R3577 PolarHBondContact O-NE 3.04Å; P3570-R3577 PolarHBondContact O-NH2 3.41Å; P3574-R3577 WeakPolarHBondContact O-CB 3.37Å; P3574-R3577 PolarHBondContact O-N 2.61Å; P3574-R3577 VanDerWaalsContact O-N 3.1Å; M3575-R3577 PolarHBondContact O-N 2.67Å; M3575-R3577 VanDerWaalsContact O-N 3.14Å
3578	S	62.5	Low	69.8	Low	81 Å²	81	68.4 Å²	68.4	57%	0.566	38%	0.375	S	S	*	.	S	Bend	trans	-98.8	3.7	-178.4	-53.4	0	0	0	0	112.4	M3575	M3575-S3578 WeakPolarHBondContact O-CB 3.36Å; M3575-S3578 PolarHBondContact O-N 3.4Å
3579	L	62.5	Low	70.5	Confident	45 Å²	45	68 Å²	68	24%	0.236	37%	0.371	C	S	.	.			trans	-125.1	82.1	-179.5	-64.6	172.8	0	0	0	107.1	D3581 N3613 L3616 I3617	L3579-D3581 PolarHBondContact O-N 3.45Å; L3579-N3613 HydrophobicContact CD1-CB 4.24Å; L3579-L3616 HydrophobicContact CD1-CB 4.28Å; L3579-L3616 HydrophobicContact CD2-CD1 4.49Å; L3579-I3617 HydrophobicContact CD1-CD1 3.9Å; L3579-I3617 HydrophobicContact CD1-CG1 3.66Å
3580	D	54.1	Low	71.3	Confident	155 Å²	155	68.9 Å²	68.9	83%	0.829	38%	0.375	S	S	*	.			trans	-60.9	-15.2	-169.3	-64.2	-65.3	0	0	0	114.8	A3582	D3580-A3582 PolarHBondContact O-N 2.98Å
3581	D	56.8	Low	72	Confident	85 Å²	85	67.9 Å²	67.9	46%	0.455	37%	0.366	S	S	.	.	S	Bend	trans	-92.9	95.3	174.9	-72.7	-19.6	0	0	0	111.5	L3579 F3583 R3609	L3579-D3581 PolarHBondContact O-N 3.45Å; D3581-F3583 VanDerWaalsContact C-N 3.35Å; D3581-F3583 PolarHBondContact O-N 2.77Å; D3581-R3609 IonicContact OD2-CZ 2.88Å; D3581-R3609 IonicContact OD2-NH1 3.17Å; D3581-R3609 PolarHBondContact OD2-NH1 2.91Å; D3581-R3609 IonicContact OD2-NH2 3.11Å; D3581-R3609 PolarHBondContact OD2-NH2 3.45Å
3582	A	55.9	Low	72.7	Confident	72 Å²	72	60.8 Å²	60.8	60%	0.595	33%	0.329	S	S	*	.			trans	-70	81.8	177.9	0	0	0	0	0	112.8	T3567 D3580	T3567-A3582 HydrophobicContact CG2-CB 4.12Å; D3580-A3582 PolarHBondContact O-N 2.98Å
3583	F	70.4	Confident	73.4	Confident	29 Å²	29	59.7 Å²	59.7	13%	0.127	32%	0.324	C	S	.	.			trans	-102.4	121.9	-170.2	-156.5	-97.9	0	0	0	112.5	D3581 V3588 D3606 L3610	D3581-F3583 VanDerWaalsContact C-N 3.35Å; D3581-F3583 PolarHBondContact O-N 2.77Å; F3583-V3588 HydrophobicContact CD1-CG2 4.39Å; F3583-V3588 HydrophobicContact CE1-CG2 3.47Å; F3583-V3588 VanDerWaalsContact CE1-CG2 3.47Å; F3583-V3588 HydrophobicContact CZ-CG2 3.63Å; F3583-D3606 HydrophobicContact CE1-CB 4.17Å; F3583-D3606 WeakPolarHBondContact CE1-O 3.47Å; F3583-D3606 HydrophobicContact CE2-CB 4.49Å; F3583-D3606 WeakPolarHBondContact CE2-OD2 3.44Å; F3583-D3606 HydrophobicContact CZ-CB 3.64Å; F3583-D3606 VanDerWaalsContact CZ-CG 3.43Å; F3583-D3606 WeakPolarHBondContact CZ-OD2 3.46Å; F3583-L3610 HydrophobicContact CD1-CB 3.89Å; F3583-L3610 HydrophobicContact CD1-CD1 3.98Å; F3583-L3610 HydrophobicContact CE1-CB 4.15Å; F3583-L3610 WeakPolarHBondContact O-CD1 3.44Å
3584	N	81.4	Confident	74.1	Confident	17 Å²	17	61.8 Å²	61.8	9%	0.091	34%	0.341	C	S	.	.			trans	-136	165.5	-176.7	-59.2	-13	0	0	0	110.6	F3564 T3567 S3587 V3588	F3564-N3584 WeakPolarHBondContact O-CB 3.32Å; T3567-N3584 VanDerWaalsContact CG2-ND2 3.26Å; T3567-N3584 WeakPolarHBondContact CG2-ND2 3.45Å; T3567-N3584 PolarHBondContact N-ND2 2.7Å; N3584-S3587 PolarHBondContact N-OG 3.29Å; N3584-S3587 WeakPolarHBondContact O-CA 3.13Å; N3584-S3587 VanDerWaalsContact O-CB 3.26Å; N3584-S3587 WeakPolarHBondContact O-CB 3.4Å; N3584-S3587 PolarHBondContact O-N 3.06Å; N3584-V3588 PolarHBondContact O-N 3.39Å
3585	L	83.6	Confident	74.7	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-55.6	-43	175.3	-89.9	79.7	0	0	0	113.5	I3552 L3555 Q3556 F3564 S3587 V3588 I3589 L3610	I3552-L3585 HydrophobicContact CG2-CB 4.29Å; I3552-L3585 HydrophobicContact CG2-CD2 3.78Å; I3552-L3585 HydrophobicContact CG2-CG 4.05Å; L3555-L3585 HydrophobicContact CB-CD2 4.1Å; Q3556-L3585 HydrophobicContact CG-CB 3.96Å; Q3556-L3585 HydrophobicContact CG-CD2 3.57Å; Q3556-L3585 HydrophobicContact CG-CG 4.39Å; F3564-L3585 HydrophobicContact CB-CD1 3.34Å; F3564-L3585 HydrophobicContact CG-CD1 4.03Å; F3564-L3585 PolarHBondContact O-N 2.86Å; L3585-S3587 PolarHBondContact O-N 3.33Å; L3585-V3588 WeakPolarHBondContact O-CB 3.35Å; L3585-V3588 PolarHBondContact O-N 3.42Å; L3585-V3588 VanDerWaalsContact O-N 3.07Å; L3585-I3589 PolarHBondContact O-N 3.24Å; L3585-L3610 HydrophobicContact CD1-CD2 3.39Å; L3585-L3610 HydrophobicContact CG-CD2 4.36Å
3586	P	84.2	Confident	75.5	Confident	46 Å²	46	62.8 Å²	62.8	30%	0.299	34%	0.342	S	S	.	.	H	α-helix	trans	-57.2	-34.6	174	-27.9	36.6	0	0	0	113.5	I3589 I3590	P3586-I3589 PolarHBondContact O-N 3.44Å; P3586-I3590 VanDerWaalsContact O-CG1 3.3Å; P3586-I3590 WeakPolarHBondContact O-CG1 3.5Å; P3586-I3590 PolarHBondContact O-N 3.15Å
3587	S	83.2	Confident	76.3	Confident	32 Å²	32	62.4 Å²	62.4	22%	0.224	34%	0.336	C	S	.	.	H	α-helix	trans	-65.5	-39.6	174.6	-44.7	0	0	0	0	111.5	N3584 L3585 I3590 N3591	N3584-S3587 PolarHBondContact N-OG 3.29Å; N3584-S3587 WeakPolarHBondContact O-CA 3.13Å; N3584-S3587 VanDerWaalsContact O-CB 3.26Å; N3584-S3587 WeakPolarHBondContact O-CB 3.4Å; N3584-S3587 PolarHBondContact O-N 3.06Å; L3585-S3587 PolarHBondContact O-N 3.33Å; S3587-I3590 PolarHBondContact O-N 3.11Å; S3587-N3591 WeakPolarHBondContact O-CB 3.47Å; S3587-N3591 VanDerWaalsContact O-CG 3.26Å; S3587-N3591 PolarHBondContact O-N 3.41Å; S3587-N3591 PolarHBondContact O-OD1 2.66Å
3588	V	84.3	Confident	77.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65	-41.9	174.9	-166.7	0	0	0	0	111.6	I3552 F3583 N3584 L3585 I3590 N3591 L3592 Y3597 F3603 M3607	I3552-V3588 HydrophobicContact CD1-CG1 3.97Å; F3583-V3588 HydrophobicContact CD1-CG2 4.39Å; F3583-V3588 HydrophobicContact CE1-CG2 3.47Å; F3583-V3588 VanDerWaalsContact CE1-CG2 3.47Å; F3583-V3588 HydrophobicContact CZ-CG2 3.63Å; N3584-V3588 PolarHBondContact O-N 3.39Å; L3585-V3588 WeakPolarHBondContact O-CB 3.35Å; L3585-V3588 PolarHBondContact O-N 3.42Å; L3585-V3588 VanDerWaalsContact O-N 3.07Å; V3588-I3590 VanDerWaalsContact C-N 3.31Å; V3588-I3590 PolarHBondContact O-N 3.11Å; V3588-N3591 PolarHBondContact O-N 3.37Å; V3588-L3592 HydrophobicContact CG1-CD1 4.45Å; V3588-L3592 PolarHBondContact O-N 2.99Å; V3588-Y3597 HydrophobicContact CG1-CE2 4.2Å; V3588-F3603 HydrophobicContact CG1-CD2 4.11Å; V3588-F3603 HydrophobicContact CG1-CE2 3.68Å; V3588-M3607 HydrophobicContact CB-CE 4.38Å; V3588-M3607 HydrophobicContact CG1-CE 3.99Å; V3588-M3607 HydrophobicContact CG1-SD 4.27Å; V3588-M3607 HydrophobicContact CG2-CE 4.37Å; V3588-M3607 HydrophobicContact CG2-SD 4.01Å
3589	I	86.3	Confident	78.3	Confident	15 Å²	15	60.2 Å²	60.2	8%	0.077	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-39.8	175.6	-67.6	-177.2	0	0	0	110.9	I3552 E3553 L3585 P3586 K3593	I3552-I3589 HydrophobicContact CB-CD1 4.43Å; I3552-I3589 HydrophobicContact CB-CG1 4.17Å; I3552-I3589 HydrophobicContact CG2-CD1 3.87Å; I3552-I3589 HydrophobicContact CG2-CG1 3.63Å; E3553-I3589 HydrophobicContact CG-CD1 3.79Å; L3585-I3589 PolarHBondContact O-N 3.24Å; P3586-I3589 PolarHBondContact O-N 3.44Å; I3589-K3593 HydrophobicContact CG2-CD 3.74Å; I3589-K3593 VanDerWaalsContact CG2-CE 3.49Å; I3589-K3593 WeakPolarHBondContact O-CB 3.21Å; I3589-K3593 VanDerWaalsContact O-CG 3.27Å; I3589-K3593 WeakPolarHBondContact O-CG 3.44Å; I3589-K3593 PolarHBondContact O-N 3.27Å
3590	I	85.9	Confident	79.3	Confident	100 Å²	100	58.3 Å²	58.3	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-52.2	173.5	-69.8	163.1	0	0	0	110	P3586 S3587 V3588 L3592 K3593 T3594	P3586-I3590 VanDerWaalsContact O-CG1 3.3Å; P3586-I3590 WeakPolarHBondContact O-CG1 3.5Å; P3586-I3590 PolarHBondContact O-N 3.15Å; S3587-I3590 PolarHBondContact O-N 3.11Å; V3588-I3590 VanDerWaalsContact C-N 3.31Å; V3588-I3590 PolarHBondContact O-N 3.11Å; I3590-L3592 VanDerWaalsContact C-N 3.29Å; I3590-L3592 PolarHBondContact O-N 3.21Å; I3590-K3593 CarbonylContact O-C 3.59Å; I3590-K3593 WeakPolarHBondContact O-CA 3.46Å; I3590-K3593 PolarHBondContact O-N 3.09Å; I3590-T3594 HydrophobicContact CG2-CG2 4.43Å; I3590-T3594 PolarHBondContact O-N 3.5Å; I3590-T3594 PolarHBondContact O-OG1 3.24Å; I3590-T3594 VanDerWaalsContact O-OG1 3.05Å
3591	N	85.3	Confident	80.7	Confident	42 Å²	42	51.8 Å²	51.8	23%	0.225	28%	0.283	C	S	.	.	H	α-helix	trans	-58.2	-37.3	-178.5	-72	-3.7	0	0	0	113.2	S3587 V3588 T3594 E3595 V3596 Y3597	S3587-N3591 WeakPolarHBondContact O-CB 3.47Å; S3587-N3591 VanDerWaalsContact O-CG 3.26Å; S3587-N3591 PolarHBondContact O-N 3.41Å; S3587-N3591 PolarHBondContact O-OD1 2.66Å; V3588-N3591 PolarHBondContact O-N 3.37Å; N3591-T3594 WeakPolarHBondContact CA-OG1 3.5Å; N3591-T3594 PolarHBondContact O-OG1 3.35Å; N3591-T3594 VanDerWaalsContact O-OG1 3.1Å; N3591-E3595 PolarHBondContact O-N 3.2Å; N3591-V3596 PolarHBondContact O-N 3.48Å; N3591-V3596 VanDerWaalsContact O-N 3.07Å; N3591-Y3597 HydrophobicContact CB-CD2 4.27Å; N3591-Y3597 HydrophobicContact CB-CE2 3.36Å; N3591-Y3597 WeakPolarHBondContact CB-OH 3.3Å; N3591-Y3597 PolarHBondContact ND2-OH 3.2Å; N3591-Y3597 VanDerWaalsContact ND2-OH 3.09Å
3592	L	85.4	Confident	82	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-45.4	171.2	-83.8	165.5	0	0	0	112.4	L3540 I3545 L3548 I3549 I3552 V3588 I3590 T3594 E3595 Y3597 F3603	L3540-L3592 HydrophobicContact CD2-CD2 4.24Å; I3545-L3592 HydrophobicContact CG2-CB 4.45Å; I3545-L3592 HydrophobicContact CG2-CD2 4.26Å; L3548-L3592 HydrophobicContact CB-CD1 4.33Å; L3548-L3592 HydrophobicContact CB-CD2 4.46Å; L3548-L3592 HydrophobicContact CD1-CD2 4.41Å; I3549-L3592 HydrophobicContact CD1-CB 4.42Å; I3549-L3592 HydrophobicContact CG1-CB 4.07Å; I3549-L3592 HydrophobicContact CG1-CD1 4.17Å; I3552-L3592 HydrophobicContact CD1-CD1 3.24Å; V3588-L3592 HydrophobicContact CG1-CD1 4.45Å; V3588-L3592 PolarHBondContact O-N 2.99Å; I3590-L3592 VanDerWaalsContact C-N 3.29Å; I3590-L3592 PolarHBondContact O-N 3.21Å; L3592-T3594 PolarHBondContact O-N 3.41Å; L3592-E3595 PolarHBondContact O-N 3.43Å; L3592-Y3597 HydrophobicContact CB-CD2 4.46Å; L3592-Y3597 HydrophobicContact CD2-CD2 3.71Å; L3592-Y3597 HydrophobicContact CD2-CE2 4.43Å; L3592-Y3597 HydrophobicContact CG-CD2 3.68Å; L3592-Y3597 HydrophobicContact CG-CE2 3.92Å; L3592-F3603 HydrophobicContact CD1-CD2 4.17Å; L3592-F3603 HydrophobicContact CD1-CE2 3.9Å; L3592-F3603 HydrophobicContact CD2-CD2 4.36Å; L3592-F3603 HydrophobicContact CG-CD2 4.39Å
3593	K	86	Confident	83.5	Confident	120 Å²	120	47.5 Å²	47.5	52%	0.522	25%	0.25	S	C	.	.	H	α-helix	trans	-69	-17.1	178.4	-71.3	172.1	-175.8	168.2	0	112.5	I3549 E3553 I3589 I3590	I3549-K3593 HydrophobicContact CD1-CD 4.42Å; I3549-K3593 HydrophobicContact CD1-CG 3.67Å; E3553-K3593 IonicContact OE1-NZ 2.68Å; E3553-K3593 PolarHBondContact OE1-NZ 2.96Å; I3589-K3593 HydrophobicContact CG2-CD 3.74Å; I3589-K3593 VanDerWaalsContact CG2-CE 3.49Å; I3589-K3593 WeakPolarHBondContact O-CB 3.21Å; I3589-K3593 VanDerWaalsContact O-CG 3.27Å; I3589-K3593 WeakPolarHBondContact O-CG 3.44Å; I3589-K3593 PolarHBondContact O-N 3.27Å; I3590-K3593 CarbonylContact O-C 3.59Å; I3590-K3593 WeakPolarHBondContact O-CA 3.46Å; I3590-K3593 PolarHBondContact O-N 3.09Å
3594	T	86	Confident	84.3	Confident	85 Å²	85	46.8 Å²	46.8	52%	0.521	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	10.1	170.1	55.7	0	0	0	0	114.4	I3590 N3591 L3592 V3596	I3590-T3594 HydrophobicContact CG2-CG2 4.43Å; I3590-T3594 PolarHBondContact O-N 3.5Å; I3590-T3594 PolarHBondContact O-OG1 3.24Å; I3590-T3594 VanDerWaalsContact O-OG1 3.05Å; N3591-T3594 WeakPolarHBondContact CA-OG1 3.5Å; N3591-T3594 PolarHBondContact O-OG1 3.35Å; N3591-T3594 VanDerWaalsContact O-OG1 3.1Å; L3592-T3594 PolarHBondContact O-N 3.41Å; T3594-V3596 PolarHBondContact O-N 2.93Å; T3594-V3596 VanDerWaalsContact O-N 3.15Å; T3594-V3596 WeakPolarHBondContact OG1-CG2 3.25Å
3595	E	80.5	Confident	84.5	Confident	129 Å²	129	52.9 Å²	52.9	60%	0.603	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	33.8	176.8	-54.7	-166	149.9	0	0	115	I3545 N3591 L3592	I3545-E3595 HydrophobicContact CD1-CG 4.16Å; N3591-E3595 PolarHBondContact O-N 3.2Å; L3592-E3595 PolarHBondContact O-N 3.43Å
3596	V	83	Confident	84.7	Confident	88 Å²	88	54.1 Å²	54.1	53%	0.533	28%	0.281	S	S	.	.			trans	-71.6	-33.5	179.5	172.4	0	0	0	0	111.7	N3591 T3594 K3598	N3591-V3596 PolarHBondContact O-N 3.48Å; N3591-V3596 VanDerWaalsContact O-N 3.07Å; T3594-V3596 PolarHBondContact O-N 2.93Å; T3594-V3596 VanDerWaalsContact O-N 3.15Å; T3594-V3596 WeakPolarHBondContact OG1-CG2 3.25Å; V3596-K3598 PolarHBondContact O-N 3.34Å
3597	Y	84.6	Confident	84.8	Confident	10 Å²	10	52 Å²	52	4%	0.039	27%	0.267	C	S	.	.			trans	-80.7	112.8	177.9	-55.9	-62.9	0	0	0	111	V3588 N3591 L3592 D3602 F3603 D3606	V3588-Y3597 HydrophobicContact CG1-CE2 4.2Å; N3591-Y3597 HydrophobicContact CB-CD2 4.27Å; N3591-Y3597 HydrophobicContact CB-CE2 3.36Å; N3591-Y3597 WeakPolarHBondContact CB-OH 3.3Å; N3591-Y3597 PolarHBondContact ND2-OH 3.2Å; N3591-Y3597 VanDerWaalsContact ND2-OH 3.09Å; L3592-Y3597 HydrophobicContact CB-CD2 4.46Å; L3592-Y3597 HydrophobicContact CD2-CD2 3.71Å; L3592-Y3597 HydrophobicContact CD2-CE2 4.43Å; L3592-Y3597 HydrophobicContact CG-CD2 3.68Å; L3592-Y3597 HydrophobicContact CG-CE2 3.92Å; Y3597-D3602 HydrophobicContact CD1-CB 3.84Å; Y3597-F3603 HydrophobicContact CD1-CB 4.29Å; Y3597-F3603 HydrophobicContact CD2-CD2 4.35Å; Y3597-F3603 HydrophobicContact CE2-CD2 4.33Å; Y3597-F3603 HydrophobicContact CG-CB 4.12Å; Y3597-D3606 HydrophobicContact CE1-CB 3.84Å; Y3597-D3606 VanDerWaalsContact CE1-OD2 3.23Å; Y3597-D3606 WeakPolarHBondContact CE1-OD2 3.46Å; Y3597-D3606 VanDerWaalsContact CZ-OD2 3.32Å; Y3597-D3606 PolarHBondContact OH-OD2 3.45Å
3598	K	80.6	Confident	85	Confident	157 Å²	157	53.8 Å²	53.8	68%	0.683	27%	0.274	S	S	*	.			trans	-86.3	-39	179.3	-64.4	176.9	-177.4	175.6	0	111.4	N3539 L3540 V3596 D3602	N3539-K3598 WeakPolarHBondContact CA-O 3.39Å; L3540-K3598 PolarHBondContact N-O 2.99Å; V3596-K3598 PolarHBondContact O-N 3.34Å; K3598-D3602 PolarHBondContact N-OD2 3.27Å
3599	T	83.9	Confident	85.1	Confident	33 Å²	33	58 Å²	58	20%	0.202	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-120.9	156.9	-174.6	72.7	0	0	0	0	110.8	Y3536 L3540 G3601 D3602 F3603	Y3536-T3599 VanDerWaalsContact O-CB 3.26Å; Y3536-T3599 WeakPolarHBondContact O-CB 3.48Å; L3540-T3599 VanDerWaalsContact CD1-C 3.4Å; T3599-G3601 PolarHBondContact O-N 2.91Å; T3599-D3602 WeakPolarHBondContact CB-OD2 3.43Å; T3599-D3602 PolarHBondContact N-OD2 3.46Å; T3599-D3602 PolarHBondContact O-N 2.82Å; T3599-D3602 PolarHBondContact OG1-N 3.28Å; T3599-D3602 PolarHBondContact OG1-OD2 2.87Å; T3599-F3603 PolarHBondContact O-N 3.23Å
3600	L	84.1	Confident	85.1	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-23	177.7	-167.2	65.4	0	0	0	111.8	I3535 Y3536 T3538 L3540 L3548 F3603 S3604 M3639 F3642	I3535-L3600 HydrophobicContact CG2-CD2 3.97Å; Y3536-L3600 PolarHBondContact O-N 2.88Å; Y3536-L3600 VanDerWaalsContact O-N 3.1Å; T3538-L3600 PolarHBondContact O-N 3.42Å; L3540-L3600 HydrophobicContact CD1-CB 4.01Å; L3540-L3600 HydrophobicContact CD1-CD1 4.32Å; L3540-L3600 VanDerWaalsContact CD1-N 3.28Å; L3548-L3600 HydrophobicContact CD1-CD1 3.83Å; L3548-L3600 HydrophobicContact CD2-CD1 4.15Å; L3600-F3603 HydrophobicContact CD1-CD1 4.06Å; L3600-S3604 WeakPolarHBondContact O-CB 3.41Å; L3600-S3604 PolarHBondContact O-N 2.92Å; L3600-S3604 PolarHBondContact O-OG 3.2Å; L3600-M3639 HydrophobicContact CD1-CE 4.14Å; L3600-M3639 HydrophobicContact CD2-CE 4.33Å; L3600-M3639 HydrophobicContact CG-CE 4.18Å; L3600-F3642 HydrophobicContact CD1-CE1 3.98Å; L3600-F3642 HydrophobicContact CD2-CD1 4.42Å; L3600-F3642 HydrophobicContact CD2-CE1 4.1Å
3601	G	82.5	Confident	85.2	Confident	17 Å²	17	52.8 Å²	52.8	18%	0.175	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-45.2	169.3	0	0	0	0	0	113.4	Y3536 T3599 F3603 S3604 F3605	Y3536-G3601 PolarHBondContact O-N 3.42Å; T3599-G3601 PolarHBondContact O-N 2.91Å; G3601-F3603 VanDerWaalsContact C-N 3.3Å; G3601-F3603 PolarHBondContact O-N 2.98Å; G3601-S3604 PolarHBondContact O-N 3.03Å; G3601-S3604 PolarHBondContact O-OG 2.9Å; G3601-F3605 VanDerWaalsContact O-CB 3.26Å; G3601-F3605 WeakPolarHBondContact O-CB 3.4Å; G3601-F3605 PolarHBondContact O-N 3.48Å
3602	D	85	Confident	85.2	Confident	67 Å²	67	54.2 Å²	54.2	36%	0.358	27%	0.274	S	S	.	.	H	α-helix	trans	-58.9	-45	178.3	-55.5	-55.4	0	0	0	110.7	Y3597 K3598 T3599 D3606	Y3597-D3602 HydrophobicContact CD1-CB 3.84Å; K3598-D3602 PolarHBondContact N-OD2 3.27Å; T3599-D3602 WeakPolarHBondContact CB-OD2 3.43Å; T3599-D3602 PolarHBondContact N-OD2 3.46Å; T3599-D3602 PolarHBondContact O-N 2.82Å; T3599-D3602 PolarHBondContact OG1-N 3.28Å; T3599-D3602 PolarHBondContact OG1-OD2 2.87Å; D3602-D3606 PolarHBondContact O-N 3.45Å
3603	F	88.4	Confident	85.1	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65	-46.9	177.7	169.8	-107.7	0	0	0	112.9	L3548 I3552 V3588 L3592 Y3597 T3599 L3600 G3601 F3605 D3606 M3607 F3635 M3639	L3548-F3603 HydrophobicContact CD1-CD1 4.22Å; L3548-F3603 HydrophobicContact CD1-CG 4.48Å; L3548-F3603 HydrophobicContact CD2-CD1 4.13Å; L3548-F3603 HydrophobicContact CD2-CE1 3.76Å; L3548-F3603 HydrophobicContact CD2-CZ 4.4Å; I3552-F3603 HydrophobicContact CD1-CE2 3.59Å; I3552-F3603 HydrophobicContact CD1-CZ 3.83Å; I3552-F3603 HydrophobicContact CG1-CE2 4.4Å; I3552-F3603 HydrophobicContact CG1-CZ 4.17Å; V3588-F3603 HydrophobicContact CG1-CD2 4.11Å; V3588-F3603 HydrophobicContact CG1-CE2 3.68Å; L3592-F3603 HydrophobicContact CD1-CD2 4.17Å; L3592-F3603 HydrophobicContact CD1-CE2 3.9Å; L3592-F3603 HydrophobicContact CD2-CD2 4.36Å; L3592-F3603 HydrophobicContact CG-CD2 4.39Å; Y3597-F3603 HydrophobicContact CD1-CB 4.29Å; Y3597-F3603 HydrophobicContact CD2-CD2 4.35Å; Y3597-F3603 HydrophobicContact CE2-CD2 4.33Å; Y3597-F3603 HydrophobicContact CG-CB 4.12Å; T3599-F3603 PolarHBondContact O-N 3.23Å; L3600-F3603 HydrophobicContact CD1-CD1 4.06Å; G3601-F3603 VanDerWaalsContact C-N 3.3Å; G3601-F3603 PolarHBondContact O-N 2.98Å; F3603-F3605 VanDerWaalsContact C-N 3.32Å; F3603-F3605 PolarHBondContact O-N 2.97Å; F3603-D3606 PolarHBondContact O-N 3.27Å; F3603-M3607 HydrophobicContact CE1-CG 4.48Å; F3603-M3607 HydrophobicContact CE2-CE 4.02Å; F3603-M3607 HydrophobicContact CE2-CG 3.88Å; F3603-M3607 HydrophobicContact CZ-CE 3.96Å; F3603-M3607 HydrophobicContact CZ-CG 3.85Å; F3603-M3607 PolarHBondContact O-N 2.84Å; F3603-M3607 VanDerWaalsContact O-N 3.14Å; F3603-F3635 AromaticContact CE1-CE2 3.93Å; F3603-F3635 HydrophobicContact CE1-CE2 3.93Å; F3603-F3635 HydrophobicContact CE1-CZ 4.1Å; F3603-F3635 HydrophobicContact CZ-CE2 4.01Å; F3603-F3635 HydrophobicContact CZ-CZ 4.44Å; F3603-M3639 HydrophobicContact CD1-CE 4.36Å; F3603-M3639 HydrophobicContact CE1-CE 4.32Å; F3603-M3639 HydrophobicContact CE1-SD 3.91Å
3604	S	86.5	Confident	85.1	Confident	14 Å²	14	49.7 Å²	49.7	10%	0.098	26%	0.256	C	S	.	.	H	α-helix	trans	-68.6	-32.5	-179.1	68.2	0	0	0	0	112.3	L3600 G3601 M3607 N3608	L3600-S3604 WeakPolarHBondContact O-CB 3.41Å; L3600-S3604 PolarHBondContact O-N 2.92Å; L3600-S3604 PolarHBondContact O-OG 3.2Å; G3601-S3604 PolarHBondContact O-N 3.03Å; G3601-S3604 PolarHBondContact O-OG 2.9Å; S3604-M3607 PolarHBondContact O-N 2.99Å; S3604-N3608 WeakPolarHBondContact O-CB 3.49Å; S3604-N3608 PolarHBondContact O-N 3.45Å; S3604-N3608 PolarHBondContact O-ND2 3.21Å
3605	F	85.8	Confident	85	Confident	145 Å²	145	49.8 Å²	49.8	64%	0.636	25%	0.247	S	C	*	.	H	α-helix	trans	-64.4	-45	175.1	-173.5	-93.5	0	0	0	111.8	G3601 F3603 N3608 R3609	G3601-F3605 VanDerWaalsContact O-CB 3.26Å; G3601-F3605 WeakPolarHBondContact O-CB 3.4Å; G3601-F3605 PolarHBondContact O-N 3.48Å; F3603-F3605 VanDerWaalsContact C-N 3.32Å; F3603-F3605 PolarHBondContact O-N 2.97Å; F3605-N3608 PolarHBondContact O-N 2.94Å; F3605-R3609 WeakPolarHBondContact O-CB 3.4Å; F3605-R3609 PolarHBondContact O-N 3.48Å
3606	D	86.6	Confident	85.1	Confident	29 Å²	29	48 Å²	48	16%	0.155	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-37	177.9	-108.1	17.9	0	0	0	112.5	F3583 Y3597 D3602 F3603 R3609 L3610	F3583-D3606 HydrophobicContact CE1-CB 4.17Å; F3583-D3606 WeakPolarHBondContact CE1-O 3.47Å; F3583-D3606 HydrophobicContact CE2-CB 4.49Å; F3583-D3606 WeakPolarHBondContact CE2-OD2 3.44Å; F3583-D3606 HydrophobicContact CZ-CB 3.64Å; F3583-D3606 VanDerWaalsContact CZ-CG 3.43Å; F3583-D3606 WeakPolarHBondContact CZ-OD2 3.46Å; Y3597-D3606 HydrophobicContact CE1-CB 3.84Å; Y3597-D3606 VanDerWaalsContact CE1-OD2 3.23Å; Y3597-D3606 WeakPolarHBondContact CE1-OD2 3.46Å; Y3597-D3606 VanDerWaalsContact CZ-OD2 3.32Å; Y3597-D3606 PolarHBondContact OH-OD2 3.45Å; D3602-D3606 PolarHBondContact O-N 3.45Å; F3603-D3606 PolarHBondContact O-N 3.27Å; D3606-R3609 WeakPolarHBondContact O-CB 3.27Å; D3606-R3609 PolarHBondContact O-N 3.15Å; D3606-L3610 PolarHBondContact O-N 3.23Å
3607	M	87.2	Confident	85.1	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-43.4	171.2	-76.9	-61.8	-151.5	0	0	112.4	I3552 V3588 F3603 S3604 R3609 L3610 F3611 F3635	I3552-M3607 HydrophobicContact CB-CE 4.44Å; I3552-M3607 HydrophobicContact CD1-CE 3.77Å; I3552-M3607 HydrophobicContact CG1-CE 3.55Å; I3552-M3607 HydrophobicContact CG2-CE 4.04Å; V3588-M3607 HydrophobicContact CB-CE 4.38Å; V3588-M3607 HydrophobicContact CG1-CE 3.99Å; V3588-M3607 HydrophobicContact CG1-SD 4.27Å; V3588-M3607 HydrophobicContact CG2-CE 4.37Å; V3588-M3607 HydrophobicContact CG2-SD 4.01Å; F3603-M3607 HydrophobicContact CE1-CG 4.48Å; F3603-M3607 HydrophobicContact CE2-CE 4.02Å; F3603-M3607 HydrophobicContact CE2-CG 3.88Å; F3603-M3607 HydrophobicContact CZ-CE 3.96Å; F3603-M3607 HydrophobicContact CZ-CG 3.85Å; F3603-M3607 PolarHBondContact O-N 2.84Å; F3603-M3607 VanDerWaalsContact O-N 3.14Å; S3604-M3607 PolarHBondContact O-N 2.99Å; M3607-R3609 PolarHBondContact O-N 2.87Å; M3607-L3610 VanDerWaalsContact O-CB 3.3Å; M3607-L3610 WeakPolarHBondContact O-CB 3.45Å; M3607-L3610 PolarHBondContact O-N 2.98Å; M3607-L3610 VanDerWaalsContact O-N 3.14Å; M3607-L3610 HydrophobicContact SD-CD2 4.26Å; M3607-F3611 HydrophobicContact CB-CE2 4.37Å; M3607-F3611 WeakPolarHBondContact O-CD2 3.27Å; M3607-F3611 PolarHBondContact O-N 3.31Å; M3607-F3635 HydrophobicContact CB-CD1 4.41Å; M3607-F3635 HydrophobicContact CB-CE1 3.66Å; M3607-F3635 HydrophobicContact CB-CE2 4.06Å; M3607-F3635 HydrophobicContact CB-CZ 3.45Å; M3607-F3635 VanDerWaalsContact CB-CZ 3.45Å; M3607-F3635 HydrophobicContact CE-CE2 4.45Å; M3607-F3635 HydrophobicContact CG-CE1 4.33Å; M3607-F3635 HydrophobicContact CG-CE2 3.8Å; M3607-F3635 HydrophobicContact CG-CZ 3.65Å
3608	N	87.8	Confident	85	Confident	70 Å²	70	45 Å²	45	37%	0.374	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-30.4	174.2	-68.6	-13.6	0	0	0	111.8	S3604 F3605 T3612	S3604-N3608 WeakPolarHBondContact O-CB 3.49Å; S3604-N3608 PolarHBondContact O-N 3.45Å; S3604-N3608 PolarHBondContact O-ND2 3.21Å; F3605-N3608 PolarHBondContact O-N 2.94Å; N3608-T3612 VanDerWaalsContact O-CB 3.3Å; N3608-T3612 WeakPolarHBondContact O-CB 3.48Å; N3608-T3612 PolarHBondContact O-N 2.95Å; N3608-T3612 PolarHBondContact O-OG1 2.96Å
3609	R	84.9	Confident	85	Confident	89 Å²	89	40.8 Å²	40.8	34%	0.336	21%	0.21	S	C	.	.	H	α-helix	trans	-65.9	-41.6	172.3	-169	-178.9	-170.9	-152.9	-3.3	112	D3581 F3605 D3606 M3607 T3612 N3613	D3581-R3609 IonicContact OD2-CZ 2.88Å; D3581-R3609 IonicContact OD2-NH1 3.17Å; D3581-R3609 PolarHBondContact OD2-NH1 2.91Å; D3581-R3609 IonicContact OD2-NH2 3.11Å; D3581-R3609 PolarHBondContact OD2-NH2 3.45Å; F3605-R3609 WeakPolarHBondContact O-CB 3.4Å; F3605-R3609 PolarHBondContact O-N 3.48Å; D3606-R3609 WeakPolarHBondContact O-CB 3.27Å; D3606-R3609 PolarHBondContact O-N 3.15Å; M3607-R3609 PolarHBondContact O-N 2.87Å; R3609-T3612 PolarHBondContact O-N 3.16Å; R3609-N3613 WeakPolarHBondContact O-CB 3.35Å; R3609-N3613 VanDerWaalsContact O-CG 3.25Å; R3609-N3613 PolarHBondContact O-N 3.3Å; R3609-N3613 PolarHBondContact O-OD1 2.85Å
3610	L	86.6	Confident	84.9	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-56.5	-50.9	173.4	179	74.1	0	0	0	111.7	F3564 F3583 L3585 D3606 M3607 N3613 S3614	F3564-L3610 HydrophobicContact CB-CD2 4.41Å; F3564-L3610 HydrophobicContact CD1-CD1 3.91Å; F3564-L3610 HydrophobicContact CD1-CD2 3.74Å; F3564-L3610 HydrophobicContact CD1-CG 3.67Å; F3564-L3610 HydrophobicContact CE1-CD2 4.17Å; F3564-L3610 HydrophobicContact CE1-CG 3.98Å; F3564-L3610 HydrophobicContact CG-CD2 4.31Å; F3583-L3610 HydrophobicContact CD1-CB 3.89Å; F3583-L3610 HydrophobicContact CD1-CD1 3.98Å; F3583-L3610 HydrophobicContact CE1-CB 4.15Å; F3583-L3610 WeakPolarHBondContact O-CD1 3.44Å; L3585-L3610 HydrophobicContact CD1-CD2 3.39Å; L3585-L3610 HydrophobicContact CG-CD2 4.36Å; D3606-L3610 PolarHBondContact O-N 3.23Å; M3607-L3610 VanDerWaalsContact O-CB 3.3Å; M3607-L3610 WeakPolarHBondContact O-CB 3.45Å; M3607-L3610 PolarHBondContact O-N 2.98Å; M3607-L3610 VanDerWaalsContact O-N 3.14Å; M3607-L3610 HydrophobicContact SD-CD2 4.26Å; L3610-N3613 PolarHBondContact O-N 3.06Å; L3610-S3614 WeakPolarHBondContact O-CB 3.28Å; L3610-S3614 PolarHBondContact O-N 3.36Å; L3610-S3614 PolarHBondContact O-OG 3.34Å
3611	F	88.1	Confident	84.6	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.009	27%	0.272	C	S	.	.	H	α-helix	trans	-65.5	-40.6	179.5	-58.7	-54	0	0	0	111.8	F3564 M3607 S3614 R3615 T3628 V3631 E3632 F3635	F3564-F3611 AromaticContact CE1-CD1 3.71Å; F3564-F3611 HydrophobicContact CE1-CD1 3.71Å; F3564-F3611 AromaticContact CE1-CE1 3.99Å; F3564-F3611 HydrophobicContact CE1-CE1 3.99Å; F3564-F3611 HydrophobicContact CE2-CE1 4.31Å; F3564-F3611 AromaticContact CZ-CD1 3.56Å; F3564-F3611 HydrophobicContact CZ-CD1 3.56Å; F3564-F3611 AromaticContact CZ-CE1 3.66Å; F3564-F3611 HydrophobicContact CZ-CE1 3.66Å; M3607-F3611 HydrophobicContact CB-CE2 4.37Å; M3607-F3611 WeakPolarHBondContact O-CD2 3.27Å; M3607-F3611 PolarHBondContact O-N 3.31Å; F3611-S3614 PolarHBondContact O-N 3.49Å; F3611-R3615 PolarHBondContact O-N 2.69Å; F3611-T3628 HydrophobicContact CB-CG2 4.36Å; F3611-T3628 HydrophobicContact CD1-CG2 4.27Å; F3611-V3631 HydrophobicContact CE1-CB 4.27Å; F3611-V3631 HydrophobicContact CE1-CG1 3.8Å; F3611-V3631 HydrophobicContact CZ-CG1 4.13Å; F3611-E3632 HydrophobicContact CB-CB 4.47Å; F3611-E3632 HydrophobicContact CB-CG 4.3Å; F3611-E3632 HydrophobicContact CD1-CB 3.97Å; F3611-E3632 HydrophobicContact CD2-CB 3.99Å; F3611-E3632 HydrophobicContact CD2-CG 3.75Å; F3611-E3632 HydrophobicContact CE1-CB 4.21Å; F3611-E3632 HydrophobicContact CE2-CB 4.23Å; F3611-E3632 HydrophobicContact CE2-CG 4.24Å; F3611-E3632 HydrophobicContact CG-CB 3.88Å; F3611-E3632 HydrophobicContact CG-CG 3.95Å; F3611-E3632 HydrophobicContact CZ-CB 4.34Å; F3611-F3635 HydrophobicContact CE2-CB 4.08Å; F3611-F3635 AromaticContact CE2-CD1 3.7Å; F3611-F3635 HydrophobicContact CE2-CD1 3.7Å; F3611-F3635 HydrophobicContact CE2-CE1 4.37Å; F3611-F3635 AromaticContact CE2-CG 3.99Å; F3611-F3635 HydrophobicContact CE2-CG 3.99Å; F3611-F3635 HydrophobicContact CZ-CB 4.01Å; F3611-F3635 HydrophobicContact CZ-CD1 4.43Å; F3611-F3635 HydrophobicContact CZ-CG 4.29Å
3612	T	85.9	Confident	84.7	Confident	73 Å²	73	54.5 Å²	54.5	45%	0.448	27%	0.272	S	S	.	.	H	α-helix	trans	-64.1	-45.4	176.4	-57.5	0	0	0	0	112.2	N3608 R3609 S3614 R3615 L3616	N3608-T3612 VanDerWaalsContact O-CB 3.3Å; N3608-T3612 WeakPolarHBondContact O-CB 3.48Å; N3608-T3612 PolarHBondContact O-N 2.95Å; N3608-T3612 PolarHBondContact O-OG1 2.96Å; R3609-T3612 PolarHBondContact O-N 3.16Å; T3612-S3614 VanDerWaalsContact C-N 3.3Å; T3612-S3614 PolarHBondContact O-N 3.44Å; T3612-R3615 PolarHBondContact O-N 2.67Å; T3612-L3616 WeakPolarHBondContact O-CG 3.48Å; T3612-L3616 PolarHBondContact O-N 2.95Å
3613	N	83.8	Confident	84.7	Confident	19 Å²	19	53.1 Å²	53.1	10%	0.102	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-42.9	174.7	-75.6	-0.8	0	0	0	110.8	L3579 R3609 L3610 R3615 L3616 I3617	L3579-N3613 HydrophobicContact CD1-CB 4.24Å; R3609-N3613 WeakPolarHBondContact O-CB 3.35Å; R3609-N3613 VanDerWaalsContact O-CG 3.25Å; R3609-N3613 PolarHBondContact O-N 3.3Å; R3609-N3613 PolarHBondContact O-OD1 2.85Å; L3610-N3613 PolarHBondContact O-N 3.06Å; N3613-R3615 PolarHBondContact O-N 2.69Å; N3613-L3616 WeakPolarHBondContact O-CB 3.26Å; N3613-L3616 PolarHBondContact O-N 3.46Å; N3613-I3617 WeakPolarHBondContact O-CG1 3.34Å; N3613-I3617 PolarHBondContact O-N 2.93Å
3614	S	84.6	Confident	84.5	Confident	8 Å²	8	54.5 Å²	54.5	6%	0.056	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-41.8	179.9	-57.2	0	0	0	0	112	F3564 L3610 F3611 T3612 L3616 I3617 Y3618	F3564-S3614 WeakPolarHBondContact CE1-OG 3.24Å; L3610-S3614 WeakPolarHBondContact O-CB 3.28Å; L3610-S3614 PolarHBondContact O-N 3.36Å; L3610-S3614 PolarHBondContact O-OG 3.34Å; F3611-S3614 PolarHBondContact O-N 3.49Å; T3612-S3614 VanDerWaalsContact C-N 3.3Å; T3612-S3614 PolarHBondContact O-N 3.44Å; S3614-L3616 PolarHBondContact O-N 2.96Å; S3614-I3617 PolarHBondContact O-N 2.9Å; S3614-Y3618 WeakPolarHBondContact O-CB 3.5Å; S3614-Y3618 VanDerWaalsContact O-CD2 3.25Å; S3614-Y3618 WeakPolarHBondContact O-CD2 3.38Å; S3614-Y3618 PolarHBondContact O-N 3.32Å
3615	R	84.3	Confident	84.5	Confident	86 Å²	86	54.3 Å²	54.3	33%	0.325	27%	0.27	S	S	.	.	H	α-helix	trans	-62.2	-20	171.1	-75.1	-168.9	171	106.3	2.5	114.8	F3611 T3612 N3613 F3625 T3628 E3629 E3632	F3611-R3615 PolarHBondContact O-N 2.69Å; T3612-R3615 PolarHBondContact O-N 2.67Å; N3613-R3615 PolarHBondContact O-N 2.69Å; R3615-F3625 HydrophobicContact CB-CE2 4Å; R3615-F3625 HydrophobicContact CG-CD2 4.41Å; R3615-F3625 HydrophobicContact CG-CE2 3.72Å; R3615-F3625 HydrophobicContact CG-CZ 4.19Å; R3615-T3628 HydrophobicContact CG-CG2 4.21Å; R3615-E3629 IonicContact CZ-OE1 2.61Å; R3615-E3629 IonicContact NE-OE1 3.52Å; R3615-E3629 PolarHBondContact NE-OE1 2.96Å; R3615-E3629 IonicContact NH2-OE1 2.73Å; R3615-E3629 PolarHBondContact NH2-OE1 3.02Å; R3615-E3632 IonicContact CZ-OE1 2.74Å; R3615-E3632 IonicContact CZ-OE2 2.84Å; R3615-E3632 IonicContact NH1-OE1 3.16Å; R3615-E3632 PolarHBondContact NH1-OE1 2.98Å; R3615-E3632 IonicContact NH1-OE2 3.03Å; R3615-E3632 PolarHBondContact NH1-OE2 3.06Å; R3615-E3632 IonicContact NH2-OE1 3.56Å; R3615-E3632 IonicContact NH2-OE2 2.69Å; R3615-E3632 PolarHBondContact NH2-OE2 2.78Å
3616	L	83	Confident	84.4	Confident	93 Å²	93	50.1 Å²	50.1	49%	0.487	26%	0.255	S	S	.	.	H	α-helix	trans	-90.4	-29.9	175.6	-67.6	170.2	0	0	0	112.4	M3575 L3579 T3612 N3613 S3614	M3575-L3616 WeakPolarHBondContact CG-O 3.46Å; L3579-L3616 HydrophobicContact CD1-CB 4.28Å; L3579-L3616 HydrophobicContact CD2-CD1 4.49Å; T3612-L3616 WeakPolarHBondContact O-CG 3.48Å; T3612-L3616 PolarHBondContact O-N 2.95Å; N3613-L3616 WeakPolarHBondContact O-CB 3.26Å; N3613-L3616 PolarHBondContact O-N 3.46Å; S3614-L3616 PolarHBondContact O-N 2.96Å
3617	I	82.2	Confident	84.4	Confident	22 Å²	22	48.8 Å²	48.8	11%	0.113	25%	0.247	C	C	.	.	H	α-helix	trans	-81.6	-43.7	179.9	-65.7	170.7	0	0	0	111.5	P3568 F3573 A3576 L3579 N3613 S3614	P3568-I3617 HydrophobicContact CB-CG2 4.12Å; P3568-I3617 HydrophobicContact CG-CD1 3.79Å; P3568-I3617 HydrophobicContact CG-CG2 4.14Å; F3573-I3617 HydrophobicContact CB-CG2 3.66Å; F3573-I3617 HydrophobicContact CD1-CG2 4.48Å; F3573-I3617 HydrophobicContact CG-CG2 3.99Å; A3576-I3617 HydrophobicContact CB-CD1 4.13Å; A3576-I3617 HydrophobicContact CB-CG1 4.32Å; A3576-I3617 HydrophobicContact CB-CG2 4.18Å; L3579-I3617 HydrophobicContact CD1-CD1 3.9Å; L3579-I3617 HydrophobicContact CD1-CG1 3.66Å; N3613-I3617 WeakPolarHBondContact O-CG1 3.34Å; N3613-I3617 PolarHBondContact O-N 2.93Å; S3614-I3617 PolarHBondContact O-N 2.9Å
3618	Y	82.9	Confident	84.3	Confident	13 Å²	13	48.7 Å²	48.7	5%	0.051	25%	0.247	C	C	.	.	S	Bend	trans	-97.4	126.8	-172.1	-56.1	-52.7	0	0	0	111.6	P3563 P3568 F3573 S3614 E3624 F3625	P3563-Y3618 HydrophobicContact CB-CE2 4.12Å; P3563-Y3618 PolarHBondContact O-OH 2.95Å; P3568-Y3618 HydrophobicContact CB-CE1 4.22Å; F3573-Y3618 HydrophobicContact CD1-CD1 4.13Å; F3573-Y3618 HydrophobicContact CD2-CD1 4.48Å; F3573-Y3618 HydrophobicContact CD2-CE1 4.11Å; F3573-Y3618 AromaticContact CE1-CD1 3.85Å; F3573-Y3618 HydrophobicContact CE1-CD1 3.85Å; F3573-Y3618 HydrophobicContact CE1-CE1 4.31Å; F3573-Y3618 HydrophobicContact CE2-CD1 4.22Å; F3573-Y3618 AromaticContact CE2-CE1 3.84Å; F3573-Y3618 HydrophobicContact CE2-CE1 3.84Å; F3573-Y3618 HydrophobicContact CG-CD1 4.44Å; F3573-Y3618 HydrophobicContact CG-CE1 4.46Å; F3573-Y3618 AromaticContact CZ-CD1 3.89Å; F3573-Y3618 HydrophobicContact CZ-CD1 3.89Å; F3573-Y3618 AromaticContact CZ-CE1 3.95Å; F3573-Y3618 HydrophobicContact CZ-CE1 3.95Å; S3614-Y3618 WeakPolarHBondContact O-CB 3.5Å; S3614-Y3618 VanDerWaalsContact O-CD2 3.25Å; S3614-Y3618 WeakPolarHBondContact O-CD2 3.38Å; S3614-Y3618 PolarHBondContact O-N 3.32Å; Y3618-E3624 HydrophobicContact CD1-CB 3.58Å; Y3618-E3624 HydrophobicContact CD1-CG 3.88Å; Y3618-E3624 HydrophobicContact CD2-CB 3.78Å; Y3618-E3624 HydrophobicContact CE1-CB 3.9Å; Y3618-E3624 HydrophobicContact CE1-CG 3.8Å; Y3618-E3624 HydrophobicContact CE2-CB 4.09Å; Y3618-E3624 HydrophobicContact CG-CB 3.52Å; Y3618-E3624 HydrophobicContact CG-CG 4.33Å; Y3618-F3625 WeakPolarHBondContact O-CD2 3.5Å
3619	P	82.1	Confident	84.2	Confident	68 Å²	68	49.1 Å²	49.1	44%	0.442	25%	0.247	S	C	.	.			trans	-64.2	149.8	172.3	-17.1	28.8	0	0	0	112	D3621 T3622 F3625	P3619-D3621 PolarHBondContact O-N 3.3Å; P3619-D3621 VanDerWaalsContact O-N 3.08Å; P3619-T3622 HydrophobicContact CB-CG2 4.16Å; P3619-T3622 HydrophobicContact CG-CG2 4.09Å; P3619-T3622 WeakPolarHBondContact O-CB 3.38Å; P3619-T3622 PolarHBondContact O-N 2.93Å; P3619-T3622 PolarHBondContact O-OG1 2.96Å; P3619-F3625 WeakPolarHBondContact O-CB 3.45Å
3620	K	80.6	Confident	84.2	Confident	155 Å²	155	45.3 Å²	45.3	67%	0.674	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.4	-179	-67.4	-160.2	170.2	-152.7	0	114.6	T3622 F3625	K3620-T3622 PolarHBondContact O-N 3.48Å; K3620-F3625 HydrophobicContact CB-CD1 4.47Å; K3620-F3625 HydrophobicContact CD-CZ 4.39Å; K3620-F3625 HydrophobicContact CG-CD1 4.48Å; K3620-F3625 HydrophobicContact CG-CD2 4.41Å; K3620-F3625 HydrophobicContact CG-CE1 4.12Å; K3620-F3625 HydrophobicContact CG-CE2 4.04Å; K3620-F3625 HydrophobicContact CG-CZ 3.91Å
3621	D	79	Confident	84.3	Confident	158 Å²	158	45.2 Å²	45.2	85%	0.845	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	6.5	-177.6	-40.7	-71.3	0	0	0	113.2	P3619	P3619-D3621 PolarHBondContact O-N 3.3Å; P3619-D3621 VanDerWaalsContact O-N 3.08Å
3622	T	83.8	Confident	84.3	Confident	30 Å²	30	46.9 Å²	46.9	18%	0.184	24%	0.24	C	C	.	.	S	Bend	trans	-105.5	143.8	-176	63.5	0	0	0	0	112.7	P3619 K3620 E3624 F3625 N3626	P3619-T3622 HydrophobicContact CB-CG2 4.16Å; P3619-T3622 HydrophobicContact CG-CG2 4.09Å; P3619-T3622 WeakPolarHBondContact O-CB 3.38Å; P3619-T3622 PolarHBondContact O-N 2.93Å; P3619-T3622 PolarHBondContact O-OG1 2.96Å; K3620-T3622 PolarHBondContact O-N 3.48Å; T3622-E3624 PolarHBondContact O-N 3.12Å; T3622-F3625 WeakPolarHBondContact O-CB 3.35Å; T3622-F3625 PolarHBondContact O-N 2.9Å; T3622-N3626 PolarHBondContact O-N 3.46Å
3623	P	84	Confident	84.2	Confident	37 Å²	37	44 Å²	44	24%	0.24	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-27.5	176.3	25.8	-33.1	0	0	0	111.9	F3625 N3626 C3627	P3623-F3625 VanDerWaalsContact C-N 3.27Å; P3623-F3625 PolarHBondContact O-N 3.29Å; P3623-N3626 PolarHBondContact O-N 3.08Å; P3623-C3627 VanDerWaalsContact O-CB 3.24Å; P3623-C3627 WeakPolarHBondContact O-CB 3.48Å; P3623-C3627 PolarHBondContact O-N 2.99Å; P3623-C3627 PolarHBondContact O-SG 3.46Å
3624	E	86	Confident	84.3	Confident	29 Å²	29	44.9 Å²	44.9	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-53.7	-40	168.9	-70.3	71.9	-165.5	0	0	112.6	R3403 W3562 P3563 Y3618 T3622 T3628	R3403-E3624 IonicContact NH2-OE1 3.07Å; R3403-E3624 PolarHBondContact NH2-OE1 2.91Å; W3562-E3624 HydrophobicContact CH2-CB 4.44Å; W3562-E3624 VanDerWaalsContact CH2-CD 3.5Å; W3562-E3624 HydrophobicContact CH2-CG 3.58Å; W3562-E3624 WeakPolarHBondContact CH2-OE1 3.37Å; W3562-E3624 HydrophobicContact CZ3-CG 3.91Å; P3563-E3624 HydrophobicContact CB-CG 4.48Å; Y3618-E3624 HydrophobicContact CD1-CB 3.58Å; Y3618-E3624 HydrophobicContact CD1-CG 3.88Å; Y3618-E3624 HydrophobicContact CD2-CB 3.78Å; Y3618-E3624 HydrophobicContact CE1-CB 3.9Å; Y3618-E3624 HydrophobicContact CE1-CG 3.8Å; Y3618-E3624 HydrophobicContact CE2-CB 4.09Å; Y3618-E3624 HydrophobicContact CG-CB 3.52Å; Y3618-E3624 HydrophobicContact CG-CG 4.33Å; T3622-E3624 PolarHBondContact O-N 3.12Å; E3624-T3628 PolarHBondContact O-N 3.07Å; E3624-T3628 VanDerWaalsContact O-N 3.15Å; E3624-T3628 PolarHBondContact O-OG1 3.48Å
3625	F	85.2	Confident	84.5	Confident	11 Å²	11	44.7 Å²	44.7	5%	0.048	23%	0.226	C	C	.	.	H	α-helix	trans	-72.8	-45.7	176.6	-173	-83.9	0	0	0	111.7	R3615 Y3618 P3619 K3620 T3622 P3623 C3627 T3628 E3629	R3615-F3625 HydrophobicContact CB-CE2 4Å; R3615-F3625 HydrophobicContact CG-CD2 4.41Å; R3615-F3625 HydrophobicContact CG-CE2 3.72Å; R3615-F3625 HydrophobicContact CG-CZ 4.19Å; Y3618-F3625 WeakPolarHBondContact O-CD2 3.5Å; P3619-F3625 WeakPolarHBondContact O-CB 3.45Å; K3620-F3625 HydrophobicContact CB-CD1 4.47Å; K3620-F3625 HydrophobicContact CD-CZ 4.39Å; K3620-F3625 HydrophobicContact CG-CD1 4.48Å; K3620-F3625 HydrophobicContact CG-CD2 4.41Å; K3620-F3625 HydrophobicContact CG-CE1 4.12Å; K3620-F3625 HydrophobicContact CG-CE2 4.04Å; K3620-F3625 HydrophobicContact CG-CZ 3.91Å; T3622-F3625 WeakPolarHBondContact O-CB 3.35Å; T3622-F3625 PolarHBondContact O-N 2.9Å; P3623-F3625 VanDerWaalsContact C-N 3.27Å; P3623-F3625 PolarHBondContact O-N 3.29Å; F3625-C3627 VanDerWaalsContact C-N 3.34Å; F3625-C3627 PolarHBondContact O-N 3.3Å; F3625-T3628 WeakPolarHBondContact O-CA 3.44Å; F3625-T3628 WeakPolarHBondContact O-CB 3.4Å; F3625-T3628 PolarHBondContact O-N 3.3Å; F3625-E3629 HydrophobicContact CD1-CG 4.3Å; F3625-E3629 VanDerWaalsContact CE1-CD 3.43Å; F3625-E3629 HydrophobicContact CE1-CG 3.92Å; F3625-E3629 HydrophobicContact CZ-CG 4.48Å; F3625-E3629 PolarHBondContact O-N 2.92Å
3626	N	83.5	Confident	84.6	Confident	57 Å²	57	43 Å²	43	31%	0.305	23%	0.225	S	C	.	.	H	α-helix	trans	-63.6	-40.4	178.3	-66.1	-5	0	0	0	111.9	L3401 T3622 P3623 T3628 E3629 I3630	L3401-N3626 HydrophobicContact CD2-CB 3.65Å; T3622-N3626 PolarHBondContact O-N 3.46Å; P3623-N3626 PolarHBondContact O-N 3.08Å; N3626-T3628 PolarHBondContact O-N 3.45Å; N3626-E3629 PolarHBondContact O-N 2.65Å; N3626-I3630 WeakPolarHBondContact O-CG1 3.47Å; N3626-I3630 PolarHBondContact O-N 2.79Å; N3626-I3630 VanDerWaalsContact O-N 3.14Å
3627	C	86.3	Confident	84.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.6	-33.1	170	-74.5	0	0	0	0	112.3	L3401 M3560 P3563 P3623 F3625 V3631	L3401-C3627 PolarHBondContact O-SG 3.48Å; L3401-C3627 VanDerWaalsContact O-SG 3.39Å; M3560-C3627 HydrophobicContact CB-CB 4.38Å; M3560-C3627 WeakPolarHBondContact O-CB 3.44Å; P3563-C3627 HydrophobicContact CG-CB 3.76Å; P3623-C3627 VanDerWaalsContact O-CB 3.24Å; P3623-C3627 WeakPolarHBondContact O-CB 3.48Å; P3623-C3627 PolarHBondContact O-N 2.99Å; P3623-C3627 PolarHBondContact O-SG 3.46Å; F3625-C3627 VanDerWaalsContact C-N 3.34Å; F3625-C3627 PolarHBondContact O-N 3.3Å; C3627-V3631 WeakPolarHBondContact O-CB 3.46Å; C3627-V3631 WeakPolarHBondContact O-CG2 3.23Å; C3627-V3631 PolarHBondContact O-N 2.95Å
3628	T	86.8	Confident	84.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.3	-47.9	176.4	-61.4	0	0	0	0	111.4	F3564 F3611 R3615 E3624 F3625 N3626 V3631 E3632	F3564-T3628 HydrophobicContact CE1-CG2 4.34Å; F3564-T3628 HydrophobicContact CZ-CG2 3.91Å; F3611-T3628 HydrophobicContact CB-CG2 4.36Å; F3611-T3628 HydrophobicContact CD1-CG2 4.27Å; R3615-T3628 HydrophobicContact CG-CG2 4.21Å; E3624-T3628 PolarHBondContact O-N 3.07Å; E3624-T3628 VanDerWaalsContact O-N 3.15Å; E3624-T3628 PolarHBondContact O-OG1 3.48Å; F3625-T3628 WeakPolarHBondContact O-CA 3.44Å; F3625-T3628 WeakPolarHBondContact O-CB 3.4Å; F3625-T3628 PolarHBondContact O-N 3.3Å; N3626-T3628 PolarHBondContact O-N 3.45Å; T3628-V3631 PolarHBondContact O-N 2.83Å; T3628-E3632 WeakPolarHBondContact O-CB 3.27Å; T3628-E3632 PolarHBondContact O-N 3.41Å
3629	E	84.9	Confident	84.9	Confident	79 Å²	79	45.4 Å²	45.4	37%	0.369	23%	0.233	S	C	.	.	H	α-helix	trans	-70.2	-36.2	-177.3	-49.8	-152.4	120	0	0	112.1	R3615 F3625 N3626 A3633	R3615-E3629 IonicContact CZ-OE1 2.61Å; R3615-E3629 IonicContact NE-OE1 3.52Å; R3615-E3629 PolarHBondContact NE-OE1 2.96Å; R3615-E3629 IonicContact NH2-OE1 2.73Å; R3615-E3629 PolarHBondContact NH2-OE1 3.02Å; F3625-E3629 HydrophobicContact CD1-CG 4.3Å; F3625-E3629 VanDerWaalsContact CE1-CD 3.43Å; F3625-E3629 HydrophobicContact CE1-CG 3.92Å; F3625-E3629 HydrophobicContact CZ-CG 4.48Å; F3625-E3629 PolarHBondContact O-N 2.92Å; N3626-E3629 PolarHBondContact O-N 2.65Å; E3629-A3633 WeakPolarHBondContact O-CB 3.13Å; E3629-A3633 PolarHBondContact O-N 3.42Å
3630	I	85.6	Confident	84.8	Confident	9 Å²	9	44.7 Å²	44.7	5%	0.046	22%	0.223	C	C	.	.	H	α-helix	trans	-66.9	-42.8	175.3	-61.7	166.4	0	0	0	111.4	L3401 A3433 E3434 M3560 N3626 L3634	L3401-I3630 HydrophobicContact CD1-CD1 3.99Å; L3401-I3630 HydrophobicContact CD2-CD1 4.43Å; A3433-I3630 HydrophobicContact CB-CG2 3.98Å; E3434-I3630 HydrophobicContact CB-CD1 4.26Å; M3560-I3630 HydrophobicContact CG-CB 4.38Å; M3560-I3630 HydrophobicContact CG-CG2 3.85Å; M3560-I3630 HydrophobicContact SD-CD1 4.04Å; M3560-I3630 HydrophobicContact SD-CG2 4.47Å; N3626-I3630 WeakPolarHBondContact O-CG1 3.47Å; N3626-I3630 PolarHBondContact O-N 2.79Å; N3626-I3630 VanDerWaalsContact O-N 3.14Å; I3630-L3634 HydrophobicContact CG2-CD1 3.96Å; I3630-L3634 WeakPolarHBondContact O-CB 3.33Å; I3630-L3634 WeakPolarHBondContact O-CD1 3.34Å; I3630-L3634 VanDerWaalsContact O-CG 3.27Å; I3630-L3634 WeakPolarHBondContact O-CG 3.42Å; I3630-L3634 PolarHBondContact O-N 3.31Å
3631	V	88.2	Confident	84.9	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-70.4	-35.7	179.7	176.3	0	0	0	0	111.7	M3560 F3564 F3611 C3627 T3628 L3634 F3635	M3560-V3631 HydrophobicContact CB-CG2 3.54Å; F3564-V3631 HydrophobicContact CE2-CB 3.89Å; F3564-V3631 HydrophobicContact CE2-CG1 4.03Å; F3564-V3631 HydrophobicContact CE2-CG2 4.07Å; F3564-V3631 HydrophobicContact CZ-CB 4.49Å; F3611-V3631 HydrophobicContact CE1-CB 4.27Å; F3611-V3631 HydrophobicContact CE1-CG1 3.8Å; F3611-V3631 HydrophobicContact CZ-CG1 4.13Å; C3627-V3631 WeakPolarHBondContact O-CB 3.46Å; C3627-V3631 WeakPolarHBondContact O-CG2 3.23Å; C3627-V3631 PolarHBondContact O-N 2.95Å; T3628-V3631 PolarHBondContact O-N 2.83Å; V3631-L3634 PolarHBondContact O-N 3.24Å; V3631-F3635 WeakPolarHBondContact O-CB 3.4Å; V3631-F3635 PolarHBondContact O-N 3.25Å
3632	E	88	Confident	85	Confident	36 Å²	36	34 Å²	34	17%	0.168	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-44.9	174.3	-175.9	-179.9	-163	0	0	111.7	F3611 R3615 T3628 L3634 F3635 V3636	F3611-E3632 HydrophobicContact CB-CB 4.47Å; F3611-E3632 HydrophobicContact CB-CG 4.3Å; F3611-E3632 HydrophobicContact CD1-CB 3.97Å; F3611-E3632 HydrophobicContact CD2-CB 3.99Å; F3611-E3632 HydrophobicContact CD2-CG 3.75Å; F3611-E3632 HydrophobicContact CE1-CB 4.21Å; F3611-E3632 HydrophobicContact CE2-CB 4.23Å; F3611-E3632 HydrophobicContact CE2-CG 4.24Å; F3611-E3632 HydrophobicContact CG-CB 3.88Å; F3611-E3632 HydrophobicContact CG-CG 3.95Å; F3611-E3632 HydrophobicContact CZ-CB 4.34Å; R3615-E3632 IonicContact CZ-OE1 2.74Å; R3615-E3632 IonicContact CZ-OE2 2.84Å; R3615-E3632 IonicContact NH1-OE1 3.16Å; R3615-E3632 PolarHBondContact NH1-OE1 2.98Å; R3615-E3632 IonicContact NH1-OE2 3.03Å; R3615-E3632 PolarHBondContact NH1-OE2 3.06Å; R3615-E3632 IonicContact NH2-OE1 3.56Å; R3615-E3632 IonicContact NH2-OE2 2.69Å; R3615-E3632 PolarHBondContact NH2-OE2 2.78Å; T3628-E3632 WeakPolarHBondContact O-CB 3.27Å; T3628-E3632 PolarHBondContact O-N 3.41Å; E3632-L3634 VanDerWaalsContact C-N 3.33Å; E3632-L3634 PolarHBondContact O-N 2.97Å; E3632-F3635 PolarHBondContact O-N 3.46Å; E3632-V3636 WeakPolarHBondContact O-CG2 3.44Å; E3632-V3636 PolarHBondContact O-N 3.17Å
3633	A	84.3	Confident	84.5	Confident	12 Å²	12	33.7 Å²	33.7	10%	0.099	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-41	175	0	0	0	0	0	112.1	A3437 M3440 E3629 V3636 Q3637	A3437-A3633 HydrophobicContact CB-CB 3.54Å; M3440-A3633 HydrophobicContact CE-CB 4.26Å; E3629-A3633 WeakPolarHBondContact O-CB 3.13Å; E3629-A3633 PolarHBondContact O-N 3.42Å; A3633-V3636 PolarHBondContact O-N 3.41Å; A3633-Q3637 WeakPolarHBondContact O-CB 3.34Å; A3633-Q3637 PolarHBondContact O-N 3.19Å
3634	L	85.6	Confident	84	Confident	38 Å²	38	37.8 Å²	37.8	20%	0.199	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-37.8	174.6	-71.7	166.9	0	0	0	112.6	L3555 H3558 I3630 V3631 E3632 Q3637 K3638	L3555-L3634 HydrophobicContact CD2-CB 4.31Å; H3558-L3634 WeakPolarHBondContact CE1-CD1 3.16Å; H3558-L3634 WeakPolarHBondContact ND1-CD1 3.35Å; I3630-L3634 HydrophobicContact CG2-CD1 3.96Å; I3630-L3634 WeakPolarHBondContact O-CB 3.33Å; I3630-L3634 WeakPolarHBondContact O-CD1 3.34Å; I3630-L3634 VanDerWaalsContact O-CG 3.27Å; I3630-L3634 WeakPolarHBondContact O-CG 3.42Å; I3630-L3634 PolarHBondContact O-N 3.31Å; V3631-L3634 PolarHBondContact O-N 3.24Å; E3632-L3634 VanDerWaalsContact C-N 3.33Å; E3632-L3634 PolarHBondContact O-N 2.97Å; L3634-Q3637 PolarHBondContact O-N 3.35Å; L3634-K3638 WeakPolarHBondContact O-CB 3.5Å; L3634-K3638 WeakPolarHBondContact O-CG 3.32Å; L3634-K3638 PolarHBondContact O-N 3.2Å
3635	F	88.4	Confident	83.3	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-44.9	172.4	171	-107.2	0	0	0	111.1	L3551 L3555 F3603 M3607 F3611 V3631 E3632 Q3637 K3638 M3639	L3551-F3635 HydrophobicContact CD2-CD2 4.23Å; L3555-F3635 HydrophobicContact CD1-CB 4.09Å; L3555-F3635 HydrophobicContact CD1-CD2 3.84Å; L3555-F3635 HydrophobicContact CD1-CG 4.45Å; F3603-F3635 AromaticContact CE1-CE2 3.93Å; F3603-F3635 HydrophobicContact CE1-CE2 3.93Å; F3603-F3635 HydrophobicContact CE1-CZ 4.1Å; F3603-F3635 HydrophobicContact CZ-CE2 4.01Å; F3603-F3635 HydrophobicContact CZ-CZ 4.44Å; M3607-F3635 HydrophobicContact CB-CD1 4.41Å; M3607-F3635 HydrophobicContact CB-CE1 3.66Å; M3607-F3635 HydrophobicContact CB-CE2 4.06Å; M3607-F3635 HydrophobicContact CB-CZ 3.45Å; M3607-F3635 VanDerWaalsContact CB-CZ 3.45Å; M3607-F3635 HydrophobicContact CE-CE2 4.45Å; M3607-F3635 HydrophobicContact CG-CE1 4.33Å; M3607-F3635 HydrophobicContact CG-CE2 3.8Å; M3607-F3635 HydrophobicContact CG-CZ 3.65Å; F3611-F3635 HydrophobicContact CE2-CB 4.08Å; F3611-F3635 AromaticContact CE2-CD1 3.7Å; F3611-F3635 HydrophobicContact CE2-CD1 3.7Å; F3611-F3635 HydrophobicContact CE2-CE1 4.37Å; F3611-F3635 AromaticContact CE2-CG 3.99Å; F3611-F3635 HydrophobicContact CE2-CG 3.99Å; F3611-F3635 HydrophobicContact CZ-CB 4.01Å; F3611-F3635 HydrophobicContact CZ-CD1 4.43Å; F3611-F3635 HydrophobicContact CZ-CG 4.29Å; V3631-F3635 WeakPolarHBondContact O-CB 3.4Å; V3631-F3635 PolarHBondContact O-N 3.25Å; E3632-F3635 PolarHBondContact O-N 3.46Å; F3635-Q3637 VanDerWaalsContact C-N 3.35Å; F3635-Q3637 PolarHBondContact O-N 3.01Å; F3635-K3638 PolarHBondContact O-N 2.91Å; F3635-M3639 HydrophobicContact CD1-CG 4.33Å; F3635-M3639 HydrophobicContact CD2-CG 3.91Å; F3635-M3639 HydrophobicContact CE1-CG 3.96Å; F3635-M3639 HydrophobicContact CE2-CG 3.48Å; F3635-M3639 VanDerWaalsContact CE2-CG 3.48Å; F3635-M3639 HydrophobicContact CE2-SD 3.88Å; F3635-M3639 HydrophobicContact CG-CG 4.32Å; F3635-M3639 HydrophobicContact CZ-CE 4.39Å; F3635-M3639 HydrophobicContact CZ-CG 3.52Å; F3635-M3639 HydrophobicContact CZ-SD 3.98Å; F3635-M3639 VanDerWaalsContact O-CB 3.28Å; F3635-M3639 WeakPolarHBondContact O-CB 3.4Å; F3635-M3639 VanDerWaalsContact O-CG 3.25Å; F3635-M3639 WeakPolarHBondContact O-CG 3.42Å; F3635-M3639 PolarHBondContact O-N 3.2Å
3636	V	86.8	Confident	82.1	Confident	50 Å²	50	44.4 Å²	44.4	30%	0.303	22%	0.215	S	C	.	.	H	α-helix	trans	-60.6	-43.4	174.8	170.6	0	0	0	0	111	E3632 A3633 M3639 K3640	E3632-V3636 WeakPolarHBondContact O-CG2 3.44Å; E3632-V3636 PolarHBondContact O-N 3.17Å; A3633-V3636 PolarHBondContact O-N 3.41Å; V3636-M3639 PolarHBondContact O-N 3.21Å; V3636-K3640 WeakPolarHBondContact O-CG 3.21Å; V3636-K3640 PolarHBondContact O-N 3.35Å
3637	Q	84.2	Confident	80.4	Confident	97 Å²	97	47.8 Å²	47.8	45%	0.453	23%	0.233	S	C	.	.	H	α-helix	trans	-62.7	-46.2	175.8	-172.6	-179.4	11.9	0	0	112.2	A3633 L3634 F3635 M3639 K3640 Q3641	A3633-Q3637 WeakPolarHBondContact O-CB 3.34Å; A3633-Q3637 PolarHBondContact O-N 3.19Å; L3634-Q3637 PolarHBondContact O-N 3.35Å; F3635-Q3637 VanDerWaalsContact C-N 3.35Å; F3635-Q3637 PolarHBondContact O-N 3.01Å; Q3637-M3639 VanDerWaalsContact C-N 3.35Å; Q3637-K3640 WeakPolarHBondContact O-CB 3.46Å; Q3637-K3640 PolarHBondContact O-N 3.45Å; Q3637-Q3641 PolarHBondContact O-N 3.4Å
3638	K	85.2	Confident	80.1	Confident	69 Å²	69	50.2 Å²	50.2	30%	0.3	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-36.4	177	-80.1	-79.6	173.7	173.2	0	112.4	L3551 E3554 L3634 F3635 Q3641 F3642	L3551-K3638 HydrophobicContact CD1-CB 4.12Å; L3551-K3638 HydrophobicContact CD2-CB 3.96Å; L3551-K3638 HydrophobicContact CG-CB 4Å; E3554-K3638 VanDerWaalsContact OE2-CE 3.31Å; E3554-K3638 WeakPolarHBondContact OE2-CE 3.29Å; E3554-K3638 IonicContact OE2-NZ 3.99Å; E3554-K3638 PolarHBondContact OE2-NZ 3.47Å; L3634-K3638 WeakPolarHBondContact O-CB 3.5Å; L3634-K3638 WeakPolarHBondContact O-CG 3.32Å; L3634-K3638 PolarHBondContact O-N 3.2Å; F3635-K3638 PolarHBondContact O-N 2.91Å; K3638-Q3641 PolarHBondContact O-N 2.83Å; K3638-F3642 WeakPolarHBondContact O-CB 3.49Å; K3638-F3642 PolarHBondContact O-N 3.05Å
3639	M	84	Confident	79.7	Confident	13 Å²	13	52.8 Å²	52.8	6%	0.064	26%	0.257	C	S	.	.	H	α-helix	trans	-67.9	-35.4	173.2	-76.1	-67.5	-73.1	0	0	112.1	L3548 L3551 L3600 F3603 F3635 V3636 Q3637 F3642 K3643	L3548-M3639 HydrophobicContact CD2-SD 4.41Å; L3551-M3639 HydrophobicContact CD1-SD 4.41Å; L3600-M3639 HydrophobicContact CD1-CE 4.14Å; L3600-M3639 HydrophobicContact CD2-CE 4.33Å; L3600-M3639 HydrophobicContact CG-CE 4.18Å; F3603-M3639 HydrophobicContact CD1-CE 4.36Å; F3603-M3639 HydrophobicContact CE1-CE 4.32Å; F3603-M3639 HydrophobicContact CE1-SD 3.91Å; F3635-M3639 HydrophobicContact CD1-CG 4.33Å; F3635-M3639 HydrophobicContact CD2-CG 3.91Å; F3635-M3639 HydrophobicContact CE1-CG 3.96Å; F3635-M3639 HydrophobicContact CE2-CG 3.48Å; F3635-M3639 VanDerWaalsContact CE2-CG 3.48Å; F3635-M3639 HydrophobicContact CE2-SD 3.88Å; F3635-M3639 HydrophobicContact CG-CG 4.32Å; F3635-M3639 HydrophobicContact CZ-CE 4.39Å; F3635-M3639 HydrophobicContact CZ-CG 3.52Å; F3635-M3639 HydrophobicContact CZ-SD 3.98Å; F3635-M3639 VanDerWaalsContact O-CB 3.28Å; F3635-M3639 WeakPolarHBondContact O-CB 3.4Å; F3635-M3639 VanDerWaalsContact O-CG 3.25Å; F3635-M3639 WeakPolarHBondContact O-CG 3.42Å; F3635-M3639 PolarHBondContact O-N 3.2Å; V3636-M3639 PolarHBondContact O-N 3.21Å; Q3637-M3639 VanDerWaalsContact C-N 3.35Å; M3639-F3642 PolarHBondContact O-N 2.9Å; M3639-K3643 WeakPolarHBondContact O-CG 3.47Å; M3639-K3643 PolarHBondContact O-N 2.77Å
3640	K	80.4	Confident	79.4	Confident	53 Å²	53	51.3 Å²	51.3	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-63.8	-47.3	171.2	-75	178.7	174	-158.7	0	111.5	E3463 V3636 Q3637 F3642 K3643 E3644	E3463-K3640 WeakPolarHBondContact OE1-CD 3.21Å; E3463-K3640 VanDerWaalsContact OE1-CE 3.25Å; E3463-K3640 WeakPolarHBondContact OE1-CE 3.36Å; E3463-K3640 IonicContact OE1-NZ 3.03Å; E3463-K3640 PolarHBondContact OE1-NZ 2.79Å; E3463-K3640 IonicContact OE2-NZ 2.72Å; E3463-K3640 PolarHBondContact OE2-NZ 3.23Å; V3636-K3640 WeakPolarHBondContact O-CG 3.21Å; V3636-K3640 PolarHBondContact O-N 3.35Å; Q3637-K3640 WeakPolarHBondContact O-CB 3.46Å; Q3637-K3640 PolarHBondContact O-N 3.45Å; K3640-F3642 VanDerWaalsContact C-N 3.32Å; K3640-F3642 PolarHBondContact O-N 3.07Å; K3640-K3643 WeakPolarHBondContact O-CA 3.43Å; K3640-K3643 WeakPolarHBondContact O-CB 3.45Å; K3640-K3643 PolarHBondContact O-N 3.26Å; K3640-E3644 WeakPolarHBondContact O-CG 3.47Å; K3640-E3644 PolarHBondContact O-N 2.68Å
3641	Q	81.8	Confident	79.1	Confident	76 Å²	76	53.8 Å²	53.8	36%	0.355	26%	0.263	S	S	.	.	H	α-helix	trans	-58.6	-42.6	173.5	-70.1	174.8	-19.7	0	0	111.9	Q3637 K3638 K3643 E3644 E3645	Q3637-Q3641 PolarHBondContact O-N 3.4Å; K3638-Q3641 PolarHBondContact O-N 2.83Å; Q3641-K3643 VanDerWaalsContact C-N 3.29Å; Q3641-K3643 PolarHBondContact O-N 3.42Å; Q3641-E3644 PolarHBondContact O-N 2.83Å; Q3641-E3645 WeakPolarHBondContact O-CB 3.35Å; Q3641-E3645 PolarHBondContact O-N 2.83Å
3642	F	81.3	Confident	78.5	Confident	13 Å²	13	57.1 Å²	57.1	6%	0.057	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-27.1	175	-178.2	-99.3	0	0	0	113.2	R3544 K3547 L3548 L3551 L3600 K3638 M3639 K3640 N3646	R3544-F3642 HydrophobicContact CB-CZ 4.33Å; R3544-F3642 HydrophobicContact CG-CZ 4.4Å; K3547-F3642 HydrophobicContact CB-CD2 4.24Å; K3547-F3642 HydrophobicContact CB-CE2 3.59Å; K3547-F3642 HydrophobicContact CD-CD2 4.2Å; K3547-F3642 HydrophobicContact CD-CE2 3.74Å; K3547-F3642 HydrophobicContact CG-CE2 4.33Å; L3548-F3642 HydrophobicContact CD2-CD1 4.07Å; L3548-F3642 HydrophobicContact CD2-CD2 4.47Å; L3548-F3642 HydrophobicContact CD2-CE1 3.78Å; L3548-F3642 HydrophobicContact CD2-CE2 4.2Å; L3548-F3642 HydrophobicContact CD2-CG 4.41Å; L3548-F3642 HydrophobicContact CD2-CZ 3.84Å; L3548-F3642 HydrophobicContact CG-CE1 4.27Å; L3548-F3642 HydrophobicContact CG-CE2 4.34Å; L3548-F3642 HydrophobicContact CG-CZ 3.91Å; L3551-F3642 HydrophobicContact CD1-CB 4.14Å; L3551-F3642 HydrophobicContact CD1-CG 4.5Å; L3600-F3642 HydrophobicContact CD1-CE1 3.98Å; L3600-F3642 HydrophobicContact CD2-CD1 4.42Å; L3600-F3642 HydrophobicContact CD2-CE1 4.1Å; K3638-F3642 WeakPolarHBondContact O-CB 3.49Å; K3638-F3642 PolarHBondContact O-N 3.05Å; M3639-F3642 PolarHBondContact O-N 2.9Å; K3640-F3642 VanDerWaalsContact C-N 3.32Å; K3640-F3642 PolarHBondContact O-N 3.07Å; F3642-N3646 WeakPolarHBondContact CD2-ND2 3.37Å; F3642-N3646 VanDerWaalsContact CE2-ND2 3.31Å; F3642-N3646 WeakPolarHBondContact CE2-ND2 3.47Å; F3642-N3646 PolarHBondContact O-ND2 3.32Å
3643	K	74.6	Confident	77.9	Confident	23 Å²	23	58.5 Å²	58.5	10%	0.1	29%	0.286	C	S	.	.	H	α-helix	trans	-71.3	-50.4	168.5	-70.9	175.7	-176.3	-178.4	0	110.8	D3462 I3535 Y3536 M3639 K3640 Q3641 E3645 N3646 L3647	D3462-K3643 IonicContact OD2-NZ 3.27Å; D3462-K3643 PolarHBondContact OD2-NZ 3.03Å; I3535-K3643 HydrophobicContact CD1-CD 3.94Å; I3535-K3643 HydrophobicContact CD1-CG 4.23Å; I3535-K3643 HydrophobicContact CG2-CD 4.26Å; I3535-K3643 HydrophobicContact CG2-CG 4.09Å; Y3536-K3643 PolarHBondContact OH-NZ 3.47Å; M3639-K3643 WeakPolarHBondContact O-CG 3.47Å; M3639-K3643 PolarHBondContact O-N 2.77Å; K3640-K3643 WeakPolarHBondContact O-CA 3.43Å; K3640-K3643 WeakPolarHBondContact O-CB 3.45Å; K3640-K3643 PolarHBondContact O-N 3.26Å; Q3641-K3643 VanDerWaalsContact C-N 3.29Å; Q3641-K3643 PolarHBondContact O-N 3.42Å; K3643-E3645 VanDerWaalsContact C-N 3.27Å; K3643-E3645 PolarHBondContact O-N 3.24Å; K3643-N3646 CarbonylContact O-C 3.59Å; K3643-N3646 PolarHBondContact O-N 2.93Å; K3643-L3647 HydrophobicContact CB-CD1 4.4Å; K3643-L3647 WeakPolarHBondContact O-CB 3.15Å; K3643-L3647 WeakPolarHBondContact O-CG 3.34Å; K3643-L3647 PolarHBondContact O-N 2.93Å
3644	E	73.3	Confident	77.4	Confident	124 Å²	124	61.9 Å²	61.9	58%	0.579	30%	0.3	S	S	*	.	H	α-helix	trans	-59.2	-33	-179.9	-69.4	176.4	159	0	0	113.2	K3640 Q3641	K3640-E3644 WeakPolarHBondContact O-CG 3.47Å; K3640-E3644 PolarHBondContact O-N 2.68Å; Q3641-E3644 PolarHBondContact O-N 2.83Å
3645	E	70.1	Confident	76.8	Confident	126 Å²	126	63.7 Å²	63.7	59%	0.589	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-15.2	175	-84	-169	-163	0	0	115.7	K3547 Q3641 K3643	K3547-E3645 IonicContact NZ-OE2 3.81Å; K3547-E3645 PolarHBondContact NZ-OE2 2.98Å; Q3641-E3645 WeakPolarHBondContact O-CB 3.35Å; Q3641-E3645 PolarHBondContact O-N 2.83Å; K3643-E3645 VanDerWaalsContact C-N 3.27Å; K3643-E3645 PolarHBondContact O-N 3.24Å
3646	N	59.9	Low	75.8	Confident	53 Å²	53	68.7 Å²	68.7	28%	0.283	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	18.5	-171.6	-59.5	-74.7	0	0	0	112.8	K3547 F3642 K3643	K3547-N3646 PolarHBondContact NZ-OD1 3.16Å; F3642-N3646 WeakPolarHBondContact CD2-ND2 3.37Å; F3642-N3646 VanDerWaalsContact CE2-ND2 3.31Å; F3642-N3646 WeakPolarHBondContact CE2-ND2 3.47Å; F3642-N3646 PolarHBondContact O-ND2 3.32Å; K3643-N3646 CarbonylContact O-C 3.59Å; K3643-N3646 PolarHBondContact O-N 2.93Å
3647	L	47.8	Very low	74.8	Confident	127 Å²	127	70.4 Å²	70.4	67%	0.665	33%	0.334	S	S	*	.			trans	-104	0	172	-91.4	165.8	0	0	0	111.2	L3492 I3535 K3643	L3492-L3647 HydrophobicContact CD2-CB 3.93Å; L3492-L3647 HydrophobicContact CD2-CD2 4.1Å; I3535-L3647 HydrophobicContact CD1-CD1 4.33Å; K3643-L3647 HydrophobicContact CB-CD1 4.4Å; K3643-L3647 WeakPolarHBondContact O-CB 3.15Å; K3643-L3647 WeakPolarHBondContact O-CG 3.34Å; K3643-L3647 PolarHBondContact O-N 2.93Å

Retrieved 3,647 of 3,647 residues in 2422.8 ms (Link to these results)

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