A0A3Q0KP99_SCHMA Loading...

Putative transient receptor potential cation channel

AlphaFold DB , UniProt , Accession A0A3Q0KP99, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,514 aa.

						>A0A3Q0KP99_SCHMA|A0A3Q0KP99
MGRKRHTVGSVFRNRSDKSSRSSGTSSSSSSSSSKSSIKPIPWIEQNIVCLECAKFVFARHSKSNPCCSCGLTFSEHPSNVQIEALTQQNLNLQPDISNTGDYHLKPTNNEHWHVKTHTQEIPTNAYGTVEFQGGPHPTKARYVRLHCETCPEVVLHLLLHEWKIRVPNLVISIVGGLANAPLQAKLQQVVQHGILRAAKTTGAWIVTNGLDIGVTRHIGEALKDEVHIRGSNIVALGIAPWGYVQHRETLIGLDNTCSYYSQGWRPGRQEAPLNPDHNYFLLADNGTSGKFGGELGLRRRLEQYLAQQPIDMRRYGGSKSRVPIVGVLLEGGTQTFRTVFELVTGRNPVPIVVCDGSGRAADLLAFMHRYANEDGDLSTQLRDQMVANISRAFQIRRFEAEGLYSELKLCMKRRHLISVFRMGEGDSDEIDITILTALLQVSGQNLTPAEQLSLTMAWNRPDIARSKVFAKFNNWSKTTLENAMADALLNDRLEFVQLLLTKGLRIQRFLTRERLEELYNVDVNNQSFHKLFAKVLGTKQKITLRSVGQLIENLVGGGYQHSYCSKPSTADLMGSPNHGNGWLPNVNVTFINKHGSTVSEPVDSKTIRSGNILNNTSDKSILPCTLNPGSISNLITSKELVTQHITNIINRQHTSQQHVPYSASSNDINQSNRYFRYPYTELLQWTLLTRRLDMAKFLVLAGEESIAKALFSVKLLRSIRHVTLDEETDIELLNECRSHELALERLAVDLQDHCYRHDQDQAKRLLTYELQAFSKNTCLSLAYMCESKVFIGHPCTQAILNDLWYGGLRKGDLVGAKVALILIGLIVPPLYPLIAFFFTKKSKFLEFKTKEELAQQPQTLQEHLDELEDSSESSSSSSSSSSSSSTSSPSTSRRCSVNHPNLPNEKQLTNENFLSNHNVTEDSLLDQVPTIRINSPAPSAKSDKLVLHPHNSNNDIVRSNLSNEINQRNDHFESINNIHDWSPTLKYHSENTDKLDKTDVLSNFPSSSSQPCYNESINHPIDYKINPQLNNKQYMSTNPHTIKELTTPSTHHDHTDDGLPFKSRKKRMVSDTINTDLQTVPTVKTLPTEMNSAKRYRCEPNYKSIYPLTTIKNRKLSQSSSNISQTIPQSFIQTPKHSYPDRNFNGLRHESRNHIRKQRYTFHPYSTALNTSQNAALARHAFLLRSNLAALIPSNHYASVAASNDFQQRRRYERRRNRVYSNPDEDDTNKITQKIINNKKLSTTNCDVVYVSSIPTITTINPSIFTYNHHNKQNKLNSTLKDHSFSSLSYHHRNGQWVPCDLTVGYDFQSTNNHGLQLSWRKKVYEFFSAPLLYLVFLVLFIGLCIHTLPPDTFSFLELYVYLHILTYWLDKFREVTLNPGATYIQKFAVHLSAFWNSYDMIMCLLSIIGIILRYYGIINQNYYMWGKNLLIICCSLWQMRFLELMQIWRFSGPYIYMLVKMVRLMIPMLTLLFLPLLAFGTIRQGIMYPKHTYVNLEAVKGIMLKPYFMLYGEVYAGEIDPIDWPIESQTAPFLEIVPIATVIYLLYSIILFVNVVIAVFNDIFARVRQQSELVYNYLRYAVIIEYESRPLLPPPFIIISWIYMSIRNIYRIRKKRRASIQPNTLNLPNLSDAQKQTSQNGNNTNNNNNNNNNNNDPNSPSKSDSRNRRDNNEPQDTVIDSATTELSAGLKLFLNPDEVEKLHDFEEECVEDYTRVTRKAELHKAEGQVEILNKKIDQLQFRMDEIHVRQRHLRGLVHLVEEHLVCMEDNLHTAGVISPSPGVIHHQYNTHDMEHLTMTTSTTTTVNSHEIPSNSIVNNSKEKDMIFTSSLLWLLKRQIAQDSGTTTNENIDYPQQLARSLVSQLGRRSRVPTGSFSSRQHQNHLDPAFERSPTCSVRMKHRNGRTDHRHSLPTFDYLSFPHSEGHYHGSYYDRMYERGRNRLPTNRIQHGSYRAPDLTYREYTTICDDIDLSCLSYPNSPIMSPNGSRIDLTCVGLIRNTNLPTDTTLFKTKEYLPITKYQNVPFIPIENITNRPVNQIIPSCMATDSNTAIIATAKASLEPKSAPATPKEERALLFQSSINENGTQRSQSLATLHTNTKSIDQQSHMPTKHYTSYDTNLHFINPELYPYTHILTNTDTNHNVKTTKNSVNIQNLITDLKNYTQDMSITNESYIIDDHQDNNDFGNGDDDVINYDDEHNRRNVDDQDNDPDENENMKEMEDETDDYDNDNDDGDDDDNDLEDEERKIQLGLQEAENAERIELQGAMLRRLRKLSTSVPSKPCHLSGVNNSTASHLDKHNNVKIIKHGFNQINSQKTSCWNTENLPDSTEKSPIPIIGHTHEVGLISSEDMGDFLSHVANEEEAVDPDLDLDFDSIHHDSSSLSSSDMRSYVESPVEQAGTSLNLNDDIELISRNLRSSSGKINTNIDDNDDDDALSLSPPLNSLTTDNTIVNNDNNNNSNIHLSYPSPILEEKEEEEEVDVEVYPDNNDDNHHCEVEEPIIMKITETRKSL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.9	Very low	26.4	Very low	252 Å²	252	143 Å²	143	100%	1.241	77%	0.766	S	S	*	*				0	131.4	0	-62.3	-179.4	-175.6	0	0	107.2
2	G	26.3	Very low	26.2	Very low	55 Å²	55	146.3 Å²	146.3	57%	0.567	77%	0.769	S	S	*	*			cis	118.4	157.5	1.4	0	0	0	0	0	112.6
3	R	23.6	Very low	26.1	Very low	218 Å²	218	151.4 Å²	151.4	82%	0.823	77%	0.771	S	S	*	*			trans	77.3	138.4	-170.2	-60.9	178.5	167.9	178.6	-4.6	113.4
4	K	24	Very low	25.9	Very low	159 Å²	159	150.9 Å²	150.9	69%	0.691	77%	0.771	S	S	*	*			cis	-150.2	147.5	4.4	-130.2	171.3	-177.8	-166.1	0	111.2
5	R	26.6	Very low	25.8	Very low	198 Å²	198	154.3 Å²	154.3	75%	0.747	77%	0.771	S	S	*	*			trans	-57.1	141.2	152.8	-69.6	177.4	176.1	163.2	-2.9	108
6	H	26.7	Very low	25.7	Very low	155 Å²	155	151.5 Å²	151.5	72%	0.718	77%	0.77	S	S	*	*			trans	-129.3	78	153.7	-104.7	-75.1	0	0	0	108.7
7	T	32.5	Very low	25.6	Very low	123 Å²	123	149.7 Å²	149.7	76%	0.755	76%	0.763	S	S	*	*			trans	-59.2	124.6	147.1	30.1	0	0	0	0	108.3
8	V	27	Very low	25.7	Very low	122 Å²	122	150.9 Å²	150.9	74%	0.739	76%	0.762	S	S	*	*			trans	-144.3	76	154	-168.6	0	0	0	0	109.2
9	G	23.2	Very low	25.7	Very low	67 Å²	67	148.6 Å²	148.6	69%	0.691	76%	0.762	S	S	*	*	S	Bend		-83.4	153.6	122.8	0	0	0	0	0	107.6
10	S	26.7	Very low	25.9	Very low	104 Å²	104	146.6 Å²	146.6	73%	0.727	76%	0.761	S	S	*	*			trans	-77	150.5	174.1	72.2	0	0	0	0	109.2
11	V	25.8	Very low	26	Very low	120 Å²	120	150.7 Å²	150.7	73%	0.727	77%	0.767	S	S	*	*				54.4	117.1	53.2	179.6	0	0	0	0	110.9
12	F	24.5	Very low	26.1	Very low	182 Å²	182	143.3 Å²	143.3	80%	0.798	74%	0.74	S	S	*	*			trans	14.3	132.9	159.4	-65.6	-100.8	0	0	0	117.8
13	R	24.9	Very low	26.3	Very low	213 Å²	213	146.4 Å²	146.4	80%	0.804	75%	0.753	S	S	*	*				-178.4	149.9	53.5	-141	161.5	-173.8	165.7	0.4	112
14	N	23.3	Very low	26.6	Very low	144 Å²	144	139.5 Å²	139.5	77%	0.77	75%	0.749	S	S	*	*			trans	39.6	140	149.7	-64.6	17.4	0	0	0	123
15	R	23.7	Very low	27	Very low	203 Å²	203	138.6 Å²	138.6	77%	0.766	76%	0.757	S	S	*	*			trans	-55.7	167.8	157.2	-72.6	172.1	162.5	165.8	-7.1	113.1
16	S	24.8	Very low	27.2	Very low	109 Å²	109	133.6 Å²	133.6	76%	0.762	75%	0.753	S	S	*	*			trans	91.5	122.5	155.3	69.8	0	0	0	0	120.8
17	D	24	Very low	27.4	Very low	121 Å²	121	131.1 Å²	131.1	65%	0.647	75%	0.753	S	S	*	*			trans	67.6	112.8	143.1	-70.6	-60.3	0	0	0	125.1
18	K	26.3	Very low	27.3	Very low	172 Å²	172	130 Å²	130	75%	0.748	75%	0.75	S	S	*	*				54.4	116.1	128.6	-59.1	-177.8	-175.1	87	0	121.6
19	S	26.9	Very low	27.4	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	75%	0.752	S	S	*	*				90.2	117.5	129.1	72.9	0	0	0	0	123.6
20	S	28.6	Very low	27.8	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	75%	0.754	S	S	*	*			trans	79	129	133.1	72.7	0	0	0	0	124.6
21	R	28.4	Very low	28	Very low	233 Å²	233	131.8 Å²	131.8	88%	0.879	76%	0.757	S	S	*	*			trans	79.1	116.6	136.4	-85.6	-177.3	171.1	172	-2.8	123.8
22	S	30.5	Very low	28.3	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	77%	0.766	S	S	*	*				75.8	122.3	125.9	64.7	0	0	0	0	124.4
23	S	30.9	Very low	28.7	Very low	120 Å²	120	129.4 Å²	129.4	84%	0.839	77%	0.769	S	S	*	*			trans	60.8	130.8	136.1	61.8	0	0	0	0	122.1
24	G	30	Very low	29.1	Very low	73 Å²	73	124.8 Å²	124.8	75%	0.753	77%	0.769	S	S	*	*			trans	172.2	162.8	165.4	0	0	0	0	0	115.1
25	T	31.4	Very low	29.4	Very low	140 Å²	140	128.3 Å²	128.3	86%	0.859	78%	0.777	S	S	*	*			trans	-149.2	-179.3	-177.4	58.2	0	0	0	0	109.3
26	S	30.4	Very low	29.9	Very low	94 Å²	94	124 Å²	124	66%	0.657	78%	0.779	S	S	*	*			cis	-161.7	165.3	16.1	-14.9	0	0	0	0	113
27	S	30.7	Very low	30.3	Very low	103 Å²	103	123 Å²	123	72%	0.72	77%	0.771	S	S	*	*			trans	57.5	129	144.7	62.7	0	0	0	0	123.8
28	S	30.5	Very low	30.9	Very low	99 Å²	99	124 Å²	124	69%	0.692	78%	0.776	S	S	*	*			trans	73.6	136.9	133.9	61.6	0	0	0	0	123.9
29	S	30.7	Very low	31.8	Very low	112 Å²	112	124.5 Å²	124.5	78%	0.783	78%	0.778	S	S	*	*			trans	65.7	148.7	155.8	35.1	0	0	0	0	119.4
30	S	30.9	Very low	32.9	Very low	103 Å²	103	124.9 Å²	124.9	72%	0.72	78%	0.778	S	S	*	*			cis	-162.9	144	-9.9	45.9	0	0	0	0	112.9
31	S	31.5	Very low	34.3	Very low	115 Å²	115	124.6 Å²	124.6	80%	0.804	77%	0.766	S	S	*	*			trans	37.7	117.5	150.2	62.9	0	0	0	0	121.9
32	S	31.1	Very low	36.5	Very low	129 Å²	129	116 Å²	116	90%	0.902	74%	0.741	S	S	*	*				-152.9	154.5	127.2	64.7	0	0	0	0	110.4
33	S	33.1	Very low	39.1	Very low	123 Å²	123	114.1 Å²	114.1	86%	0.86	72%	0.719	S	S	*	*			trans	-116.8	126.7	-169.8	62.5	0	0	0	0	113.4
34	S	32.7	Very low	41.8	Very low	116 Å²	116	109 Å²	109	81%	0.811	68%	0.682	S	S	*	*			trans	-139.6	143.1	164.3	59.9	0	0	0	0	110.9
35	K	29.9	Very low	44.3	Very low	218 Å²	218	108 Å²	108	95%	0.948	66%	0.658	S	S	*	*			trans	-81	130.3	-170.3	-61.7	175.5	-177.6	175.7	0	110.8
36	S	34.5	Very low	46.8	Very low	113 Å²	113	107.3 Å²	107.3	79%	0.79	65%	0.645	S	S	*	*			trans	-133.9	164.3	175.5	57.9	0	0	0	0	111.5
37	S	32.9	Very low	49.5	Very low	87 Å²	87	106.3 Å²	106.3	61%	0.608	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-83	123.6	-164.6	49.8	0	0	0	0	113.8
38	I	36.9	Very low	52.4	Low	144 Å²	144	101.5 Å²	101.5	74%	0.738	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-78.5	121.1	170.2	-62.2	167.9	0	0	0	108.6
39	K	45.6	Very low	55.3	Low	182 Å²	182	98.9 Å²	98.9	79%	0.791	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-72	145.6	159.9	-78.7	-173.8	174.6	-175.4	0	108.4	I41	K39-I41 PolarHBondContact O-N 3.44Å
40	P	49	Very low	58.1	Low	115 Å²	115	93.6 Å²	93.6	75%	0.747	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-59.5	139.2	169.5	27.7	-34.1	0	0	0	110
41	I	59.8	Low	60.9	Low	100 Å²	100	88.9 Å²	88.9	51%	0.513	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-63.4	134.3	174.4	-61	171.6	0	0	0	108	K39 E45 Q46	K39-I41 PolarHBondContact O-N 3.44Å; I41-E45 HydrophobicContact CG2-CB 3.73Å; I41-Q46 HydrophobicContact CB-CG 4.09Å; I41-Q46 HydrophobicContact CG2-CG 3.8Å; I41-Q46 PolarHBondContact O-NE2 3.35Å
42	P	73.4	Confident	63.4	Low	54 Å²	54	86 Å²	86	35%	0.351	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-52	143.8	177.3	-29.2	37.1	0	0	0	113.2	I44 E45 Q46 Y127	P42-I44 PolarHBondContact O-N 3.16Å; P42-E45 HydrophobicContact CB-CG 4.42Å; P42-E45 PolarHBondContact O-N 2.92Å; P42-E45 VanDerWaalsContact O-N 3.13Å; P42-Q46 PolarHBondContact O-N 3.35Å; P42-Y127 WeakPolarHBondContact CG-OH 3.24Å
43	W	86.1	Confident	66	Low	56 Å²	56	80.1 Å²	80.1	21%	0.212	44%	0.441	C	S	.	.	H	α-helix	trans	-57.5	-34.3	-179.6	-179.9	95.7	0	0	0	112.2	Q46 N47 I48 V154 H157 L158 E162	W43-Q46 PolarHBondContact O-N 3.16Å; W43-N47 HydrophobicContact CD2-CB 4.36Å; W43-N47 HydrophobicContact CH2-CB 4.24Å; W43-N47 HydrophobicContact CZ2-CB 4.03Å; W43-N47 HydrophobicContact CZ3-CB 4.49Å; W43-N47 PolarHBondContact NE1-ND2 2.98Å; W43-N47 WeakPolarHBondContact O-CB 3.47Å; W43-N47 PolarHBondContact O-N 2.73Å; W43-N47 VanDerWaalsContact O-N 3.09Å; W43-N47 PolarHBondContact O-ND2 3.44Å; W43-I48 HydrophobicContact CZ3-CD1 4.15Å; W43-I48 HydrophobicContact CZ3-CG1 4.44Å; W43-V154 HydrophobicContact CH2-CG1 3.64Å; W43-V154 WeakPolarHBondContact CH2-O 3.38Å; W43-V154 HydrophobicContact CZ2-CG1 4.23Å; W43-V154 HydrophobicContact CZ3-CG1 4.47Å; W43-H157 AromaticContact CE2-CE1 3.64Å; W43-H157 AromaticContact CE2-ND1 3.43Å; W43-H157 HydrophobicContact CH2-CB 4.04Å; W43-H157 AromaticContact CH2-ND1 3.63Å; W43-H157 HydrophobicContact CZ2-CB 3.95Å; W43-H157 AromaticContact CZ2-CE1 3.83Å; W43-H157 AromaticContact CZ2-CG 3.6Å; W43-H157 AromaticContact CZ2-ND1 3.17Å; W43-H157 WeakPolarHBondContact CZ2-ND1 3.48Å; W43-H157 AromaticContact NE1-CE1 3.61Å; W43-H157 AromaticContact NE1-ND1 3.88Å; W43-L158 HydrophobicContact CE3-CD1 4.47Å; W43-L158 HydrophobicContact CH2-CB 4.42Å; W43-L158 HydrophobicContact CZ3-CB 4.05Å; W43-L158 HydrophobicContact CZ3-CD1 3.98Å; W43-E162 HydrophobicContact CD2-CG 4.07Å; W43-E162 HydrophobicContact CE3-CG 3.66Å; W43-E162 HydrophobicContact CZ3-CG 4.11Å
44	I	85.9	Confident	68.5	Low	13 Å²	13	75.7 Å²	75.7	7%	0.067	41%	0.411	C	S	.	.	H	α-helix	trans	-59.7	-51.6	176	-65.5	172.4	0	0	0	111.1	P42 Q46 N47 I48 T124 Y127 V144 L158	P42-I44 PolarHBondContact O-N 3.16Å; I44-Q46 PolarHBondContact O-N 2.86Å; I44-N47 PolarHBondContact O-N 3.15Å; I44-I48 HydrophobicContact CG2-CB 4.43Å; I44-I48 HydrophobicContact CG2-CD1 4.31Å; I44-I48 WeakPolarHBondContact O-CB 3.48Å; I44-I48 PolarHBondContact O-N 3.17Å; I44-T124 HydrophobicContact CG2-CG2 3.64Å; I44-Y127 HydrophobicContact CB-CD2 4.36Å; I44-Y127 HydrophobicContact CB-CE2 4.35Å; I44-Y127 HydrophobicContact CD1-CD2 3.67Å; I44-Y127 HydrophobicContact CD1-CE2 4.04Å; I44-Y127 HydrophobicContact CD1-CG 4.34Å; I44-Y127 HydrophobicContact CG2-CD1 3.75Å; I44-Y127 HydrophobicContact CG2-CD2 3.97Å; I44-Y127 HydrophobicContact CG2-CE1 4.11Å; I44-Y127 HydrophobicContact CG2-CE2 4.32Å; I44-Y127 HydrophobicContact CG2-CG 3.67Å; I44-V144 HydrophobicContact CG2-CG2 4.29Å; I44-L158 HydrophobicContact CD1-CD1 4.04Å; I44-L158 HydrophobicContact CG1-CD1 3.85Å
45	E	83.4	Confident	70.8	Confident	53 Å²	53	72.4 Å²	72.4	25%	0.248	38%	0.382	C	S	.	.	H	α-helix	trans	-64.3	-27.3	179.4	-70.6	174.9	-162	0	0	113.1	I41 P42 Y127	I41-E45 HydrophobicContact CG2-CB 3.73Å; P42-E45 HydrophobicContact CB-CG 4.42Å; P42-E45 PolarHBondContact O-N 2.92Å; P42-E45 VanDerWaalsContact O-N 3.13Å; E45-Y127 HydrophobicContact CG-CE1 3.68Å; E45-Y127 PolarHBondContact OE1-OH 2.94Å
46	Q	84.7	Confident	73.2	Confident	125 Å²	125	62.5 Å²	62.5	58%	0.584	34%	0.339	S	S	*	.	H	α-helix	trans	-79.6	-31.2	177.1	-65.6	-176	37.1	0	0	113.7	I41 P42 W43 I44	I41-Q46 HydrophobicContact CB-CG 4.09Å; I41-Q46 HydrophobicContact CG2-CG 3.8Å; I41-Q46 PolarHBondContact O-NE2 3.35Å; P42-Q46 PolarHBondContact O-N 3.35Å; W43-Q46 PolarHBondContact O-N 3.16Å; I44-Q46 PolarHBondContact O-N 2.86Å
47	N	86.9	Confident	75.3	Confident	72 Å²	72	57.8 Å²	57.8	39%	0.385	31%	0.306	S	S	.	.	H	α-helix	trans	-119.9	-10.9	-166.3	-64.2	-88.9	0	0	0	114.6	W43 I44 V154	W43-N47 HydrophobicContact CD2-CB 4.36Å; W43-N47 HydrophobicContact CH2-CB 4.24Å; W43-N47 HydrophobicContact CZ2-CB 4.03Å; W43-N47 HydrophobicContact CZ3-CB 4.49Å; W43-N47 PolarHBondContact NE1-ND2 2.98Å; W43-N47 WeakPolarHBondContact O-CB 3.47Å; W43-N47 PolarHBondContact O-N 2.73Å; W43-N47 VanDerWaalsContact O-N 3.09Å; W43-N47 PolarHBondContact O-ND2 3.44Å; I44-N47 PolarHBondContact O-N 3.15Å; N47-V154 HydrophobicContact CB-CG1 4.25Å
48	I	90.4	Very high	77.3	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.01	30%	0.3	C	S	.	.			trans	-120.2	119.8	-176.5	-57	-174.4	0	0	0	110.2	W43 I44 T124 V144 L146 V154 L158	W43-I48 HydrophobicContact CZ3-CD1 4.15Å; W43-I48 HydrophobicContact CZ3-CG1 4.44Å; I44-I48 HydrophobicContact CG2-CB 4.43Å; I44-I48 HydrophobicContact CG2-CD1 4.31Å; I44-I48 WeakPolarHBondContact O-CB 3.48Å; I44-I48 PolarHBondContact O-N 3.17Å; I48-T124 HydrophobicContact CB-CG2 3.97Å; I48-T124 HydrophobicContact CG2-CG2 3.9Å; I48-T124 WeakPolarHBondContact O-CB 3.28Å; I48-T124 WeakPolarHBondContact O-CG2 3.5Å; I48-T124 PolarHBondContact O-N 2.91Å; I48-V144 HydrophobicContact CD1-CG2 4.03Å; I48-V144 HydrophobicContact CG2-CG2 4.01Å; I48-L146 HydrophobicContact CG2-CB 3.55Å; I48-V154 HydrophobicContact CG1-CG1 4.27Å; I48-L158 HydrophobicContact CD1-CD1 4.12Å; I48-L158 HydrophobicContact CD1-CD2 4.16Å
49	V	91	Very high	78.9	Confident	45 Å²	45	53.4 Å²	53.4	27%	0.273	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	152.7	176.4	-66.1	0	0	0	0	111.3	E121 I122 L146 H147	V49-E121 HydrophobicContact CB-CB 4.38Å; V49-E121 HydrophobicContact CG2-CB 4.43Å; V49-E121 HydrophobicContact CG2-CG 4.33Å; V49-I122 CarbonylContact C-O 3.46Å; V49-I122 WeakPolarHBondContact CA-O 3.37Å; V49-I122 WeakPolarHBondContact CB-O 3.41Å; V49-L146 CarbonylContact O-C 3.49Å; V49-L146 WeakPolarHBondContact O-CA 3.39Å; V49-H147 HydrophobicContact CG2-CB 4.06Å; V49-H147 PolarHBondContact O-N 2.61Å
50	C	89.9	Confident	79.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	178	166.8	67	0	0	0	0	110.6	E121 I122 R145	C50-E121 WeakPolarHBondContact O-CA 3.45Å; C50-I122 PolarHBondContact N-O 3.47Å; C50-I122 PolarHBondContact O-N 3.44Å; C50-R145 HydrophobicContact CB-CG 3.87Å
51	L	89.7	Confident	80.2	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.8	178.5	-74.3	-178.6	0	0	0	112.1	V115 Q120 E121 R145 H147 D285	L51-V115 HydrophobicContact CD1-CG1 3.55Å; L51-Q120 WeakPolarHBondContact CA-O 3.43Å; L51-E121 HydrophobicContact CD2-CB 4.44Å; L51-E121 HydrophobicContact CD2-CG 3.6Å; L51-R145 PolarHBondContact O-NH2 3.26Å; L51-H147 WeakPolarHBondContact CD1-CD2 3.42Å; L51-H147 HydrophobicContact CG-CB 4.48Å; L51-D285 PolarHBondContact N-OD2 3.04Å; L51-D285 VanDerWaalsContact O-OD2 3.11Å
52	E	84.6	Confident	80.1	Confident	55 Å²	55	52.3 Å²	52.3	26%	0.257	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.9	169.4	-60.3	-166.5	169.5	0	0	111	A54 T119 Q120 I122 N125 R145	E52-A54 PolarHBondContact O-N 2.86Å; E52-T119 CarbonylContact O-C 3.57Å; E52-T119 WeakPolarHBondContact O-CA 3.21Å; E52-T119 WeakPolarHBondContact O-CB 3.39Å; E52-Q120 PolarHBondContact N-O 2.86Å; E52-Q120 VanDerWaalsContact N-O 3.08Å; E52-Q120 PolarHBondContact O-N 3.38Å; E52-I122 HydrophobicContact CB-CD1 3.94Å; E52-I122 HydrophobicContact CG-CD1 4.03Å; E52-N125 PolarHBondContact OE1-ND2 2.81Å; E52-R145 IonicContact OE1-NH1 2.9Å; E52-R145 PolarHBondContact OE1-NH1 3.02Å; E52-R145 IonicContact OE1-NH2 3.48Å
53	C	86.7	Confident	79	Confident	5 Å²	5	60.1 Å²	60.1	3%	0.034	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	108.5	-172.9	-171.2	0	0	0	0	111	K55 C70 H77 W113 H118	C53-K55 PolarHBondContact SG-O 3.13Å; C53-K55 VanDerWaalsContact SG-O 3.4Å; C53-C70 HydrophobicContact CB-CB 4.03Å; C53-H77 PolarHBondContact O-ND1 2.84Å; C53-W113 PolarHBondContact SG-NE1 3.43Å; C53-H118 CarbonylContact C-O 3.54Å; C53-H118 PolarHBondContact SG-O 3.37Å
54	A	84.6	Confident	77.5	Confident	29 Å²	29	62.4 Å²	62.4	24%	0.24	31%	0.313	C	S	.	.			trans	-89.2	-11.3	-169.5	0	0	0	0	0	115.1	E52 V81 H118 Q120	E52-A54 PolarHBondContact O-N 2.86Å; A54-V81 WeakPolarHBondContact O-CG2 3.36Å; A54-H118 PolarHBondContact N-O 2.91Å; A54-Q120 HydrophobicContact CB-CB 3.88Å
55	K	81.8	Confident	76.4	Confident	47 Å²	47	66.9 Å²	66.9	20%	0.204	34%	0.337	C	S	.	.	S	Bend	trans	-136	137.8	175	-166.2	-178.8	-169.5	-171.1	0	111.1	C53 E111 H118	C53-K55 PolarHBondContact SG-O 3.13Å; C53-K55 VanDerWaalsContact SG-O 3.4Å; K55-E111 IonicContact NZ-OE1 2.68Å; K55-E111 PolarHBondContact NZ-OE1 2.91Å; K55-E111 IonicContact NZ-OE2 2.99Å; K55-E111 PolarHBondContact NZ-OE2 3.38Å; K55-H118 PolarHBondContact N-O 2.84Å
56	F	80.1	Confident	75.5	Confident	11 Å²	11	68.3 Å²	68.3	5%	0.048	35%	0.351	C	S	.	.			trans	-85.2	112.7	177.9	-164.8	-88.1	0	0	0	111.1	F58 C68 F74 H77 V81 A85	F56-F58 HydrophobicContact CD1-CD2 4.12Å; F56-F58 HydrophobicContact CD1-CE1 4.37Å; F56-F58 AromaticContact CD1-CE2 3.89Å; F56-F58 HydrophobicContact CD1-CE2 3.89Å; F56-F58 HydrophobicContact CD1-CG 4.43Å; F56-F58 HydrophobicContact CD1-CZ 4.01Å; F56-F58 AromaticContact CE1-CD1 3.78Å; F56-F58 HydrophobicContact CE1-CD1 3.78Å; F56-F58 HydrophobicContact CE1-CD2 4.12Å; F56-F58 AromaticContact CE1-CE1 3.66Å; F56-F58 HydrophobicContact CE1-CE1 3.66Å; F56-F58 AromaticContact CE1-CE2 3.99Å; F56-F58 HydrophobicContact CE1-CE2 3.99Å; F56-F58 HydrophobicContact CE1-CG 4.01Å; F56-F58 AromaticContact CE1-CZ 3.75Å; F56-F58 HydrophobicContact CE1-CZ 3.75Å; F56-C68 HydrophobicContact CD2-CB 3.76Å; F56-C68 HydrophobicContact CE2-CB 3.62Å; F56-C68 HydrophobicContact CG-CB 4.34Å; F56-C68 HydrophobicContact CZ-CB 4.11Å; F56-F74 HydrophobicContact CD2-CD2 4.44Å; F56-F74 HydrophobicContact CE2-CB 4.1Å; F56-F74 HydrophobicContact CE2-CD2 4.22Å; F56-F74 HydrophobicContact CZ-CB 4.23Å; F56-F74 HydrophobicContact CZ-CD2 4.39Å; F56-H77 AromaticContact CD2-CD2 3.49Å; F56-H77 VanDerWaalsContact CD2-CD2 3.49Å; F56-H77 WeakPolarHBondContact CD2-CD2 3.44Å; F56-H77 AromaticContact CD2-NE2 3.54Å; F56-H77 AromaticContact CE2-CD2 3.67Å; F56-H77 AromaticContact CE2-NE2 3.81Å; F56-V81 HydrophobicContact CB-CG1 4.04Å; F56-A85 HydrophobicContact CB-CB 3.8Å; F56-A85 HydrophobicContact CG-CB 4.21Å
57	V	78.8	Confident	74.9	Confident	14 Å²	14	63.7 Å²	63.7	9%	0.085	33%	0.332	C	S	.	.			trans	-121.6	104.7	179.5	-177.7	0	0	0	0	109.7	A59 C68 S69 W113 H118	V57-A59 PolarHBondContact O-N 2.65Å; V57-C68 PolarHBondContact N-SG 3.18Å; V57-C68 CarbonylContact O-C 3.46Å; V57-C68 WeakPolarHBondContact O-CA 3.36Å; V57-S69 WeakPolarHBondContact O-CB 3.32Å; V57-S69 PolarHBondContact O-N 3.25Å; V57-S69 PolarHBondContact O-OG 3.24Å; V57-W113 HydrophobicContact CB-CB 4.27Å; V57-W113 HydrophobicContact CG1-CB 4.29Å; V57-H118 WeakPolarHBondContact CG2-CD2 3.31Å
58	F	73.9	Confident	74.8	Confident	109 Å²	109	60.3 Å²	60.3	48%	0.478	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-49.3	127	-176.9	-67	-94.5	0	0	0	113.1	F56 R60 P66 S69	F56-F58 HydrophobicContact CD1-CD2 4.12Å; F56-F58 HydrophobicContact CD1-CE1 4.37Å; F56-F58 AromaticContact CD1-CE2 3.89Å; F56-F58 HydrophobicContact CD1-CE2 3.89Å; F56-F58 HydrophobicContact CD1-CG 4.43Å; F56-F58 HydrophobicContact CD1-CZ 4.01Å; F56-F58 AromaticContact CE1-CD1 3.78Å; F56-F58 HydrophobicContact CE1-CD1 3.78Å; F56-F58 HydrophobicContact CE1-CD2 4.12Å; F56-F58 AromaticContact CE1-CE1 3.66Å; F56-F58 HydrophobicContact CE1-CE1 3.66Å; F56-F58 AromaticContact CE1-CE2 3.99Å; F56-F58 HydrophobicContact CE1-CE2 3.99Å; F56-F58 HydrophobicContact CE1-CG 4.01Å; F56-F58 AromaticContact CE1-CZ 3.75Å; F56-F58 HydrophobicContact CE1-CZ 3.75Å; F58-R60 PolarHBondContact O-N 3.31Å; F58-P66 HydrophobicContact CD1-CB 4.31Å; F58-P66 HydrophobicContact CE1-CB 4.2Å; F58-S69 PolarHBondContact O-OG 2.79Å
59	A	70.8	Confident	74.2	Confident	29 Å²	29	61.5 Å²	61.5	24%	0.24	32%	0.323	C	S	.	.			trans	-74.1	121.9	-179.8	0	0	0	0	0	112.1	V57 H61 S62 C67 S69	V57-A59 PolarHBondContact O-N 2.65Å; A59-H61 PolarHBondContact O-N 2.8Å; A59-S62 PolarHBondContact O-N 2.99Å; A59-C67 WeakPolarHBondContact CB-O 3.49Å; A59-C67 PolarHBondContact N-O 3.37Å; A59-S69 WeakPolarHBondContact CA-OG 3.39Å
60	R	62.5	Low	73.7	Confident	147 Å²	147	59.4 Å²	59.4	56%	0.555	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-5.4	-176.6	-72.5	-168.5	-178.1	149.4	7.6	116.7	F58 N110 H112	F58-R60 PolarHBondContact O-N 3.31Å; R60-N110 PolarHBondContact NH2-OD1 3.47Å; R60-H112 VanDerWaalsContact CZ-NE2 3.34Å; R60-H112 PolarHBondContact NH1-CE1 2.91Å; R60-H112 PolarHBondContact NH1-NE2 3.3Å; R60-H112 PolarHBondContact NH2-CD2 3.33Å; R60-H112 PolarHBondContact NH2-NE2 3.08Å
61	H	60	Low	73.1	Confident	181 Å²	181	61 Å²	61	84%	0.838	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-4.9	-171.7	-65	-65.3	0	0	0	115.6	A59	A59-H61 PolarHBondContact O-N 2.8Å
62	S	55.9	Low	72.7	Confident	47 Å²	47	62.4 Å²	62.4	33%	0.329	33%	0.334	S	S	.	.			trans	-93.9	113.3	175.4	-171.9	0	0	0	0	111.3	A59 N65	A59-S62 PolarHBondContact O-N 2.99Å; S62-N65 VanDerWaalsContact CB-O 3.25Å; S62-N65 WeakPolarHBondContact CB-O 3.43Å; S62-N65 PolarHBondContact OG-N 3.3Å; S62-N65 PolarHBondContact OG-O 3.18Å
63	K	51.2	Low	72.4	Confident	217 Å²	217	61.6 Å²	61.6	94%	0.943	33%	0.333	S	S	*	.	S	Bend	trans	-93	-10.8	175.4	-71.9	-171.8	176.9	-176.6	0	114.1
64	S	55.5	Low	72	Confident	104 Å²	104	64 Å²	64	73%	0.727	34%	0.343	S	S	*	.	S	Bend	trans	-113.9	-32.1	-170.8	49.1	0	0	0	0	114.4
65	N	61.1	Low	71.6	Confident	108 Å²	108	67.1 Å²	67.1	58%	0.578	36%	0.363	S	S	*	.	S	Bend	trans	-136.8	124.8	177.1	-86.8	-24.3	0	0	0	110.2	S62 C67	S62-N65 VanDerWaalsContact CB-O 3.25Å; S62-N65 WeakPolarHBondContact CB-O 3.43Å; S62-N65 PolarHBondContact OG-N 3.3Å; S62-N65 PolarHBondContact OG-O 3.18Å; N65-C67 PolarHBondContact O-N 2.92Å
66	P	64.9	Low	71.4	Confident	82 Å²	82	69.7 Å²	69.7	53%	0.532	38%	0.376	S	S	.	.			trans	-71.9	91.7	177.9	29.4	-33.9	0	0	0	110.9	F58	F58-P66 HydrophobicContact CD1-CB 4.31Å; F58-P66 HydrophobicContact CE1-CB 4.2Å
67	C	73.6	Confident	71.5	Confident	28 Å²	28	69.4 Å²	69.4	19%	0.189	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-93.8	151.3	169.9	62.3	0	0	0	0	111.2	A59 N65 L72	A59-C67 WeakPolarHBondContact CB-O 3.49Å; A59-C67 PolarHBondContact N-O 3.37Å; N65-C67 PolarHBondContact O-N 2.92Å; C67-L72 CarbonylContact C-O 3.39Å; C67-L72 WeakPolarHBondContact CA-O 3.5Å; C67-L72 WeakPolarHBondContact CB-O 3.48Å
68	C	83.3	Confident	71.4	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.007	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-70.2	154.9	166.2	-177.5	0	0	0	0	109.9	F56 V57 C70 G71 L72 H77	F56-C68 HydrophobicContact CD2-CB 3.76Å; F56-C68 HydrophobicContact CE2-CB 3.62Å; F56-C68 HydrophobicContact CG-CB 4.34Å; F56-C68 HydrophobicContact CZ-CB 4.11Å; V57-C68 PolarHBondContact N-SG 3.18Å; V57-C68 CarbonylContact O-C 3.46Å; V57-C68 WeakPolarHBondContact O-CA 3.36Å; C68-C70 VanDerWaalsContact CB-SG 3.56Å; C68-C70 PolarHBondContact O-N 3.49Å; C68-C70 VanDerWaalsContact O-N 3.15Å; C68-G71 PolarHBondContact O-N 3.27Å; C68-L72 PolarHBondContact N-O 3.44Å; C68-H77 WeakPolarHBondContact CB-NE2 3.17Å
69	S	78.6	Confident	71.6	Confident	28 Å²	28	69.8 Å²	69.8	20%	0.196	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-11.8	175.6	-63.9	0	0	0	0	113.5	V57 F58 A59 G71 K291	V57-S69 WeakPolarHBondContact O-CB 3.32Å; V57-S69 PolarHBondContact O-N 3.25Å; V57-S69 PolarHBondContact O-OG 3.24Å; F58-S69 PolarHBondContact O-OG 2.79Å; A59-S69 WeakPolarHBondContact CA-OG 3.39Å; S69-G71 VanDerWaalsContact C-N 3.29Å; S69-K291 PolarHBondContact O-NZ 2.65Å
70	C	80.9	Confident	72	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-24	165.2	66.4	0	0	0	0	112.9	C53 C68 L72 W113 G287 T288 S289	C53-C70 HydrophobicContact CB-CB 4.03Å; C68-C70 VanDerWaalsContact CB-SG 3.56Å; C68-C70 PolarHBondContact O-N 3.49Å; C68-C70 VanDerWaalsContact O-N 3.15Å; C70-L72 PolarHBondContact SG-N 3.11Å; C70-W113 HydrophobicContact CB-CZ2 3.69Å; C70-G287 WeakPolarHBondContact CB-O 3.32Å; C70-T288 CarbonylContact O-C 3.55Å; C70-T288 WeakPolarHBondContact O-CA 3.34Å; C70-T288 VanDerWaalsContact O-CB 3.22Å; C70-T288 WeakPolarHBondContact O-CB 3.32Å; C70-S289 PolarHBondContact O-N 3.06Å
71	G	77	Confident	72.7	Confident	35 Å²	35	65.9 Å²	65.9	36%	0.361	38%	0.376	S	S	.	.	S	Bend	trans	110.2	-9	-177.5	0	0	0	0	0	114.8	C68 S69	C68-G71 PolarHBondContact O-N 3.27Å; S69-G71 VanDerWaalsContact C-N 3.29Å
72	L	80.5	Confident	73.7	Confident	34 Å²	34	59.9 Å²	59.9	18%	0.178	35%	0.348	C	S	.	.			trans	-81.7	148.3	177.2	-60	177.3	0	0	0	112	C67 C68 C70 E76	C67-L72 CarbonylContact C-O 3.39Å; C67-L72 WeakPolarHBondContact CA-O 3.5Å; C67-L72 WeakPolarHBondContact CB-O 3.48Å; C68-L72 PolarHBondContact N-O 3.44Å; C70-L72 PolarHBondContact SG-N 3.11Å; L72-E76 VanDerWaalsContact CA-OE2 3.3Å; L72-E76 WeakPolarHBondContact CA-OE2 3.44Å; L72-E76 HydrophobicContact CB-CB 3.99Å; L72-E76 HydrophobicContact CD2-CB 4.22Å
73	T	79.6	Confident	74.6	Confident	38 Å²	38	62.7 Å²	62.7	23%	0.233	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-74.7	161.8	167.7	71.3	0	0	0	0	111.4	S75 E76 H77	T73-S75 PolarHBondContact O-N 3.15Å; T73-S75 PolarHBondContact OG1-OG 3.48Å; T73-E76 WeakPolarHBondContact CB-OE1 3.43Å; T73-E76 WeakPolarHBondContact CG2-OE1 3.44Å; T73-E76 PolarHBondContact N-OE2 2.55Å; T73-E76 PolarHBondContact O-N 3.45Å; T73-E76 WeakPolarHBondContact OG1-CG 3.49Å; T73-E76 PolarHBondContact OG1-OE1 3.37Å; T73-H77 PolarHBondContact O-CD2 2.85Å
74	F	76.9	Confident	75.6	Confident	55 Å²	55	56.3 Å²	56.3	24%	0.241	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-50.5	-41.3	176.2	179.4	-87.5	0	0	0	113.1	F56 E76 H77 Q82 A85 L86	F56-F74 HydrophobicContact CD2-CD2 4.44Å; F56-F74 HydrophobicContact CE2-CB 4.1Å; F56-F74 HydrophobicContact CE2-CD2 4.22Å; F56-F74 HydrophobicContact CZ-CB 4.23Å; F56-F74 HydrophobicContact CZ-CD2 4.39Å; F74-E76 VanDerWaalsContact C-N 3.31Å; F74-E76 PolarHBondContact O-N 2.88Å; F74-H77 PolarHBondContact O-N 2.86Å; F74-Q82 HydrophobicContact CE1-CB 4.2Å; F74-Q82 HydrophobicContact CE1-CG 4.18Å; F74-Q82 HydrophobicContact CE2-CB 4.48Å; F74-Q82 HydrophobicContact CZ-CB 3.81Å; F74-Q82 HydrophobicContact CZ-CG 4.18Å; F74-A85 HydrophobicContact CE2-CB 3.88Å; F74-L86 HydrophobicContact CE2-CG 4.41Å; F74-L86 HydrophobicContact CZ-CD1 3.95Å; F74-L86 HydrophobicContact CZ-CD2 4.36Å; F74-L86 HydrophobicContact CZ-CG 3.79Å
75	S	77.7	Confident	76.1	Confident	94 Å²	94	51.6 Å²	51.6	66%	0.657	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-69.2	-19.6	178.2	29.7	0	0	0	0	115.2	T73 Q82	T73-S75 PolarHBondContact O-N 3.15Å; T73-S75 PolarHBondContact OG1-OG 3.48Å; S75-Q82 PolarHBondContact O-NE2 2.88Å
76	E	76.9	Confident	76.5	Confident	102 Å²	102	50 Å²	50	48%	0.477	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-91.1	-9.4	-179.1	-73.6	149.4	-137.2	0	0	113.3	L72 T73 F74	L72-E76 VanDerWaalsContact CA-OE2 3.3Å; L72-E76 WeakPolarHBondContact CA-OE2 3.44Å; L72-E76 HydrophobicContact CB-CB 3.99Å; L72-E76 HydrophobicContact CD2-CB 4.22Å; T73-E76 WeakPolarHBondContact CB-OE1 3.43Å; T73-E76 WeakPolarHBondContact CG2-OE1 3.44Å; T73-E76 PolarHBondContact N-OE2 2.55Å; T73-E76 PolarHBondContact O-N 3.45Å; T73-E76 WeakPolarHBondContact OG1-CG 3.49Å; T73-E76 PolarHBondContact OG1-OE1 3.37Å; F74-E76 VanDerWaalsContact C-N 3.31Å; F74-E76 PolarHBondContact O-N 2.88Å
77	H	81.6	Confident	76.5	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.023	29%	0.285	C	S	.	.	S	Bend	trans	-76.3	149.5	173.8	-83.4	-88.4	0	0	0	111.9	C53 F56 C68 T73 F74 V81 Q82	C53-H77 PolarHBondContact O-ND1 2.84Å; F56-H77 AromaticContact CD2-CD2 3.49Å; F56-H77 VanDerWaalsContact CD2-CD2 3.49Å; F56-H77 WeakPolarHBondContact CD2-CD2 3.44Å; F56-H77 AromaticContact CD2-NE2 3.54Å; F56-H77 AromaticContact CE2-CD2 3.67Å; F56-H77 AromaticContact CE2-NE2 3.81Å; C68-H77 WeakPolarHBondContact CB-NE2 3.17Å; T73-H77 PolarHBondContact O-CD2 2.85Å; F74-H77 PolarHBondContact O-N 2.86Å; H77-V81 HydrophobicContact CB-CB 4.2Å; H77-V81 HydrophobicContact CB-CG1 4.24Å; H77-Q82 HydrophobicContact CB-CG 4.27Å; H77-Q82 PolarHBondContact O-NE2 3.4Å
78	P	76.1	Confident	75.9	Confident	49 Å²	49	50.8 Å²	50.8	32%	0.318	29%	0.29	S	S	.	.			trans	-64.8	153.8	173.2	27.9	-34.1	0	0	0	111.6	N80 V81 Q82	P78-N80 VanDerWaalsContact C-N 3.26Å; P78-N80 WeakPolarHBondContact CB-OD1 3.47Å; P78-N80 WeakPolarHBondContact CG-OD1 3.44Å; P78-N80 PolarHBondContact O-N 3.34Å; P78-N80 VanDerWaalsContact O-N 3.12Å; P78-N80 PolarHBondContact O-OD1 3.08Å; P78-V81 HydrophobicContact CG-CG2 4.08Å; P78-V81 PolarHBondContact O-N 3.26Å; P78-Q82 PolarHBondContact O-N 2.85Å; P78-Q82 VanDerWaalsContact O-N 3.16Å
79	S	79	Confident	74.8	Confident	82 Å²	82	55.1 Å²	55.1	57%	0.573	31%	0.31	S	S	*	.	H	α-helix	trans	-59.7	-31.1	-164.6	-36.6	0	0	0	0	114.4	V81 Q82 I83	S79-V81 VanDerWaalsContact C-N 3.35Å; S79-Q82 PolarHBondContact O-N 3.16Å; S79-I83 WeakPolarHBondContact O-CB 3.4Å; S79-I83 WeakPolarHBondContact O-CD1 3.45Å; S79-I83 WeakPolarHBondContact O-CG1 3.42Å; S79-I83 PolarHBondContact O-N 2.7Å
80	N	78.3	Confident	73.5	Confident	94 Å²	94	59 Å²	59	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-58.5	-44.8	173	56.5	-31.5	0	0	0	111.9	P78 I83 E84	P78-N80 VanDerWaalsContact C-N 3.26Å; P78-N80 WeakPolarHBondContact CB-OD1 3.47Å; P78-N80 WeakPolarHBondContact CG-OD1 3.44Å; P78-N80 PolarHBondContact O-N 3.34Å; P78-N80 VanDerWaalsContact O-N 3.12Å; P78-N80 PolarHBondContact O-OD1 3.08Å; N80-I83 PolarHBondContact O-N 3.46Å; N80-E84 PolarHBondContact O-N 3.05Å
81	V	79.1	Confident	72	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-75.3	-34.4	-178.8	-176.1	0	0	0	0	111.2	A54 F56 H77 P78 S79 A85	A54-V81 WeakPolarHBondContact O-CG2 3.36Å; F56-V81 HydrophobicContact CB-CG1 4.04Å; H77-V81 HydrophobicContact CB-CB 4.2Å; H77-V81 HydrophobicContact CB-CG1 4.24Å; P78-V81 HydrophobicContact CG-CG2 4.08Å; P78-V81 PolarHBondContact O-N 3.26Å; S79-V81 VanDerWaalsContact C-N 3.35Å; V81-A85 VanDerWaalsContact O-CB 3.25Å; V81-A85 WeakPolarHBondContact O-CB 3.42Å; V81-A85 PolarHBondContact O-N 3.18Å
82	Q	79.8	Confident	70.5	Confident	54 Å²	54	70.1 Å²	70.1	25%	0.252	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-46.1	169.7	-62.7	-172.9	16.5	0	0	111.4	F74 S75 H77 P78 S79 A85 L86	F74-Q82 HydrophobicContact CE1-CB 4.2Å; F74-Q82 HydrophobicContact CE1-CG 4.18Å; F74-Q82 HydrophobicContact CE2-CB 4.48Å; F74-Q82 HydrophobicContact CZ-CB 3.81Å; F74-Q82 HydrophobicContact CZ-CG 4.18Å; S75-Q82 PolarHBondContact O-NE2 2.88Å; H77-Q82 HydrophobicContact CB-CG 4.27Å; H77-Q82 PolarHBondContact O-NE2 3.4Å; P78-Q82 PolarHBondContact O-N 2.85Å; P78-Q82 VanDerWaalsContact O-N 3.16Å; S79-Q82 PolarHBondContact O-N 3.16Å; Q82-A85 PolarHBondContact O-N 2.68Å; Q82-L86 WeakPolarHBondContact O-CB 3.31Å; Q82-L86 WeakPolarHBondContact O-CG 3.46Å; Q82-L86 PolarHBondContact O-N 3.19Å
83	I	75.7	Confident	68.4	Low	106 Å²	106	75.1 Å²	75.1	54%	0.544	41%	0.405	S	S	.	.	H	α-helix	trans	-65.5	-43.3	178.4	-70.4	163.8	0	0	0	111.1	S79 N80 L86 T87	S79-I83 WeakPolarHBondContact O-CB 3.4Å; S79-I83 WeakPolarHBondContact O-CD1 3.45Å; S79-I83 WeakPolarHBondContact O-CG1 3.42Å; S79-I83 PolarHBondContact O-N 2.7Å; N80-I83 PolarHBondContact O-N 3.46Å; I83-L86 PolarHBondContact O-N 3.45Å; I83-T87 WeakPolarHBondContact O-CB 3.4Å; I83-T87 PolarHBondContact O-N 2.95Å; I83-T87 PolarHBondContact O-OG1 3.23Å
84	E	71.4	Confident	66.3	Low	83 Å²	83	82.4 Å²	82.4	39%	0.388	44%	0.436	S	S	.	.	H	α-helix	trans	-61.7	-46.2	177	-163.8	-167.8	144	0	0	111	N80 T87 Q88	N80-E84 PolarHBondContact O-N 3.05Å; E84-T87 WeakPolarHBondContact O-CB 3.33Å; E84-T87 PolarHBondContact O-N 2.67Å; E84-T87 VanDerWaalsContact O-N 3.16Å; E84-Q88 WeakPolarHBondContact O-CG 3.34Å; E84-Q88 PolarHBondContact O-N 2.8Å; E84-Q88 PolarHBondContact OE1-NE2 2.92Å
85	A	67.2	Low	64.3	Low	6 Å²	6	85.5 Å²	85.5	5%	0.05	46%	0.462	C	S	.	.	H	α-helix	trans	-63.7	-41.2	177.4	0	0	0	0	0	112.8	F56 F74 V81 Q82 T87 Q88 Q89	F56-A85 HydrophobicContact CB-CB 3.8Å; F56-A85 HydrophobicContact CG-CB 4.21Å; F74-A85 HydrophobicContact CE2-CB 3.88Å; V81-A85 VanDerWaalsContact O-CB 3.25Å; V81-A85 WeakPolarHBondContact O-CB 3.42Å; V81-A85 PolarHBondContact O-N 3.18Å; Q82-A85 PolarHBondContact O-N 2.68Å; A85-T87 VanDerWaalsContact C-N 3.31Å; A85-T87 PolarHBondContact O-N 3.35Å; A85-Q88 PolarHBondContact O-N 3.44Å; A85-Q89 WeakPolarHBondContact O-CG 3.48Å; A85-Q89 PolarHBondContact O-N 3.04Å
86	L	68	Low	62.2	Low	73 Å²	73	89.3 Å²	89.3	38%	0.382	48%	0.475	S	S	.	.	H	α-helix	trans	-64.3	-35.2	172.4	-77.9	163.1	0	0	0	112.2	F74 Q82 I83 Q89 N90	F74-L86 HydrophobicContact CE2-CG 4.41Å; F74-L86 HydrophobicContact CZ-CD1 3.95Å; F74-L86 HydrophobicContact CZ-CD2 4.36Å; F74-L86 HydrophobicContact CZ-CG 3.79Å; Q82-L86 WeakPolarHBondContact O-CB 3.31Å; Q82-L86 WeakPolarHBondContact O-CG 3.46Å; Q82-L86 PolarHBondContact O-N 3.19Å; I83-L86 PolarHBondContact O-N 3.45Å; L86-Q89 PolarHBondContact O-N 2.87Å; L86-N90 WeakPolarHBondContact O-CB 3.31Å; L86-N90 PolarHBondContact O-N 2.94Å; L86-N90 PolarHBondContact O-ND2 2.82Å
87	T	64.9	Low	60.2	Low	68 Å²	68	92 Å²	92	42%	0.417	49%	0.491	S	S	.	.	H	α-helix	trans	-69	-42.7	176.4	-54.9	0	0	0	0	110.4	I83 E84 A85 Q89 N90 L91	I83-T87 WeakPolarHBondContact O-CB 3.4Å; I83-T87 PolarHBondContact O-N 2.95Å; I83-T87 PolarHBondContact O-OG1 3.23Å; E84-T87 WeakPolarHBondContact O-CB 3.33Å; E84-T87 PolarHBondContact O-N 2.67Å; E84-T87 VanDerWaalsContact O-N 3.16Å; A85-T87 VanDerWaalsContact C-N 3.31Å; A85-T87 PolarHBondContact O-N 3.35Å; T87-Q89 VanDerWaalsContact C-N 3.31Å; T87-Q89 PolarHBondContact O-N 2.77Å; T87-N90 PolarHBondContact O-N 3.35Å; T87-L91 HydrophobicContact CG2-CD1 3.93Å; T87-L91 HydrophobicContact CG2-CG 4.45Å; T87-L91 WeakPolarHBondContact O-CB 3.27Å; T87-L91 WeakPolarHBondContact O-CG 3.3Å; T87-L91 PolarHBondContact O-N 3.16Å
88	Q	62.1	Low	58	Low	60 Å²	60	96.8 Å²	96.8	28%	0.28	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-31.7	173.2	-69.3	176.1	21.3	0	0	112.7	E84 A85 N92	E84-Q88 WeakPolarHBondContact O-CG 3.34Å; E84-Q88 PolarHBondContact O-N 2.8Å; E84-Q88 PolarHBondContact OE1-NE2 2.92Å; A85-Q88 PolarHBondContact O-N 3.44Å; Q88-N92 PolarHBondContact O-ND2 3.31Å
89	Q	58.8	Low	56	Low	92 Å²	92	101 Å²	101	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-71.6	-49.8	171.7	-76.2	-179.4	-30	0	0	112.3	A85 L86 T87 L91 N92	A85-Q89 WeakPolarHBondContact O-CG 3.48Å; A85-Q89 PolarHBondContact O-N 3.04Å; L86-Q89 PolarHBondContact O-N 2.87Å; T87-Q89 VanDerWaalsContact C-N 3.31Å; T87-Q89 PolarHBondContact O-N 2.77Å; Q89-L91 VanDerWaalsContact C-N 3.35Å; Q89-L91 PolarHBondContact O-N 3.05Å; Q89-N92 PolarHBondContact O-N 2.75Å
90	N	51.7	Low	53.7	Low	109 Å²	109	103.9 Å²	103.9	58%	0.583	56%	0.559	S	S	*	*	H	α-helix	trans	-69.2	-27.8	-174.6	-73.8	-47.8	0	0	0	113.8	L86 T87 N92	L86-N90 WeakPolarHBondContact O-CB 3.31Å; L86-N90 PolarHBondContact O-N 2.94Å; L86-N90 PolarHBondContact O-ND2 2.82Å; T87-N90 PolarHBondContact O-N 3.35Å; N90-N92 PolarHBondContact O-N 2.82Å
91	L	50.6	Low	51.5	Low	140 Å²	140	101.8 Å²	101.8	73%	0.733	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-7.4	175.9	-77	168.6	0	0	0	114.5	T87 Q89	T87-L91 HydrophobicContact CG2-CD1 3.93Å; T87-L91 HydrophobicContact CG2-CG 4.45Å; T87-L91 WeakPolarHBondContact O-CB 3.27Å; T87-L91 WeakPolarHBondContact O-CG 3.3Å; T87-L91 PolarHBondContact O-N 3.16Å; Q89-L91 VanDerWaalsContact C-N 3.35Å; Q89-L91 PolarHBondContact O-N 3.05Å
92	N	45.6	Very low	49.2	Very low	129 Å²	129	110.1 Å²	110.1	69%	0.69	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	15.3	180	-78	-74.9	0	0	0	114	Q88 Q89 N90	Q88-N92 PolarHBondContact O-ND2 3.31Å; Q89-N92 PolarHBondContact O-N 2.75Å; N90-N92 PolarHBondContact O-N 2.82Å
93	L	35.3	Very low	46.8	Very low	139 Å²	139	116.9 Å²	116.9	73%	0.728	63%	0.629	S	S	*	*			trans	-124.1	83.8	-174.8	-81.2	150.3	0	0	0	112.7
94	Q	36	Very low	44.9	Very low	190 Å²	190	120.2 Å²	120.2	89%	0.888	64%	0.642	S	S	*	*			trans	-139.6	125.9	164.5	-129	176.6	9.7	0	0	109.9
95	P	33.9	Very low	43	Very low	121 Å²	121	123.5 Å²	123.5	79%	0.786	66%	0.661	S	S	*	*			trans	-99.2	122.1	-173.7	34.8	-30.6	0	0	0	112.9
96	D	35.2	Very low	41.1	Very low	173 Å²	173	132.2 Å²	132.2	93%	0.925	70%	0.698	S	S	*	*			trans	-115.2	153.5	168.3	-107.3	-41	0	0	0	111.4
97	I	34.5	Very low	39.8	Very low	158 Å²	158	134 Å²	134	81%	0.81	71%	0.714	S	S	*	*			trans	-112.4	115.5	-156.2	-57.3	169.5	0	0	0	112.3
98	S	35.4	Very low	38.3	Very low	106 Å²	106	136.5 Å²	136.5	74%	0.741	73%	0.73	S	S	*	*			trans	171.2	147	132.1	44.9	0	0	0	0	115.8
99	N	33.1	Very low	37.5	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	74%	0.744	S	S	*	*			trans	48.8	95.7	149.3	-61.8	-2.4	0	0	0	121.7
100	T	31.9	Very low	37.1	Very low	143 Å²	143	140.7 Å²	140.7	88%	0.877	76%	0.757	S	S	*	*				40	101	126.6	58.8	0	0	0	0	119.2
101	G	31.6	Very low	37.7	Very low	50 Å²	50	139.7 Å²	139.7	52%	0.515	75%	0.748	S	S	.	*			trans	171.6	155.1	165.7	0	0	0	0	0	109.8	Y103	G101-Y103 WeakPolarHBondContact O-CD2 3.49Å; G101-Y103 PolarHBondContact O-N 3.17Å
102	D	30.2	Very low	38.5	Very low	176 Å²	176	138 Å²	138	94%	0.941	74%	0.737	S	S	*	*			trans	-71.8	72.2	-177	-73	-60.9	0	0	0	113	H104	D102-H104 PolarHBondContact O-N 3.45Å; D102-H104 VanDerWaalsContact O-N 3.12Å
103	Y	30.1	Very low	40	Very low	196 Å²	196	133.4 Å²	133.4	77%	0.769	71%	0.71	S	S	*	*			trans	-85.7	85.3	176.9	-70.8	-67.9	0	0	0	111.4	G101 L105	G101-Y103 WeakPolarHBondContact O-CD2 3.49Å; G101-Y103 PolarHBondContact O-N 3.17Å; Y103-L105 PolarHBondContact O-N 2.96Å
104	H	35.3	Very low	42.1	Very low	175 Å²	175	132.3 Å²	132.3	81%	0.81	70%	0.7	S	S	*	*			trans	-54.4	101.3	166	-158.6	-50.6	0	0	0	109.7	D102 K106	D102-H104 PolarHBondContact O-N 3.45Å; D102-H104 VanDerWaalsContact O-N 3.12Å; H104-K106 PolarHBondContact O-N 3.47Å
105	L	31.1	Very low	44.2	Very low	152 Å²	152	125.4 Å²	125.4	80%	0.796	67%	0.671	S	S	*	*			trans	-53.9	127.5	171.2	-88.8	79.3	0	0	0	108.1	Y103 P107	Y103-L105 PolarHBondContact O-N 2.96Å; L105-P107 VanDerWaalsContact O-CD 3.23Å; L105-P107 WeakPolarHBondContact O-CD 3.49Å
106	K	28.8	Very low	46.5	Very low	189 Å²	189	126.7 Å²	126.7	82%	0.822	66%	0.664	S	S	*	*			trans	-81	111.7	166.8	-75.5	-179	177.4	175.6	0	107.3	H104 T108	H104-K106 PolarHBondContact O-N 3.47Å; K106-T108 PolarHBondContact O-N 3.27Å
107	P	38.8	Very low	48.8	Very low	110 Å²	110	123.3 Å²	123.3	71%	0.714	65%	0.65	S	S	*	*			trans	-66.2	109.2	168	27.9	-32.6	0	0	0	108.2	L105 N109	L105-P107 VanDerWaalsContact O-CD 3.23Å; L105-P107 WeakPolarHBondContact O-CD 3.49Å; P107-N109 PolarHBondContact O-N 3.02Å
108	T	33.6	Very low	51.3	Low	122 Å²	122	116.2 Å²	116.2	75%	0.748	61%	0.614	S	S	*	*	S	Bend	trans	-73.3	69.4	168.4	48.2	0	0	0	0	109.5	K106	K106-T108 PolarHBondContact O-N 3.27Å
109	N	45.3	Very low	53.7	Low	108 Å²	108	112.3 Å²	112.3	58%	0.578	59%	0.585	S	S	*	*			trans	-168.8	108.7	166.3	-95.1	-25.2	0	0	0	108.9	P107	P107-N109 PolarHBondContact O-N 3.02Å
110	N	51.4	Low	56.3	Low	131 Å²	131	110.8 Å²	110.8	70%	0.701	57%	0.574	S	S	*	*			trans	-129	30.5	173.9	-155.4	15	0	0	0	111.5	R60	R60-N110 PolarHBondContact NH2-OD1 3.47Å
111	E	63.1	Low	59	Low	88 Å²	88	109.2 Å²	109.2	41%	0.411	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-65.5	133.6	177.8	-63.1	-178	145.5	0	0	110.8	K55	K55-E111 IonicContact NZ-OE1 2.68Å; K55-E111 PolarHBondContact NZ-OE1 2.91Å; K55-E111 IonicContact NZ-OE2 2.99Å; K55-E111 PolarHBondContact NZ-OE2 3.38Å
112	H	68.6	Low	61.7	Low	105 Å²	105	109.2 Å²	109.2	49%	0.486	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-93.5	133.5	168	-90.3	-95.1	0	0	0	109.4	R60 H114 H118	R60-H112 VanDerWaalsContact CZ-NE2 3.34Å; R60-H112 PolarHBondContact NH1-CE1 2.91Å; R60-H112 PolarHBondContact NH1-NE2 3.3Å; R60-H112 PolarHBondContact NH2-CD2 3.33Å; R60-H112 PolarHBondContact NH2-NE2 3.08Å; H112-H114 PolarHBondContact O-CD2 3.48Å; H112-H114 PolarHBondContact O-N 3.06Å; H112-H118 PolarHBondContact O-CE1 3.06Å
113	W	76.3	Confident	64.5	Low	33 Å²	33	104.7 Å²	104.7	13%	0.125	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-67.5	126.3	174.6	-170.9	98.1	0	0	0	110.7	C53 V57 C70 V115 H118 T119 T288	C53-W113 PolarHBondContact SG-NE1 3.43Å; V57-W113 HydrophobicContact CB-CB 4.27Å; V57-W113 HydrophobicContact CG1-CB 4.29Å; C70-W113 HydrophobicContact CB-CZ2 3.69Å; W113-V115 HydrophobicContact CH2-CB 4.42Å; W113-V115 HydrophobicContact CH2-CG2 3.83Å; W113-V115 HydrophobicContact CZ3-CG2 3.74Å; W113-H118 AromaticContact CD1-CG 3.91Å; W113-H118 HydrophobicContact CD2-CB 4.43Å; W113-H118 HydrophobicContact CG-CB 4.2Å; W113-T119 HydrophobicContact CH2-CG2 3.94Å; W113-T119 HydrophobicContact CZ2-CG2 3.55Å; W113-T288 HydrophobicContact CE3-CG2 4.47Å; W113-T288 HydrophobicContact CH2-CG2 3.26Å; W113-T288 HydrophobicContact CZ2-CG2 4.1Å; W113-T288 HydrophobicContact CZ3-CG2 3.48Å; W113-T288 VanDerWaalsContact CZ3-CG2 3.48Å
114	H	79.1	Confident	67.3	Low	115 Å²	115	95.5 Å²	95.5	53%	0.532	49%	0.488	S	S	.	.			trans	-138.4	134.3	178.6	-65.7	-72.1	0	0	0	108.4	H112 K116 T117 H118	H112-H114 PolarHBondContact O-CD2 3.48Å; H112-H114 PolarHBondContact O-N 3.06Å; H114-K116 PolarHBondContact O-N 2.85Å; H114-T117 PolarHBondContact O-N 3.21Å; H114-T117 VanDerWaalsContact O-N 3.17Å; H114-H118 PolarHBondContact N-ND1 3.37Å; H114-H118 WeakPolarHBondContact O-CB 3.47Å; H114-H118 PolarHBondContact O-N 3.13Å; H114-H118 PolarHBondContact O-ND1 3.26Å
115	V	80.5	Confident	69.8	Low	45 Å²	45	89.2 Å²	89.2	27%	0.273	46%	0.461	S	S	.	.	H	α-helix	trans	-45.2	-61.7	-180	-173.4	0	0	0	0	110.8	L51 W113 T117 H118 T119	L51-V115 HydrophobicContact CD1-CG1 3.55Å; W113-V115 HydrophobicContact CH2-CB 4.42Å; W113-V115 HydrophobicContact CH2-CG2 3.83Å; W113-V115 HydrophobicContact CZ3-CG2 3.74Å; V115-T117 PolarHBondContact O-N 2.82Å; V115-H118 PolarHBondContact O-N 2.99Å; V115-H118 VanDerWaalsContact O-N 3.13Å; V115-T119 HydrophobicContact CG1-CG2 4.25Å; V115-T119 WeakPolarHBondContact CG1-OG1 3.21Å; V115-T119 PolarHBondContact O-N 3Å; V115-T119 PolarHBondContact O-OG1 2.73Å
116	K	82.7	Confident	72.6	Confident	148 Å²	148	82 Å²	82	64%	0.643	42%	0.423	S	S	*	.	H	α-helix	trans	-58.1	-10.1	-174.4	-60.9	-176.7	-174.7	-72.9	0	116.7	H114 E149	H114-K116 PolarHBondContact O-N 2.85Å; K116-E149 WeakPolarHBondContact CE-OE1 3.11Å; K116-E149 IonicContact NZ-OE1 2.69Å; K116-E149 PolarHBondContact NZ-OE1 3.33Å; K116-E149 IonicContact NZ-OE2 3.86Å; K116-E149 PolarHBondContact NZ-OE2 2.98Å
117	T	83.4	Confident	75.6	Confident	102 Å²	102	73.2 Å²	73.2	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-130.6	-2.1	179.2	63.5	0	0	0	0	114.3	H114 V115	H114-T117 PolarHBondContact O-N 3.21Å; H114-T117 VanDerWaalsContact O-N 3.17Å; V115-T117 PolarHBondContact O-N 2.82Å
118	H	86.4	Confident	78	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.046	35%	0.354	C	S	.	.	H	α-helix	trans	-130.9	-1.9	-178.2	-56.6	84.2	0	0	0	113.4	C53 A54 K55 V57 H112 W113 H114 V115	C53-H118 CarbonylContact C-O 3.54Å; C53-H118 PolarHBondContact SG-O 3.37Å; A54-H118 PolarHBondContact N-O 2.91Å; K55-H118 PolarHBondContact N-O 2.84Å; V57-H118 WeakPolarHBondContact CG2-CD2 3.31Å; H112-H118 PolarHBondContact O-CE1 3.06Å; W113-H118 AromaticContact CD1-CG 3.91Å; W113-H118 HydrophobicContact CD2-CB 4.43Å; W113-H118 HydrophobicContact CG-CB 4.2Å; H114-H118 PolarHBondContact N-ND1 3.37Å; H114-H118 WeakPolarHBondContact O-CB 3.47Å; H114-H118 PolarHBondContact O-N 3.13Å; H114-H118 PolarHBondContact O-ND1 3.26Å; V115-H118 PolarHBondContact O-N 2.99Å; V115-H118 VanDerWaalsContact O-N 3.13Å
119	T	86.8	Confident	80.8	Confident	23 Å²	23	64.1 Å²	64.1	14%	0.141	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	152.8	169.4	63.7	0	0	0	0	111.2	E52 W113 V115	E52-T119 CarbonylContact O-C 3.57Å; E52-T119 WeakPolarHBondContact O-CA 3.21Å; E52-T119 WeakPolarHBondContact O-CB 3.39Å; W113-T119 HydrophobicContact CH2-CG2 3.94Å; W113-T119 HydrophobicContact CZ2-CG2 3.55Å; V115-T119 HydrophobicContact CG1-CG2 4.25Å; V115-T119 WeakPolarHBondContact CG1-OG1 3.21Å; V115-T119 PolarHBondContact O-N 3Å; V115-T119 PolarHBondContact O-OG1 2.73Å
120	Q	88.2	Confident	82.9	Confident	106 Å²	106	59 Å²	59	50%	0.495	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	139.7	174.2	176.7	173.8	-0.3	0	0	109.7	L51 E52 A54 I122	L51-Q120 WeakPolarHBondContact CA-O 3.43Å; E52-Q120 PolarHBondContact N-O 2.86Å; E52-Q120 VanDerWaalsContact N-O 3.08Å; E52-Q120 PolarHBondContact O-N 3.38Å; A54-Q120 HydrophobicContact CB-CB 3.88Å; Q120-I122 HydrophobicContact CG-CG1 4.31Å
121	E	88.1	Confident	84.7	Confident	109 Å²	109	54.2 Å²	54.2	51%	0.509	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.3	170.1	-70	-174.6	143.9	0	0	110.7	V49 C50 L51 H147	V49-E121 HydrophobicContact CB-CB 4.38Å; V49-E121 HydrophobicContact CG2-CB 4.43Å; V49-E121 HydrophobicContact CG2-CG 4.33Å; C50-E121 WeakPolarHBondContact O-CA 3.45Å; L51-E121 HydrophobicContact CD2-CB 4.44Å; L51-E121 HydrophobicContact CD2-CG 3.6Å; E121-H147 IonicContact OE1-CE1 3.18Å; E121-H147 PolarHBondContact OE1-CE1 3.32Å; E121-H147 VanDerWaalsContact OE1-CE1 3.25Å; E121-H147 IonicContact OE1-CG 2.75Å; E121-H147 IonicContact OE1-ND1 2.66Å; E121-H147 PolarHBondContact OE1-ND1 2.92Å
122	I	87.8	Confident	85.8	Confident	50 Å²	50	50.3 Å²	50.3	26%	0.256	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145	-178.1	-58.1	-176.9	0	0	0	107.6	V49 C50 E52 Q120	V49-I122 CarbonylContact C-O 3.46Å; V49-I122 WeakPolarHBondContact CA-O 3.37Å; V49-I122 WeakPolarHBondContact CB-O 3.41Å; C50-I122 PolarHBondContact N-O 3.47Å; C50-I122 PolarHBondContact O-N 3.44Å; E52-I122 HydrophobicContact CB-CD1 3.94Å; E52-I122 HydrophobicContact CG-CD1 4.03Å; Q120-I122 HydrophobicContact CG-CG1 4.31Å
123	P	88.1	Confident	86.4	Confident	81 Å²	81	48.2 Å²	48.2	53%	0.526	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	141.3	172.5	-26.6	35.8	0	0	0	112.1	N125	P123-N125 PolarHBondContact O-N 3.44Å
124	T	89.1	Confident	86	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.018	28%	0.281	C	S	.	.			trans	-64.3	131.1	-172.1	-170.4	0	0	0	0	113.1	I44 I48 Y127 V144 R145	I44-T124 HydrophobicContact CG2-CG2 3.64Å; I48-T124 HydrophobicContact CB-CG2 3.97Å; I48-T124 HydrophobicContact CG2-CG2 3.9Å; I48-T124 WeakPolarHBondContact O-CB 3.28Å; I48-T124 WeakPolarHBondContact O-CG2 3.5Å; I48-T124 PolarHBondContact O-N 2.91Å; T124-Y127 HydrophobicContact CG2-CD1 4.11Å; T124-V144 HydrophobicContact CG2-CG2 4.44Å; T124-R145 WeakPolarHBondContact CB-O 3.32Å; T124-R145 PolarHBondContact OG1-O 3.28Å
125	N	88.4	Confident	85.3	Confident	44 Å²	44	47.3 Å²	47.3	24%	0.235	28%	0.279	C	S	.	.			trans	-108.3	12.6	-176.2	57.3	3.7	0	0	0	113.3	E52 P123 R145 I252 G253	E52-N125 PolarHBondContact OE1-ND2 2.81Å; P123-N125 PolarHBondContact O-N 3.44Å; N125-R145 PolarHBondContact OD1-NH1 2.96Å; N125-I252 WeakPolarHBondContact O-CG2 3.47Å; N125-G253 CarbonylContact C-O 3.32Å; N125-G253 PolarHBondContact O-N 3.47Å
126	A	90	Very high	84.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	89.5	-175.2	0	0	0	0	0	110	Y143 R145 W242 L251 G253	A126-Y143 HydrophobicContact CB-CE2 4.4Å; A126-R145 HydrophobicContact CB-CB 3.68Å; A126-R145 HydrophobicContact CB-CG 4.46Å; A126-R145 WeakPolarHBondContact O-CB 3.3Å; A126-R145 PolarHBondContact O-N 3.18Å; A126-W242 HydrophobicContact CB-CH2 3.94Å; A126-W242 HydrophobicContact CB-CZ3 4.24Å; A126-L251 WeakPolarHBondContact CA-O 3.47Å; A126-L251 WeakPolarHBondContact CB-O 3.22Å; A126-G253 WeakPolarHBondContact CA-O 3.41Å
127	Y	92	Very high	83.5	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.02	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	153.2	174	73.9	-90.3	0	0	0	111.9	P42 I44 E45 T124 Y143 G253 L254 D255	P42-Y127 WeakPolarHBondContact CG-OH 3.24Å; I44-Y127 HydrophobicContact CB-CD2 4.36Å; I44-Y127 HydrophobicContact CB-CE2 4.35Å; I44-Y127 HydrophobicContact CD1-CD2 3.67Å; I44-Y127 HydrophobicContact CD1-CE2 4.04Å; I44-Y127 HydrophobicContact CD1-CG 4.34Å; I44-Y127 HydrophobicContact CG2-CD1 3.75Å; I44-Y127 HydrophobicContact CG2-CD2 3.97Å; I44-Y127 HydrophobicContact CG2-CE1 4.11Å; I44-Y127 HydrophobicContact CG2-CE2 4.32Å; I44-Y127 HydrophobicContact CG2-CG 3.67Å; E45-Y127 HydrophobicContact CG-CE1 3.68Å; E45-Y127 PolarHBondContact OE1-OH 2.94Å; T124-Y127 HydrophobicContact CG2-CD1 4.11Å; Y127-Y143 WeakPolarHBondContact CA-O 3.4Å; Y127-G253 PolarHBondContact N-O 2.66Å; Y127-L254 HydrophobicContact CD1-CD2 4.21Å; Y127-L254 HydrophobicContact CE1-CB 4.02Å; Y127-L254 HydrophobicContact CE1-CD2 3.63Å; Y127-L254 HydrophobicContact CE1-CG 4.43Å; Y127-D255 HydrophobicContact CD2-CB 4.42Å; Y127-D255 HydrophobicContact CE2-CB 3.69Å; Y127-D255 VanDerWaalsContact CE2-N 3.3Å; Y127-D255 WeakPolarHBondContact O-CA 3.33Å; Y127-D255 PolarHBondContact O-N 2.9Å
128	G	90.1	Very high	82.7	Confident	6 Å²	6	47.5 Å²	47.5	6%	0.062	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.7	-131.9	178.1	0	0	0	0	0	112.2	Y143	G128-Y143 VanDerWaalsContact C-CD1 3.45Å; G128-Y143 VanDerWaalsContact C-CE1 3.45Å; G128-Y143 PolarHBondContact N-O 2.96Å; G128-Y143 VanDerWaalsContact N-O 3.1Å; G128-Y143 WeakPolarHBondContact O-CD1 3.22Å; G128-Y143 PolarHBondContact O-N 3.18Å
129	T	90.5	Very high	82.2	Confident	35 Å²	35	48 Å²	48	22%	0.215	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.2	176.3	38	0	0	0	0	111.9	A141 R142 N256 T257 C258	T129-A141 CarbonylContact C-O 3.51Å; T129-A141 VanDerWaalsContact CA-O 3.24Å; T129-A141 WeakPolarHBondContact CA-O 3.41Å; T129-R142 HydrophobicContact CG2-CG 4.19Å; T129-N256 PolarHBondContact N-O 3.06Å; T129-T257 CarbonylContact O-C 3.55Å; T129-T257 WeakPolarHBondContact O-CA 3.47Å; T129-T257 WeakPolarHBondContact OG1-CA 3.3Å; T129-T257 WeakPolarHBondContact OG1-CB 3.22Å; T129-T257 PolarHBondContact OG1-OG1 2.7Å; T129-C258 PolarHBondContact O-N 3.19Å
130	V	90	Very high	82.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.3	166	-171.1	0	0	0	0	107.4	F132 K140 A141 Y143 L251 Y260	V130-F132 HydrophobicContact CB-CE2 4.25Å; V130-F132 HydrophobicContact CG1-CD1 4.4Å; V130-F132 HydrophobicContact CG1-CD2 4.19Å; V130-F132 HydrophobicContact CG1-CE1 4.14Å; V130-F132 HydrophobicContact CG1-CE2 3.92Å; V130-F132 HydrophobicContact CG1-CG 4.43Å; V130-F132 HydrophobicContact CG1-CZ 3.89Å; V130-K140 WeakPolarHBondContact O-CA 3.36Å; V130-A141 PolarHBondContact N-O 3.12Å; V130-A141 PolarHBondContact O-N 3.18Å; V130-Y143 HydrophobicContact CB-CD1 4.48Å; V130-Y143 HydrophobicContact CG2-CD1 3.38Å; V130-Y143 HydrophobicContact CG2-CE1 4.04Å; V130-Y143 HydrophobicContact CG2-CG 3.76Å; V130-L251 HydrophobicContact CG1-CD2 4.45Å; V130-L251 HydrophobicContact CG2-CD2 3.91Å; V130-Y260 VanDerWaalsContact CG1-CB 3.42Å; V130-Y260 HydrophobicContact CG1-CD1 4.43Å; V130-Y260 HydrophobicContact CG1-CG 4.02Å
131	E	88.8	Confident	82.2	Confident	30 Å²	30	48.2 Å²	48.2	14%	0.14	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	107.2	170.9	-177.8	-178.5	-106.4	0	0	108.3	Q133 P138 T139 K140 T257 C258 S259 Y260	E131-Q133 PolarHBondContact O-N 2.96Å; E131-Q133 PolarHBondContact OE2-NE2 2.98Å; E131-P138 HydrophobicContact CG-CB 3.87Å; E131-T139 WeakPolarHBondContact CA-O 3.43Å; E131-K140 HydrophobicContact CG-CG 4.32Å; E131-K140 WeakPolarHBondContact OE1-CE 3.5Å; E131-K140 IonicContact OE1-NZ 3.29Å; E131-K140 PolarHBondContact OE1-NZ 2.91Å; E131-T257 HydrophobicContact CB-CG2 3.91Å; E131-C258 PolarHBondContact N-O 3.43Å; E131-S259 CarbonylContact O-C 3.58Å; E131-S259 WeakPolarHBondContact O-CA 3.4Å; E131-S259 PolarHBondContact OE2-OG 2.91Å; E131-Y260 PolarHBondContact O-N 3.46Å
132	F	87.3	Confident	82.4	Confident	7 Å²	7	46.9 Å²	46.9	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	123.7	-175.5	-69.9	-84.9	0	0	0	110.9	V130 P138 T139 A141 Y260 L274 N275 P276 F281	V130-F132 HydrophobicContact CB-CE2 4.25Å; V130-F132 HydrophobicContact CG1-CD1 4.4Å; V130-F132 HydrophobicContact CG1-CD2 4.19Å; V130-F132 HydrophobicContact CG1-CE1 4.14Å; V130-F132 HydrophobicContact CG1-CE2 3.92Å; V130-F132 HydrophobicContact CG1-CG 4.43Å; V130-F132 HydrophobicContact CG1-CZ 3.89Å; F132-P138 WeakPolarHBondContact O-CA 3.38Å; F132-T139 WeakPolarHBondContact CB-OG1 3.32Å; F132-T139 WeakPolarHBondContact CD2-OG1 3.09Å; F132-T139 PolarHBondContact N-O 3.09Å; F132-A141 HydrophobicContact CE2-CB 3.96Å; F132-Y260 WeakPolarHBondContact CA-O 3.43Å; F132-Y260 AromaticContact CD1-CD1 3.76Å; F132-Y260 HydrophobicContact CD1-CD1 3.76Å; F132-Y260 HydrophobicContact CD1-CE1 4.49Å; F132-Y260 AromaticContact CE1-CD1 3.59Å; F132-Y260 HydrophobicContact CE1-CD1 3.59Å; F132-Y260 HydrophobicContact CE1-CE1 4.02Å; F132-L274 HydrophobicContact CE1-CB 3.95Å; F132-L274 HydrophobicContact CZ-CB 4.03Å; F132-N275 WeakPolarHBondContact CZ-O 3.35Å; F132-P276 HydrophobicContact CB-CB 3.94Å; F132-P276 HydrophobicContact CD1-CB 3.77Å; F132-P276 HydrophobicContact CD2-CB 4.23Å; F132-P276 HydrophobicContact CE1-CB 4.31Å; F132-P276 HydrophobicContact CG-CB 3.73Å; F132-F281 AromaticContact CE2-CE2 3.88Å; F132-F281 HydrophobicContact CE2-CE2 3.88Å; F132-F281 HydrophobicContact CE2-CZ 4.34Å; F132-F281 AromaticContact CZ-CE2 3.72Å; F132-F281 HydrophobicContact CZ-CE2 3.72Å; F132-F281 AromaticContact CZ-CZ 3.84Å; F132-F281 HydrophobicContact CZ-CZ 3.84Å
133	Q	80.3	Confident	82.7	Confident	60 Å²	60	44.6 Å²	44.6	28%	0.28	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.5	-179.4	-63.6	-65.4	-22.3	0	0	110.1	E131 Y260 Y261	E131-Q133 PolarHBondContact O-N 2.96Å; E131-Q133 PolarHBondContact OE2-NE2 2.98Å; Q133-Y260 PolarHBondContact N-O 2.99Å; Q133-Y261 HydrophobicContact CB-CD1 3.66Å; Q133-Y261 HydrophobicContact CB-CD2 4.41Å; Q133-Y261 HydrophobicContact CB-CE1 3.39Å; Q133-Y261 HydrophobicContact CB-CE2 4.17Å; Q133-Y261 HydrophobicContact CB-CG 4.18Å; Q133-Y261 HydrophobicContact CG-CE1 4.24Å; Q133-Y261 HydrophobicContact CG-CE2 4.29Å
134	G	67.6	Low	83	Confident	82 Å²	82	40.8 Å²	40.8	85%	0.845	24%	0.242	S	C	*	.	S	Bend	trans	124.4	-4.9	178.8	0	0	0	0	0	116.3
135	G	65.2	Low	83.2	Confident	48 Å²	48	41.2 Å²	41.2	50%	0.495	24%	0.243	S	C	.	.	S	Bend	trans	-84.5	172.3	165.9	0	0	0	0	0	112.6	H137	G135-H137 PolarHBondContact O-N 3.28Å
136	P	63.5	Low	83.4	Confident	108 Å²	108	39.2 Å²	39.2	70%	0.701	23%	0.232	S	C	*	.	S	Bend	trans	-63.9	-29.3	173.5	28.1	-34.6	0	0	0	111.9
137	H	62.3	Low	83.5	Confident	127 Å²	127	39.8 Å²	39.8	59%	0.588	24%	0.235	S	C	*	.	S	Bend	trans	-128.9	145.8	168.1	-59	-28.6	0	0	0	109	G135 T139	G135-H137 PolarHBondContact O-N 3.28Å; H137-T139 PolarHBondContact O-N 3.34Å
138	P	66.5	Low	83.4	Confident	63 Å²	63	40.4 Å²	40.4	41%	0.409	24%	0.24	S	C	.	.			trans	-75.9	108.2	178.7	29	-32.9	0	0	0	110.9	E131 F132	E131-P138 HydrophobicContact CG-CB 3.87Å; F132-P138 WeakPolarHBondContact O-CA 3.38Å
139	T	76.4	Confident	83.4	Confident	21 Å²	21	44.8 Å²	44.8	13%	0.129	26%	0.259	C	S	.	.			trans	-71.1	144.1	176.6	62.8	0	0	0	0	110.5	E131 F132 H137 V227 P276	E131-T139 WeakPolarHBondContact CA-O 3.43Å; F132-T139 WeakPolarHBondContact CB-OG1 3.32Å; F132-T139 WeakPolarHBondContact CD2-OG1 3.09Å; F132-T139 PolarHBondContact N-O 3.09Å; H137-T139 PolarHBondContact O-N 3.34Å; T139-V227 HydrophobicContact CG2-CG1 4.08Å; T139-P276 PolarHBondContact OG1-O 2.96Å
140	K	85.6	Confident	83.4	Confident	130 Å²	130	43.9 Å²	43.9	57%	0.565	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.1	-176.3	-54.1	-161	-168.5	-146.3	0	111.3	V130 E131	V130-K140 WeakPolarHBondContact O-CA 3.36Å; E131-K140 HydrophobicContact CG-CG 4.32Å; E131-K140 WeakPolarHBondContact OE1-CE 3.5Å; E131-K140 IonicContact OE1-NZ 3.29Å; E131-K140 PolarHBondContact OE1-NZ 2.91Å
141	A	89	Confident	83.5	Confident	3 Å²	3	47.2 Å²	47.2	3%	0.025	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	151.4	180	0	0	0	0	0	111.2	T129 V130 F132 H278 N279 F281	T129-A141 CarbonylContact C-O 3.51Å; T129-A141 VanDerWaalsContact CA-O 3.24Å; T129-A141 WeakPolarHBondContact CA-O 3.41Å; V130-A141 PolarHBondContact N-O 3.12Å; V130-A141 PolarHBondContact O-N 3.18Å; F132-A141 HydrophobicContact CE2-CB 3.96Å; A141-H278 WeakPolarHBondContact CB-O 3.33Å; A141-N279 CarbonylContact C-O 3.57Å; A141-N279 WeakPolarHBondContact CA-O 3.41Å; A141-N279 WeakPolarHBondContact CB-O 3.5Å; A141-F281 HydrophobicContact CB-CD2 3.82Å; A141-F281 HydrophobicContact CB-CE2 3.61Å
142	R	91.6	Very high	83.5	Confident	82 Å²	82	46.6 Å²	46.6	31%	0.309	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	139.7	172.6	-56.2	-170.9	73.9	172.2	-3.9	110.3	T129 E162 W163 N279 Y280 F281	T129-R142 HydrophobicContact CG2-CG 4.19Å; R142-E162 PolarHBondContact NH1-O 2.79Å; R142-E162 VanDerWaalsContact NH1-O 3.16Å; R142-W163 HydrophobicContact CB-CD2 4.26Å; R142-W163 HydrophobicContact CB-CH2 4.42Å; R142-W163 HydrophobicContact CB-CZ2 4.05Å; R142-N279 PolarHBondContact N-O 2.75Å; R142-Y280 HydrophobicContact CB-CD1 4.07Å; R142-Y280 HydrophobicContact CB-CE1 4.4Å; R142-Y280 HydrophobicContact CG-CD1 4.48Å; R142-Y280 HydrophobicContact CG-CE1 4.33Å; R142-Y280 CarbonylContact O-C 3.42Å; R142-Y280 WeakPolarHBondContact O-CA 3.23Å; R142-F281 PolarHBondContact O-N 3.45Å
143	Y	94.1	Very high	83.7	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.008	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	155.4	-178.7	78.7	-79.4	0	0	0	113.7	A126 Y127 G128 V130 L251 C258 F281 L283	A126-Y143 HydrophobicContact CB-CE2 4.4Å; Y127-Y143 WeakPolarHBondContact CA-O 3.4Å; G128-Y143 VanDerWaalsContact C-CD1 3.45Å; G128-Y143 VanDerWaalsContact C-CE1 3.45Å; G128-Y143 PolarHBondContact N-O 2.96Å; G128-Y143 VanDerWaalsContact N-O 3.1Å; G128-Y143 WeakPolarHBondContact O-CD1 3.22Å; G128-Y143 PolarHBondContact O-N 3.18Å; V130-Y143 HydrophobicContact CB-CD1 4.48Å; V130-Y143 HydrophobicContact CG2-CD1 3.38Å; V130-Y143 HydrophobicContact CG2-CE1 4.04Å; V130-Y143 HydrophobicContact CG2-CG 3.76Å; Y143-L251 HydrophobicContact CE2-CB 3.94Å; Y143-L251 VanDerWaalsContact CE2-O 3.27Å; Y143-L251 WeakPolarHBondContact CE2-O 3.42Å; Y143-L251 PolarHBondContact OH-O 3.27Å; Y143-L251 VanDerWaalsContact OH-O 3.08Å; Y143-C258 PolarHBondContact OH-SG 3.21Å; Y143-F281 WeakPolarHBondContact CA-O 3.42Å; Y143-L283 HydrophobicContact CD2-CD1 4.07Å
144	V	94.1	Very high	84.3	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	136.9	170	61.1	0	0	0	0	111.4	I44 I48 T124 L146 L158 W163 F281 L282 L283	I44-V144 HydrophobicContact CG2-CG2 4.29Å; I48-V144 HydrophobicContact CD1-CG2 4.03Å; I48-V144 HydrophobicContact CG2-CG2 4.01Å; T124-V144 HydrophobicContact CG2-CG2 4.44Å; V144-L146 HydrophobicContact CG1-CD2 4.03Å; V144-L158 HydrophobicContact CG1-CD2 3.64Å; V144-W163 HydrophobicContact CB-CZ2 4.36Å; V144-W163 HydrophobicContact CG1-CH2 4.09Å; V144-W163 HydrophobicContact CG1-CZ2 3.99Å; V144-F281 PolarHBondContact N-O 2.71Å; V144-F281 VanDerWaalsContact N-O 3.17Å; V144-L282 HydrophobicContact CG1-CD2 3.75Å; V144-L283 WeakPolarHBondContact O-CB 3.35Å; V144-L283 PolarHBondContact O-N 2.99Å
145	R	93.9	Very high	85.5	Confident	12 Å²	12	45.9 Å²	45.9	5%	0.045	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	128.1	164.6	-179.5	-174	176.5	-166.2	-0.6	109.3	C50 L51 E52 T124 N125 A126 W242 L283 D285	C50-R145 HydrophobicContact CB-CG 3.87Å; L51-R145 PolarHBondContact O-NH2 3.26Å; E52-R145 IonicContact OE1-NH1 2.9Å; E52-R145 PolarHBondContact OE1-NH1 3.02Å; E52-R145 IonicContact OE1-NH2 3.48Å; T124-R145 WeakPolarHBondContact CB-O 3.32Å; T124-R145 PolarHBondContact OG1-O 3.28Å; N125-R145 PolarHBondContact OD1-NH1 2.96Å; A126-R145 HydrophobicContact CB-CB 3.68Å; A126-R145 HydrophobicContact CB-CG 4.46Å; A126-R145 WeakPolarHBondContact O-CB 3.3Å; A126-R145 PolarHBondContact O-N 3.18Å; R145-W242 HydrophobicContact CB-CE3 4.43Å; R145-W242 HydrophobicContact CG-CD2 4.01Å; R145-W242 HydrophobicContact CG-CE3 4.23Å; R145-W242 HydrophobicContact CG-CG 4.22Å; R145-L283 WeakPolarHBondContact CA-O 3.35Å; R145-D285 HydrophobicContact CG-CB 4.32Å; R145-D285 IonicContact CZ-OD2 2.68Å; R145-D285 IonicContact NE-OD2 3.75Å; R145-D285 PolarHBondContact NE-OD2 2.97Å; R145-D285 IonicContact NH2-OD2 2.67Å; R145-D285 PolarHBondContact NH2-OD2 3Å
146	L	93.3	Very high	86.6	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	149.8	-178.2	57.1	76.5	0	0	0	112.3	I48 V49 V144 V155 L282 L283 A284 D285 L298	I48-L146 HydrophobicContact CG2-CB 3.55Å; V49-L146 CarbonylContact O-C 3.49Å; V49-L146 WeakPolarHBondContact O-CA 3.39Å; V144-L146 HydrophobicContact CG1-CD2 4.03Å; L146-V155 HydrophobicContact CD2-CG2 4.29Å; L146-L282 HydrophobicContact CD2-CB 4.44Å; L146-L282 HydrophobicContact CD2-CD2 4.1Å; L146-L283 PolarHBondContact N-O 3.34Å; L146-A284 CarbonylContact O-C 3.24Å; L146-A284 WeakPolarHBondContact O-CA 3.3Å; L146-D285 WeakPolarHBondContact O-CB 3.46Å; L146-D285 PolarHBondContact O-N 3.08Å; L146-L298 HydrophobicContact CD1-CD1 3.42Å; L146-L298 VanDerWaalsContact CD1-CD1 3.42Å; L146-L298 HydrophobicContact CD1-CD2 3.92Å; L146-L298 HydrophobicContact CD1-CG 4.31Å
147	H	92.1	Very high	87.9	Confident	12 Å²	12	42.2 Å²	42.2	6%	0.056	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	134.5	178	174.5	-159.4	0	0	0	110.6	V49 L51 E121 E149 T150	V49-H147 HydrophobicContact CG2-CB 4.06Å; V49-H147 PolarHBondContact O-N 2.61Å; L51-H147 WeakPolarHBondContact CD1-CD2 3.42Å; L51-H147 HydrophobicContact CG-CB 4.48Å; E121-H147 IonicContact OE1-CE1 3.18Å; E121-H147 PolarHBondContact OE1-CE1 3.32Å; E121-H147 VanDerWaalsContact OE1-CE1 3.25Å; E121-H147 IonicContact OE1-CG 2.75Å; E121-H147 IonicContact OE1-ND1 2.66Å; E121-H147 PolarHBondContact OE1-ND1 2.92Å; H147-E149 PolarHBondContact CD2-N 2.66Å; H147-E149 PolarHBondContact O-N 3.4Å; H147-E149 VanDerWaalsContact O-N 3.12Å; H147-T150 PolarHBondContact N-OG1 2.81Å; H147-T150 WeakPolarHBondContact O-CB 3.31Å; H147-T150 PolarHBondContact O-N 3.44Å; H147-T150 PolarHBondContact O-OG1 2.84Å
148	C	89.9	Confident	89.3	Confident	19 Å²	19	36.1 Å²	36.1	13%	0.128	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-23.4	178.6	58.7	0	0	0	0	115.2	D285 G294 R301	C148-D285 WeakPolarHBondContact CB-O 3.22Å; C148-D285 PolarHBondContact N-O 2.88Å; C148-D285 PolarHBondContact SG-O 2.91Å; C148-G294 VanDerWaalsContact CB-O 3.32Å; C148-G294 WeakPolarHBondContact CB-O 3.35Å; C148-R301 PolarHBondContact O-NH2 2.66Å
149	E	88.6	Confident	90.5	Very high	98 Å²	98	33.2 Å²	33.2	46%	0.458	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-3.5	173	-57.7	-166.5	148.7	0	0	114.5	K116 H147 C151 R301	K116-E149 WeakPolarHBondContact CE-OE1 3.11Å; K116-E149 IonicContact NZ-OE1 2.69Å; K116-E149 PolarHBondContact NZ-OE1 3.33Å; K116-E149 IonicContact NZ-OE2 3.86Å; K116-E149 PolarHBondContact NZ-OE2 2.98Å; H147-E149 PolarHBondContact CD2-N 2.66Å; H147-E149 PolarHBondContact O-N 3.4Å; H147-E149 VanDerWaalsContact O-N 3.12Å; E149-C151 PolarHBondContact O-N 2.72Å; E149-R301 PolarHBondContact O-NH1 2.65Å; E149-R301 PolarHBondContact O-NH2 2.72Å
150	T	90.8	Very high	91	Very high	16 Å²	16	34 Å²	34	10%	0.098	17%	0.169	C	C	.	.			trans	-47.3	136.3	178.2	-59.6	0	0	0	0	112.3	H147 V154 V155 R301	H147-T150 PolarHBondContact N-OG1 2.81Å; H147-T150 WeakPolarHBondContact O-CB 3.31Å; H147-T150 PolarHBondContact O-N 3.44Å; H147-T150 PolarHBondContact O-OG1 2.84Å; T150-V154 HydrophobicContact CG2-CB 4.35Å; T150-V155 HydrophobicContact CG2-CG2 4.24Å; T150-R301 PolarHBondContact O-NH1 2.01Å; T150-R301 PolarHBondContact O-NH2 2.51Å
151	C	91.7	Very high	91	Very high	69 Å²	69	33.3 Å²	33.3	47%	0.466	17%	0.167	S	C	.	.			trans	-68	135.9	-175.5	-61	0	0	0	0	112.6	E149 E153 V154 V155	E149-C151 PolarHBondContact O-N 2.72Å; C151-E153 WeakPolarHBondContact CB-OE2 3Å; C151-E153 PolarHBondContact O-N 3.46Å; C151-V154 HydrophobicContact CB-CG2 4.32Å; C151-V154 PolarHBondContact O-N 3.48Å; C151-V155 PolarHBondContact O-N 3.5Å
152	P	90.8	Very high	90.8	Very high	18 Å²	18	36.5 Å²	36.5	12%	0.117	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-21.8	-177.6	28.6	-36.4	0	0	0	113.5	V154 V155 L156 Y305	P152-V154 VanDerWaalsContact C-N 3.34Å; P152-V155 PolarHBondContact O-N 3.22Å; P152-L156 WeakPolarHBondContact O-CB 3.41Å; P152-L156 PolarHBondContact O-N 2.93Å; P152-Y305 HydrophobicContact CB-CD1 4.19Å; P152-Y305 HydrophobicContact CB-CG 3.91Å; P152-Y305 HydrophobicContact CG-CD2 4.15Å; P152-Y305 HydrophobicContact CG-CG 4.01Å
153	E	90.7	Very high	90.7	Very high	94 Å²	94	33.1 Å²	33.1	44%	0.439	17%	0.169	S	C	.	.	H	α-helix	trans	-57.8	-44.7	170.6	-66.1	72.8	-168.5	0	0	111.8	C151 L156 H157 Y305	C151-E153 WeakPolarHBondContact CB-OE2 3Å; C151-E153 PolarHBondContact O-N 3.46Å; E153-L156 PolarHBondContact O-N 3.43Å; E153-H157 PolarHBondContact O-N 3.21Å; E153-Y305 HydrophobicContact CG-CE2 3.97Å; E153-Y305 WeakPolarHBondContact OE1-CE2 3.28Å
154	V	92.3	Very high	90.3	Very high	36 Å²	36	39.2 Å²	39.2	22%	0.218	20%	0.195	C	C	.	.	H	α-helix	trans	-70.4	-41.3	-179.9	-177.4	0	0	0	0	109.8	W43 N47 I48 T150 C151 P152 H157 L158	W43-V154 HydrophobicContact CH2-CG1 3.64Å; W43-V154 WeakPolarHBondContact CH2-O 3.38Å; W43-V154 HydrophobicContact CZ2-CG1 4.23Å; W43-V154 HydrophobicContact CZ3-CG1 4.47Å; N47-V154 HydrophobicContact CB-CG1 4.25Å; I48-V154 HydrophobicContact CG1-CG1 4.27Å; T150-V154 HydrophobicContact CG2-CB 4.35Å; C151-V154 HydrophobicContact CB-CG2 4.32Å; C151-V154 PolarHBondContact O-N 3.48Å; P152-V154 VanDerWaalsContact C-N 3.34Å; V154-H157 PolarHBondContact O-N 2.85Å; V154-L158 PolarHBondContact O-N 3.23Å
155	V	92.4	Very high	90	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.018	20%	0.199	C	C	.	.	H	α-helix	trans	-62.5	-43.5	174.8	-176.4	0	0	0	0	110.8	L146 T150 C151 P152 H157 L158 L159 L282 L302	L146-V155 HydrophobicContact CD2-CG2 4.29Å; T150-V155 HydrophobicContact CG2-CG2 4.24Å; C151-V155 PolarHBondContact O-N 3.5Å; P152-V155 PolarHBondContact O-N 3.22Å; V155-H157 PolarHBondContact O-N 3.38Å; V155-L158 WeakPolarHBondContact O-CB 3.21Å; V155-L158 PolarHBondContact O-N 2.84Å; V155-L159 HydrophobicContact CG1-CD1 4.38Å; V155-L159 WeakPolarHBondContact O-CG 2.9Å; V155-L159 PolarHBondContact O-N 3.05Å; V155-L282 HydrophobicContact CG1-CD1 3.63Å; V155-L282 HydrophobicContact CG1-CD2 4.45Å; V155-L302 HydrophobicContact CB-CD1 4.13Å; V155-L302 HydrophobicContact CG1-CD1 3.8Å; V155-L302 HydrophobicContact CG1-CD2 4.02Å
156	L	89.8	Confident	89.4	Confident	12 Å²	12	46 Å²	46	6%	0.063	22%	0.222	C	C	.	.	H	α-helix	trans	-67.3	-36.6	177.8	-168.3	67.5	0	0	0	112.4	P152 E153 L158 L159 L160 Y305 L306 Q309	P152-L156 WeakPolarHBondContact O-CB 3.41Å; P152-L156 PolarHBondContact O-N 2.93Å; E153-L156 PolarHBondContact O-N 3.43Å; L156-L158 VanDerWaalsContact C-N 3.34Å; L156-L159 PolarHBondContact O-N 3.22Å; L156-L160 HydrophobicContact CD1-CD1 3.85Å; L156-L160 HydrophobicContact CD1-CD2 4.34Å; L156-L160 HydrophobicContact CD1-CG 3.83Å; L156-L160 HydrophobicContact CD2-CD1 3.98Å; L156-L160 HydrophobicContact CG-CD1 3.68Å; L156-L160 HydrophobicContact CG-CG 3.97Å; L156-L160 WeakPolarHBondContact O-CB 3.26Å; L156-L160 WeakPolarHBondContact O-CG 3.3Å; L156-L160 PolarHBondContact O-N 3.34Å; L156-Y305 HydrophobicContact CB-CD1 4.3Å; L156-Y305 HydrophobicContact CB-CE1 4.04Å; L156-Y305 HydrophobicContact CD2-CD1 4.06Å; L156-Y305 HydrophobicContact CD2-CE1 3.59Å; L156-Y305 HydrophobicContact CG-CE1 4.45Å; L156-L306 HydrophobicContact CD1-CD2 3.7Å; L156-Q309 HydrophobicContact CD2-CG 3.79Å
157	H	90.4	Very high	88.9	Confident	67 Å²	67	48 Å²	48	31%	0.31	23%	0.234	S	C	.	.	H	α-helix	trans	-61	-43.1	173	-173.3	-70.9	0	0	0	111.5	W43 E153 V154 V155 H161 E162	W43-H157 AromaticContact CE2-CE1 3.64Å; W43-H157 AromaticContact CE2-ND1 3.43Å; W43-H157 HydrophobicContact CH2-CB 4.04Å; W43-H157 AromaticContact CH2-ND1 3.63Å; W43-H157 HydrophobicContact CZ2-CB 3.95Å; W43-H157 AromaticContact CZ2-CE1 3.83Å; W43-H157 AromaticContact CZ2-CG 3.6Å; W43-H157 AromaticContact CZ2-ND1 3.17Å; W43-H157 WeakPolarHBondContact CZ2-ND1 3.48Å; W43-H157 AromaticContact NE1-CE1 3.61Å; W43-H157 AromaticContact NE1-ND1 3.88Å; E153-H157 PolarHBondContact O-N 3.21Å; V154-H157 PolarHBondContact O-N 2.85Å; V155-H157 PolarHBondContact O-N 3.38Å; H157-H161 AromaticContact CD2-CD2 3.55Å; H157-H161 AromaticContact CG-CD2 3.9Å; H157-H161 AromaticContact NE2-CD2 3.74Å; H157-H161 WeakPolarHBondContact O-CB 3.31Å; H157-H161 PolarHBondContact O-N 3.38Å; H157-E162 IonicContact CE1-OE1 3.65Å; H157-E162 PolarHBondContact CE1-OE1 3.39Å; H157-E162 IonicContact ND1-OE1 2.8Å; H157-E162 PolarHBondContact O-N 3.29Å
158	L	91.9	Very high	88.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-57	-51.6	173	-177.4	79.3	0	0	0	111	W43 I44 I48 V144 V154 V155 L156 E162 W163 L282	W43-L158 HydrophobicContact CE3-CD1 4.47Å; W43-L158 HydrophobicContact CH2-CB 4.42Å; W43-L158 HydrophobicContact CZ3-CB 4.05Å; W43-L158 HydrophobicContact CZ3-CD1 3.98Å; I44-L158 HydrophobicContact CD1-CD1 4.04Å; I44-L158 HydrophobicContact CG1-CD1 3.85Å; I48-L158 HydrophobicContact CD1-CD1 4.12Å; I48-L158 HydrophobicContact CD1-CD2 4.16Å; V144-L158 HydrophobicContact CG1-CD2 3.64Å; V154-L158 PolarHBondContact O-N 3.23Å; V155-L158 WeakPolarHBondContact O-CB 3.21Å; V155-L158 PolarHBondContact O-N 2.84Å; L156-L158 VanDerWaalsContact C-N 3.34Å; L158-E162 HydrophobicContact CD1-CB 4.04Å; L158-E162 HydrophobicContact CD1-CG 4.31Å; L158-E162 PolarHBondContact O-N 3.14Å; L158-W163 HydrophobicContact CD2-CD2 4.42Å; L158-W163 HydrophobicContact CD2-CH2 4.15Å; L158-W163 HydrophobicContact CD2-CZ2 3.82Å; L158-W163 HydrophobicContact CG-CD2 4.21Å; L158-W163 HydrophobicContact CG-CG 4.43Å; L158-W163 HydrophobicContact CG-CZ2 4.35Å; L158-W163 WeakPolarHBondContact O-CB 3.25Å; L158-W163 PolarHBondContact O-N 3.22Å; L158-L282 HydrophobicContact CD2-CD2 4.26Å
159	L	91	Very high	88.3	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.237	C	C	.	.	I	π-helix	trans	-63	-48.4	-177.5	-62.9	179.1	0	0	0	112.6	V155 L156 W163 K164 I165 W205 L237	V155-L159 HydrophobicContact CG1-CD1 4.38Å; V155-L159 WeakPolarHBondContact O-CG 2.9Å; V155-L159 PolarHBondContact O-N 3.05Å; L156-L159 PolarHBondContact O-N 3.22Å; L159-W163 HydrophobicContact CD2-CD2 4.44Å; L159-W163 HydrophobicContact CD2-CE3 3.43Å; L159-W163 VanDerWaalsContact CD2-CE3 3.43Å; L159-W163 HydrophobicContact CD2-CZ3 3.61Å; L159-W163 CarbonylContact O-C 3.48Å; L159-K164 PolarHBondContact O-N 2.94Å; L159-I165 HydrophobicContact CB-CD1 4.35Å; L159-I165 HydrophobicContact CD2-CD1 4.05Å; L159-I165 WeakPolarHBondContact O-CB 3.22Å; L159-I165 WeakPolarHBondContact O-CG1 3.48Å; L159-I165 PolarHBondContact O-N 3.06Å; L159-W205 HydrophobicContact CB-CH2 4.08Å; L159-W205 HydrophobicContact CD1-CH2 3.75Å; L159-W205 HydrophobicContact CD1-CZ3 3.57Å; L159-L237 HydrophobicContact CD1-CD2 4.35Å; L159-L237 HydrophobicContact CD2-CD1 4.31Å
160	L	86.4	Confident	88.3	Confident	39 Å²	39	44 Å²	44	20%	0.204	22%	0.215	C	C	.	.	I	π-helix	trans	-84.8	-31.7	-172	-59.7	-175.9	0	0	0	114.3	L156 K164 I165 V167 W205	L156-L160 HydrophobicContact CD1-CD1 3.85Å; L156-L160 HydrophobicContact CD1-CD2 4.34Å; L156-L160 HydrophobicContact CD1-CG 3.83Å; L156-L160 HydrophobicContact CD2-CD1 3.98Å; L156-L160 HydrophobicContact CG-CD1 3.68Å; L156-L160 HydrophobicContact CG-CG 3.97Å; L156-L160 WeakPolarHBondContact O-CB 3.26Å; L156-L160 WeakPolarHBondContact O-CG 3.3Å; L156-L160 PolarHBondContact O-N 3.34Å; L160-K164 WeakPolarHBondContact O-CA 3.38Å; L160-I165 WeakPolarHBondContact CD2-O 3.46Å; L160-V167 HydrophobicContact CD1-CG2 4.05Å; L160-V167 HydrophobicContact CD2-CG2 3.98Å; L160-W205 HydrophobicContact CD2-CH2 4.31Å; L160-W205 HydrophobicContact CD2-CZ2 4.32Å
161	H	86.3	Confident	88.4	Confident	115 Å²	115	43.3 Å²	43.3	53%	0.532	21%	0.21	S	C	.	.	I	π-helix	trans	-108.9	-47	-173.2	-61.7	-50.2	0	0	0	113.6	H157 K164	H157-H161 AromaticContact CD2-CD2 3.55Å; H157-H161 AromaticContact CG-CD2 3.9Å; H157-H161 AromaticContact NE2-CD2 3.74Å; H157-H161 WeakPolarHBondContact O-CB 3.31Å; H157-H161 PolarHBondContact O-N 3.38Å; H161-K164 WeakPolarHBondContact O-CG 3.2Å
162	E	85.8	Confident	88.5	Confident	69 Å²	69	40 Å²	40	32%	0.322	19%	0.188	S	C	.	.	I	π-helix	trans	-81.9	-35.3	-179.7	-53.4	-58.5	134	0	0	112.1	W43 R142 H157 L158	W43-E162 HydrophobicContact CD2-CG 4.07Å; W43-E162 HydrophobicContact CE3-CG 3.66Å; W43-E162 HydrophobicContact CZ3-CG 4.11Å; R142-E162 PolarHBondContact NH1-O 2.79Å; R142-E162 VanDerWaalsContact NH1-O 3.16Å; H157-E162 IonicContact CE1-OE1 3.65Å; H157-E162 PolarHBondContact CE1-OE1 3.39Å; H157-E162 IonicContact ND1-OE1 2.8Å; H157-E162 PolarHBondContact O-N 3.29Å; L158-E162 HydrophobicContact CD1-CB 4.04Å; L158-E162 HydrophobicContact CD1-CG 4.31Å; L158-E162 PolarHBondContact O-N 3.14Å
163	W	88.7	Confident	88.6	Confident	12 Å²	12	39.2 Å²	39.2	5%	0.045	18%	0.183	C	C	.	.	S	Bend	trans	-96.4	-11.8	176.6	-67.5	6.4	0	0	0	113.7	R142 V144 L158 L159 I165 Y280 L282	R142-W163 HydrophobicContact CB-CD2 4.26Å; R142-W163 HydrophobicContact CB-CH2 4.42Å; R142-W163 HydrophobicContact CB-CZ2 4.05Å; V144-W163 HydrophobicContact CB-CZ2 4.36Å; V144-W163 HydrophobicContact CG1-CH2 4.09Å; V144-W163 HydrophobicContact CG1-CZ2 3.99Å; L158-W163 HydrophobicContact CD2-CD2 4.42Å; L158-W163 HydrophobicContact CD2-CH2 4.15Å; L158-W163 HydrophobicContact CD2-CZ2 3.82Å; L158-W163 HydrophobicContact CG-CD2 4.21Å; L158-W163 HydrophobicContact CG-CG 4.43Å; L158-W163 HydrophobicContact CG-CZ2 4.35Å; L158-W163 WeakPolarHBondContact O-CB 3.25Å; L158-W163 PolarHBondContact O-N 3.22Å; L159-W163 HydrophobicContact CD2-CD2 4.44Å; L159-W163 HydrophobicContact CD2-CE3 3.43Å; L159-W163 VanDerWaalsContact CD2-CE3 3.43Å; L159-W163 HydrophobicContact CD2-CZ3 3.61Å; L159-W163 CarbonylContact O-C 3.48Å; W163-I165 VanDerWaalsContact C-N 3.28Å; W163-I165 HydrophobicContact CB-CD1 4.21Å; W163-I165 HydrophobicContact CB-CG1 4.08Å; W163-I165 HydrophobicContact CE3-CD1 4.22Å; W163-I165 PolarHBondContact O-N 3.34Å; W163-Y280 HydrophobicContact CD2-CD1 4.17Å; W163-Y280 AromaticContact CE3-CD1 3.39Å; W163-Y280 HydrophobicContact CE3-CD1 3.39Å; W163-Y280 HydrophobicContact CE3-CE1 4.04Å; W163-Y280 HydrophobicContact CE3-CG 4.18Å; W163-Y280 AromaticContact CZ3-CD1 3.71Å; W163-Y280 HydrophobicContact CZ3-CD1 3.71Å; W163-Y280 HydrophobicContact CZ3-CG 4.19Å; W163-L282 HydrophobicContact CH2-CD2 3.91Å; W163-L282 HydrophobicContact CZ3-CD2 4.13Å
164	K	86.3	Confident	88.7	Confident	129 Å²	129	35.1 Å²	35.1	56%	0.561	16%	0.164	S	C	*	.			trans	57.8	32.2	174	-55.8	-166.4	-180	-160.6	0	115	L159 L160 H161 S1990 R1991	L159-K164 PolarHBondContact O-N 2.94Å; L160-K164 WeakPolarHBondContact O-CA 3.38Å; H161-K164 WeakPolarHBondContact O-CG 3.2Å; K164-S1990 PolarHBondContact NZ-O 2.98Å; K164-R1991 PolarHBondContact NZ-O 2.94Å
165	I	86.7	Confident	88.6	Confident	15 Å²	15	34 Å²	34	8%	0.077	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-78.1	139.5	177.3	-48.8	175.3	0	0	0	109.6	L159 L160 W163 W205 V235 Y280	L159-I165 HydrophobicContact CB-CD1 4.35Å; L159-I165 HydrophobicContact CD2-CD1 4.05Å; L159-I165 WeakPolarHBondContact O-CB 3.22Å; L159-I165 WeakPolarHBondContact O-CG1 3.48Å; L159-I165 PolarHBondContact O-N 3.06Å; L160-I165 WeakPolarHBondContact CD2-O 3.46Å; W163-I165 VanDerWaalsContact C-N 3.28Å; W163-I165 HydrophobicContact CB-CD1 4.21Å; W163-I165 HydrophobicContact CB-CG1 4.08Å; W163-I165 HydrophobicContact CE3-CD1 4.22Å; W163-I165 PolarHBondContact O-N 3.34Å; I165-W205 HydrophobicContact CB-CZ2 4.14Å; I165-W205 HydrophobicContact CG2-CZ2 3.55Å; I165-V235 HydrophobicContact CD1-CG1 4.43Å; I165-V235 HydrophobicContact CG2-CG1 4.1Å; I165-V235 HydrophobicContact CG2-CG2 3.71Å; I165-Y280 HydrophobicContact CD1-CD1 3.92Å; I165-Y280 HydrophobicContact CD1-CD2 4.05Å; I165-Y280 HydrophobicContact CD1-CE1 3.63Å; I165-Y280 HydrophobicContact CD1-CE2 3.78Å; I165-Y280 HydrophobicContact CD1-CG 4.11Å; I165-Y280 HydrophobicContact CG1-CE1 4.08Å; I165-Y280 HydrophobicContact CG1-CE2 4.32Å
166	R	82.8	Confident	88.3	Confident	142 Å²	142	34.7 Å²	34.7	54%	0.536	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-67.2	149.4	172.1	-72.6	175.8	168.7	154.5	-7.6	111.4	W205 N233 S1986	R166-W205 VanDerWaalsContact O-CZ2 3.29Å; R166-W205 WeakPolarHBondContact O-CZ2 3.38Å; R166-W205 PolarHBondContact O-NE1 3.25Å; R166-N233 PolarHBondContact NH1-OD1 3.35Å; R166-S1986 PolarHBondContact NH2-OG 3.37Å
167	V	82.2	Confident	87.9	Confident	43 Å²	43	34.3 Å²	34.3	26%	0.261	16%	0.164	S	C	.	.	P	Polyproline II helix	trans	-63.4	133.9	174.1	-178.3	0	0	0	0	109.9	L160 V323	L160-V167 HydrophobicContact CD1-CG2 4.05Å; L160-V167 HydrophobicContact CD2-CG2 3.98Å; V167-V323 HydrophobicContact CG1-CG2 4.2Å
168	P	85.2	Confident	87.3	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.013	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-69.6	143.3	-178.3	20.6	-27.4	0	0	0	113.5	L170 V171 W205 V323	P168-L170 VanDerWaalsContact C-N 3.32Å; P168-L170 WeakPolarHBondContact CB-O 3.49Å; P168-V171 HydrophobicContact CB-CG2 4.13Å; P168-V171 HydrophobicContact CG-CG2 3.88Å; P168-W205 HydrophobicContact CB-CB 4.24Å; P168-W205 HydrophobicContact CB-CD2 3.98Å; P168-W205 HydrophobicContact CB-CG 3.69Å; P168-W205 HydrophobicContact CG-CD2 3.7Å; P168-W205 HydrophobicContact CG-CE3 4.03Å; P168-W205 HydrophobicContact CG-CG 3.97Å; P168-W205 HydrophobicContact CG-CZ2 4.34Å; P168-W205 HydrophobicContact CG-CZ3 4.47Å; P168-V323 HydrophobicContact CB-CG1 4.3Å; P168-V323 HydrophobicContact CG-CG1 4.01Å; P168-V323 WeakPolarHBondContact O-CG2 3.46Å
169	N	83.6	Confident	86.6	Confident	43 Å²	43	37.2 Å²	37.2	23%	0.23	19%	0.187	C	C	.	.	S	Bend	trans	-79.4	-18.3	165.1	-66.1	-32.1	0	0	0	112.7	T202 I311 P324 W459	N169-T202 VanDerWaalsContact CB-O 3.3Å; N169-T202 WeakPolarHBondContact CB-O 3Å; N169-T202 PolarHBondContact ND2-O 2.98Å; N169-I311 VanDerWaalsContact OD1-CG2 3.3Å; N169-I311 WeakPolarHBondContact OD1-CG2 3.44Å; N169-P324 VanDerWaalsContact O-CD 3.26Å; N169-P324 WeakPolarHBondContact O-CD 3.45Å; N169-P324 WeakPolarHBondContact O-CG 3.32Å; N169-W459 PolarHBondContact O-NE1 3.38Å
170	L	89.2	Confident	85.6	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.			trans	-159.8	145.6	-177.7	173.3	60.1	0	0	0	109.4	P168 I172 T202 A204 W205 P324 V326 L436 L439	P168-L170 VanDerWaalsContact C-N 3.32Å; P168-L170 WeakPolarHBondContact CB-O 3.49Å; L170-I172 HydrophobicContact CD2-CD1 4.21Å; L170-I172 HydrophobicContact CD2-CG1 4.04Å; L170-I172 HydrophobicContact CG-CG1 4.12Å; L170-T202 HydrophobicContact CD2-CG2 4.35Å; L170-A204 HydrophobicContact CB-CB 3.95Å; L170-A204 HydrophobicContact CD2-CB 4.18Å; L170-A204 HydrophobicContact CG-CB 4.03Å; L170-A204 CarbonylContact O-C 3.58Å; L170-A204 VanDerWaalsContact O-CA 3.24Å; L170-A204 WeakPolarHBondContact O-CA 3.4Å; L170-W205 PolarHBondContact O-N 3.45Å; L170-P324 HydrophobicContact CB-CG 4.48Å; L170-P324 HydrophobicContact CD1-CB 4.27Å; L170-P324 HydrophobicContact CD1-CG 3.94Å; L170-V326 HydrophobicContact CD1-CG1 4.03Å; L170-L436 HydrophobicContact CD2-CD2 3.81Å; L170-L439 HydrophobicContact CD1-CD1 3.51Å
171	V	91.9	Very high	84.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	119.8	168	-175.7	0	0	0	0	109.7	P168 W205 V207 L306 V323 P324 I325 V326	P168-V171 HydrophobicContact CB-CG2 4.13Å; P168-V171 HydrophobicContact CG-CG2 3.88Å; V171-W205 WeakPolarHBondContact CA-O 3.45Å; V171-W205 HydrophobicContact CG2-CB 4.47Å; V171-V207 HydrophobicContact CG1-CG2 3.65Å; V171-L306 HydrophobicContact CG2-CD1 4.33Å; V171-V323 HydrophobicContact CG2-CG1 3.84Å; V171-P324 PolarHBondContact N-O 2.87Å; V171-I325 HydrophobicContact CB-CB 4.46Å; V171-I325 HydrophobicContact CB-CD1 4.28Å; V171-I325 HydrophobicContact CB-CG1 4.01Å; V171-I325 HydrophobicContact CB-CG2 4.24Å; V171-I325 HydrophobicContact CG1-CG2 4.41Å; V171-I325 HydrophobicContact CG2-CD1 4.44Å; V171-I325 HydrophobicContact CG2-CG1 4.35Å; V171-I325 WeakPolarHBondContact O-CA 3.32Å; V171-V326 PolarHBondContact O-N 3.41Å
172	I	93.8	Very high	84.4	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	111.7	174.6	-61	167.5	0	0	0	107.8	L170 I174 A198 A204 W205 V207 V326 V328	L170-I172 HydrophobicContact CD2-CD1 4.21Å; L170-I172 HydrophobicContact CD2-CG1 4.04Å; L170-I172 HydrophobicContact CG-CG1 4.12Å; I172-I174 HydrophobicContact CG2-CD1 3.98Å; I172-I174 HydrophobicContact CG2-CG1 4.46Å; I172-A198 HydrophobicContact CD1-CB 4.03Å; I172-A204 HydrophobicContact CD1-CB 3.89Å; I172-A204 HydrophobicContact CG1-CB 4.19Å; I172-W205 PolarHBondContact N-O 3.07Å; I172-V207 PolarHBondContact O-N 2.77Å; I172-V326 HydrophobicContact CB-CG1 4.47Å; I172-V326 HydrophobicContact CG1-CG1 3.98Å; I172-V328 HydrophobicContact CG2-CG2 3.93Å
173	S	93.5	Very high	84.1	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	102.1	-175.9	-178.2	0	0	0	0	109.6	V175 R299 E303 V326 G327 V328	S173-V175 PolarHBondContact O-N 3.43Å; S173-R299 PolarHBondContact OG-NH2 2.7Å; S173-E303 WeakPolarHBondContact CB-OE1 3.47Å; S173-E303 PolarHBondContact OG-OE1 3.36Å; S173-V326 PolarHBondContact N-O 2.66Å; S173-G327 CarbonylContact O-C 3.54Å; S173-G327 VanDerWaalsContact O-CA 3.3Å; S173-G327 WeakPolarHBondContact O-CA 3.41Å; S173-V328 PolarHBondContact O-N 3.4Å
174	I	92.9	Very high	83.8	Confident	9 Å²	9	44 Å²	44	5%	0.046	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.1	-179.9	-66.7	100.3	0	0	0	111	I172 I206 V207 T208 V215 I219 R299 V328	I172-I174 HydrophobicContact CG2-CD1 3.98Å; I172-I174 HydrophobicContact CG2-CG1 4.46Å; I174-I206 HydrophobicContact CD1-CG2 3.47Å; I174-I206 VanDerWaalsContact CD1-CG2 3.47Å; I174-V207 PolarHBondContact N-O 2.89Å; I174-T208 HydrophobicContact CD1-CG2 4.29Å; I174-V215 HydrophobicContact CG2-CG1 3.59Å; I174-I219 HydrophobicContact CB-CD1 3.96Å; I174-I219 HydrophobicContact CD1-CD1 3.98Å; I174-I219 HydrophobicContact CG1-CD1 3.62Å; I174-I219 HydrophobicContact CG2-CD1 3.55Å; I174-R299 PolarHBondContact O-NH1 3.45Å; I174-R299 PolarHBondContact O-NH2 2.79Å; I174-V328 HydrophobicContact CG1-CB 4.44Å
175	V	89.4	Confident	83.6	Confident	12 Å²	12	41 Å²	41	7%	0.073	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.6	178.5	178.6	0	0	0	0	107.4	S173 V328 L329 L330 T336 T339 V340 L343	S173-V175 PolarHBondContact O-N 3.43Å; V175-V328 PolarHBondContact N-O 2.7Å; V175-V328 VanDerWaalsContact O-O 3.04Å; V175-L329 HydrophobicContact CG1-CD1 4.35Å; V175-L329 WeakPolarHBondContact O-CA 3.3Å; V175-L330 PolarHBondContact O-N 3.21Å; V175-L330 VanDerWaalsContact O-N 3.17Å; V175-T336 HydrophobicContact CG1-CG2 3.63Å; V175-T339 HydrophobicContact CG1-CG2 4.36Å; V175-V340 HydrophobicContact CG1-CG2 3.94Å; V175-L343 HydrophobicContact CG2-CD1 4.25Å
176	G	87.2	Confident	83.1	Confident	18 Å²	18	42.9 Å²	42.9	19%	0.186	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	-161.9	-174.5	0	0	0	0	0	115.8	L330 T336	G176-L330 WeakPolarHBondContact CA-O 3.25Å; G176-T336 VanDerWaalsContact O-CG2 3.23Å; G176-T336 WeakPolarHBondContact O-CG2 3.24Å; G176-T336 PolarHBondContact O-OG1 3.37Å
177	G	79.9	Confident	83.2	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.031	22%	0.221	C	C	.	.			trans	-78.4	141.6	179.2	0	0	0	0	0	114.6	A179 V215 E331	G177-A179 VanDerWaalsContact C-N 3.34Å; G177-V215 PolarHBondContact O-N 3.3Å; G177-E331 VanDerWaalsContact CA-OE2 3.29Å; G177-E331 WeakPolarHBondContact CA-OE2 3.29Å
178	L	78.7	Confident	83.4	Confident	86 Å²	86	36.1 Å²	36.1	45%	0.45	22%	0.217	S	C	.	.	S	Bend	trans	-93.2	9.3	166.4	-59.9	173.1	0	0	0	112.6	I213 F292	L178-I213 WeakPolarHBondContact O-CG2 3.28Å; L178-F292 HydrophobicContact CD1-CD1 3.76Å; L178-F292 HydrophobicContact CD1-CD2 4.2Å; L178-F292 HydrophobicContact CD1-CE1 3.47Å; L178-F292 VanDerWaalsContact CD1-CE1 3.47Å; L178-F292 HydrophobicContact CD1-CE2 3.93Å; L178-F292 HydrophobicContact CD1-CG 4.12Å; L178-F292 HydrophobicContact CD1-CZ 3.56Å; L178-F292 HydrophobicContact CD2-CE1 4.08Å; L178-F292 HydrophobicContact CD2-CE2 4.19Å; L178-F292 HydrophobicContact CD2-CZ 3.56Å; L178-F292 HydrophobicContact CG-CE1 4.39Å; L178-F292 HydrophobicContact CG-CZ 4.22Å
179	A	76.8	Confident	83.3	Confident	43 Å²	43	42 Å²	42	36%	0.355	24%	0.244	S	C	.	.	S	Bend	trans	-102.1	144	171.7	0	0	0	0	0	108.7	G177 A181 G214	G177-A179 VanDerWaalsContact C-N 3.34Å; A179-A181 PolarHBondContact O-N 2.95Å; A179-G214 WeakPolarHBondContact O-CA 3.42Å
180	N	70.1	Confident	83.3	Confident	81 Å²	81	41.8 Å²	41.8	43%	0.433	24%	0.244	S	C	.	.			trans	-75.5	74.7	171.2	-68	2.6	0	0	0	109.5	I213 G214	N180-I213 WeakPolarHBondContact OD1-CG2 3.28Å; N180-G214 PolarHBondContact OD1-N 3.31Å
181	A	71.6	Confident	83.2	Confident	33 Å²	33	42 Å²	42	27%	0.273	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-87.6	122.6	168.6	0	0	0	0	0	108.9	A179 L183 E331	A179-A181 PolarHBondContact O-N 2.95Å; A181-L183 PolarHBondContact O-N 3.1Å; A181-E331 HydrophobicContact CB-CG 4.06Å; A181-E331 WeakPolarHBondContact CB-OE1 3.5Å
182	P	75.7	Confident	83	Confident	120 Å²	120	43.8 Å²	43.8	78%	0.779	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-70	122.7	177.3	28.5	-33	0	0	0	109.9
183	L	81	Confident	82.6	Confident	19 Å²	19	49.5 Å²	49.5	10%	0.099	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-66.6	153.1	166.8	-67.4	172.2	0	0	0	110	A181 A185 Q188	A181-L183 PolarHBondContact O-N 3.1Å; L183-A185 PolarHBondContact O-N 3.3Å; L183-Q188 HydrophobicContact CB-CB 4.05Å
184	Q	82.1	Confident	82.3	Confident	124 Å²	124	49.7 Å²	49.7	58%	0.579	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-59.9	126	169.1	-178.9	-176.9	3.3	0	0	108.8	K186 L187 Q188	Q184-K186 PolarHBondContact O-N 3.5Å; Q184-L187 HydrophobicContact CB-CB 4.25Å; Q184-L187 CarbonylContact O-C 3.57Å; Q184-L187 WeakPolarHBondContact O-CA 3.37Å; Q184-L187 WeakPolarHBondContact O-CB 3.34Å; Q184-L187 PolarHBondContact O-N 2.53Å; Q184-Q188 PolarHBondContact O-N 3.32Å
185	A	80.8	Confident	82.2	Confident	68 Å²	68	49.4 Å²	49.4	56%	0.562	28%	0.281	S	S	*	.	H	α-helix	trans	-49.5	-39.4	-170.7	0	0	0	0	0	114.4	L183 Q188 Q189	L183-A185 PolarHBondContact O-N 3.3Å; A185-Q188 WeakPolarHBondContact O-CB 3.45Å; A185-Q188 PolarHBondContact O-N 3.45Å; A185-Q189 WeakPolarHBondContact O-CG 3.49Å; A185-Q189 PolarHBondContact O-N 3.02Å
186	K	78	Confident	82.1	Confident	54 Å²	54	50.4 Å²	50.4	24%	0.235	29%	0.286	C	S	.	.	H	α-helix	trans	-69.6	-38.6	177.6	-149.2	-165.8	170.2	-173.4	0	113.4	Q184 V190 M423 D1746	Q184-K186 PolarHBondContact O-N 3.5Å; K186-V190 PolarHBondContact O-N 2.77Å; K186-M423 HydrophobicContact CB-CE 4.24Å; K186-M423 HydrophobicContact CD-CE 3.53Å; K186-M423 HydrophobicContact CD-SD 4.5Å; K186-M423 HydrophobicContact CG-CE 3.66Å; K186-D1746 WeakPolarHBondContact CE-OD2 3.42Å; K186-D1746 IonicContact NZ-OD1 3.46Å; K186-D1746 PolarHBondContact NZ-OD1 3.48Å; K186-D1746 IonicContact NZ-OD2 3.51Å; K186-D1746 PolarHBondContact NZ-OD2 2.84Å
187	L	84.9	Confident	82.1	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-68.7	-38.5	172.4	179.6	62.4	0	0	0	110.6	Q184 V190 V191 G357 F421 M423	Q184-L187 HydrophobicContact CB-CB 4.25Å; Q184-L187 CarbonylContact O-C 3.57Å; Q184-L187 WeakPolarHBondContact O-CA 3.37Å; Q184-L187 WeakPolarHBondContact O-CB 3.34Å; Q184-L187 PolarHBondContact O-N 2.53Å; L187-V190 PolarHBondContact O-N 3.03Å; L187-V191 HydrophobicContact CD1-CG2 3.96Å; L187-V191 HydrophobicContact CG-CG2 4.23Å; L187-V191 VanDerWaalsContact O-CB 3.3Å; L187-V191 WeakPolarHBondContact O-CB 3.31Å; L187-V191 VanDerWaalsContact O-CG2 3.22Å; L187-V191 WeakPolarHBondContact O-CG2 3.4Å; L187-V191 PolarHBondContact O-N 2.86Å; L187-G357 WeakPolarHBondContact CD2-O 3.34Å; L187-F421 HydrophobicContact CD1-CE1 4.41Å; L187-M423 HydrophobicContact CB-SD 4.44Å
188	Q	84.7	Confident	82.5	Confident	39 Å²	39	53.5 Å²	53.5	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-57.2	-52.5	173.2	-175.5	179.4	-15.4	0	0	110.3	L183 Q184 A185 V190 V191 Q192 H218	L183-Q188 HydrophobicContact CB-CB 4.05Å; Q184-Q188 PolarHBondContact O-N 3.32Å; A185-Q188 WeakPolarHBondContact O-CB 3.45Å; A185-Q188 PolarHBondContact O-N 3.45Å; Q188-V190 PolarHBondContact O-N 3.33Å; Q188-V191 PolarHBondContact O-N 3.03Å; Q188-Q192 HydrophobicContact CG-CG 4.03Å; Q188-Q192 WeakPolarHBondContact O-CB 3.49Å; Q188-Q192 WeakPolarHBondContact O-CG 3.25Å; Q188-Q192 PolarHBondContact O-N 3.38Å; Q188-H218 PolarHBondContact NE2-ND1 2.86Å
189	Q	83.2	Confident	83	Confident	124 Å²	124	49.4 Å²	49.4	58%	0.579	27%	0.27	S	S	*	.	H	α-helix	trans	-55.4	-47.2	178.5	-74.7	170.9	-39.7	0	0	112.8	A185 Q192 H193	A185-Q189 WeakPolarHBondContact O-CG 3.49Å; A185-Q189 PolarHBondContact O-N 3.02Å; Q189-Q192 PolarHBondContact O-N 3.37Å; Q189-H193 WeakPolarHBondContact O-CB 3.11Å; Q189-H193 PolarHBondContact O-N 3.42Å
190	V	84.6	Confident	83.3	Confident	39 Å²	39	53.2 Å²	53.2	24%	0.236	28%	0.278	C	S	.	.	H	α-helix	trans	-66.6	-41.2	178.9	170.3	0	0	0	0	112.3	K186 L187 Q188 G194 F421 M423 I431	K186-V190 PolarHBondContact O-N 2.77Å; L187-V190 PolarHBondContact O-N 3.03Å; Q188-V190 PolarHBondContact O-N 3.33Å; V190-G194 PolarHBondContact O-N 3.44Å; V190-F421 HydrophobicContact CG1-CE1 4.02Å; V190-F421 HydrophobicContact CG1-CZ 3.81Å; V190-M423 HydrophobicContact CB-CE 4.39Å; V190-M423 HydrophobicContact CG2-CE 3.54Å; V190-I431 HydrophobicContact CG1-CG2 4.37Å; V190-I431 WeakPolarHBondContact O-CG2 3.33Å
191	V	87.4	Confident	83.9	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.03	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-45	176.1	167.7	0	0	0	0	111.1	L187 Q188 I195 L330 I431	L187-V191 HydrophobicContact CD1-CG2 3.96Å; L187-V191 HydrophobicContact CG-CG2 4.23Å; L187-V191 VanDerWaalsContact O-CB 3.3Å; L187-V191 WeakPolarHBondContact O-CB 3.31Å; L187-V191 VanDerWaalsContact O-CG2 3.22Å; L187-V191 WeakPolarHBondContact O-CG2 3.4Å; L187-V191 PolarHBondContact O-N 2.86Å; Q188-V191 PolarHBondContact O-N 3.03Å; V191-I195 HydrophobicContact CG1-CD1 3.71Å; V191-I195 VanDerWaalsContact O-CB 3.28Å; V191-I195 WeakPolarHBondContact O-CB 3.23Å; V191-I195 VanDerWaalsContact O-CG1 3.22Å; V191-I195 WeakPolarHBondContact O-CG1 3.45Å; V191-I195 PolarHBondContact O-N 3.5Å; V191-L330 HydrophobicContact CG1-CD1 3.71Å; V191-L330 HydrophobicContact CG1-CD2 3.86Å; V191-L330 HydrophobicContact CG1-CG 4.44Å; V191-L330 HydrophobicContact CG2-CD2 3.93Å; V191-I431 HydrophobicContact CG2-CD1 4.21Å
192	Q	87.9	Confident	84.5	Confident	38 Å²	38	50.9 Å²	50.9	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-56.1	179	-71	-175.8	-49.1	0	0	111.2	Q188 Q189 G194 L196 H218 A222	Q188-Q192 HydrophobicContact CG-CG 4.03Å; Q188-Q192 WeakPolarHBondContact O-CB 3.49Å; Q188-Q192 WeakPolarHBondContact O-CG 3.25Å; Q188-Q192 PolarHBondContact O-N 3.38Å; Q189-Q192 PolarHBondContact O-N 3.37Å; Q192-G194 PolarHBondContact O-N 2.84Å; Q192-L196 WeakPolarHBondContact O-CB 3.42Å; Q192-L196 PolarHBondContact O-N 2.76Å; Q192-L196 VanDerWaalsContact O-N 3.09Å; Q192-H218 WeakPolarHBondContact CG-O 3.12Å; Q192-H218 PolarHBondContact NE2-O 3.46Å; Q192-A222 HydrophobicContact CB-CB 3.62Å; Q192-A222 HydrophobicContact CG-CB 3.79Å
193	H	85.1	Confident	84.8	Confident	119 Å²	119	46.1 Å²	46.1	55%	0.551	24%	0.236	S	C	*	.	H	α-helix	trans	-63.7	-42.3	-178.1	-174.9	87	0	0	0	112.1	Q189 L196 R197	Q189-H193 WeakPolarHBondContact O-CB 3.11Å; Q189-H193 PolarHBondContact O-N 3.42Å; H193-L196 PolarHBondContact O-N 2.92Å; H193-R197 VanDerWaalsContact O-CB 3.24Å; H193-R197 WeakPolarHBondContact O-CB 3.26Å; H193-R197 PolarHBondContact O-N 2.81Å
194	G	86.4	Confident	85.1	Confident	6 Å²	6	45.2 Å²	45.2	6%	0.062	23%	0.231	C	C	.	.	H	α-helix	trans	-74.4	-34.2	-178.2	0	0	0	0	0	114.5	V190 Q192 R197 A198	V190-G194 PolarHBondContact O-N 3.44Å; Q192-G194 PolarHBondContact O-N 2.84Å; G194-R197 PolarHBondContact O-N 3.24Å; G194-A198 VanDerWaalsContact O-CB 3.3Å; G194-A198 WeakPolarHBondContact O-CB 3.35Å; G194-A198 PolarHBondContact O-N 3.08Å
195	I	90.5	Very high	85.6	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-42.6	170.4	-71.2	174	0	0	0	110.1	V191 A198 A199 I219 L330	V191-I195 HydrophobicContact CG1-CD1 3.71Å; V191-I195 VanDerWaalsContact O-CB 3.28Å; V191-I195 WeakPolarHBondContact O-CB 3.23Å; V191-I195 VanDerWaalsContact O-CG1 3.22Å; V191-I195 WeakPolarHBondContact O-CG1 3.45Å; V191-I195 PolarHBondContact O-N 3.5Å; I195-A198 PolarHBondContact O-N 3.25Å; I195-A199 WeakPolarHBondContact O-CB 3.3Å; I195-A199 PolarHBondContact O-N 2.94Å; I195-I219 HydrophobicContact CD1-CG1 4.47Å; I195-L330 HydrophobicContact CD1-CD1 4.33Å
196	L	88.3	Confident	86.2	Confident	33 Å²	33	36.3 Å²	36.3	17%	0.173	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-48.6	175.3	176.1	62.6	0	0	0	111.4	Q192 H193 A198 A199 K200 L223 E226 I234	Q192-L196 WeakPolarHBondContact O-CB 3.42Å; Q192-L196 PolarHBondContact O-N 2.76Å; Q192-L196 VanDerWaalsContact O-N 3.09Å; H193-L196 PolarHBondContact O-N 2.92Å; L196-A198 PolarHBondContact O-N 3.22Å; L196-A199 PolarHBondContact O-N 2.67Å; L196-A199 VanDerWaalsContact O-N 3.17Å; L196-K200 WeakPolarHBondContact O-CB 3.42Å; L196-K200 PolarHBondContact O-N 3.39Å; L196-L223 HydrophobicContact CD1-CD2 4.12Å; L196-E226 HydrophobicContact CD1-CB 4.48Å; L196-E226 HydrophobicContact CD1-CG 3.98Å; L196-E226 HydrophobicContact CD2-CG 4.47Å; L196-I234 HydrophobicContact CD1-CD1 3.72Å
197	R	86.3	Confident	87	Confident	86 Å²	86	33.8 Å²	33.8	33%	0.325	17%	0.167	S	C	.	.	H	α-helix	trans	-62.2	-40.8	178.6	-178.2	169.3	164.7	179.4	-11.7	112.6	H193 G194 A199 T201 E430 D432	H193-R197 VanDerWaalsContact O-CB 3.24Å; H193-R197 WeakPolarHBondContact O-CB 3.26Å; H193-R197 PolarHBondContact O-N 2.81Å; G194-R197 PolarHBondContact O-N 3.24Å; R197-A199 VanDerWaalsContact C-N 3.35Å; R197-A199 PolarHBondContact O-N 2.75Å; R197-T201 HydrophobicContact CG-CG2 4.38Å; R197-T201 WeakPolarHBondContact O-CB 3.47Å; R197-T201 WeakPolarHBondContact O-CG2 3.48Å; R197-T201 PolarHBondContact O-N 2.74Å; R197-T201 PolarHBondContact O-OG1 2.81Å; R197-E430 IonicContact CZ-OE1 3.76Å; R197-E430 IonicContact CZ-OE2 3.73Å; R197-E430 IonicContact NH1-OE1 2.86Å; R197-E430 PolarHBondContact NH1-OE1 3.31Å; R197-E430 IonicContact NH1-OE2 2.95Å; R197-E430 IonicContact NH2-OE1 2.67Å; R197-E430 PolarHBondContact NH2-OE1 2.97Å; R197-E430 IonicContact NH2-OE2 2.65Å; R197-E430 PolarHBondContact NH2-OE2 3.46Å; R197-D432 IonicContact NE-OD2 3.35Å
198	A	88.3	Confident	87.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.2	-43.4	172.6	0	0	0	0	0	111.9	I172 G194 I195 L196 T201 T202 D432	I172-A198 HydrophobicContact CD1-CB 4.03Å; G194-A198 VanDerWaalsContact O-CB 3.3Å; G194-A198 WeakPolarHBondContact O-CB 3.35Å; G194-A198 PolarHBondContact O-N 3.08Å; I195-A198 PolarHBondContact O-N 3.25Å; L196-A198 PolarHBondContact O-N 3.22Å; A198-T201 PolarHBondContact O-OG1 2.87Å; A198-T202 WeakPolarHBondContact O-CG2 3.41Å; A198-T202 PolarHBondContact O-N 3.16Å; A198-T202 PolarHBondContact O-OG1 3.49Å; A198-D432 HydrophobicContact CB-CB 3.69Å
199	A	88.8	Confident	87.6	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-70.9	-44.5	179.7	0	0	0	0	0	112.8	I195 L196 R197 G203 A204 I206 I234	I195-A199 WeakPolarHBondContact O-CB 3.3Å; I195-A199 PolarHBondContact O-N 2.94Å; L196-A199 PolarHBondContact O-N 2.67Å; L196-A199 VanDerWaalsContact O-N 3.17Å; R197-A199 VanDerWaalsContact C-N 3.35Å; R197-A199 PolarHBondContact O-N 2.75Å; A199-G203 WeakPolarHBondContact O-CA 3.47Å; A199-G203 PolarHBondContact O-N 3.48Å; A199-A204 HydrophobicContact CB-CB 4.32Å; A199-A204 PolarHBondContact O-N 2.83Å; A199-I206 HydrophobicContact CB-CD1 3.74Å; A199-I206 HydrophobicContact CB-CG1 4.08Å; A199-I234 HydrophobicContact CB-CG2 4.26Å
200	K	83.3	Confident	87.9	Confident	124 Å²	124	26.7 Å²	26.7	54%	0.539	14%	0.135	S	C	.	.	H	α-helix	trans	-65	-45.1	-179.5	-170.4	172.7	-173.1	168.7	0	112.4	L196 E226 I234	L196-K200 WeakPolarHBondContact O-CB 3.42Å; L196-K200 PolarHBondContact O-N 3.39Å; K200-E226 VanDerWaalsContact CD-OE1 3.31Å; K200-E226 WeakPolarHBondContact CD-OE1 3.11Å; K200-E226 VanDerWaalsContact CE-OE1 3.23Å; K200-E226 WeakPolarHBondContact CE-OE1 3.31Å; K200-E226 IonicContact NZ-OE1 2.68Å; K200-E226 PolarHBondContact NZ-OE1 3.44Å; K200-I234 HydrophobicContact CB-CD1 4.14Å
201	T	82.6	Confident	88.1	Confident	59 Å²	59	25 Å²	25	36%	0.362	12%	0.124	S	C	.	.	H	α-helix	trans	-70.3	-37	-178.9	53.1	0	0	0	0	113.1	R197 A198	R197-T201 HydrophobicContact CG-CG2 4.38Å; R197-T201 WeakPolarHBondContact O-CB 3.47Å; R197-T201 WeakPolarHBondContact O-CG2 3.48Å; R197-T201 PolarHBondContact O-N 2.74Å; R197-T201 PolarHBondContact O-OG1 2.81Å; A198-T201 PolarHBondContact O-OG1 2.87Å
202	T	84.3	Confident	88.2	Confident	5 Å²	5	25.4 Å²	25.4	3%	0.031	13%	0.126	C	C	.	.	H	α-helix	trans	-95.2	-20.8	-175.5	64.7	0	0	0	0	114.9	N169 L170 A198 L436 W459	N169-T202 VanDerWaalsContact CB-O 3.3Å; N169-T202 WeakPolarHBondContact CB-O 3Å; N169-T202 PolarHBondContact ND2-O 2.98Å; L170-T202 HydrophobicContact CD2-CG2 4.35Å; A198-T202 WeakPolarHBondContact O-CG2 3.41Å; A198-T202 PolarHBondContact O-N 3.16Å; A198-T202 PolarHBondContact O-OG1 3.49Å; T202-L436 HydrophobicContact CG2-CD1 4.17Å; T202-L436 HydrophobicContact CG2-CD2 3.93Å; T202-W459 HydrophobicContact CG2-CB 3.83Å; T202-W459 HydrophobicContact CG2-CG 3.86Å
203	G	81.7	Confident	88.1	Confident	20 Å²	20	24 Å²	24	21%	0.206	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	47.6	-166.8	0	0	0	0	0	111.8	A199	A199-G203 WeakPolarHBondContact O-CA 3.47Å; A199-G203 PolarHBondContact O-N 3.48Å
204	A	88.5	Confident	88.1	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.			trans	-80.3	150.8	-177.8	0	0	0	0	0	113.2	L170 I172 A199	L170-A204 HydrophobicContact CB-CB 3.95Å; L170-A204 HydrophobicContact CD2-CB 4.18Å; L170-A204 HydrophobicContact CG-CB 4.03Å; L170-A204 CarbonylContact O-C 3.58Å; L170-A204 VanDerWaalsContact O-CA 3.24Å; L170-A204 WeakPolarHBondContact O-CA 3.4Å; I172-A204 HydrophobicContact CD1-CB 3.89Å; I172-A204 HydrophobicContact CG1-CB 4.19Å; A199-A204 HydrophobicContact CB-CB 4.32Å; A199-A204 PolarHBondContact O-N 2.83Å
205	W	92.1	Very high	88.2	Confident	5 Å²	5	18.7 Å²	18.7	2%	0.019	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	132.3	160	-71	13.4	0	0	0	109.6	L159 L160 I165 R166 P168 L170 V171 I172 V235 L306	L159-W205 HydrophobicContact CB-CH2 4.08Å; L159-W205 HydrophobicContact CD1-CH2 3.75Å; L159-W205 HydrophobicContact CD1-CZ3 3.57Å; L160-W205 HydrophobicContact CD2-CH2 4.31Å; L160-W205 HydrophobicContact CD2-CZ2 4.32Å; I165-W205 HydrophobicContact CB-CZ2 4.14Å; I165-W205 HydrophobicContact CG2-CZ2 3.55Å; R166-W205 VanDerWaalsContact O-CZ2 3.29Å; R166-W205 WeakPolarHBondContact O-CZ2 3.38Å; R166-W205 PolarHBondContact O-NE1 3.25Å; P168-W205 HydrophobicContact CB-CB 4.24Å; P168-W205 HydrophobicContact CB-CD2 3.98Å; P168-W205 HydrophobicContact CB-CG 3.69Å; P168-W205 HydrophobicContact CG-CD2 3.7Å; P168-W205 HydrophobicContact CG-CE3 4.03Å; P168-W205 HydrophobicContact CG-CG 3.97Å; P168-W205 HydrophobicContact CG-CZ2 4.34Å; P168-W205 HydrophobicContact CG-CZ3 4.47Å; L170-W205 PolarHBondContact O-N 3.45Å; V171-W205 WeakPolarHBondContact CA-O 3.45Å; V171-W205 HydrophobicContact CG2-CB 4.47Å; I172-W205 PolarHBondContact N-O 3.07Å; W205-V235 WeakPolarHBondContact CA-O 3.5Å; W205-V235 HydrophobicContact CB-CB 4.45Å; W205-V235 VanDerWaalsContact CD1-CB 3.44Å; W205-V235 HydrophobicContact CD2-CG1 4.13Å; W205-V235 HydrophobicContact CG-CB 3.9Å; W205-V235 HydrophobicContact CG-CG1 3.95Å; W205-L306 HydrophobicContact CE3-CD1 4.2Å; W205-L306 HydrophobicContact CE3-CD2 4.47Å; W205-L306 HydrophobicContact CH2-CD2 4.44Å; W205-L306 HydrophobicContact CZ3-CD1 4.11Å; W205-L306 HydrophobicContact CZ3-CD2 3.87Å
206	I	94.1	Very high	88.2	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116	177.2	-57.7	176.7	0	0	0	107.8	I174 A199 T208 I219 L223 I234 V235 L237	I174-I206 HydrophobicContact CD1-CG2 3.47Å; I174-I206 VanDerWaalsContact CD1-CG2 3.47Å; A199-I206 HydrophobicContact CB-CD1 3.74Å; A199-I206 HydrophobicContact CB-CG1 4.08Å; I206-T208 HydrophobicContact CG2-CG2 3.99Å; I206-I219 HydrophobicContact CG2-CG2 4.31Å; I206-L223 HydrophobicContact CD1-CD1 3.94Å; I206-L223 HydrophobicContact CD1-CD2 3.61Å; I206-L223 HydrophobicContact CD1-CG 4.35Å; I206-I234 HydrophobicContact CD1-CG2 3.93Å; I206-V235 PolarHBondContact N-O 2.99Å; I206-L237 PolarHBondContact O-N 3.33Å
207	V	93.9	Very high	88.2	Confident	2 Å²	2	22 Å²	22	1%	0.012	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.5	-177.7	-174.3	0	0	0	0	110.2	V171 I172 I174 L237 I239 R299	V171-V207 HydrophobicContact CG1-CG2 3.65Å; I172-V207 PolarHBondContact O-N 2.77Å; I174-V207 PolarHBondContact N-O 2.89Å; V207-L237 HydrophobicContact CG2-CD2 4.48Å; V207-I239 HydrophobicContact CG1-CD1 3.76Å; V207-I239 HydrophobicContact CG1-CG1 4.21Å; V207-R299 HydrophobicContact CG1-CG 4.28Å; V207-R299 PolarHBondContact O-NH2 3.26Å
208	T	92.9	Very high	88.2	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.006	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	-171.4	-176.5	78.3	0	0	0	0	111.4	I174 I206 G210 L237 I239 H278 R299	I174-T208 HydrophobicContact CD1-CG2 4.29Å; I206-T208 HydrophobicContact CG2-CG2 3.99Å; T208-G210 PolarHBondContact OG1-N 3.01Å; T208-L237 PolarHBondContact N-O 2.71Å; T208-I239 PolarHBondContact O-N 2.79Å; T208-I239 VanDerWaalsContact O-N 3.1Å; T208-H278 VanDerWaalsContact CG2-NE2 3.28Å; T208-H278 WeakPolarHBondContact CG2-NE2 3.48Å; T208-H278 PolarHBondContact OG1-CD2 2.93Å; T208-H278 VanDerWaalsContact OG1-CD2 3.31Å; T208-H278 PolarHBondContact OG1-NE2 3.1Å; T208-R299 PolarHBondContact O-NH1 3.17Å
209	N	89.2	Confident	88.3	Confident	16 Å²	16	19.5 Å²	19.5	9%	0.086	10%	0.099	C	C	.	.			trans	-89.9	-1.1	169.8	-140.4	-68	0	0	0	112.6	L211 I239 A240 P241 F292	N209-L211 PolarHBondContact O-N 3.3Å; N209-I239 PolarHBondContact OD1-O 3.29Å; N209-A240 WeakPolarHBondContact O-CB 3.45Å; N209-P241 WeakPolarHBondContact OD1-CD 3.42Å; N209-F292 WeakPolarHBondContact OD1-CZ 3.34Å
210	G	89.4	Confident	88.2	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.099	C	C	.	.			trans	65.7	-11.1	176.4	0	0	0	0	0	118.2	T208 N275	T208-G210 PolarHBondContact OG1-N 3.01Å; G210-N275 PolarHBondContact O-N 2.94Å
211	L	89.4	Confident	88.2	Confident	3 Å²	3	16.9 Å²	16.9	2%	0.016	9%	0.089	C	C	.	.	B	Isolated β-bridge	trans	-84.6	144.4	177.6	-57.1	176	0	0	0	111.4	N209 I213 T216 A240 Y244 V245 A272 P273 L274 F292	N209-L211 PolarHBondContact O-N 3.3Å; L211-I213 PolarHBondContact O-N 2.87Å; L211-T216 VanDerWaalsContact O-CB 3.23Å; L211-T216 WeakPolarHBondContact O-CB 3.29Å; L211-T216 WeakPolarHBondContact O-CG2 3.3Å; L211-A240 HydrophobicContact CD2-CB 3.66Å; L211-A240 HydrophobicContact CG-CB 3.84Å; L211-Y244 HydrophobicContact CD1-CD1 3.71Å; L211-Y244 HydrophobicContact CD1-CE1 4.24Å; L211-V245 HydrophobicContact CD2-CG2 4.3Å; L211-A272 HydrophobicContact CB-CB 4.15Å; L211-A272 HydrophobicContact CD1-CB 3.9Å; L211-A272 HydrophobicContact CD2-CB 3.91Å; L211-A272 HydrophobicContact CG-CB 4.19Å; L211-P273 WeakPolarHBondContact CA-O 3.14Å; L211-L274 HydrophobicContact CD2-CD2 4.28Å; L211-F292 HydrophobicContact CD1-CE2 3.75Å; L211-F292 HydrophobicContact CD1-CZ 4.24Å
212	D	88.7	Confident	88.3	Confident	15 Å²	15	14.7 Å²	14.7	8%	0.08	8%	0.077	C	C	.	.	S	Bend	trans	-77.8	56	175.7	-161.5	59.8	0	0	0	112.9	R217 P273 N275	D212-R217 WeakPolarHBondContact OD1-CG 3.39Å; D212-R217 IonicContact OD2-NH1 2.74Å; D212-R217 PolarHBondContact OD2-NH1 3.23Å; D212-P273 HydrophobicContact CB-CG 4.06Å; D212-P273 PolarHBondContact N-O 3.47Å; D212-N275 HydrophobicContact CB-CB 4.01Å; D212-N275 PolarHBondContact OD1-ND2 2.93Å
213	I	86.8	Confident	88.4	Confident	7 Å²	7	14.7 Å²	14.7	4%	0.036	8%	0.076	C	C	.	.	S	Bend	trans	-138.9	139.5	-178.2	-56.6	-174.5	0	0	0	110.4	L178 N180 L211 T216 W265 A272	L178-I213 WeakPolarHBondContact O-CG2 3.28Å; N180-I213 WeakPolarHBondContact OD1-CG2 3.28Å; L211-I213 PolarHBondContact O-N 2.87Å; I213-T216 PolarHBondContact O-N 3.22Å; I213-W265 HydrophobicContact CD1-CB 4.13Å; I213-W265 HydrophobicContact CD1-CD2 4.05Å; I213-W265 HydrophobicContact CD1-CG 3.59Å; I213-W265 HydrophobicContact CG1-CB 4.04Å; I213-W265 HydrophobicContact CG1-CD2 4.5Å; I213-W265 HydrophobicContact CG1-CG 3.99Å; I213-A272 HydrophobicContact CD1-CB 3.34Å; I213-A272 HydrophobicContact CG1-CB 4.12Å
214	G	85.1	Confident	88.3	Confident	5 Å²	5	18.4 Å²	18.4	5%	0.052	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	-136.2	174.1	0	0	0	0	0	112.5	A179 N180 T216 R217	A179-G214 WeakPolarHBondContact O-CA 3.42Å; N180-G214 PolarHBondContact OD1-N 3.31Å; G214-T216 PolarHBondContact O-N 2.88Å; G214-R217 WeakPolarHBondContact O-CB 3.38Å; G214-R217 PolarHBondContact O-N 3.49Å; G214-R217 VanDerWaalsContact O-N 3.13Å
215	V	88.5	Confident	87.5	Confident	9 Å²	9	24.1 Å²	24.1	6%	0.055	12%	0.117	C	C	.	.	H	α-helix	trans	-57.6	-34.2	-176.1	176	0	0	0	0	112.8	I174 G177 R217 H218 I219 L330 E331	I174-V215 HydrophobicContact CG2-CG1 3.59Å; G177-V215 PolarHBondContact O-N 3.3Å; V215-R217 VanDerWaalsContact C-N 3.26Å; V215-R217 PolarHBondContact O-N 2.99Å; V215-H218 PolarHBondContact O-N 3.1Å; V215-I219 HydrophobicContact CG1-CD1 3.9Å; V215-I219 PolarHBondContact O-N 3.27Å; V215-L330 HydrophobicContact CG1-CB 3.72Å; V215-L330 HydrophobicContact CG1-CD1 3.64Å; V215-L330 HydrophobicContact CG1-CG 4.32Å; V215-L330 HydrophobicContact CG2-CB 3.91Å; V215-L330 WeakPolarHBondContact CG2-O 3.32Å; V215-E331 HydrophobicContact CG2-CB 4.27Å
216	T	89.8	Confident	86.4	Confident	12 Å²	12	25 Å²	25	7%	0.074	12%	0.122	C	C	.	.	H	α-helix	trans	-60.3	-37.7	-179.5	-49.6	0	0	0	0	111.9	L211 I213 G214 I219 G220	L211-T216 VanDerWaalsContact O-CB 3.23Å; L211-T216 WeakPolarHBondContact O-CB 3.29Å; L211-T216 WeakPolarHBondContact O-CG2 3.3Å; I213-T216 PolarHBondContact O-N 3.22Å; G214-T216 PolarHBondContact O-N 2.88Å; T216-I219 PolarHBondContact O-N 2.88Å; T216-G220 PolarHBondContact O-N 2.99Å
217	R	88.1	Confident	84.9	Confident	94 Å²	94	26.6 Å²	26.6	36%	0.355	13%	0.132	S	C	.	.	H	α-helix	trans	-66.2	-45.6	179	173.2	179.1	165.6	121.7	5.9	112	D212 G214 V215 I219 G220 E221	D212-R217 WeakPolarHBondContact OD1-CG 3.39Å; D212-R217 IonicContact OD2-NH1 2.74Å; D212-R217 PolarHBondContact OD2-NH1 3.23Å; G214-R217 WeakPolarHBondContact O-CB 3.38Å; G214-R217 PolarHBondContact O-N 3.49Å; G214-R217 VanDerWaalsContact O-N 3.13Å; V215-R217 VanDerWaalsContact C-N 3.26Å; V215-R217 PolarHBondContact O-N 2.99Å; R217-I219 PolarHBondContact O-N 2.99Å; R217-I219 VanDerWaalsContact O-N 3.13Å; R217-G220 PolarHBondContact O-N 3.44Å; R217-G220 VanDerWaalsContact O-N 3.09Å; R217-E221 HydrophobicContact CG-CG 4.34Å; R217-E221 IonicContact CZ-OE1 3.49Å; R217-E221 VanDerWaalsContact CZ-OE1 3.27Å; R217-E221 IonicContact NE-OE1 2.76Å; R217-E221 PolarHBondContact NE-OE1 3.13Å; R217-E221 IonicContact NH2-OE1 2.68Å; R217-E221 PolarHBondContact NH2-OE1 3Å; R217-E221 WeakPolarHBondContact O-CB 3.41Å; R217-E221 WeakPolarHBondContact O-CG 3.47Å; R217-E221 PolarHBondContact O-N 3.33Å
218	H	87.5	Confident	83.2	Confident	29 Å²	29	30 Å²	30	13%	0.134	15%	0.147	C	C	.	.	H	α-helix	trans	-60.5	-24.2	177.4	-70.1	-46.5	0	0	0	113.1	Q188 Q192 V215 E221 A222	Q188-H218 PolarHBondContact NE2-ND1 2.86Å; Q192-H218 WeakPolarHBondContact CG-O 3.12Å; Q192-H218 PolarHBondContact NE2-O 3.46Å; V215-H218 PolarHBondContact O-N 3.1Å; H218-E221 IonicContact ND1-OE2 3.71Å; H218-E221 PolarHBondContact ND1-OE2 3.44Å; H218-E221 VanDerWaalsContact ND1-OE2 3.15Å; H218-A222 PolarHBondContact O-N 3.19Å
219	I	89.2	Confident	81.6	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-86.7	-35.3	175.3	-68.3	156.4	0	0	0	111.6	I174 I195 I206 V215 T216 R217 E221 A222 L223 L330	I174-I219 HydrophobicContact CB-CD1 3.96Å; I174-I219 HydrophobicContact CD1-CD1 3.98Å; I174-I219 HydrophobicContact CG1-CD1 3.62Å; I174-I219 HydrophobicContact CG2-CD1 3.55Å; I195-I219 HydrophobicContact CD1-CG1 4.47Å; I206-I219 HydrophobicContact CG2-CG2 4.31Å; V215-I219 HydrophobicContact CG1-CD1 3.9Å; V215-I219 PolarHBondContact O-N 3.27Å; T216-I219 PolarHBondContact O-N 2.88Å; R217-I219 PolarHBondContact O-N 2.99Å; R217-I219 VanDerWaalsContact O-N 3.13Å; I219-E221 VanDerWaalsContact C-N 3.33Å; I219-A222 WeakPolarHBondContact O-CA 3.44Å; I219-A222 WeakPolarHBondContact O-CB 3.08Å; I219-A222 PolarHBondContact O-N 3.24Å; I219-L223 HydrophobicContact CG2-CD1 3.86Å; I219-L223 HydrophobicContact CG2-CG 4.42Å; I219-L223 WeakPolarHBondContact O-CG 3.49Å; I219-L223 PolarHBondContact O-N 3.42Å; I219-L223 VanDerWaalsContact O-N 3.07Å; I219-L330 HydrophobicContact CD1-CD1 4.48Å
220	G	87.1	Confident	79.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.1	-47	168	0	0	0	0	0	111.5	T216 R217 A222 L223 K224 D277	T216-G220 PolarHBondContact O-N 2.99Å; R217-G220 PolarHBondContact O-N 3.44Å; R217-G220 VanDerWaalsContact O-N 3.09Å; G220-A222 PolarHBondContact O-N 3.02Å; G220-L223 PolarHBondContact O-N 3.27Å; G220-K224 PolarHBondContact O-N 3.14Å; G220-D277 VanDerWaalsContact C-OD2 3.31Å; G220-D277 WeakPolarHBondContact CA-OD2 3.26Å; G220-D277 WeakPolarHBondContact O-CB 3.44Å
221	E	83.8	Confident	77.8	Confident	68 Å²	68	48.8 Å²	48.8	32%	0.318	24%	0.244	S	C	.	.	H	α-helix	trans	-55.6	-21.5	171.2	-71.3	170.6	173.2	0	0	113.4	R217 H218 I219	R217-E221 HydrophobicContact CG-CG 4.34Å; R217-E221 IonicContact CZ-OE1 3.49Å; R217-E221 VanDerWaalsContact CZ-OE1 3.27Å; R217-E221 IonicContact NE-OE1 2.76Å; R217-E221 PolarHBondContact NE-OE1 3.13Å; R217-E221 IonicContact NH2-OE1 2.68Å; R217-E221 PolarHBondContact NH2-OE1 3Å; R217-E221 WeakPolarHBondContact O-CB 3.41Å; R217-E221 WeakPolarHBondContact O-CG 3.47Å; R217-E221 PolarHBondContact O-N 3.33Å; H218-E221 IonicContact ND1-OE2 3.71Å; H218-E221 PolarHBondContact ND1-OE2 3.44Å; H218-E221 VanDerWaalsContact ND1-OE2 3.15Å; I219-E221 VanDerWaalsContact C-N 3.33Å
222	A	85.2	Confident	76.5	Confident	14 Å²	14	50.4 Å²	50.4	12%	0.116	26%	0.255	C	S	.	.	H	α-helix	trans	-93.8	-19.2	176	0	0	0	0	0	114.6	Q192 H218 I219 G220	Q192-A222 HydrophobicContact CB-CB 3.62Å; Q192-A222 HydrophobicContact CG-CB 3.79Å; H218-A222 PolarHBondContact O-N 3.19Å; I219-A222 WeakPolarHBondContact O-CA 3.44Å; I219-A222 WeakPolarHBondContact O-CB 3.08Å; I219-A222 PolarHBondContact O-N 3.24Å; G220-A222 PolarHBondContact O-N 3.02Å
223	L	85.6	Confident	75.6	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-100.6	-20.7	-177.5	-68.2	170.3	0	0	0	112.5	L196 I206 I219 G220 D225 E226 V227 I234 A236	L196-L223 HydrophobicContact CD1-CD2 4.12Å; I206-L223 HydrophobicContact CD1-CD1 3.94Å; I206-L223 HydrophobicContact CD1-CD2 3.61Å; I206-L223 HydrophobicContact CD1-CG 4.35Å; I219-L223 HydrophobicContact CG2-CD1 3.86Å; I219-L223 HydrophobicContact CG2-CG 4.42Å; I219-L223 WeakPolarHBondContact O-CG 3.49Å; I219-L223 PolarHBondContact O-N 3.42Å; I219-L223 VanDerWaalsContact O-N 3.07Å; G220-L223 PolarHBondContact O-N 3.27Å; L223-D225 VanDerWaalsContact C-N 3.25Å; L223-D225 PolarHBondContact O-N 2.87Å; L223-D225 VanDerWaalsContact O-N 3.08Å; L223-E226 PolarHBondContact O-N 3.44Å; L223-V227 HydrophobicContact CB-CG2 4.31Å; L223-V227 WeakPolarHBondContact O-CG2 3.39Å; L223-V227 PolarHBondContact O-N 3.29Å; L223-I234 HydrophobicContact CD2-CG2 4.13Å; L223-A236 HydrophobicContact CD1-CB 4.02Å
224	K	79.2	Confident	75.4	Confident	99 Å²	99	54.3 Å²	54.3	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-39.2	-48.9	-177.5	-175.3	-174.8	173.6	-158.6	0	114	G220 H228	G220-K224 PolarHBondContact O-N 3.14Å; K224-H228 PolarHBondContact O-CE1 2.94Å; K224-H228 PolarHBondContact O-ND1 2.76Å
225	D	71.9	Confident	75.5	Confident	119 Å²	119	54.8 Å²	54.8	64%	0.636	28%	0.278	S	S	*	.	H	α-helix	trans	-71	-39.6	-174	-55	-28.2	0	0	0	111.8	L223 H228	L223-D225 VanDerWaalsContact C-N 3.25Å; L223-D225 PolarHBondContact O-N 2.87Å; L223-D225 VanDerWaalsContact O-N 3.08Å; D225-H228 PolarHBondContact O-N 2.9Å
226	E	69.8	Low	75.7	Confident	25 Å²	25	54.4 Å²	54.4	12%	0.117	28%	0.276	C	S	.	.	H	α-helix	trans	-79.5	-21.4	-179	-70.3	-109.3	-178.8	0	0	113.7	L196 K200 L223 H228 I229 S232 I234	L196-E226 HydrophobicContact CD1-CB 4.48Å; L196-E226 HydrophobicContact CD1-CG 3.98Å; L196-E226 HydrophobicContact CD2-CG 4.47Å; K200-E226 VanDerWaalsContact CD-OE1 3.31Å; K200-E226 WeakPolarHBondContact CD-OE1 3.11Å; K200-E226 VanDerWaalsContact CE-OE1 3.23Å; K200-E226 WeakPolarHBondContact CE-OE1 3.31Å; K200-E226 IonicContact NZ-OE1 2.68Å; K200-E226 PolarHBondContact NZ-OE1 3.44Å; L223-E226 PolarHBondContact O-N 3.44Å; E226-H228 PolarHBondContact O-N 2.68Å; E226-I229 HydrophobicContact CG-CD1 4.34Å; E226-I229 PolarHBondContact O-N 3.18Å; E226-S232 PolarHBondContact O-OG 3.48Å; E226-I234 HydrophobicContact CB-CD1 4.44Å
227	V	61.3	Low	75.8	Confident	33 Å²	33	53.9 Å²	53.9	20%	0.2	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-23.1	170.9	169.6	0	0	0	0	111.8	T139 L223 D277	T139-V227 HydrophobicContact CG2-CG1 4.08Å; L223-V227 HydrophobicContact CB-CG2 4.31Å; L223-V227 WeakPolarHBondContact O-CG2 3.39Å; L223-V227 PolarHBondContact O-N 3.29Å; V227-D277 WeakPolarHBondContact CG2-O 3.25Å
228	H	59.3	Low	76.1	Confident	73 Å²	73	49.4 Å²	49.4	34%	0.338	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-16.7	175.8	-66.5	78.7	0	0	0	113.3	K224 D225 E226 R230	K224-H228 PolarHBondContact O-CE1 2.94Å; K224-H228 PolarHBondContact O-ND1 2.76Å; D225-H228 PolarHBondContact O-N 2.9Å; E226-H228 PolarHBondContact O-N 2.68Å; H228-R230 PolarHBondContact O-N 3.44Å
229	I	58.2	Low	76.4	Confident	91 Å²	91	48.1 Å²	48.1	47%	0.467	25%	0.25	S	C	.	.	S	Bend	trans	-81.9	108.2	-177.5	-56.9	177.1	0	0	0	110.1	E226 G231 S232	E226-I229 HydrophobicContact CG-CD1 4.34Å; E226-I229 PolarHBondContact O-N 3.18Å; I229-G231 PolarHBondContact O-N 2.63Å; I229-S232 PolarHBondContact O-N 3.07Å; I229-S232 PolarHBondContact O-OG 3.06Å
230	R	47.8	Very low	76.6	Confident	252 Å²	252	47.9 Å²	47.9	95%	0.951	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	108.4	174.4	-76.3	-174.3	176	178.9	1.7	110.7	H228	H228-R230 PolarHBondContact O-N 3.44Å
231	G	52.8	Low	76.9	Confident	69 Å²	69	48 Å²	48	71%	0.711	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	115.2	-0	177.5	0	0	0	0	0	114.9	I229 N233	I229-G231 PolarHBondContact O-N 2.63Å; G231-N233 PolarHBondContact O-N 3.06Å
232	S	60.2	Low	77.2	Confident	36 Å²	36	45.4 Å²	45.4	25%	0.252	24%	0.237	S	C	.	.			trans	-56.5	130.2	173.6	60.3	0	0	0	0	111.4	E226 I229 I234	E226-S232 PolarHBondContact O-OG 3.48Å; I229-S232 PolarHBondContact O-N 3.07Å; I229-S232 PolarHBondContact O-OG 3.06Å; S232-I234 PolarHBondContact O-N 3.05Å
233	N	69.9	Low	77.2	Confident	93 Å²	93	44.9 Å²	44.9	50%	0.497	23%	0.232	S	C	.	.			trans	-79.3	6.1	-179.1	-73.9	-74.7	0	0	0	113.2	R166 G231	R166-N233 PolarHBondContact NH1-OD1 3.35Å; G231-N233 PolarHBondContact O-N 3.06Å
234	I	82.3	Confident	77.3	Confident	11 Å²	11	46.8 Å²	46.8	6%	0.056	24%	0.24	C	C	.	.			trans	-86.7	130.6	-171.7	-56.1	177	0	0	0	110.3	L196 A199 K200 I206 L223 E226 S232 N279	L196-I234 HydrophobicContact CD1-CD1 3.72Å; A199-I234 HydrophobicContact CB-CG2 4.26Å; K200-I234 HydrophobicContact CB-CD1 4.14Å; I206-I234 HydrophobicContact CD1-CG2 3.93Å; L223-I234 HydrophobicContact CD2-CG2 4.13Å; E226-I234 HydrophobicContact CB-CD1 4.44Å; S232-I234 PolarHBondContact O-N 3.05Å; I234-N279 PolarHBondContact O-ND2 3.28Å
235	V	88.4	Confident	77.8	Confident	15 Å²	15	42.1 Å²	42.1	9%	0.091	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	99.2	-177.4	178.1	0	0	0	0	109.7	I165 W205 I206 Y280	I165-V235 HydrophobicContact CD1-CG1 4.43Å; I165-V235 HydrophobicContact CG2-CG1 4.1Å; I165-V235 HydrophobicContact CG2-CG2 3.71Å; W205-V235 WeakPolarHBondContact CA-O 3.5Å; W205-V235 HydrophobicContact CB-CB 4.45Å; W205-V235 VanDerWaalsContact CD1-CB 3.44Å; W205-V235 HydrophobicContact CD2-CG1 4.13Å; W205-V235 HydrophobicContact CG-CB 3.9Å; W205-V235 HydrophobicContact CG-CG1 3.95Å; I206-V235 PolarHBondContact N-O 2.99Å; V235-Y280 HydrophobicContact CG1-CD2 3.82Å; V235-Y280 HydrophobicContact CG1-CE2 3.92Å
236	A	91.5	Very high	78.6	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.008	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	116.1	172.4	0	0	0	0	0	110.8	L223 H278 N279 Y280	L223-A236 HydrophobicContact CD1-CB 4.02Å; A236-H278 HydrophobicContact CB-CB 4.38Å; A236-N279 PolarHBondContact O-N 3.43Å; A236-Y280 PolarHBondContact O-N 2.8Å; A236-Y280 VanDerWaalsContact O-N 3.11Å
237	L	93.7	Very high	79.3	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	104.6	-175.5	-175.8	67.2	0	0	0	110.9	L159 I206 V207 T208 I239 L282 L302	L159-L237 HydrophobicContact CD1-CD2 4.35Å; L159-L237 HydrophobicContact CD2-CD1 4.31Å; I206-L237 PolarHBondContact O-N 3.33Å; V207-L237 HydrophobicContact CG2-CD2 4.48Å; T208-L237 PolarHBondContact N-O 2.71Å; L237-I239 HydrophobicContact CG-CG1 4.43Å; L237-L282 HydrophobicContact CD1-CD1 4.26Å; L237-L282 HydrophobicContact CD1-CG 4.06Å; L237-L282 HydrophobicContact CD2-CD1 4.38Å; L237-L302 HydrophobicContact CD2-CD2 4.28Å
238	G	93.6	Very high	80.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.5	175.4	0	0	0	0	0	112.1	Y280 F281 L282	G238-Y280 PolarHBondContact N-O 2.86Å; G238-F281 WeakPolarHBondContact O-CA 3.42Å; G238-L282 PolarHBondContact O-N 2.84Å
239	I	94.7	Very high	81.9	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	86.1	175.7	-48.6	-175.8	0	0	0	109.6	V207 T208 N209 L237 L282 E295 L298 R299 L302	V207-I239 HydrophobicContact CG1-CD1 3.76Å; V207-I239 HydrophobicContact CG1-CG1 4.21Å; T208-I239 PolarHBondContact O-N 2.79Å; T208-I239 VanDerWaalsContact O-N 3.1Å; N209-I239 PolarHBondContact OD1-O 3.29Å; L237-I239 HydrophobicContact CG-CG1 4.43Å; I239-L282 CarbonylContact C-O 3.58Å; I239-L282 WeakPolarHBondContact CA-O 3.28Å; I239-L282 HydrophobicContact CD1-CD1 4.49Å; I239-L282 HydrophobicContact CG1-CB 4.49Å; I239-L282 HydrophobicContact CG1-CD1 4.43Å; I239-L282 HydrophobicContact CG2-CB 4.36Å; I239-E295 HydrophobicContact CG2-CB 4.2Å; I239-L298 HydrophobicContact CG2-CD2 3.8Å; I239-R299 HydrophobicContact CD1-CB 3.88Å; I239-R299 HydrophobicContact CD1-CG 3.96Å; I239-R299 HydrophobicContact CG2-CB 4.49Å; I239-L302 HydrophobicContact CD1-CD2 4.07Å
240	A	92.5	Very high	83.2	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	127.6	177.4	0	0	0	0	0	118.7	N209 L211 W242 L282 L283 A284	N209-A240 WeakPolarHBondContact O-CB 3.45Å; L211-A240 HydrophobicContact CD2-CB 3.66Å; L211-A240 HydrophobicContact CG-CB 3.84Å; A240-W242 PolarHBondContact O-N 2.82Å; A240-L282 PolarHBondContact N-O 3.44Å; A240-L283 CarbonylContact O-C 3.6Å; A240-L283 WeakPolarHBondContact O-CA 3.39Å; A240-A284 PolarHBondContact O-N 2.77Å
241	P	92.2	Very high	85.2	Confident	2 Å²	2	27 Å²	27	1%	0.013	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	113.6	157.5	21	-17.6	0	0	0	111	N209 G243 Y244 V245 A284 F292 E295	N209-P241 WeakPolarHBondContact OD1-CD 3.42Å; P241-G243 PolarHBondContact O-N 3.3Å; P241-G243 VanDerWaalsContact O-N 3.14Å; P241-Y244 WeakPolarHBondContact O-CB 3.33Å; P241-Y244 PolarHBondContact O-N 3.5Å; P241-V245 PolarHBondContact O-N 3.29Å; P241-A284 WeakPolarHBondContact CA-O 3.5Å; P241-F292 HydrophobicContact CG-CD2 3.99Å; P241-F292 HydrophobicContact CG-CE2 3.77Å; P241-F292 HydrophobicContact CG-CZ 4.11Å; P241-E295 HydrophobicContact CB-CB 4.49Å; P241-E295 WeakPolarHBondContact CB-OE2 2.94Å; P241-E295 HydrophobicContact CG-CG 4.29Å; P241-E295 WeakPolarHBondContact CG-OE2 3.38Å
242	W	91.2	Very high	86.8	Confident	14 Å²	14	28 Å²	28	5%	0.053	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-53	-36.3	-179.7	173	-106.9	0	0	0	113.2	A126 R145 A240 Y244 V245 R248 L251 I252 L283 A284 D285	A126-W242 HydrophobicContact CB-CH2 3.94Å; A126-W242 HydrophobicContact CB-CZ3 4.24Å; R145-W242 HydrophobicContact CB-CE3 4.43Å; R145-W242 HydrophobicContact CG-CD2 4.01Å; R145-W242 HydrophobicContact CG-CE3 4.23Å; R145-W242 HydrophobicContact CG-CG 4.22Å; A240-W242 PolarHBondContact O-N 2.82Å; W242-Y244 PolarHBondContact O-N 2.91Å; W242-Y244 VanDerWaalsContact O-N 3.1Å; W242-V245 PolarHBondContact O-N 2.95Å; W242-R248 HydrophobicContact CE3-CB 4.35Å; W242-R248 HydrophobicContact CH2-CB 3.83Å; W242-R248 WeakPolarHBondContact CH2-O 3.2Å; W242-R248 HydrophobicContact CZ2-CB 4.06Å; W242-R248 HydrophobicContact CZ2-CG 4.31Å; W242-R248 HydrophobicContact CZ3-CB 3.98Å; W242-L251 HydrophobicContact CH2-CB 4.32Å; W242-L251 HydrophobicContact CZ3-CB 4.11Å; W242-L251 HydrophobicContact CZ3-CD1 4.43Å; W242-I252 HydrophobicContact CH2-CG1 4.06Å; W242-I252 HydrophobicContact CZ2-CG1 4.24Å; W242-L283 HydrophobicContact CB-CB 4.44Å; W242-L283 HydrophobicContact CE3-CB 4.07Å; W242-L283 HydrophobicContact CE3-CD1 3.79Å; W242-L283 HydrophobicContact CZ3-CD1 3.87Å; W242-A284 PolarHBondContact N-O 3.26Å; W242-D285 HydrophobicContact CB-CB 4.14Å; W242-D285 HydrophobicContact CG-CB 4.45Å
243	G	86	Confident	87.9	Confident	2 Å²	2	26.8 Å²	26.8	2%	0.021	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-61.8	-14.5	176.3	0	0	0	0	0	115.3	P241 R248 T288 S289 G290	P241-G243 PolarHBondContact O-N 3.3Å; P241-G243 VanDerWaalsContact O-N 3.14Å; G243-R248 PolarHBondContact O-NH1 2.98Å; G243-R248 VanDerWaalsContact O-NH1 3.17Å; G243-T288 WeakPolarHBondContact CA-O 3.31Å; G243-S289 WeakPolarHBondContact O-CA 3.23Å; G243-G290 PolarHBondContact O-N 3.24Å
244	Y	87.6	Confident	88.6	Confident	45 Å²	45	26.6 Å²	26.6	18%	0.176	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-117.9	-5.5	-172.3	-151.5	-103.8	0	0	0	113.2	L211 P241 W242 Q246 Q270 E271 A272 F292	L211-Y244 HydrophobicContact CD1-CD1 3.71Å; L211-Y244 HydrophobicContact CD1-CE1 4.24Å; P241-Y244 WeakPolarHBondContact O-CB 3.33Å; P241-Y244 PolarHBondContact O-N 3.5Å; W242-Y244 PolarHBondContact O-N 2.91Å; W242-Y244 VanDerWaalsContact O-N 3.1Å; Y244-Q246 PolarHBondContact O-N 3.39Å; Y244-Q270 VanDerWaalsContact CD2-O 3.24Å; Y244-Q270 WeakPolarHBondContact CD2-O 3.49Å; Y244-Q270 WeakPolarHBondContact CE2-O 3.49Å; Y244-E271 CarbonylContact O-C 2.73Å; Y244-E271 WeakPolarHBondContact O-CA 3.01Å; Y244-A272 HydrophobicContact CD1-CB 3.66Å; Y244-A272 HydrophobicContact CE1-CB 3.72Å; Y244-A272 PolarHBondContact O-N 2.9Å; Y244-F292 HydrophobicContact CD1-CD2 4.04Å; Y244-F292 HydrophobicContact CD1-CE2 4.01Å; Y244-F292 HydrophobicContact CD2-CD2 4.19Å; Y244-F292 HydrophobicContact CE1-CD2 4.12Å; Y244-F292 HydrophobicContact CE1-CE2 4.14Å; Y244-F292 HydrophobicContact CE2-CD2 4.29Å; Y244-F292 HydrophobicContact CG-CD2 4.08Å; Y244-F292 HydrophobicContact CG-CE2 4.42Å
245	V	89.6	Confident	88.6	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.006	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-75.6	124.1	-178.9	175.1	0	0	0	0	110.9	L211 P241 W242 R248 L251 A272 L274 L283	L211-V245 HydrophobicContact CD2-CG2 4.3Å; P241-V245 PolarHBondContact O-N 3.29Å; W242-V245 PolarHBondContact O-N 2.95Å; V245-R248 HydrophobicContact CB-CB 4.31Å; V245-R248 HydrophobicContact CG1-CB 4.32Å; V245-L251 HydrophobicContact CG1-CD1 3.97Å; V245-A272 WeakPolarHBondContact CA-O 3.35Å; V245-L274 HydrophobicContact CG1-CD1 4.39Å; V245-L274 HydrophobicContact CG1-CD2 4.17Å; V245-L274 HydrophobicContact CG1-CG 4.01Å; V245-L274 HydrophobicContact CG2-CD2 3.94Å; V245-L283 HydrophobicContact CG2-CD2 4.36Å
246	Q	88.1	Confident	88.2	Confident	9 Å²	9	34.8 Å²	34.8	4%	0.042	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	141.5	173.3	-171.6	-177.7	-17.8	0	0	110.6	Y244 R248 Y260 E271 A272	Y244-Q246 PolarHBondContact O-N 3.39Å; Q246-R248 PolarHBondContact O-N 3.44Å; Q246-Y260 VanDerWaalsContact O-CE2 3.3Å; Q246-Y260 WeakPolarHBondContact O-CE2 3.27Å; Q246-Y260 PolarHBondContact O-OH 3.25Å; Q246-E271 HydrophobicContact CB-CB 4.13Å; Q246-E271 HydrophobicContact CG-CB 4.49Å; Q246-A272 WeakPolarHBondContact CB-O 3.23Å; Q246-A272 PolarHBondContact N-O 2.81Å
247	H	85.3	Confident	87.9	Confident	41 Å²	41	38.5 Å²	38.5	19%	0.19	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	28.5	-177.2	-47.9	132.2	0	0	0	114.5	E249 T250 Y260	H247-E249 WeakPolarHBondContact CA-OE1 3.47Å; H247-E249 WeakPolarHBondContact CA-OE2 3.23Å; H247-E249 IonicContact CD2-OE1 3.44Å; H247-E249 PolarHBondContact O-N 2.93Å; H247-T250 HydrophobicContact CB-CG2 4.18Å; H247-T250 WeakPolarHBondContact O-CB 3.43Å; H247-T250 PolarHBondContact O-N 3.26Å; H247-T250 PolarHBondContact O-OG1 3.24Å; H247-Y260 HydrophobicContact CB-CE2 4.11Å
248	R	87.5	Confident	87.5	Confident	49 Å²	49	39.1 Å²	39.1	19%	0.185	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-55.1	-25.6	-179.1	65.7	-176.5	178.8	-148	-5	113.8	W242 G243 V245 Q246 T250 L251 S289	W242-R248 HydrophobicContact CE3-CB 4.35Å; W242-R248 HydrophobicContact CH2-CB 3.83Å; W242-R248 WeakPolarHBondContact CH2-O 3.2Å; W242-R248 HydrophobicContact CZ2-CB 4.06Å; W242-R248 HydrophobicContact CZ2-CG 4.31Å; W242-R248 HydrophobicContact CZ3-CB 3.98Å; G243-R248 PolarHBondContact O-NH1 2.98Å; G243-R248 VanDerWaalsContact O-NH1 3.17Å; V245-R248 HydrophobicContact CB-CB 4.31Å; V245-R248 HydrophobicContact CG1-CB 4.32Å; Q246-R248 PolarHBondContact O-N 3.44Å; R248-T250 PolarHBondContact O-N 2.87Å; R248-L251 WeakPolarHBondContact O-CA 3.42Å; R248-L251 WeakPolarHBondContact O-CB 3.38Å; R248-L251 PolarHBondContact O-N 3.39Å; R248-S289 PolarHBondContact NH1-OG 2.73Å; R248-S289 PolarHBondContact NH2-OG 3.06Å
249	E	85.8	Confident	87.1	Confident	118 Å²	118	42 Å²	42	55%	0.551	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-60.2	-27.3	172.8	66.5	-76.3	178.1	0	0	113.4	H247 L251	H247-E249 WeakPolarHBondContact CA-OE1 3.47Å; H247-E249 WeakPolarHBondContact CA-OE2 3.23Å; H247-E249 IonicContact CD2-OE1 3.44Å; H247-E249 PolarHBondContact O-N 2.93Å; E249-L251 VanDerWaalsContact C-N 3.28Å; E249-L251 PolarHBondContact O-N 3.27Å
250	T	86.8	Confident	86.8	Confident	59 Å²	59	42 Å²	42	36%	0.362	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-75.1	-17.1	172.9	66.6	0	0	0	0	113.3	H247 R248 C258	H247-T250 HydrophobicContact CB-CG2 4.18Å; H247-T250 WeakPolarHBondContact O-CB 3.43Å; H247-T250 PolarHBondContact O-N 3.26Å; H247-T250 PolarHBondContact O-OG1 3.24Å; R248-T250 PolarHBondContact O-N 2.87Å; T250-C258 VanDerWaalsContact O-CB 3.32Å; T250-C258 WeakPolarHBondContact O-CB 3.25Å; T250-C258 PolarHBondContact O-SG 3.08Å
251	L	88.6	Confident	86.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-95	6.6	178.5	-54.9	176.9	0	0	0	112.3	A126 V130 Y143 W242 V245 R248 E249 C258 Y260 L274 L283	A126-L251 WeakPolarHBondContact CA-O 3.47Å; A126-L251 WeakPolarHBondContact CB-O 3.22Å; V130-L251 HydrophobicContact CG1-CD2 4.45Å; V130-L251 HydrophobicContact CG2-CD2 3.91Å; Y143-L251 HydrophobicContact CE2-CB 3.94Å; Y143-L251 VanDerWaalsContact CE2-O 3.27Å; Y143-L251 WeakPolarHBondContact CE2-O 3.42Å; Y143-L251 PolarHBondContact OH-O 3.27Å; Y143-L251 VanDerWaalsContact OH-O 3.08Å; W242-L251 HydrophobicContact CH2-CB 4.32Å; W242-L251 HydrophobicContact CZ3-CB 4.11Å; W242-L251 HydrophobicContact CZ3-CD1 4.43Å; V245-L251 HydrophobicContact CG1-CD1 3.97Å; R248-L251 WeakPolarHBondContact O-CA 3.42Å; R248-L251 WeakPolarHBondContact O-CB 3.38Å; R248-L251 PolarHBondContact O-N 3.39Å; E249-L251 VanDerWaalsContact C-N 3.28Å; E249-L251 PolarHBondContact O-N 3.27Å; L251-C258 HydrophobicContact CD2-CB 4.45Å; L251-Y260 HydrophobicContact CD1-CE2 4.32Å; L251-Y260 HydrophobicContact CD2-CD2 3.91Å; L251-Y260 HydrophobicContact CD2-CE2 4.48Å; L251-Y260 HydrophobicContact CG-CD2 4.27Å; L251-Y260 HydrophobicContact CG-CE2 4.42Å; L251-L274 HydrophobicContact CD1-CD1 3.89Å; L251-L283 HydrophobicContact CD1-CD1 4.01Å
252	I	88.1	Confident	85.7	Confident	89 Å²	89	50.3 Å²	50.3	46%	0.456	26%	0.262	S	S	.	.			trans	-87.3	117.1	175.9	-59.5	179.3	0	0	0	108.5	N125 W242	N125-I252 WeakPolarHBondContact O-CG2 3.47Å; W242-I252 HydrophobicContact CH2-CG1 4.06Å; W242-I252 HydrophobicContact CZ2-CG1 4.24Å
253	G	82.9	Confident	84.9	Confident	10 Å²	10	53.5 Å²	53.5	10%	0.103	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172	160.5	-170.3	0	0	0	0	0	112.4	N125 A126 Y127	N125-G253 CarbonylContact C-O 3.32Å; N125-G253 PolarHBondContact O-N 3.47Å; A126-G253 WeakPolarHBondContact CA-O 3.41Å; Y127-G253 PolarHBondContact N-O 2.66Å
254	L	84.2	Confident	84.1	Confident	90 Å²	90	55.5 Å²	55.5	47%	0.471	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	109	179.5	-52.5	174.6	0	0	0	108.3	Y127 N256	Y127-L254 HydrophobicContact CD1-CD2 4.21Å; Y127-L254 HydrophobicContact CE1-CB 4.02Å; Y127-L254 HydrophobicContact CE1-CD2 3.63Å; Y127-L254 HydrophobicContact CE1-CG 4.43Å; L254-N256 PolarHBondContact O-N 3.33Å; L254-N256 VanDerWaalsContact O-N 3.12Å
255	D	82	Confident	83.3	Confident	110 Å²	110	56.9 Å²	56.9	59%	0.588	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.3	24.1	-176.5	-146.2	31.4	0	0	0	115.2	Y127	Y127-D255 HydrophobicContact CD2-CB 4.42Å; Y127-D255 HydrophobicContact CE2-CB 3.69Å; Y127-D255 VanDerWaalsContact CE2-N 3.3Å; Y127-D255 WeakPolarHBondContact O-CA 3.33Å; Y127-D255 PolarHBondContact O-N 2.9Å
256	N	79.9	Confident	82.5	Confident	87 Å²	87	63.6 Å²	63.6	47%	0.465	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	149.5	-179.1	-77.5	-24.1	0	0	0	112	T129 L254	T129-N256 PolarHBondContact N-O 3.06Å; L254-N256 PolarHBondContact O-N 3.33Å; L254-N256 VanDerWaalsContact O-N 3.12Å
257	T	85.1	Confident	81.4	Confident	79 Å²	79	68.3 Å²	68.3	49%	0.485	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	111	160.1	-56.9	0	0	0	0	108.9	T129 E131	T129-T257 CarbonylContact O-C 3.55Å; T129-T257 WeakPolarHBondContact O-CA 3.47Å; T129-T257 WeakPolarHBondContact OG1-CA 3.3Å; T129-T257 WeakPolarHBondContact OG1-CB 3.22Å; T129-T257 PolarHBondContact OG1-OG1 2.7Å; E131-T257 HydrophobicContact CB-CG2 3.91Å
258	C	85.5	Confident	80.5	Confident	15 Å²	15	70.2 Å²	70.2	10%	0.101	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	115.7	-178.1	-64	0	0	0	0	110.7	T129 E131 Y143 T250 L251 Y260	T129-C258 PolarHBondContact O-N 3.19Å; E131-C258 PolarHBondContact N-O 3.43Å; Y143-C258 PolarHBondContact OH-SG 3.21Å; T250-C258 VanDerWaalsContact O-CB 3.32Å; T250-C258 WeakPolarHBondContact O-CB 3.25Å; T250-C258 PolarHBondContact O-SG 3.08Å; L251-C258 HydrophobicContact CD2-CB 4.45Å; C258-Y260 PolarHBondContact O-N 3.5Å
259	S	85.4	Confident	79.7	Confident	62 Å²	62	74.2 Å²	74.2	43%	0.434	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	114.1	174.7	-48.9	0	0	0	0	110.4	E131	E131-S259 CarbonylContact O-C 3.58Å; E131-S259 WeakPolarHBondContact O-CA 3.4Å; E131-S259 PolarHBondContact OE2-OG 2.91Å
260	Y	87.9	Confident	79.1	Confident	1 Å²	1	74.9 Å²	74.9	0%	0.004	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.7	-171.7	-176	-92.2	0	0	0	111.5	V130 E131 F132 Q133 Q246 H247 L251 C258 P273 L274	V130-Y260 VanDerWaalsContact CG1-CB 3.42Å; V130-Y260 HydrophobicContact CG1-CD1 4.43Å; V130-Y260 HydrophobicContact CG1-CG 4.02Å; E131-Y260 PolarHBondContact O-N 3.46Å; F132-Y260 WeakPolarHBondContact CA-O 3.43Å; F132-Y260 AromaticContact CD1-CD1 3.76Å; F132-Y260 HydrophobicContact CD1-CD1 3.76Å; F132-Y260 HydrophobicContact CD1-CE1 4.49Å; F132-Y260 AromaticContact CE1-CD1 3.59Å; F132-Y260 HydrophobicContact CE1-CD1 3.59Å; F132-Y260 HydrophobicContact CE1-CE1 4.02Å; Q133-Y260 PolarHBondContact N-O 2.99Å; Q246-Y260 VanDerWaalsContact O-CE2 3.3Å; Q246-Y260 WeakPolarHBondContact O-CE2 3.27Å; Q246-Y260 PolarHBondContact O-OH 3.25Å; H247-Y260 HydrophobicContact CB-CE2 4.11Å; L251-Y260 HydrophobicContact CD1-CE2 4.32Å; L251-Y260 HydrophobicContact CD2-CD2 3.91Å; L251-Y260 HydrophobicContact CD2-CE2 4.48Å; L251-Y260 HydrophobicContact CG-CD2 4.27Å; L251-Y260 HydrophobicContact CG-CE2 4.42Å; C258-Y260 PolarHBondContact O-N 3.5Å; Y260-P273 WeakPolarHBondContact OH-CA 3.27Å; Y260-L274 HydrophobicContact CE1-CB 3.93Å; Y260-L274 HydrophobicContact CE1-CG 4.39Å; Y260-L274 PolarHBondContact OH-N 3.39Å; Y260-L274 VanDerWaalsContact OH-N 3.15Å
261	Y	83.9	Confident	78.8	Confident	139 Å²	139	75 Å²	75	55%	0.545	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	106.4	178.6	-67.4	-92.3	0	0	0	109.8	Q133 Q263	Q133-Y261 HydrophobicContact CB-CD1 3.66Å; Q133-Y261 HydrophobicContact CB-CD2 4.41Å; Q133-Y261 HydrophobicContact CB-CE1 3.39Å; Q133-Y261 HydrophobicContact CB-CE2 4.17Å; Q133-Y261 HydrophobicContact CB-CG 4.18Å; Q133-Y261 HydrophobicContact CG-CE1 4.24Å; Q133-Y261 HydrophobicContact CG-CE2 4.29Å; Y261-Q263 VanDerWaalsContact C-N 3.33Å; Y261-Q263 PolarHBondContact O-N 2.8Å
262	S	78.4	Confident	78.7	Confident	37 Å²	37	75 Å²	75	26%	0.259	41%	0.405	S	S	.	.			trans	-73.7	87.2	174.8	-165.1	0	0	0	0	109.7	L274	S262-L274 PolarHBondContact OG-O 3.18Å
263	Q	73.6	Confident	78.8	Confident	80 Å²	80	70.8 Å²	70.8	37%	0.374	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-81.5	116.8	175.5	-66.5	-175.2	22.6	0	0	109.3	Y261 W265 P273	Y261-Q263 VanDerWaalsContact C-N 3.33Å; Y261-Q263 PolarHBondContact O-N 2.8Å; Q263-W265 PolarHBondContact O-N 2.75Å; Q263-P273 WeakPolarHBondContact O-CG 3.29Å
264	G	69.5	Low	79.2	Confident	44 Å²	44	70.3 Å²	70.3	45%	0.454	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-47.6	136.3	-177.1	0	0	0	0	0	114
265	W	70.5	Confident	79.5	Confident	74 Å²	74	66 Å²	66	28%	0.28	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-53.2	138.3	-171.4	174.5	71	0	0	0	113.3	I213 Q263 P267	I213-W265 HydrophobicContact CD1-CB 4.13Å; I213-W265 HydrophobicContact CD1-CD2 4.05Å; I213-W265 HydrophobicContact CD1-CG 3.59Å; I213-W265 HydrophobicContact CG1-CB 4.04Å; I213-W265 HydrophobicContact CG1-CD2 4.5Å; I213-W265 HydrophobicContact CG1-CG 3.99Å; Q263-W265 PolarHBondContact O-N 2.75Å; W265-P267 HydrophobicContact CE3-CG 4.4Å; W265-P267 HydrophobicContact CH2-CB 4.28Å; W265-P267 HydrophobicContact CH2-CG 4.19Å; W265-P267 HydrophobicContact CZ3-CG 3.93Å
266	R	72.8	Confident	79.7	Confident	143 Å²	143	62.5 Å²	62.5	54%	0.54	34%	0.339	S	S	.	.			trans	-111	120.1	179.4	-60	-169.6	-170.2	-171.9	6.7	110.5	G268 R269	R266-G268 PolarHBondContact O-N 2.7Å; R266-R269 PolarHBondContact O-N 3.34Å
267	P	65.4	Low	80.1	Confident	107 Å²	107	59.2 Å²	59.2	70%	0.695	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	135	175	-28.3	35.1	0	0	0	112.3	W265	W265-P267 HydrophobicContact CE3-CG 4.4Å; W265-P267 HydrophobicContact CH2-CB 4.28Å; W265-P267 HydrophobicContact CH2-CG 4.19Å; W265-P267 HydrophobicContact CZ3-CG 3.93Å
268	G	67.3	Low	80.3	Confident	82 Å²	82	55.5 Å²	55.5	85%	0.845	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-10.7	179.4	0	0	0	0	0	115.8	R266	R266-G268 PolarHBondContact O-N 2.7Å
269	R	69.3	Low	80.4	Confident	133 Å²	133	56.4 Å²	56.4	50%	0.502	30%	0.302	S	S	.	.			trans	-82	147.2	164.2	-78.3	-165	170.2	-136	3.4	111.3	R266 E271	R266-R269 PolarHBondContact O-N 3.34Å; R269-E271 IonicContact CZ-OE2 3.72Å; R269-E271 IonicContact NH1-OE2 3.56Å; R269-E271 PolarHBondContact NH1-OE2 3.17Å; R269-E271 PolarHBondContact O-N 2.78Å
270	Q	73.4	Confident	80.8	Confident	132 Å²	132	55.5 Å²	55.5	62%	0.617	29%	0.29	S	S	*	.	S	Bend	trans	-91.7	28.2	173.5	-60.1	-177.8	-0.2	0	0	111.9	Y244	Y244-Q270 VanDerWaalsContact CD2-O 3.24Å; Y244-Q270 WeakPolarHBondContact CD2-O 3.49Å; Y244-Q270 WeakPolarHBondContact CE2-O 3.49Å
271	E	81.6	Confident	81.1	Confident	62 Å²	62	55.5 Å²	55.5	29%	0.29	29%	0.29	S	S	.	.			trans	-137.4	146.8	-172.1	-64.3	170.3	161.2	0	0	109.1	Y244 Q246 R269	Y244-E271 CarbonylContact O-C 2.73Å; Y244-E271 WeakPolarHBondContact O-CA 3.01Å; Q246-E271 HydrophobicContact CB-CB 4.13Å; Q246-E271 HydrophobicContact CG-CB 4.49Å; R269-E271 IonicContact CZ-OE2 3.72Å; R269-E271 IonicContact NH1-OE2 3.56Å; R269-E271 PolarHBondContact NH1-OE2 3.17Å; R269-E271 PolarHBondContact O-N 2.78Å
272	A	86.6	Confident	81.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-135.9	135.9	-177	0	0	0	0	0	111.1	L211 I213 Y244 V245 Q246	L211-A272 HydrophobicContact CB-CB 4.15Å; L211-A272 HydrophobicContact CD1-CB 3.9Å; L211-A272 HydrophobicContact CD2-CB 3.91Å; L211-A272 HydrophobicContact CG-CB 4.19Å; I213-A272 HydrophobicContact CD1-CB 3.34Å; I213-A272 HydrophobicContact CG1-CB 4.12Å; Y244-A272 HydrophobicContact CD1-CB 3.66Å; Y244-A272 HydrophobicContact CE1-CB 3.72Å; Y244-A272 PolarHBondContact O-N 2.9Å; V245-A272 WeakPolarHBondContact CA-O 3.35Å; Q246-A272 WeakPolarHBondContact CB-O 3.23Å; Q246-A272 PolarHBondContact N-O 2.81Å
273	P	89.7	Confident	82.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-69.5	153.6	172.9	33.6	-39.2	0	0	0	111.4	L211 D212 Y260 Q263	L211-P273 WeakPolarHBondContact CA-O 3.14Å; D212-P273 HydrophobicContact CB-CG 4.06Å; D212-P273 PolarHBondContact N-O 3.47Å; Y260-P273 WeakPolarHBondContact OH-CA 3.27Å; Q263-P273 WeakPolarHBondContact O-CG 3.29Å
274	L	91.7	Very high	83.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-70.3	140	165.4	-61.6	177.9	0	0	0	110.2	F132 L211 V245 L251 Y260 S262 F281 L283	F132-L274 HydrophobicContact CE1-CB 3.95Å; F132-L274 HydrophobicContact CZ-CB 4.03Å; L211-L274 HydrophobicContact CD2-CD2 4.28Å; V245-L274 HydrophobicContact CG1-CD1 4.39Å; V245-L274 HydrophobicContact CG1-CD2 4.17Å; V245-L274 HydrophobicContact CG1-CG 4.01Å; V245-L274 HydrophobicContact CG2-CD2 3.94Å; L251-L274 HydrophobicContact CD1-CD1 3.89Å; Y260-L274 HydrophobicContact CE1-CB 3.93Å; Y260-L274 HydrophobicContact CE1-CG 4.39Å; Y260-L274 PolarHBondContact OH-N 3.39Å; Y260-L274 VanDerWaalsContact OH-N 3.15Å; S262-L274 PolarHBondContact OG-O 3.18Å; L274-F281 HydrophobicContact CB-CE1 4.15Å; L274-F281 HydrophobicContact CB-CZ 4.16Å; L274-F281 HydrophobicContact CD1-CD1 4.42Å; L274-F281 HydrophobicContact CD1-CE1 4.46Å; L274-F281 HydrophobicContact CD2-CD1 4Å; L274-F281 HydrophobicContact CD2-CE1 3.95Å; L274-F281 HydrophobicContact CG-CE1 4.41Å; L274-L283 HydrophobicContact CD2-CD2 4.15Å
275	N	89.5	Confident	84.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-74.5	131.2	175.5	168.7	-90.4	0	0	0	110.6	F132 G210 D212 D277 H278 F281	F132-N275 WeakPolarHBondContact CZ-O 3.35Å; G210-N275 PolarHBondContact O-N 2.94Å; D212-N275 HydrophobicContact CB-CB 4.01Å; D212-N275 PolarHBondContact OD1-ND2 2.93Å; N275-D277 VanDerWaalsContact C-N 3.26Å; N275-D277 PolarHBondContact ND2-OD2 2.99Å; N275-D277 PolarHBondContact O-N 2.81Å; N275-D277 WeakPolarHBondContact OD1-CA 3.34Å; N275-D277 WeakPolarHBondContact OD1-CB 3.3Å; N275-D277 PolarHBondContact OD1-N 3Å; N275-D277 PolarHBondContact OD1-OD2 3.33Å; N275-H278 PolarHBondContact OD1-CE1 2.85Å; N275-H278 PolarHBondContact OD1-ND1 2.97Å; N275-F281 WeakPolarHBondContact O-CZ 3.34Å
276	P	87.6	Confident	85.2	Confident	36 Å²	36	38.8 Å²	38.8	23%	0.234	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-9.5	-173	31	-37.4	0	0	0	115.2	F132 T139	F132-P276 HydrophobicContact CB-CB 3.94Å; F132-P276 HydrophobicContact CD1-CB 3.77Å; F132-P276 HydrophobicContact CD2-CB 4.23Å; F132-P276 HydrophobicContact CE1-CB 4.31Å; F132-P276 HydrophobicContact CG-CB 3.73Å; T139-P276 PolarHBondContact OG1-O 2.96Å
277	D	87.1	Confident	85.8	Confident	17 Å²	17	32.4 Å²	32.4	9%	0.091	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	15.9	-172.5	-36.7	-73	0	0	0	112.4	G220 V227 N275	G220-D277 VanDerWaalsContact C-OD2 3.31Å; G220-D277 WeakPolarHBondContact CA-OD2 3.26Å; G220-D277 WeakPolarHBondContact O-CB 3.44Å; V227-D277 WeakPolarHBondContact CG2-O 3.25Å; N275-D277 VanDerWaalsContact C-N 3.26Å; N275-D277 PolarHBondContact ND2-OD2 2.99Å; N275-D277 PolarHBondContact O-N 2.81Å; N275-D277 WeakPolarHBondContact OD1-CA 3.34Å; N275-D277 WeakPolarHBondContact OD1-CB 3.3Å; N275-D277 PolarHBondContact OD1-N 3Å; N275-D277 PolarHBondContact OD1-OD2 3.33Å
278	H	90	Very high	86.7	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.009	15%	0.154	C	C	.	.			trans	-112.2	125.1	177.7	-76.1	65.3	0	0	0	111.8	A141 T208 A236 N275 Y280 F281	A141-H278 WeakPolarHBondContact CB-O 3.33Å; T208-H278 VanDerWaalsContact CG2-NE2 3.28Å; T208-H278 WeakPolarHBondContact CG2-NE2 3.48Å; T208-H278 PolarHBondContact OG1-CD2 2.93Å; T208-H278 VanDerWaalsContact OG1-CD2 3.31Å; T208-H278 PolarHBondContact OG1-NE2 3.1Å; A236-H278 HydrophobicContact CB-CB 4.38Å; N275-H278 PolarHBondContact OD1-CE1 2.85Å; N275-H278 PolarHBondContact OD1-ND1 2.97Å; H278-Y280 PolarHBondContact O-N 2.6Å; H278-F281 HydrophobicContact CB-CE1 4.07Å; H278-F281 HydrophobicContact CB-CE2 4.2Å; H278-F281 HydrophobicContact CB-CZ 3.63Å; H278-F281 WeakPolarHBondContact O-CE2 3.49Å
279	N	87.9	Confident	87.6	Confident	33 Å²	33	24.9 Å²	24.9	18%	0.176	12%	0.12	C	C	.	.	S	Bend	trans	-72.8	-24.5	-174.6	-63.7	-12.9	0	0	0	113.6	A141 R142 I234 A236	A141-N279 CarbonylContact C-O 3.57Å; A141-N279 WeakPolarHBondContact CA-O 3.41Å; A141-N279 WeakPolarHBondContact CB-O 3.5Å; R142-N279 PolarHBondContact N-O 2.75Å; I234-N279 PolarHBondContact O-ND2 3.28Å; A236-N279 PolarHBondContact O-N 3.43Å
280	Y	92.5	Very high	87.9	Confident	44 Å²	44	19.4 Å²	19.4	17%	0.173	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	137.3	-170.5	-60.4	-77.1	0	0	0	112.9	R142 W163 I165 V235 A236 G238 H278	R142-Y280 HydrophobicContact CB-CD1 4.07Å; R142-Y280 HydrophobicContact CB-CE1 4.4Å; R142-Y280 HydrophobicContact CG-CD1 4.48Å; R142-Y280 HydrophobicContact CG-CE1 4.33Å; R142-Y280 CarbonylContact O-C 3.42Å; R142-Y280 WeakPolarHBondContact O-CA 3.23Å; W163-Y280 HydrophobicContact CD2-CD1 4.17Å; W163-Y280 AromaticContact CE3-CD1 3.39Å; W163-Y280 HydrophobicContact CE3-CD1 3.39Å; W163-Y280 HydrophobicContact CE3-CE1 4.04Å; W163-Y280 HydrophobicContact CE3-CG 4.18Å; W163-Y280 AromaticContact CZ3-CD1 3.71Å; W163-Y280 HydrophobicContact CZ3-CD1 3.71Å; W163-Y280 HydrophobicContact CZ3-CG 4.19Å; I165-Y280 HydrophobicContact CD1-CD1 3.92Å; I165-Y280 HydrophobicContact CD1-CD2 4.05Å; I165-Y280 HydrophobicContact CD1-CE1 3.63Å; I165-Y280 HydrophobicContact CD1-CE2 3.78Å; I165-Y280 HydrophobicContact CD1-CG 4.11Å; I165-Y280 HydrophobicContact CG1-CE1 4.08Å; I165-Y280 HydrophobicContact CG1-CE2 4.32Å; V235-Y280 HydrophobicContact CG1-CD2 3.82Å; V235-Y280 HydrophobicContact CG1-CE2 3.92Å; A236-Y280 PolarHBondContact O-N 2.8Å; A236-Y280 VanDerWaalsContact O-N 3.11Å; G238-Y280 PolarHBondContact N-O 2.86Å; H278-Y280 PolarHBondContact O-N 2.6Å
281	F	94.9	Very high	88.1	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	126	-178.9	-68.9	-79.2	0	0	0	114	F132 A141 R142 Y143 V144 G238 L274 N275 H278 L283	F132-F281 AromaticContact CE2-CE2 3.88Å; F132-F281 HydrophobicContact CE2-CE2 3.88Å; F132-F281 HydrophobicContact CE2-CZ 4.34Å; F132-F281 AromaticContact CZ-CE2 3.72Å; F132-F281 HydrophobicContact CZ-CE2 3.72Å; F132-F281 AromaticContact CZ-CZ 3.84Å; F132-F281 HydrophobicContact CZ-CZ 3.84Å; A141-F281 HydrophobicContact CB-CD2 3.82Å; A141-F281 HydrophobicContact CB-CE2 3.61Å; R142-F281 PolarHBondContact O-N 3.45Å; Y143-F281 WeakPolarHBondContact CA-O 3.42Å; V144-F281 PolarHBondContact N-O 2.71Å; V144-F281 VanDerWaalsContact N-O 3.17Å; G238-F281 WeakPolarHBondContact O-CA 3.42Å; L274-F281 HydrophobicContact CB-CE1 4.15Å; L274-F281 HydrophobicContact CB-CZ 4.16Å; L274-F281 HydrophobicContact CD1-CD1 4.42Å; L274-F281 HydrophobicContact CD1-CE1 4.46Å; L274-F281 HydrophobicContact CD2-CD1 4Å; L274-F281 HydrophobicContact CD2-CE1 3.95Å; L274-F281 HydrophobicContact CG-CE1 4.41Å; N275-F281 WeakPolarHBondContact O-CZ 3.34Å; H278-F281 HydrophobicContact CB-CE1 4.07Å; H278-F281 HydrophobicContact CB-CE2 4.2Å; H278-F281 HydrophobicContact CB-CZ 3.63Å; H278-F281 WeakPolarHBondContact O-CE2 3.49Å; F281-L283 HydrophobicContact CB-CD2 4.07Å; F281-L283 HydrophobicContact CB-CG 4.48Å
282	L	95.1	Very high	87.9	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	106	166.9	-57	179.9	0	0	0	108.4	V144 L146 V155 L158 W163 L237 G238 I239 A240 A284 L298 L302	V144-L282 HydrophobicContact CG1-CD2 3.75Å; L146-L282 HydrophobicContact CD2-CB 4.44Å; L146-L282 HydrophobicContact CD2-CD2 4.1Å; V155-L282 HydrophobicContact CG1-CD1 3.63Å; V155-L282 HydrophobicContact CG1-CD2 4.45Å; L158-L282 HydrophobicContact CD2-CD2 4.26Å; W163-L282 HydrophobicContact CH2-CD2 3.91Å; W163-L282 HydrophobicContact CZ3-CD2 4.13Å; L237-L282 HydrophobicContact CD1-CD1 4.26Å; L237-L282 HydrophobicContact CD1-CG 4.06Å; L237-L282 HydrophobicContact CD2-CD1 4.38Å; G238-L282 PolarHBondContact O-N 2.84Å; I239-L282 CarbonylContact C-O 3.58Å; I239-L282 WeakPolarHBondContact CA-O 3.28Å; I239-L282 HydrophobicContact CD1-CD1 4.49Å; I239-L282 HydrophobicContact CG1-CB 4.49Å; I239-L282 HydrophobicContact CG1-CD1 4.43Å; I239-L282 HydrophobicContact CG2-CB 4.36Å; A240-L282 PolarHBondContact N-O 3.44Å; L282-A284 PolarHBondContact O-N 2.74Å; L282-L298 HydrophobicContact CD1-CD2 4.45Å; L282-L302 HydrophobicContact CD1-CD2 3.95Å
283	L	94.3	Very high	87.4	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	91.8	-176.9	-50.2	-179.5	0	0	0	109	Y143 V144 R145 L146 A240 W242 V245 L251 L274 F281 D285	Y143-L283 HydrophobicContact CD2-CD1 4.07Å; V144-L283 WeakPolarHBondContact O-CB 3.35Å; V144-L283 PolarHBondContact O-N 2.99Å; R145-L283 WeakPolarHBondContact CA-O 3.35Å; L146-L283 PolarHBondContact N-O 3.34Å; A240-L283 CarbonylContact O-C 3.6Å; A240-L283 WeakPolarHBondContact O-CA 3.39Å; W242-L283 HydrophobicContact CB-CB 4.44Å; W242-L283 HydrophobicContact CE3-CB 4.07Å; W242-L283 HydrophobicContact CE3-CD1 3.79Å; W242-L283 HydrophobicContact CZ3-CD1 3.87Å; V245-L283 HydrophobicContact CG2-CD2 4.36Å; L251-L283 HydrophobicContact CD1-CD1 4.01Å; L274-L283 HydrophobicContact CD2-CD2 4.15Å; F281-L283 HydrophobicContact CB-CD2 4.07Å; F281-L283 HydrophobicContact CB-CG 4.48Å; L283-D285 PolarHBondContact O-N 2.96Å
284	A	93.3	Very high	86.7	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.008	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	121.6	-178.1	0	0	0	0	0	112	L146 A240 P241 W242 L282 E295	L146-A284 CarbonylContact O-C 3.24Å; L146-A284 WeakPolarHBondContact O-CA 3.3Å; A240-A284 PolarHBondContact O-N 2.77Å; P241-A284 WeakPolarHBondContact CA-O 3.5Å; W242-A284 PolarHBondContact N-O 3.26Å; L282-A284 PolarHBondContact O-N 2.74Å; A284-E295 HydrophobicContact CB-CB 3.97Å
285	D	92	Very high	86.5	Confident	1 Å²	1	20 Å²	20	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.7	-173.5	-170.5	4.1	0	0	0	111.5	L51 R145 L146 C148 W242 L283 G287	L51-D285 PolarHBondContact N-OD2 3.04Å; L51-D285 VanDerWaalsContact O-OD2 3.11Å; R145-D285 HydrophobicContact CG-CB 4.32Å; R145-D285 IonicContact CZ-OD2 2.68Å; R145-D285 IonicContact NE-OD2 3.75Å; R145-D285 PolarHBondContact NE-OD2 2.97Å; R145-D285 IonicContact NH2-OD2 2.67Å; R145-D285 PolarHBondContact NH2-OD2 3Å; L146-D285 WeakPolarHBondContact O-CB 3.46Å; L146-D285 PolarHBondContact O-N 3.08Å; C148-D285 WeakPolarHBondContact CB-O 3.22Å; C148-D285 PolarHBondContact N-O 2.88Å; C148-D285 PolarHBondContact SG-O 2.91Å; W242-D285 HydrophobicContact CB-CB 4.14Å; W242-D285 HydrophobicContact CG-CB 4.45Å; L283-D285 PolarHBondContact O-N 2.96Å; D285-G287 PolarHBondContact OD1-N 3.3Å
286	N	88	Confident	86.2	Confident	21 Å²	21	22.3 Å²	22.3	11%	0.112	13%	0.13	C	C	.	.			trans	-123	10.8	178	65.5	6.2	0	0	0	112.1	T288	N286-T288 VanDerWaalsContact CG-OG1 3.26Å; N286-T288 PolarHBondContact ND2-OG1 3.47Å; N286-T288 PolarHBondContact O-N 3.28Å; N286-T288 WeakPolarHBondContact OD1-CB 3.35Å; N286-T288 PolarHBondContact OD1-N 3.39Å; N286-T288 PolarHBondContact OD1-OG1 3.19Å
287	G	84.1	Confident	86	Confident	10 Å²	10	22.5 Å²	22.5	10%	0.103	14%	0.138	C	C	.	.	S	Bend	trans	64.9	20.6	-176.2	0	0	0	0	0	114.7	C70 D285	C70-G287 WeakPolarHBondContact CB-O 3.32Å; D285-G287 PolarHBondContact OD1-N 3.3Å
288	T	85.9	Confident	86.2	Confident	10 Å²	10	21.8 Å²	21.8	6%	0.061	14%	0.135	C	C	.	.			trans	-117.6	157.9	173.8	70.7	0	0	0	0	112.6	C70 W113 G243 N286 K291	C70-T288 CarbonylContact O-C 3.55Å; C70-T288 WeakPolarHBondContact O-CA 3.34Å; C70-T288 VanDerWaalsContact O-CB 3.22Å; C70-T288 WeakPolarHBondContact O-CB 3.32Å; W113-T288 HydrophobicContact CE3-CG2 4.47Å; W113-T288 HydrophobicContact CH2-CG2 3.26Å; W113-T288 HydrophobicContact CZ2-CG2 4.1Å; W113-T288 HydrophobicContact CZ3-CG2 3.48Å; W113-T288 VanDerWaalsContact CZ3-CG2 3.48Å; G243-T288 WeakPolarHBondContact CA-O 3.31Å; N286-T288 VanDerWaalsContact CG-OG1 3.26Å; N286-T288 PolarHBondContact ND2-OG1 3.47Å; N286-T288 PolarHBondContact O-N 3.28Å; N286-T288 WeakPolarHBondContact OD1-CB 3.35Å; N286-T288 PolarHBondContact OD1-N 3.39Å; N286-T288 PolarHBondContact OD1-OG1 3.19Å; T288-K291 HydrophobicContact CG2-CD 4.16Å
289	S	84.3	Confident	86.2	Confident	20 Å²	20	22.7 Å²	22.7	14%	0.14	14%	0.138	C	C	.	.	S	Bend	trans	-116.8	143.4	173	-163.2	0	0	0	0	109.9	C70 G243 R248 K291	C70-S289 PolarHBondContact O-N 3.06Å; G243-S289 WeakPolarHBondContact O-CA 3.23Å; R248-S289 PolarHBondContact NH1-OG 2.73Å; R248-S289 PolarHBondContact NH2-OG 3.06Å; S289-K291 VanDerWaalsContact C-N 3.26Å; S289-K291 PolarHBondContact O-N 3.18Å
290	G	76.8	Confident	86.1	Confident	18 Å²	18	25 Å²	25	19%	0.186	14%	0.144	C	C	.	.	S	Bend	trans	71.9	6.1	177.3	0	0	0	0	0	116.2	G243	G243-G290 PolarHBondContact O-N 3.24Å
291	K	77.6	Confident	85.9	Confident	90 Å²	90	26.5 Å²	26.5	39%	0.391	15%	0.15	S	C	.	.			trans	-113.6	141.1	-179.1	-57.9	-179.1	-165.5	169.5	0	112.3	S69 T288 S289	S69-K291 PolarHBondContact O-NZ 2.65Å; T288-K291 HydrophobicContact CG2-CD 4.16Å; S289-K291 VanDerWaalsContact C-N 3.26Å; S289-K291 PolarHBondContact O-N 3.18Å
292	F	77.2	Confident	85.7	Confident	69 Å²	69	26.7 Å²	26.7	30%	0.303	15%	0.151	S	C	.	.			trans	-100.5	160.2	-178.8	-144.7	-89.5	0	0	0	112.1	L178 N209 L211 P241 Y244 E295	L178-F292 HydrophobicContact CD1-CD1 3.76Å; L178-F292 HydrophobicContact CD1-CD2 4.2Å; L178-F292 HydrophobicContact CD1-CE1 3.47Å; L178-F292 VanDerWaalsContact CD1-CE1 3.47Å; L178-F292 HydrophobicContact CD1-CE2 3.93Å; L178-F292 HydrophobicContact CD1-CG 4.12Å; L178-F292 HydrophobicContact CD1-CZ 3.56Å; L178-F292 HydrophobicContact CD2-CE1 4.08Å; L178-F292 HydrophobicContact CD2-CE2 4.19Å; L178-F292 HydrophobicContact CD2-CZ 3.56Å; L178-F292 HydrophobicContact CG-CE1 4.39Å; L178-F292 HydrophobicContact CG-CZ 4.22Å; N209-F292 WeakPolarHBondContact OD1-CZ 3.34Å; L211-F292 HydrophobicContact CD1-CE2 3.75Å; L211-F292 HydrophobicContact CD1-CZ 4.24Å; P241-F292 HydrophobicContact CG-CD2 3.99Å; P241-F292 HydrophobicContact CG-CE2 3.77Å; P241-F292 HydrophobicContact CG-CZ 4.11Å; Y244-F292 HydrophobicContact CD1-CD2 4.04Å; Y244-F292 HydrophobicContact CD1-CE2 4.01Å; Y244-F292 HydrophobicContact CD2-CD2 4.19Å; Y244-F292 HydrophobicContact CE1-CD2 4.12Å; Y244-F292 HydrophobicContact CE1-CE2 4.14Å; Y244-F292 HydrophobicContact CE2-CD2 4.29Å; Y244-F292 HydrophobicContact CG-CD2 4.08Å; Y244-F292 HydrophobicContact CG-CE2 4.42Å; F292-E295 WeakPolarHBondContact CD1-OE1 3.37Å; F292-E295 WeakPolarHBondContact CE1-OE1 3.39Å
293	G	75.3	Confident	85.3	Confident	33 Å²	33	27.2 Å²	27.2	34%	0.34	15%	0.153	S	C	.	.			trans	101.1	0.7	169	0	0	0	0	0	116	E295	G293-E295 VanDerWaalsContact C-N 3.29Å; G293-E295 VanDerWaalsContact C-OE2 3.29Å; G293-E295 WeakPolarHBondContact CA-OE1 3.47Å; G293-E295 VanDerWaalsContact CA-OE2 3.23Å; G293-E295 WeakPolarHBondContact CA-OE2 3.43Å; G293-E295 PolarHBondContact N-OE1 2.84Å; G293-E295 PolarHBondContact N-OE2 2.85Å
294	G	76.3	Confident	84.9	Confident	13 Å²	13	30 Å²	30	13%	0.134	17%	0.166	C	C	.	.	H	α-helix	trans	-70.7	-28.9	172.1	0	0	0	0	0	112.6	C148	C148-G294 VanDerWaalsContact CB-O 3.32Å; C148-G294 WeakPolarHBondContact CB-O 3.35Å
295	E	86	Confident	84.5	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-74.5	-33.4	-179.6	74.9	-59.9	147.6	0	0	113.4	I239 P241 A284 F292 G293 G297 L298 R299	I239-E295 HydrophobicContact CG2-CB 4.2Å; P241-E295 HydrophobicContact CB-CB 4.49Å; P241-E295 WeakPolarHBondContact CB-OE2 2.94Å; P241-E295 HydrophobicContact CG-CG 4.29Å; P241-E295 WeakPolarHBondContact CG-OE2 3.38Å; A284-E295 HydrophobicContact CB-CB 3.97Å; F292-E295 WeakPolarHBondContact CD1-OE1 3.37Å; F292-E295 WeakPolarHBondContact CE1-OE1 3.39Å; G293-E295 VanDerWaalsContact C-N 3.29Å; G293-E295 VanDerWaalsContact C-OE2 3.29Å; G293-E295 WeakPolarHBondContact CA-OE1 3.47Å; G293-E295 VanDerWaalsContact CA-OE2 3.23Å; G293-E295 WeakPolarHBondContact CA-OE2 3.43Å; G293-E295 PolarHBondContact N-OE1 2.84Å; G293-E295 PolarHBondContact N-OE2 2.85Å; E295-G297 VanDerWaalsContact C-N 3.3Å; E295-G297 PolarHBondContact O-N 2.95Å; E295-L298 PolarHBondContact O-N 3.13Å; E295-L298 VanDerWaalsContact O-N 3.1Å; E295-R299 WeakPolarHBondContact O-CB 3.12Å; E295-R299 PolarHBondContact O-N 2.98Å
296	L	84.2	Confident	84.3	Confident	48 Å²	48	32.8 Å²	32.8	25%	0.251	18%	0.177	S	C	.	.	H	α-helix	trans	-57.4	-41.8	-179.4	-61	-179.8	0	0	0	112.4	L298 R300	L296-L298 VanDerWaalsContact C-N 3.32Å; L296-L298 PolarHBondContact O-N 2.69Å; L296-R300 WeakPolarHBondContact O-CB 3.47Å; L296-R300 PolarHBondContact O-N 3.35Å
297	G	83.7	Confident	84	Confident	40 Å²	40	33.3 Å²	33.3	41%	0.412	18%	0.184	S	C	.	.	H	α-helix	trans	-69.6	-26.5	179.6	0	0	0	0	0	113.9	E295 R301	E295-G297 VanDerWaalsContact C-N 3.3Å; E295-G297 PolarHBondContact O-N 2.95Å; G297-R301 WeakPolarHBondContact O-CG 3.09Å; G297-R301 PolarHBondContact O-NE 3.05Å
298	L	89.8	Confident	83.8	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-78.7	-52.2	171.7	-172.7	108.8	0	0	0	110.4	L146 I239 L282 E295 L296 R300 R301 L302	L146-L298 HydrophobicContact CD1-CD1 3.42Å; L146-L298 VanDerWaalsContact CD1-CD1 3.42Å; L146-L298 HydrophobicContact CD1-CD2 3.92Å; L146-L298 HydrophobicContact CD1-CG 4.31Å; I239-L298 HydrophobicContact CG2-CD2 3.8Å; L282-L298 HydrophobicContact CD1-CD2 4.45Å; E295-L298 PolarHBondContact O-N 3.13Å; E295-L298 VanDerWaalsContact O-N 3.1Å; L296-L298 VanDerWaalsContact C-N 3.32Å; L296-L298 PolarHBondContact O-N 2.69Å; L298-R300 PolarHBondContact O-N 3.22Å; L298-R301 PolarHBondContact O-N 3.2Å; L298-R301 VanDerWaalsContact O-N 3.08Å; L298-L302 PolarHBondContact O-N 3.02Å
299	R	90.4	Very high	83.5	Confident	21 Å²	21	39.3 Å²	39.3	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-53.1	-49.7	-179.3	177.1	165.8	173.3	-178.7	-7.6	112	S173 I174 V207 T208 I239 E295 R301 L302 E303	S173-R299 PolarHBondContact OG-NH2 2.7Å; I174-R299 PolarHBondContact O-NH1 3.45Å; I174-R299 PolarHBondContact O-NH2 2.79Å; V207-R299 HydrophobicContact CG1-CG 4.28Å; V207-R299 PolarHBondContact O-NH2 3.26Å; T208-R299 PolarHBondContact O-NH1 3.17Å; I239-R299 HydrophobicContact CD1-CB 3.88Å; I239-R299 HydrophobicContact CD1-CG 3.96Å; I239-R299 HydrophobicContact CG2-CB 4.49Å; E295-R299 WeakPolarHBondContact O-CB 3.12Å; E295-R299 PolarHBondContact O-N 2.98Å; R299-R301 VanDerWaalsContact C-N 3.32Å; R299-R301 PolarHBondContact O-N 2.85Å; R299-L302 PolarHBondContact O-N 2.81Å; R299-E303 HydrophobicContact CG-CG 4.37Å; R299-E303 VanDerWaalsContact CG-OE1 3.27Å; R299-E303 WeakPolarHBondContact CG-OE1 3.34Å; R299-E303 IonicContact CZ-OE1 3.49Å; R299-E303 IonicContact NE-OE1 3.19Å; R299-E303 PolarHBondContact NE-OE1 2.79Å; R299-E303 IonicContact NH2-OE1 2.91Å; R299-E303 WeakPolarHBondContact O-CB 3.36Å; R299-E303 WeakPolarHBondContact O-CG 3.24Å; R299-E303 PolarHBondContact O-N 2.98Å
300	R	86.1	Confident	83	Confident	81 Å²	81	40.7 Å²	40.7	31%	0.306	22%	0.217	S	C	.	.	H	α-helix	trans	-58.8	-40.2	178.1	-171.6	-172.7	-168.2	178	14.7	113	L296 L298 Q304 E342	L296-R300 WeakPolarHBondContact O-CB 3.47Å; L296-R300 PolarHBondContact O-N 3.35Å; L298-R300 PolarHBondContact O-N 3.22Å; R300-Q304 VanDerWaalsContact O-CB 3.32Å; R300-Q304 WeakPolarHBondContact O-CB 3.15Å; R300-Q304 WeakPolarHBondContact O-CG 3.46Å; R300-Q304 PolarHBondContact O-N 3.39Å; R300-E342 IonicContact CZ-OE2 2.86Å; R300-E342 IonicContact NH1-OE2 3Å; R300-E342 PolarHBondContact NH1-OE2 2.84Å; R300-E342 PolarHBondContact NH2-O 3.28Å; R300-E342 IonicContact NH2-OE2 2.8Å; R300-E342 PolarHBondContact NH2-OE2 2.9Å
301	R	88.8	Confident	82.7	Confident	76 Å²	76	40.2 Å²	40.2	29%	0.287	21%	0.21	S	C	.	.	H	α-helix	trans	-72.3	-38.2	178.8	-69.6	-176.7	-58	129.8	11.4	111.6	C148 E149 T150 G297 L298 R299 Y305	C148-R301 PolarHBondContact O-NH2 2.66Å; E149-R301 PolarHBondContact O-NH1 2.65Å; E149-R301 PolarHBondContact O-NH2 2.72Å; T150-R301 PolarHBondContact O-NH1 2.01Å; T150-R301 PolarHBondContact O-NH2 2.51Å; G297-R301 WeakPolarHBondContact O-CG 3.09Å; G297-R301 PolarHBondContact O-NE 3.05Å; L298-R301 PolarHBondContact O-N 3.2Å; L298-R301 VanDerWaalsContact O-N 3.08Å; R299-R301 VanDerWaalsContact C-N 3.32Å; R299-R301 PolarHBondContact O-N 2.85Å; R301-Y305 WeakPolarHBondContact O-CB 3.48Å; R301-Y305 PolarHBondContact O-N 3.41Å
302	L	90	Very high	82	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-48.3	175.5	-177.5	61.9	0	0	0	111.5	V155 L237 I239 L282 L298 R299 Y305 L306	V155-L302 HydrophobicContact CB-CD1 4.13Å; V155-L302 HydrophobicContact CG1-CD1 3.8Å; V155-L302 HydrophobicContact CG1-CD2 4.02Å; L237-L302 HydrophobicContact CD2-CD2 4.28Å; I239-L302 HydrophobicContact CD1-CD2 4.07Å; L282-L302 HydrophobicContact CD1-CD2 3.95Å; L298-L302 PolarHBondContact O-N 3.02Å; R299-L302 PolarHBondContact O-N 2.81Å; L302-Y305 PolarHBondContact O-N 2.87Å; L302-Y305 VanDerWaalsContact O-N 3.13Å; L302-L306 HydrophobicContact CD1-CD1 4.46Å; L302-L306 HydrophobicContact CG-CD1 4.1Å; L302-L306 WeakPolarHBondContact O-CG 3.14Å; L302-L306 PolarHBondContact O-N 2.74Å
303	E	88.2	Confident	81.2	Confident	10 Å²	10	40.2 Å²	40.2	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-48.4	175.5	-70.8	169.4	176.2	0	0	111.2	S173 R299 Y305 L306 A307 I325	S173-E303 WeakPolarHBondContact CB-OE1 3.47Å; S173-E303 PolarHBondContact OG-OE1 3.36Å; R299-E303 HydrophobicContact CG-CG 4.37Å; R299-E303 VanDerWaalsContact CG-OE1 3.27Å; R299-E303 WeakPolarHBondContact CG-OE1 3.34Å; R299-E303 IonicContact CZ-OE1 3.49Å; R299-E303 IonicContact NE-OE1 3.19Å; R299-E303 PolarHBondContact NE-OE1 2.79Å; R299-E303 IonicContact NH2-OE1 2.91Å; R299-E303 WeakPolarHBondContact O-CB 3.36Å; R299-E303 WeakPolarHBondContact O-CG 3.24Å; R299-E303 PolarHBondContact O-N 2.98Å; E303-Y305 PolarHBondContact O-N 3.42Å; E303-Y305 VanDerWaalsContact O-N 3.16Å; E303-L306 PolarHBondContact O-N 2.99Å; E303-A307 PolarHBondContact O-N 2.77Å; E303-I325 HydrophobicContact CB-CD1 4.04Å; E303-I325 WeakPolarHBondContact O-CD1 3.15Å
304	Q	84.6	Confident	80.4	Confident	60 Å²	60	41.2 Å²	41.2	28%	0.28	21%	0.211	S	C	.	.	H	α-helix	trans	-63.2	-21.3	176.7	-74.1	177	1.2	0	0	114	R300 Q308	R300-Q304 VanDerWaalsContact O-CB 3.32Å; R300-Q304 WeakPolarHBondContact O-CB 3.15Å; R300-Q304 WeakPolarHBondContact O-CG 3.46Å; R300-Q304 PolarHBondContact O-N 3.39Å; Q304-Q308 PolarHBondContact O-NE2 3.48Å
305	Y	86.1	Confident	79.6	Confident	57 Å²	57	42.5 Å²	42.5	22%	0.224	21%	0.212	C	C	.	.	H	α-helix	trans	-86.8	-39.4	174.6	-169.3	-103.9	0	0	0	112.3	P152 E153 L156 R301 L302 E303 A307 Q308	P152-Y305 HydrophobicContact CB-CD1 4.19Å; P152-Y305 HydrophobicContact CB-CG 3.91Å; P152-Y305 HydrophobicContact CG-CD2 4.15Å; P152-Y305 HydrophobicContact CG-CG 4.01Å; E153-Y305 HydrophobicContact CG-CE2 3.97Å; E153-Y305 WeakPolarHBondContact OE1-CE2 3.28Å; L156-Y305 HydrophobicContact CB-CD1 4.3Å; L156-Y305 HydrophobicContact CB-CE1 4.04Å; L156-Y305 HydrophobicContact CD2-CD1 4.06Å; L156-Y305 HydrophobicContact CD2-CE1 3.59Å; L156-Y305 HydrophobicContact CG-CE1 4.45Å; R301-Y305 WeakPolarHBondContact O-CB 3.48Å; R301-Y305 PolarHBondContact O-N 3.41Å; L302-Y305 PolarHBondContact O-N 2.87Å; L302-Y305 VanDerWaalsContact O-N 3.13Å; E303-Y305 PolarHBondContact O-N 3.42Å; E303-Y305 VanDerWaalsContact O-N 3.16Å; Y305-A307 VanDerWaalsContact C-N 3.33Å; Y305-A307 PolarHBondContact O-N 2.89Å; Y305-Q308 WeakPolarHBondContact O-CB 3.23Å; Y305-Q308 PolarHBondContact O-N 3.11Å; Y305-Q308 VanDerWaalsContact O-N 3.11Å
306	L	86.6	Confident	78.3	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-42.2	172.4	-74.8	168	0	0	0	111.4	L156 V171 W205 L302 E303 Q308 Q309 I325	L156-L306 HydrophobicContact CD1-CD2 3.7Å; V171-L306 HydrophobicContact CG2-CD1 4.33Å; W205-L306 HydrophobicContact CE3-CD1 4.2Å; W205-L306 HydrophobicContact CE3-CD2 4.47Å; W205-L306 HydrophobicContact CH2-CD2 4.44Å; W205-L306 HydrophobicContact CZ3-CD1 4.11Å; W205-L306 HydrophobicContact CZ3-CD2 3.87Å; L302-L306 HydrophobicContact CD1-CD1 4.46Å; L302-L306 HydrophobicContact CG-CD1 4.1Å; L302-L306 WeakPolarHBondContact O-CG 3.14Å; L302-L306 PolarHBondContact O-N 2.74Å; E303-L306 PolarHBondContact O-N 2.99Å; L306-Q308 PolarHBondContact O-N 2.93Å; L306-Q309 WeakPolarHBondContact O-CB 3.24Å; L306-Q309 PolarHBondContact O-N 2.7Å; L306-I325 HydrophobicContact CB-CD1 4.13Å
307	A	82	Confident	76.9	Confident	32 Å²	32	47.2 Å²	47.2	26%	0.264	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-2.9	174.9	0	0	0	0	0	114.9	E303 Y305 I325	E303-A307 PolarHBondContact O-N 2.77Å; Y305-A307 VanDerWaalsContact C-N 3.33Å; Y305-A307 PolarHBondContact O-N 2.89Å; A307-I325 HydrophobicContact CB-CD1 3.85Å; A307-I325 HydrophobicContact CB-CG1 4.12Å
308	Q	80.4	Confident	75.4	Confident	101 Å²	101	47.9 Å²	47.9	47%	0.472	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-11.2	175.2	-61.2	177.7	67	0	0	113.3	Q304 Y305 L306	Q304-Q308 PolarHBondContact O-NE2 3.48Å; Y305-Q308 WeakPolarHBondContact O-CB 3.23Å; Y305-Q308 PolarHBondContact O-N 3.11Å; Y305-Q308 VanDerWaalsContact O-N 3.11Å; L306-Q308 PolarHBondContact O-N 2.93Å
309	Q	78.2	Confident	73.7	Confident	45 Å²	45	51.6 Å²	51.6	21%	0.21	28%	0.28	C	S	.	.	S	Bend	trans	-76.4	148.6	177.8	-57.9	-53.5	-35.2	0	0	111.3	L156 L306 R322 V323	L156-Q309 HydrophobicContact CD2-CG 3.79Å; L306-Q309 WeakPolarHBondContact O-CB 3.24Å; L306-Q309 PolarHBondContact O-N 2.7Å; Q309-R322 CarbonylContact O-C 3.55Å; Q309-R322 VanDerWaalsContact O-CA 3.23Å; Q309-R322 WeakPolarHBondContact O-CA 3.14Å; Q309-V323 HydrophobicContact CB-CG2 4.25Å; Q309-V323 PolarHBondContact O-N 3.36Å
310	P	74.3	Confident	72.2	Confident	49 Å²	49	57.9 Å²	57.9	32%	0.318	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-78.7	144.7	173.6	32.7	-34.1	0	0	0	111.9	K320 S321	P310-K320 HydrophobicContact CB-CB 3.78Å; P310-K320 HydrophobicContact CB-CD 3.58Å; P310-K320 HydrophobicContact CB-CG 4.27Å; P310-K320 HydrophobicContact CG-CD 4.11Å; P310-S321 WeakPolarHBondContact CA-O 3.3Å
311	I	71.5	Confident	71.3	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.041	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-68.1	138.3	169.5	-56.8	177.1	0	0	0	109.7	N169 M313 S321 R322 V323 L455	N169-I311 VanDerWaalsContact OD1-CG2 3.3Å; N169-I311 WeakPolarHBondContact OD1-CG2 3.44Å; I311-M313 HydrophobicContact CG2-CB 4.16Å; I311-M313 PolarHBondContact O-N 3.01Å; I311-S321 PolarHBondContact N-O 3.35Å; I311-R322 WeakPolarHBondContact CD1-O 3.42Å; I311-V323 HydrophobicContact CG1-CG2 4.33Å; I311-L455 HydrophobicContact CD1-CD2 3.89Å
312	D	63	Low	70.7	Confident	132 Å²	132	58 Å²	58	71%	0.706	31%	0.309	S	S	*	.			trans	-82	51.3	178.7	-160.9	22.9	0	0	0	112.9
313	M	59.9	Low	70.3	Confident	27 Å²	27	58 Å²	58	13%	0.133	31%	0.31	C	S	.	.			trans	-101.6	133.3	173.1	-175.7	-171.4	-175.9	0	0	109	I311 R315 M457 A458 D487	I311-M313 HydrophobicContact CG2-CB 4.16Å; I311-M313 PolarHBondContact O-N 3.01Å; M313-R315 HydrophobicContact CB-CG 4.4Å; M313-R315 HydrophobicContact CG-CG 4.25Å; M313-R315 PolarHBondContact O-N 3.26Å; M313-R315 VanDerWaalsContact O-N 3.16Å; M313-R315 HydrophobicContact SD-CG 4.26Å; M313-M457 HydrophobicContact CE-CB 3.88Å; M313-M457 HydrophobicContact CE-CE 4.18Å; M313-A458 HydrophobicContact SD-CB 3.86Å; M313-D487 HydrophobicContact CE-CB 4.29Å
314	R	58	Low	70.3	Confident	55 Å²	55	58.2 Å²	58.2	21%	0.208	31%	0.312	C	S	.	.			trans	-69.9	114.7	174	-57.7	-172.4	-156.9	152.3	18.8	108.8	N491 D523 N525 M1985	R314-N491 PolarHBondContact O-ND2 2.69Å; R314-D523 IonicContact NH1-OD1 2.82Å; R314-N525 PolarHBondContact NH2-ND2 2.84Å; R314-N525 VanDerWaalsContact NH2-ND2 3.16Å; R314-M1985 PolarHBondContact NH2-O 3.14Å; R314-M1985 PolarHBondContact NH2-SD 3.34Å
315	R	60.6	Low	70.5	Confident	40 Å²	40	56 Å²	56	15%	0.151	30%	0.302	C	S	.	.			trans	-123.8	124	-176.1	-69.2	177.9	175.2	-132.3	-8	111.8	M313 S319 S454 D487	M313-R315 HydrophobicContact CB-CG 4.4Å; M313-R315 HydrophobicContact CG-CG 4.25Å; M313-R315 PolarHBondContact O-N 3.26Å; M313-R315 VanDerWaalsContact O-N 3.16Å; M313-R315 HydrophobicContact SD-CG 4.26Å; R315-S319 VanDerWaalsContact CD-O 3.28Å; R315-S319 WeakPolarHBondContact CD-O 3.22Å; R315-S319 PolarHBondContact NH1-O 2.86Å; R315-S454 VanDerWaalsContact CZ-OG 3.28Å; R315-S454 VanDerWaalsContact NH1-CB 3.34Å; R315-S454 PolarHBondContact NH1-OG 3.45Å; R315-S454 PolarHBondContact NH2-O 2.89Å; R315-S454 PolarHBondContact NH2-OG 2.95Å; R315-D487 WeakPolarHBondContact CA-OD1 3.44Å
316	Y	57.5	Low	70.7	Confident	84 Å²	84	53.2 Å²	53.2	33%	0.329	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-68.5	148.8	170.4	-168.3	-97	0	0	0	111	G318 N483 D487 E518	Y316-G318 PolarHBondContact O-N 2.9Å; Y316-G318 VanDerWaalsContact O-N 3.13Å; Y316-N483 WeakPolarHBondContact CD1-OD1 3.39Å; Y316-D487 PolarHBondContact N-OD1 3.4Å; Y316-E518 VanDerWaalsContact CE2-CD 3.49Å; Y316-E518 WeakPolarHBondContact CE2-OE1 3.49Å; Y316-E518 WeakPolarHBondContact CE2-OE2 3.4Å; Y316-E518 VanDerWaalsContact OH-CD 3.29Å; Y316-E518 PolarHBondContact OH-OE1 3.2Å; Y316-E518 PolarHBondContact OH-OE2 3.42Å; Y316-E518 VanDerWaalsContact OH-OE2 3.12Å
317	G	54.4	Low	71	Confident	65 Å²	65	53.2 Å²	53.2	67%	0.67	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	71.7	-2.7	-176.1	0	0	0	0	0	115.5	S319	G317-S319 VanDerWaalsContact C-N 3.32Å; G317-S319 PolarHBondContact O-N 3.34Å
318	G	52.2	Low	71.6	Confident	54 Å²	54	51.7 Å²	51.7	56%	0.557	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	74.2	6.5	165.5	0	0	0	0	0	117.1	Y316 K320	Y316-G318 PolarHBondContact O-N 2.9Å; Y316-G318 VanDerWaalsContact O-N 3.13Å; G318-K320 PolarHBondContact O-N 2.89Å
319	S	55.8	Low	72.2	Confident	81 Å²	81	46.9 Å²	46.9	57%	0.566	26%	0.256	S	S	*	.			trans	-74.7	95.2	175.2	-165.8	0	0	0	0	111	R315 G317 S321	R315-S319 VanDerWaalsContact CD-O 3.28Å; R315-S319 WeakPolarHBondContact CD-O 3.22Å; R315-S319 PolarHBondContact NH1-O 2.86Å; G317-S319 VanDerWaalsContact C-N 3.32Å; G317-S319 PolarHBondContact O-N 3.34Å; S319-S321 PolarHBondContact O-N 3.27Å
320	K	58.6	Low	72.8	Confident	152 Å²	152	44.9 Å²	44.9	66%	0.661	25%	0.247	S	C	*	.			trans	-76.6	110.5	-179.3	-54.9	-165.8	-178.9	-162.9	0	110.6	P310 G318	P310-K320 HydrophobicContact CB-CB 3.78Å; P310-K320 HydrophobicContact CB-CD 3.58Å; P310-K320 HydrophobicContact CB-CG 4.27Å; P310-K320 HydrophobicContact CG-CD 4.11Å; G318-K320 PolarHBondContact O-N 2.89Å
321	S	66.9	Low	73.5	Confident	9 Å²	9	43 Å²	43	6%	0.063	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-61	145.5	164.3	-175.6	0	0	0	0	109.8	P310 I311 S319	P310-S321 WeakPolarHBondContact CA-O 3.3Å; I311-S321 PolarHBondContact N-O 3.35Å; S319-S321 PolarHBondContact O-N 3.27Å
322	R	76.2	Confident	74.2	Confident	150 Å²	150	42.7 Å²	42.7	57%	0.566	23%	0.232	S	C	*	.	B	Isolated β-bridge	trans	-80.8	158.7	171	-64.2	167.4	-174.3	-100.7	-4.3	110.2	Q309 I311 P324	Q309-R322 CarbonylContact O-C 3.55Å; Q309-R322 VanDerWaalsContact O-CA 3.23Å; Q309-R322 WeakPolarHBondContact O-CA 3.14Å; I311-R322 WeakPolarHBondContact CD1-O 3.42Å; R322-P324 WeakPolarHBondContact O-CD 3.46Å
323	V	82.3	Confident	75.3	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.024	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-64.2	120.8	171.5	-178.5	0	0	0	0	109.8	V167 P168 V171 Q309 I311	V167-V323 HydrophobicContact CG1-CG2 4.2Å; P168-V323 HydrophobicContact CB-CG1 4.3Å; P168-V323 HydrophobicContact CG-CG1 4.01Å; P168-V323 WeakPolarHBondContact O-CG2 3.46Å; V171-V323 HydrophobicContact CG2-CG1 3.84Å; Q309-V323 HydrophobicContact CB-CG2 4.25Å; Q309-V323 PolarHBondContact O-N 3.36Å; I311-V323 HydrophobicContact CG1-CG2 4.33Å
324	P	86.8	Confident	76.6	Confident	16 Å²	16	38.1 Å²	38.1	10%	0.104	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-73.1	146.7	172.7	30	-33.5	0	0	0	111	N169 L170 V171 R322 L439 L455 W459	N169-P324 VanDerWaalsContact O-CD 3.26Å; N169-P324 WeakPolarHBondContact O-CD 3.45Å; N169-P324 WeakPolarHBondContact O-CG 3.32Å; L170-P324 HydrophobicContact CB-CG 4.48Å; L170-P324 HydrophobicContact CD1-CB 4.27Å; L170-P324 HydrophobicContact CD1-CG 3.94Å; V171-P324 PolarHBondContact N-O 2.87Å; R322-P324 WeakPolarHBondContact O-CD 3.46Å; P324-L439 HydrophobicContact CB-CD1 4.22Å; P324-L439 HydrophobicContact CB-CD2 3.96Å; P324-L455 HydrophobicContact CG-CD2 4.17Å; P324-W459 HydrophobicContact CG-CZ2 4Å
325	I	89	Confident	77.8	Confident	12 Å²	12	40.1 Å²	40.1	6%	0.062	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.7	174.7	-52	-161.9	0	0	0	108.8	V171 E303 L306 A307 V350 P351	V171-I325 HydrophobicContact CB-CB 4.46Å; V171-I325 HydrophobicContact CB-CD1 4.28Å; V171-I325 HydrophobicContact CB-CG1 4.01Å; V171-I325 HydrophobicContact CB-CG2 4.24Å; V171-I325 HydrophobicContact CG1-CG2 4.41Å; V171-I325 HydrophobicContact CG2-CD1 4.44Å; V171-I325 HydrophobicContact CG2-CG1 4.35Å; V171-I325 WeakPolarHBondContact O-CA 3.32Å; E303-I325 HydrophobicContact CB-CD1 4.04Å; E303-I325 WeakPolarHBondContact O-CD1 3.15Å; L306-I325 HydrophobicContact CB-CD1 4.13Å; A307-I325 HydrophobicContact CB-CD1 3.85Å; A307-I325 HydrophobicContact CB-CG1 4.12Å; I325-V350 HydrophobicContact CG2-CG1 4.13Å; I325-P351 WeakPolarHBondContact O-CD 3.46Å
326	V	91.1	Very high	79.1	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132.2	177.8	61.2	0	0	0	0	109.7	L170 V171 I172 S173 V353 I435 L439	L170-V326 HydrophobicContact CD1-CG1 4.03Å; V171-V326 PolarHBondContact O-N 3.41Å; I172-V326 HydrophobicContact CB-CG1 4.47Å; I172-V326 HydrophobicContact CG1-CG1 3.98Å; S173-V326 PolarHBondContact N-O 2.66Å; V326-V353 HydrophobicContact CG2-CG2 4.11Å; V326-I435 HydrophobicContact CG1-CG2 3.7Å; V326-I435 HydrophobicContact CG2-CG2 4.26Å; V326-L439 HydrophobicContact CB-CD1 4.27Å; V326-L439 HydrophobicContact CB-CD2 4.05Å; V326-L439 HydrophobicContact CB-CG 4.18Å; V326-L439 HydrophobicContact CG1-CD1 4.41Å
327	G	92.2	Very high	80.5	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	141.1	169.2	0	0	0	0	0	110.8	S173 P351 I352 V353	S173-G327 CarbonylContact O-C 3.54Å; S173-G327 VanDerWaalsContact O-CA 3.3Å; S173-G327 WeakPolarHBondContact O-CA 3.41Å; G327-P351 PolarHBondContact N-O 3.35Å; G327-I352 CarbonylContact O-C 2.82Å; G327-I352 WeakPolarHBondContact O-CA 3.27Å; G327-V353 PolarHBondContact O-N 3.19Å
328	V	93.7	Very high	82	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.2	167.6	-178.2	0	0	0	0	108	I172 S173 I174 V175 L330 V353 I435	I172-V328 HydrophobicContact CG2-CG2 3.93Å; S173-V328 PolarHBondContact O-N 3.4Å; I174-V328 HydrophobicContact CG1-CB 4.44Å; V175-V328 PolarHBondContact N-O 2.7Å; V175-V328 VanDerWaalsContact O-O 3.04Å; V328-L330 HydrophobicContact CG1-CD1 4.42Å; V328-L330 HydrophobicContact CG1-CG 4.32Å; V328-V353 WeakPolarHBondContact CA-O 3.45Å; V328-I435 HydrophobicContact CG2-CD1 4.05Å; V328-I435 HydrophobicContact CG2-CG1 4.19Å
329	L	93.8	Very high	83.7	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	115.1	178	179.4	62.3	0	0	0	110.3	V175 T336 V340 I352 V353 V354 C355 A362 L365	V175-L329 HydrophobicContact CG1-CD1 4.35Å; V175-L329 WeakPolarHBondContact O-CA 3.3Å; L329-T336 HydrophobicContact CD1-CG2 3.74Å; L329-V340 HydrophobicContact CD1-CG2 3.96Å; L329-V340 HydrophobicContact CD2-CG2 4.08Å; L329-V340 HydrophobicContact CG-CG2 4.47Å; L329-I352 HydrophobicContact CB-CG2 3.87Å; L329-V353 PolarHBondContact N-O 3Å; L329-V354 HydrophobicContact CB-CG2 4.44Å; L329-V354 HydrophobicContact CD2-CG1 4.22Å; L329-V354 HydrophobicContact CD2-CG2 4.23Å; L329-C355 PolarHBondContact O-N 2.6Å; L329-A362 HydrophobicContact CD2-CB 4.38Å; L329-A362 HydrophobicContact CG-CB 4.23Å; L329-L365 HydrophobicContact CD2-CD2 3.71Å
330	L	91.2	Very high	85.2	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.3	172.3	-70.8	160.7	0	0	0	108.6	V175 G176 V191 I195 V215 I219 V328 C355	V175-L330 PolarHBondContact O-N 3.21Å; V175-L330 VanDerWaalsContact O-N 3.17Å; G176-L330 WeakPolarHBondContact CA-O 3.25Å; V191-L330 HydrophobicContact CG1-CD1 3.71Å; V191-L330 HydrophobicContact CG1-CD2 3.86Å; V191-L330 HydrophobicContact CG1-CG 4.44Å; V191-L330 HydrophobicContact CG2-CD2 3.93Å; I195-L330 HydrophobicContact CD1-CD1 4.33Å; V215-L330 HydrophobicContact CG1-CB 3.72Å; V215-L330 HydrophobicContact CG1-CD1 3.64Å; V215-L330 HydrophobicContact CG1-CG 4.32Å; V215-L330 HydrophobicContact CG2-CB 3.91Å; V215-L330 WeakPolarHBondContact CG2-O 3.32Å; I219-L330 HydrophobicContact CD1-CD1 4.48Å; V328-L330 HydrophobicContact CG1-CD1 4.42Å; V328-L330 HydrophobicContact CG1-CG 4.32Å; L330-C355 HydrophobicContact CD2-CB 3.77Å
331	E	88.7	Confident	86.7	Confident	11 Å²	11	27.1 Å²	27.1	5%	0.051	13%	0.129	C	C	.	.	S	Bend	trans	55.6	-139.7	179.9	-146.8	-106.2	177.6	0	0	112.2	G177 A181 V215 S358 G359 R360 A362	G177-E331 VanDerWaalsContact CA-OE2 3.29Å; G177-E331 WeakPolarHBondContact CA-OE2 3.29Å; A181-E331 HydrophobicContact CB-CG 4.06Å; A181-E331 WeakPolarHBondContact CB-OE1 3.5Å; V215-E331 HydrophobicContact CG2-CB 4.27Å; E331-S358 VanDerWaalsContact CA-O 3.3Å; E331-S358 WeakPolarHBondContact CA-O 3.44Å; E331-S358 VanDerWaalsContact CB-O 3.25Å; E331-S358 WeakPolarHBondContact CB-O 3.33Å; E331-S358 WeakPolarHBondContact CG-O 3.24Å; E331-S358 PolarHBondContact N-O 2.85Å; E331-S358 PolarHBondContact N-OG 3.48Å; E331-S358 VanDerWaalsContact N-OG 3.08Å; E331-G359 CarbonylContact C-O 3.45Å; E331-G359 VanDerWaalsContact CA-O 3.28Å; E331-G359 WeakPolarHBondContact CA-O 3.43Å; E331-R360 IonicContact OE1-CZ 2.7Å; E331-R360 IonicContact OE1-NE 2.9Å; E331-R360 PolarHBondContact OE1-NE 3.17Å; E331-R360 IonicContact OE1-NH2 3.6Å; E331-R360 PolarHBondContact OE1-NH2 2.87Å; E331-R360 IonicContact OE2-CZ 3.67Å; E331-R360 IonicContact OE2-NE 2.66Å; E331-R360 IonicContact OE2-NH2 3.39Å; E331-R360 PolarHBondContact OE2-NH2 3.38Å; E331-A362 PolarHBondContact O-N 3.43Å
332	G	87.2	Confident	87.5	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.144	C	C	.	.			trans	123.6	153.2	166.1	0	0	0	0	0	115.9	R360 A361	G332-R360 VanDerWaalsContact O-CB 3.28Å; G332-R360 WeakPolarHBondContact O-CB 3.39Å; G332-A361 WeakPolarHBondContact O-CB 3.32Å; G332-A361 PolarHBondContact O-N 2.96Å
333	G	85.8	Confident	87.9	Confident	15 Å²	15	24 Å²	24	16%	0.155	12%	0.12	C	C	.	.			trans	-106.5	-172.9	172.4	0	0	0	0	0	113.2	Q335 T336 F337	G333-Q335 VanDerWaalsContact C-N 3.29Å; G333-Q335 PolarHBondContact O-N 3.45Å; G333-T336 PolarHBondContact N-OG1 3.25Å; G333-T336 VanDerWaalsContact O-CB 3.29Å; G333-T336 WeakPolarHBondContact O-CB 3.5Å; G333-T336 PolarHBondContact O-N 2.84Å; G333-T336 VanDerWaalsContact O-N 3.1Å; G333-F337 PolarHBondContact O-N 2.91Å
334	T	86.4	Confident	88.1	Confident	49 Å²	49	23.8 Å²	23.8	30%	0.301	12%	0.119	S	C	.	.	H	α-helix	trans	-58.8	-36.3	178.9	56.4	0	0	0	0	113.3	R338 F394 I396 L404	T334-R338 PolarHBondContact O-N 2.83Å; T334-R338 VanDerWaalsContact O-N 3.1Å; T334-F394 HydrophobicContact CG2-CB 3.59Å; T334-F394 HydrophobicContact CG2-CD1 3.8Å; T334-F394 HydrophobicContact CG2-CD2 3.89Å; T334-F394 HydrophobicContact CG2-CE1 4.43Å; T334-F394 HydrophobicContact CG2-CG 3.49Å; T334-F394 VanDerWaalsContact CG2-CG 3.49Å; T334-I396 HydrophobicContact CG2-CD1 4.49Å; T334-I396 HydrophobicContact CG2-CG2 4.26Å; T334-L404 HydrophobicContact CG2-CD1 3.69Å
335	Q	82.6	Confident	88.1	Confident	96 Å²	96	25 Å²	25	45%	0.449	13%	0.126	S	C	.	.	H	α-helix	trans	-73.8	-36.7	175.2	-172.3	57.2	35.9	0	0	112.3	G333 F337 R338 T339	G333-Q335 VanDerWaalsContact C-N 3.29Å; G333-Q335 PolarHBondContact O-N 3.45Å; Q335-F337 VanDerWaalsContact C-N 3.29Å; Q335-F337 PolarHBondContact O-N 2.92Å; Q335-R338 PolarHBondContact O-N 3.4Å; Q335-T339 PolarHBondContact O-N 3.45Å; Q335-T339 PolarHBondContact O-OG1 3.42Å
336	T	87.7	Confident	87.6	Confident	17 Å²	17	25 Å²	25	10%	0.104	13%	0.129	C	C	.	.	H	α-helix	trans	-57.8	-46.6	172	-46.1	0	0	0	0	110.3	V175 G176 L329 G333 R338 T339 V340	V175-T336 HydrophobicContact CG1-CG2 3.63Å; G176-T336 VanDerWaalsContact O-CG2 3.23Å; G176-T336 WeakPolarHBondContact O-CG2 3.24Å; G176-T336 PolarHBondContact O-OG1 3.37Å; L329-T336 HydrophobicContact CD1-CG2 3.74Å; G333-T336 PolarHBondContact N-OG1 3.25Å; G333-T336 VanDerWaalsContact O-CB 3.29Å; G333-T336 WeakPolarHBondContact O-CB 3.5Å; G333-T336 PolarHBondContact O-N 2.84Å; G333-T336 VanDerWaalsContact O-N 3.1Å; T336-R338 PolarHBondContact O-N 2.84Å; T336-T339 WeakPolarHBondContact O-CB 3.23Å; T336-T339 PolarHBondContact O-N 3.16Å; T336-V340 WeakPolarHBondContact O-CG2 3.49Å; T336-V340 PolarHBondContact O-N 3.33Å
337	F	87.1	Confident	86.9	Confident	8 Å²	8	36.7 Å²	36.7	4%	0.035	17%	0.173	C	C	.	.	H	α-helix	trans	-59.9	-40.9	176.3	175.4	-95.4	0	0	0	112.7	G333 Q335 V340 F341 A361 L365 L404 E407 L408	G333-F337 PolarHBondContact O-N 2.91Å; Q335-F337 VanDerWaalsContact C-N 3.29Å; Q335-F337 PolarHBondContact O-N 2.92Å; F337-V340 WeakPolarHBondContact O-CB 3.38Å; F337-V340 PolarHBondContact O-N 2.83Å; F337-F341 WeakPolarHBondContact O-CB 3.49Å; F337-F341 PolarHBondContact O-N 3.17Å; F337-A361 HydrophobicContact CB-CB 4.44Å; F337-L365 HydrophobicContact CE2-CD1 4.4Å; F337-L404 HydrophobicContact CD1-CD2 4.11Å; F337-L404 HydrophobicContact CE1-CD2 4.35Å; F337-E407 HydrophobicContact CE1-CB 3.76Å; F337-E407 HydrophobicContact CZ-CB 4.25Å; F337-L408 HydrophobicContact CE2-CB 4.12Å; F337-L408 HydrophobicContact CE2-CD1 4.1Å; F337-L408 HydrophobicContact CE2-CG 3.69Å; F337-L408 HydrophobicContact CZ-CB 3.65Å; F337-L408 HydrophobicContact CZ-CD1 4.38Å; F337-L408 HydrophobicContact CZ-CG 3.78Å
338	R	87.4	Confident	86.1	Confident	106 Å²	106	40.2 Å²	40.2	40%	0.4	19%	0.192	S	C	.	.	H	α-helix	trans	-65.1	-39.6	173.9	-79.2	178.2	170.4	163.1	-1.9	113.6	T334 Q335 T336 V340 F341 E342 E407	T334-R338 PolarHBondContact O-N 2.83Å; T334-R338 VanDerWaalsContact O-N 3.1Å; Q335-R338 PolarHBondContact O-N 3.4Å; T336-R338 PolarHBondContact O-N 2.84Å; R338-V340 VanDerWaalsContact C-N 3.34Å; R338-V340 PolarHBondContact O-N 2.74Å; R338-F341 WeakPolarHBondContact O-CB 3.38Å; R338-F341 PolarHBondContact O-N 2.76Å; R338-E342 WeakPolarHBondContact O-CB 3.04Å; R338-E342 WeakPolarHBondContact O-CG 3.33Å; R338-E342 PolarHBondContact O-N 2.99Å; R338-E407 WeakPolarHBondContact CG-OE2 3.48Å; R338-E407 IonicContact CZ-OE1 3.68Å; R338-E407 IonicContact NE-OE1 2.84Å; R338-E407 PolarHBondContact NE-OE1 3.36Å; R338-E407 IonicContact NE-OE2 2.81Å; R338-E407 PolarHBondContact NE-OE2 2.93Å; R338-E407 IonicContact NH2-OE1 2.66Å; R338-E407 PolarHBondContact NH2-OE1 2.91Å
339	T	86.5	Confident	85.4	Confident	31 Å²	31	41.5 Å²	41.5	19%	0.19	20%	0.2	C	C	.	.	H	α-helix	trans	-60.5	-44.5	172.6	-57.5	0	0	0	0	111.1	V175 Q335 T336 E342 L343	V175-T339 HydrophobicContact CG1-CG2 4.36Å; Q335-T339 PolarHBondContact O-N 3.45Å; Q335-T339 PolarHBondContact O-OG1 3.42Å; T336-T339 WeakPolarHBondContact O-CB 3.23Å; T336-T339 PolarHBondContact O-N 3.16Å; T339-E342 PolarHBondContact O-N 3.46Å; T339-L343 HydrophobicContact CG2-CD1 4.09Å; T339-L343 WeakPolarHBondContact O-CB 3.43Å; T339-L343 VanDerWaalsContact O-CG 3.28Å; T339-L343 WeakPolarHBondContact O-CG 3.35Å; T339-L343 PolarHBondContact O-N 2.89Å
340	V	88.7	Confident	84.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.2	-48.9	174	163.2	0	0	0	0	111.4	V175 L329 T336 F337 R338 E342 L343 V344 I352 L365	V175-V340 HydrophobicContact CG1-CG2 3.94Å; L329-V340 HydrophobicContact CD1-CG2 3.96Å; L329-V340 HydrophobicContact CD2-CG2 4.08Å; L329-V340 HydrophobicContact CG-CG2 4.47Å; T336-V340 WeakPolarHBondContact O-CG2 3.49Å; T336-V340 PolarHBondContact O-N 3.33Å; F337-V340 WeakPolarHBondContact O-CB 3.38Å; F337-V340 PolarHBondContact O-N 2.83Å; R338-V340 VanDerWaalsContact C-N 3.34Å; R338-V340 PolarHBondContact O-N 2.74Å; V340-E342 PolarHBondContact O-N 3.44Å; V340-L343 PolarHBondContact O-N 3.49Å; V340-V344 WeakPolarHBondContact O-CG2 3.42Å; V340-V344 PolarHBondContact O-N 3.44Å; V340-I352 HydrophobicContact CB-CD1 4.16Å; V340-I352 HydrophobicContact CG1-CD1 3.85Å; V340-I352 HydrophobicContact CG2-CD1 4.12Å; V340-L365 HydrophobicContact CG1-CD2 3.9Å
341	F	88.7	Confident	84.8	Confident	41 Å²	41	42.2 Å²	42.2	18%	0.18	21%	0.205	C	C	.	.	H	α-helix	trans	-57.6	-44.9	175.5	171.7	-98.1	0	0	0	112.4	F337 R338 L343 V344 T345 E407 L410 C411	F337-F341 WeakPolarHBondContact O-CB 3.49Å; F337-F341 PolarHBondContact O-N 3.17Å; R338-F341 WeakPolarHBondContact O-CB 3.38Å; R338-F341 PolarHBondContact O-N 2.76Å; F341-L343 VanDerWaalsContact C-N 3.33Å; F341-L343 PolarHBondContact O-N 3.49Å; F341-V344 PolarHBondContact O-N 3.17Å; F341-T345 HydrophobicContact CD2-CG2 3.85Å; F341-T345 HydrophobicContact CE2-CG2 3.66Å; F341-T345 HydrophobicContact CG-CG2 4.45Å; F341-T345 HydrophobicContact CZ-CG2 4.12Å; F341-T345 WeakPolarHBondContact O-CB 3.13Å; F341-T345 WeakPolarHBondContact O-CG2 3.39Å; F341-T345 PolarHBondContact O-N 2.76Å; F341-T345 PolarHBondContact O-OG1 3.43Å; F341-E407 HydrophobicContact CD2-CB 4.15Å; F341-E407 VanDerWaalsContact CD2-O 3.3Å; F341-E407 WeakPolarHBondContact CD2-O 3.28Å; F341-E407 HydrophobicContact CE2-CB 4.19Å; F341-E407 WeakPolarHBondContact CE2-O 3.47Å; F341-L410 HydrophobicContact CE2-CB 4.16Å; F341-L410 HydrophobicContact CE2-CD2 3.97Å; F341-L410 HydrophobicContact CE2-CG 4.37Å; F341-L410 HydrophobicContact CZ-CD2 3.99Å; F341-C411 HydrophobicContact CD2-CB 4.36Å
342	E	84.7	Confident	85	Confident	80 Å²	80	41.8 Å²	41.8	37%	0.374	20%	0.203	S	C	.	.	H	α-helix	trans	-70	-22.7	179.2	-81	-162.1	-124.6	0	0	114.8	R300 R338 T339 V340 G346	R300-E342 IonicContact CZ-OE2 2.86Å; R300-E342 IonicContact NH1-OE2 3Å; R300-E342 PolarHBondContact NH1-OE2 2.84Å; R300-E342 PolarHBondContact NH2-O 3.28Å; R300-E342 IonicContact NH2-OE2 2.8Å; R300-E342 PolarHBondContact NH2-OE2 2.9Å; R338-E342 WeakPolarHBondContact O-CB 3.04Å; R338-E342 WeakPolarHBondContact O-CG 3.33Å; R338-E342 PolarHBondContact O-N 2.99Å; T339-E342 PolarHBondContact O-N 3.46Å; V340-E342 PolarHBondContact O-N 3.44Å; E342-G346 PolarHBondContact O-N 3.07Å
343	L	84.5	Confident	85.3	Confident	14 Å²	14	41.8 Å²	41.8	7%	0.073	20%	0.203	C	C	.	.	H	α-helix	trans	-81.6	-42.1	173.4	-74	169	0	0	0	111.7	V175 T339 V340 F341 P349 V350 I352	V175-L343 HydrophobicContact CG2-CD1 4.25Å; T339-L343 HydrophobicContact CG2-CD1 4.09Å; T339-L343 WeakPolarHBondContact O-CB 3.43Å; T339-L343 VanDerWaalsContact O-CG 3.28Å; T339-L343 WeakPolarHBondContact O-CG 3.35Å; T339-L343 PolarHBondContact O-N 2.89Å; V340-L343 PolarHBondContact O-N 3.49Å; F341-L343 VanDerWaalsContact C-N 3.33Å; F341-L343 PolarHBondContact O-N 3.49Å; L343-P349 WeakPolarHBondContact O-CA 3.45Å; L343-V350 HydrophobicContact CB-CB 4.39Å; L343-V350 HydrophobicContact CD2-CB 4.27Å; L343-V350 HydrophobicContact CD2-CG2 4.06Å; L343-V350 PolarHBondContact O-N 3.24Å; L343-V350 VanDerWaalsContact O-N 3.13Å; L343-I352 HydrophobicContact CB-CD1 4.13Å; L343-I352 HydrophobicContact CD1-CD1 4.34Å
344	V	86.8	Confident	85.6	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-75.5	-39.6	-180	172.8	0	0	0	0	112.1	V340 F341 I352 R414 L417 I418	V340-V344 WeakPolarHBondContact O-CG2 3.42Å; V340-V344 PolarHBondContact O-N 3.44Å; F341-V344 PolarHBondContact O-N 3.17Å; V344-I352 HydrophobicContact CG2-CD1 3.73Å; V344-I352 HydrophobicContact CG2-CG1 4.24Å; V344-R414 HydrophobicContact CG1-CB 4Å; V344-R414 VanDerWaalsContact O-CD 3.31Å; V344-R414 WeakPolarHBondContact O-CD 3.34Å; V344-R414 PolarHBondContact O-NH1 3.19Å; V344-L417 HydrophobicContact CG1-CB 4.32Å; V344-L417 HydrophobicContact CG1-CD1 3.97Å; V344-L417 WeakPolarHBondContact O-CD1 3.41Å; V344-I418 HydrophobicContact CG2-CG1 4.33Å
345	T	86.5	Confident	85.8	Confident	41 Å²	41	38.7 Å²	38.7	25%	0.252	18%	0.181	S	C	.	.	S	Bend	trans	-88.7	-10	-178.4	64.4	0	0	0	0	114.3	F341 R414	F341-T345 HydrophobicContact CD2-CG2 3.85Å; F341-T345 HydrophobicContact CE2-CG2 3.66Å; F341-T345 HydrophobicContact CG-CG2 4.45Å; F341-T345 HydrophobicContact CZ-CG2 4.12Å; F341-T345 WeakPolarHBondContact O-CB 3.13Å; F341-T345 WeakPolarHBondContact O-CG2 3.39Å; F341-T345 PolarHBondContact O-N 2.76Å; F341-T345 PolarHBondContact O-OG1 3.43Å; T345-R414 VanDerWaalsContact C-NH1 3.33Å; T345-R414 PolarHBondContact O-NH1 3.46Å
346	G	77.8	Confident	86.2	Confident	12 Å²	12	36.3 Å²	36.3	12%	0.124	17%	0.171	C	C	.	.	S	Bend	trans	-60.3	171.7	-176.7	0	0	0	0	0	115.5	E342 R414	E342-G346 PolarHBondContact O-N 3.07Å; G346-R414 PolarHBondContact O-NH1 3.09Å
347	R	76.4	Confident	86	Confident	245 Å²	245	37.6 Å²	37.6	93%	0.925	19%	0.188	S	C	*	.	S	Bend	trans	-61.3	-42.9	177.6	-70.3	-177.1	179.6	166.3	0.3	112.4	P349	R347-P349 WeakPolarHBondContact O-CD 3.41Å
348	N	75.2	Confident	86	Confident	76 Å²	76	37.5 Å²	37.5	41%	0.406	19%	0.188	S	C	.	.	S	Bend	trans	-108.1	100	170.9	-62.7	5.8	0	0	0	106.1
349	P	79.3	Confident	85.8	Confident	27 Å²	27	33.2 Å²	33.2	18%	0.175	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-68	131.5	-179.5	24.6	-31.6	0	0	0	111.2	L343 R347 L417	L343-P349 WeakPolarHBondContact O-CA 3.45Å; R347-P349 WeakPolarHBondContact O-CD 3.41Å; P349-L417 HydrophobicContact CB-CD1 3.46Å; P349-L417 VanDerWaalsContact CB-CD1 3.46Å; P349-L417 HydrophobicContact CB-CD2 4.21Å; P349-L417 HydrophobicContact CG-CD1 4.39Å
350	V	83.8	Confident	85.9	Confident	16 Å²	16	35.8 Å²	35.8	10%	0.097	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-101.2	128.8	170.8	-179.7	0	0	0	0	108.2	I325 L343	I325-V350 HydrophobicContact CG2-CG1 4.13Å; L343-V350 HydrophobicContact CB-CB 4.39Å; L343-V350 HydrophobicContact CD2-CB 4.27Å; L343-V350 HydrophobicContact CD2-CG2 4.06Å; L343-V350 PolarHBondContact O-N 3.24Å; L343-V350 VanDerWaalsContact O-N 3.13Å
351	P	89.8	Confident	85.9	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.013	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-75	148.8	175.9	32	-35.3	0	0	0	111.9	I325 G327 L417 L439 V442	I325-P351 WeakPolarHBondContact O-CD 3.46Å; G327-P351 PolarHBondContact N-O 3.35Å; P351-L417 CarbonylContact C-O 3.23Å; P351-L417 VanDerWaalsContact CA-O 3.26Å; P351-L417 WeakPolarHBondContact CA-O 3.37Å; P351-L439 HydrophobicContact CG-CD2 4.01Å; P351-V442 HydrophobicContact CB-CG2 3.45Å; P351-V442 VanDerWaalsContact CB-CG2 3.45Å; P351-V442 HydrophobicContact CG-CG2 4.09Å
352	I	91.9	Very high	86	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	124.5	-173	-59	-176.5	0	0	0	110.4	G327 L329 V340 L343 V344 V354 L417 I418 S419	G327-I352 CarbonylContact O-C 2.82Å; G327-I352 WeakPolarHBondContact O-CA 3.27Å; L329-I352 HydrophobicContact CB-CG2 3.87Å; V340-I352 HydrophobicContact CB-CD1 4.16Å; V340-I352 HydrophobicContact CG1-CD1 3.85Å; V340-I352 HydrophobicContact CG2-CD1 4.12Å; L343-I352 HydrophobicContact CB-CD1 4.13Å; L343-I352 HydrophobicContact CD1-CD1 4.34Å; V344-I352 HydrophobicContact CG2-CD1 3.73Å; V344-I352 HydrophobicContact CG2-CG1 4.24Å; I352-V354 HydrophobicContact CG2-CG2 4.29Å; I352-L417 PolarHBondContact N-O 3.43Å; I352-I418 WeakPolarHBondContact O-CA 3.44Å; I352-S419 PolarHBondContact O-N 2.85Å
353	V	92.8	Very high	86.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.4	167.6	-178.7	0	0	0	0	108.7	V326 G327 V328 L329 S419 F421 T434 I435 A438	V326-V353 HydrophobicContact CG2-CG2 4.11Å; G327-V353 PolarHBondContact O-N 3.19Å; V328-V353 WeakPolarHBondContact CA-O 3.45Å; L329-V353 PolarHBondContact N-O 3Å; V353-S419 CarbonylContact C-O 3.36Å; V353-S419 VanDerWaalsContact CA-O 3.32Å; V353-S419 WeakPolarHBondContact CA-O 3.24Å; V353-F421 HydrophobicContact CG1-CB 4.2Å; V353-T434 HydrophobicContact CG1-CG2 3.95Å; V353-I435 HydrophobicContact CG2-CG1 4.11Å; V353-A438 HydrophobicContact CG2-CB 3.91Å
354	V	93.4	Very high	86.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.5	-179.9	-175.7	0	0	0	0	108.5	L329 I352 D356 A362 L365 A366 I418 S419 V420 F421	L329-V354 HydrophobicContact CB-CG2 4.44Å; L329-V354 HydrophobicContact CD2-CG1 4.22Å; L329-V354 HydrophobicContact CD2-CG2 4.23Å; I352-V354 HydrophobicContact CG2-CG2 4.29Å; V354-D356 PolarHBondContact O-N 2.87Å; V354-A362 HydrophobicContact CG1-CB 3.97Å; V354-A362 WeakPolarHBondContact CG1-O 3.26Å; V354-L365 HydrophobicContact CG1-CB 4.49Å; V354-L365 HydrophobicContact CG2-CD2 3.73Å; V354-L365 HydrophobicContact CG2-CG 4.34Å; V354-A366 HydrophobicContact CG1-CB 4.24Å; V354-I418 HydrophobicContact CG2-CG2 3.72Å; V354-S419 PolarHBondContact N-O 3.3Å; V354-V420 HydrophobicContact CB-CG2 4.45Å; V354-V420 CarbonylContact O-C 3.53Å; V354-V420 WeakPolarHBondContact O-CA 3.38Å; V354-F421 PolarHBondContact O-N 3.13Å
355	C	90.9	Very high	86.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	109.1	174.9	-59.9	0	0	0	0	109.9	L329 L330 S358 I431	L329-C355 PolarHBondContact O-N 2.6Å; L330-C355 HydrophobicContact CD2-CB 3.77Å; C355-S358 WeakPolarHBondContact O-CB 3.45Å; C355-S358 PolarHBondContact O-N 3.15Å; C355-S358 PolarHBondContact O-OG 3.25Å; C355-I431 VanDerWaalsContact SG-CD1 3.55Å
356	D	89.3	Confident	87.1	Confident	46 Å²	46	30.9 Å²	30.9	25%	0.246	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	136.5	176.7	-147.2	-19.4	0	0	0	109.9	V354 S358 A366 V420 F421 R422	V354-D356 PolarHBondContact O-N 2.87Å; D356-S358 VanDerWaalsContact C-N 3.33Å; D356-A366 HydrophobicContact CB-CB 4.11Å; D356-A366 VanDerWaalsContact CG-CB 3.45Å; D356-A366 WeakPolarHBondContact OD1-CB 3.16Å; D356-V420 HydrophobicContact CB-CG1 3.9Å; D356-F421 WeakPolarHBondContact CB-O 3.22Å; D356-F421 PolarHBondContact N-O 2.65Å; D356-R422 HydrophobicContact CB-CG 3.95Å; D356-R422 IonicContact OD2-CZ 3.52Å; D356-R422 IonicContact OD2-NE 3.19Å; D356-R422 PolarHBondContact OD2-NE 3.19Å; D356-R422 IonicContact OD2-NH2 2.89Å; D356-R422 PolarHBondContact OD2-NH2 2.84Å
357	G	85.3	Confident	87.7	Confident	44 Å²	44	33.6 Å²	33.6	45%	0.454	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	10.6	-173.2	0	0	0	0	0	115.4	L187 D363	L187-G357 WeakPolarHBondContact CD2-O 3.34Å; G357-D363 VanDerWaalsContact CA-OD1 3.31Å; G357-D363 WeakPolarHBondContact CA-OD1 3.36Å; G357-D363 PolarHBondContact N-OD1 2.86Å; G357-D363 VanDerWaalsContact N-OD1 3.08Å
358	S	86.4	Confident	88.4	Confident	5 Å²	5	22 Å²	22	4%	0.035	13%	0.125	C	C	.	.	S	Bend	trans	-87.9	-6.6	174.2	69.5	0	0	0	0	114.5	E331 C355 D356 A362 D363	E331-S358 VanDerWaalsContact CA-O 3.3Å; E331-S358 WeakPolarHBondContact CA-O 3.44Å; E331-S358 VanDerWaalsContact CB-O 3.25Å; E331-S358 WeakPolarHBondContact CB-O 3.33Å; E331-S358 WeakPolarHBondContact CG-O 3.24Å; E331-S358 PolarHBondContact N-O 2.85Å; E331-S358 PolarHBondContact N-OG 3.48Å; E331-S358 VanDerWaalsContact N-OG 3.08Å; C355-S358 WeakPolarHBondContact O-CB 3.45Å; C355-S358 PolarHBondContact O-N 3.15Å; C355-S358 PolarHBondContact O-OG 3.25Å; D356-S358 VanDerWaalsContact C-N 3.33Å; S358-A362 WeakPolarHBondContact OG-CB 3.38Å; S358-D363 PolarHBondContact N-OD1 3.21Å; S358-D363 VanDerWaalsContact N-OD1 3.16Å
359	G	83.1	Confident	89.1	Confident	17 Å²	17	21.4 Å²	21.4	18%	0.175	12%	0.12	C	C	.	.			trans	114.2	147.9	167.9	0	0	0	0	0	115.4	E331 A361 A362 D363	E331-G359 CarbonylContact C-O 3.45Å; E331-G359 VanDerWaalsContact CA-O 3.28Å; E331-G359 WeakPolarHBondContact CA-O 3.43Å; G359-A361 PolarHBondContact O-N 3.19Å; G359-A362 PolarHBondContact O-N 3.17Å; G359-A362 VanDerWaalsContact O-N 3.07Å; G359-D363 WeakPolarHBondContact CA-OD2 3.04Å; G359-D363 PolarHBondContact N-OD1 2.86Å; G359-D363 PolarHBondContact N-OD2 2.74Å
360	R	87.6	Confident	89.5	Confident	84 Å²	84	26.2 Å²	26.2	32%	0.317	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	-102.9	164.4	-62.8	-167.7	-68.7	166	0	113.9	E331 G332 A362 D363 L364 F394	E331-R360 IonicContact OE1-CZ 2.7Å; E331-R360 IonicContact OE1-NE 2.9Å; E331-R360 PolarHBondContact OE1-NE 3.17Å; E331-R360 IonicContact OE1-NH2 3.6Å; E331-R360 PolarHBondContact OE1-NH2 2.87Å; E331-R360 IonicContact OE2-CZ 3.67Å; E331-R360 IonicContact OE2-NE 2.66Å; E331-R360 IonicContact OE2-NH2 3.39Å; E331-R360 PolarHBondContact OE2-NH2 3.38Å; G332-R360 VanDerWaalsContact O-CB 3.28Å; G332-R360 WeakPolarHBondContact O-CB 3.39Å; R360-A362 PolarHBondContact O-N 3.27Å; R360-D363 PolarHBondContact N-OD2 2.9Å; R360-L364 WeakPolarHBondContact O-CB 3.36Å; R360-L364 WeakPolarHBondContact O-CD1 3.41Å; R360-L364 WeakPolarHBondContact O-CG 3.45Å; R360-L364 PolarHBondContact O-N 2.88Å; R360-F394 HydrophobicContact CB-CE1 4.36Å
361	A	89.7	Confident	89.8	Confident	2 Å²	2	30.7 Å²	30.7	2%	0.017	15%	0.151	C	C	.	.	H	α-helix	trans	-67.8	-32.8	-174.9	0	0	0	0	0	113.4	G332 F337 G359 L365 F394	G332-A361 WeakPolarHBondContact O-CB 3.32Å; G332-A361 PolarHBondContact O-N 2.96Å; F337-A361 HydrophobicContact CB-CB 4.44Å; G359-A361 PolarHBondContact O-N 3.19Å; A361-L365 WeakPolarHBondContact O-CB 3.11Å; A361-L365 PolarHBondContact O-N 3.22Å; A361-F394 HydrophobicContact CB-CE1 4.16Å; A361-F394 HydrophobicContact CB-CZ 3.93Å
362	A	91.5	Very high	89.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.7	-52.7	177.3	0	0	0	0	0	111.4	L329 E331 V354 S358 G359 R360 L364 L365 A366	L329-A362 HydrophobicContact CD2-CB 4.38Å; L329-A362 HydrophobicContact CG-CB 4.23Å; E331-A362 PolarHBondContact O-N 3.43Å; V354-A362 HydrophobicContact CG1-CB 3.97Å; V354-A362 WeakPolarHBondContact CG1-O 3.26Å; S358-A362 WeakPolarHBondContact OG-CB 3.38Å; G359-A362 PolarHBondContact O-N 3.17Å; G359-A362 VanDerWaalsContact O-N 3.07Å; R360-A362 PolarHBondContact O-N 3.27Å; A362-L364 VanDerWaalsContact C-N 3.34Å; A362-L364 PolarHBondContact O-N 2.98Å; A362-L365 WeakPolarHBondContact O-CB 3.37Å; A362-L365 PolarHBondContact O-N 3.16Å; A362-A366 WeakPolarHBondContact O-CB 3.49Å; A362-A366 PolarHBondContact O-N 2.89Å
363	D	90.6	Very high	89.3	Confident	51 Å²	51	36 Å²	36	27%	0.273	18%	0.181	S	C	.	.	H	α-helix	trans	-61.9	-40.9	-178	-45.6	-25.4	0	0	0	111.8	G357 S358 G359 R360 L365 A366 F367	G357-D363 VanDerWaalsContact CA-OD1 3.31Å; G357-D363 WeakPolarHBondContact CA-OD1 3.36Å; G357-D363 PolarHBondContact N-OD1 2.86Å; G357-D363 VanDerWaalsContact N-OD1 3.08Å; S358-D363 PolarHBondContact N-OD1 3.21Å; S358-D363 VanDerWaalsContact N-OD1 3.16Å; G359-D363 WeakPolarHBondContact CA-OD2 3.04Å; G359-D363 PolarHBondContact N-OD1 2.86Å; G359-D363 PolarHBondContact N-OD2 2.74Å; R360-D363 PolarHBondContact N-OD2 2.9Å; D363-L365 VanDerWaalsContact C-N 3.28Å; D363-L365 PolarHBondContact O-N 3.42Å; D363-A366 PolarHBondContact O-N 3.22Å; D363-F367 VanDerWaalsContact O-CB 3.25Å; D363-F367 WeakPolarHBondContact O-CB 3.25Å; D363-F367 PolarHBondContact O-N 3.08Å
364	L	91.6	Very high	88.6	Confident	20 Å²	20	43.7 Å²	43.7	11%	0.105	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-35.4	175.6	-70.5	169.9	0	0	0	111.9	R360 A362 M368 M386 N389 I390 A393 F394	R360-L364 WeakPolarHBondContact O-CB 3.36Å; R360-L364 WeakPolarHBondContact O-CD1 3.41Å; R360-L364 WeakPolarHBondContact O-CG 3.45Å; R360-L364 PolarHBondContact O-N 2.88Å; A362-L364 VanDerWaalsContact C-N 3.34Å; A362-L364 PolarHBondContact O-N 2.98Å; L364-M368 WeakPolarHBondContact O-CB 3.48Å; L364-M368 VanDerWaalsContact O-CG 3.22Å; L364-M368 WeakPolarHBondContact O-CG 3.32Å; L364-M368 PolarHBondContact O-N 2.89Å; L364-M386 HydrophobicContact CB-CE 3.76Å; L364-M386 HydrophobicContact CD2-CE 3.52Å; L364-M386 HydrophobicContact CD2-SD 3.85Å; L364-M386 HydrophobicContact CG-CE 4.2Å; L364-M386 WeakPolarHBondContact O-CE 3.44Å; L364-N389 HydrophobicContact CD2-CB 4.33Å; L364-I390 HydrophobicContact CD1-CG1 4.23Å; L364-I390 HydrophobicContact CD2-CG1 4.32Å; L364-A393 HydrophobicContact CD1-CB 4.03Å; L364-F394 HydrophobicContact CD1-CD2 4.47Å; L364-F394 HydrophobicContact CD1-CE2 3.68Å; L364-F394 HydrophobicContact CD1-CZ 3.85Å
365	L	91.8	Very high	87.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-76.4	-38.4	177.5	-165.9	65	0	0	0	111.7	L329 F337 V340 V354 A361 A362 D363 M368 H369 L408 M412 I418	L329-L365 HydrophobicContact CD2-CD2 3.71Å; F337-L365 HydrophobicContact CE2-CD1 4.4Å; V340-L365 HydrophobicContact CG1-CD2 3.9Å; V354-L365 HydrophobicContact CG1-CB 4.49Å; V354-L365 HydrophobicContact CG2-CD2 3.73Å; V354-L365 HydrophobicContact CG2-CG 4.34Å; A361-L365 WeakPolarHBondContact O-CB 3.11Å; A361-L365 PolarHBondContact O-N 3.22Å; A362-L365 WeakPolarHBondContact O-CB 3.37Å; A362-L365 PolarHBondContact O-N 3.16Å; D363-L365 VanDerWaalsContact C-N 3.28Å; D363-L365 PolarHBondContact O-N 3.42Å; L365-M368 PolarHBondContact O-N 2.92Å; L365-H369 WeakPolarHBondContact O-CB 3.44Å; L365-H369 PolarHBondContact O-N 3.1Å; L365-L408 HydrophobicContact CD1-CD2 4Å; L365-L408 HydrophobicContact CD1-CG 4.3Å; L365-M412 HydrophobicContact CD1-CE 3.44Å; L365-M412 VanDerWaalsContact CD1-CE 3.44Å; L365-M412 HydrophobicContact CG-CE 4.29Å; L365-I418 HydrophobicContact CD2-CG2 4.48Å
366	A	91	Very high	87.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.5	-39.8	176.1	0	0	0	0	0	112.8	V354 D356 A362 D363 H369 R370 V420 R422	V354-A366 HydrophobicContact CG1-CB 4.24Å; D356-A366 HydrophobicContact CB-CB 4.11Å; D356-A366 VanDerWaalsContact CG-CB 3.45Å; D356-A366 WeakPolarHBondContact OD1-CB 3.16Å; A362-A366 WeakPolarHBondContact O-CB 3.49Å; A362-A366 PolarHBondContact O-N 2.89Å; D363-A366 PolarHBondContact O-N 3.22Å; A366-H369 PolarHBondContact O-N 3.34Å; A366-R370 PolarHBondContact O-N 2.98Å; A366-V420 HydrophobicContact CB-CG1 3.73Å; A366-V420 HydrophobicContact CB-CG2 4.37Å; A366-R422 PolarHBondContact O-NH2 2.82Å
367	F	90.6	Very high	87.1	Confident	70 Å²	70	48.6 Å²	48.6	31%	0.307	24%	0.244	S	C	.	.	H	α-helix	trans	-60.7	-47.9	171.4	179.3	-89.3	0	0	0	111.4	D363 H369 R370 Y371 L378 M386	D363-F367 VanDerWaalsContact O-CB 3.25Å; D363-F367 WeakPolarHBondContact O-CB 3.25Å; D363-F367 PolarHBondContact O-N 3.08Å; F367-H369 PolarHBondContact O-N 3.35Å; F367-R370 WeakPolarHBondContact O-CB 3.2Å; F367-R370 PolarHBondContact O-N 3.32Å; F367-R370 VanDerWaalsContact O-N 3.08Å; F367-Y371 HydrophobicContact CD1-CD2 4.26Å; F367-Y371 AromaticContact CD2-CD2 3.68Å; F367-Y371 HydrophobicContact CD2-CD2 3.68Å; F367-Y371 AromaticContact CD2-CE2 3.71Å; F367-Y371 HydrophobicContact CD2-CE2 3.71Å; F367-Y371 HydrophobicContact CE1-CD2 4.1Å; F367-Y371 AromaticContact CE2-CD2 3.5Å; F367-Y371 HydrophobicContact CE2-CD2 3.5Å; F367-Y371 AromaticContact CE2-CE2 3.52Å; F367-Y371 HydrophobicContact CE2-CE2 3.52Å; F367-Y371 HydrophobicContact CG-CD2 4.06Å; F367-Y371 HydrophobicContact CG-CE2 4.48Å; F367-Y371 AromaticContact CZ-CD2 3.72Å; F367-Y371 HydrophobicContact CZ-CD2 3.72Å; F367-Y371 HydrophobicContact CZ-CE2 4.16Å; F367-Y371 WeakPolarHBondContact O-CD2 3.23Å; F367-Y371 PolarHBondContact O-N 3.23Å; F367-L378 HydrophobicContact CE1-CD1 4.28Å; F367-M386 HydrophobicContact CD1-SD 3.92Å; F367-M386 HydrophobicContact CE1-SD 4.18Å
368	M	91.2	Very high	87.1	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-40.5	177.3	-75	-71.9	-49.6	0	0	112.1	L364 L365 R370 Y371 A372 L378 M386 Y405 L408 M412	L364-M368 WeakPolarHBondContact O-CB 3.48Å; L364-M368 VanDerWaalsContact O-CG 3.22Å; L364-M368 WeakPolarHBondContact O-CG 3.32Å; L364-M368 PolarHBondContact O-N 2.89Å; L365-M368 PolarHBondContact O-N 2.92Å; M368-R370 PolarHBondContact O-N 2.89Å; M368-Y371 PolarHBondContact O-N 3.4Å; M368-A372 HydrophobicContact CE-CB 4.23Å; M368-A372 WeakPolarHBondContact O-CB 3.48Å; M368-A372 PolarHBondContact O-N 3.46Å; M368-L378 HydrophobicContact CE-CD1 4.34Å; M368-L378 HydrophobicContact CE-CG 3.99Å; M368-L378 HydrophobicContact SD-CD1 3.44Å; M368-L378 WeakPolarHBondContact SD-CD1 3.17Å; M368-L378 HydrophobicContact SD-CD2 4.19Å; M368-L378 HydrophobicContact SD-CG 3.68Å; M368-M386 HydrophobicContact CG-CE 3.51Å; M368-M386 HydrophobicContact CG-SD 4.44Å; M368-M386 HydrophobicContact SD-CE 4.02Å; M368-M386 HydrophobicContact SD-CG 4Å; M368-M386 HydrophobicContact SD-SD 4.39Å; M368-Y405 HydrophobicContact SD-CE2 4.33Å; M368-L408 HydrophobicContact CB-CD2 3.59Å; M368-L408 HydrophobicContact CE-CD2 4.02Å; M368-L408 HydrophobicContact CG-CD1 3.93Å; M368-L408 HydrophobicContact CG-CD2 3.49Å; M368-L408 VanDerWaalsContact CG-CD2 3.49Å; M368-L408 HydrophobicContact CG-CG 4.36Å; M368-L408 HydrophobicContact SD-CD2 4.38Å; M368-M412 HydrophobicContact CB-CG 4.13Å; M368-M412 HydrophobicContact CB-SD 3.79Å; M368-M412 HydrophobicContact CE-CG 4.02Å
369	H	90	Very high	87.1	Confident	65 Å²	65	49.3 Å²	49.3	30%	0.301	24%	0.241	S	C	.	.	H	α-helix	trans	-61.2	-32.6	172.9	-177.7	-63.6	0	0	0	112.2	L365 A366 F367 M412 I418 V420	L365-H369 WeakPolarHBondContact O-CB 3.44Å; L365-H369 PolarHBondContact O-N 3.1Å; A366-H369 PolarHBondContact O-N 3.34Å; F367-H369 PolarHBondContact O-N 3.35Å; H369-M412 HydrophobicContact CB-SD 4.47Å; H369-I418 PolarHBondContact CD2-O 3.26Å; H369-I418 PolarHBondContact NE2-O 2.83Å; H369-V420 HydrophobicContact CB-CG2 3.85Å
370	R	87.7	Confident	87.2	Confident	128 Å²	128	53.7 Å²	53.7	48%	0.483	26%	0.264	S	S	.	.	H	α-helix	trans	-76.7	-32.9	179.7	-172.8	172.2	179.4	140.2	3.6	113.5	A366 F367 M368 E425	A366-R370 PolarHBondContact O-N 2.98Å; F367-R370 WeakPolarHBondContact O-CB 3.2Å; F367-R370 PolarHBondContact O-N 3.32Å; F367-R370 VanDerWaalsContact O-N 3.08Å; M368-R370 PolarHBondContact O-N 2.89Å; R370-E425 IonicContact NH1-OE2 2.65Å
371	Y	89.2	Confident	87	Confident	110 Å²	110	56.9 Å²	56.9	43%	0.431	28%	0.283	S	S	.	.	H	α-helix	trans	-121	-5.4	-168.7	-63.5	-65.5	0	0	0	116.2	F367 M368 L378	F367-Y371 HydrophobicContact CD1-CD2 4.26Å; F367-Y371 AromaticContact CD2-CD2 3.68Å; F367-Y371 HydrophobicContact CD2-CD2 3.68Å; F367-Y371 AromaticContact CD2-CE2 3.71Å; F367-Y371 HydrophobicContact CD2-CE2 3.71Å; F367-Y371 HydrophobicContact CE1-CD2 4.1Å; F367-Y371 AromaticContact CE2-CD2 3.5Å; F367-Y371 HydrophobicContact CE2-CD2 3.5Å; F367-Y371 AromaticContact CE2-CE2 3.52Å; F367-Y371 HydrophobicContact CE2-CE2 3.52Å; F367-Y371 HydrophobicContact CG-CD2 4.06Å; F367-Y371 HydrophobicContact CG-CE2 4.48Å; F367-Y371 AromaticContact CZ-CD2 3.72Å; F367-Y371 HydrophobicContact CZ-CD2 3.72Å; F367-Y371 HydrophobicContact CZ-CE2 4.16Å; F367-Y371 WeakPolarHBondContact O-CD2 3.23Å; F367-Y371 PolarHBondContact O-N 3.23Å; M368-Y371 PolarHBondContact O-N 3.4Å; Y371-L378 WeakPolarHBondContact O-CD2 3.33Å
372	A	86.9	Confident	86.9	Confident	18 Å²	18	59.4 Å²	59.4	15%	0.149	30%	0.296	C	S	.	.			trans	-74.2	136.2	177.9	0	0	0	0	0	112.8	M368 M412	M368-A372 HydrophobicContact CE-CB 4.23Å; M368-A372 WeakPolarHBondContact O-CB 3.48Å; M368-A372 PolarHBondContact O-N 3.46Å; A372-M412 HydrophobicContact CB-CB 4.47Å; A372-M412 HydrophobicContact CB-CG 4.29Å
373	N	85.4	Confident	86.7	Confident	96 Å²	96	63.7 Å²	63.7	51%	0.513	31%	0.312	S	S	.	.			trans	-65.2	171.4	169.7	-65.3	-16.4	0	0	0	111.1	D375 G376 D377	N373-D375 PolarHBondContact O-N 3.16Å; N373-D375 VanDerWaalsContact O-N 3.15Å; N373-G376 WeakPolarHBondContact O-CA 3.33Å; N373-G376 PolarHBondContact O-N 3.33Å; N373-D377 WeakPolarHBondContact CB-O 3.5Å; N373-D377 PolarHBondContact N-O 2.8Å
374	E	78.5	Confident	86.6	Confident	161 Å²	161	64.9 Å²	64.9	75%	0.752	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26	-178.2	-49.6	-141.4	112	0	0	113.6	G376 R415	E374-G376 PolarHBondContact O-N 3.39Å; E374-R415 IonicContact OE1-CZ 3.56Å; E374-R415 IonicContact OE1-NH1 3.18Å; E374-R415 IonicContact OE1-NH2 3.41Å; E374-R415 PolarHBondContact OE1-NH2 2.95Å
375	D	77.3	Confident	86.5	Confident	116 Å²	116	69.3 Å²	69.3	62%	0.62	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-9.8	170.9	-69.8	-59.1	0	0	0	114.7	N373 K413	N373-D375 PolarHBondContact O-N 3.16Å; N373-D375 VanDerWaalsContact O-N 3.15Å; D375-K413 VanDerWaalsContact O-CE 3.31Å; D375-K413 WeakPolarHBondContact O-CE 3.34Å
376	G	77.9	Confident	86.3	Confident	2 Å²	2	69.4 Å²	69.4	2%	0.021	34%	0.339	C	S	.	.	S	Bend	trans	81.2	12.8	-173.3	0	0	0	0	0	114.9	N373 E374 K409	N373-G376 WeakPolarHBondContact O-CA 3.33Å; N373-G376 PolarHBondContact O-N 3.33Å; E374-G376 PolarHBondContact O-N 3.39Å; G376-K409 WeakPolarHBondContact O-CA 3.41Å
377	D	85.9	Confident	86.3	Confident	32 Å²	32	69.4 Å²	69.4	17%	0.171	34%	0.339	C	S	.	.			trans	-113.6	158.7	-178.1	-148	-2.7	0	0	0	112.6	N373 Y405 K409	N373-D377 WeakPolarHBondContact CB-O 3.5Å; N373-D377 PolarHBondContact N-O 2.8Å; D377-Y405 WeakPolarHBondContact OD1-CE1 3.41Å; D377-Y405 PolarHBondContact OD1-OH 3.41Å; D377-K409 HydrophobicContact CB-CD 4.02Å; D377-K409 WeakPolarHBondContact OD2-CE 3.42Å; D377-K409 IonicContact OD2-NZ 2.74Å; D377-K409 PolarHBondContact OD2-NZ 3.41Å
378	L	86.3	Confident	86.2	Confident	10 Å²	10	67.7 Å²	67.7	5%	0.052	34%	0.338	C	S	.	.			trans	-89.6	167.2	172.1	-70.6	173.5	0	0	0	111.8	F367 M368 Y371 L382 R383 M386 Y405	F367-L378 HydrophobicContact CE1-CD1 4.28Å; M368-L378 HydrophobicContact CE-CD1 4.34Å; M368-L378 HydrophobicContact CE-CG 3.99Å; M368-L378 HydrophobicContact SD-CD1 3.44Å; M368-L378 WeakPolarHBondContact SD-CD1 3.17Å; M368-L378 HydrophobicContact SD-CD2 4.19Å; M368-L378 HydrophobicContact SD-CG 3.68Å; Y371-L378 WeakPolarHBondContact O-CD2 3.33Å; L378-L382 HydrophobicContact CB-CB 4.01Å; L378-L382 HydrophobicContact CD1-CB 4.05Å; L378-L382 HydrophobicContact CD2-CB 4.31Å; L378-L382 HydrophobicContact CD2-CD1 4.41Å; L378-L382 HydrophobicContact CG-CB 4.37Å; L378-R383 HydrophobicContact CB-CB 4.27Å; L378-M386 HydrophobicContact CD1-CB 3.69Å; L378-M386 HydrophobicContact CD1-CG 3.99Å; L378-Y405 HydrophobicContact CD1-CE2 4.25Å; L378-Y405 PolarHBondContact N-OH 3.33Å
379	S	86.5	Confident	86.1	Confident	54 Å²	54	70.5 Å²	70.5	38%	0.378	35%	0.353	S	S	.	.			trans	-59.9	154.1	161.4	73.1	0	0	0	0	110.6	Q381 L382 R383	S379-Q381 VanDerWaalsContact C-N 3.32Å; S379-Q381 PolarHBondContact O-N 2.91Å; S379-L382 PolarHBondContact O-N 3.13Å; S379-L382 VanDerWaalsContact O-N 3.15Å; S379-L382 WeakPolarHBondContact OG-CG 3.46Å; S379-R383 WeakPolarHBondContact O-CB 3.35Å; S379-R383 PolarHBondContact O-N 2.97Å
380	T	84	Confident	86.1	Confident	108 Å²	108	67.5 Å²	67.5	66%	0.663	34%	0.339	S	S	*	.	H	α-helix	trans	-57	-42.1	-173.7	47.9	0	0	0	0	113.3	R383 D384	T380-R383 PolarHBondContact O-N 2.95Å; T380-D384 PolarHBondContact O-N 2.8Å; T380-D384 VanDerWaalsContact O-N 3.13Å
381	Q	83.4	Confident	86.3	Confident	152 Å²	152	62.9 Å²	62.9	71%	0.71	33%	0.327	S	S	*	.	H	α-helix	trans	-63.1	-47.8	176.7	-66.1	175.9	-14.3	0	0	112	S379 R383 D384 Q385	S379-Q381 VanDerWaalsContact C-N 3.32Å; S379-Q381 PolarHBondContact O-N 2.91Å; Q381-R383 VanDerWaalsContact C-N 3.32Å; Q381-R383 PolarHBondContact O-N 3.11Å; Q381-D384 PolarHBondContact O-N 3.47Å; Q381-Q385 WeakPolarHBondContact O-CG 3.36Å; Q381-Q385 PolarHBondContact O-N 2.86Å
382	L	86.9	Confident	86.2	Confident	55 Å²	55	65.7 Å²	65.7	29%	0.288	34%	0.336	S	S	.	.	H	α-helix	trans	-67	-33.3	177.6	-68.7	176.8	0	0	0	111.6	L378 S379 Q385 M386	L378-L382 HydrophobicContact CB-CB 4.01Å; L378-L382 HydrophobicContact CD1-CB 4.05Å; L378-L382 HydrophobicContact CD2-CB 4.31Å; L378-L382 HydrophobicContact CD2-CD1 4.41Å; L378-L382 HydrophobicContact CG-CB 4.37Å; S379-L382 PolarHBondContact O-N 3.13Å; S379-L382 VanDerWaalsContact O-N 3.15Å; S379-L382 WeakPolarHBondContact OG-CG 3.46Å; L382-Q385 PolarHBondContact O-N 2.78Å; L382-M386 WeakPolarHBondContact O-CB 3.43Å; L382-M386 PolarHBondContact O-N 2.91Å
383	R	88.8	Confident	86.1	Confident	90 Å²	90	66.6 Å²	66.6	34%	0.34	34%	0.344	S	S	.	.	H	α-helix	trans	-61.9	-47.7	174.8	170.2	170.2	174.6	-87.5	-5.1	112.1	L378 S379 T380 Q381 M386 V387 Y405	L378-R383 HydrophobicContact CB-CB 4.27Å; S379-R383 WeakPolarHBondContact O-CB 3.35Å; S379-R383 PolarHBondContact O-N 2.97Å; T380-R383 PolarHBondContact O-N 2.95Å; Q381-R383 VanDerWaalsContact C-N 3.32Å; Q381-R383 PolarHBondContact O-N 3.11Å; R383-M386 PolarHBondContact O-N 3.12Å; R383-V387 WeakPolarHBondContact O-CG2 3.38Å; R383-V387 PolarHBondContact O-N 3.06Å; R383-Y405 HydrophobicContact CB-CE2 4.46Å; R383-Y405 HydrophobicContact CG-CE1 3.84Å; R383-Y405 HydrophobicContact CG-CE2 4.08Å
384	D	88.5	Confident	86	Confident	75 Å²	75	63.5 Å²	63.5	40%	0.401	33%	0.326	S	S	.	.	H	α-helix	trans	-68.7	-35.4	179.4	-84.9	-51.4	0	0	0	112.5	T380 Q381 A388 R398	T380-D384 PolarHBondContact O-N 2.8Å; T380-D384 VanDerWaalsContact O-N 3.13Å; Q381-D384 PolarHBondContact O-N 3.47Å; D384-A388 WeakPolarHBondContact O-CB 3.37Å; D384-A388 PolarHBondContact O-N 3.25Å; D384-A388 VanDerWaalsContact O-N 3.11Å; D384-R398 IonicContact OD1-NH2 2.86Å; D384-R398 PolarHBondContact OD1-NH2 3.46Å
385	Q	88.3	Confident	86.5	Confident	113 Å²	113	64.6 Å²	64.6	53%	0.528	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-43.3	169.2	-69.5	174.9	0.2	0	0	111.5	Q381 L382 A388 N389	Q381-Q385 WeakPolarHBondContact O-CG 3.36Å; Q381-Q385 PolarHBondContact O-N 2.86Å; L382-Q385 PolarHBondContact O-N 2.78Å; Q385-A388 WeakPolarHBondContact O-CB 3.4Å; Q385-A388 PolarHBondContact O-N 2.74Å; Q385-N389 WeakPolarHBondContact O-CB 3.33Å; Q385-N389 PolarHBondContact O-N 3.24Å; Q385-N389 PolarHBondContact O-ND2 3.07Å; Q385-N389 PolarHBondContact O-OD1 2.84Å
386	M	88.3	Confident	86.9	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-65.3	-43.1	179.3	-174	62.4	-179	0	0	112	L364 F367 M368 L378 L382 R383 A388 N389 I390 Y405 L408	L364-M386 HydrophobicContact CB-CE 3.76Å; L364-M386 HydrophobicContact CD2-CE 3.52Å; L364-M386 HydrophobicContact CD2-SD 3.85Å; L364-M386 HydrophobicContact CG-CE 4.2Å; L364-M386 WeakPolarHBondContact O-CE 3.44Å; F367-M386 HydrophobicContact CD1-SD 3.92Å; F367-M386 HydrophobicContact CE1-SD 4.18Å; M368-M386 HydrophobicContact CG-CE 3.51Å; M368-M386 HydrophobicContact CG-SD 4.44Å; M368-M386 HydrophobicContact SD-CE 4.02Å; M368-M386 HydrophobicContact SD-CG 4Å; M368-M386 HydrophobicContact SD-SD 4.39Å; L378-M386 HydrophobicContact CD1-CB 3.69Å; L378-M386 HydrophobicContact CD1-CG 3.99Å; L382-M386 WeakPolarHBondContact O-CB 3.43Å; L382-M386 PolarHBondContact O-N 2.91Å; R383-M386 PolarHBondContact O-N 3.12Å; M386-A388 VanDerWaalsContact C-N 3.32Å; M386-A388 PolarHBondContact O-N 3.44Å; M386-N389 PolarHBondContact O-N 2.82Å; M386-N389 VanDerWaalsContact O-N 3.17Å; M386-I390 HydrophobicContact CE-CD1 4.01Å; M386-I390 HydrophobicContact CE-CG1 4.03Å; M386-I390 HydrophobicContact CG-CD1 3.98Å; M386-I390 HydrophobicContact CG-CG1 4.44Å; M386-I390 WeakPolarHBondContact O-CB 3.32Å; M386-I390 VanDerWaalsContact O-CG1 3.24Å; M386-I390 WeakPolarHBondContact O-CG1 3.21Å; M386-I390 PolarHBondContact O-N 3.48Å; M386-Y405 HydrophobicContact CB-CD2 4.38Å; M386-Y405 HydrophobicContact CB-CE2 4.07Å; M386-Y405 HydrophobicContact CG-CD2 3.96Å; M386-Y405 HydrophobicContact CG-CE2 3.86Å; M386-L408 HydrophobicContact CE-CD1 3.95Å
387	V	90.5	Very high	87.5	Confident	1 Å²	1	69 Å²	69	1%	0.006	34%	0.341	C	S	.	.	H	α-helix	trans	-61.2	-40.6	173.7	167.6	0	0	0	0	111.3	R383 S391 R398 A401 E402 Y405	R383-V387 WeakPolarHBondContact O-CG2 3.38Å; R383-V387 PolarHBondContact O-N 3.06Å; V387-S391 WeakPolarHBondContact O-CB 3.33Å; V387-S391 PolarHBondContact O-N 3.47Å; V387-R398 HydrophobicContact CG1-CG 3.87Å; V387-A401 HydrophobicContact CG1-CB 4.28Å; V387-E402 HydrophobicContact CG1-CG 3.65Å; V387-E402 HydrophobicContact CG2-CG 4.16Å; V387-Y405 HydrophobicContact CG2-CD2 3.99Å; V387-Y405 HydrophobicContact CG2-CG 3.96Å
388	A	89.3	Confident	87.6	Confident	34 Å²	34	73 Å²	73	28%	0.281	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-39.3	173.6	0	0	0	0	0	112.3	D384 Q385 M386 S391 R392	D384-A388 WeakPolarHBondContact O-CB 3.37Å; D384-A388 PolarHBondContact O-N 3.25Å; D384-A388 VanDerWaalsContact O-N 3.11Å; Q385-A388 WeakPolarHBondContact O-CB 3.4Å; Q385-A388 PolarHBondContact O-N 2.74Å; M386-A388 VanDerWaalsContact C-N 3.32Å; M386-A388 PolarHBondContact O-N 3.44Å; A388-S391 PolarHBondContact O-N 2.82Å; A388-R392 WeakPolarHBondContact O-CB 3.35Å; A388-R392 PolarHBondContact O-N 3.27Å
389	N	88.9	Confident	87.7	Confident	58 Å²	58	80.9 Å²	80.9	31%	0.31	39%	0.387	S	S	.	.	H	α-helix	trans	-68.1	-42	177.1	-69.5	-13.4	0	0	0	112.1	L364 Q385 M386 R392 A393	L364-N389 HydrophobicContact CD2-CB 4.33Å; Q385-N389 WeakPolarHBondContact O-CB 3.33Å; Q385-N389 PolarHBondContact O-N 3.24Å; Q385-N389 PolarHBondContact O-ND2 3.07Å; Q385-N389 PolarHBondContact O-OD1 2.84Å; M386-N389 PolarHBondContact O-N 2.82Å; M386-N389 VanDerWaalsContact O-N 3.17Å; N389-R392 PolarHBondContact O-N 3.36Å; N389-R392 PolarHBondContact OD1-NH1 3.46Å; N389-A393 WeakPolarHBondContact O-CB 3.29Å; N389-A393 PolarHBondContact O-N 2.87Å
390	I	90.4	Very high	87.8	Confident	2 Å²	2	81.5 Å²	81.5	1%	0.01	38%	0.384	C	S	.	.	H	α-helix	trans	-59.8	-46.6	172.8	-69.4	165.9	0	0	0	110.4	L364 M386 R392 A393 F394 I396 A401 L404 Y405	L364-I390 HydrophobicContact CD1-CG1 4.23Å; L364-I390 HydrophobicContact CD2-CG1 4.32Å; M386-I390 HydrophobicContact CE-CD1 4.01Å; M386-I390 HydrophobicContact CE-CG1 4.03Å; M386-I390 HydrophobicContact CG-CD1 3.98Å; M386-I390 HydrophobicContact CG-CG1 4.44Å; M386-I390 WeakPolarHBondContact O-CB 3.32Å; M386-I390 VanDerWaalsContact O-CG1 3.24Å; M386-I390 WeakPolarHBondContact O-CG1 3.21Å; M386-I390 PolarHBondContact O-N 3.48Å; I390-R392 VanDerWaalsContact C-N 3.35Å; I390-R392 PolarHBondContact O-N 2.91Å; I390-A393 PolarHBondContact O-N 2.98Å; I390-F394 HydrophobicContact CG2-CD2 3.92Å; I390-F394 HydrophobicContact CG2-CE2 4.24Å; I390-F394 WeakPolarHBondContact O-CD2 3.21Å; I390-F394 PolarHBondContact O-N 3.04Å; I390-F394 VanDerWaalsContact O-N 3.14Å; I390-I396 HydrophobicContact CG2-CD1 4.17Å; I390-A401 HydrophobicContact CB-CB 4.14Å; I390-A401 HydrophobicContact CG2-CB 3.66Å; I390-L404 HydrophobicContact CG2-CB 4.19Å; I390-L404 HydrophobicContact CG2-CD1 4.26Å; I390-Y405 HydrophobicContact CD1-CD2 4.02Å
391	S	91.2	Very high	88	Confident	32 Å²	32	76.3 Å²	76.3	22%	0.224	35%	0.352	C	S	.	.	H	α-helix	trans	-61.2	-41.9	177.2	-177.7	0	0	0	0	111.8	V387 A388 Q395 I396	V387-S391 WeakPolarHBondContact O-CB 3.33Å; V387-S391 PolarHBondContact O-N 3.47Å; A388-S391 PolarHBondContact O-N 2.82Å; S391-Q395 VanDerWaalsContact O-CA 3.28Å; S391-Q395 WeakPolarHBondContact O-CA 3.29Å; S391-Q395 PolarHBondContact O-N 3.16Å; S391-I396 PolarHBondContact O-N 2.87Å; S391-I396 PolarHBondContact OG-O 3.41Å
392	R	87.5	Confident	88.3	Confident	169 Å²	169	72.7 Å²	72.7	64%	0.638	34%	0.336	S	S	*	.	H	α-helix	trans	-69.1	-46	177.1	-162.3	-172.4	-57.9	104.7	-1	112.8	A388 N389 I390 F394	A388-R392 WeakPolarHBondContact O-CB 3.35Å; A388-R392 PolarHBondContact O-N 3.27Å; N389-R392 PolarHBondContact O-N 3.36Å; N389-R392 PolarHBondContact OD1-NH1 3.46Å; I390-R392 VanDerWaalsContact C-N 3.35Å; I390-R392 PolarHBondContact O-N 2.91Å; R392-F394 PolarHBondContact O-N 2.92Å
393	A	84.2	Confident	88.4	Confident	37 Å²	37	71.4 Å²	71.4	31%	0.306	34%	0.336	S	S	.	.	H	α-helix	trans	-70.2	-31.4	-173.9	0	0	0	0	0	113.7	L364 N389 I390	L364-A393 HydrophobicContact CD1-CB 4.03Å; N389-A393 WeakPolarHBondContact O-CB 3.29Å; N389-A393 PolarHBondContact O-N 2.87Å; I390-A393 PolarHBondContact O-N 2.98Å
394	F	84.5	Confident	88.4	Confident	30 Å²	30	67.5 Å²	67.5	13%	0.132	32%	0.321	C	S	.	.	H	α-helix	trans	-105.9	-2.7	178.2	-60.4	-53.9	0	0	0	114.4	T334 R360 A361 L364 I390 R392 I396 L404	T334-F394 HydrophobicContact CG2-CB 3.59Å; T334-F394 HydrophobicContact CG2-CD1 3.8Å; T334-F394 HydrophobicContact CG2-CD2 3.89Å; T334-F394 HydrophobicContact CG2-CE1 4.43Å; T334-F394 HydrophobicContact CG2-CG 3.49Å; T334-F394 VanDerWaalsContact CG2-CG 3.49Å; R360-F394 HydrophobicContact CB-CE1 4.36Å; A361-F394 HydrophobicContact CB-CE1 4.16Å; A361-F394 HydrophobicContact CB-CZ 3.93Å; L364-F394 HydrophobicContact CD1-CD2 4.47Å; L364-F394 HydrophobicContact CD1-CE2 3.68Å; L364-F394 HydrophobicContact CD1-CZ 3.85Å; I390-F394 HydrophobicContact CG2-CD2 3.92Å; I390-F394 HydrophobicContact CG2-CE2 4.24Å; I390-F394 WeakPolarHBondContact O-CD2 3.21Å; I390-F394 PolarHBondContact O-N 3.04Å; I390-F394 VanDerWaalsContact O-N 3.14Å; R392-F394 PolarHBondContact O-N 2.92Å; F394-I396 HydrophobicContact CB-CD1 4.17Å; F394-I396 HydrophobicContact CB-CG1 4.13Å; F394-I396 HydrophobicContact CB-CG2 4.02Å; F394-I396 HydrophobicContact CD2-CD1 4.42Å; F394-I396 PolarHBondContact O-N 3.38Å; F394-L404 HydrophobicContact CD2-CD1 3.93Å; F394-L404 HydrophobicContact CE2-CD1 4.15Å
395	Q	87.2	Confident	88.5	Confident	185 Å²	185	64.2 Å²	64.2	86%	0.864	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	32.3	-176.6	-55.5	-179.2	-0.1	0	0	113.7	S391	S391-Q395 VanDerWaalsContact O-CA 3.28Å; S391-Q395 WeakPolarHBondContact O-CA 3.29Å; S391-Q395 PolarHBondContact O-N 3.16Å
396	I	87	Confident	88.6	Confident	32 Å²	32	62.4 Å²	62.4	16%	0.164	30%	0.303	C	S	.	.			trans	-100.5	158.8	-178.5	62.8	-179.6	0	0	0	112.3	T334 I390 S391 F394 E400 A401 L404	T334-I396 HydrophobicContact CG2-CD1 4.49Å; T334-I396 HydrophobicContact CG2-CG2 4.26Å; I390-I396 HydrophobicContact CG2-CD1 4.17Å; S391-I396 PolarHBondContact O-N 2.87Å; S391-I396 PolarHBondContact OG-O 3.41Å; F394-I396 HydrophobicContact CB-CD1 4.17Å; F394-I396 HydrophobicContact CB-CG1 4.13Å; F394-I396 HydrophobicContact CB-CG2 4.02Å; F394-I396 HydrophobicContact CD2-CD1 4.42Å; F394-I396 PolarHBondContact O-N 3.38Å; I396-E400 HydrophobicContact CB-CB 4.13Å; I396-E400 HydrophobicContact CD1-CB 4.13Å; I396-E400 HydrophobicContact CG1-CB 4.36Å; I396-A401 HydrophobicContact CD1-CB 4.12Å; I396-A401 HydrophobicContact CG1-CB 4.16Å; I396-L404 HydrophobicContact CD1-CD1 3.45Å; I396-L404 VanDerWaalsContact CD1-CD1 3.45Å; I396-L404 HydrophobicContact CD1-CG 4.15Å
397	R	89.7	Confident	88.6	Confident	179 Å²	179	63.9 Å²	63.9	68%	0.675	31%	0.31	S	S	*	.			trans	-66.2	148.6	179.4	-59.1	-179.3	-73.3	178.5	-2.5	110.1	F399 E400 A401	R397-F399 PolarHBondContact O-N 3.43Å; R397-F399 VanDerWaalsContact O-N 3.13Å; R397-E400 HydrophobicContact CB-CG 4.46Å; R397-E400 WeakPolarHBondContact CB-OE2 3.28Å; R397-E400 IonicContact CZ-OE1 3.43Å; R397-E400 PolarHBondContact N-OE2 2.9Å; R397-E400 IonicContact NE-OE1 3.21Å; R397-E400 PolarHBondContact NE-OE1 3.17Å; R397-E400 IonicContact NE-OE2 2.83Å; R397-E400 PolarHBondContact NE-OE2 3.19Å; R397-E400 IonicContact NH2-OE1 3.7Å; R397-E400 PolarHBondContact NH2-OE1 3.35Å; R397-E400 WeakPolarHBondContact O-CA 3.24Å; R397-E400 WeakPolarHBondContact O-CB 3.4Å; R397-E400 PolarHBondContact O-N 3.38Å; R397-A401 PolarHBondContact O-N 2.93Å
398	R	88.2	Confident	88.5	Confident	116 Å²	116	64.1 Å²	64.1	44%	0.438	31%	0.311	S	S	.	.	H	α-helix	trans	-53.5	-39.2	-176.8	-168	-178.6	177.2	115.5	0.8	113.3	D384 V387 E400 A401 E402	D384-R398 IonicContact OD1-NH2 2.86Å; D384-R398 PolarHBondContact OD1-NH2 3.46Å; V387-R398 HydrophobicContact CG1-CG 3.87Å; R398-E400 VanDerWaalsContact C-N 3.32Å; R398-E400 PolarHBondContact O-N 3.26Å; R398-A401 CarbonylContact O-C 3.59Å; R398-A401 WeakPolarHBondContact O-CB 3.33Å; R398-A401 PolarHBondContact O-N 3.05Å; R398-A401 VanDerWaalsContact O-N 3.16Å; R398-E402 IonicContact NE-OE1 3.53Å; R398-E402 PolarHBondContact NE-OE1 2.92Å; R398-E402 WeakPolarHBondContact O-CG 3.2Å; R398-E402 PolarHBondContact O-N 3.31Å
399	F	88.2	Confident	88.6	Confident	174 Å²	174	65.8 Å²	65.8	76%	0.763	31%	0.312	S	S	*	.	H	α-helix	trans	-60.4	-36.9	174.4	-179.1	-100.4	0	0	0	113.5	R397 G403	R397-F399 PolarHBondContact O-N 3.43Å; R397-F399 VanDerWaalsContact O-N 3.13Å; F399-G403 PolarHBondContact O-N 3.43Å; F399-G403 VanDerWaalsContact O-N 3.08Å
400	E	88.2	Confident	88.5	Confident	67 Å²	67	67.3 Å²	67.3	31%	0.313	32%	0.32	S	S	.	.	H	α-helix	trans	-74.4	-34.8	175.4	-65.5	156.3	170.4	0	0	111	I396 R397 R398 G403 L404	I396-E400 HydrophobicContact CB-CB 4.13Å; I396-E400 HydrophobicContact CD1-CB 4.13Å; I396-E400 HydrophobicContact CG1-CB 4.36Å; R397-E400 HydrophobicContact CB-CG 4.46Å; R397-E400 WeakPolarHBondContact CB-OE2 3.28Å; R397-E400 IonicContact CZ-OE1 3.43Å; R397-E400 PolarHBondContact N-OE2 2.9Å; R397-E400 IonicContact NE-OE1 3.21Å; R397-E400 PolarHBondContact NE-OE1 3.17Å; R397-E400 IonicContact NE-OE2 2.83Å; R397-E400 PolarHBondContact NE-OE2 3.19Å; R397-E400 IonicContact NH2-OE1 3.7Å; R397-E400 PolarHBondContact NH2-OE1 3.35Å; R397-E400 WeakPolarHBondContact O-CA 3.24Å; R397-E400 WeakPolarHBondContact O-CB 3.4Å; R397-E400 PolarHBondContact O-N 3.38Å; R398-E400 VanDerWaalsContact C-N 3.32Å; R398-E400 PolarHBondContact O-N 3.26Å; E400-G403 WeakPolarHBondContact O-CA 3.44Å; E400-G403 PolarHBondContact O-N 3.14Å; E400-L404 PolarHBondContact O-N 2.96Å
401	A	89	Confident	88.5	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.3	-36.9	172.6	0	0	0	0	0	112.8	V387 I390 I396 R397 R398 G403 L404 Y405	V387-A401 HydrophobicContact CG1-CB 4.28Å; I390-A401 HydrophobicContact CB-CB 4.14Å; I390-A401 HydrophobicContact CG2-CB 3.66Å; I396-A401 HydrophobicContact CD1-CB 4.12Å; I396-A401 HydrophobicContact CG1-CB 4.16Å; R397-A401 PolarHBondContact O-N 2.93Å; R398-A401 CarbonylContact O-C 3.59Å; R398-A401 WeakPolarHBondContact O-CB 3.33Å; R398-A401 PolarHBondContact O-N 3.05Å; R398-A401 VanDerWaalsContact O-N 3.16Å; A401-G403 VanDerWaalsContact C-N 3.34Å; A401-L404 PolarHBondContact O-N 3.21Å; A401-Y405 WeakPolarHBondContact O-CB 3.26Å; A401-Y405 PolarHBondContact O-N 3.41Å
402	E	89.9	Confident	88.4	Confident	76 Å²	76	65.9 Å²	65.9	36%	0.355	31%	0.31	S	S	.	.	H	α-helix	trans	-66.8	-35.9	171.3	-72.3	170.4	-162.7	0	0	111.5	V387 R398 Y405 S406	V387-E402 HydrophobicContact CG1-CG 3.65Å; V387-E402 HydrophobicContact CG2-CG 4.16Å; R398-E402 IonicContact NE-OE1 3.53Å; R398-E402 PolarHBondContact NE-OE1 2.92Å; R398-E402 WeakPolarHBondContact O-CG 3.2Å; R398-E402 PolarHBondContact O-N 3.31Å; E402-Y405 PolarHBondContact O-N 2.75Å; E402-S406 PolarHBondContact O-N 3.44Å
403	G	89.3	Confident	88.4	Confident	28 Å²	28	63.8 Å²	63.8	29%	0.289	31%	0.305	S	S	.	.	H	α-helix	trans	-58.3	-55.8	168.5	0	0	0	0	0	112.5	F399 E400 A401 Y405 S406 E407	F399-G403 PolarHBondContact O-N 3.43Å; F399-G403 VanDerWaalsContact O-N 3.08Å; E400-G403 WeakPolarHBondContact O-CA 3.44Å; E400-G403 PolarHBondContact O-N 3.14Å; A401-G403 VanDerWaalsContact C-N 3.34Å; G403-Y405 VanDerWaalsContact C-N 3.3Å; G403-Y405 PolarHBondContact O-N 2.96Å; G403-S406 WeakPolarHBondContact O-CB 3.22Å; G403-S406 PolarHBondContact O-N 3.19Å; G403-S406 PolarHBondContact O-OG 2.85Å; G403-E407 PolarHBondContact O-N 2.94Å; G403-E407 VanDerWaalsContact O-N 3.09Å
404	L	88.5	Confident	88.4	Confident	7 Å²	7	66.3 Å²	66.3	4%	0.037	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-36.2	176.8	-66.3	-172.9	0	0	0	112.5	T334 F337 I390 F394 I396 E400 A401 S406 E407 L408	T334-L404 HydrophobicContact CG2-CD1 3.69Å; F337-L404 HydrophobicContact CD1-CD2 4.11Å; F337-L404 HydrophobicContact CE1-CD2 4.35Å; I390-L404 HydrophobicContact CG2-CB 4.19Å; I390-L404 HydrophobicContact CG2-CD1 4.26Å; F394-L404 HydrophobicContact CD2-CD1 3.93Å; F394-L404 HydrophobicContact CE2-CD1 4.15Å; I396-L404 HydrophobicContact CD1-CD1 3.45Å; I396-L404 VanDerWaalsContact CD1-CD1 3.45Å; I396-L404 HydrophobicContact CD1-CG 4.15Å; E400-L404 PolarHBondContact O-N 2.96Å; A401-L404 PolarHBondContact O-N 3.21Å; L404-S406 VanDerWaalsContact C-N 3.27Å; L404-S406 PolarHBondContact O-N 3.19Å; L404-E407 WeakPolarHBondContact CD2-OE2 3.3Å; L404-E407 WeakPolarHBondContact O-CB 3.33Å; L404-E407 PolarHBondContact O-N 3.22Å; L404-L408 WeakPolarHBondContact O-CB 3.2Å; L404-L408 PolarHBondContact O-N 2.73Å
405	Y	90.7	Very high	88.5	Confident	7 Å²	7	70 Å²	70	3%	0.027	32%	0.319	C	S	.	.	H	α-helix	trans	-60	-38	173.2	-175.2	-86.9	0	0	0	111.6	M368 D377 L378 R383 M386 V387 I390 A401 E402 G403 L408 K409	M368-Y405 HydrophobicContact SD-CE2 4.33Å; D377-Y405 WeakPolarHBondContact OD1-CE1 3.41Å; D377-Y405 PolarHBondContact OD1-OH 3.41Å; L378-Y405 HydrophobicContact CD1-CE2 4.25Å; L378-Y405 PolarHBondContact N-OH 3.33Å; R383-Y405 HydrophobicContact CB-CE2 4.46Å; R383-Y405 HydrophobicContact CG-CE1 3.84Å; R383-Y405 HydrophobicContact CG-CE2 4.08Å; M386-Y405 HydrophobicContact CB-CD2 4.38Å; M386-Y405 HydrophobicContact CB-CE2 4.07Å; M386-Y405 HydrophobicContact CG-CD2 3.96Å; M386-Y405 HydrophobicContact CG-CE2 3.86Å; V387-Y405 HydrophobicContact CG2-CD2 3.99Å; V387-Y405 HydrophobicContact CG2-CG 3.96Å; I390-Y405 HydrophobicContact CD1-CD2 4.02Å; A401-Y405 WeakPolarHBondContact O-CB 3.26Å; A401-Y405 PolarHBondContact O-N 3.41Å; E402-Y405 PolarHBondContact O-N 2.75Å; G403-Y405 VanDerWaalsContact C-N 3.3Å; G403-Y405 PolarHBondContact O-N 2.96Å; Y405-L408 PolarHBondContact O-N 2.81Å; Y405-K409 WeakPolarHBondContact O-CB 3.45Å; Y405-K409 PolarHBondContact O-N 3.22Å
406	S	89.2	Confident	88.3	Confident	74 Å²	74	65.1 Å²	65.1	52%	0.517	30%	0.297	S	S	.	.	H	α-helix	trans	-69.8	-38.1	176.2	79.4	0	0	0	0	113.1	E402 G403 L404 L408 L410	E402-S406 PolarHBondContact O-N 3.44Å; G403-S406 WeakPolarHBondContact O-CB 3.22Å; G403-S406 PolarHBondContact O-N 3.19Å; G403-S406 PolarHBondContact O-OG 2.85Å; L404-S406 VanDerWaalsContact C-N 3.27Å; L404-S406 PolarHBondContact O-N 3.19Å; S406-L408 VanDerWaalsContact C-N 3.33Å; S406-L410 PolarHBondContact O-N 3.43Å
407	E	89.1	Confident	88.3	Confident	34 Å²	34	63.7 Å²	63.7	16%	0.159	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-43.3	170.1	-66.5	175.1	-158.8	0	0	110	F337 R338 F341 G403 L404 L410 C411	F337-E407 HydrophobicContact CE1-CB 3.76Å; F337-E407 HydrophobicContact CZ-CB 4.25Å; R338-E407 WeakPolarHBondContact CG-OE2 3.48Å; R338-E407 IonicContact CZ-OE1 3.68Å; R338-E407 IonicContact NE-OE1 2.84Å; R338-E407 PolarHBondContact NE-OE1 3.36Å; R338-E407 IonicContact NE-OE2 2.81Å; R338-E407 PolarHBondContact NE-OE2 2.93Å; R338-E407 IonicContact NH2-OE1 2.66Å; R338-E407 PolarHBondContact NH2-OE1 2.91Å; F341-E407 HydrophobicContact CD2-CB 4.15Å; F341-E407 VanDerWaalsContact CD2-O 3.3Å; F341-E407 WeakPolarHBondContact CD2-O 3.28Å; F341-E407 HydrophobicContact CE2-CB 4.19Å; F341-E407 WeakPolarHBondContact CE2-O 3.47Å; G403-E407 PolarHBondContact O-N 2.94Å; G403-E407 VanDerWaalsContact O-N 3.09Å; L404-E407 WeakPolarHBondContact CD2-OE2 3.3Å; L404-E407 WeakPolarHBondContact O-CB 3.33Å; L404-E407 PolarHBondContact O-N 3.22Å; E407-L410 PolarHBondContact O-N 3.37Å; E407-C411 PolarHBondContact O-N 3.46Å
408	L	89.4	Confident	88.3	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-68.7	-45.9	-179.2	-149.6	171.8	0	0	0	112.4	F337 L365 M368 M386 L404 Y405 S406 L410 C411 M412	F337-L408 HydrophobicContact CE2-CB 4.12Å; F337-L408 HydrophobicContact CE2-CD1 4.1Å; F337-L408 HydrophobicContact CE2-CG 3.69Å; F337-L408 HydrophobicContact CZ-CB 3.65Å; F337-L408 HydrophobicContact CZ-CD1 4.38Å; F337-L408 HydrophobicContact CZ-CG 3.78Å; L365-L408 HydrophobicContact CD1-CD2 4Å; L365-L408 HydrophobicContact CD1-CG 4.3Å; M368-L408 HydrophobicContact CB-CD2 3.59Å; M368-L408 HydrophobicContact CE-CD2 4.02Å; M368-L408 HydrophobicContact CG-CD1 3.93Å; M368-L408 HydrophobicContact CG-CD2 3.49Å; M368-L408 VanDerWaalsContact CG-CD2 3.49Å; M368-L408 HydrophobicContact CG-CG 4.36Å; M368-L408 HydrophobicContact SD-CD2 4.38Å; M386-L408 HydrophobicContact CE-CD1 3.95Å; L404-L408 WeakPolarHBondContact O-CB 3.2Å; L404-L408 PolarHBondContact O-N 2.73Å; Y405-L408 PolarHBondContact O-N 2.81Å; S406-L408 VanDerWaalsContact C-N 3.33Å; L408-L410 PolarHBondContact O-N 2.92Å; L408-C411 WeakPolarHBondContact O-CA 3.42Å; L408-C411 WeakPolarHBondContact O-CB 3.23Å; L408-C411 PolarHBondContact O-N 2.81Å; L408-M412 HydrophobicContact CD2-CE 4.02Å; L408-M412 HydrophobicContact CD2-CG 3.8Å; L408-M412 HydrophobicContact CD2-SD 4.34Å; L408-M412 PolarHBondContact O-N 3.27Å
409	K	89.6	Confident	88.4	Confident	68 Å²	68	50.8 Å²	50.8	30%	0.296	24%	0.244	S	C	.	.	H	α-helix	trans	-54	-41.7	172.1	172.6	171	-179.2	172.4	0	111.8	G376 D377 Y405 M412 K413	G376-K409 WeakPolarHBondContact O-CA 3.41Å; D377-K409 HydrophobicContact CB-CD 4.02Å; D377-K409 WeakPolarHBondContact OD2-CE 3.42Å; D377-K409 IonicContact OD2-NZ 2.74Å; D377-K409 PolarHBondContact OD2-NZ 3.41Å; Y405-K409 WeakPolarHBondContact O-CB 3.45Å; Y405-K409 PolarHBondContact O-N 3.22Å; K409-M412 PolarHBondContact O-N 3.15Å; K409-K413 PolarHBondContact O-N 2.72Å
410	L	88	Confident	88.4	Confident	90 Å²	90	43.8 Å²	43.8	47%	0.471	22%	0.215	S	C	.	.	H	α-helix	trans	-71.5	-30.7	177.2	-169.1	70	0	0	0	112.4	F341 S406 E407 L408 K413	F341-L410 HydrophobicContact CE2-CB 4.16Å; F341-L410 HydrophobicContact CE2-CD2 3.97Å; F341-L410 HydrophobicContact CE2-CG 4.37Å; F341-L410 HydrophobicContact CZ-CD2 3.99Å; S406-L410 PolarHBondContact O-N 3.43Å; E407-L410 PolarHBondContact O-N 3.37Å; L408-L410 PolarHBondContact O-N 2.92Å; L410-K413 HydrophobicContact CD1-CD 4.3Å
411	C	89.3	Confident	88.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-45.8	171.1	-159	0	0	0	0	111.8	F341 E407 L408 K413 R414	F341-C411 HydrophobicContact CD2-CB 4.36Å; E407-C411 PolarHBondContact O-N 3.46Å; L408-C411 WeakPolarHBondContact O-CA 3.42Å; L408-C411 WeakPolarHBondContact O-CB 3.23Å; L408-C411 PolarHBondContact O-N 2.81Å; C411-K413 PolarHBondContact O-N 2.93Å; C411-R414 PolarHBondContact O-N 3.24Å
412	M	90.2	Very high	88.3	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-24.6	178.9	-68.3	-59.8	96.5	0	0	114	L365 M368 H369 A372 L408 K409 R414 R415 I418	L365-M412 HydrophobicContact CD1-CE 3.44Å; L365-M412 VanDerWaalsContact CD1-CE 3.44Å; L365-M412 HydrophobicContact CG-CE 4.29Å; M368-M412 HydrophobicContact CB-CG 4.13Å; M368-M412 HydrophobicContact CB-SD 3.79Å; M368-M412 HydrophobicContact CE-CG 4.02Å; H369-M412 HydrophobicContact CB-SD 4.47Å; A372-M412 HydrophobicContact CB-CB 4.47Å; A372-M412 HydrophobicContact CB-CG 4.29Å; L408-M412 HydrophobicContact CD2-CE 4.02Å; L408-M412 HydrophobicContact CD2-CG 3.8Å; L408-M412 HydrophobicContact CD2-SD 4.34Å; L408-M412 PolarHBondContact O-N 3.27Å; K409-M412 PolarHBondContact O-N 3.15Å; M412-R414 PolarHBondContact O-N 2.71Å; M412-R415 WeakPolarHBondContact O-CB 3.24Å; M412-R415 PolarHBondContact O-N 2.77Å; M412-I418 HydrophobicContact CE-CD1 3.48Å; M412-I418 VanDerWaalsContact CE-CD1 3.48Å
413	K	86.1	Confident	87.7	Confident	124 Å²	124	42.6 Å²	42.6	54%	0.539	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-16.5	171	-61.8	-157.7	178.5	-158.1	0	113.9	D375 K409 L410 C411	D375-K413 VanDerWaalsContact O-CE 3.31Å; D375-K413 WeakPolarHBondContact O-CE 3.34Å; K409-K413 PolarHBondContact O-N 2.72Å; L410-K413 HydrophobicContact CD1-CD 4.3Å; C411-K413 PolarHBondContact O-N 2.93Å
414	R	84.8	Confident	86.5	Confident	91 Å²	91	42.1 Å²	42.1	34%	0.343	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	39	170.6	-61.1	-174.4	176.9	-179.6	-1	111.8	V344 T345 G346 C411 M412 H416 L417	V344-R414 HydrophobicContact CG1-CB 4Å; V344-R414 VanDerWaalsContact O-CD 3.31Å; V344-R414 WeakPolarHBondContact O-CD 3.34Å; V344-R414 PolarHBondContact O-NH1 3.19Å; T345-R414 VanDerWaalsContact C-NH1 3.33Å; T345-R414 PolarHBondContact O-NH1 3.46Å; G346-R414 PolarHBondContact O-NH1 3.09Å; C411-R414 PolarHBondContact O-N 3.24Å; M412-R414 PolarHBondContact O-N 2.71Å; R414-H416 PolarHBondContact O-N 3.13Å; R414-L417 HydrophobicContact CB-CD1 3.85Å; R414-L417 HydrophobicContact CB-CG 4.22Å; R414-L417 HydrophobicContact CG-CD1 4.39Å; R414-L417 WeakPolarHBondContact O-CB 3.35Å; R414-L417 PolarHBondContact O-N 3.3Å
415	R	86.6	Confident	85.3	Confident	106 Å²	106	47.5 Å²	47.5	40%	0.4	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-48	-32.1	-179.3	65.9	179.8	-175.6	-162.7	-3.2	114.5	E374 M412 L417 I418	E374-R415 IonicContact OE1-CZ 3.56Å; E374-R415 IonicContact OE1-NH1 3.18Å; E374-R415 IonicContact OE1-NH2 3.41Å; E374-R415 PolarHBondContact OE1-NH2 2.95Å; M412-R415 WeakPolarHBondContact O-CB 3.24Å; M412-R415 PolarHBondContact O-N 2.77Å; R415-L417 PolarHBondContact O-N 3Å; R415-I418 PolarHBondContact O-N 3.37Å; R415-I418 VanDerWaalsContact O-O 3.08Å
416	H	83.4	Confident	83.7	Confident	84 Å²	84	49.9 Å²	49.9	39%	0.389	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-64.8	-5.9	175.2	71.7	-101.7	0	0	0	115.8	R414	R414-H416 PolarHBondContact O-N 3.13Å
417	L	87.1	Confident	82	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-96.7	-4.3	171.2	-62.2	179.4	0	0	0	112.8	V344 P349 P351 I352 R414 R415 V442	V344-L417 HydrophobicContact CG1-CB 4.32Å; V344-L417 HydrophobicContact CG1-CD1 3.97Å; V344-L417 WeakPolarHBondContact O-CD1 3.41Å; P349-L417 HydrophobicContact CB-CD1 3.46Å; P349-L417 VanDerWaalsContact CB-CD1 3.46Å; P349-L417 HydrophobicContact CB-CD2 4.21Å; P349-L417 HydrophobicContact CG-CD1 4.39Å; P351-L417 CarbonylContact C-O 3.23Å; P351-L417 VanDerWaalsContact CA-O 3.26Å; P351-L417 WeakPolarHBondContact CA-O 3.37Å; I352-L417 PolarHBondContact N-O 3.43Å; R414-L417 HydrophobicContact CB-CD1 3.85Å; R414-L417 HydrophobicContact CB-CG 4.22Å; R414-L417 HydrophobicContact CG-CD1 4.39Å; R414-L417 WeakPolarHBondContact O-CB 3.35Å; R414-L417 PolarHBondContact O-N 3.3Å; R415-L417 PolarHBondContact O-N 3Å; L417-V442 HydrophobicContact CD2-CG1 3.58Å; L417-V442 HydrophobicContact CD2-CG2 4.32Å
418	I	89.8	Confident	80.5	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	111.4	-171.6	-57.3	172.9	0	0	0	107	V344 I352 V354 L365 H369 M412 R415	V344-I418 HydrophobicContact CG2-CG1 4.33Å; I352-I418 WeakPolarHBondContact O-CA 3.44Å; V354-I418 HydrophobicContact CG2-CG2 3.72Å; L365-I418 HydrophobicContact CD2-CG2 4.48Å; H369-I418 PolarHBondContact CD2-O 3.26Å; H369-I418 PolarHBondContact NE2-O 2.83Å; M412-I418 HydrophobicContact CE-CD1 3.48Å; M412-I418 VanDerWaalsContact CE-CD1 3.48Å; R415-I418 PolarHBondContact O-N 3.37Å; R415-I418 VanDerWaalsContact O-O 3.08Å
419	S	89.4	Confident	79.1	Confident	21 Å²	21	55.5 Å²	55.5	15%	0.147	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.3	174.2	-58.1	0	0	0	0	108.7	I352 V353 V354 A438	I352-S419 PolarHBondContact O-N 2.85Å; V353-S419 CarbonylContact C-O 3.36Å; V353-S419 VanDerWaalsContact CA-O 3.32Å; V353-S419 WeakPolarHBondContact CA-O 3.24Å; V354-S419 PolarHBondContact N-O 3.3Å; S419-A438 WeakPolarHBondContact OG-CB 3.2Å
420	V	89.7	Confident	78.5	Confident	26 Å²	26	55.3 Å²	55.3	16%	0.158	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.2	178.8	-174.8	0	0	0	0	109.5	V354 D356 A366 H369 R422	V354-V420 HydrophobicContact CB-CG2 4.45Å; V354-V420 CarbonylContact O-C 3.53Å; V354-V420 WeakPolarHBondContact O-CA 3.38Å; D356-V420 HydrophobicContact CB-CG1 3.9Å; A366-V420 HydrophobicContact CB-CG1 3.73Å; A366-V420 HydrophobicContact CB-CG2 4.37Å; H369-V420 HydrophobicContact CB-CG2 3.85Å; V420-R422 HydrophobicContact CG1-CG 4.2Å
421	F	89.7	Confident	78.5	Confident	6 Å²	6	51 Å²	51	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.7	169.5	178.3	-110.8	0	0	0	109.3	L187 V190 V353 V354 D356 D429 I431 T434	L187-F421 HydrophobicContact CD1-CE1 4.41Å; V190-F421 HydrophobicContact CG1-CE1 4.02Å; V190-F421 HydrophobicContact CG1-CZ 3.81Å; V353-F421 HydrophobicContact CG1-CB 4.2Å; V354-F421 PolarHBondContact O-N 3.13Å; D356-F421 WeakPolarHBondContact CB-O 3.22Å; D356-F421 PolarHBondContact N-O 2.65Å; F421-D429 WeakPolarHBondContact CE2-O 3.16Å; F421-D429 WeakPolarHBondContact CZ-O 3.28Å; F421-I431 HydrophobicContact CD1-CB 4.34Å; F421-I431 HydrophobicContact CD1-CD1 4.18Å; F421-I431 HydrophobicContact CD1-CG1 4.31Å; F421-I431 HydrophobicContact CD2-CB 4.18Å; F421-I431 HydrophobicContact CD2-CG1 4.4Å; F421-I431 HydrophobicContact CE1-CB 4.19Å; F421-I431 HydrophobicContact CE2-CB 4.02Å; F421-I431 HydrophobicContact CG-CB 4.33Å; F421-I431 HydrophobicContact CG-CD1 4.45Å; F421-I431 HydrophobicContact CG-CG1 4.19Å; F421-I431 HydrophobicContact CZ-CB 4.03Å; F421-T434 HydrophobicContact CB-CG2 4.13Å; F421-T434 HydrophobicContact CD2-CG2 4.34Å; F421-T434 WeakPolarHBondContact CD2-OG1 3.19Å
422	R	85.5	Confident	78.4	Confident	51 Å²	51	51.1 Å²	51.1	19%	0.192	26%	0.261	C	S	.	.			trans	-120.2	128.7	173.6	-67.7	-164	170.2	85.7	17	109.7	D356 A366 V420 G424 E425	D356-R422 HydrophobicContact CB-CG 3.95Å; D356-R422 IonicContact OD2-CZ 3.52Å; D356-R422 IonicContact OD2-NE 3.19Å; D356-R422 PolarHBondContact OD2-NE 3.19Å; D356-R422 IonicContact OD2-NH2 2.89Å; D356-R422 PolarHBondContact OD2-NH2 2.84Å; A366-R422 PolarHBondContact O-NH2 2.82Å; V420-R422 HydrophobicContact CG1-CG 4.2Å; R422-G424 PolarHBondContact O-N 3.25Å; R422-E425 HydrophobicContact CB-CB 4.03Å; R422-E425 WeakPolarHBondContact CD-OE2 3.47Å
423	M	76.8	Confident	78.1	Confident	62 Å²	62	52.2 Å²	52.2	31%	0.305	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	108.8	-179.5	-172.8	169.7	-167.1	0	0	110.5	K186 L187 V190	K186-M423 HydrophobicContact CB-CE 4.24Å; K186-M423 HydrophobicContact CD-CE 3.53Å; K186-M423 HydrophobicContact CD-SD 4.5Å; K186-M423 HydrophobicContact CG-CE 3.66Å; L187-M423 HydrophobicContact CB-SD 4.44Å; V190-M423 HydrophobicContact CB-CE 4.39Å; V190-M423 HydrophobicContact CG2-CE 3.54Å
424	G	64.5	Low	78.2	Confident	18 Å²	18	47.1 Å²	47.1	19%	0.186	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	22.2	-179.2	0	0	0	0	0	115.7	R422 D429	R422-G424 PolarHBondContact O-N 3.25Å; G424-D429 WeakPolarHBondContact CA-OD1 2.95Å; G424-D429 PolarHBondContact N-OD1 3.45Å
425	E	61.6	Low	78.5	Confident	120 Å²	120	42.8 Å²	42.8	56%	0.561	23%	0.229	S	C	*	.	S	Bend	trans	-137.5	82.8	171.6	-70.7	-168.8	148.5	0	0	111.7	R370 R422	R370-E425 IonicContact NH1-OE2 2.65Å; R422-E425 HydrophobicContact CB-CB 4.03Å; R422-E425 WeakPolarHBondContact CD-OE2 3.47Å
426	G	57.2	Low	78.5	Confident	56 Å²	56	37.7 Å²	37.7	58%	0.577	21%	0.21	S	C	*	.	S	Bend	trans	164.1	-179.8	168.2	0	0	0	0	0	115.4	S428	G426-S428 PolarHBondContact O-N 2.73Å
427	D	54.1	Low	78.5	Confident	152 Å²	152	34.3 Å²	34.3	81%	0.813	20%	0.195	S	C	*	.	S	Bend	trans	-71.1	-3	173.9	-54	-24.8	0	0	0	113.7	K468	D427-K468 IonicContact OD2-NZ 2.67Å; D427-K468 PolarHBondContact OD2-NZ 3.02Å
428	S	57.5	Low	78.4	Confident	33 Å²	33	34.2 Å²	34.2	23%	0.231	20%	0.195	C	C	.	.			trans	-157.6	97.8	-170.9	60.9	0	0	0	0	111.4	G426 E430	G426-S428 PolarHBondContact O-N 2.73Å; S428-E430 PolarHBondContact O-N 2.71Å
429	D	61	Low	78.2	Confident	47 Å²	47	34.7 Å²	34.7	25%	0.251	20%	0.198	S	C	.	.			trans	-76.6	-4.6	178	-59	-83.2	0	0	0	113.7	F421 G424 F1743	F421-D429 WeakPolarHBondContact CE2-O 3.16Å; F421-D429 WeakPolarHBondContact CZ-O 3.28Å; G424-D429 WeakPolarHBondContact CA-OD1 2.95Å; G424-D429 PolarHBondContact N-OD1 3.45Å; D429-F1743 HydrophobicContact CB-CE2 3.71Å; D429-F1743 HydrophobicContact CB-CZ 3.8Å; D429-F1743 VanDerWaalsContact OD1-CZ 3.28Å; D429-F1743 WeakPolarHBondContact OD1-CZ 3.34Å; D429-F1743 VanDerWaalsContact OD2-CZ 3.23Å; D429-F1743 WeakPolarHBondContact OD2-CZ 2.9Å
430	E	77.4	Confident	77.7	Confident	64 Å²	64	34.2 Å²	34.2	30%	0.299	19%	0.193	S	C	.	.			trans	-86.5	122.5	177	-45.4	-171.4	136.3	0	0	111.2	R197 S428 D432 I433 T434	R197-E430 IonicContact CZ-OE1 3.76Å; R197-E430 IonicContact CZ-OE2 3.73Å; R197-E430 IonicContact NH1-OE1 2.86Å; R197-E430 PolarHBondContact NH1-OE1 3.31Å; R197-E430 IonicContact NH1-OE2 2.95Å; R197-E430 IonicContact NH2-OE1 2.67Å; R197-E430 PolarHBondContact NH2-OE1 2.97Å; R197-E430 IonicContact NH2-OE2 2.65Å; R197-E430 PolarHBondContact NH2-OE2 3.46Å; S428-E430 PolarHBondContact O-N 2.71Å; E430-D432 VanDerWaalsContact C-N 3.27Å; E430-D432 WeakPolarHBondContact CB-OD1 3.47Å; E430-D432 PolarHBondContact O-N 2.9Å; E430-I433 HydrophobicContact CB-CD1 4.18Å; E430-I433 HydrophobicContact CB-CG1 4.23Å; E430-I433 HydrophobicContact CG-CD1 4.37Å; E430-I433 PolarHBondContact O-N 3.47Å; E430-I433 VanDerWaalsContact OE2-CD1 3.26Å; E430-I433 WeakPolarHBondContact OE2-CD1 3.48Å; E430-T434 PolarHBondContact O-N 3.03Å; E430-T434 PolarHBondContact O-OG1 3.5Å
431	I	86.4	Confident	76.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-23.8	179.4	-174.1	174.9	0	0	0	112.6	V190 V191 C355 F421 T434 I435	V190-I431 HydrophobicContact CG1-CG2 4.37Å; V190-I431 WeakPolarHBondContact O-CG2 3.33Å; V191-I431 HydrophobicContact CG2-CD1 4.21Å; C355-I431 VanDerWaalsContact SG-CD1 3.55Å; F421-I431 HydrophobicContact CD1-CB 4.34Å; F421-I431 HydrophobicContact CD1-CD1 4.18Å; F421-I431 HydrophobicContact CD1-CG1 4.31Å; F421-I431 HydrophobicContact CD2-CB 4.18Å; F421-I431 HydrophobicContact CD2-CG1 4.4Å; F421-I431 HydrophobicContact CE1-CB 4.19Å; F421-I431 HydrophobicContact CE2-CB 4.02Å; F421-I431 HydrophobicContact CG-CB 4.33Å; F421-I431 HydrophobicContact CG-CD1 4.45Å; F421-I431 HydrophobicContact CG-CG1 4.19Å; F421-I431 HydrophobicContact CZ-CB 4.03Å; I431-T434 WeakPolarHBondContact O-CB 3.33Å; I431-T434 PolarHBondContact O-N 2.78Å; I431-I435 HydrophobicContact CG1-CD1 4.06Å; I431-I435 HydrophobicContact CG1-CG1 4.32Å; I431-I435 WeakPolarHBondContact O-CB 3.16Å; I431-I435 VanDerWaalsContact O-CG1 3.24Å; I431-I435 WeakPolarHBondContact O-CG1 3.39Å; I431-I435 PolarHBondContact O-N 3.45Å
432	D	87.4	Confident	75.8	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-66.1	-43.8	174	71.9	-38.3	0	0	0	111.7	R197 A198 E430 T434 I435 L436 R461	R197-D432 IonicContact NE-OD2 3.35Å; A198-D432 HydrophobicContact CB-CB 3.69Å; E430-D432 VanDerWaalsContact C-N 3.27Å; E430-D432 WeakPolarHBondContact CB-OD1 3.47Å; E430-D432 PolarHBondContact O-N 2.9Å; D432-T434 VanDerWaalsContact C-N 3.26Å; D432-T434 PolarHBondContact O-N 2.94Å; D432-I435 PolarHBondContact O-N 3.37Å; D432-L436 WeakPolarHBondContact O-CB 3.46Å; D432-L436 WeakPolarHBondContact O-CG 3.22Å; D432-L436 PolarHBondContact O-N 2.86Å; D432-R461 IonicContact OD2-CZ 3.1Å; D432-R461 IonicContact OD2-NH1 3.39Å; D432-R461 PolarHBondContact OD2-NH1 3.5Å; D432-R461 IonicContact OD2-NH2 2.67Å
433	I	85	Confident	74.1	Confident	28 Å²	28	39.8 Å²	39.8	14%	0.144	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-40.4	171.9	-62.3	177.2	0	0	0	109.9	E430 L436 T437	E430-I433 HydrophobicContact CB-CD1 4.18Å; E430-I433 HydrophobicContact CB-CG1 4.23Å; E430-I433 HydrophobicContact CG-CD1 4.37Å; E430-I433 PolarHBondContact O-N 3.47Å; E430-I433 VanDerWaalsContact OE2-CD1 3.26Å; E430-I433 WeakPolarHBondContact OE2-CD1 3.48Å; I433-L436 PolarHBondContact O-N 2.82Å; I433-T437 HydrophobicContact CG2-CG2 4.04Å; I433-T437 VanDerWaalsContact O-CB 3.29Å; I433-T437 WeakPolarHBondContact O-CB 3.46Å; I433-T437 VanDerWaalsContact O-CG2 3.25Å; I433-T437 WeakPolarHBondContact O-CG2 3.18Å; I433-T437 PolarHBondContact O-N 3.22Å; I433-T437 PolarHBondContact O-OG1 3.49Å
434	T	87.7	Confident	72.8	Confident	17 Å²	17	38.9 Å²	38.9	10%	0.104	24%	0.236	C	C	.	.	H	α-helix	trans	-64.7	-42.2	176.5	-57	0	0	0	0	112.2	V353 F421 E430 I431 D432 T437 A438	V353-T434 HydrophobicContact CG1-CG2 3.95Å; F421-T434 HydrophobicContact CB-CG2 4.13Å; F421-T434 HydrophobicContact CD2-CG2 4.34Å; F421-T434 WeakPolarHBondContact CD2-OG1 3.19Å; E430-T434 PolarHBondContact O-N 3.03Å; E430-T434 PolarHBondContact O-OG1 3.5Å; I431-T434 WeakPolarHBondContact O-CB 3.33Å; I431-T434 PolarHBondContact O-N 2.78Å; D432-T434 VanDerWaalsContact C-N 3.26Å; D432-T434 PolarHBondContact O-N 2.94Å; T434-T437 PolarHBondContact O-OG1 2.87Å; T434-A438 WeakPolarHBondContact O-CB 3.5Å; T434-A438 PolarHBondContact O-N 3.05Å
435	I	90	Very high	72.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.2	-46	175.8	-71.7	164.5	0	0	0	111.6	V326 V328 V353 I431 D432	V326-I435 HydrophobicContact CG1-CG2 3.7Å; V326-I435 HydrophobicContact CG2-CG2 4.26Å; V328-I435 HydrophobicContact CG2-CD1 4.05Å; V328-I435 HydrophobicContact CG2-CG1 4.19Å; V353-I435 HydrophobicContact CG2-CG1 4.11Å; I431-I435 HydrophobicContact CG1-CD1 4.06Å; I431-I435 HydrophobicContact CG1-CG1 4.32Å; I431-I435 WeakPolarHBondContact O-CB 3.16Å; I431-I435 VanDerWaalsContact O-CG1 3.24Å; I431-I435 WeakPolarHBondContact O-CG1 3.39Å; I431-I435 PolarHBondContact O-N 3.45Å; D432-I435 PolarHBondContact O-N 3.37Å
436	L	87.5	Confident	72.2	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-76.3	-31.8	-177.6	-62.8	176.8	0	0	0	112.6	L170 T202 D432 I433 W459 R461 I464	L170-L436 HydrophobicContact CD2-CD2 3.81Å; T202-L436 HydrophobicContact CG2-CD1 4.17Å; T202-L436 HydrophobicContact CG2-CD2 3.93Å; D432-L436 WeakPolarHBondContact O-CB 3.46Å; D432-L436 WeakPolarHBondContact O-CG 3.22Å; D432-L436 PolarHBondContact O-N 2.86Å; I433-L436 PolarHBondContact O-N 2.82Å; L436-W459 HydrophobicContact CB-CE3 4.36Å; L436-W459 HydrophobicContact CB-CZ3 4.09Å; L436-W459 HydrophobicContact CD2-CD2 3.98Å; L436-W459 HydrophobicContact CD2-CE3 3.92Å; L436-W459 HydrophobicContact CD2-CH2 4.3Å; L436-W459 HydrophobicContact CD2-CZ2 4.35Å; L436-W459 HydrophobicContact CD2-CZ3 4.09Å; L436-R461 HydrophobicContact CD1-CG 4.23Å; L436-I464 HydrophobicContact CB-CD1 3.72Å; L436-I464 HydrophobicContact CD1-CD1 3.58Å; L436-I464 HydrophobicContact CG-CD1 4.3Å
437	T	83.5	Confident	72.7	Confident	12 Å²	12	43.2 Å²	43.2	7%	0.074	24%	0.242	C	C	.	.	H	α-helix	trans	-76.8	-32.3	175.2	55.1	0	0	0	0	113.1	I433 T434 L439 L440 Q441 K468	I433-T437 HydrophobicContact CG2-CG2 4.04Å; I433-T437 VanDerWaalsContact O-CB 3.29Å; I433-T437 WeakPolarHBondContact O-CB 3.46Å; I433-T437 VanDerWaalsContact O-CG2 3.25Å; I433-T437 WeakPolarHBondContact O-CG2 3.18Å; I433-T437 PolarHBondContact O-N 3.22Å; I433-T437 PolarHBondContact O-OG1 3.49Å; T434-T437 PolarHBondContact O-OG1 2.87Å; T437-L439 VanDerWaalsContact C-N 3.26Å; T437-L439 PolarHBondContact O-N 2.97Å; T437-L440 PolarHBondContact O-N 2.7Å; T437-Q441 VanDerWaalsContact O-CG 3.3Å; T437-Q441 WeakPolarHBondContact O-CG 3.4Å; T437-Q441 PolarHBondContact O-N 3.34Å; T437-K468 HydrophobicContact CG2-CG 3.97Å
438	A	85.5	Confident	73.7	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-53.7	-45.9	171	0	0	0	0	0	111.1	V353 S419 T434 L440 Q441 V442	V353-A438 HydrophobicContact CG2-CB 3.91Å; S419-A438 WeakPolarHBondContact OG-CB 3.2Å; T434-A438 WeakPolarHBondContact O-CB 3.5Å; T434-A438 PolarHBondContact O-N 3.05Å; A438-L440 VanDerWaalsContact C-N 3.27Å; A438-L440 PolarHBondContact O-N 2.97Å; A438-Q441 PolarHBondContact O-N 2.73Å; A438-V442 WeakPolarHBondContact O-CG2 3.46Å; A438-V442 PolarHBondContact O-N 3.1Å
439	L	84.5	Confident	74.7	Confident	14 Å²	14	39.6 Å²	39.6	7%	0.073	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-29.5	176	-70.7	167.5	0	0	0	114	L170 P324 V326 P351 T437 L447 W459	L170-L439 HydrophobicContact CD1-CD1 3.51Å; P324-L439 HydrophobicContact CB-CD1 4.22Å; P324-L439 HydrophobicContact CB-CD2 3.96Å; V326-L439 HydrophobicContact CB-CD1 4.27Å; V326-L439 HydrophobicContact CB-CD2 4.05Å; V326-L439 HydrophobicContact CB-CG 4.18Å; V326-L439 HydrophobicContact CG1-CD1 4.41Å; P351-L439 HydrophobicContact CG-CD2 4.01Å; T437-L439 VanDerWaalsContact C-N 3.26Å; T437-L439 PolarHBondContact O-N 2.97Å; L439-L447 WeakPolarHBondContact O-CD1 3.24Å; L439-W459 HydrophobicContact CB-CH2 3.89Å; L439-W459 HydrophobicContact CB-CZ2 4.44Å; L439-W459 HydrophobicContact CD1-CH2 3.91Å; L439-W459 HydrophobicContact CD1-CZ2 3.79Å
440	L	79.6	Confident	75.6	Confident	10 Å²	10	39.1 Å²	39.1	5%	0.052	23%	0.227	C	C	.	.	H	α-helix	trans	-88.8	-19.7	179.4	-64.3	173.2	0	0	0	113.7	T437 A438 Q452 T456 W459 I464 V469	T437-L440 PolarHBondContact O-N 2.7Å; A438-L440 VanDerWaalsContact C-N 3.27Å; A438-L440 PolarHBondContact O-N 2.97Å; L440-Q452 HydrophobicContact CD2-CB 3.94Å; L440-Q452 HydrophobicContact CD2-CG 4.07Å; L440-Q452 PolarHBondContact O-NE2 3.31Å; L440-T456 HydrophobicContact CD1-CG2 3.96Å; L440-W459 HydrophobicContact CD1-CZ3 4.31Å; L440-W459 HydrophobicContact CD2-CH2 4.44Å; L440-W459 HydrophobicContact CD2-CZ3 4.32Å; L440-W459 HydrophobicContact CG-CH2 4.44Å; L440-W459 HydrophobicContact CG-CZ3 4.2Å; L440-I464 HydrophobicContact CD1-CG2 3.61Å; L440-V469 HydrophobicContact CD1-CG2 4.21Å
441	Q	73.2	Confident	75.6	Confident	111 Å²	111	39 Å²	39	52%	0.519	23%	0.227	S	C	.	.	H	α-helix	trans	-92.1	-22.8	-176.9	-70.7	178.2	23.8	0	0	113.8	T437 A438 S443	T437-Q441 VanDerWaalsContact O-CG 3.3Å; T437-Q441 WeakPolarHBondContact O-CG 3.4Å; T437-Q441 PolarHBondContact O-N 3.34Å; A438-Q441 PolarHBondContact O-N 2.73Å; Q441-S443 PolarHBondContact O-N 3.44Å; Q441-S443 PolarHBondContact O-OG 3.49Å
442	V	66.1	Low	75.5	Confident	8 Å²	8	39.6 Å²	39.6	5%	0.048	23%	0.23	C	C	.	.			trans	-58.8	101.9	-172.1	160.7	0	0	0	0	113.3	P351 L417 A438 G444 Q445	P351-V442 HydrophobicContact CB-CG2 3.45Å; P351-V442 VanDerWaalsContact CB-CG2 3.45Å; P351-V442 HydrophobicContact CG-CG2 4.09Å; L417-V442 HydrophobicContact CD2-CG1 3.58Å; L417-V442 HydrophobicContact CD2-CG2 4.32Å; A438-V442 WeakPolarHBondContact O-CG2 3.46Å; A438-V442 PolarHBondContact O-N 3.1Å; V442-G444 PolarHBondContact O-N 2.88Å; V442-G444 VanDerWaalsContact O-N 3.14Å; V442-Q445 HydrophobicContact CG1-CG 4.37Å; V442-Q445 PolarHBondContact O-N 3.49Å; V442-Q445 VanDerWaalsContact O-O 3.09Å
443	S	49.5	Very low	75.4	Confident	82 Å²	82	39.7 Å²	39.7	57%	0.573	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-9.6	-178.5	-37	0	0	0	0	114.2	Q441 Q445	Q441-S443 PolarHBondContact O-N 3.44Å; Q441-S443 PolarHBondContact O-OG 3.49Å; S443-Q445 VanDerWaalsContact C-N 3.34Å
444	G	49.8	Very low	75.3	Confident	42 Å²	42	38.8 Å²	38.8	43%	0.433	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-13.6	175.9	0	0	0	0	0	114.3	V442	V442-G444 PolarHBondContact O-N 2.88Å; V442-G444 VanDerWaalsContact O-N 3.14Å
445	Q	55.5	Low	75	Confident	98 Å²	98	38.2 Å²	38.2	46%	0.458	22%	0.223	S	C	.	.	S	Bend	trans	-118.5	115.9	168	-60.1	-174.2	23.7	0	0	107.2	V442 S443 L447	V442-Q445 HydrophobicContact CG1-CG 4.37Å; V442-Q445 PolarHBondContact O-N 3.49Å; V442-Q445 VanDerWaalsContact O-O 3.09Å; S443-Q445 VanDerWaalsContact C-N 3.34Å; Q445-L447 HydrophobicContact CB-CG 4.38Å; Q445-L447 PolarHBondContact O-N 2.91Å
446	N	57.4	Low	74.8	Confident	155 Å²	155	38.2 Å²	38.2	83%	0.829	22%	0.223	S	C	*	.			trans	-74.8	60.1	178.8	-77	-26	0	0	0	111.3	T448	N446-T448 PolarHBondContact O-N 3.1Å
447	L	68.3	Low	74.6	Confident	33 Å²	33	38.3 Å²	38.3	17%	0.173	22%	0.223	C	C	.	.			trans	-57.9	109.9	171.7	-71.2	170.2	0	0	0	108.3	L439 Q445 E451 Q452 L455	L439-L447 WeakPolarHBondContact O-CD1 3.24Å; Q445-L447 HydrophobicContact CB-CG 4.38Å; Q445-L447 PolarHBondContact O-N 2.91Å; L447-E451 HydrophobicContact CD2-CB 3.99Å; L447-Q452 HydrophobicContact CB-CG 3.86Å; L447-L455 HydrophobicContact CD1-CD1 4.1Å; L447-L455 HydrophobicContact CD2-CD1 4.04Å
448	T	75.2	Confident	74.5	Confident	64 Å²	64	38.1 Å²	38.1	39%	0.393	22%	0.223	S	C	.	.			trans	-60.3	155.5	173.5	58.7	0	0	0	0	110	N446 A450 E451 Q452	N446-T448 PolarHBondContact O-N 3.1Å; T448-A450 PolarHBondContact O-N 2.94Å; T448-A450 VanDerWaalsContact O-N 3.08Å; T448-E451 WeakPolarHBondContact CB-OE2 3.45Å; T448-E451 WeakPolarHBondContact CG2-OE2 3.49Å; T448-E451 PolarHBondContact N-OE2 2.97Å; T448-E451 WeakPolarHBondContact O-CA 3.38Å; T448-E451 PolarHBondContact O-N 3.17Å; T448-E451 WeakPolarHBondContact OG1-CG 3.08Å; T448-E451 PolarHBondContact OG1-N 3.44Å; T448-E451 PolarHBondContact OG1-OE2 2.97Å; T448-Q452 PolarHBondContact O-N 2.92Å
449	P	78.4	Confident	74.4	Confident	44 Å²	44	38.1 Å²	38.1	29%	0.286	22%	0.223	S	C	.	.	H	α-helix	trans	-54.8	-30.5	174	-26.6	35.3	0	0	0	112.6	L453 F473 W476	P449-L453 VanDerWaalsContact O-CB 3.3Å; P449-L453 WeakPolarHBondContact O-CB 3.3Å; P449-L453 PolarHBondContact O-N 2.58Å; P449-F473 HydrophobicContact CB-CD2 4.08Å; P449-F473 HydrophobicContact CB-CE2 4.25Å; P449-F473 HydrophobicContact CB-CG 4.33Å; P449-F473 HydrophobicContact CG-CD1 4.04Å; P449-F473 HydrophobicContact CG-CD2 4.1Å; P449-F473 HydrophobicContact CG-CE1 3.93Å; P449-F473 HydrophobicContact CG-CE2 3.99Å; P449-F473 HydrophobicContact CG-CG 4.12Å; P449-F473 HydrophobicContact CG-CZ 3.91Å; P449-W476 HydrophobicContact CB-CE3 4.34Å; P449-W476 HydrophobicContact CB-CH2 3.58Å; P449-W476 HydrophobicContact CB-CZ2 4.24Å; P449-W476 HydrophobicContact CB-CZ3 3.66Å; P449-W476 WeakPolarHBondContact O-CH2 3.37Å; P449-W476 WeakPolarHBondContact O-CZ3 3.28Å
450	A	79	Confident	74.4	Confident	37 Å²	37	39.5 Å²	39.5	31%	0.306	23%	0.23	S	C	.	.	H	α-helix	trans	-61.8	-47	170.8	0	0	0	0	0	112.7	T448 S454 T480	T448-A450 PolarHBondContact O-N 2.94Å; T448-A450 VanDerWaalsContact O-N 3.08Å; A450-S454 VanDerWaalsContact O-CB 3.24Å; A450-S454 WeakPolarHBondContact O-CB 3.29Å; A450-S454 PolarHBondContact O-N 3.26Å; A450-S454 PolarHBondContact O-OG 2.95Å; A450-T480 HydrophobicContact CB-CG2 3.47Å; A450-T480 VanDerWaalsContact CB-CG2 3.47Å
451	E	78.4	Confident	74.8	Confident	61 Å²	61	39.9 Å²	39.9	29%	0.285	23%	0.231	S	C	.	.	H	α-helix	trans	-66.4	-43.5	176.5	-73.9	158.7	130.3	0	0	111.5	L447 T448 S454 L455	L447-E451 HydrophobicContact CD2-CB 3.99Å; T448-E451 WeakPolarHBondContact CB-OE2 3.45Å; T448-E451 WeakPolarHBondContact CG2-OE2 3.49Å; T448-E451 PolarHBondContact N-OE2 2.97Å; T448-E451 WeakPolarHBondContact O-CA 3.38Å; T448-E451 PolarHBondContact O-N 3.17Å; T448-E451 WeakPolarHBondContact OG1-CG 3.08Å; T448-E451 PolarHBondContact OG1-N 3.44Å; T448-E451 PolarHBondContact OG1-OE2 2.97Å; E451-S454 WeakPolarHBondContact CA-OG 3.28Å; E451-S454 CarbonylContact O-C 3.51Å; E451-S454 PolarHBondContact O-N 2.89Å; E451-S454 VanDerWaalsContact O-N 3.17Å; E451-S454 PolarHBondContact O-OG 3.24Å; E451-L455 WeakPolarHBondContact O-CG 3.43Å; E451-L455 PolarHBondContact O-N 2.93Å
452	Q	84.1	Confident	75.5	Confident	15 Å²	15	34.9 Å²	34.9	7%	0.07	21%	0.208	C	C	.	.	H	α-helix	trans	-57.2	-50.8	175.7	-66.1	-162.3	-11.9	0	0	112.3	L440 L447 T448 S454 L455 T456 V469	L440-Q452 HydrophobicContact CD2-CB 3.94Å; L440-Q452 HydrophobicContact CD2-CG 4.07Å; L440-Q452 PolarHBondContact O-NE2 3.31Å; L447-Q452 HydrophobicContact CB-CG 3.86Å; T448-Q452 PolarHBondContact O-N 2.92Å; Q452-S454 VanDerWaalsContact C-N 3.32Å; Q452-S454 PolarHBondContact O-N 3.46Å; Q452-L455 PolarHBondContact O-N 3.16Å; Q452-T456 PolarHBondContact O-N 3.45Å; Q452-T456 PolarHBondContact O-OG1 2.84Å; Q452-V469 HydrophobicContact CB-CG1 4.37Å; Q452-V469 HydrophobicContact CB-CG2 4.4Å
453	L	85.4	Confident	76.5	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-57.5	-47.1	174.4	-179.9	58.8	0	0	0	110.6	P449 L455 T456 M457 V469 F470 W476 L481 A484 F496 L500	P449-L453 VanDerWaalsContact O-CB 3.3Å; P449-L453 WeakPolarHBondContact O-CB 3.3Å; P449-L453 PolarHBondContact O-N 2.58Å; L453-L455 VanDerWaalsContact C-N 3.27Å; L453-L455 PolarHBondContact O-N 3.47Å; L453-T456 PolarHBondContact O-N 3Å; L453-T456 PolarHBondContact O-OG1 2.86Å; L453-M457 HydrophobicContact CD1-CG 4.46Å; L453-M457 HydrophobicContact CD1-SD 4.42Å; L453-M457 HydrophobicContact CG-SD 4.1Å; L453-M457 WeakPolarHBondContact O-CG 3.3Å; L453-M457 PolarHBondContact O-N 2.84Å; L453-V469 HydrophobicContact CB-CG1 4.37Å; L453-F470 HydrophobicContact CD1-CE2 3.78Å; L453-F470 HydrophobicContact CD1-CZ 3.79Å; L453-F470 HydrophobicContact CD2-CZ 4.18Å; L453-W476 HydrophobicContact CB-CH2 4.11Å; L453-W476 HydrophobicContact CB-CZ3 4.15Å; L453-W476 HydrophobicContact CD2-CH2 4.32Å; L453-W476 HydrophobicContact CD2-CZ3 3.9Å; L453-L481 HydrophobicContact CD2-CD2 4.26Å; L453-A484 HydrophobicContact CD2-CB 3.7Å; L453-A484 HydrophobicContact CG-CB 4.4Å; L453-F496 HydrophobicContact CD1-CE1 4.38Å; L453-L500 HydrophobicContact CD2-CD2 4.38Å
454	S	82.4	Confident	78.3	Confident	10 Å²	10	33.4 Å²	33.4	7%	0.07	19%	0.194	C	C	.	.	H	α-helix	trans	-65.5	-24.5	-180	83.9	0	0	0	0	114.6	R315 A450 E451 Q452 A458	R315-S454 VanDerWaalsContact CZ-OG 3.28Å; R315-S454 VanDerWaalsContact NH1-CB 3.34Å; R315-S454 PolarHBondContact NH1-OG 3.45Å; R315-S454 PolarHBondContact NH2-O 2.89Å; R315-S454 PolarHBondContact NH2-OG 2.95Å; A450-S454 VanDerWaalsContact O-CB 3.24Å; A450-S454 WeakPolarHBondContact O-CB 3.29Å; A450-S454 PolarHBondContact O-N 3.26Å; A450-S454 PolarHBondContact O-OG 2.95Å; E451-S454 WeakPolarHBondContact CA-OG 3.28Å; E451-S454 CarbonylContact O-C 3.51Å; E451-S454 PolarHBondContact O-N 2.89Å; E451-S454 VanDerWaalsContact O-N 3.17Å; E451-S454 PolarHBondContact O-OG 3.24Å; Q452-S454 VanDerWaalsContact C-N 3.32Å; Q452-S454 PolarHBondContact O-N 3.46Å; S454-A458 WeakPolarHBondContact O-CB 3.44Å; S454-A458 PolarHBondContact O-N 3.35Å; S454-A458 VanDerWaalsContact O-N 3.15Å
455	L	81.6	Confident	80.1	Confident	5 Å²	5	31.4 Å²	31.4	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-75.4	-48.5	171.8	-75.6	170.9	0	0	0	110.2	I311 P324 L447 E451 Q452 L453 M457 A458 W459	I311-L455 HydrophobicContact CD1-CD2 3.89Å; P324-L455 HydrophobicContact CG-CD2 4.17Å; L447-L455 HydrophobicContact CD1-CD1 4.1Å; L447-L455 HydrophobicContact CD2-CD1 4.04Å; E451-L455 WeakPolarHBondContact O-CG 3.43Å; E451-L455 PolarHBondContact O-N 2.93Å; Q452-L455 PolarHBondContact O-N 3.16Å; L453-L455 VanDerWaalsContact C-N 3.27Å; L453-L455 PolarHBondContact O-N 3.47Å; L455-M457 PolarHBondContact O-N 2.95Å; L455-A458 WeakPolarHBondContact O-CB 3.44Å; L455-A458 PolarHBondContact O-N 3.06Å; L455-W459 HydrophobicContact CB-CH2 4.12Å; L455-W459 HydrophobicContact CB-CZ2 4.08Å; L455-W459 HydrophobicContact CB-CZ3 4.39Å; L455-W459 HydrophobicContact CD2-CZ2 4.26Å; L455-W459 VanDerWaalsContact O-CG 3.23Å; L455-W459 PolarHBondContact O-N 2.69Å
456	T	86.2	Confident	81.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-59.4	-33.4	175.4	55.7	0	0	0	0	113	L440 Q452 L453 W459 N460 R461 I464 A465 V469 F496	L440-T456 HydrophobicContact CD1-CG2 3.96Å; Q452-T456 PolarHBondContact O-N 3.45Å; Q452-T456 PolarHBondContact O-OG1 2.84Å; L453-T456 PolarHBondContact O-N 3Å; L453-T456 PolarHBondContact O-OG1 2.86Å; T456-W459 HydrophobicContact CG2-CE3 4.42Å; T456-N460 PolarHBondContact O-N 2.95Å; T456-N460 VanDerWaalsContact O-N 3.16Å; T456-R461 PolarHBondContact O-N 3.18Å; T456-I464 HydrophobicContact CG2-CB 4.35Å; T456-I464 HydrophobicContact CG2-CG2 3.98Å; T456-A465 HydrophobicContact CG2-CB 4.42Å; T456-V469 HydrophobicContact CG2-CG2 3.89Å; T456-F496 WeakPolarHBondContact O-CZ 3.19Å
457	M	84	Confident	82.8	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-70.9	-39.3	172.6	-70.1	174.8	65	0	0	113.5	M313 L453 L455 W459 N460 A484 D487 A488 F496	M313-M457 HydrophobicContact CE-CB 3.88Å; M313-M457 HydrophobicContact CE-CE 4.18Å; L453-M457 HydrophobicContact CD1-CG 4.46Å; L453-M457 HydrophobicContact CD1-SD 4.42Å; L453-M457 HydrophobicContact CG-SD 4.1Å; L453-M457 WeakPolarHBondContact O-CG 3.3Å; L453-M457 PolarHBondContact O-N 2.84Å; L455-M457 PolarHBondContact O-N 2.95Å; M457-W459 VanDerWaalsContact C-N 3.3Å; M457-N460 PolarHBondContact O-N 2.87Å; M457-A484 VanDerWaalsContact CE-O 3.28Å; M457-A484 WeakPolarHBondContact CE-O 3.4Å; M457-A484 HydrophobicContact SD-CB 3.99Å; M457-D487 HydrophobicContact CE-CB 3.69Å; M457-A488 HydrophobicContact CE-CB 3.87Å; M457-F496 HydrophobicContact CB-CE1 4.36Å; M457-F496 HydrophobicContact CB-CZ 4.36Å; M457-F496 HydrophobicContact CG-CD1 3.47Å; M457-F496 VanDerWaalsContact CG-CD1 3.47Å; M457-F496 HydrophobicContact CG-CD2 4.38Å; M457-F496 HydrophobicContact CG-CE1 3.42Å; M457-F496 VanDerWaalsContact CG-CE1 3.42Å; M457-F496 HydrophobicContact CG-CE2 4.34Å; M457-F496 HydrophobicContact CG-CG 3.97Å; M457-F496 HydrophobicContact CG-CZ 3.89Å; M457-F496 HydrophobicContact SD-CD1 4.43Å
458	A	81.5	Confident	83.4	Confident	8 Å²	8	31.2 Å²	31.2	7%	0.066	17%	0.166	C	C	.	.	H	α-helix	trans	-64.1	-38.1	175	0	0	0	0	0	111.4	M313 S454 L455 N460	M313-A458 HydrophobicContact SD-CB 3.86Å; S454-A458 WeakPolarHBondContact O-CB 3.44Å; S454-A458 PolarHBondContact O-N 3.35Å; S454-A458 VanDerWaalsContact O-N 3.15Å; L455-A458 WeakPolarHBondContact O-CB 3.44Å; L455-A458 PolarHBondContact O-N 3.06Å; A458-N460 VanDerWaalsContact C-N 3.3Å; A458-N460 PolarHBondContact O-N 3.14Å
459	W	82	Confident	83.8	Confident	1 Å²	1	28.1 Å²	28.1	0%	0.004	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-6.4	176	-59.5	-24.4	0	0	0	114.8	N169 T202 P324 L436 L439 L440 L455 T456 M457 R461	N169-W459 PolarHBondContact O-NE1 3.38Å; T202-W459 HydrophobicContact CG2-CB 3.83Å; T202-W459 HydrophobicContact CG2-CG 3.86Å; P324-W459 HydrophobicContact CG-CZ2 4Å; L436-W459 HydrophobicContact CB-CE3 4.36Å; L436-W459 HydrophobicContact CB-CZ3 4.09Å; L436-W459 HydrophobicContact CD2-CD2 3.98Å; L436-W459 HydrophobicContact CD2-CE3 3.92Å; L436-W459 HydrophobicContact CD2-CH2 4.3Å; L436-W459 HydrophobicContact CD2-CZ2 4.35Å; L436-W459 HydrophobicContact CD2-CZ3 4.09Å; L439-W459 HydrophobicContact CB-CH2 3.89Å; L439-W459 HydrophobicContact CB-CZ2 4.44Å; L439-W459 HydrophobicContact CD1-CH2 3.91Å; L439-W459 HydrophobicContact CD1-CZ2 3.79Å; L440-W459 HydrophobicContact CD1-CZ3 4.31Å; L440-W459 HydrophobicContact CD2-CH2 4.44Å; L440-W459 HydrophobicContact CD2-CZ3 4.32Å; L440-W459 HydrophobicContact CG-CH2 4.44Å; L440-W459 HydrophobicContact CG-CZ3 4.2Å; L455-W459 HydrophobicContact CB-CH2 4.12Å; L455-W459 HydrophobicContact CB-CZ2 4.08Å; L455-W459 HydrophobicContact CB-CZ3 4.39Å; L455-W459 HydrophobicContact CD2-CZ2 4.26Å; L455-W459 VanDerWaalsContact O-CG 3.23Å; L455-W459 PolarHBondContact O-N 2.69Å; T456-W459 HydrophobicContact CG2-CE3 4.42Å; M457-W459 VanDerWaalsContact C-N 3.3Å; W459-R461 VanDerWaalsContact C-N 3.31Å; W459-R461 HydrophobicContact CB-CG 4.38Å; W459-R461 PolarHBondContact O-N 3.41Å
460	N	84.4	Confident	84.1	Confident	42 Å²	42	26.4 Å²	26.4	23%	0.225	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	40.8	-172.1	-156.7	50.3	0	0	0	114.8	T456 M457 A458 P462 R493	T456-N460 PolarHBondContact O-N 2.95Å; T456-N460 VanDerWaalsContact O-N 3.16Å; M457-N460 PolarHBondContact O-N 2.87Å; A458-N460 VanDerWaalsContact C-N 3.3Å; A458-N460 PolarHBondContact O-N 3.14Å; N460-P462 VanDerWaalsContact C-CD 3.47Å; N460-P462 WeakPolarHBondContact O-CD 3.32Å; N460-R493 VanDerWaalsContact CG-CZ 3.43Å; N460-R493 VanDerWaalsContact CG-NH1 3.35Å; N460-R493 VanDerWaalsContact OD1-CD 3.28Å; N460-R493 WeakPolarHBondContact OD1-CD 3.49Å; N460-R493 PolarHBondContact OD1-NE 3.16Å; N460-R493 PolarHBondContact OD1-NH1 2.89Å
461	R	87.6	Confident	84.2	Confident	19 Å²	19	28 Å²	28	7%	0.072	15%	0.148	C	C	.	.			trans	-114.4	77.6	179.8	-70.2	-62.6	-68.7	-103.7	3.6	111.8	D432 L436 T456 W459 D463 I464 A465	D432-R461 IonicContact OD2-CZ 3.1Å; D432-R461 IonicContact OD2-NH1 3.39Å; D432-R461 PolarHBondContact OD2-NH1 3.5Å; D432-R461 IonicContact OD2-NH2 2.67Å; L436-R461 HydrophobicContact CD1-CG 4.23Å; T456-R461 PolarHBondContact O-N 3.18Å; W459-R461 VanDerWaalsContact C-N 3.31Å; W459-R461 HydrophobicContact CB-CG 4.38Å; W459-R461 PolarHBondContact O-N 3.41Å; R461-D463 WeakPolarHBondContact CA-OD1 3.4Å; R461-D463 VanDerWaalsContact CB-OD1 3.24Å; R461-D463 WeakPolarHBondContact CB-OD1 3.46Å; R461-D463 IonicContact CZ-OD1 3.37Å; R461-D463 IonicContact CZ-OD2 2.92Å; R461-D463 VanDerWaalsContact CZ-OD2 3.29Å; R461-D463 VanDerWaalsContact NE-CG 3.35Å; R461-D463 IonicContact NE-OD1 3.92Å; R461-D463 PolarHBondContact NE-OD1 3.38Å; R461-D463 IonicContact NE-OD2 3.08Å; R461-D463 PolarHBondContact NE-OD2 3.1Å; R461-D463 IonicContact NH2-OD2 3.42Å; R461-D463 PolarHBondContact NH2-OD2 3.14Å; R461-D463 PolarHBondContact O-N 2.98Å; R461-I464 HydrophobicContact CB-CB 4.15Å; R461-I464 HydrophobicContact CB-CD1 3.89Å; R461-I464 HydrophobicContact CB-CG1 4.02Å; R461-I464 HydrophobicContact CG-CD1 4.13Å; R461-I464 PolarHBondContact O-N 2.82Å; R461-A465 PolarHBondContact O-N 3.37Å; R461-A465 VanDerWaalsContact O-N 3.16Å
462	P	89.1	Confident	84	Confident	6 Å²	6	31 Å²	31	4%	0.039	16%	0.16	C	C	.	.	H	α-helix	trans	-70.2	-21.6	178.8	30	-34.3	0	0	0	112.5	N460 A465 R466 E495 F496 L499	N460-P462 VanDerWaalsContact C-CD 3.47Å; N460-P462 WeakPolarHBondContact O-CD 3.32Å; P462-A465 PolarHBondContact O-N 3.15Å; P462-R466 VanDerWaalsContact O-CB 3.23Å; P462-R466 WeakPolarHBondContact O-CB 3.44Å; P462-R466 PolarHBondContact O-N 3.5Å; P462-E495 HydrophobicContact CB-CB 4.17Å; P462-E495 HydrophobicContact CG-CB 3.91Å; P462-E495 WeakPolarHBondContact CG-OE2 3.3Å; P462-F496 HydrophobicContact CB-CD2 4.03Å; P462-F496 HydrophobicContact CB-CE1 4.3Å; P462-F496 HydrophobicContact CB-CE2 3.72Å; P462-F496 HydrophobicContact CB-CG 4.45Å; P462-F496 HydrophobicContact CB-CZ 3.87Å; P462-F496 HydrophobicContact CG-CE2 4.18Å; P462-L499 HydrophobicContact CB-CD2 4.34Å
463	D	87.1	Confident	83.4	Confident	57 Å²	57	33.3 Å²	33.3	31%	0.305	17%	0.17	S	C	.	.	H	α-helix	trans	-59.3	-48.6	168.3	62.7	-42.4	0	0	0	111.9	R461 R466 S467	R461-D463 WeakPolarHBondContact CA-OD1 3.4Å; R461-D463 VanDerWaalsContact CB-OD1 3.24Å; R461-D463 WeakPolarHBondContact CB-OD1 3.46Å; R461-D463 IonicContact CZ-OD1 3.37Å; R461-D463 IonicContact CZ-OD2 2.92Å; R461-D463 VanDerWaalsContact CZ-OD2 3.29Å; R461-D463 VanDerWaalsContact NE-CG 3.35Å; R461-D463 IonicContact NE-OD1 3.92Å; R461-D463 PolarHBondContact NE-OD1 3.38Å; R461-D463 IonicContact NE-OD2 3.08Å; R461-D463 PolarHBondContact NE-OD2 3.1Å; R461-D463 IonicContact NH2-OD2 3.42Å; R461-D463 PolarHBondContact NH2-OD2 3.14Å; R461-D463 PolarHBondContact O-N 2.98Å; D463-R466 PolarHBondContact O-N 2.77Å; D463-S467 VanDerWaalsContact O-CB 3.3Å; D463-S467 WeakPolarHBondContact O-CB 3.36Å; D463-S467 PolarHBondContact O-N 2.94Å; D463-S467 PolarHBondContact O-OG 2.73Å
464	I	85.9	Confident	82.7	Confident	2 Å²	2	40 Å²	40	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-69.4	-38.1	177	-59.7	-180	0	0	0	110.2	L436 L440 T456 R461 K468 V469	L436-I464 HydrophobicContact CB-CD1 3.72Å; L436-I464 HydrophobicContact CD1-CD1 3.58Å; L436-I464 HydrophobicContact CG-CD1 4.3Å; L440-I464 HydrophobicContact CD1-CG2 3.61Å; T456-I464 HydrophobicContact CG2-CB 4.35Å; T456-I464 HydrophobicContact CG2-CG2 3.98Å; R461-I464 HydrophobicContact CB-CB 4.15Å; R461-I464 HydrophobicContact CB-CD1 3.89Å; R461-I464 HydrophobicContact CB-CG1 4.02Å; R461-I464 HydrophobicContact CG-CD1 4.13Å; R461-I464 PolarHBondContact O-N 2.82Å; I464-K468 PolarHBondContact O-N 2.82Å; I464-V469 PolarHBondContact O-N 2.97Å
465	A	88	Confident	82.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.244	C	C	.	.	I	π-helix	trans	-60.2	-48.6	173.6	0	0	0	0	0	111.5	T456 R461 P462 V469 F470 F496 L499	T456-A465 HydrophobicContact CG2-CB 4.42Å; R461-A465 PolarHBondContact O-N 3.37Å; R461-A465 VanDerWaalsContact O-N 3.16Å; P462-A465 PolarHBondContact O-N 3.15Å; A465-V469 WeakPolarHBondContact O-CA 3.4Å; A465-V469 WeakPolarHBondContact O-CB 3.42Å; A465-V469 PolarHBondContact O-N 2.88Å; A465-F470 HydrophobicContact CB-CD2 4.41Å; A465-F470 HydrophobicContact CB-CE2 4.38Å; A465-F470 WeakPolarHBondContact O-CD2 3.33Å; A465-F470 PolarHBondContact O-N 3.01Å; A465-F496 HydrophobicContact CB-CE1 3.67Å; A465-F496 HydrophobicContact CB-CZ 4.15Å; A465-L499 HydrophobicContact CB-CD2 3.87Å
466	R	88	Confident	82.3	Confident	145 Å²	145	49.2 Å²	49.2	55%	0.547	25%	0.251	S	S	.	.	I	π-helix	trans	-63	-48.6	179.2	-170.2	-173.7	-58.2	169.9	4.4	111.8	P462 D463 L499	P462-R466 VanDerWaalsContact O-CB 3.23Å; P462-R466 WeakPolarHBondContact O-CB 3.44Å; P462-R466 PolarHBondContact O-N 3.5Å; D463-R466 PolarHBondContact O-N 2.77Å; R466-L499 HydrophobicContact CB-CD1 4.14Å; R466-L499 HydrophobicContact CB-CD2 4.32Å; R466-L499 HydrophobicContact CG-CD1 4.12Å
467	S	82.9	Confident	82.1	Confident	64 Å²	64	52 Å²	52	45%	0.448	27%	0.27	S	S	.	.	I	π-helix	trans	-83.6	-30.2	-170.5	60.4	0	0	0	0	115.4	D463 A471	D463-S467 VanDerWaalsContact O-CB 3.3Å; D463-S467 WeakPolarHBondContact O-CB 3.36Å; D463-S467 PolarHBondContact O-N 2.94Å; D463-S467 PolarHBondContact O-OG 2.73Å; S467-A471 VanDerWaalsContact O-CB 3.27Å; S467-A471 WeakPolarHBondContact O-CB 3.19Å
468	K	80.8	Confident	81.9	Confident	72 Å²	72	58.7 Å²	58.7	31%	0.313	30%	0.299	S	S	.	.	I	π-helix	trans	-123.5	-26.1	-174.8	-53.1	-63	-179.3	-173.9	0	114.4	D427 T437 I464 K472	D427-K468 IonicContact OD2-NZ 2.67Å; D427-K468 PolarHBondContact OD2-NZ 3.02Å; T437-K468 HydrophobicContact CG2-CG 3.97Å; I464-K468 PolarHBondContact O-N 2.82Å; K468-K472 WeakPolarHBondContact O-CB 3.27Å
469	V	82.9	Confident	82	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.321	C	S	.	.	I	π-helix	trans	-89.7	-58.2	178.3	-178.2	0	0	0	0	111.4	L440 Q452 L453 T456 I464 A465 A471 K472 F473 W476	L440-V469 HydrophobicContact CD1-CG2 4.21Å; Q452-V469 HydrophobicContact CB-CG1 4.37Å; Q452-V469 HydrophobicContact CB-CG2 4.4Å; L453-V469 HydrophobicContact CB-CG1 4.37Å; T456-V469 HydrophobicContact CG2-CG2 3.89Å; I464-V469 PolarHBondContact O-N 2.97Å; A465-V469 WeakPolarHBondContact O-CA 3.4Å; A465-V469 WeakPolarHBondContact O-CB 3.42Å; A465-V469 PolarHBondContact O-N 2.88Å; V469-A471 VanDerWaalsContact C-N 3.35Å; V469-A471 PolarHBondContact O-N 3.41Å; V469-K472 PolarHBondContact O-N 2.97Å; V469-F473 PolarHBondContact O-N 3.1Å; V469-W476 HydrophobicContact CG1-CH2 3.64Å; V469-W476 HydrophobicContact CG1-CZ2 3.84Å
470	F	85.2	Confident	82.1	Confident	8 Å²	8	63.9 Å²	63.9	4%	0.035	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-24.6	179.4	-73.6	-68.8	0	0	0	113.7	L453 A465 K472 W476 L481 L499 L500 K503	L453-F470 HydrophobicContact CD1-CE2 3.78Å; L453-F470 HydrophobicContact CD1-CZ 3.79Å; L453-F470 HydrophobicContact CD2-CZ 4.18Å; A465-F470 HydrophobicContact CB-CD2 4.41Å; A465-F470 HydrophobicContact CB-CE2 4.38Å; A465-F470 WeakPolarHBondContact O-CD2 3.33Å; A465-F470 PolarHBondContact O-N 3.01Å; F470-K472 VanDerWaalsContact C-N 3.31Å; F470-W476 AromaticContact CD1-CE2 3.85Å; F470-W476 AromaticContact CD1-CZ2 3.96Å; F470-W476 HydrophobicContact CD1-CZ2 3.96Å; F470-W476 AromaticContact CD1-NE1 3.68Å; F470-W476 HydrophobicContact CE1-CD2 4.36Å; F470-W476 AromaticContact CE1-CE2 3.86Å; F470-W476 HydrophobicContact CE1-CZ2 4.03Å; F470-W476 AromaticContact CE1-NE1 4Å; F470-L481 HydrophobicContact CE1-CD2 4.28Å; F470-L499 HydrophobicContact CD2-CD1 4.22Å; F470-L499 HydrophobicContact CD2-CD2 3.91Å; F470-L499 HydrophobicContact CD2-CG 4.02Å; F470-L499 HydrophobicContact CE2-CD1 4.42Å; F470-L499 HydrophobicContact CE2-CD2 3.69Å; F470-L499 HydrophobicContact CE2-CG 3.75Å; F470-L500 HydrophobicContact CZ-CD2 4.06Å; F470-K503 HydrophobicContact CB-CD 4.37Å; F470-K503 HydrophobicContact CD1-CB 4.42Å; F470-K503 HydrophobicContact CD1-CD 4.21Å; F470-K503 HydrophobicContact CD1-CG 3.91Å; F470-K503 HydrophobicContact CE1-CB 4.28Å; F470-K503 HydrophobicContact CE1-CG 4.11Å; F470-K503 HydrophobicContact CG-CD 4.32Å; F470-K503 HydrophobicContact CG-CG 4.15Å
471	A	80.6	Confident	82.2	Confident	69 Å²	69	62.8 Å²	62.8	57%	0.57	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-22.4	173.6	0	0	0	0	0	113.4	S467 V469	S467-A471 VanDerWaalsContact O-CB 3.27Å; S467-A471 WeakPolarHBondContact O-CB 3.19Å; V469-A471 VanDerWaalsContact C-N 3.35Å; V469-A471 PolarHBondContact O-N 3.41Å
472	K	73.6	Confident	82.2	Confident	126 Å²	126	64 Å²	64	55%	0.548	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-23	-177	-173.8	172.8	179.9	177.9	0	113.5	K468 V469 F470	K468-K472 WeakPolarHBondContact O-CB 3.27Å; V469-K472 PolarHBondContact O-N 2.97Å; F470-K472 VanDerWaalsContact C-N 3.31Å
473	F	71.7	Confident	82.1	Confident	62 Å²	62	66.4 Å²	66.4	27%	0.272	34%	0.343	S	S	.	.			trans	-132.8	110.3	-175.3	-60.1	-74.7	0	0	0	111.1	P449 V469 W476	P449-F473 HydrophobicContact CB-CD2 4.08Å; P449-F473 HydrophobicContact CB-CE2 4.25Å; P449-F473 HydrophobicContact CB-CG 4.33Å; P449-F473 HydrophobicContact CG-CD1 4.04Å; P449-F473 HydrophobicContact CG-CD2 4.1Å; P449-F473 HydrophobicContact CG-CE1 3.93Å; P449-F473 HydrophobicContact CG-CE2 3.99Å; P449-F473 HydrophobicContact CG-CG 4.12Å; P449-F473 HydrophobicContact CG-CZ 3.91Å; V469-F473 PolarHBondContact O-N 3.1Å; F473-W476 HydrophobicContact CB-CZ2 4.03Å; F473-W476 HydrophobicContact CD2-CZ2 4.48Å; F473-W476 PolarHBondContact O-NE1 3.43Å
474	N	72.2	Confident	82.1	Confident	144 Å²	144	64 Å²	64	77%	0.77	33%	0.332	S	S	*	.	S	Bend	trans	-83.6	-30.5	175.2	-66.7	-2.5	0	0	0	112.4
475	N	76.4	Confident	82.3	Confident	161 Å²	161	64 Å²	64	86%	0.861	33%	0.332	S	S	*	.			trans	-100.2	103.7	-175.6	-72.6	-21.2	0	0	0	111.6
476	W	78.7	Confident	82.3	Confident	47 Å²	47	64 Å²	64	18%	0.178	33%	0.332	C	S	.	.			trans	-103.5	146.4	177.8	-71.2	81.3	0	0	0	112.6	P449 L453 V469 F470 F473 T480 L481	P449-W476 HydrophobicContact CB-CE3 4.34Å; P449-W476 HydrophobicContact CB-CH2 3.58Å; P449-W476 HydrophobicContact CB-CZ2 4.24Å; P449-W476 HydrophobicContact CB-CZ3 3.66Å; P449-W476 WeakPolarHBondContact O-CH2 3.37Å; P449-W476 WeakPolarHBondContact O-CZ3 3.28Å; L453-W476 HydrophobicContact CB-CH2 4.11Å; L453-W476 HydrophobicContact CB-CZ3 4.15Å; L453-W476 HydrophobicContact CD2-CH2 4.32Å; L453-W476 HydrophobicContact CD2-CZ3 3.9Å; V469-W476 HydrophobicContact CG1-CH2 3.64Å; V469-W476 HydrophobicContact CG1-CZ2 3.84Å; F470-W476 AromaticContact CD1-CE2 3.85Å; F470-W476 AromaticContact CD1-CZ2 3.96Å; F470-W476 HydrophobicContact CD1-CZ2 3.96Å; F470-W476 AromaticContact CD1-NE1 3.68Å; F470-W476 HydrophobicContact CE1-CD2 4.36Å; F470-W476 AromaticContact CE1-CE2 3.86Å; F470-W476 HydrophobicContact CE1-CZ2 4.03Å; F470-W476 AromaticContact CE1-NE1 4Å; F473-W476 HydrophobicContact CB-CZ2 4.03Å; F473-W476 HydrophobicContact CD2-CZ2 4.48Å; F473-W476 PolarHBondContact O-NE1 3.43Å; W476-T480 HydrophobicContact CE3-CG2 3.96Å; W476-T480 HydrophobicContact CZ3-CG2 4.08Å; W476-L481 HydrophobicContact CB-CD1 3.71Å; W476-L481 HydrophobicContact CB-CD2 4.13Å; W476-L481 HydrophobicContact CB-CG 3.88Å; W476-L481 HydrophobicContact CD2-CD2 3.97Å; W476-L481 HydrophobicContact CE3-CD2 3.82Å; W476-L481 HydrophobicContact CG-CD1 4.3Å; W476-L481 HydrophobicContact CG-CD2 4.09Å; W476-L481 HydrophobicContact CG-CG 4.38Å
477	S	80.9	Confident	82.1	Confident	58 Å²	58	57.6 Å²	57.6	41%	0.406	31%	0.308	S	S	.	.			trans	-74.8	134.7	169.7	112.6	0	0	0	0	109.7	T479 T480 L481	S477-T479 VanDerWaalsContact C-N 3.32Å; S477-T479 PolarHBondContact O-N 3.19Å; S477-T479 PolarHBondContact OG-OG1 3.32Å; S477-T480 VanDerWaalsContact O-CB 3.31Å; S477-T480 WeakPolarHBondContact O-CB 3.36Å; S477-T480 PolarHBondContact O-N 3.25Å; S477-T480 WeakPolarHBondContact OG-CB 3.47Å; S477-T480 PolarHBondContact OG-N 2.93Å; S477-T480 PolarHBondContact OG-OG1 2.74Å; S477-L481 PolarHBondContact O-N 2.79Å
478	K	80.7	Confident	82.4	Confident	141 Å²	141	54.5 Å²	54.5	61%	0.613	29%	0.287	S	S	*	.	H	α-helix	trans	-60	-43.6	-177.6	-68.8	178.6	178.9	173.4	0	111.5	T480 L481 E482	K478-T480 VanDerWaalsContact C-N 3.28Å; K478-T480 PolarHBondContact O-N 3.11Å; K478-L481 PolarHBondContact O-N 3.4Å; K478-L481 VanDerWaalsContact O-N 3.16Å; K478-E482 WeakPolarHBondContact O-CB 3.17Å; K478-E482 WeakPolarHBondContact O-CG 3.43Å; K478-E482 PolarHBondContact O-N 2.95Å
479	T	82.7	Confident	82.8	Confident	87 Å²	87	51.1 Å²	51.1	53%	0.534	27%	0.272	S	S	.	.	H	α-helix	trans	-65.2	-27.4	176.1	49.4	0	0	0	0	113.3	S477 N483	S477-T479 VanDerWaalsContact C-N 3.32Å; S477-T479 PolarHBondContact O-N 3.19Å; S477-T479 PolarHBondContact OG-OG1 3.32Å; T479-N483 WeakPolarHBondContact O-CB 3.5Å; T479-N483 PolarHBondContact O-N 2.85Å; T479-N483 PolarHBondContact O-ND2 3.4Å
480	T	84.2	Confident	82.9	Confident	31 Å²	31	51.5 Å²	51.5	19%	0.19	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-48.9	170.9	-61.5	0	0	0	0	111	A450 W476 S477 K478 N483 A484	A450-T480 HydrophobicContact CB-CG2 3.47Å; A450-T480 VanDerWaalsContact CB-CG2 3.47Å; W476-T480 HydrophobicContact CE3-CG2 3.96Å; W476-T480 HydrophobicContact CZ3-CG2 4.08Å; S477-T480 VanDerWaalsContact O-CB 3.31Å; S477-T480 WeakPolarHBondContact O-CB 3.36Å; S477-T480 PolarHBondContact O-N 3.25Å; S477-T480 WeakPolarHBondContact OG-CB 3.47Å; S477-T480 PolarHBondContact OG-N 2.93Å; S477-T480 PolarHBondContact OG-OG1 2.74Å; K478-T480 VanDerWaalsContact C-N 3.28Å; K478-T480 PolarHBondContact O-N 3.11Å; T480-N483 PolarHBondContact O-N 3.05Å; T480-A484 WeakPolarHBondContact O-CB 3.36Å; T480-A484 PolarHBondContact O-N 2.95Å
481	L	87.1	Confident	82.7	Confident	19 Å²	19	51.7 Å²	51.7	10%	0.099	28%	0.276	C	S	.	.	H	α-helix	trans	-70.4	-37.1	179.3	-59.7	178.9	0	0	0	111.8	L453 F470 W476 S477 K478 N483 A484 M485 L500 L505	L453-L481 HydrophobicContact CD2-CD2 4.26Å; F470-L481 HydrophobicContact CE1-CD2 4.28Å; W476-L481 HydrophobicContact CB-CD1 3.71Å; W476-L481 HydrophobicContact CB-CD2 4.13Å; W476-L481 HydrophobicContact CB-CG 3.88Å; W476-L481 HydrophobicContact CD2-CD2 3.97Å; W476-L481 HydrophobicContact CE3-CD2 3.82Å; W476-L481 HydrophobicContact CG-CD1 4.3Å; W476-L481 HydrophobicContact CG-CD2 4.09Å; W476-L481 HydrophobicContact CG-CG 4.38Å; S477-L481 PolarHBondContact O-N 2.79Å; K478-L481 PolarHBondContact O-N 3.4Å; K478-L481 VanDerWaalsContact O-N 3.16Å; L481-N483 VanDerWaalsContact C-N 3.28Å; L481-N483 PolarHBondContact O-N 3.4Å; L481-A484 PolarHBondContact O-N 2.78Å; L481-M485 VanDerWaalsContact O-CB 3.27Å; L481-M485 WeakPolarHBondContact O-CB 3.38Å; L481-M485 PolarHBondContact O-N 2.85Å; L481-L500 HydrophobicContact CD2-CD2 3.8Å; L481-L505 HydrophobicContact CB-CD1 3.8Å; L481-L505 WeakPolarHBondContact O-CD1 3.36Å
482	E	87.2	Confident	82.9	Confident	45 Å²	45	51.9 Å²	51.9	21%	0.21	27%	0.267	C	S	.	.	H	α-helix	trans	-66.8	-25.6	175.1	-70.9	159	-178.4	0	0	112.8	K478 F510 R515	K478-E482 WeakPolarHBondContact O-CB 3.17Å; K478-E482 WeakPolarHBondContact O-CG 3.43Å; K478-E482 PolarHBondContact O-N 2.95Å; E482-F510 HydrophobicContact CB-CD2 4.17Å; E482-F510 HydrophobicContact CG-CB 4.4Å; E482-F510 HydrophobicContact CG-CD2 4.43Å; E482-F510 WeakPolarHBondContact O-CD2 3.45Å; E482-F510 WeakPolarHBondContact O-CE2 3.43Å; E482-R515 PolarHBondContact O-NH2 2.97Å
483	N	86.6	Confident	83.6	Confident	56 Å²	56	48 Å²	48	30%	0.299	25%	0.249	S	C	.	.	H	α-helix	trans	-80.2	-47.3	169.4	-71.9	-16	0	0	0	111.1	Y316 T479 T480 L481 M485 A486 D487	Y316-N483 WeakPolarHBondContact CD1-OD1 3.39Å; T479-N483 WeakPolarHBondContact O-CB 3.5Å; T479-N483 PolarHBondContact O-N 2.85Å; T479-N483 PolarHBondContact O-ND2 3.4Å; T480-N483 PolarHBondContact O-N 3.05Å; L481-N483 VanDerWaalsContact C-N 3.28Å; L481-N483 PolarHBondContact O-N 3.4Å; N483-M485 PolarHBondContact O-N 3.45Å; N483-A486 PolarHBondContact O-N 3.36Å; N483-A486 VanDerWaalsContact O-N 3.11Å; N483-D487 PolarHBondContact O-N 2.68Å
484	A	87.7	Confident	84.5	Confident	8 Å²	8	47.1 Å²	47.1	7%	0.066	25%	0.247	C	C	.	.	H	α-helix	trans	-57.9	-34.4	175.6	0	0	0	0	0	112.5	L453 M457 T480 L481 D487 A488 L500	L453-A484 HydrophobicContact CD2-CB 3.7Å; L453-A484 HydrophobicContact CG-CB 4.4Å; M457-A484 VanDerWaalsContact CE-O 3.28Å; M457-A484 WeakPolarHBondContact CE-O 3.4Å; M457-A484 HydrophobicContact SD-CB 3.99Å; T480-A484 WeakPolarHBondContact O-CB 3.36Å; T480-A484 PolarHBondContact O-N 2.95Å; L481-A484 PolarHBondContact O-N 2.78Å; A484-D487 PolarHBondContact O-N 3.08Å; A484-A488 VanDerWaalsContact O-CB 3.3Å; A484-A488 WeakPolarHBondContact O-CB 3.25Å; A484-A488 PolarHBondContact O-N 3.06Å; A484-L500 HydrophobicContact CB-CD1 4.11Å; A484-L500 HydrophobicContact CB-CD2 4.29Å
485	M	90.1	Very high	85.4	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-65.4	-42.8	175.5	-175.4	63.2	176.5	0	0	112.1	L481 N483 A488 L489 V497 L500 L501 L505 I507 F510	L481-M485 VanDerWaalsContact O-CB 3.27Å; L481-M485 WeakPolarHBondContact O-CB 3.38Å; L481-M485 PolarHBondContact O-N 2.85Å; N483-M485 PolarHBondContact O-N 3.45Å; M485-A488 PolarHBondContact O-N 2.7Å; M485-L489 HydrophobicContact CE-CD1 4.07Å; M485-L489 HydrophobicContact CE-CD2 4.43Å; M485-L489 HydrophobicContact CE-CG 4.33Å; M485-L489 HydrophobicContact CG-CD1 4.22Å; M485-L489 WeakPolarHBondContact O-CB 3.38Å; M485-L489 VanDerWaalsContact O-CG 3.24Å; M485-L489 WeakPolarHBondContact O-CG 3.38Å; M485-L489 PolarHBondContact O-N 3Å; M485-V497 HydrophobicContact CE-CG1 3.88Å; M485-V497 HydrophobicContact SD-CG1 4.38Å; M485-V497 HydrophobicContact SD-CG2 4.39Å; M485-L500 HydrophobicContact CB-CD1 4.27Å; M485-L500 HydrophobicContact SD-CB 4.38Å; M485-L500 HydrophobicContact SD-CD1 4.3Å; M485-L501 HydrophobicContact CE-CD2 4.44Å; M485-L505 HydrophobicContact CB-CD1 3.76Å; M485-L505 HydrophobicContact CB-CD2 4.3Å; M485-L505 HydrophobicContact CE-CD2 4.24Å; M485-L505 HydrophobicContact CG-CD1 4.2Å; M485-L505 HydrophobicContact CG-CD2 3.8Å; M485-L505 HydrophobicContact SD-CD2 4.04Å; M485-I507 HydrophobicContact CE-CD1 3.63Å; M485-F510 HydrophobicContact CB-CD2 3.99Å; M485-F510 HydrophobicContact CB-CE2 3.78Å; M485-F510 HydrophobicContact CB-CZ 4.19Å; M485-F510 HydrophobicContact CG-CD1 4.04Å; M485-F510 HydrophobicContact CG-CD2 3.97Å; M485-F510 HydrophobicContact CG-CE1 3.87Å; M485-F510 HydrophobicContact CG-CE2 3.77Å; M485-F510 HydrophobicContact CG-CG 4.1Å; M485-F510 HydrophobicContact CG-CZ 3.73Å
486	A	87.6	Confident	86.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69.1	-37	174.2	0	0	0	0	0	112.1	N483 A488 L489 L490 F510 R515	N483-A486 PolarHBondContact O-N 3.36Å; N483-A486 VanDerWaalsContact O-N 3.11Å; A486-A488 VanDerWaalsContact C-N 3.31Å; A486-A488 PolarHBondContact O-N 2.93Å; A486-L489 PolarHBondContact O-N 3.06Å; A486-L490 VanDerWaalsContact O-CB 3.26Å; A486-L490 WeakPolarHBondContact O-CB 3.03Å; A486-L490 VanDerWaalsContact O-CG 3.23Å; A486-L490 WeakPolarHBondContact O-CG 3.28Å; A486-L490 PolarHBondContact O-N 3.16Å; A486-F510 HydrophobicContact CB-CE2 4.03Å; A486-F510 HydrophobicContact CB-CZ 4.17Å; A486-R515 VanDerWaalsContact CB-CZ 3.48Å; A486-R515 VanDerWaalsContact CB-NH2 3.27Å
487	D	84.9	Confident	86.8	Confident	10 Å²	10	35.4 Å²	35.4	5%	0.053	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-34.1	175.2	-71.7	6.9	0	0	0	111.5	M313 R315 Y316 M457 N483 A484 N491	M313-D487 HydrophobicContact CE-CB 4.29Å; R315-D487 WeakPolarHBondContact CA-OD1 3.44Å; Y316-D487 PolarHBondContact N-OD1 3.4Å; M457-D487 HydrophobicContact CE-CB 3.69Å; N483-D487 PolarHBondContact O-N 2.68Å; A484-D487 PolarHBondContact O-N 3.08Å; D487-N491 WeakPolarHBondContact O-CB 3.28Å; D487-N491 PolarHBondContact O-N 2.93Å; D487-N491 PolarHBondContact O-ND2 2.91Å
488	A	89.1	Confident	87.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-70.5	-45.5	174.2	0	0	0	0	0	111.8	M457 A484 M485 A486 D492 R493 F496 V497 L500	M457-A488 HydrophobicContact CE-CB 3.87Å; A484-A488 VanDerWaalsContact O-CB 3.3Å; A484-A488 WeakPolarHBondContact O-CB 3.25Å; A484-A488 PolarHBondContact O-N 3.06Å; M485-A488 PolarHBondContact O-N 2.7Å; A486-A488 VanDerWaalsContact C-N 3.31Å; A486-A488 PolarHBondContact O-N 2.93Å; A488-D492 PolarHBondContact O-N 3.13Å; A488-R493 HydrophobicContact CB-CB 4.39Å; A488-R493 PolarHBondContact O-N 3.24Å; A488-F496 HydrophobicContact CB-CB 4.01Å; A488-V497 HydrophobicContact CB-CG2 3.93Å; A488-L500 HydrophobicContact CB-CD1 4.24Å
489	L	88.7	Confident	87.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-52.8	177.3	-70.3	169.3	0	0	0	111.6	M485 A486 N491 D492 V497 F510 L683 W686 R692 M695	M485-L489 HydrophobicContact CE-CD1 4.07Å; M485-L489 HydrophobicContact CE-CD2 4.43Å; M485-L489 HydrophobicContact CE-CG 4.33Å; M485-L489 HydrophobicContact CG-CD1 4.22Å; M485-L489 WeakPolarHBondContact O-CB 3.38Å; M485-L489 VanDerWaalsContact O-CG 3.24Å; M485-L489 WeakPolarHBondContact O-CG 3.38Å; M485-L489 PolarHBondContact O-N 3Å; A486-L489 PolarHBondContact O-N 3.06Å; L489-N491 VanDerWaalsContact C-N 3.32Å; L489-N491 PolarHBondContact O-N 3.2Å; L489-D492 PolarHBondContact O-N 3.13Å; L489-D492 VanDerWaalsContact O-N 3.15Å; L489-V497 HydrophobicContact CD2-CG2 3.83Å; L489-V497 HydrophobicContact CG-CG2 4.21Å; L489-F510 HydrophobicContact CD1-CE1 3.65Å; L489-F510 HydrophobicContact CD1-CZ 3.7Å; L489-L683 HydrophobicContact CD1-CD1 4.07Å; L489-L683 HydrophobicContact CD1-CD2 4.41Å; L489-L683 HydrophobicContact CD2-CD1 4.29Å; L489-L683 HydrophobicContact CD2-CD2 4.08Å; L489-W686 HydrophobicContact CB-CH2 4.03Å; L489-W686 HydrophobicContact CB-CZ3 4.23Å; L489-W686 HydrophobicContact CD2-CZ3 4.16Å; L489-R692 PolarHBondContact O-NH1 3.22Å; L489-M695 HydrophobicContact CD2-CE 4.23Å; L489-M695 HydrophobicContact CD2-SD 3.51Å; L489-M695 VanDerWaalsContact CD2-SD 3.51Å
490	L	84.7	Confident	88.1	Confident	8 Å²	8	25.7 Å²	25.7	4%	0.042	13%	0.128	C	C	.	.	H	α-helix	trans	-59.1	-41	-177	-74.1	171.6	0	0	0	112.8	A486 L519 V522 R692	A486-L490 VanDerWaalsContact O-CB 3.26Å; A486-L490 WeakPolarHBondContact O-CB 3.03Å; A486-L490 VanDerWaalsContact O-CG 3.23Å; A486-L490 WeakPolarHBondContact O-CG 3.28Å; A486-L490 PolarHBondContact O-N 3.16Å; L490-L519 HydrophobicContact CD2-CD2 3.77Å; L490-L519 HydrophobicContact CG-CD2 3.97Å; L490-V522 HydrophobicContact CD1-CG1 4.1Å; L490-V522 HydrophobicContact CD2-CB 3.93Å; L490-V522 HydrophobicContact CD2-CG1 3.66Å; L490-R692 PolarHBondContact O-NH1 2.89Å; L490-R692 PolarHBondContact O-NH2 3.12Å
491	N	81.1	Confident	88.3	Confident	13 Å²	13	25.6 Å²	25.6	7%	0.07	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	16.6	-178.9	-56	-79.2	0	0	0	113.4	R314 D487 L489 R493 I1984	R314-N491 PolarHBondContact O-ND2 2.69Å; D487-N491 WeakPolarHBondContact O-CB 3.28Å; D487-N491 PolarHBondContact O-N 2.93Å; D487-N491 PolarHBondContact O-ND2 2.91Å; L489-N491 VanDerWaalsContact C-N 3.32Å; L489-N491 PolarHBondContact O-N 3.2Å; N491-R493 HydrophobicContact CB-CG 4.39Å; N491-R493 WeakPolarHBondContact O-CD 3.18Å; N491-R493 WeakPolarHBondContact O-CG 3.46Å; N491-R493 PolarHBondContact O-N 3.1Å; N491-I1984 HydrophobicContact CB-CD1 4.39Å; N491-I1984 VanDerWaalsContact O-CD1 3.31Å; N491-I1984 WeakPolarHBondContact O-CD1 3.47Å
492	D	85.4	Confident	88.2	Confident	72 Å²	72	30 Å²	30	39%	0.385	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	48	171.4	-132.3	39.6	0	0	0	115.7	A488 L489 R692 M695	A488-D492 PolarHBondContact O-N 3.13Å; L489-D492 PolarHBondContact O-N 3.13Å; L489-D492 VanDerWaalsContact O-N 3.15Å; D492-R692 VanDerWaalsContact CG-NH1 3.33Å; D492-R692 WeakPolarHBondContact OD1-CD 3.22Å; D492-R692 VanDerWaalsContact OD1-CG 3.25Å; D492-R692 WeakPolarHBondContact OD1-CG 3.44Å; D492-R692 IonicContact OD1-CZ 2.76Å; D492-R692 IonicContact OD1-NE 2.96Å; D492-R692 IonicContact OD1-NH1 3.63Å; D492-R692 PolarHBondContact OD1-NH1 3.09Å; D492-M695 WeakPolarHBondContact OD1-CE 3.36Å
493	R	88.8	Confident	88.1	Confident	46 Å²	46	32.8 Å²	32.8	17%	0.174	17%	0.166	C	C	.	.			trans	-105.7	74.9	-175.8	-56.2	-50.6	-155.1	-178.7	4.2	112.2	N460 A488 N491 E495 F496 V497	N460-R493 VanDerWaalsContact CG-CZ 3.43Å; N460-R493 VanDerWaalsContact CG-NH1 3.35Å; N460-R493 VanDerWaalsContact OD1-CD 3.28Å; N460-R493 WeakPolarHBondContact OD1-CD 3.49Å; N460-R493 PolarHBondContact OD1-NE 3.16Å; N460-R493 PolarHBondContact OD1-NH1 2.89Å; A488-R493 HydrophobicContact CB-CB 4.39Å; A488-R493 PolarHBondContact O-N 3.24Å; N491-R493 HydrophobicContact CB-CG 4.39Å; N491-R493 WeakPolarHBondContact O-CD 3.18Å; N491-R493 WeakPolarHBondContact O-CG 3.46Å; N491-R493 PolarHBondContact O-N 3.1Å; R493-E495 PolarHBondContact O-N 3.48Å; R493-F496 HydrophobicContact CB-CB 4Å; R493-F496 HydrophobicContact CB-CD2 4.12Å; R493-F496 HydrophobicContact CB-CG 4.5Å; R493-F496 PolarHBondContact O-N 2.73Å; R493-V497 PolarHBondContact O-N 2.84Å
494	L	90.4	Very high	87.6	Confident	43 Å²	43	33 Å²	33	23%	0.225	18%	0.181	C	C	.	.	H	α-helix	trans	-52.9	-46.8	-176.3	179.7	57.9	0	0	0	113.7	F496 V497 Q498 D694 M695 F698	L494-F496 VanDerWaalsContact C-N 3.27Å; L494-F496 PolarHBondContact O-N 2.82Å; L494-V497 WeakPolarHBondContact O-CA 3.19Å; L494-V497 WeakPolarHBondContact O-CB 3.16Å; L494-V497 PolarHBondContact O-N 3.15Å; L494-Q498 HydrophobicContact CD1-CG 4.41Å; L494-Q498 PolarHBondContact O-N 3.2Å; L494-D694 HydrophobicContact CD2-CB 4.38Å; L494-M695 HydrophobicContact CD1-CG 4.22Å; L494-F698 HydrophobicContact CD1-CB 3.87Å; L494-F698 HydrophobicContact CD1-CD1 3.77Å; L494-F698 HydrophobicContact CD1-CG 3.89Å
495	E	90.8	Very high	87.4	Confident	104 Å²	104	33.3 Å²	33.3	49%	0.486	18%	0.181	S	C	.	.	H	α-helix	trans	-61.2	-33.8	177.7	-74	-171.4	-117	0	0	113.2	P462 R493 L499	P462-E495 HydrophobicContact CB-CB 4.17Å; P462-E495 HydrophobicContact CG-CB 3.91Å; P462-E495 WeakPolarHBondContact CG-OE2 3.3Å; R493-E495 PolarHBondContact O-N 3.48Å; E495-L499 WeakPolarHBondContact O-CB 3.25Å; E495-L499 PolarHBondContact O-N 2.89Å
496	F	92.4	Very high	87.1	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	22%	0.217	C	C	.	.	H	α-helix	trans	-73.4	-33	174.1	-83.7	-82.8	0	0	0	112	L453 T456 M457 P462 A465 A488 R493 L494 L499 L500	L453-F496 HydrophobicContact CD1-CE1 4.38Å; T456-F496 WeakPolarHBondContact O-CZ 3.19Å; M457-F496 HydrophobicContact CB-CE1 4.36Å; M457-F496 HydrophobicContact CB-CZ 4.36Å; M457-F496 HydrophobicContact CG-CD1 3.47Å; M457-F496 VanDerWaalsContact CG-CD1 3.47Å; M457-F496 HydrophobicContact CG-CD2 4.38Å; M457-F496 HydrophobicContact CG-CE1 3.42Å; M457-F496 VanDerWaalsContact CG-CE1 3.42Å; M457-F496 HydrophobicContact CG-CE2 4.34Å; M457-F496 HydrophobicContact CG-CG 3.97Å; M457-F496 HydrophobicContact CG-CZ 3.89Å; M457-F496 HydrophobicContact SD-CD1 4.43Å; P462-F496 HydrophobicContact CB-CD2 4.03Å; P462-F496 HydrophobicContact CB-CE1 4.3Å; P462-F496 HydrophobicContact CB-CE2 3.72Å; P462-F496 HydrophobicContact CB-CG 4.45Å; P462-F496 HydrophobicContact CB-CZ 3.87Å; P462-F496 HydrophobicContact CG-CE2 4.18Å; A465-F496 HydrophobicContact CB-CE1 3.67Å; A465-F496 HydrophobicContact CB-CZ 4.15Å; A488-F496 HydrophobicContact CB-CB 4.01Å; R493-F496 HydrophobicContact CB-CB 4Å; R493-F496 HydrophobicContact CB-CD2 4.12Å; R493-F496 HydrophobicContact CB-CG 4.5Å; R493-F496 PolarHBondContact O-N 2.73Å; L494-F496 VanDerWaalsContact C-N 3.27Å; L494-F496 PolarHBondContact O-N 2.82Å; F496-L499 HydrophobicContact CD1-CD2 4.49Å; F496-L499 PolarHBondContact O-N 3.31Å; F496-L500 WeakPolarHBondContact O-CB 3.41Å; F496-L500 WeakPolarHBondContact O-CD1 3.37Å; F496-L500 WeakPolarHBondContact O-CG 3.39Å; F496-L500 PolarHBondContact O-N 2.9Å
497	V	91.6	Very high	87.1	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-48.9	170.8	170	0	0	0	0	110.4	M485 A488 L489 R493 L494 L499 L500 L501 F698	M485-V497 HydrophobicContact CE-CG1 3.88Å; M485-V497 HydrophobicContact SD-CG1 4.38Å; M485-V497 HydrophobicContact SD-CG2 4.39Å; A488-V497 HydrophobicContact CB-CG2 3.93Å; L489-V497 HydrophobicContact CD2-CG2 3.83Å; L489-V497 HydrophobicContact CG-CG2 4.21Å; R493-V497 PolarHBondContact O-N 2.84Å; L494-V497 WeakPolarHBondContact O-CA 3.19Å; L494-V497 WeakPolarHBondContact O-CB 3.16Å; L494-V497 PolarHBondContact O-N 3.15Å; V497-L499 PolarHBondContact O-N 2.78Å; V497-L500 PolarHBondContact O-N 2.79Å; V497-L501 HydrophobicContact CG1-CD1 3.92Å; V497-L501 WeakPolarHBondContact O-CG 3.48Å; V497-L501 PolarHBondContact O-N 2.74Å; V497-F698 HydrophobicContact CG1-CE1 4.34Å
498	Q	91.2	Very high	87	Confident	74 Å²	74	48 Å²	48	35%	0.346	24%	0.241	S	C	.	.	H	α-helix	trans	-60.5	-43.2	175.4	-69.4	175.7	-8.7	0	0	112.1	L494 L500 L501 T502 F698	L494-Q498 HydrophobicContact CD1-CG 4.41Å; L494-Q498 PolarHBondContact O-N 3.2Å; Q498-L500 PolarHBondContact O-N 3.04Å; Q498-L501 PolarHBondContact O-N 3.26Å; Q498-T502 WeakPolarHBondContact O-CB 3.4Å; Q498-T502 WeakPolarHBondContact O-CG2 3.27Å; Q498-T502 PolarHBondContact O-N 3.16Å; Q498-T502 PolarHBondContact O-OG1 2.96Å; Q498-F698 HydrophobicContact CG-CD2 4.25Å; Q498-F698 HydrophobicContact CG-CE1 4.14Å; Q498-F698 HydrophobicContact CG-CE2 3.77Å; Q498-F698 HydrophobicContact CG-CZ 3.72Å
499	L	89.8	Confident	86.7	Confident	6 Å²	6	54.8 Å²	54.8	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-34.2	177.1	-175.7	58.8	0	0	0	112.7	P462 A465 R466 F470 E495 F496 V497 T502 K503	P462-L499 HydrophobicContact CB-CD2 4.34Å; A465-L499 HydrophobicContact CB-CD2 3.87Å; R466-L499 HydrophobicContact CB-CD1 4.14Å; R466-L499 HydrophobicContact CB-CD2 4.32Å; R466-L499 HydrophobicContact CG-CD1 4.12Å; F470-L499 HydrophobicContact CD2-CD1 4.22Å; F470-L499 HydrophobicContact CD2-CD2 3.91Å; F470-L499 HydrophobicContact CD2-CG 4.02Å; F470-L499 HydrophobicContact CE2-CD1 4.42Å; F470-L499 HydrophobicContact CE2-CD2 3.69Å; F470-L499 HydrophobicContact CE2-CG 3.75Å; E495-L499 WeakPolarHBondContact O-CB 3.25Å; E495-L499 PolarHBondContact O-N 2.89Å; F496-L499 HydrophobicContact CD1-CD2 4.49Å; F496-L499 PolarHBondContact O-N 3.31Å; V497-L499 PolarHBondContact O-N 2.78Å; L499-T502 WeakPolarHBondContact CA-OG1 3.45Å; L499-T502 PolarHBondContact O-OG1 2.79Å; L499-K503 HydrophobicContact CD1-CG 4.39Å; L499-K503 WeakPolarHBondContact O-CB 3.24Å; L499-K503 WeakPolarHBondContact O-CG 3.38Å; L499-K503 PolarHBondContact O-N 3.31Å
500	L	90.8	Very high	86.6	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-75.9	-37.3	176.8	-73	167.7	0	0	0	112.4	L453 F470 L481 A484 M485 A488 F496 V497 Q498 K503 G504 L505	L453-L500 HydrophobicContact CD2-CD2 4.38Å; F470-L500 HydrophobicContact CZ-CD2 4.06Å; L481-L500 HydrophobicContact CD2-CD2 3.8Å; A484-L500 HydrophobicContact CB-CD1 4.11Å; A484-L500 HydrophobicContact CB-CD2 4.29Å; M485-L500 HydrophobicContact CB-CD1 4.27Å; M485-L500 HydrophobicContact SD-CB 4.38Å; M485-L500 HydrophobicContact SD-CD1 4.3Å; A488-L500 HydrophobicContact CB-CD1 4.24Å; F496-L500 WeakPolarHBondContact O-CB 3.41Å; F496-L500 WeakPolarHBondContact O-CD1 3.37Å; F496-L500 WeakPolarHBondContact O-CG 3.39Å; F496-L500 PolarHBondContact O-N 2.9Å; V497-L500 PolarHBondContact O-N 2.79Å; Q498-L500 PolarHBondContact O-N 3.04Å; L500-K503 PolarHBondContact O-N 2.92Å; L500-G504 PolarHBondContact O-N 3.23Å; L500-L505 VanDerWaalsContact O-CB 3.29Å; L500-L505 WeakPolarHBondContact O-CB 3.5Å; L500-L505 PolarHBondContact O-N 2.85Å
501	L	88.3	Confident	86.7	Confident	30 Å²	30	54.8 Å²	54.8	16%	0.157	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-49.3	174.6	-69.8	171.1	0	0	0	111.2	M485 V497 Q498 K503 G504 L505 I507 F698	M485-L501 HydrophobicContact CE-CD2 4.44Å; V497-L501 HydrophobicContact CG1-CD1 3.92Å; V497-L501 WeakPolarHBondContact O-CG 3.48Å; V497-L501 PolarHBondContact O-N 2.74Å; Q498-L501 PolarHBondContact O-N 3.26Å; L501-K503 PolarHBondContact O-N 2.8Å; L501-G504 PolarHBondContact O-N 2.64Å; L501-L505 HydrophobicContact CD2-CD2 4.3Å; L501-I507 HydrophobicContact CD2-CB 4.42Å; L501-F698 HydrophobicContact CD1-CE1 3.9Å; L501-F698 HydrophobicContact CD1-CZ 4.07Å
502	T	86.1	Confident	86.9	Confident	110 Å²	110	56.2 Å²	56.2	68%	0.675	28%	0.276	S	S	*	.	H	α-helix	trans	-64.1	-19.1	176.4	52.3	0	0	0	0	113.9	Q498 L499 G504	Q498-T502 WeakPolarHBondContact O-CB 3.4Å; Q498-T502 WeakPolarHBondContact O-CG2 3.27Å; Q498-T502 PolarHBondContact O-N 3.16Å; Q498-T502 PolarHBondContact O-OG1 2.96Å; L499-T502 WeakPolarHBondContact CA-OG1 3.45Å; L499-T502 PolarHBondContact O-OG1 2.79Å; T502-G504 VanDerWaalsContact C-N 3.34Å
503	K	84	Confident	86.8	Confident	105 Å²	105	59.7 Å²	59.7	46%	0.457	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	12.5	170.2	-63.4	-67.5	174.8	-171.9	0	113.8	F470 L499 L500 L501	F470-K503 HydrophobicContact CB-CD 4.37Å; F470-K503 HydrophobicContact CD1-CB 4.42Å; F470-K503 HydrophobicContact CD1-CD 4.21Å; F470-K503 HydrophobicContact CD1-CG 3.91Å; F470-K503 HydrophobicContact CE1-CB 4.28Å; F470-K503 HydrophobicContact CE1-CG 4.11Å; F470-K503 HydrophobicContact CG-CD 4.32Å; F470-K503 HydrophobicContact CG-CG 4.15Å; L499-K503 HydrophobicContact CD1-CG 4.39Å; L499-K503 WeakPolarHBondContact O-CB 3.24Å; L499-K503 WeakPolarHBondContact O-CG 3.38Å; L499-K503 PolarHBondContact O-N 3.31Å; L500-K503 PolarHBondContact O-N 2.92Å; L501-K503 PolarHBondContact O-N 2.8Å
504	G	75.4	Confident	86.5	Confident	59 Å²	59	64.8 Å²	64.8	61%	0.608	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	18.8	166.1	0	0	0	0	0	116.2	L500 L501 T502 R506	L500-G504 PolarHBondContact O-N 3.23Å; L501-G504 PolarHBondContact O-N 2.64Å; T502-G504 VanDerWaalsContact C-N 3.34Å; G504-R506 PolarHBondContact O-N 2.67Å
505	L	84.8	Confident	86.2	Confident	15 Å²	15	63.6 Å²	63.6	8%	0.079	30%	0.302	C	S	.	.			trans	-68.9	109.8	172.2	-177.1	133.3	0	0	0	110.8	L481 M485 L500 L501 I507 F510	L481-L505 HydrophobicContact CB-CD1 3.8Å; L481-L505 WeakPolarHBondContact O-CD1 3.36Å; M485-L505 HydrophobicContact CB-CD1 3.76Å; M485-L505 HydrophobicContact CB-CD2 4.3Å; M485-L505 HydrophobicContact CE-CD2 4.24Å; M485-L505 HydrophobicContact CG-CD1 4.2Å; M485-L505 HydrophobicContact CG-CD2 3.8Å; M485-L505 HydrophobicContact SD-CD2 4.04Å; L500-L505 VanDerWaalsContact O-CB 3.29Å; L500-L505 WeakPolarHBondContact O-CB 3.5Å; L500-L505 PolarHBondContact O-N 2.85Å; L501-L505 HydrophobicContact CD2-CD2 4.3Å; L505-I507 PolarHBondContact O-N 3.43Å; L505-I507 VanDerWaalsContact O-N 3.14Å; L505-F510 HydrophobicContact CD2-CB 4.22Å
506	R	84.1	Confident	86.1	Confident	202 Å²	202	58.7 Å²	58.7	76%	0.762	28%	0.279	S	S	*	.			trans	-74.9	101.8	176.5	-65.5	-169.4	-177.2	-165.4	-1.4	111.1	G504 Q508 R509 F510	G504-R506 PolarHBondContact O-N 2.67Å; R506-Q508 VanDerWaalsContact C-N 3.26Å; R506-Q508 PolarHBondContact O-N 3.04Å; R506-R509 PolarHBondContact O-N 2.98Å; R506-F510 PolarHBondContact O-N 3.04Å
507	I	86.1	Confident	85.7	Confident	8 Å²	8	60.1 Å²	60.1	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-53	-39.4	-176.8	-168.2	73	0	0	0	113.3	M485 L501 L505 R509 F510 L511 P679 Y680 L683	M485-I507 HydrophobicContact CE-CD1 3.63Å; L501-I507 HydrophobicContact CD2-CB 4.42Å; L505-I507 PolarHBondContact O-N 3.43Å; L505-I507 VanDerWaalsContact O-N 3.14Å; I507-R509 PolarHBondContact O-N 3.09Å; I507-R509 VanDerWaalsContact O-N 3.1Å; I507-F510 HydrophobicContact CD1-CD1 3.8Å; I507-F510 HydrophobicContact CD1-CE1 4.37Å; I507-F510 PolarHBondContact O-N 2.86Å; I507-F510 VanDerWaalsContact O-N 3.12Å; I507-L511 PolarHBondContact O-N 2.96Å; I507-P679 HydrophobicContact CG1-CB 4.27Å; I507-P679 HydrophobicContact CG2-CB 4.29Å; I507-P679 HydrophobicContact CG2-CG 3.74Å; I507-Y680 HydrophobicContact CB-CE1 4.43Å; I507-Y680 HydrophobicContact CG1-CE1 4.45Å; I507-Y680 HydrophobicContact CG2-CD2 4.25Å; I507-Y680 HydrophobicContact CG2-CE1 3.98Å; I507-Y680 HydrophobicContact CG2-CE2 3.68Å; I507-L683 HydrophobicContact CD1-CD2 4.27Å
508	Q	83.5	Confident	85.3	Confident	109 Å²	109	63.1 Å²	63.1	51%	0.509	30%	0.299	S	S	.	.	H	α-helix	trans	-52.4	-32.8	176.2	-72.2	173.8	-13.7	0	0	113.4	R506 Y675 P679	R506-Q508 VanDerWaalsContact C-N 3.26Å; R506-Q508 PolarHBondContact O-N 3.04Å; Q508-Y675 VanDerWaalsContact O-CD1 3.25Å; Q508-Y675 WeakPolarHBondContact O-CD1 3.5Å; Q508-P679 HydrophobicContact CB-CG 4.49Å; Q508-P679 HydrophobicContact CG-CG 3.77Å
509	R	83	Confident	85	Confident	144 Å²	144	59.8 Å²	59.8	54%	0.543	28%	0.284	S	S	.	.	H	α-helix	trans	-89.3	-30.5	-177.8	-162.3	-179.2	-170.6	118.1	4.7	112.6	R506 I507	R506-R509 PolarHBondContact O-N 2.98Å; I507-R509 PolarHBondContact O-N 3.09Å; I507-R509 VanDerWaalsContact O-N 3.1Å
510	F	87	Confident	84.7	Confident	8 Å²	8	59.6 Å²	59.6	4%	0.035	28%	0.283	C	S	.	.	H	α-helix	trans	-72.3	-47.7	175	161.5	-95.8	0	0	0	111.6	E482 M485 A486 L489 L505 R506 I507 T512 R515	E482-F510 HydrophobicContact CB-CD2 4.17Å; E482-F510 HydrophobicContact CG-CB 4.4Å; E482-F510 HydrophobicContact CG-CD2 4.43Å; E482-F510 WeakPolarHBondContact O-CD2 3.45Å; E482-F510 WeakPolarHBondContact O-CE2 3.43Å; M485-F510 HydrophobicContact CB-CD2 3.99Å; M485-F510 HydrophobicContact CB-CE2 3.78Å; M485-F510 HydrophobicContact CB-CZ 4.19Å; M485-F510 HydrophobicContact CG-CD1 4.04Å; M485-F510 HydrophobicContact CG-CD2 3.97Å; M485-F510 HydrophobicContact CG-CE1 3.87Å; M485-F510 HydrophobicContact CG-CE2 3.77Å; M485-F510 HydrophobicContact CG-CG 4.1Å; M485-F510 HydrophobicContact CG-CZ 3.73Å; A486-F510 HydrophobicContact CB-CE2 4.03Å; A486-F510 HydrophobicContact CB-CZ 4.17Å; L489-F510 HydrophobicContact CD1-CE1 3.65Å; L489-F510 HydrophobicContact CD1-CZ 3.7Å; L505-F510 HydrophobicContact CD2-CB 4.22Å; R506-F510 PolarHBondContact O-N 3.04Å; I507-F510 HydrophobicContact CD1-CD1 3.8Å; I507-F510 HydrophobicContact CD1-CE1 4.37Å; I507-F510 PolarHBondContact O-N 2.86Å; I507-F510 VanDerWaalsContact O-N 3.12Å; F510-T512 PolarHBondContact O-N 2.85Å; F510-R515 HydrophobicContact CE1-CG 4.45Å; F510-R515 HydrophobicContact CE2-CG 4.38Å; F510-R515 HydrophobicContact CZ-CG 4.17Å
511	L	87	Confident	84.3	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.293	C	S	.	.			trans	-84.7	83.3	-172.9	-160.8	72.8	0	0	0	110.9	I507 L516 L519 F676 P679 E682 L683	I507-L511 PolarHBondContact O-N 2.96Å; L511-L516 HydrophobicContact CD1-CB 4.44Å; L511-L516 HydrophobicContact CD1-CD1 4.3Å; L511-L519 HydrophobicContact CD1-CD1 4.27Å; L511-F676 HydrophobicContact CD2-CD2 4.09Å; L511-F676 HydrophobicContact CD2-CE2 4.49Å; L511-F676 HydrophobicContact CG-CD2 4.04Å; L511-F676 HydrophobicContact CG-CE2 4.21Å; L511-F676 VanDerWaalsContact O-CD2 3.29Å; L511-F676 WeakPolarHBondContact O-CD2 3.37Å; L511-P679 HydrophobicContact CB-CB 4.32Å; L511-P679 HydrophobicContact CD2-CB 3.95Å; L511-P679 WeakPolarHBondContact CD2-O 3.39Å; L511-E682 HydrophobicContact CD2-CB 4.08Å; L511-L683 HydrophobicContact CD1-CD1 4.44Å; L511-L683 HydrophobicContact CD2-CB 4.27Å
512	T	84.7	Confident	83.4	Confident	42 Å²	42	62.9 Å²	62.9	26%	0.258	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-88.2	163	169.5	71.3	0	0	0	0	111.2	F510 E514 R515 L516	F510-T512 PolarHBondContact O-N 2.85Å; T512-E514 VanDerWaalsContact C-N 3.27Å; T512-E514 PolarHBondContact O-N 2.71Å; T512-R515 WeakPolarHBondContact O-CB 3.42Å; T512-R515 PolarHBondContact O-N 3.47Å; T512-R515 VanDerWaalsContact O-N 3.14Å; T512-R515 WeakPolarHBondContact OG1-CB 3.34Å; T512-R515 PolarHBondContact OG1-N 2.74Å; T512-L516 PolarHBondContact O-N 3.07Å
513	R	82.9	Confident	82.1	Confident	146 Å²	146	57.7 Å²	57.7	55%	0.551	27%	0.271	S	S	*	.	H	α-helix	trans	-54.9	-41	174.6	-172.3	-175.1	170.3	153.8	1	113.5	E517 L545 F676	R513-E517 PolarHBondContact O-N 2.82Å; R513-L545 HydrophobicContact CG-CD1 3.5Å; R513-F676 HydrophobicContact CB-CZ 4.26Å; R513-F676 HydrophobicContact CG-CZ 4.48Å
514	E	82.4	Confident	80.7	Confident	153 Å²	153	57.2 Å²	57.2	72%	0.715	28%	0.276	S	S	*	.	H	α-helix	trans	-67.5	-43.4	178.1	-68	172.3	-174.2	0	0	110.4	T512 L516 E517 E518	T512-E514 VanDerWaalsContact C-N 3.27Å; T512-E514 PolarHBondContact O-N 2.71Å; E514-L516 VanDerWaalsContact C-N 3.34Å; E514-L516 PolarHBondContact O-N 3.21Å; E514-E517 PolarHBondContact O-N 2.95Å; E514-E518 WeakPolarHBondContact O-CG 3.4Å; E514-E518 PolarHBondContact O-N 3Å
515	R	85.3	Confident	79.4	Confident	18 Å²	18	55.9 Å²	55.9	7%	0.068	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-40.5	177.1	-179.9	55.4	124.8	-163.8	-1.1	112.9	E482 A486 F510 T512 E518 L519	E482-R515 PolarHBondContact O-NH2 2.97Å; A486-R515 VanDerWaalsContact CB-CZ 3.48Å; A486-R515 VanDerWaalsContact CB-NH2 3.27Å; F510-R515 HydrophobicContact CE1-CG 4.45Å; F510-R515 HydrophobicContact CE2-CG 4.38Å; F510-R515 HydrophobicContact CZ-CG 4.17Å; T512-R515 WeakPolarHBondContact O-CB 3.42Å; T512-R515 PolarHBondContact O-N 3.47Å; T512-R515 VanDerWaalsContact O-N 3.14Å; T512-R515 WeakPolarHBondContact OG1-CB 3.34Å; T512-R515 PolarHBondContact OG1-N 2.74Å; R515-E518 IonicContact NH1-OE2 3.52Å; R515-E518 PolarHBondContact NH1-OE2 3.17Å; R515-E518 WeakPolarHBondContact O-CB 3.35Å; R515-E518 PolarHBondContact O-N 3.49Å; R515-L519 WeakPolarHBondContact O-CG 3.4Å; R515-L519 PolarHBondContact O-N 2.82Å; R515-L519 VanDerWaalsContact O-N 3.1Å
516	L	87.7	Confident	77.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-71.7	-35.9	177.4	-170.7	61.3	0	0	0	112.1	L511 T512 E514 E518 L519 Y520 L545 Y564 F676 E682 W686	L511-L516 HydrophobicContact CD1-CB 4.44Å; L511-L516 HydrophobicContact CD1-CD1 4.3Å; T512-L516 PolarHBondContact O-N 3.07Å; E514-L516 VanDerWaalsContact C-N 3.34Å; E514-L516 PolarHBondContact O-N 3.21Å; L516-E518 VanDerWaalsContact C-N 3.3Å; L516-E518 PolarHBondContact O-N 3.02Å; L516-L519 HydrophobicContact CD1-CD1 4.36Å; L516-L519 PolarHBondContact O-N 3.46Å; L516-Y520 HydrophobicContact CD1-CD2 4.2Å; L516-Y520 HydrophobicContact CD1-CE2 3.87Å; L516-Y520 HydrophobicContact CD2-CE2 4.36Å; L516-Y520 HydrophobicContact CG-CD2 4.07Å; L516-Y520 HydrophobicContact CG-CE2 3.87Å; L516-Y520 WeakPolarHBondContact O-CD2 3.35Å; L516-Y520 PolarHBondContact O-N 2.76Å; L516-Y520 VanDerWaalsContact O-N 3.17Å; L516-L545 HydrophobicContact CB-CD2 4.5Å; L516-L545 HydrophobicContact CD2-CD2 3.71Å; L516-L545 HydrophobicContact CG-CD2 3.91Å; L516-Y564 WeakPolarHBondContact CD2-OH 3.32Å; L516-F676 HydrophobicContact CB-CE2 4.06Å; L516-F676 HydrophobicContact CB-CZ 4.25Å; L516-F676 HydrophobicContact CD2-CE1 4.49Å; L516-F676 HydrophobicContact CD2-CE2 3.86Å; L516-F676 HydrophobicContact CD2-CZ 3.67Å; L516-E682 HydrophobicContact CD2-CB 4.06Å; L516-W686 HydrophobicContact CD1-CB 4.15Å
517	E	84.1	Confident	76.7	Confident	32 Å²	32	53.2 Å²	53.2	15%	0.15	25%	0.252	C	S	.	.	H	α-helix	trans	-64.5	-31.6	169.7	-79.2	-159.9	-175.6	0	0	112.9	R513 E514 N521 K542 L545	R513-E517 PolarHBondContact O-N 2.82Å; E514-E517 PolarHBondContact O-N 2.95Å; E517-N521 PolarHBondContact O-N 2.76Å; E517-N521 PolarHBondContact O-ND2 3.15Å; E517-K542 IonicContact OE2-NZ 3.56Å; E517-K542 PolarHBondContact OE2-NZ 2.93Å; E517-L545 HydrophobicContact CG-CB 4.49Å; E517-L545 HydrophobicContact CG-CD1 3.86Å; E517-L545 HydrophobicContact CG-CG 3.66Å; E517-L545 PolarHBondContact OE1-N 2.82Å
518	E	82.2	Confident	75.8	Confident	64 Å²	64	54.9 Å²	54.9	30%	0.299	26%	0.264	S	S	.	.	H	α-helix	trans	-64.8	-49.8	171.4	-67	176.1	148	0	0	111.5	Y316 E514 R515 L516 Y520 N521 V522	Y316-E518 VanDerWaalsContact CE2-CD 3.49Å; Y316-E518 WeakPolarHBondContact CE2-OE1 3.49Å; Y316-E518 WeakPolarHBondContact CE2-OE2 3.4Å; Y316-E518 VanDerWaalsContact OH-CD 3.29Å; Y316-E518 PolarHBondContact OH-OE1 3.2Å; Y316-E518 PolarHBondContact OH-OE2 3.42Å; Y316-E518 VanDerWaalsContact OH-OE2 3.12Å; E514-E518 WeakPolarHBondContact O-CG 3.4Å; E514-E518 PolarHBondContact O-N 3Å; R515-E518 IonicContact NH1-OE2 3.52Å; R515-E518 PolarHBondContact NH1-OE2 3.17Å; R515-E518 WeakPolarHBondContact O-CB 3.35Å; R515-E518 PolarHBondContact O-N 3.49Å; L516-E518 VanDerWaalsContact C-N 3.3Å; L516-E518 PolarHBondContact O-N 3.02Å; E518-Y520 VanDerWaalsContact C-N 3.33Å; E518-Y520 PolarHBondContact O-N 3.31Å; E518-N521 PolarHBondContact O-N 2.82Å; E518-V522 WeakPolarHBondContact O-CG2 3.49Å; E518-V522 PolarHBondContact O-N 2.85Å
519	L	85.7	Confident	75.4	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-56.3	-43.5	-179.2	-69.9	172.6	0	0	0	112.3	L490 L511 R515 L516 N521 L683 W686	L490-L519 HydrophobicContact CD2-CD2 3.77Å; L490-L519 HydrophobicContact CG-CD2 3.97Å; L511-L519 HydrophobicContact CD1-CD1 4.27Å; R515-L519 WeakPolarHBondContact O-CG 3.4Å; R515-L519 PolarHBondContact O-N 2.82Å; R515-L519 VanDerWaalsContact O-N 3.1Å; L516-L519 HydrophobicContact CD1-CD1 4.36Å; L516-L519 PolarHBondContact O-N 3.46Å; L519-N521 VanDerWaalsContact C-N 3.29Å; L519-N521 PolarHBondContact O-N 2.92Å; L519-L683 HydrophobicContact CD1-CD1 4.4Å; L519-W686 HydrophobicContact CB-CZ2 4.46Å; L519-W686 HydrophobicContact CD2-CZ2 4.37Å; L519-W686 PolarHBondContact O-NE1 3.25Å
520	Y	84.4	Confident	74.9	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-69.7	-15.8	175.2	-80.3	-68	0	0	0	115.1	L516 E518 F529 I543 L545 V548 W686 L689	L516-Y520 HydrophobicContact CD1-CD2 4.2Å; L516-Y520 HydrophobicContact CD1-CE2 3.87Å; L516-Y520 HydrophobicContact CD2-CE2 4.36Å; L516-Y520 HydrophobicContact CG-CD2 4.07Å; L516-Y520 HydrophobicContact CG-CE2 3.87Å; L516-Y520 WeakPolarHBondContact O-CD2 3.35Å; L516-Y520 PolarHBondContact O-N 2.76Å; L516-Y520 VanDerWaalsContact O-N 3.17Å; E518-Y520 VanDerWaalsContact C-N 3.33Å; E518-Y520 PolarHBondContact O-N 3.31Å; Y520-F529 AromaticContact CD1-CE1 3.73Å; Y520-F529 HydrophobicContact CD1-CE1 3.73Å; Y520-F529 AromaticContact CD1-CZ 3.7Å; Y520-F529 HydrophobicContact CD1-CZ 3.7Å; Y520-F529 HydrophobicContact CE1-CE1 4.43Å; Y520-F529 HydrophobicContact CE1-CZ 4.01Å; Y520-I543 WeakPolarHBondContact O-CD1 3.44Å; Y520-L545 HydrophobicContact CD2-CD2 4.19Å; Y520-L545 HydrophobicContact CE2-CD2 4.07Å; Y520-V548 HydrophobicContact CD1-CG2 4.22Å; Y520-V548 HydrophobicContact CD2-CG2 4.17Å; Y520-V548 HydrophobicContact CE1-CG1 4.14Å; Y520-V548 HydrophobicContact CE1-CG2 4.28Å; Y520-V548 HydrophobicContact CE2-CG1 4.13Å; Y520-V548 HydrophobicContact CE2-CG2 4.23Å; Y520-V548 HydrophobicContact CG-CG2 4.17Å; Y520-W686 AromaticContact CD1-CD1 3.74Å; Y520-W686 HydrophobicContact CE1-CB 4.21Å; Y520-W686 AromaticContact CE1-CD1 3.73Å; Y520-W686 HydrophobicContact CE1-CG 4.37Å; Y520-W686 HydrophobicContact CE2-CB 4.2Å; Y520-W686 AromaticContact CZ-CD1 3.99Å; Y520-W686 VanDerWaalsContact OH-CA 3.31Å; Y520-W686 WeakPolarHBondContact OH-CA 3.5Å; Y520-W686 PolarHBondContact OH-N 2.65Å; Y520-L689 HydrophobicContact CE1-CB 4.41Å; Y520-L689 HydrophobicContact CE1-CD1 4.12Å
521	N	80.9	Confident	74.1	Confident	40 Å²	40	49.7 Å²	49.7	21%	0.214	25%	0.245	C	C	.	.	H	α-helix	trans	-106.6	-12.2	-179.2	-77.1	-80.8	0	0	0	114.1	E517 E518 L519 K542 I543	E517-N521 PolarHBondContact O-N 2.76Å; E517-N521 PolarHBondContact O-ND2 3.15Å; E518-N521 PolarHBondContact O-N 2.82Å; L519-N521 VanDerWaalsContact C-N 3.29Å; L519-N521 PolarHBondContact O-N 2.92Å; N521-K542 WeakPolarHBondContact OD1-CG 3.49Å; N521-I543 PolarHBondContact ND2-O 3.17Å; N521-I543 PolarHBondContact OD1-N 2.92Å
522	V	70.2	Confident	73.5	Confident	61 Å²	61	50.7 Å²	50.7	37%	0.37	25%	0.25	S	S	.	.	H	α-helix	trans	-83.7	-24.1	178.6	171	0	0	0	0	112.5	L490 E518 V524	L490-V522 HydrophobicContact CD1-CG1 4.1Å; L490-V522 HydrophobicContact CD2-CB 3.93Å; L490-V522 HydrophobicContact CD2-CG1 3.66Å; E518-V522 WeakPolarHBondContact O-CG2 3.49Å; E518-V522 PolarHBondContact O-N 2.85Å; V522-V524 PolarHBondContact O-N 2.93Å
523	D	59.7	Low	73.2	Confident	1 Å²	1	49 Å²	49	1%	0.005	24%	0.239	C	C	.	.			trans	-78.1	35.7	-175.2	-83.5	-24	0	0	0	115.4	R314 N525 N526 R692	R314-D523 IonicContact NH1-OD1 2.82Å; D523-N525 PolarHBondContact O-N 2.72Å; D523-N526 PolarHBondContact O-N 3.05Å; D523-R692 VanDerWaalsContact CG-NH2 3.29Å; D523-R692 IonicContact OD1-NH2 2.7Å; D523-R692 PolarHBondContact OD1-NH2 3.06Å; D523-R692 VanDerWaalsContact OD1-NH2 3.1Å; D523-R692 IonicContact OD2-CZ 2.75Å; D523-R692 IonicContact OD2-NE 2.69Å; D523-R692 IonicContact OD2-NH2 3.32Å; D523-R692 PolarHBondContact OD2-NH2 3.28Å
524	V	52.8	Low	72.7	Confident	95 Å²	95	43.6 Å²	43.6	58%	0.576	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-23.5	174.6	-175.2	0	0	0	0	113	V522	V522-V524 PolarHBondContact O-N 2.93Å
525	N	50.1	Low	72.3	Confident	31 Å²	31	40.6 Å²	40.6	17%	0.166	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-19	179.4	-75	10.8	0	0	0	114.3	R314 D523 Q527 M1985 P1987	R314-N525 PolarHBondContact NH2-ND2 2.84Å; R314-N525 VanDerWaalsContact NH2-ND2 3.16Å; D523-N525 PolarHBondContact O-N 2.72Å; N525-Q527 PolarHBondContact O-N 3.04Å; N525-M1985 HydrophobicContact CB-CB 4.42Å; N525-P1987 HydrophobicContact CB-CG 3.67Å
526	N	53.3	Low	71.5	Confident	35 Å²	35	41.7 Å²	41.7	19%	0.187	22%	0.219	C	C	.	.			trans	-86.9	90.9	168.3	-97.3	16.6	0	0	0	108.6	D523 S528 F529 T690 M1985	D523-N526 PolarHBondContact O-N 3.05Å; N526-S528 PolarHBondContact O-N 3.3Å; N526-S528 VanDerWaalsContact O-N 3.14Å; N526-F529 PolarHBondContact O-N 3.03Å; N526-T690 PolarHBondContact ND2-O 3.28Å; N526-M1985 HydrophobicContact CB-CE 4.17Å; N526-M1985 VanDerWaalsContact CG-CE 3.5Å; N526-M1985 WeakPolarHBondContact OD1-CE 3.19Å; N526-M1985 WeakPolarHBondContact OD1-CG 2.75Å
527	Q	58.7	Low	71	Confident	126 Å²	126	43.3 Å²	43.3	59%	0.589	23%	0.228	S	C	*	.	H	α-helix	trans	-58.6	-25.8	178.3	-63.9	-172.5	9.8	0	0	112.2	N525 H530 K531	N525-Q527 PolarHBondContact O-N 3.04Å; Q527-H530 PolarHBondContact O-N 3.33Å; Q527-K531 VanDerWaalsContact O-CB 3.25Å; Q527-K531 WeakPolarHBondContact O-CB 3.3Å; Q527-K531 VanDerWaalsContact O-CG 3.31Å; Q527-K531 WeakPolarHBondContact O-CG 3.31Å; Q527-K531 PolarHBondContact O-N 3.24Å
528	S	65.7	Low	70.2	Confident	42 Å²	42	43.3 Å²	43.3	29%	0.294	24%	0.236	S	C	.	.	H	α-helix	trans	-52.9	-56.8	177.3	49.4	0	0	0	0	113.6	N526 H530 K531 L532	N526-S528 PolarHBondContact O-N 3.3Å; N526-S528 VanDerWaalsContact O-N 3.14Å; S528-H530 PolarHBondContact O-N 3.19Å; S528-K531 WeakPolarHBondContact O-CB 3.31Å; S528-K531 PolarHBondContact O-N 3.48Å; S528-L532 WeakPolarHBondContact O-CB 3.4Å; S528-L532 PolarHBondContact O-N 3.11Å
529	F	76	Confident	69.2	Low	1 Å²	1	46.7 Å²	46.7	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-65.9	-40.3	180	178.5	-120.8	0	0	0	112	Y520 N526 L532 F533 I543 L551 L689	Y520-F529 AromaticContact CD1-CE1 3.73Å; Y520-F529 HydrophobicContact CD1-CE1 3.73Å; Y520-F529 AromaticContact CD1-CZ 3.7Å; Y520-F529 HydrophobicContact CD1-CZ 3.7Å; Y520-F529 HydrophobicContact CE1-CE1 4.43Å; Y520-F529 HydrophobicContact CE1-CZ 4.01Å; N526-F529 PolarHBondContact O-N 3.03Å; F529-L532 PolarHBondContact O-N 2.94Å; F529-F533 HydrophobicContact CZ-CD2 4.16Å; F529-F533 VanDerWaalsContact O-CB 3.26Å; F529-F533 WeakPolarHBondContact O-CB 3.39Å; F529-F533 PolarHBondContact O-N 3.4Å; F529-I543 HydrophobicContact CE1-CD1 3.93Å; F529-L551 HydrophobicContact CE2-CD2 3.79Å; F529-L689 WeakPolarHBondContact CB-O 3.21Å; F529-L689 HydrophobicContact CD2-CB 3.99Å; F529-L689 VanDerWaalsContact CD2-O 3.24Å; F529-L689 WeakPolarHBondContact CD2-O 3.37Å; F529-L689 HydrophobicContact CE2-CB 3.91Å; F529-L689 HydrophobicContact CE2-CD1 4.3Å; F529-L689 HydrophobicContact CE2-CG 4.49Å
530	H	72.5	Confident	68	Low	63 Å²	63	51.3 Å²	51.3	29%	0.292	28%	0.282	S	S	.	.	H	α-helix	trans	-68.2	-35.1	177.5	-84.7	-73.9	0	0	0	113	Q527 S528 A534 I543	Q527-H530 PolarHBondContact O-N 3.33Å; S528-H530 PolarHBondContact O-N 3.19Å; H530-A534 WeakPolarHBondContact O-CB 3.33Å; H530-A534 PolarHBondContact O-N 2.87Å; H530-I543 VanDerWaalsContact CE1-CD1 3.49Å; H530-I543 WeakPolarHBondContact CE1-CD1 3.45Å
531	K	70.1	Confident	66.7	Low	89 Å²	89	59.3 Å²	59.3	39%	0.387	32%	0.319	S	S	.	.	H	α-helix	trans	-60.1	-57	168.5	-84.4	-176.7	170.5	-164.2	0	109.7	Q527 S528 F533 A534 K535 E727	Q527-K531 VanDerWaalsContact O-CB 3.25Å; Q527-K531 WeakPolarHBondContact O-CB 3.3Å; Q527-K531 VanDerWaalsContact O-CG 3.31Å; Q527-K531 WeakPolarHBondContact O-CG 3.31Å; Q527-K531 PolarHBondContact O-N 3.24Å; S528-K531 WeakPolarHBondContact O-CB 3.31Å; S528-K531 PolarHBondContact O-N 3.48Å; K531-F533 PolarHBondContact O-N 2.77Å; K531-A534 CarbonylContact O-C 3.52Å; K531-A534 PolarHBondContact O-N 3.25Å; K531-A534 VanDerWaalsContact O-N 3.09Å; K531-K535 WeakPolarHBondContact O-CB 3.37Å; K531-K535 PolarHBondContact O-N 2.91Å; K531-E727 IonicContact NZ-OE2 3.67Å; K531-E727 PolarHBondContact NZ-OE2 2.86Å
532	L	74.1	Confident	66	Low	20 Å²	20	63 Å²	63	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-57.1	-48.8	-177.4	-179.4	65.2	0	0	0	111.9	S528 F529 A534 K535 V536 L689 I720 V723	S528-L532 WeakPolarHBondContact O-CB 3.4Å; S528-L532 PolarHBondContact O-N 3.11Å; F529-L532 PolarHBondContact O-N 2.94Å; L532-A534 VanDerWaalsContact C-N 3.33Å; L532-A534 PolarHBondContact O-N 2.83Å; L532-K535 PolarHBondContact O-N 2.85Å; L532-V536 HydrophobicContact CD1-CG2 4.28Å; L532-V536 WeakPolarHBondContact O-CG2 3.28Å; L532-V536 PolarHBondContact O-N 3.4Å; L532-L689 HydrophobicContact CD2-CD2 4.42Å; L532-I720 HydrophobicContact CD2-CG1 4.25Å; L532-V723 HydrophobicContact CD1-CB 4.31Å; L532-V723 HydrophobicContact CD1-CG1 3.6Å
533	F	79.1	Confident	66.3	Low	6 Å²	6	60.3 Å²	60.3	3%	0.026	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-39.6	176.4	-172.7	-77.1	0	0	0	111.8	F529 K531 L537 G538 K540 I543 L551	F529-F533 HydrophobicContact CZ-CD2 4.16Å; F529-F533 VanDerWaalsContact O-CB 3.26Å; F529-F533 WeakPolarHBondContact O-CB 3.39Å; F529-F533 PolarHBondContact O-N 3.4Å; K531-F533 PolarHBondContact O-N 2.77Å; F533-L537 HydrophobicContact CD2-CD1 4.41Å; F533-L537 HydrophobicContact CE1-CB 4.37Å; F533-L537 HydrophobicContact CE2-CD1 4.04Å; F533-L537 HydrophobicContact CZ-CD1 4.25Å; F533-L537 WeakPolarHBondContact O-CA 3.47Å; F533-L537 WeakPolarHBondContact O-CB 3.35Å; F533-L537 PolarHBondContact O-N 3.43Å; F533-G538 PolarHBondContact O-N 2.95Å; F533-K540 HydrophobicContact CE1-CB 4.18Å; F533-K540 HydrophobicContact CE1-CD 4Å; F533-K540 HydrophobicContact CE1-CG 4.34Å; F533-K540 HydrophobicContact CZ-CD 4.19Å; F533-I543 HydrophobicContact CD2-CG1 4.41Å; F533-I543 HydrophobicContact CE1-CG1 4.41Å; F533-I543 HydrophobicContact CE2-CG1 4.14Å; F533-I543 HydrophobicContact CE2-CG2 4.13Å; F533-I543 HydrophobicContact CZ-CG1 4.13Å; F533-L551 HydrophobicContact CD2-CD2 4.14Å
534	A	72.5	Confident	67.4	Low	34 Å²	34	62.8 Å²	62.8	28%	0.281	33%	0.332	S	S	.	.	H	α-helix	trans	-68.7	-37.6	176.2	0	0	0	0	0	112.8	H530 K531 L532 G538 T539	H530-A534 WeakPolarHBondContact O-CB 3.33Å; H530-A534 PolarHBondContact O-N 2.87Å; K531-A534 CarbonylContact O-C 3.52Å; K531-A534 PolarHBondContact O-N 3.25Å; K531-A534 VanDerWaalsContact O-N 3.09Å; L532-A534 VanDerWaalsContact C-N 3.33Å; L532-A534 PolarHBondContact O-N 2.83Å; A534-G538 WeakPolarHBondContact O-CA 3.49Å; A534-G538 PolarHBondContact O-N 3.18Å; A534-T539 HydrophobicContact CB-CG2 3.76Å
535	K	72.4	Confident	68.9	Low	90 Å²	90	58.4 Å²	58.4	39%	0.391	31%	0.305	S	S	.	.	H	α-helix	trans	-65.3	-45.4	177.3	-170.3	171.8	-178.2	177.1	0	111.6	K531 L532 V723 D726	K531-K535 WeakPolarHBondContact O-CB 3.37Å; K531-K535 PolarHBondContact O-N 2.91Å; L532-K535 PolarHBondContact O-N 2.85Å; K535-V723 HydrophobicContact CD-CG1 4.03Å; K535-V723 PolarHBondContact NZ-O 3.45Å; K535-D726 VanDerWaalsContact CE-OD2 3.26Å; K535-D726 WeakPolarHBondContact CE-OD2 3.33Å; K535-D726 IonicContact NZ-OD2 3.59Å; K535-D726 PolarHBondContact NZ-OD2 3.29Å
536	V	70.1	Confident	70.5	Confident	41 Å²	41	61.6 Å²	61.6	25%	0.248	32%	0.315	C	S	.	.	H	α-helix	trans	-88.9	-30.2	-175.1	-176.9	0	0	0	0	113.9	L532 L551 N554 L555 V723	L532-V536 HydrophobicContact CD1-CG2 4.28Å; L532-V536 WeakPolarHBondContact O-CG2 3.28Å; L532-V536 PolarHBondContact O-N 3.4Å; V536-L551 HydrophobicContact CB-CD1 3.6Å; V536-L551 HydrophobicContact CG1-CD1 3.69Å; V536-L551 HydrophobicContact CG2-CD1 4.05Å; V536-N554 HydrophobicContact CG1-CB 3.91Å; V536-L555 HydrophobicContact CG2-CD2 4.48Å; V536-V723 HydrophobicContact CG2-CG1 4.18Å
537	L	77.1	Confident	71.9	Confident	34 Å²	34	60.2 Å²	60.2	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-131.1	1.5	-172.5	-68	178.3	0	0	0	115.7	F533 K540 S547 Q550 L551	F533-L537 HydrophobicContact CD2-CD1 4.41Å; F533-L537 HydrophobicContact CE1-CB 4.37Å; F533-L537 HydrophobicContact CE2-CD1 4.04Å; F533-L537 HydrophobicContact CZ-CD1 4.25Å; F533-L537 WeakPolarHBondContact O-CA 3.47Å; F533-L537 WeakPolarHBondContact O-CB 3.35Å; F533-L537 PolarHBondContact O-N 3.43Å; L537-K540 VanDerWaalsContact O-CE 3.26Å; L537-K540 WeakPolarHBondContact O-CE 3.3Å; L537-K540 PolarHBondContact O-NZ 3.4Å; L537-S547 WeakPolarHBondContact CD1-O 3.33Å; L537-Q550 HydrophobicContact CD1-CB 4.31Å; L537-Q550 HydrophobicContact CD2-CB 4.43Å; L537-L551 HydrophobicContact CD1-CB 3.78Å; L537-L551 HydrophobicContact CD1-CD1 4.39Å; L537-L551 HydrophobicContact CG-CD1 4.48Å
538	G	67.1	Low	73.2	Confident	32 Å²	32	54.2 Å²	54.2	33%	0.33	28%	0.28	S	S	.	.			trans	76.9	160	-177.7	0	0	0	0	0	114.5	F533 A534 K540	F533-G538 PolarHBondContact O-N 2.95Å; A534-G538 WeakPolarHBondContact O-CA 3.49Å; A534-G538 PolarHBondContact O-N 3.18Å; G538-K540 PolarHBondContact O-N 3.49Å
539	T	59.9	Low	74.3	Confident	135 Å²	135	52.2 Å²	52.2	83%	0.828	27%	0.266	S	S	*	.			trans	-69.8	114	-177.7	46.3	0	0	0	0	112.3	A534	A534-T539 HydrophobicContact CB-CG2 3.76Å
540	K	60.7	Low	74.6	Confident	100 Å²	100	56.1 Å²	56.1	44%	0.435	28%	0.284	S	S	.	.			trans	-120	145.3	177.5	-64.7	171.2	-170.1	154.7	0	110.2	F533 L537 G538	F533-K540 HydrophobicContact CE1-CB 4.18Å; F533-K540 HydrophobicContact CE1-CD 4Å; F533-K540 HydrophobicContact CE1-CG 4.34Å; F533-K540 HydrophobicContact CZ-CD 4.19Å; L537-K540 VanDerWaalsContact O-CE 3.26Å; L537-K540 WeakPolarHBondContact O-CE 3.3Å; L537-K540 PolarHBondContact O-NZ 3.4Å; G538-K540 PolarHBondContact O-N 3.49Å
541	Q	57.1	Low	75.3	Confident	170 Å²	170	53.1 Å²	53.1	79%	0.794	27%	0.27	S	S	*	.	S	Bend	trans	-79	-18.3	-172.2	-69.2	-168.2	-38.3	0	0	115.7	Y1103	Q541-Y1103 PolarHBondContact NE2-OH 3.33Å
542	K	67.7	Low	76.1	Confident	118 Å²	118	48.9 Å²	48.9	51%	0.513	25%	0.252	S	S	.	.	S	Bend	trans	-141.5	135	169.4	-163.6	-155.7	177.1	-154.8	0	108	E517 N521	E517-K542 IonicContact OE2-NZ 3.56Å; E517-K542 PolarHBondContact OE2-NZ 2.93Å; N521-K542 WeakPolarHBondContact OD1-CG 3.49Å
543	I	75.9	Confident	76.7	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.015	26%	0.257	C	S	.	.			trans	-82	139.1	171	-65.1	141.6	0	0	0	108.4	Y520 N521 F529 H530 F533 V548	Y520-I543 WeakPolarHBondContact O-CD1 3.44Å; N521-I543 PolarHBondContact ND2-O 3.17Å; N521-I543 PolarHBondContact OD1-N 2.92Å; F529-I543 HydrophobicContact CE1-CD1 3.93Å; H530-I543 VanDerWaalsContact CE1-CD1 3.49Å; H530-I543 WeakPolarHBondContact CE1-CD1 3.45Å; F533-I543 HydrophobicContact CD2-CG1 4.41Å; F533-I543 HydrophobicContact CE1-CG1 4.41Å; F533-I543 HydrophobicContact CE2-CG1 4.14Å; F533-I543 HydrophobicContact CE2-CG2 4.13Å; F533-I543 HydrophobicContact CZ-CG1 4.13Å; I543-V548 HydrophobicContact CG2-CG2 3.6Å
544	T	82.2	Confident	76.9	Confident	53 Å²	53	54.6 Å²	54.6	33%	0.325	28%	0.281	S	S	.	.			trans	-126.8	154.4	176.5	65.8	0	0	0	0	109.5	R546 S547 V548	T544-R546 PolarHBondContact O-N 3.25Å; T544-S547 PolarHBondContact N-OG 2.76Å; T544-S547 WeakPolarHBondContact O-CA 3.39Å; T544-S547 PolarHBondContact O-N 2.83Å; T544-S547 PolarHBondContact O-OG 3.17Å; T544-S547 PolarHBondContact OG1-N 2.79Å; T544-S547 PolarHBondContact OG1-OG 2.89Å; T544-V548 PolarHBondContact O-N 3.12Å
545	L	83.8	Confident	77.4	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-60.6	-32.8	-178.8	-73.4	164.1	0	0	0	112.6	R513 L516 E517 Y520 S547 V548 G549 Y564 F676	R513-L545 HydrophobicContact CG-CD1 3.5Å; L516-L545 HydrophobicContact CB-CD2 4.5Å; L516-L545 HydrophobicContact CD2-CD2 3.71Å; L516-L545 HydrophobicContact CG-CD2 3.91Å; E517-L545 HydrophobicContact CG-CB 4.49Å; E517-L545 HydrophobicContact CG-CD1 3.86Å; E517-L545 HydrophobicContact CG-CG 3.66Å; E517-L545 PolarHBondContact OE1-N 2.82Å; Y520-L545 HydrophobicContact CD2-CD2 4.19Å; Y520-L545 HydrophobicContact CE2-CD2 4.07Å; L545-S547 VanDerWaalsContact C-N 3.31Å; L545-S547 PolarHBondContact O-N 2.75Å; L545-V548 PolarHBondContact O-N 3.34Å; L545-V548 VanDerWaalsContact O-N 3.16Å; L545-G549 PolarHBondContact O-N 3.16Å; L545-Y564 HydrophobicContact CB-CD2 4.03Å; L545-Y564 HydrophobicContact CB-CE2 4.28Å; L545-Y564 HydrophobicContact CB-CG 4.26Å; L545-Y564 HydrophobicContact CD2-CD2 4.17Å; L545-Y564 HydrophobicContact CD2-CE2 3.56Å; L545-Y564 HydrophobicContact CG-CE2 4.48Å; L545-Y564 WeakPolarHBondContact O-CB 3.45Å; L545-Y564 WeakPolarHBondContact O-CD2 3.48Å; L545-F676 HydrophobicContact CD1-CZ 4.2Å
546	R	84.3	Confident	77.8	Confident	98 Å²	98	49.8 Å²	49.8	37%	0.37	26%	0.255	S	S	.	.	H	α-helix	trans	-62	-37.7	173.1	-180	165	-70.7	-81.8	-9.9	112.5	T544 Q550 Y564 C565 S566	T544-R546 PolarHBondContact O-N 3.25Å; R546-Q550 WeakPolarHBondContact O-CG 3.46Å; R546-Q550 PolarHBondContact O-N 3.29Å; R546-Q550 VanDerWaalsContact O-N 3.11Å; R546-Y564 PolarHBondContact NH2-O 3.35Å; R546-C565 PolarHBondContact NH1-O 3.3Å; R546-S566 PolarHBondContact NH2-O 3.44Å
547	S	83.8	Confident	77.9	Confident	6 Å²	6	49.2 Å²	49.2	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-76.1	-25.1	174.3	49	0	0	0	0	113.7	L537 T544 L545 L551	L537-S547 WeakPolarHBondContact CD1-O 3.33Å; T544-S547 PolarHBondContact N-OG 2.76Å; T544-S547 WeakPolarHBondContact O-CA 3.39Å; T544-S547 PolarHBondContact O-N 2.83Å; T544-S547 PolarHBondContact O-OG 3.17Å; T544-S547 PolarHBondContact OG1-N 2.79Å; T544-S547 PolarHBondContact OG1-OG 2.89Å; L545-S547 VanDerWaalsContact C-N 3.31Å; L545-S547 PolarHBondContact O-N 2.75Å; S547-L551 PolarHBondContact O-N 3.25Å; S547-L551 VanDerWaalsContact O-N 3.15Å
548	V	86	Confident	77.2	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-70	-43.5	169.7	177.2	0	0	0	0	110.2	Y520 I543 T544 L545 Q550 L551 I552 Y564 L689	Y520-V548 HydrophobicContact CD1-CG2 4.22Å; Y520-V548 HydrophobicContact CD2-CG2 4.17Å; Y520-V548 HydrophobicContact CE1-CG1 4.14Å; Y520-V548 HydrophobicContact CE1-CG2 4.28Å; Y520-V548 HydrophobicContact CE2-CG1 4.13Å; Y520-V548 HydrophobicContact CE2-CG2 4.23Å; Y520-V548 HydrophobicContact CG-CG2 4.17Å; I543-V548 HydrophobicContact CG2-CG2 3.6Å; T544-V548 PolarHBondContact O-N 3.12Å; L545-V548 PolarHBondContact O-N 3.34Å; L545-V548 VanDerWaalsContact O-N 3.16Å; V548-Q550 VanDerWaalsContact C-N 3.3Å; V548-Q550 PolarHBondContact O-N 2.85Å; V548-L551 WeakPolarHBondContact O-CA 3.07Å; V548-L551 VanDerWaalsContact O-CB 3.32Å; V548-L551 WeakPolarHBondContact O-CB 3.39Å; V548-L551 PolarHBondContact O-N 2.9Å; V548-I552 HydrophobicContact CG1-CD1 4.02Å; V548-I552 WeakPolarHBondContact O-CG1 3.29Å; V548-I552 PolarHBondContact O-N 3.27Å; V548-Y564 HydrophobicContact CG1-CE2 4.41Å; V548-L689 HydrophobicContact CG1-CD1 3.87Å
549	G	87.2	Confident	76.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.8	-42.5	173.1	0	0	0	0	0	112.3	L545 L551 I552 E553	L545-G549 PolarHBondContact O-N 3.16Å; G549-L551 VanDerWaalsContact C-N 3.26Å; G549-L551 PolarHBondContact O-N 2.9Å; G549-I552 PolarHBondContact O-N 2.99Å; G549-E553 WeakPolarHBondContact O-CG 3.35Å; G549-E553 PolarHBondContact O-N 3.37Å
550	Q	84.1	Confident	77.5	Confident	83 Å²	83	46.1 Å²	46.1	39%	0.388	26%	0.257	S	S	.	.	H	α-helix	trans	-65.4	-27.8	175.3	-73.6	179.8	-35.7	0	0	113.2	L537 R546 V548 N554 C565	L537-Q550 HydrophobicContact CD1-CB 4.31Å; L537-Q550 HydrophobicContact CD2-CB 4.43Å; R546-Q550 WeakPolarHBondContact O-CG 3.46Å; R546-Q550 PolarHBondContact O-N 3.29Å; R546-Q550 VanDerWaalsContact O-N 3.11Å; V548-Q550 VanDerWaalsContact C-N 3.3Å; V548-Q550 PolarHBondContact O-N 2.85Å; Q550-N554 WeakPolarHBondContact O-CB 3.46Å; Q550-N554 PolarHBondContact O-N 3.22Å; Q550-N554 PolarHBondContact O-OD1 3.01Å; Q550-C565 PolarHBondContact N-SG 3.19Å
551	L	86.5	Confident	78.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-70.2	-46.6	173	-179.2	62.6	0	0	0	109.8	F529 F533 V536 L537 S547 V548 G549 N554 L555 L689	F529-L551 HydrophobicContact CE2-CD2 3.79Å; F533-L551 HydrophobicContact CD2-CD2 4.14Å; V536-L551 HydrophobicContact CB-CD1 3.6Å; V536-L551 HydrophobicContact CG1-CD1 3.69Å; V536-L551 HydrophobicContact CG2-CD1 4.05Å; L537-L551 HydrophobicContact CD1-CB 3.78Å; L537-L551 HydrophobicContact CD1-CD1 4.39Å; L537-L551 HydrophobicContact CG-CD1 4.48Å; S547-L551 PolarHBondContact O-N 3.25Å; S547-L551 VanDerWaalsContact O-N 3.15Å; V548-L551 WeakPolarHBondContact O-CA 3.07Å; V548-L551 VanDerWaalsContact O-CB 3.32Å; V548-L551 WeakPolarHBondContact O-CB 3.39Å; V548-L551 PolarHBondContact O-N 2.9Å; G549-L551 VanDerWaalsContact C-N 3.26Å; G549-L551 PolarHBondContact O-N 2.9Å; L551-N554 PolarHBondContact O-N 3.45Å; L551-L555 HydrophobicContact CD1-CD1 4.01Å; L551-L555 HydrophobicContact CD1-CG 4.24Å; L551-L555 HydrophobicContact CG-CD1 3.83Å; L551-L555 HydrophobicContact CG-CG 4.42Å; L551-L555 WeakPolarHBondContact O-CB 3.49Å; L551-L555 VanDerWaalsContact O-CG 3.3Å; L551-L555 WeakPolarHBondContact O-CG 3.43Å; L551-L555 PolarHBondContact O-N 3.49Å; L551-L689 HydrophobicContact CD2-CD2 4.08Å
552	I	87.6	Confident	79.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-40.1	-178.8	-60.5	166.4	0	0	0	111.4	V548 G549 N554 L555 V556 Y560 H562 Q685 L689 F712	V548-I552 HydrophobicContact CG1-CD1 4.02Å; V548-I552 WeakPolarHBondContact O-CG1 3.29Å; V548-I552 PolarHBondContact O-N 3.27Å; G549-I552 PolarHBondContact O-N 2.99Å; I552-N554 VanDerWaalsContact C-N 3.31Å; I552-N554 PolarHBondContact O-N 2.67Å; I552-L555 PolarHBondContact O-N 2.95Å; I552-V556 HydrophobicContact CG2-CG2 3.84Å; I552-V556 WeakPolarHBondContact O-CB 3.41Å; I552-V556 WeakPolarHBondContact O-CG2 3.48Å; I552-V556 PolarHBondContact O-N 2.79Å; I552-Y560 HydrophobicContact CG2-CE1 4.18Å; I552-H562 WeakPolarHBondContact CD1-NE2 3.21Å; I552-Q685 HydrophobicContact CD1-CB 4.47Å; I552-Q685 HydrophobicContact CD1-CG 4.29Å; I552-L689 HydrophobicContact CD1-CD1 4.1Å; I552-L689 HydrophobicContact CG1-CD1 4.1Å; I552-F712 HydrophobicContact CG2-CE2 4.27Å; I552-F712 HydrophobicContact CG2-CZ 3.95Å
553	E	85.5	Confident	79.6	Confident	47 Å²	47	36 Å²	36	22%	0.22	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-40	173.1	-72	176.7	155.3	0	0	112.3	G549 G557 Q561 H562 C565	G549-E553 WeakPolarHBondContact O-CG 3.35Å; G549-E553 PolarHBondContact O-N 3.37Å; E553-G557 PolarHBondContact O-N 3.33Å; E553-Q561 WeakPolarHBondContact OE1-CA 3.24Å; E553-Q561 WeakPolarHBondContact OE1-CG 3.26Å; E553-H562 HydrophobicContact CG-CB 3.92Å; E553-H562 PolarHBondContact OE1-N 3.01Å; E553-C565 VanDerWaalsContact CD-CB 3.46Å; E553-C565 VanDerWaalsContact CD-SG 3.57Å; E553-C565 WeakPolarHBondContact OE1-CB 3.39Å; E553-C565 VanDerWaalsContact OE2-CB 3.31Å; E553-C565 WeakPolarHBondContact OE2-CB 3.39Å; E553-C565 PolarHBondContact OE2-SG 3.14Å
554	N	82.7	Confident	79.8	Confident	100 Å²	100	37.2 Å²	37.2	54%	0.535	23%	0.225	S	C	.	.	H	α-helix	trans	-72.2	-33.9	176.9	-76.2	4.4	0	0	0	113	V536 Q550 L551 I552	V536-N554 HydrophobicContact CG1-CB 3.91Å; Q550-N554 WeakPolarHBondContact O-CB 3.46Å; Q550-N554 PolarHBondContact O-N 3.22Å; Q550-N554 PolarHBondContact O-OD1 3.01Å; L551-N554 PolarHBondContact O-N 3.45Å; I552-N554 VanDerWaalsContact C-N 3.31Å; I552-N554 PolarHBondContact O-N 2.67Å
555	L	83.7	Confident	79.3	Confident	17 Å²	17	35.5 Å²	35.5	9%	0.089	22%	0.215	C	C	.	.	H	α-helix	trans	-78.6	-48.2	-178.8	-76.2	174.9	0	0	0	112.5	V536 L551 I552 L689 L716 S719 I720 V723	V536-L555 HydrophobicContact CG2-CD2 4.48Å; L551-L555 HydrophobicContact CD1-CD1 4.01Å; L551-L555 HydrophobicContact CD1-CG 4.24Å; L551-L555 HydrophobicContact CG-CD1 3.83Å; L551-L555 HydrophobicContact CG-CG 4.42Å; L551-L555 WeakPolarHBondContact O-CB 3.49Å; L551-L555 VanDerWaalsContact O-CG 3.3Å; L551-L555 WeakPolarHBondContact O-CG 3.43Å; L551-L555 PolarHBondContact O-N 3.49Å; I552-L555 PolarHBondContact O-N 2.95Å; L555-L689 HydrophobicContact CD1-CD2 4.16Å; L555-L716 HydrophobicContact CB-CD1 4.19Å; L555-L716 HydrophobicContact CD1-CD1 4.09Å; L555-S719 WeakPolarHBondContact O-CB 3.49Å; L555-I720 HydrophobicContact CD1-CG1 4.45Å; L555-V723 HydrophobicContact CD2-CG2 3.98Å
556	V	81.5	Confident	78.2	Confident	5 Å²	5	37.9 Å²	37.9	3%	0.03	23%	0.232	C	C	.	.	H	α-helix	trans	-73.5	-32.5	-175.6	176.4	0	0	0	0	112.1	I552 Y560 F712 K715 L716 M785	I552-V556 HydrophobicContact CG2-CG2 3.84Å; I552-V556 WeakPolarHBondContact O-CB 3.41Å; I552-V556 WeakPolarHBondContact O-CG2 3.48Å; I552-V556 PolarHBondContact O-N 2.79Å; V556-Y560 HydrophobicContact CB-CD1 4.33Å; V556-Y560 HydrophobicContact CB-CG 4.26Å; V556-Y560 HydrophobicContact CG1-CD1 4.31Å; V556-Y560 HydrophobicContact CG1-CD2 4.02Å; V556-Y560 HydrophobicContact CG1-CG 3.8Å; V556-F712 HydrophobicContact CG2-CE2 4.09Å; V556-K715 HydrophobicContact CG1-CG 4.33Å; V556-L716 HydrophobicContact CG2-CD1 4.27Å; V556-M785 HydrophobicContact CG1-CE 4.06Å
557	G	71.7	Confident	76.4	Confident	29 Å²	29	41.8 Å²	41.8	30%	0.299	25%	0.251	S	S	.	.			trans	64.8	-147.9	178.3	0	0	0	0	0	113.5	E553 G559 Y560	E553-G557 PolarHBondContact O-N 3.33Å; G557-G559 PolarHBondContact O-N 3.12Å; G557-Y560 VanDerWaalsContact O-CB 3.23Å; G557-Y560 WeakPolarHBondContact O-CB 3.38Å; G557-Y560 PolarHBondContact O-N 3.04Å
558	G	61.4	Low	74.4	Confident	55 Å²	55	46.1 Å²	46.1	57%	0.567	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	2.2	172.4	0	0	0	0	0	117.7
559	G	61.6	Low	71.6	Confident	68 Å²	68	49.6 Å²	49.6	70%	0.701	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	10.6	-169.8	0	0	0	0	0	114.4	G557	G557-G559 PolarHBondContact O-N 3.12Å
560	Y	73	Confident	68.9	Low	13 Å²	13	55.9 Å²	55.9	5%	0.051	34%	0.342	C	S	.	.			trans	-56.4	138.2	173.5	-169.7	-94.1	0	0	0	111.6	I552 V556 G557 H562 F712 F774 S775	I552-Y560 HydrophobicContact CG2-CE1 4.18Å; V556-Y560 HydrophobicContact CB-CD1 4.33Å; V556-Y560 HydrophobicContact CB-CG 4.26Å; V556-Y560 HydrophobicContact CG1-CD1 4.31Å; V556-Y560 HydrophobicContact CG1-CD2 4.02Å; V556-Y560 HydrophobicContact CG1-CG 3.8Å; G557-Y560 VanDerWaalsContact O-CB 3.23Å; G557-Y560 WeakPolarHBondContact O-CB 3.38Å; G557-Y560 PolarHBondContact O-N 3.04Å; Y560-H562 AromaticContact CE1-CD2 3.89Å; Y560-F712 HydrophobicContact CE1-CE2 4.32Å; Y560-F712 HydrophobicContact CE2-CE2 4.34Å; Y560-F712 AromaticContact CZ-CE2 3.82Å; Y560-F774 HydrophobicContact CE2-CB 4.4Å; Y560-S775 WeakPolarHBondContact CD2-OG 3.13Å
561	Q	73.6	Confident	66.3	Low	106 Å²	106	54.4 Å²	54.4	50%	0.495	34%	0.344	S	S	.	.			trans	-124.4	123.3	177.4	-170	-169.5	-51.1	0	0	110.1	E553 S775	E553-Q561 WeakPolarHBondContact OE1-CA 3.24Å; E553-Q561 WeakPolarHBondContact OE1-CG 3.26Å; Q561-S775 VanDerWaalsContact O-CB 3.27Å; Q561-S775 WeakPolarHBondContact O-CB 3.23Å
562	H	80.9	Confident	63.7	Low	4 Å²	4	59.4 Å²	59.4	2%	0.019	37%	0.371	C	S	.	.			trans	-82.9	140.4	-179.2	-150	-88.8	0	0	0	111.7	I552 E553 Y560 Y564 C565 S566 Q685	I552-H562 WeakPolarHBondContact CD1-NE2 3.21Å; E553-H562 HydrophobicContact CG-CB 3.92Å; E553-H562 PolarHBondContact OE1-N 3.01Å; Y560-H562 AromaticContact CE1-CD2 3.89Å; H562-Y564 AromaticContact CE1-CD2 3.54Å; H562-Y564 AromaticContact CE1-CE2 3.59Å; H562-Y564 AromaticContact CE1-CG 3.82Å; H562-Y564 AromaticContact CE1-CZ 3.85Å; H562-Y564 AromaticContact ND1-CD1 3.84Å; H562-Y564 AromaticContact ND1-CD2 3.4Å; H562-Y564 WeakPolarHBondContact ND1-CD2 3.45Å; H562-Y564 AromaticContact ND1-CE2 3.94Å; H562-Y564 AromaticContact ND1-CG 3.35Å; H562-Y564 PolarHBondContact O-N 3.09Å; H562-Y564 VanDerWaalsContact O-N 3.13Å; H562-C565 HydrophobicContact CB-CB 4.43Å; H562-C565 WeakPolarHBondContact O-CB 3.32Å; H562-C565 PolarHBondContact O-N 3.03Å; H562-S566 PolarHBondContact O-N 3.33Å; H562-Q685 PolarHBondContact CE1-OE1 3.49Å; H562-Q685 PolarHBondContact NE2-OE1 2.93Å; H562-Q685 VanDerWaalsContact NE2-OE1 3.14Å
563	S	75.7	Confident	61	Low	67 Å²	67	67.2 Å²	67.2	47%	0.469	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-36.8	176.2	-61.7	0	0	0	0	112.8	C565 S566	S563-C565 VanDerWaalsContact C-N 3.29Å; S563-C565 PolarHBondContact O-N 2.89Å; S563-S566 PolarHBondContact O-N 3.26Å
564	Y	79.2	Confident	58.2	Low	27 Å²	27	73.4 Å²	73.4	11%	0.106	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.6	176.7	-55.9	-13.9	0	0	0	114.4	L516 L545 R546 V548 H562 F676 E682	L516-Y564 WeakPolarHBondContact CD2-OH 3.32Å; L545-Y564 HydrophobicContact CB-CD2 4.03Å; L545-Y564 HydrophobicContact CB-CE2 4.28Å; L545-Y564 HydrophobicContact CB-CG 4.26Å; L545-Y564 HydrophobicContact CD2-CD2 4.17Å; L545-Y564 HydrophobicContact CD2-CE2 3.56Å; L545-Y564 HydrophobicContact CG-CE2 4.48Å; L545-Y564 WeakPolarHBondContact O-CB 3.45Å; L545-Y564 WeakPolarHBondContact O-CD2 3.48Å; R546-Y564 PolarHBondContact NH2-O 3.35Å; V548-Y564 HydrophobicContact CG1-CE2 4.41Å; H562-Y564 AromaticContact CE1-CD2 3.54Å; H562-Y564 AromaticContact CE1-CE2 3.59Å; H562-Y564 AromaticContact CE1-CG 3.82Å; H562-Y564 AromaticContact CE1-CZ 3.85Å; H562-Y564 AromaticContact ND1-CD1 3.84Å; H562-Y564 AromaticContact ND1-CD2 3.4Å; H562-Y564 WeakPolarHBondContact ND1-CD2 3.45Å; H562-Y564 AromaticContact ND1-CE2 3.94Å; H562-Y564 AromaticContact ND1-CG 3.35Å; H562-Y564 PolarHBondContact O-N 3.09Å; H562-Y564 VanDerWaalsContact O-N 3.13Å; Y564-F676 HydrophobicContact CE1-CE1 4.08Å; Y564-E682 WeakPolarHBondContact CE1-OE1 3.41Å; Y564-E682 WeakPolarHBondContact CE1-OE2 3.27Å; Y564-E682 VanDerWaalsContact CZ-OE2 3.23Å; Y564-E682 PolarHBondContact OH-OE2 3.4Å
565	C	71.4	Confident	55.5	Low	18 Å²	18	71.7 Å²	71.7	12%	0.122	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-22.5	-177.6	-78.3	0	0	0	0	113.2	R546 Q550 E553 H562 S563	R546-C565 PolarHBondContact NH1-O 3.3Å; Q550-C565 PolarHBondContact N-SG 3.19Å; E553-C565 VanDerWaalsContact CD-CB 3.46Å; E553-C565 VanDerWaalsContact CD-SG 3.57Å; E553-C565 WeakPolarHBondContact OE1-CB 3.39Å; E553-C565 VanDerWaalsContact OE2-CB 3.31Å; E553-C565 WeakPolarHBondContact OE2-CB 3.39Å; E553-C565 PolarHBondContact OE2-SG 3.14Å; H562-C565 HydrophobicContact CB-CB 4.43Å; H562-C565 WeakPolarHBondContact O-CB 3.32Å; H562-C565 PolarHBondContact O-N 3.03Å; S563-C565 VanDerWaalsContact C-N 3.29Å; S563-C565 PolarHBondContact O-N 2.89Å
566	S	61.5	Low	52.8	Low	53 Å²	53	75.9 Å²	75.9	37%	0.371	48%	0.48	S	S	.	.	S	Bend	trans	-53.1	154.6	172.7	-163.3	0	0	0	0	112.2	R546 H562 S563	R546-S566 PolarHBondContact NH2-O 3.44Å; H562-S566 PolarHBondContact O-N 3.33Å; S563-S566 PolarHBondContact O-N 3.26Å
567	K	46.9	Very low	50.2	Low	179 Å²	179	81.5 Å²	81.5	78%	0.778	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-86.8	122.3	172.9	-68.7	178.6	-177.3	173.6	0	108.3
568	P	41.1	Very low	48	Very low	97 Å²	97	86.9 Å²	86.9	63%	0.63	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-59.9	148.4	161.5	28.6	-33.7	0	0	0	108.9	T570	P568-T570 PolarHBondContact O-N 3.41Å; P568-T570 VanDerWaalsContact O-N 3.1Å
569	S	27.1	Very low	46.4	Very low	73 Å²	73	93.5 Å²	93.5	51%	0.51	55%	0.554	S	S	.	*			trans	-53.6	113.9	179.5	36	0	0	0	0	110.9	A571 D572	S569-A571 PolarHBondContact O-N 2.86Å; S569-D572 VanDerWaalsContact CB-OD2 3.23Å; S569-D572 WeakPolarHBondContact CB-OD2 3.44Å; S569-D572 PolarHBondContact OG-OD2 2.9Å
570	T	30.4	Very low	44.8	Very low	132 Å²	132	93.8 Å²	93.8	81%	0.81	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	39	177.4	56.8	0	0	0	0	112.1	P568	P568-T570 PolarHBondContact O-N 3.41Å; P568-T570 VanDerWaalsContact O-N 3.1Å
571	A	28.6	Very low	42.5	Very low	52 Å²	52	101.6 Å²	101.6	43%	0.43	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.7	-49	177.2	0	0	0	0	0	110.2	S569 L573 M574	S569-A571 PolarHBondContact O-N 2.86Å; A571-L573 PolarHBondContact O-N 3.15Å; A571-M574 PolarHBondContact O-N 2.82Å; A571-M574 VanDerWaalsContact O-N 3.17Å
572	D	32.9	Very low	40.1	Very low	105 Å²	105	99.6 Å²	99.6	56%	0.561	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-72.3	-13.4	-171.9	-49	-65.7	0	0	0	113.8	S569	S569-D572 VanDerWaalsContact CB-OD2 3.23Å; S569-D572 WeakPolarHBondContact CB-OD2 3.44Å; S569-D572 PolarHBondContact OG-OD2 2.9Å
573	L	31	Very low	37.5	Very low	165 Å²	165	111.2 Å²	111.2	86%	0.864	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-101.2	15.8	176.3	-99.8	154	0	0	0	114.2	A571	A571-L573 PolarHBondContact O-N 3.15Å
574	M	25.5	Very low	35	Very low	176 Å²	176	115.5 Å²	115.5	87%	0.867	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-109.1	22.4	163.5	-78.5	-164.6	158.1	0	0	113.3	A571 S576	A571-M574 PolarHBondContact O-N 2.82Å; A571-M574 VanDerWaalsContact O-N 3.17Å; M574-S576 PolarHBondContact O-N 3.36Å
575	G	27.1	Very low	32.4	Very low	64 Å²	64	119.3 Å²	119.3	66%	0.66	70%	0.696	S	S	*	*	S	Bend	trans	-89	90.9	174.1	0	0	0	0	0	114.4
576	S	26.8	Very low	30.2	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	73%	0.725	S	S	*	*			trans	50.1	103	160.2	-168.4	0	0	0	0	119.1	M574 N578	M574-S576 PolarHBondContact O-N 3.36Å; S576-N578 PolarHBondContact O-N 2.85Å
577	P	26.1	Very low	28.5	Very low	122 Å²	122	128.9 Å²	128.9	79%	0.792	75%	0.747	S	S	*	*			trans	-80.9	116.9	174	32	-32.1	0	0	0	112.8
578	N	25.7	Very low	27.4	Very low	143 Å²	143	126.8 Å²	126.8	77%	0.765	74%	0.744	S	S	*	*			trans	-163.7	145.2	156.7	-100.6	-41.9	0	0	0	112.4	S576	S576-N578 PolarHBondContact O-N 2.85Å
579	H	29.3	Very low	26.5	Very low	194 Å²	194	128.2 Å²	128.2	90%	0.898	75%	0.75	S	S	*	*	S	Bend	trans	64.3	133.1	-177.5	-54.9	-85	0	0	0	116.9
580	G	26.6	Very low	26.4	Very low	73 Å²	73	130.7 Å²	130.7	75%	0.753	76%	0.763	S	S	*	*			trans	146.7	-11.2	153.6	0	0	0	0	0	121.7
581	N	24.2	Very low	26	Very low	177 Å²	177	133 Å²	133	95%	0.947	76%	0.762	S	S	*	*			trans	25.1	92.3	172	-69.8	-10.7	0	0	0	118.8
582	G	24.4	Very low	25.9	Very low	64 Å²	64	136.9 Å²	136.9	66%	0.66	77%	0.774	S	S	*	*			trans	-170.1	129.4	167.4	0	0	0	0	0	116.2
583	W	25.9	Very low	25.5	Very low	249 Å²	249	138.8 Å²	138.8	94%	0.943	78%	0.784	S	S	*	*			trans	55.6	67	154.6	-58.8	98.4	0	0	0	120.3
584	L	23.3	Very low	25.2	Very low	157 Å²	157	138.8 Å²	138.8	82%	0.822	78%	0.777	S	S	*	*			trans	-137.5	110.5	148.3	-85	179.7	0	0	0	111.8
585	P	24.6	Very low	25.3	Very low	106 Å²	106	138.8 Å²	138.8	69%	0.688	77%	0.774	S	S	*	*			trans	-95	99.3	163.6	33.3	-26.8	0	0	0	110.5	V587	P585-V587 PolarHBondContact O-N 3.35Å
586	N	24.4	Very low	25.2	Very low	136 Å²	136	138.5 Å²	138.5	73%	0.727	77%	0.772	S	S	*	*			trans	-63	106.7	170.4	-79.3	-30	0	0	0	110.5	N588	N586-N588 PolarHBondContact O-N 3.43Å
587	V	25.9	Very low	25.1	Very low	137 Å²	137	137.7 Å²	137.7	83%	0.83	77%	0.766	S	S	*	*			trans	-78.2	74.9	170.4	-174.7	0	0	0	0	109.2	P585 V589	P585-V587 PolarHBondContact O-N 3.35Å; V587-V589 PolarHBondContact O-N 2.82Å
588	N	24.4	Very low	25.1	Very low	135 Å²	135	136.6 Å²	136.6	72%	0.722	76%	0.758	S	S	*	*			trans	-65.4	125.2	170.8	-92.7	-19.6	0	0	0	110.3	N586 T590	N586-N588 PolarHBondContact O-N 3.43Å; N588-T590 PolarHBondContact O-N 3.35Å; N588-T590 VanDerWaalsContact O-N 3.13Å
589	V	23.2	Very low	25.1	Very low	127 Å²	127	134.2 Å²	134.2	77%	0.77	75%	0.748	S	S	*	*			trans	-77.1	96.7	174	-180	0	0	0	0	109.3	V587	V587-V589 PolarHBondContact O-N 2.82Å
590	T	23.4	Very low	24.9	Very low	125 Å²	125	128.2 Å²	128.2	77%	0.767	73%	0.728	S	S	*	*			trans	-131.6	138.3	167.9	49.9	0	0	0	0	111.3	N588	N588-T590 PolarHBondContact O-N 3.35Å; N588-T590 VanDerWaalsContact O-N 3.13Å
591	F	23.8	Very low	25	Very low	181 Å²	181	130.5 Å²	130.5	79%	0.794	72%	0.719	S	S	*	*			trans	-86	160.2	-174.2	-90.3	-108.8	0	0	0	113.8
592	I	24.6	Very low	25.3	Very low	132 Å²	132	126.8 Å²	126.8	68%	0.677	70%	0.704	S	S	*	*			trans	-49.7	130	170.6	-67	159.1	0	0	0	111.4
593	N	26.1	Very low	25.5	Very low	146 Å²	146	129.7 Å²	129.7	78%	0.781	71%	0.709	S	S	*	*				-158.4	169	104.7	-128.8	-34.7	0	0	0	116.2
594	K	24.6	Very low	25.6	Very low	164 Å²	164	124.7 Å²	124.7	71%	0.713	70%	0.701	S	S	*	*			trans	-81.9	166.4	-162.9	-59.9	171.9	172.6	177.6	0	115.9
595	H	26.4	Very low	25.6	Very low	176 Å²	176	122.7 Å²	122.7	82%	0.815	70%	0.7	S	S	*	*			trans	77.4	122	153.7	-66.6	-71.6	0	0	0	120.1
596	G	25.8	Very low	25.7	Very low	59 Å²	59	127 Å²	127	61%	0.608	71%	0.708	S	S	*	*			trans	111.4	106.4	147	0	0	0	0	0	118
597	S	24.4	Very low	25.7	Very low	89 Å²	89	126.1 Å²	126.1	62%	0.622	71%	0.708	S	S	*	*			trans	28	141.1	131.6	43.9	0	0	0	0	121.6	K639	S597-K639 PolarHBondContact O-NZ 2.93Å
598	T	25.2	Very low	25.7	Very low	99 Å²	99	127.2 Å²	127.2	61%	0.607	71%	0.707	S	S	*	*			cis	-178.7	132.8	-5.3	23.7	0	0	0	0	110.3	E640	T598-E640 VanDerWaalsContact CA-OE1 3.27Å; T598-E640 WeakPolarHBondContact CA-OE1 3.41Å; T598-E640 PolarHBondContact N-OE1 3.17Å; T598-E640 PolarHBondContact N-OE2 3.14Å
599	V	26.4	Very low	25.7	Very low	92 Å²	92	129.5 Å²	129.5	56%	0.558	71%	0.706	S	S	*	*			trans	67	133.3	136.2	178.9	0	0	0	0	119.4	E640	V599-E640 PolarHBondContact N-OE1 3.44Å
600	S	26.1	Very low	25.8	Very low	69 Å²	69	128 Å²	128	48%	0.483	70%	0.701	S	S	.	*			trans	-179.7	178.3	154.3	-82.1	0	0	0	0	110.9	L641 V642	S600-L641 WeakPolarHBondContact O-CA 3.33Å; S600-L641 WeakPolarHBondContact O-CB 3.39Å; S600-V642 WeakPolarHBondContact O-CA 3.19Å
601	E	28.3	Very low	25.9	Very low	120 Å²	120	125.7 Å²	125.7	56%	0.561	70%	0.702	S	S	*	*			trans	-155.4	126.4	176.6	-169.5	154.4	-54.4	0	0	110.1	V642	E601-V642 HydrophobicContact CB-CG2 3.96Å; E601-V642 HydrophobicContact CG-CG2 3.52Å; E601-V642 WeakPolarHBondContact OE1-CG2 3.29Å
602	P	29.9	Very low	26.1	Very low	99 Å²	99	124 Å²	124	64%	0.643	70%	0.701	S	S	*	*				-147.7	-135.3	106.4	42.9	-24.8	0	0	0	114.2
603	V	27.8	Very low	26.2	Very low	125 Å²	125	124.3 Å²	124.3	76%	0.758	70%	0.703	S	S	*	*			trans	-151.8	171.6	-149.6	161.4	0	0	0	0	112.8
604	D	28.3	Very low	26.2	Very low	145 Å²	145	123.9 Å²	123.9	78%	0.775	70%	0.7	S	S	*	*			trans	-32.7	153.9	173.8	-54.8	-57.3	0	0	0	120.2
605	S	25	Very low	26.3	Very low	115 Å²	115	123.8 Å²	123.8	80%	0.804	71%	0.707	S	S	*	*				-177.8	127.3	113.4	38.5	0	0	0	0	117.1
606	K	25.3	Very low	26.3	Very low	196 Å²	196	121.7 Å²	121.7	85%	0.852	70%	0.702	S	S	*	*			trans	41.6	149.9	144	-67.3	-177.5	178	175.3	0	124.6
607	T	24.5	Very low	26.3	Very low	118 Å²	118	124.9 Å²	124.9	72%	0.724	71%	0.709	S	S	*	*			trans	88.1	127.3	141.9	27.1	0	0	0	0	123.5
608	I	25.5	Very low	26.3	Very low	159 Å²	159	125.3 Å²	125.3	82%	0.815	71%	0.713	S	S	*	*			trans	74.8	145.6	145.2	-67.2	162.9	0	0	0	118.5
609	R	24.8	Very low	26.3	Very low	183 Å²	183	127.9 Å²	127.9	69%	0.691	72%	0.723	S	S	*	*			cis	-171.9	142.7	-35.3	-157.2	-169.8	-165.8	179.6	5.9	109.8
610	S	25.6	Very low	26.2	Very low	96 Å²	96	132.8 Å²	132.8	67%	0.671	74%	0.737	S	S	*	*			trans	60	119.5	156	-66.1	0	0	0	0	123.6
611	G	26.2	Very low	26.1	Very low	76 Å²	76	134.7 Å²	134.7	78%	0.784	75%	0.75	S	S	*	*			trans	86.3	162.8	134.3	0	0	0	0	0	119.6
612	N	26.8	Very low	26	Very low	147 Å²	147	135.4 Å²	135.4	79%	0.786	76%	0.756	S	S	*	*			cis	-167.4	159.5	-15.5	-147.2	7.2	0	0	0	111
613	I	26.3	Very low	25.9	Very low	138 Å²	138	137.1 Å²	137.1	71%	0.708	76%	0.759	S	S	*	*			trans	65	105	160.9	-61.4	164.4	0	0	0	115.3
614	L	27.2	Very low	26	Very low	137 Å²	137	136.3 Å²	136.3	72%	0.717	76%	0.757	S	S	*	*				73.8	116.3	73.4	-173	87.8	0	0	0	114.9
615	N	25.9	Very low	26	Very low	161 Å²	161	135.7 Å²	135.7	86%	0.861	76%	0.762	S	S	*	*			trans	-158.6	139.2	137.5	-107.6	-17.6	0	0	0	113.5
616	N	26.4	Very low	26.1	Very low	132 Å²	132	136.5 Å²	136.5	71%	0.706	76%	0.762	S	S	*	*			trans	-81.6	170.6	171.8	-79.3	-12.6	0	0	0	110
617	T	25.9	Very low	26.1	Very low	126 Å²	126	134.1 Å²	134.1	77%	0.773	76%	0.758	S	S	*	*			cis	-173	143.8	-8.8	25.1	0	0	0	0	107.1
618	S	24.6	Very low	26.1	Very low	99 Å²	99	135 Å²	135	69%	0.692	76%	0.759	S	S	*	*			trans	-160.1	159.5	138.7	76.7	0	0	0	0	112.4
619	D	26.1	Very low	26.3	Very low	153 Å²	153	132.6 Å²	132.6	82%	0.818	75%	0.753	S	S	*	*			trans	66.4	147.2	159.1	-50.2	-48.8	0	0	0	120.6
620	K	24.5	Very low	26.3	Very low	195 Å²	195	127.1 Å²	127.1	85%	0.848	75%	0.753	S	S	*	*			trans	-116.8	162.6	-166.3	-61.2	174.5	179.5	175.6	0	110.5
621	S	23.9	Very low	26.2	Very low	108 Å²	108	127.2 Å²	127.2	76%	0.755	75%	0.754	S	S	*	*			trans	75.3	153	149.7	86.2	0	0	0	0	116.7
622	I	25.3	Very low	26.2	Very low	136 Å²	136	130.7 Å²	130.7	70%	0.697	75%	0.753	S	S	*	*			cis	-158.5	133.9	-14.4	-118.6	170.7	0	0	0	109.5
623	L	27.3	Very low	26	Very low	135 Å²	135	127.5 Å²	127.5	71%	0.707	74%	0.742	S	S	*	*			trans	42.6	-148.1	157.7	-76.6	82.8	0	0	0	115.6
624	P	31.2	Very low	25.9	Very low	108 Å²	108	126.8 Å²	126.8	70%	0.701	74%	0.74	S	S	*	*			cis	-113.2	173.5	-45.2	10.9	11.7	0	0	0	112.8
625	C	28.2	Very low	25.9	Very low	132 Å²	132	127.2 Å²	127.2	89%	0.892	74%	0.742	S	S	*	*			trans	-139.9	102.1	166.9	-64.7	0	0	0	0	112.4
626	T	26.7	Very low	26	Very low	131 Å²	131	125.2 Å²	125.2	80%	0.804	73%	0.73	S	S	*	*			trans	-90.3	-174.3	142.3	46.9	0	0	0	0	109
627	L	25.9	Very low	25.9	Very low	146 Å²	146	125.1 Å²	125.1	76%	0.764	73%	0.734	S	S	*	*			trans	-8.5	146.4	154.7	-65.8	156.1	0	0	0	116.6
628	N	24	Very low	26	Very low	138 Å²	138	124.2 Å²	124.2	74%	0.738	73%	0.733	S	S	*	*			cis	-158.3	-158.5	32.8	-132.5	-18.8	0	0	0	112.4
629	P	29.5	Very low	26.1	Very low	108 Å²	108	126.4 Å²	126.4	70%	0.701	73%	0.73	S	S	*	*			trans	-106.1	155.9	-148	42.2	-31.4	0	0	0	115.5
630	G	24.1	Very low	26.1	Very low	67 Å²	67	123.2 Å²	123.2	69%	0.691	71%	0.711	S	S	*	*			trans	64	92.5	135.8	0	0	0	0	0	118.6
631	S	24.5	Very low	26.2	Very low	98 Å²	98	117.8 Å²	117.8	69%	0.685	69%	0.691	S	S	*	*				-160.5	130.9	122	-81.4	0	0	0	0	108
632	I	25.2	Very low	26.4	Very low	149 Å²	149	116.8 Å²	116.8	76%	0.764	68%	0.679	S	S	*	*				57.9	102.5	58.8	-56.1	175	0	0	0	107.8
633	S	23.7	Very low	26.6	Very low	80 Å²	80	114.9 Å²	114.9	56%	0.559	67%	0.674	S	S	*	*			cis	-175.3	173	27.3	47.3	0	0	0	0	110.8
634	N	24.4	Very low	26.5	Very low	123 Å²	123	116.1 Å²	116.1	66%	0.658	68%	0.677	S	S	*	*			trans	68.4	153.1	161.6	-51.9	-32.1	0	0	0	115
635	L	26.4	Very low	26.3	Very low	146 Å²	146	119.1 Å²	119.1	76%	0.764	68%	0.681	S	S	*	*			cis	-137.4	123.1	5	-156.8	71	0	0	0	105.6
636	I	27.4	Very low	26.5	Very low	120 Å²	120	118.8 Å²	118.8	62%	0.615	67%	0.669	S	S	*	*				68.8	139.2	62.3	-58.8	172.9	0	0	0	112.3
637	T	25.8	Very low	26.6	Very low	129 Å²	129	114.7 Å²	114.7	79%	0.791	64%	0.644	S	S	*	*			trans	80.4	132.3	-170.8	72.2	0	0	0	0	114.8
638	S	26.9	Very low	26.7	Very low	108 Å²	108	112.2 Å²	112.2	76%	0.755	63%	0.631	S	S	*	*			cis	-133.4	132.3	-4.6	50.5	0	0	0	0	109.3
639	K	27.7	Very low	27	Very low	144 Å²	144	112.1 Å²	112.1	63%	0.626	63%	0.629	S	S	*	*				55.9	130.8	61.1	-93.6	-176.7	170.3	-100.2	0	112.2	S597	S597-K639 PolarHBondContact O-NZ 2.93Å
640	E	26.5	Very low	27	Very low	87 Å²	87	113.3 Å²	113.3	41%	0.407	63%	0.628	S	S	.	*			cis	-147.6	-115.2	-5.3	-162.3	172.9	136.6	0	0	108.7	T598 V599	T598-E640 VanDerWaalsContact CA-OE1 3.27Å; T598-E640 WeakPolarHBondContact CA-OE1 3.41Å; T598-E640 PolarHBondContact N-OE1 3.17Å; T598-E640 PolarHBondContact N-OE2 3.14Å; V599-E640 PolarHBondContact N-OE1 3.44Å
641	L	26	Very low	27.1	Very low	81 Å²	81	113.9 Å²	113.9	42%	0.424	62%	0.616	S	S	.	*			trans	73.3	157.6	179.9	-51	63.3	0	0	0	112.2	S600	S600-L641 WeakPolarHBondContact O-CA 3.33Å; S600-L641 WeakPolarHBondContact O-CB 3.39Å
642	V	27.5	Very low	27.3	Very low	86 Å²	86	118.6 Å²	118.6	52%	0.521	62%	0.619	S	S	.	*			cis	-138.4	140	-3.8	58	0	0	0	0	110	S600 E601	S600-V642 WeakPolarHBondContact O-CA 3.19Å; E601-V642 HydrophobicContact CB-CG2 3.96Å; E601-V642 HydrophobicContact CG-CG2 3.52Å; E601-V642 WeakPolarHBondContact OE1-CG2 3.29Å
643	T	28.9	Very low	27.2	Very low	97 Å²	97	119.2 Å²	119.2	60%	0.595	62%	0.618	S	S	*	*			trans	-152.6	96.5	-179.4	45.5	0	0	0	0	116.2
644	Q	25.3	Very low	27.3	Very low	161 Å²	161	123.1 Å²	123.1	75%	0.752	63%	0.627	S	S	*	*	S	Bend	trans	-141.4	-32.9	154.9	-110.7	179.2	25.4	0	0	116.9
645	H	28.2	Very low	27.2	Very low	170 Å²	170	122.8 Å²	122.8	79%	0.787	63%	0.63	S	S	*	*	S	Bend	trans	-83.2	-35.6	-165.4	-124.8	72.2	0	0	0	117.2	T647	H645-T647 PolarHBondContact O-N 3.49Å
646	I	31.5	Very low	27	Very low	126 Å²	126	119.5 Å²	119.5	65%	0.646	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	42.7	-171.1	-39.6	-176.5	0	0	0	112.9	R1065	I646-R1065 VanDerWaalsContact C-NH2 3.28Å; I646-R1065 PolarHBondContact O-NE 3.09Å; I646-R1065 PolarHBondContact O-NH2 3.18Å
647	T	28.6	Very low	26.8	Very low	45 Å²	45	119 Å²	119	28%	0.276	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94	-21	165.8	-52.5	0	0	0	0	110.7	H645 S1064 R1065	H645-T647 PolarHBondContact O-N 3.49Å; T647-S1064 VanDerWaalsContact CG2-OG 3.29Å; T647-S1064 WeakPolarHBondContact CG2-OG 3.19Å; T647-S1064 WeakPolarHBondContact O-CB 3.38Å; T647-R1065 HydrophobicContact CG2-CG 4.49Å; T647-R1065 PolarHBondContact OG1-NH1 2.87Å; T647-R1065 VanDerWaalsContact OG1-NH1 3.14Å; T647-R1065 PolarHBondContact OG1-NH2 3.4Å
648	N	29.2	Very low	26.7	Very low	94 Å²	94	117.9 Å²	117.9	50%	0.503	60%	0.6	S	S	.	*	S	Bend	trans	-95	3.5	-160.9	-106.4	-32.5	0	0	0	116.8	K1063	N648-K1063 WeakPolarHBondContact O-CE 3.14Å; N648-K1063 PolarHBondContact O-NZ 3.17Å; N648-K1063 WeakPolarHBondContact OD1-CD 3.14Å; N648-K1063 PolarHBondContact OD1-NZ 2.9Å
649	I	30.4	Very low	26.6	Very low	135 Å²	135	119.4 Å²	119.4	69%	0.692	60%	0.595	S	S	*	*	S	Bend	trans	-107.5	-29.9	-169.9	-61.8	179.3	0	0	0	113.7	N651	I649-N651 PolarHBondContact O-N 2.95Å
650	I	29	Very low	26.5	Very low	133 Å²	133	116.9 Å²	116.9	68%	0.682	59%	0.591	S	S	*	*	S	Bend	trans	-82.7	27.4	-173.8	-59.6	169.1	0	0	0	112.3
651	N	26.8	Very low	26.8	Very low	79 Å²	79	117 Å²	117	42%	0.422	60%	0.599	S	S	.	*			trans	-164.8	84.7	172.7	-104.3	-12.4	0	0	0	110.9	I649 K1063	I649-N651 PolarHBondContact O-N 2.95Å; N651-K1063 HydrophobicContact CB-CB 4.15Å; N651-K1063 HydrophobicContact CB-CG 3.62Å; N651-K1063 VanDerWaalsContact O-CE 3.23Å; N651-K1063 WeakPolarHBondContact O-CE 3.26Å; N651-K1063 WeakPolarHBondContact O-CG 3.49Å
652	R	27.1	Very low	26.6	Very low	198 Å²	198	123.7 Å²	123.7	75%	0.747	62%	0.621	S	S	*	*			trans	-131.9	123.8	146.1	-112.3	-171.3	-177.8	-174.5	0	108.5	F1062	R652-F1062 HydrophobicContact CG-CE1 3.79Å
653	Q	24.3	Very low	26.4	Very low	162 Å²	162	124.7 Å²	124.7	76%	0.757	63%	0.631	S	S	*	*			trans	-79.3	162.3	174	-72	157.8	-79.5	0	0	110.3
654	H	24.9	Very low	26.2	Very low	161 Å²	161	123.6 Å²	123.6	75%	0.745	63%	0.632	S	S	*	*			trans	75.8	140.9	143	-86	-138.2	0	0	0	121.4
655	T	22.7	Very low	26.3	Very low	117 Å²	117	121.3 Å²	121.3	72%	0.718	63%	0.634	S	S	*	*			trans	69.9	122.6	140.9	51.4	0	0	0	0	122.3
656	S	23.1	Very low	26.3	Very low	76 Å²	76	118 Å²	118	53%	0.531	63%	0.63	S	S	.	*			trans	96.2	115.1	131.7	-69.5	0	0	0	0	122
657	Q	23	Very low	26.2	Very low	111 Å²	111	116.9 Å²	116.9	52%	0.519	63%	0.625	S	S	.	*				69.8	105.6	125.2	-65.2	169.9	-75.3	0	0	120.9	C1013	Q657-C1013 PolarHBondContact O-SG 3.27Å; Q657-C1013 VanDerWaalsContact O-SG 3.38Å
658	Q	23.1	Very low	26.4	Very low	105 Å²	105	120 Å²	120	49%	0.491	64%	0.64	S	S	.	*			trans	64.5	139.2	137.2	-67.7	149.6	-89.3	0	0	118	P1012 C1013	Q658-P1012 VanDerWaalsContact CB-O 3.31Å; Q658-P1012 WeakPolarHBondContact CB-O 3.43Å; Q658-P1012 PolarHBondContact NE2-O 2.66Å; Q658-P1012 PolarHBondContact OE1-O 2.84Å; Q658-C1013 HydrophobicContact CB-CB 4.42Å; Q658-C1013 WeakPolarHBondContact O-CB 3.24Å; Q658-C1013 PolarHBondContact O-SG 2.97Å
659	H	24.6	Very low	26.7	Very low	139 Å²	139	122.9 Å²	122.9	64%	0.644	65%	0.654	S	S	*	*				-169.8	153.6	118.1	-156	-95.7	0	0	0	107.5	C1013	H659-C1013 HydrophobicContact CB-CB 3.94Å
660	V	25.1	Very low	26.9	Very low	92 Å²	92	122.1 Å²	122.1	56%	0.558	65%	0.651	S	S	*	*			trans	-122	-173.1	-179.6	-145.3	0	0	0	0	108.8
661	P	32.6	Very low	27.5	Very low	89 Å²	89	120.1 Å²	120.1	58%	0.578	64%	0.639	S	S	*	*				-103.9	-152.6	-111.2	40.7	-26.7	0	0	0	113.7
662	Y	22.2	Very low	28.2	Very low	222 Å²	222	120.4 Å²	120.4	87%	0.871	65%	0.648	S	S	*	*			trans	77.5	151	-175.8	-55.6	-80.4	0	0	0	113.9
663	S	24.1	Very low	29.4	Very low	106 Å²	106	118 Å²	118	74%	0.741	65%	0.65	S	S	*	*			cis	-148.1	164.7	15.3	67.6	0	0	0	0	114.4
664	A	24.7	Very low	31.1	Very low	75 Å²	75	118.3 Å²	118.3	62%	0.62	64%	0.644	S	S	*	*			trans	60.4	107.1	145.6	0	0	0	0	0	121.8
665	S	26.1	Very low	33.2	Very low	112 Å²	112	115.3 Å²	115.3	78%	0.783	63%	0.626	S	S	*	*			trans	34.6	93.9	131	60.8	0	0	0	0	119.4
666	S	28.2	Very low	35.8	Very low	101 Å²	101	111 Å²	111	71%	0.706	60%	0.598	S	S	*	*			trans	-169.4	-0.7	161.9	63.4	0	0	0	0	116.2
667	N	29.6	Very low	38.2	Very low	102 Å²	102	113.6 Å²	113.6	55%	0.545	60%	0.596	S	S	.	*			trans	-117	-2.2	-162.6	-81.7	-51.3	0	0	0	115.7	I669 N670	N667-I669 VanDerWaalsContact C-N 3.34Å; N667-I669 PolarHBondContact O-N 3.11Å; N667-N670 PolarHBondContact O-N 3.41Å
668	D	33.6	Very low	41	Very low	110 Å²	110	109.3 Å²	109.3	59%	0.588	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-69.3	-30.8	-162.7	-51.5	-71.3	0	0	0	113.3	N670 Q671	D668-N670 PolarHBondContact O-N 3.41Å; D668-N670 VanDerWaalsContact O-N 3.16Å; D668-Q671 PolarHBondContact O-N 2.85Å; D668-Q671 VanDerWaalsContact O-N 3.1Å
669	I	36.2	Very low	44.1	Very low	155 Å²	155	104.5 Å²	104.5	80%	0.795	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-60.6	-26.1	177.3	-57.6	175.5	0	0	0	112.3	N667 S672	N667-I669 VanDerWaalsContact C-N 3.34Å; N667-I669 PolarHBondContact O-N 3.11Å; I669-S672 PolarHBondContact O-OG 3.08Å
670	N	34.7	Very low	47.2	Very low	119 Å²	119	100.9 Å²	100.9	64%	0.636	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-94.2	0.2	179.7	-81	-44.1	0	0	0	114.3	N667 D668	N667-N670 PolarHBondContact O-N 3.41Å; D668-N670 PolarHBondContact O-N 3.41Å; D668-N670 VanDerWaalsContact O-N 3.16Å
671	Q	39.9	Very low	50.4	Low	92 Å²	92	96.7 Å²	96.7	43%	0.43	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-31.9	179.6	-66.3	-167.7	31.6	0	0	113.7	D668 N673 R674	D668-Q671 PolarHBondContact O-N 2.85Å; D668-Q671 VanDerWaalsContact O-N 3.1Å; Q671-N673 PolarHBondContact O-N 3.18Å; Q671-R674 PolarHBondContact O-N 3.41Å; Q671-R674 VanDerWaalsContact O-N 3.13Å
672	S	42.8	Very low	53.1	Low	85 Å²	85	93.6 Å²	93.6	59%	0.594	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-52.2	-41.3	178.1	53.2	0	0	0	0	112.8	I669 R674	I669-S672 PolarHBondContact O-OG 3.08Å; S672-R674 PolarHBondContact O-N 3.2Å
673	N	51.1	Low	56.4	Low	148 Å²	148	83.1 Å²	83.1	79%	0.791	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-69.1	5	-179.1	-106.4	-41.3	0	0	0	115.9	Q671	Q671-N673 PolarHBondContact O-N 3.18Å
674	R	60.1	Low	59.7	Low	167 Å²	167	78 Å²	78	63%	0.63	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-109.3	-21.5	-179.3	-62.2	-167.3	-173.6	-147.9	3.4	115.3	Q671 S672	Q671-R674 PolarHBondContact O-N 3.41Å; Q671-R674 VanDerWaalsContact O-N 3.13Å; S672-R674 PolarHBondContact O-N 3.2Å
675	Y	69.6	Low	62.9	Low	98 Å²	98	74.9 Å²	74.9	38%	0.384	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-103.3	140.8	-175.4	-58.7	-64.7	0	0	0	110	Q508	Q508-Y675 VanDerWaalsContact O-CD1 3.25Å; Q508-Y675 WeakPolarHBondContact O-CD1 3.5Å
676	F	76.7	Confident	65.9	Low	28 Å²	28	69.5 Å²	69.5	12%	0.123	35%	0.345	C	S	.	.			trans	-76.9	138.3	169.9	-62.6	-72.2	0	0	0	109.7	L511 R513 L516 L545 Y564 E682	L511-F676 HydrophobicContact CD2-CD2 4.09Å; L511-F676 HydrophobicContact CD2-CE2 4.49Å; L511-F676 HydrophobicContact CG-CD2 4.04Å; L511-F676 HydrophobicContact CG-CE2 4.21Å; L511-F676 VanDerWaalsContact O-CD2 3.29Å; L511-F676 WeakPolarHBondContact O-CD2 3.37Å; R513-F676 HydrophobicContact CB-CZ 4.26Å; R513-F676 HydrophobicContact CG-CZ 4.48Å; L516-F676 HydrophobicContact CB-CE2 4.06Å; L516-F676 HydrophobicContact CB-CZ 4.25Å; L516-F676 HydrophobicContact CD2-CE1 4.49Å; L516-F676 HydrophobicContact CD2-CE2 3.86Å; L516-F676 HydrophobicContact CD2-CZ 3.67Å; L545-F676 HydrophobicContact CD1-CZ 4.2Å; Y564-F676 HydrophobicContact CE1-CE1 4.08Å; F676-E682 HydrophobicContact CB-CG 3.88Å; F676-E682 HydrophobicContact CD1-CG 3.75Å; F676-E682 WeakPolarHBondContact CD1-OE1 3.17Å; F676-E682 HydrophobicContact CD2-CG 4.32Å; F676-E682 HydrophobicContact CE1-CG 4.32Å; F676-E682 HydrophobicContact CG-CB 4.45Å; F676-E682 HydrophobicContact CG-CG 3.75Å
677	R	73.8	Confident	68.9	Low	130 Å²	130	64.7 Å²	64.7	49%	0.491	31%	0.312	S	S	.	.	S	Bend	trans	-64.9	-46.9	175.7	-177.3	173.1	174	-176.7	-5.1	111.2	P679	R677-P679 VanDerWaalsContact C-CD 3.45Å; R677-P679 WeakPolarHBondContact O-CD 3.47Å
678	Y	82.4	Confident	71.7	Confident	20 Å²	20	60 Å²	60	8%	0.078	29%	0.286	C	S	.	.	S	Bend	trans	-113.2	69.7	-177.8	-57	-77.4	0	0	0	111.1	Y680 T681 E682 E704 E705 A773	Y678-Y680 VanDerWaalsContact C-N 3.27Å; Y678-Y680 PolarHBondContact O-N 3.11Å; Y678-T681 WeakPolarHBondContact O-CB 3.22Å; Y678-T681 PolarHBondContact O-N 3.38Å; Y678-E682 WeakPolarHBondContact O-CG 3.14Å; Y678-E682 PolarHBondContact O-N 2.94Å; Y678-E704 HydrophobicContact CD1-CB 4.25Å; Y678-E704 HydrophobicContact CE1-CB 4.18Å; Y678-E704 WeakPolarHBondContact CE1-OE2 3.44Å; Y678-E705 HydrophobicContact CE1-CG 4.34Å; Y678-A773 HydrophobicContact CD2-CB 3.95Å; Y678-A773 HydrophobicContact CE2-CB 4.22Å
679	P	88	Confident	74.3	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.032	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-29.3	-170.6	28	-37.9	0	0	0	113.6	I507 Q508 L511 R677 E682 L683	I507-P679 HydrophobicContact CG1-CB 4.27Å; I507-P679 HydrophobicContact CG2-CB 4.29Å; I507-P679 HydrophobicContact CG2-CG 3.74Å; Q508-P679 HydrophobicContact CB-CG 4.49Å; Q508-P679 HydrophobicContact CG-CG 3.77Å; L511-P679 HydrophobicContact CB-CB 4.32Å; L511-P679 HydrophobicContact CD2-CB 3.95Å; L511-P679 WeakPolarHBondContact CD2-O 3.39Å; R677-P679 VanDerWaalsContact C-CD 3.45Å; R677-P679 WeakPolarHBondContact O-CD 3.47Å; P679-E682 PolarHBondContact O-N 2.91Å; P679-L683 WeakPolarHBondContact O-CB 3.27Å; P679-L683 PolarHBondContact O-N 3.4Å
680	Y	90.5	Very high	76.5	Confident	62 Å²	62	47.5 Å²	47.5	24%	0.243	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-40.4	173.9	-68	-70.1	0	0	0	111.7	I507 Y678 L683 L684 L699 A702	I507-Y680 HydrophobicContact CB-CE1 4.43Å; I507-Y680 HydrophobicContact CG1-CE1 4.45Å; I507-Y680 HydrophobicContact CG2-CD2 4.25Å; I507-Y680 HydrophobicContact CG2-CE1 3.98Å; I507-Y680 HydrophobicContact CG2-CE2 3.68Å; Y678-Y680 VanDerWaalsContact C-N 3.27Å; Y678-Y680 PolarHBondContact O-N 3.11Å; Y680-L683 PolarHBondContact O-N 3.38Å; Y680-L684 VanDerWaalsContact O-CB 3.27Å; Y680-L684 WeakPolarHBondContact O-CB 3.48Å; Y680-L684 PolarHBondContact O-N 2.99Å; Y680-L699 HydrophobicContact CD1-CD2 3.92Å; Y680-A702 VanDerWaalsContact CB-O 3.28Å; Y680-A702 WeakPolarHBondContact CB-O 3.49Å; Y680-A702 HydrophobicContact CD1-CB 3.64Å; Y680-A702 WeakPolarHBondContact CD2-O 3.48Å; Y680-A702 HydrophobicContact CE1-CB 3.82Å; Y680-A702 HydrophobicContact CG-CB 4.02Å; Y680-A702 VanDerWaalsContact CG-O 3.3Å
681	T	90.9	Very high	78.7	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-38.4	177.5	-49.7	0	0	0	0	112.4	Y678 L684 Q685 K709 F774	Y678-T681 WeakPolarHBondContact O-CB 3.22Å; Y678-T681 PolarHBondContact O-N 3.38Å; T681-L684 PolarHBondContact O-N 3.47Å; T681-Q685 WeakPolarHBondContact O-CG 3.49Å; T681-Q685 PolarHBondContact O-N 2.93Å; T681-Q685 VanDerWaalsContact O-N 3.1Å; T681-Q685 PolarHBondContact O-NE2 3.15Å; T681-K709 VanDerWaalsContact OG1-CE 3.23Å; T681-K709 WeakPolarHBondContact OG1-CE 3.43Å; T681-F774 HydrophobicContact CG2-CE1 3.98Å; T681-F774 HydrophobicContact CG2-CE2 4.44Å; T681-F774 HydrophobicContact CG2-CZ 3.59Å
682	E	90.5	Very high	80.9	Confident	24 Å²	24	40.1 Å²	40.1	11%	0.112	18%	0.181	C	C	.	.	H	α-helix	trans	-70.4	-34.4	176.4	-52.1	-75.2	-146.7	0	0	111.7	L511 L516 Y564 F676 Y678 P679 Q685 W686	L511-E682 HydrophobicContact CD2-CB 4.08Å; L516-E682 HydrophobicContact CD2-CB 4.06Å; Y564-E682 WeakPolarHBondContact CE1-OE1 3.41Å; Y564-E682 WeakPolarHBondContact CE1-OE2 3.27Å; Y564-E682 VanDerWaalsContact CZ-OE2 3.23Å; Y564-E682 PolarHBondContact OH-OE2 3.4Å; F676-E682 HydrophobicContact CB-CG 3.88Å; F676-E682 HydrophobicContact CD1-CG 3.75Å; F676-E682 WeakPolarHBondContact CD1-OE1 3.17Å; F676-E682 HydrophobicContact CD2-CG 4.32Å; F676-E682 HydrophobicContact CE1-CG 4.32Å; F676-E682 HydrophobicContact CG-CB 4.45Å; F676-E682 HydrophobicContact CG-CG 3.75Å; Y678-E682 WeakPolarHBondContact O-CG 3.14Å; Y678-E682 PolarHBondContact O-N 2.94Å; P679-E682 PolarHBondContact O-N 2.91Å; E682-Q685 PolarHBondContact OE2-NE2 2.91Å; E682-Q685 VanDerWaalsContact OE2-NE2 3.08Å; E682-W686 PolarHBondContact O-N 3.28Å
683	L	91.4	Very high	83	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-74	-36.8	174.2	-170	65	0	0	0	111.9	L489 I507 L511 L519 P679 Y680 W686 T687 L699	L489-L683 HydrophobicContact CD1-CD1 4.07Å; L489-L683 HydrophobicContact CD1-CD2 4.41Å; L489-L683 HydrophobicContact CD2-CD1 4.29Å; L489-L683 HydrophobicContact CD2-CD2 4.08Å; I507-L683 HydrophobicContact CD1-CD2 4.27Å; L511-L683 HydrophobicContact CD1-CD1 4.44Å; L511-L683 HydrophobicContact CD2-CB 4.27Å; L519-L683 HydrophobicContact CD1-CD1 4.4Å; P679-L683 WeakPolarHBondContact O-CB 3.27Å; P679-L683 PolarHBondContact O-N 3.4Å; Y680-L683 PolarHBondContact O-N 3.38Å; L683-W686 HydrophobicContact CD1-CD2 4.43Å; L683-W686 HydrophobicContact CD1-CE3 3.64Å; L683-W686 HydrophobicContact CD1-CZ3 4.15Å; L683-W686 HydrophobicContact CG-CE3 4.45Å; L683-W686 WeakPolarHBondContact O-CB 3.17Å; L683-W686 PolarHBondContact O-N 3.04Å; L683-W686 VanDerWaalsContact O-N 3.13Å; L683-T687 PolarHBondContact O-N 3.06Å; L683-L699 HydrophobicContact CB-CD1 4.26Å; L683-L699 HydrophobicContact CD2-CD1 3.98Å; L683-L699 HydrophobicContact CD2-CD2 3.92Å; L683-L699 HydrophobicContact CG-CD1 3.79Å
684	L	92.5	Very high	84.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-58.2	-48.8	173.5	175.2	62.1	0	0	0	111	Y680 T681 W686 T687 L688 A696 L699 V700 K709	Y680-L684 VanDerWaalsContact O-CB 3.27Å; Y680-L684 WeakPolarHBondContact O-CB 3.48Å; Y680-L684 PolarHBondContact O-N 2.99Å; T681-L684 PolarHBondContact O-N 3.47Å; L684-W686 PolarHBondContact O-N 3.04Å; L684-T687 WeakPolarHBondContact CA-OG1 3.35Å; L684-T687 PolarHBondContact O-N 3.3Å; L684-T687 VanDerWaalsContact O-N 3.11Å; L684-T687 PolarHBondContact O-OG1 2.87Å; L684-L688 HydrophobicContact CD1-CD1 3.96Å; L684-L688 HydrophobicContact CD1-CG 4.1Å; L684-L688 HydrophobicContact CG-CD1 3.96Å; L684-L688 WeakPolarHBondContact O-CG 3.43Å; L684-L688 PolarHBondContact O-N 3.25Å; L684-A696 HydrophobicContact CD1-CB 3.8Å; L684-L699 HydrophobicContact CB-CB 4.22Å; L684-L699 HydrophobicContact CD1-CB 4.15Å; L684-V700 HydrophobicContact CD1-CG2 3.84Å; L684-V700 HydrophobicContact CD2-CG2 3.86Å; L684-K709 HydrophobicContact CD2-CB 3.75Å; L684-K709 HydrophobicContact CD2-CD 4.24Å; L684-K709 HydrophobicContact CD2-CG 3.85Å
685	Q	91.3	Very high	86.2	Confident	8 Å²	8	26.9 Å²	26.9	4%	0.037	12%	0.116	C	C	.	.	H	α-helix	trans	-54	-40.4	173	-70.8	165.3	39.7	0	0	112.5	I552 H562 T681 E682 L689 F712	I552-Q685 HydrophobicContact CD1-CB 4.47Å; I552-Q685 HydrophobicContact CD1-CG 4.29Å; H562-Q685 PolarHBondContact CE1-OE1 3.49Å; H562-Q685 PolarHBondContact NE2-OE1 2.93Å; H562-Q685 VanDerWaalsContact NE2-OE1 3.14Å; T681-Q685 WeakPolarHBondContact O-CG 3.49Å; T681-Q685 PolarHBondContact O-N 2.93Å; T681-Q685 VanDerWaalsContact O-N 3.1Å; T681-Q685 PolarHBondContact O-NE2 3.15Å; E682-Q685 PolarHBondContact OE2-NE2 2.91Å; E682-Q685 VanDerWaalsContact OE2-NE2 3.08Å; Q685-L689 WeakPolarHBondContact O-CB 3.19Å; Q685-L689 VanDerWaalsContact O-CG 3.32Å; Q685-L689 WeakPolarHBondContact O-CG 3.21Å; Q685-L689 PolarHBondContact O-N 3.29Å; Q685-L689 VanDerWaalsContact O-N 3.09Å; Q685-F712 HydrophobicContact CG-CE1 4.05Å; Q685-F712 HydrophobicContact CG-CZ 4.4Å
686	W	90.4	Very high	87.2	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.4	-43.2	176	170.7	81	0	0	0	112.2	L489 L516 L519 Y520 E682 L683 L684 T690 R692 M695	L489-W686 HydrophobicContact CB-CH2 4.03Å; L489-W686 HydrophobicContact CB-CZ3 4.23Å; L489-W686 HydrophobicContact CD2-CZ3 4.16Å; L516-W686 HydrophobicContact CD1-CB 4.15Å; L519-W686 HydrophobicContact CB-CZ2 4.46Å; L519-W686 HydrophobicContact CD2-CZ2 4.37Å; L519-W686 PolarHBondContact O-NE1 3.25Å; Y520-W686 AromaticContact CD1-CD1 3.74Å; Y520-W686 HydrophobicContact CE1-CB 4.21Å; Y520-W686 AromaticContact CE1-CD1 3.73Å; Y520-W686 HydrophobicContact CE1-CG 4.37Å; Y520-W686 HydrophobicContact CE2-CB 4.2Å; Y520-W686 AromaticContact CZ-CD1 3.99Å; Y520-W686 VanDerWaalsContact OH-CA 3.31Å; Y520-W686 WeakPolarHBondContact OH-CA 3.5Å; Y520-W686 PolarHBondContact OH-N 2.65Å; E682-W686 PolarHBondContact O-N 3.28Å; L683-W686 HydrophobicContact CD1-CD2 4.43Å; L683-W686 HydrophobicContact CD1-CE3 3.64Å; L683-W686 HydrophobicContact CD1-CZ3 4.15Å; L683-W686 HydrophobicContact CG-CE3 4.45Å; L683-W686 WeakPolarHBondContact O-CB 3.17Å; L683-W686 PolarHBondContact O-N 3.04Å; L683-W686 VanDerWaalsContact O-N 3.13Å; L684-W686 PolarHBondContact O-N 3.04Å; W686-T690 WeakPolarHBondContact O-CB 3.33Å; W686-T690 WeakPolarHBondContact O-CG2 3.29Å; W686-T690 PolarHBondContact O-N 3.28Å; W686-T690 PolarHBondContact O-OG1 2.88Å; W686-R692 VanDerWaalsContact CH2-NE 3.26Å; W686-M695 HydrophobicContact CZ3-SD 4.16Å
687	T	90.5	Very high	87.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.2	-43.9	176.7	54	0	0	0	0	112.9	L683 L684 T690 R691 R692 M695 L699	L683-T687 PolarHBondContact O-N 3.06Å; L684-T687 WeakPolarHBondContact CA-OG1 3.35Å; L684-T687 PolarHBondContact O-N 3.3Å; L684-T687 VanDerWaalsContact O-N 3.11Å; L684-T687 PolarHBondContact O-OG1 2.87Å; T687-T690 PolarHBondContact O-N 3.19Å; T687-T690 PolarHBondContact O-OG1 3.17Å; T687-R691 PolarHBondContact O-N 2.85Å; T687-R691 VanDerWaalsContact O-N 3.09Å; T687-R692 HydrophobicContact CG2-CB 4.24Å; T687-R692 PolarHBondContact O-N 3.25Å; T687-M695 HydrophobicContact CG2-CB 3.97Å; T687-M695 HydrophobicContact CG2-CG 3.79Å; T687-M695 HydrophobicContact CG2-SD 3.6Å; T687-M695 VanDerWaalsContact CG2-SD 3.6Å; T687-L699 HydrophobicContact CG2-CD1 3.62Å
688	L	89.3	Confident	88.6	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-63.9	-48.4	178.3	-67.5	167.9	0	0	0	111.4	L684 T690 R691 A696 L716 L717	L684-L688 HydrophobicContact CD1-CD1 3.96Å; L684-L688 HydrophobicContact CD1-CG 4.1Å; L684-L688 HydrophobicContact CG-CD1 3.96Å; L684-L688 WeakPolarHBondContact O-CG 3.43Å; L684-L688 PolarHBondContact O-N 3.25Å; L688-T690 VanDerWaalsContact C-N 3.27Å; L688-T690 PolarHBondContact O-N 3.36Å; L688-R691 PolarHBondContact O-N 3.43Å; L688-A696 HydrophobicContact CD2-CB 3.72Å; L688-A696 HydrophobicContact CG-CB 4.12Å; L688-L716 HydrophobicContact CB-CD2 3.92Å; L688-L716 HydrophobicContact CD1-CD2 3.95Å; L688-L717 HydrophobicContact CD2-CD1 4.41Å; L688-L717 HydrophobicContact CD2-CD2 4.21Å; L688-L717 HydrophobicContact CD2-CG 4.24Å
689	L	87.7	Confident	89	Confident	3 Å²	3	21.8 Å²	21.8	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-67.8	-23.1	179.2	-71.9	174.2	0	0	0	113.8	Y520 F529 L532 V548 L551 I552 L555 Q685 I720	Y520-L689 HydrophobicContact CE1-CB 4.41Å; Y520-L689 HydrophobicContact CE1-CD1 4.12Å; F529-L689 WeakPolarHBondContact CB-O 3.21Å; F529-L689 HydrophobicContact CD2-CB 3.99Å; F529-L689 VanDerWaalsContact CD2-O 3.24Å; F529-L689 WeakPolarHBondContact CD2-O 3.37Å; F529-L689 HydrophobicContact CE2-CB 3.91Å; F529-L689 HydrophobicContact CE2-CD1 4.3Å; F529-L689 HydrophobicContact CE2-CG 4.49Å; L532-L689 HydrophobicContact CD2-CD2 4.42Å; V548-L689 HydrophobicContact CG1-CD1 3.87Å; L551-L689 HydrophobicContact CD2-CD2 4.08Å; I552-L689 HydrophobicContact CD1-CD1 4.1Å; I552-L689 HydrophobicContact CG1-CD1 4.1Å; L555-L689 HydrophobicContact CD1-CD2 4.16Å; Q685-L689 WeakPolarHBondContact O-CB 3.19Å; Q685-L689 VanDerWaalsContact O-CG 3.32Å; Q685-L689 WeakPolarHBondContact O-CG 3.21Å; Q685-L689 PolarHBondContact O-N 3.29Å; Q685-L689 VanDerWaalsContact O-N 3.09Å; L689-I720 HydrophobicContact CD2-CD1 4.5Å
690	T	83.1	Confident	89.1	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-96.3	1.5	176.3	56.8	0	0	0	0	114.4	N526 W686 T687 L688 R692	N526-T690 PolarHBondContact ND2-O 3.28Å; W686-T690 WeakPolarHBondContact O-CB 3.33Å; W686-T690 WeakPolarHBondContact O-CG2 3.29Å; W686-T690 PolarHBondContact O-N 3.28Å; W686-T690 PolarHBondContact O-OG1 2.88Å; T687-T690 PolarHBondContact O-N 3.19Å; T687-T690 PolarHBondContact O-OG1 3.17Å; L688-T690 VanDerWaalsContact C-N 3.27Å; L688-T690 PolarHBondContact O-N 3.36Å; T690-R692 VanDerWaalsContact OG1-CD 3.31Å; T690-R692 WeakPolarHBondContact OG1-CD 3.3Å; T690-R692 PolarHBondContact OG1-NE 2.66Å
691	R	80.5	Confident	89.1	Confident	51 Å²	51	21 Å²	21	19%	0.192	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	39.2	-176.2	-65	-174.2	60.7	138.3	6.4	115.4	T687 L688 L693 L733 E736 C737	T687-R691 PolarHBondContact O-N 2.85Å; T687-R691 VanDerWaalsContact O-N 3.09Å; L688-R691 PolarHBondContact O-N 3.43Å; R691-L693 PolarHBondContact O-N 3.15Å; R691-L733 PolarHBondContact NH2-O 3.19Å; R691-E736 IonicContact CZ-OE2 3.52Å; R691-E736 IonicContact NH2-OE2 3.55Å; R691-E736 PolarHBondContact NH2-OE2 3.17Å; R691-C737 PolarHBondContact NH2-SG 3.05Å; R691-C737 VanDerWaalsContact NH2-SG 3.4Å
692	R	86.2	Confident	88.9	Confident	5 Å²	5	21.3 Å²	21.3	2%	0.019	10%	0.103	C	C	.	.			trans	-96.6	68.1	175.5	-58.6	170.3	-173.2	-95.6	8.5	110.2	L489 L490 D492 D523 W686 T687 T690 M695 A696	L489-R692 PolarHBondContact O-NH1 3.22Å; L490-R692 PolarHBondContact O-NH1 2.89Å; L490-R692 PolarHBondContact O-NH2 3.12Å; D492-R692 VanDerWaalsContact CG-NH1 3.33Å; D492-R692 WeakPolarHBondContact OD1-CD 3.22Å; D492-R692 VanDerWaalsContact OD1-CG 3.25Å; D492-R692 WeakPolarHBondContact OD1-CG 3.44Å; D492-R692 IonicContact OD1-CZ 2.76Å; D492-R692 IonicContact OD1-NE 2.96Å; D492-R692 IonicContact OD1-NH1 3.63Å; D492-R692 PolarHBondContact OD1-NH1 3.09Å; D523-R692 VanDerWaalsContact CG-NH2 3.29Å; D523-R692 IonicContact OD1-NH2 2.7Å; D523-R692 PolarHBondContact OD1-NH2 3.06Å; D523-R692 VanDerWaalsContact OD1-NH2 3.1Å; D523-R692 IonicContact OD2-CZ 2.75Å; D523-R692 IonicContact OD2-NE 2.69Å; D523-R692 IonicContact OD2-NH2 3.32Å; D523-R692 PolarHBondContact OD2-NH2 3.28Å; W686-R692 VanDerWaalsContact CH2-NE 3.26Å; T687-R692 HydrophobicContact CG2-CB 4.24Å; T687-R692 PolarHBondContact O-N 3.25Å; T690-R692 VanDerWaalsContact OG1-CD 3.31Å; T690-R692 WeakPolarHBondContact OG1-CD 3.3Å; T690-R692 PolarHBondContact OG1-NE 2.66Å; R692-M695 HydrophobicContact CB-CB 4.29Å; R692-M695 PolarHBondContact O-N 3.08Å; R692-A696 PolarHBondContact O-N 3.07Å
693	L	87.2	Confident	88.5	Confident	10 Å²	10	21.1 Å²	21.1	5%	0.052	11%	0.107	C	C	.	.	H	α-helix	trans	-69.4	-37	-161.2	-58.6	-179.8	0	0	0	114.3	R691 M695 A696 K697 L717 E736 H740	R691-L693 PolarHBondContact O-N 3.15Å; L693-M695 VanDerWaalsContact C-N 3.34Å; L693-M695 PolarHBondContact O-N 3.24Å; L693-A696 WeakPolarHBondContact O-CB 3.43Å; L693-A696 PolarHBondContact O-N 3.45Å; L693-K697 PolarHBondContact O-N 2.85Å; L693-L717 HydrophobicContact CD2-CD2 3.95Å; L693-E736 HydrophobicContact CD1-CG 3.99Å; L693-H740 HydrophobicContact CD1-CB 4.27Å; L693-H740 VanDerWaalsContact CD1-CD2 3.43Å; L693-H740 WeakPolarHBondContact CD1-CD2 3.43Å
694	D	87.1	Confident	88.3	Confident	110 Å²	110	24.1 Å²	24.1	59%	0.588	12%	0.121	S	C	*	.	H	α-helix	trans	-63.5	-39.5	173.6	-70.2	-36	0	0	0	112.5	L494 A696 K697 F698 H740	L494-D694 HydrophobicContact CD2-CB 4.38Å; D694-A696 VanDerWaalsContact C-N 3.31Å; D694-K697 PolarHBondContact O-N 3.07Å; D694-F698 PolarHBondContact O-N 2.88Å; D694-H740 IonicContact OD1-CE1 2.98Å
695	M	89.8	Confident	88.1	Confident	3 Å²	3	24.2 Å²	24.2	2%	0.015	12%	0.121	C	C	.	.	H	α-helix	trans	-67.2	-35.4	175.1	-164.3	-177.9	-60.5	0	0	111.1	L489 D492 L494 W686 T687 R692 L693 F698 L699	L489-M695 HydrophobicContact CD2-CE 4.23Å; L489-M695 HydrophobicContact CD2-SD 3.51Å; L489-M695 VanDerWaalsContact CD2-SD 3.51Å; D492-M695 WeakPolarHBondContact OD1-CE 3.36Å; L494-M695 HydrophobicContact CD1-CG 4.22Å; W686-M695 HydrophobicContact CZ3-SD 4.16Å; T687-M695 HydrophobicContact CG2-CB 3.97Å; T687-M695 HydrophobicContact CG2-CG 3.79Å; T687-M695 HydrophobicContact CG2-SD 3.6Å; T687-M695 VanDerWaalsContact CG2-SD 3.6Å; R692-M695 HydrophobicContact CB-CB 4.29Å; R692-M695 PolarHBondContact O-N 3.08Å; L693-M695 VanDerWaalsContact C-N 3.34Å; L693-M695 PolarHBondContact O-N 3.24Å; M695-F698 PolarHBondContact O-N 2.67Å; M695-L699 HydrophobicContact CG-CD1 4.11Å; M695-L699 WeakPolarHBondContact O-CB 3.23Å; M695-L699 VanDerWaalsContact O-CG 3.25Å; M695-L699 WeakPolarHBondContact O-CG 3.31Å; M695-L699 PolarHBondContact O-N 3.39Å
696	A	91.5	Very high	88.2	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-62.9	-44	173	0	0	0	0	0	112	L684 L688 R692 L693 D694 F698 L699 V700	L684-A696 HydrophobicContact CD1-CB 3.8Å; L688-A696 HydrophobicContact CD2-CB 3.72Å; L688-A696 HydrophobicContact CG-CB 4.12Å; R692-A696 PolarHBondContact O-N 3.07Å; L693-A696 WeakPolarHBondContact O-CB 3.43Å; L693-A696 PolarHBondContact O-N 3.45Å; D694-A696 VanDerWaalsContact C-N 3.31Å; A696-F698 VanDerWaalsContact C-N 3.29Å; A696-F698 PolarHBondContact O-N 2.82Å; A696-L699 PolarHBondContact O-N 3.06Å; A696-V700 WeakPolarHBondContact O-CG2 3.41Å; A696-V700 PolarHBondContact O-N 2.99Å
697	K	89.6	Confident	88.3	Confident	108 Å²	108	24 Å²	24	47%	0.47	12%	0.121	S	C	.	.	H	α-helix	trans	-56.8	-41.5	175.9	-172.6	-178.7	178.7	-175.8	0	111.9	L693 D694	L693-K697 PolarHBondContact O-N 2.85Å; D694-K697 PolarHBondContact O-N 3.07Å
698	F	89.9	Confident	88.4	Confident	58 Å²	58	24.1 Å²	24.1	25%	0.254	12%	0.121	S	C	.	.	H	α-helix	trans	-67.5	-39.3	174.1	173.2	-107	0	0	0	113.1	L494 V497 Q498 L501 D694 M695 A696 L701	L494-F698 HydrophobicContact CD1-CB 3.87Å; L494-F698 HydrophobicContact CD1-CD1 3.77Å; L494-F698 HydrophobicContact CD1-CG 3.89Å; V497-F698 HydrophobicContact CG1-CE1 4.34Å; Q498-F698 HydrophobicContact CG-CD2 4.25Å; Q498-F698 HydrophobicContact CG-CE1 4.14Å; Q498-F698 HydrophobicContact CG-CE2 3.77Å; Q498-F698 HydrophobicContact CG-CZ 3.72Å; L501-F698 HydrophobicContact CD1-CE1 3.9Å; L501-F698 HydrophobicContact CD1-CZ 4.07Å; D694-F698 PolarHBondContact O-N 2.88Å; M695-F698 PolarHBondContact O-N 2.67Å; A696-F698 VanDerWaalsContact C-N 3.29Å; A696-F698 PolarHBondContact O-N 2.82Å; F698-L701 PolarHBondContact O-N 3.4Å
699	L	91.4	Very high	88.6	Confident	2 Å²	2	24.1 Å²	24.1	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-76.2	-21.5	-177.4	-70.2	171.7	0	0	0	114.5	Y680 L683 L684 T687 M695 A696 A702	Y680-L699 HydrophobicContact CD1-CD2 3.92Å; L683-L699 HydrophobicContact CB-CD1 4.26Å; L683-L699 HydrophobicContact CD2-CD1 3.98Å; L683-L699 HydrophobicContact CD2-CD2 3.92Å; L683-L699 HydrophobicContact CG-CD1 3.79Å; L684-L699 HydrophobicContact CB-CB 4.22Å; L684-L699 HydrophobicContact CD1-CB 4.15Å; T687-L699 HydrophobicContact CG2-CD1 3.62Å; M695-L699 HydrophobicContact CG-CD1 4.11Å; M695-L699 WeakPolarHBondContact O-CB 3.23Å; M695-L699 VanDerWaalsContact O-CG 3.25Å; M695-L699 WeakPolarHBondContact O-CG 3.31Å; M695-L699 PolarHBondContact O-N 3.39Å; A696-L699 PolarHBondContact O-N 3.06Å; L699-A702 PolarHBondContact O-N 3.49Å
700	V	90.9	Very high	88.9	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.2	-42.1	171.6	166.6	0	0	0	0	111.1	L684 A696 A702 K709 A710 L744 L747	L684-V700 HydrophobicContact CD1-CG2 3.84Å; L684-V700 HydrophobicContact CD2-CG2 3.86Å; A696-V700 WeakPolarHBondContact O-CG2 3.41Å; A696-V700 PolarHBondContact O-N 2.99Å; V700-A702 VanDerWaalsContact C-N 3.27Å; V700-A702 PolarHBondContact O-N 3.01Å; V700-K709 HydrophobicContact CG1-CB 4.26Å; V700-K709 HydrophobicContact CG2-CB 4.36Å; V700-K709 WeakPolarHBondContact O-CD 3.46Å; V700-A710 HydrophobicContact CG1-CB 3.77Å; V700-L744 HydrophobicContact CB-CD2 4.37Å; V700-L744 HydrophobicContact CG1-CD2 4.37Å; V700-L744 HydrophobicContact CG2-CD2 4Å; V700-L747 HydrophobicContact CG1-CD2 4.12Å
701	L	90.3	Very high	89.4	Confident	49 Å²	49	24 Å²	24	26%	0.257	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	0.9	178.2	-68.9	168.3	0	0	0	114	F698 L747 L751 V1712 T1716	F698-L701 PolarHBondContact O-N 3.4Å; L701-L747 HydrophobicContact CD1-CD2 4.45Å; L701-L747 HydrophobicContact CD2-CD1 4.29Å; L701-L747 HydrophobicContact CD2-CD2 4.21Å; L701-L747 HydrophobicContact CG-CD2 4.19Å; L701-L751 HydrophobicContact CD2-CD1 4.2Å; L701-V1712 HydrophobicContact CD2-CG1 3.92Å; L701-T1716 HydrophobicContact CD1-CG2 4.05Å; L701-T1716 HydrophobicContact CD2-CG2 4.14Å
702	A	86.3	Confident	90	Very high	13 Å²	13	21.7 Å²	21.7	11%	0.107	11%	0.112	C	C	.	.	S	Bend	trans	-99.9	102.8	-175.5	0	0	0	0	0	112	Y680 L699 V700 K709	Y680-A702 VanDerWaalsContact CB-O 3.28Å; Y680-A702 WeakPolarHBondContact CB-O 3.49Å; Y680-A702 HydrophobicContact CD1-CB 3.64Å; Y680-A702 WeakPolarHBondContact CD2-O 3.48Å; Y680-A702 HydrophobicContact CE1-CB 3.82Å; Y680-A702 HydrophobicContact CG-CB 4.02Å; Y680-A702 VanDerWaalsContact CG-O 3.3Å; L699-A702 PolarHBondContact O-N 3.49Å; V700-A702 VanDerWaalsContact C-N 3.27Å; V700-A702 PolarHBondContact O-N 3.01Å; A702-K709 PolarHBondContact O-NZ 3.09Å
703	G	82.5	Confident	90.3	Very high	19 Å²	19	21.4 Å²	21.4	20%	0.196	11%	0.111	C	C	.	.	S	Bend	trans	73.4	-176.7	175.9	0	0	0	0	0	115.7	K709	G703-K709 VanDerWaalsContact C-NZ 3.28Å; G703-K709 PolarHBondContact O-NZ 3.03Å
704	E	86	Confident	90.5	Very high	65 Å²	65	21 Å²	21	30%	0.304	11%	0.109	S	C	.	.	S	Bend	trans	-34	143.4	-177.5	-54.9	172.5	-99.7	0	0	117.4	Y678 K709 H1705	Y678-E704 HydrophobicContact CD1-CB 4.25Å; Y678-E704 HydrophobicContact CE1-CB 4.18Å; Y678-E704 WeakPolarHBondContact CE1-OE2 3.44Å; E704-K709 WeakPolarHBondContact O-CE 3.4Å; E704-K709 PolarHBondContact O-NZ 3.08Å; E704-H1705 HydrophobicContact CG-CB 4.19Å; E704-H1705 IonicContact OE2-CE1 3.17Å; E704-H1705 PolarHBondContact OE2-CE1 3.27Å; E704-H1705 IonicContact OE2-CG 2.63Å; E704-H1705 IonicContact OE2-ND1 3.18Å; E704-H1705 PolarHBondContact OE2-ND1 3.46Å
705	E	88.9	Confident	90.7	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.087	C	C	.	.			trans	67.7	40.4	175.2	-49.6	-170.5	157.2	0	0	114	Y678 A708 K709 L771 F774 E1708	Y678-E705 HydrophobicContact CE1-CG 4.34Å; E705-A708 HydrophobicContact CB-CB 4.24Å; E705-A708 PolarHBondContact O-N 3.16Å; E705-K709 VanDerWaalsContact O-CG 3.31Å; E705-K709 WeakPolarHBondContact O-CG 3.41Å; E705-K709 PolarHBondContact O-N 3.5Å; E705-L771 HydrophobicContact CB-CD2 4.5Å; E705-L771 HydrophobicContact CG-CD2 4.22Å; E705-F774 HydrophobicContact CB-CE2 4.28Å; E705-F774 WeakPolarHBondContact OE2-CD2 3.22Å; E705-F774 VanDerWaalsContact OE2-CE2 3.23Å; E705-F774 WeakPolarHBondContact OE2-CE2 3.26Å; E705-E1708 WeakPolarHBondContact CA-OE2 3.42Å; E705-E1708 PolarHBondContact N-OE2 2.83Å
706	S	92.6	Very high	90.8	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.014	9%	0.086	C	C	.	.	H	α-helix	trans	-61.1	-46.7	-174	80.5	0	0	0	0	114.2	A708 K709 A710 E1708 V1712	S706-A708 VanDerWaalsContact C-N 3.31Å; S706-A708 PolarHBondContact O-N 2.99Å; S706-K709 WeakPolarHBondContact O-CB 3.3Å; S706-K709 PolarHBondContact O-N 3.31Å; S706-A710 PolarHBondContact O-N 3.04Å; S706-E1708 WeakPolarHBondContact CA-OE1 3.23Å; S706-E1708 WeakPolarHBondContact CB-OE1 3.42Å; S706-E1708 VanDerWaalsContact N-CD 3.27Å; S706-E1708 PolarHBondContact N-OE1 2.88Å; S706-E1708 PolarHBondContact N-OE2 3.38Å; S706-E1708 VanDerWaalsContact N-OE2 3.1Å; S706-E1708 VanDerWaalsContact OG-CD 3.3Å; S706-E1708 PolarHBondContact OG-OE1 3.22Å; S706-V1712 VanDerWaalsContact OG-CG2 3.3Å; S706-V1712 WeakPolarHBondContact OG-CG2 3.22Å
707	I	93.1	Very high	90.7	Very high	3 Å²	3	17.2 Å²	17.2	2%	0.015	9%	0.087	C	C	.	.	H	α-helix	trans	-67.1	-38.1	-179.7	-59.9	175.9	0	0	0	109.6	A710 L711 L751 L766 F791 E1708	I707-A710 PolarHBondContact O-N 2.78Å; I707-L711 HydrophobicContact CG2-CD1 4.33Å; I707-L711 WeakPolarHBondContact O-CG 3.45Å; I707-L711 PolarHBondContact O-N 2.92Å; I707-L711 VanDerWaalsContact O-N 3.08Å; I707-L751 HydrophobicContact CD1-CB 4.24Å; I707-L751 HydrophobicContact CG1-CB 3.93Å; I707-L751 HydrophobicContact CG1-CD1 4.44Å; I707-L766 HydrophobicContact CD1-CD2 3.89Å; I707-F791 HydrophobicContact CG2-CE2 3.6Å; I707-F791 HydrophobicContact CG2-CZ 3.7Å; I707-E1708 PolarHBondContact N-OE1 3.18Å
708	A	92.6	Very high	90.7	Very high	2 Å²	2	13.5 Å²	13.5	2%	0.017	7%	0.07	C	C	.	.	H	α-helix	trans	-67.6	-39.7	175.9	0	0	0	0	0	112.5	E705 S706 F712 L771 F774 L782	E705-A708 HydrophobicContact CB-CB 4.24Å; E705-A708 PolarHBondContact O-N 3.16Å; S706-A708 VanDerWaalsContact C-N 3.31Å; S706-A708 PolarHBondContact O-N 2.99Å; A708-F712 VanDerWaalsContact O-CB 3.26Å; A708-F712 WeakPolarHBondContact O-CB 3.38Å; A708-F712 PolarHBondContact O-N 2.88Å; A708-L771 HydrophobicContact CB-CD1 3.67Å; A708-L771 HydrophobicContact CB-CD2 3.82Å; A708-L771 HydrophobicContact CB-CG 4.42Å; A708-F774 HydrophobicContact CB-CD2 3.83Å; A708-F774 HydrophobicContact CB-CE2 3.67Å; A708-F774 HydrophobicContact CB-CZ 4.49Å; A708-L782 HydrophobicContact CB-CD2 4.3Å; A708-L782 WeakPolarHBondContact O-CD2 3.33Å
709	K	93.9	Very high	90.5	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.009	6%	0.062	C	C	.	.	H	α-helix	trans	-59.8	-43.9	171.6	-74.5	168.7	-167.2	158.6	0	112	T681 L684 V700 A702 G703 E704 E705 S706 S713 F774	T681-K709 VanDerWaalsContact OG1-CE 3.23Å; T681-K709 WeakPolarHBondContact OG1-CE 3.43Å; L684-K709 HydrophobicContact CD2-CB 3.75Å; L684-K709 HydrophobicContact CD2-CD 4.24Å; L684-K709 HydrophobicContact CD2-CG 3.85Å; V700-K709 HydrophobicContact CG1-CB 4.26Å; V700-K709 HydrophobicContact CG2-CB 4.36Å; V700-K709 WeakPolarHBondContact O-CD 3.46Å; A702-K709 PolarHBondContact O-NZ 3.09Å; G703-K709 VanDerWaalsContact C-NZ 3.28Å; G703-K709 PolarHBondContact O-NZ 3.03Å; E704-K709 WeakPolarHBondContact O-CE 3.4Å; E704-K709 PolarHBondContact O-NZ 3.08Å; E705-K709 VanDerWaalsContact O-CG 3.31Å; E705-K709 WeakPolarHBondContact O-CG 3.41Å; E705-K709 PolarHBondContact O-N 3.5Å; S706-K709 WeakPolarHBondContact O-CB 3.3Å; S706-K709 PolarHBondContact O-N 3.31Å; K709-S713 WeakPolarHBondContact O-CB 3.18Å; K709-S713 PolarHBondContact O-N 2.81Å; K709-S713 PolarHBondContact O-OG 3.29Å; K709-F774 HydrophobicContact CG-CZ 4.16Å
710	A	94.5	Very high	90.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-60.7	-53.3	179.1	0	0	0	0	0	110.7	V700 S706 I707 F712 S713 V714 A748	V700-A710 HydrophobicContact CG1-CB 3.77Å; S706-A710 PolarHBondContact O-N 3.04Å; I707-A710 PolarHBondContact O-N 2.78Å; A710-F712 PolarHBondContact O-N 3Å; A710-S713 WeakPolarHBondContact O-CB 3.41Å; A710-S713 PolarHBondContact O-N 2.85Å; A710-S713 VanDerWaalsContact O-N 3.17Å; A710-V714 WeakPolarHBondContact O-CG2 3.34Å; A710-V714 PolarHBondContact O-N 3.47Å; A710-A748 HydrophobicContact CB-CB 3.85Å
711	L	93	Very high	89.6	Confident	1 Å²	1	13.4 Å²	13.4	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-59.8	-46.6	177.3	-68.5	172.1	0	0	0	112.7	I707 S713 V714 K715 A748 L782 A783 C786 F791	I707-L711 HydrophobicContact CG2-CD1 4.33Å; I707-L711 WeakPolarHBondContact O-CG 3.45Å; I707-L711 PolarHBondContact O-N 2.92Å; I707-L711 VanDerWaalsContact O-N 3.08Å; L711-S713 VanDerWaalsContact C-N 3.26Å; L711-S713 PolarHBondContact O-N 3.32Å; L711-V714 WeakPolarHBondContact O-CB 3.42Å; L711-V714 PolarHBondContact O-N 2.8Å; L711-V714 VanDerWaalsContact O-N 3.15Å; L711-K715 PolarHBondContact O-N 3.35Å; L711-A748 HydrophobicContact CD2-CB 4.04Å; L711-A748 HydrophobicContact CG-CB 4.16Å; L711-L782 HydrophobicContact CB-CD2 3.9Å; L711-L782 HydrophobicContact CB-CG 4.01Å; L711-A783 HydrophobicContact CD1-CB 3.9Å; L711-A783 HydrophobicContact CD2-CB 4.19Å; L711-C786 PolarHBondContact O-SG 2.87Å; L711-F791 HydrophobicContact CD1-CE1 4.16Å; L711-F791 HydrophobicContact CD1-CE2 4.19Å; L711-F791 HydrophobicContact CD1-CZ 3.94Å; L711-F791 HydrophobicContact CD2-CD2 4.26Å; L711-F791 HydrophobicContact CD2-CG 4.4Å
712	F	92.3	Very high	88.9	Confident	1 Å²	1	15.9 Å²	15.9	0%	0.004	8%	0.08	C	C	.	.	H	α-helix	trans	-58.7	-39.4	176.3	174.9	-95.7	0	0	0	112.1	I552 V556 Y560 Q685 A708 A710 K715 L716 F774 L782	I552-F712 HydrophobicContact CG2-CE2 4.27Å; I552-F712 HydrophobicContact CG2-CZ 3.95Å; V556-F712 HydrophobicContact CG2-CE2 4.09Å; Y560-F712 HydrophobicContact CE1-CE2 4.32Å; Y560-F712 HydrophobicContact CE2-CE2 4.34Å; Y560-F712 AromaticContact CZ-CE2 3.82Å; Q685-F712 HydrophobicContact CG-CE1 4.05Å; Q685-F712 HydrophobicContact CG-CZ 4.4Å; A708-F712 VanDerWaalsContact O-CB 3.26Å; A708-F712 WeakPolarHBondContact O-CB 3.38Å; A708-F712 PolarHBondContact O-N 2.88Å; A710-F712 PolarHBondContact O-N 3Å; F712-K715 PolarHBondContact O-N 2.7Å; F712-L716 HydrophobicContact CE1-CD2 4.07Å; F712-L716 HydrophobicContact CZ-CD2 4.37Å; F712-L716 WeakPolarHBondContact O-CB 3.31Å; F712-L716 PolarHBondContact O-N 2.76Å; F712-F774 HydrophobicContact CB-CD1 3.9Å; F712-F774 HydrophobicContact CB-CE1 3.54Å; F712-F774 HydrophobicContact CB-CZ 4.3Å; F712-F774 AromaticContact CD1-CE1 3.89Å; F712-F774 HydrophobicContact CD1-CE1 3.89Å; F712-F774 AromaticContact CD2-CD1 3.66Å; F712-F774 HydrophobicContact CD2-CD1 3.66Å; F712-F774 AromaticContact CD2-CE1 3.82Å; F712-F774 HydrophobicContact CD2-CE1 3.82Å; F712-F774 HydrophobicContact CE2-CD1 4.35Å; F712-F774 AromaticContact CG-CD1 3.79Å; F712-F774 HydrophobicContact CG-CD1 3.79Å; F712-F774 AromaticContact CG-CE1 3.46Å; F712-F774 HydrophobicContact CG-CE1 3.46Å; F712-F774 VanDerWaalsContact CG-CE1 3.46Å; F712-L782 HydrophobicContact CB-CD2 4.31Å
713	S	92.8	Very high	88.2	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.7	-40.8	176.8	-56	0	0	0	0	111.6	K709 A710 L711 L716 L717	K709-S713 WeakPolarHBondContact O-CB 3.18Å; K709-S713 PolarHBondContact O-N 2.81Å; K709-S713 PolarHBondContact O-OG 3.29Å; A710-S713 WeakPolarHBondContact O-CB 3.41Å; A710-S713 PolarHBondContact O-N 2.85Å; A710-S713 VanDerWaalsContact O-N 3.17Å; L711-S713 VanDerWaalsContact C-N 3.26Å; L711-S713 PolarHBondContact O-N 3.32Å; S713-L716 PolarHBondContact O-N 3.15Å; S713-L717 WeakPolarHBondContact O-CB 3.44Å; S713-L717 WeakPolarHBondContact O-CG 3.22Å; S713-L717 PolarHBondContact O-N 2.9Å
714	V	92.7	Very high	87.5	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.006	9%	0.087	C	C	.	.	H	α-helix	trans	-59.2	-50.8	173.8	171.6	0	0	0	0	111.1	A710 L711 L716 L717 R718 E741 L744 E745	A710-V714 WeakPolarHBondContact O-CG2 3.34Å; A710-V714 PolarHBondContact O-N 3.47Å; L711-V714 WeakPolarHBondContact O-CB 3.42Å; L711-V714 PolarHBondContact O-N 2.8Å; L711-V714 VanDerWaalsContact O-N 3.15Å; V714-L716 VanDerWaalsContact C-N 3.34Å; V714-L716 PolarHBondContact O-N 3.48Å; V714-L717 PolarHBondContact O-N 2.85Å; V714-R718 WeakPolarHBondContact O-CB 3.27Å; V714-R718 WeakPolarHBondContact O-CG 3.08Å; V714-R718 PolarHBondContact O-N 3.01Å; V714-E741 HydrophobicContact CG1-CG 4.04Å; V714-L744 HydrophobicContact CG2-CB 3.9Å; V714-E745 HydrophobicContact CG2-CB 3.92Å
715	K	91.2	Very high	86.2	Confident	31 Å²	31	17.4 Å²	17.4	14%	0.135	9%	0.086	C	C	.	.	H	α-helix	trans	-65.8	-36.2	179.3	-169.8	54.7	165.5	-155.4	0	112.6	V556 L711 F712 S719 M785 E787	V556-K715 HydrophobicContact CG1-CG 4.33Å; L711-K715 PolarHBondContact O-N 3.35Å; F712-K715 PolarHBondContact O-N 2.7Å; K715-S719 WeakPolarHBondContact O-CB 3.37Å; K715-S719 PolarHBondContact O-N 3.5Å; K715-S719 PolarHBondContact O-OG 3.31Å; K715-M785 VanDerWaalsContact CD-O 3.22Å; K715-M785 WeakPolarHBondContact CD-O 3.45Å; K715-M785 WeakPolarHBondContact CE-O 3.44Å; K715-M785 PolarHBondContact NZ-O 2.9Å; K715-E787 IonicContact NZ-OE1 3.29Å; K715-E787 PolarHBondContact NZ-OE1 3.23Å; K715-E787 IonicContact NZ-OE2 3.69Å; K715-E787 PolarHBondContact NZ-OE2 3.26Å; K715-E787 VanDerWaalsContact NZ-OE2 3.08Å
716	L	90.8	Very high	84.6	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.1	-43.9	176.5	-170.4	61.9	0	0	0	111.4	L555 V556 L688 F712 S713 V714 S719 I720	L555-L716 HydrophobicContact CB-CD1 4.19Å; L555-L716 HydrophobicContact CD1-CD1 4.09Å; V556-L716 HydrophobicContact CG2-CD1 4.27Å; L688-L716 HydrophobicContact CB-CD2 3.92Å; L688-L716 HydrophobicContact CD1-CD2 3.95Å; F712-L716 HydrophobicContact CE1-CD2 4.07Å; F712-L716 HydrophobicContact CZ-CD2 4.37Å; F712-L716 WeakPolarHBondContact O-CB 3.31Å; F712-L716 PolarHBondContact O-N 2.76Å; S713-L716 PolarHBondContact O-N 3.15Å; V714-L716 VanDerWaalsContact C-N 3.34Å; V714-L716 PolarHBondContact O-N 3.48Å; L716-S719 PolarHBondContact O-N 3.1Å; L716-S719 PolarHBondContact O-OG 2.99Å; L716-I720 HydrophobicContact CG-CD1 4.11Å; L716-I720 WeakPolarHBondContact O-CG1 3.39Å; L716-I720 PolarHBondContact O-N 3Å
717	L	89.9	Confident	82.7	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-63.6	-42.6	174.8	-71.6	173.8	0	0	0	112.2	L688 L693 S713 V714 S719 I720 R721 H740 E741 L744	L688-L717 HydrophobicContact CD2-CD1 4.41Å; L688-L717 HydrophobicContact CD2-CD2 4.21Å; L688-L717 HydrophobicContact CD2-CG 4.24Å; L693-L717 HydrophobicContact CD2-CD2 3.95Å; S713-L717 WeakPolarHBondContact O-CB 3.44Å; S713-L717 WeakPolarHBondContact O-CG 3.22Å; S713-L717 PolarHBondContact O-N 2.9Å; V714-L717 PolarHBondContact O-N 2.85Å; L717-S719 VanDerWaalsContact C-N 3.35Å; L717-S719 PolarHBondContact O-N 3.19Å; L717-I720 PolarHBondContact O-N 3.05Å; L717-R721 PolarHBondContact O-N 3.28Å; L717-H740 HydrophobicContact CD1-CB 4.49Å; L717-E741 HydrophobicContact CB-CB 4.39Å; L717-E741 HydrophobicContact CD1-CB 4.37Å; L717-L744 HydrophobicContact CD1-CD1 3.98Å
718	R	89.4	Confident	80.6	Confident	30 Å²	30	32.1 Å²	32.1	11%	0.113	16%	0.159	C	C	.	.	H	α-helix	trans	-52.9	-51.9	170.8	-75	-178.4	172.8	152.9	13.2	110.8	V714 I720 R721 H722 E741 E745 C786	V714-R718 WeakPolarHBondContact O-CB 3.27Å; V714-R718 WeakPolarHBondContact O-CG 3.08Å; V714-R718 PolarHBondContact O-N 3.01Å; R718-I720 PolarHBondContact O-N 3.22Å; R718-R721 WeakPolarHBondContact O-CB 3.46Å; R718-R721 PolarHBondContact O-N 3.46Å; R718-H722 PolarHBondContact O-CD2 3.06Å; R718-H722 PolarHBondContact O-N 3.25Å; R718-E741 HydrophobicContact CG-CG 4.3Å; R718-E741 WeakPolarHBondContact CG-OE1 3.45Å; R718-E741 VanDerWaalsContact CG-OE2 3.24Å; R718-E741 WeakPolarHBondContact CG-OE2 3.44Å; R718-E741 IonicContact CZ-OE1 3.05Å; R718-E741 IonicContact NE-OE1 3.91Å; R718-E741 PolarHBondContact NE-OE1 2.72Å; R718-E741 IonicContact NH2-OE1 3.34Å; R718-E741 PolarHBondContact NH2-OE1 3.02Å; R718-E745 IonicContact CZ-OE2 3.1Å; R718-E745 IonicContact NH1-OE1 3.9Å; R718-E745 IonicContact NH1-OE2 3.72Å; R718-E745 IonicContact NH2-OE2 2.64Å; R718-E745 PolarHBondContact NH2-OE2 3.41Å; R718-C786 PolarHBondContact NH1-O 2.61Å
719	S	85.5	Confident	78.6	Confident	12 Å²	12	37.3 Å²	37.3	8%	0.084	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-36.6	-180	71.9	0	0	0	0	113.9	L555 K715 L716 L717 V723	L555-S719 WeakPolarHBondContact O-CB 3.49Å; K715-S719 WeakPolarHBondContact O-CB 3.37Å; K715-S719 PolarHBondContact O-N 3.5Å; K715-S719 PolarHBondContact O-OG 3.31Å; L716-S719 PolarHBondContact O-N 3.1Å; L716-S719 PolarHBondContact O-OG 2.99Å; L717-S719 VanDerWaalsContact C-N 3.35Å; L717-S719 PolarHBondContact O-N 3.19Å; S719-V723 WeakPolarHBondContact O-CG2 3.49Å; S719-V723 PolarHBondContact O-N 2.99Å
720	I	82.8	Confident	77	Confident	10 Å²	10	39.4 Å²	39.4	5%	0.051	20%	0.202	C	C	.	.	H	α-helix	trans	-67.2	-44.8	175.4	-68.9	167.2	0	0	0	109.7	L532 L555 L689 L716 L717 R718 H722 V723 T724	L532-I720 HydrophobicContact CD2-CG1 4.25Å; L555-I720 HydrophobicContact CD1-CG1 4.45Å; L689-I720 HydrophobicContact CD2-CD1 4.5Å; L716-I720 HydrophobicContact CG-CD1 4.11Å; L716-I720 WeakPolarHBondContact O-CG1 3.39Å; L716-I720 PolarHBondContact O-N 3Å; L717-I720 PolarHBondContact O-N 3.05Å; R718-I720 PolarHBondContact O-N 3.22Å; I720-H722 PolarHBondContact O-N 3.17Å; I720-V723 CarbonylContact O-C 3.47Å; I720-V723 PolarHBondContact O-N 3.28Å; I720-T724 HydrophobicContact CG2-CG2 4.36Å; I720-T724 PolarHBondContact O-N 2.8Å; I720-T724 PolarHBondContact O-OG1 3.4Å
721	R	80	Confident	75.7	Confident	36 Å²	36	42 Å²	42	14%	0.136	22%	0.215	C	C	.	.	H	α-helix	trans	-55.1	-51.4	175.3	-177.5	173	60.8	-126.6	-4.3	111.1	L717 R718 V723 T724 L725 L734 E741	L717-R721 PolarHBondContact O-N 3.28Å; R718-R721 WeakPolarHBondContact O-CB 3.46Å; R718-R721 PolarHBondContact O-N 3.46Å; R721-V723 PolarHBondContact O-N 2.94Å; R721-T724 WeakPolarHBondContact CA-OG1 3.46Å; R721-T724 PolarHBondContact O-N 3.31Å; R721-T724 PolarHBondContact O-OG1 3Å; R721-L725 WeakPolarHBondContact O-CG 3.38Å; R721-L725 PolarHBondContact O-N 3.31Å; R721-L725 VanDerWaalsContact O-N 3.15Å; R721-L734 HydrophobicContact CG-CD1 3.78Å; R721-L734 HydrophobicContact CG-CD2 4.3Å; R721-L734 HydrophobicContact CG-CG 3.98Å; R721-E741 IonicContact CZ-OE1 3.01Å; R721-E741 IonicContact CZ-OE2 3.12Å; R721-E741 VanDerWaalsContact NH1-CD 3.25Å; R721-E741 IonicContact NH1-OE1 2.75Å; R721-E741 PolarHBondContact NH1-OE1 2.96Å; R721-E741 IonicContact NH1-OE2 2.78Å; R721-E741 PolarHBondContact NH1-OE2 3Å; R721-E741 IonicContact NH2-OE1 2.77Å; R721-E741 PolarHBondContact NH2-OE1 3.14Å; R721-E741 IonicContact NH2-OE2 2.65Å; R721-E741 PolarHBondContact NH2-OE2 3.2Å; R721-E741 VanDerWaalsContact NH2-OE2 3.1Å
722	H	77.2	Confident	74.4	Confident	101 Å²	101	50.1 Å²	50.1	47%	0.468	25%	0.253	S	S	.	.	H	α-helix	trans	-59.7	-27.8	178.2	-71.6	-66.6	0	0	0	113.5	R718 I720	R718-H722 PolarHBondContact O-CD2 3.06Å; R718-H722 PolarHBondContact O-N 3.25Å; I720-H722 PolarHBondContact O-N 3.17Å
723	V	71.6	Confident	73.2	Confident	36 Å²	36	53.4 Å²	53.4	22%	0.218	27%	0.27	C	S	.	.	H	α-helix	trans	-87.2	-15.3	175.9	175.1	0	0	0	0	113	L532 K535 V536 L555 S719 I720 R721	L532-V723 HydrophobicContact CD1-CB 4.31Å; L532-V723 HydrophobicContact CD1-CG1 3.6Å; K535-V723 HydrophobicContact CD-CG1 4.03Å; K535-V723 PolarHBondContact NZ-O 3.45Å; V536-V723 HydrophobicContact CG2-CG1 4.18Å; L555-V723 HydrophobicContact CD2-CG2 3.98Å; S719-V723 WeakPolarHBondContact O-CG2 3.49Å; S719-V723 PolarHBondContact O-N 2.99Å; I720-V723 CarbonylContact O-C 3.47Å; I720-V723 PolarHBondContact O-N 3.28Å; R721-V723 PolarHBondContact O-N 2.94Å
724	T	67.2	Low	72.2	Confident	35 Å²	35	54.1 Å²	54.1	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-94.4	-19.8	176.7	50.1	0	0	0	0	114.8	I720 R721 D726 E727	I720-T724 HydrophobicContact CG2-CG2 4.36Å; I720-T724 PolarHBondContact O-N 2.8Å; I720-T724 PolarHBondContact O-OG1 3.4Å; R721-T724 WeakPolarHBondContact CA-OG1 3.46Å; R721-T724 PolarHBondContact O-N 3.31Å; R721-T724 PolarHBondContact O-OG1 3Å; T724-D726 PolarHBondContact O-N 3.4Å; T724-E727 PolarHBondContact O-N 3.35Å; T724-E727 VanDerWaalsContact O-N 3.08Å
725	L	58.3	Low	71.5	Confident	57 Å²	57	58 Å²	58	30%	0.298	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.3	-178.5	-72.8	165.8	0	0	0	114	R721 E727 L734 L2514	R721-L725 WeakPolarHBondContact O-CG 3.38Å; R721-L725 PolarHBondContact O-N 3.31Å; R721-L725 VanDerWaalsContact O-N 3.15Å; L725-E727 PolarHBondContact O-N 3.1Å; L725-L734 HydrophobicContact CD2-CD1 3.85Å; L725-L734 HydrophobicContact CD2-CD2 3.63Å; L725-L734 HydrophobicContact CD2-CG 4.4Å; L725-L734 HydrophobicContact CG-CD1 4.27Å; L725-L2514 HydrophobicContact CB-CD2 3.97Å; L725-L2514 HydrophobicContact CD2-CB 3.75Å; L725-L2514 HydrophobicContact CD2-CD2 3.55Å; L725-L2514 HydrophobicContact CD2-CG 4.3Å; L725-L2514 HydrophobicContact CG-CD2 4.36Å; L725-L2514 WeakPolarHBondContact O-CD2 3.41Å
726	D	56	Low	70.9	Confident	120 Å²	120	60.1 Å²	60.1	64%	0.642	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-11.6	177.1	-45.2	-38.7	0	0	0	114.7	K535 T724	K535-D726 VanDerWaalsContact CE-OD2 3.26Å; K535-D726 WeakPolarHBondContact CE-OD2 3.33Å; K535-D726 IonicContact NZ-OD2 3.59Å; K535-D726 PolarHBondContact NZ-OD2 3.29Å; T724-D726 PolarHBondContact O-N 3.4Å
727	E	52	Low	70.4	Confident	68 Å²	68	60.4 Å²	60.4	32%	0.318	31%	0.307	S	S	.	.			trans	-107.8	98.8	-177.4	-71.9	179.5	-133.4	0	0	110.5	K531 T724 L725 T729	K531-E727 IonicContact NZ-OE2 3.67Å; K531-E727 PolarHBondContact NZ-OE2 2.86Å; T724-E727 PolarHBondContact O-N 3.35Å; T724-E727 VanDerWaalsContact O-N 3.08Å; L725-E727 PolarHBondContact O-N 3.1Å; E727-T729 PolarHBondContact O-N 3.17Å
728	E	49.9	Very low	70.2	Confident	127 Å²	127	66.7 Å²	66.7	59%	0.593	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-8.9	-175.4	-70.3	-170.5	171.8	0	0	116.4	R2511	E728-R2511 IonicContact OE2-CZ 3.51Å; E728-R2511 IonicContact OE2-NE 3.09Å; E728-R2511 IonicContact OE2-NH2 3.36Å; E728-R2511 PolarHBondContact OE2-NH2 3.33Å
729	T	49.7	Very low	70.1	Confident	111 Å²	111	68.5 Å²	68.5	68%	0.681	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-12.3	-168.5	51.9	0	0	0	0	115.3	E727	E727-T729 PolarHBondContact O-N 3.17Å
730	D	60	Low	70.1	Confident	47 Å²	47	69.6 Å²	69.6	25%	0.251	35%	0.351	S	S	.	.			trans	-116.6	38.1	-159.8	-72.5	38.3	0	0	0	113.3	L733 L734	D730-L733 HydrophobicContact CB-CB 4.21Å; D730-L733 HydrophobicContact CB-CD1 4.11Å; D730-L733 CarbonylContact O-C 3.53Å; D730-L733 WeakPolarHBondContact O-CB 3.27Å; D730-L733 PolarHBondContact O-N 3.23Å; D730-L734 PolarHBondContact O-N 2.98Å
731	I	66.9	Low	70.5	Confident	55 Å²	55	69.4 Å²	69.4	28%	0.282	35%	0.35	S	S	.	.	H	α-helix	trans	-59.7	-53	-174.5	-41.2	162.2	0	0	0	112.8	L733 L734 N735 S2513	I731-L733 PolarHBondContact O-N 3.13Å; I731-L734 WeakPolarHBondContact O-CA 3.37Å; I731-L734 VanDerWaalsContact O-CB 3.29Å; I731-L734 WeakPolarHBondContact O-CB 3.31Å; I731-L734 PolarHBondContact O-N 2.95Å; I731-N735 PolarHBondContact O-N 2.74Å; I731-S2513 WeakPolarHBondContact CD1-OG 3.28Å; I731-S2513 WeakPolarHBondContact CG1-OG 2.99Å
732	E	66.3	Low	71.1	Confident	171 Å²	171	71.1 Å²	71.1	80%	0.799	36%	0.361	S	S	*	.	H	α-helix	trans	-56.6	-40.3	179.2	-63.6	172.2	-178.2	0	0	110.8	L734 N735 E736	E732-L734 VanDerWaalsContact C-N 3.29Å; E732-L734 PolarHBondContact O-N 3Å; E732-N735 PolarHBondContact O-N 3.4Å; E732-E736 WeakPolarHBondContact O-CB 3.41Å; E732-E736 PolarHBondContact O-N 2.57Å
733	L	66.5	Low	71.8	Confident	70 Å²	70	68.3 Å²	68.3	37%	0.366	36%	0.356	S	S	.	.	H	α-helix	trans	-71.1	-20.2	177.7	-68.6	170.3	0	0	0	112.9	R691 D730 I731 C737	R691-L733 PolarHBondContact NH2-O 3.19Å; D730-L733 HydrophobicContact CB-CB 4.21Å; D730-L733 HydrophobicContact CB-CD1 4.11Å; D730-L733 CarbonylContact O-C 3.53Å; D730-L733 WeakPolarHBondContact O-CB 3.27Å; D730-L733 PolarHBondContact O-N 3.23Å; I731-L733 PolarHBondContact O-N 3.13Å; L733-C737 PolarHBondContact O-SG 3.2Å
734	L	73.1	Confident	72.8	Confident	15 Å²	15	67 Å²	67	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-81	-43.8	172.2	-156.1	97.8	0	0	0	111	R721 L725 D730 I731 E732 C737 R738 L2514	R721-L734 HydrophobicContact CG-CD1 3.78Å; R721-L734 HydrophobicContact CG-CD2 4.3Å; R721-L734 HydrophobicContact CG-CG 3.98Å; L725-L734 HydrophobicContact CD2-CD1 3.85Å; L725-L734 HydrophobicContact CD2-CD2 3.63Å; L725-L734 HydrophobicContact CD2-CG 4.4Å; L725-L734 HydrophobicContact CG-CD1 4.27Å; D730-L734 PolarHBondContact O-N 2.98Å; I731-L734 WeakPolarHBondContact O-CA 3.37Å; I731-L734 VanDerWaalsContact O-CB 3.29Å; I731-L734 WeakPolarHBondContact O-CB 3.31Å; I731-L734 PolarHBondContact O-N 2.95Å; E732-L734 VanDerWaalsContact C-N 3.29Å; E732-L734 PolarHBondContact O-N 3Å; L734-C737 PolarHBondContact O-N 3.17Å; L734-R738 PolarHBondContact O-N 2.93Å; L734-L2514 HydrophobicContact CD2-CB 4.47Å; L734-L2514 VanDerWaalsContact CD2-OXT 3.22Å; L734-L2514 WeakPolarHBondContact CD2-OXT 3.43Å
735	N	78.5	Confident	74.1	Confident	82 Å²	82	66.4 Å²	66.4	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-64.9	-40.1	176.5	-78.3	-37.8	0	0	0	112.2	I731 E732 C737 R738 S739	I731-N735 PolarHBondContact O-N 2.74Å; E732-N735 PolarHBondContact O-N 3.4Å; N735-C737 PolarHBondContact O-N 3.34Å; N735-R738 PolarHBondContact O-N 2.82Å; N735-S739 PolarHBondContact O-N 3.39Å
736	E	77.2	Confident	75.7	Confident	76 Å²	76	71.9 Å²	71.9	36%	0.355	36%	0.359	S	S	.	.	H	α-helix	trans	-51.3	-56.1	167.7	-176.4	-164.8	-137.1	0	0	110.4	R691 L693 E732 R738 S739 H740	R691-E736 IonicContact CZ-OE2 3.52Å; R691-E736 IonicContact NH2-OE2 3.55Å; R691-E736 PolarHBondContact NH2-OE2 3.17Å; L693-E736 HydrophobicContact CD1-CG 3.99Å; E732-E736 WeakPolarHBondContact O-CB 3.41Å; E732-E736 PolarHBondContact O-N 2.57Å; E736-R738 VanDerWaalsContact C-N 3.31Å; E736-R738 PolarHBondContact O-N 2.86Å; E736-S739 PolarHBondContact O-N 2.74Å; E736-S739 PolarHBondContact O-OG 2.77Å; E736-H740 PolarHBondContact O-CD2 3.3Å; E736-H740 VanDerWaalsContact O-CD2 3.31Å; E736-H740 PolarHBondContact O-N 2.65Å; E736-H740 VanDerWaalsContact O-N 3.17Å
737	C	79.9	Confident	77.5	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.034	33%	0.332	C	S	.	.	H	α-helix	trans	-60.3	-37.9	-180	-68.3	0	0	0	0	112.9	R691 L733 L734 N735 E741	R691-C737 PolarHBondContact NH2-SG 3.05Å; R691-C737 VanDerWaalsContact NH2-SG 3.4Å; L733-C737 PolarHBondContact O-SG 3.2Å; L734-C737 PolarHBondContact O-N 3.17Å; N735-C737 PolarHBondContact O-N 3.34Å; C737-E741 WeakPolarHBondContact O-CB 3.37Å; C737-E741 PolarHBondContact O-N 2.68Å
738	R	86.3	Confident	79.5	Confident	137 Å²	137	63.7 Å²	63.7	52%	0.517	32%	0.317	S	S	.	.	H	α-helix	trans	-67.1	-37.9	177.5	-171.3	176.1	-176	175.3	-0.2	112.3	L734 N735 E736 E741 L742	L734-R738 PolarHBondContact O-N 2.93Å; N735-R738 PolarHBondContact O-N 2.82Å; E736-R738 VanDerWaalsContact C-N 3.31Å; E736-R738 PolarHBondContact O-N 2.86Å; R738-E741 PolarHBondContact O-N 3.29Å; R738-L742 HydrophobicContact CG-CD1 4.46Å; R738-L742 WeakPolarHBondContact O-CG 3.49Å; R738-L742 PolarHBondContact O-N 3.49Å; R738-L742 VanDerWaalsContact O-N 3.12Å
739	S	86.7	Confident	81.6	Confident	67 Å²	67	58.7 Å²	58.7	47%	0.469	30%	0.295	S	S	.	.	H	α-helix	trans	-66.6	-44.5	176.8	74.1	0	0	0	0	112.1	N735 E736 L742 A743	N735-S739 PolarHBondContact O-N 3.39Å; E736-S739 PolarHBondContact O-N 2.74Å; E736-S739 PolarHBondContact O-OG 2.77Å; S739-L742 PolarHBondContact O-N 2.86Å; S739-A743 WeakPolarHBondContact O-CB 3.44Å; S739-A743 PolarHBondContact O-N 3.03Å
740	H	87	Confident	83.7	Confident	35 Å²	35	56.8 Å²	56.8	16%	0.162	28%	0.281	C	S	.	.	H	α-helix	trans	-67.4	-35.1	175.8	-75.6	-84	0	0	0	112.6	L693 D694 L717 E736 A743 L744	L693-H740 HydrophobicContact CD1-CB 4.27Å; L693-H740 VanDerWaalsContact CD1-CD2 3.43Å; L693-H740 WeakPolarHBondContact CD1-CD2 3.43Å; D694-H740 IonicContact OD1-CE1 2.98Å; L717-H740 HydrophobicContact CD1-CB 4.49Å; E736-H740 PolarHBondContact O-CD2 3.3Å; E736-H740 VanDerWaalsContact O-CD2 3.31Å; E736-H740 PolarHBondContact O-N 2.65Å; E736-H740 VanDerWaalsContact O-N 3.17Å; H740-A743 PolarHBondContact O-N 2.81Å; H740-L744 WeakPolarHBondContact O-CB 3.36Å; H740-L744 VanDerWaalsContact O-CG 3.29Å; H740-L744 WeakPolarHBondContact O-CG 3.39Å; H740-L744 PolarHBondContact O-N 3.26Å
741	E	91.2	Very high	85.2	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.028	27%	0.27	C	S	.	.	H	α-helix	trans	-60	-51.4	173.1	179.9	-174.7	124.9	0	0	111.8	V714 L717 R718 R721 C737 R738 A743 L744 E745	V714-E741 HydrophobicContact CG1-CG 4.04Å; L717-E741 HydrophobicContact CB-CB 4.39Å; L717-E741 HydrophobicContact CD1-CB 4.37Å; R718-E741 HydrophobicContact CG-CG 4.3Å; R718-E741 WeakPolarHBondContact CG-OE1 3.45Å; R718-E741 VanDerWaalsContact CG-OE2 3.24Å; R718-E741 WeakPolarHBondContact CG-OE2 3.44Å; R718-E741 IonicContact CZ-OE1 3.05Å; R718-E741 IonicContact NE-OE1 3.91Å; R718-E741 PolarHBondContact NE-OE1 2.72Å; R718-E741 IonicContact NH2-OE1 3.34Å; R718-E741 PolarHBondContact NH2-OE1 3.02Å; R721-E741 IonicContact CZ-OE1 3.01Å; R721-E741 IonicContact CZ-OE2 3.12Å; R721-E741 VanDerWaalsContact NH1-CD 3.25Å; R721-E741 IonicContact NH1-OE1 2.75Å; R721-E741 PolarHBondContact NH1-OE1 2.96Å; R721-E741 IonicContact NH1-OE2 2.78Å; R721-E741 PolarHBondContact NH1-OE2 3Å; R721-E741 IonicContact NH2-OE1 2.77Å; R721-E741 PolarHBondContact NH2-OE1 3.14Å; R721-E741 IonicContact NH2-OE2 2.65Å; R721-E741 PolarHBondContact NH2-OE2 3.2Å; R721-E741 VanDerWaalsContact NH2-OE2 3.1Å; C737-E741 WeakPolarHBondContact O-CB 3.37Å; C737-E741 PolarHBondContact O-N 2.68Å; R738-E741 PolarHBondContact O-N 3.29Å; E741-A743 VanDerWaalsContact C-N 3.31Å; E741-A743 PolarHBondContact O-N 3.01Å; E741-L744 PolarHBondContact O-N 3.12Å; E741-E745 PolarHBondContact O-N 3.5Å
742	L	91.9	Very high	86.6	Confident	72 Å²	72	52.1 Å²	52.1	38%	0.377	26%	0.257	S	S	.	.	H	α-helix	trans	-64.8	-35.4	179.5	-69.8	171.1	0	0	0	112.2	R738 S739 L744 R746	R738-L742 HydrophobicContact CG-CD1 4.46Å; R738-L742 WeakPolarHBondContact O-CG 3.49Å; R738-L742 PolarHBondContact O-N 3.49Å; R738-L742 VanDerWaalsContact O-N 3.12Å; S739-L742 PolarHBondContact O-N 2.86Å; L742-L744 VanDerWaalsContact C-N 3.35Å; L742-R746 WeakPolarHBondContact O-CG 3.12Å; L742-R746 PolarHBondContact O-N 2.93Å
743	A	91.4	Very high	87.9	Confident	43 Å²	43	46.2 Å²	46.2	36%	0.355	23%	0.23	S	C	.	.	H	α-helix	trans	-65.6	-36.1	174.4	0	0	0	0	0	112.7	S739 H740 E741 L747	S739-A743 WeakPolarHBondContact O-CB 3.44Å; S739-A743 PolarHBondContact O-N 3.03Å; H740-A743 PolarHBondContact O-N 2.81Å; E741-A743 VanDerWaalsContact C-N 3.31Å; E741-A743 PolarHBondContact O-N 3.01Å; A743-L747 WeakPolarHBondContact O-CB 3.4Å; A743-L747 PolarHBondContact O-N 3.39Å; A743-L747 VanDerWaalsContact O-N 3.13Å
744	L	92.9	Very high	89.1	Confident	7 Å²	7	44.8 Å²	44.8	4%	0.037	22%	0.222	C	C	.	.	H	α-helix	trans	-79.2	-30.9	177.5	-70.6	171.3	0	0	0	113	V700 V714 L717 H740 E741 L742 L747 A748	V700-L744 HydrophobicContact CB-CD2 4.37Å; V700-L744 HydrophobicContact CG1-CD2 4.37Å; V700-L744 HydrophobicContact CG2-CD2 4Å; V714-L744 HydrophobicContact CG2-CB 3.9Å; L717-L744 HydrophobicContact CD1-CD1 3.98Å; H740-L744 WeakPolarHBondContact O-CB 3.36Å; H740-L744 VanDerWaalsContact O-CG 3.29Å; H740-L744 WeakPolarHBondContact O-CG 3.39Å; H740-L744 PolarHBondContact O-N 3.26Å; E741-L744 PolarHBondContact O-N 3.12Å; L742-L744 VanDerWaalsContact C-N 3.35Å; L744-L747 HydrophobicContact CD2-CD2 4.26Å; L744-A748 PolarHBondContact O-N 3.2Å
745	E	93.8	Very high	90.1	Very high	23 Å²	23	44.2 Å²	44.2	11%	0.107	22%	0.219	C	C	.	.	H	α-helix	trans	-67.9	-44.8	172.2	-177.6	162.3	-152.6	0	0	111.5	V714 R718 E741 A748 V749 S788	V714-E745 HydrophobicContact CG2-CB 3.92Å; R718-E745 IonicContact CZ-OE2 3.1Å; R718-E745 IonicContact NH1-OE1 3.9Å; R718-E745 IonicContact NH1-OE2 3.72Å; R718-E745 IonicContact NH2-OE2 2.64Å; R718-E745 PolarHBondContact NH2-OE2 3.41Å; E741-E745 PolarHBondContact O-N 3.5Å; E745-A748 PolarHBondContact O-N 3.34Å; E745-V749 PolarHBondContact O-N 3.37Å; E745-S788 VanDerWaalsContact OE1-CA 3.31Å; E745-S788 WeakPolarHBondContact OE1-CA 3.18Å; E745-S788 WeakPolarHBondContact OE1-CB 3.46Å; E745-S788 PolarHBondContact OE1-OG 2.97Å
746	R	93.1	Very high	90.8	Very high	173 Å²	173	42.3 Å²	42.3	65%	0.653	21%	0.206	S	C	*	.	H	α-helix	trans	-58.9	-49	172.9	-72.6	173.8	-178.5	172.9	-0.1	111.4	L742 A748 V749 D750	L742-R746 WeakPolarHBondContact O-CG 3.12Å; L742-R746 PolarHBondContact O-N 2.93Å; R746-A748 PolarHBondContact O-N 3.38Å; R746-A748 VanDerWaalsContact O-N 3.15Å; R746-V749 WeakPolarHBondContact O-CA 3.41Å; R746-V749 WeakPolarHBondContact O-CB 3.45Å; R746-V749 PolarHBondContact O-N 3.47Å; R746-D750 PolarHBondContact O-N 3.47Å
747	L	92.9	Very high	91.6	Very high	15 Å²	15	48 Å²	48	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-54.9	-36.5	178	-175.2	63.8	0	0	0	113.4	V700 L701 A743 L744 L751 Y1715	V700-L747 HydrophobicContact CG1-CD2 4.12Å; L701-L747 HydrophobicContact CD1-CD2 4.45Å; L701-L747 HydrophobicContact CD2-CD1 4.29Å; L701-L747 HydrophobicContact CD2-CD2 4.21Å; L701-L747 HydrophobicContact CG-CD2 4.19Å; A743-L747 WeakPolarHBondContact O-CB 3.4Å; A743-L747 PolarHBondContact O-N 3.39Å; A743-L747 VanDerWaalsContact O-N 3.13Å; L744-L747 HydrophobicContact CD2-CD2 4.26Å; L747-L751 HydrophobicContact CD1-CD1 4.3Å; L747-L751 HydrophobicContact CD1-CG 4.36Å; L747-L751 HydrophobicContact CG-CD1 4.15Å; L747-L751 WeakPolarHBondContact O-CB 3.36Å; L747-L751 VanDerWaalsContact O-CG 3.26Å; L747-L751 WeakPolarHBondContact O-CG 3.38Å; L747-L751 PolarHBondContact O-N 2.75Å; L747-L751 VanDerWaalsContact O-N 3.09Å; L747-Y1715 HydrophobicContact CD1-CE1 3.59Å
748	A	94.3	Very high	92	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-39	175.6	0	0	0	0	0	112.5	A710 L711 L744 E745 R746 Q752 F791	A710-A748 HydrophobicContact CB-CB 3.85Å; L711-A748 HydrophobicContact CD2-CB 4.04Å; L711-A748 HydrophobicContact CG-CB 4.16Å; L744-A748 PolarHBondContact O-N 3.2Å; E745-A748 PolarHBondContact O-N 3.34Å; R746-A748 PolarHBondContact O-N 3.38Å; R746-A748 VanDerWaalsContact O-N 3.15Å; A748-Q752 WeakPolarHBondContact O-CB 3.23Å; A748-Q752 PolarHBondContact O-N 3.43Å; A748-Q752 VanDerWaalsContact O-N 3.15Å; A748-F791 HydrophobicContact CB-CD2 4.16Å; A748-F791 HydrophobicContact CB-CE2 4.22Å; A748-F791 WeakPolarHBondContact O-CE2 3.33Å
749	V	93.9	Very high	92.2	Very high	22 Å²	22	48.6 Å²	48.6	13%	0.133	23%	0.234	C	C	.	.	H	α-helix	trans	-72.3	-43.6	177.2	178.7	0	0	0	0	111	E745 R746 L751 Q752 D753 V790 F791	E745-V749 PolarHBondContact O-N 3.37Å; R746-V749 WeakPolarHBondContact O-CA 3.41Å; R746-V749 WeakPolarHBondContact O-CB 3.45Å; R746-V749 PolarHBondContact O-N 3.47Å; V749-L751 PolarHBondContact O-N 3.24Å; V749-Q752 WeakPolarHBondContact O-CB 3.45Å; V749-Q752 PolarHBondContact O-N 3.04Å; V749-Q752 VanDerWaalsContact O-N 3.09Å; V749-D753 PolarHBondContact O-N 2.87Å; V749-V790 HydrophobicContact CG1-CG1 4.14Å; V749-V790 HydrophobicContact CG2-CB 4.27Å; V749-V790 HydrophobicContact CG2-CG1 3.95Å; V749-F791 HydrophobicContact CG2-CB 4.09Å; V749-F791 HydrophobicContact CG2-CD2 4.15Å
750	D	93.1	Very high	92.3	Very high	72 Å²	72	50.1 Å²	50.1	39%	0.385	23%	0.234	S	C	.	.	H	α-helix	trans	-62.5	-42.2	-179.7	-58.3	-31.5	0	0	0	111.4	R746 H754 Y1715	R746-D750 PolarHBondContact O-N 3.47Å; D750-H754 WeakPolarHBondContact O-CB 3.12Å; D750-H754 PolarHBondContact O-N 3.34Å; D750-Y1715 HydrophobicContact CB-CE2 3.73Å; D750-Y1715 WeakPolarHBondContact CB-OH 3.37Å; D750-Y1715 PolarHBondContact OD2-OH 3.02Å
751	L	93.2	Very high	92.1	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-35.9	172.7	-73	172.8	0	0	0	112.4	L701 I707 L747 V749 H754 C755 V1712 Y1715	L701-L751 HydrophobicContact CD2-CD1 4.2Å; I707-L751 HydrophobicContact CD1-CB 4.24Å; I707-L751 HydrophobicContact CG1-CB 3.93Å; I707-L751 HydrophobicContact CG1-CD1 4.44Å; L747-L751 HydrophobicContact CD1-CD1 4.3Å; L747-L751 HydrophobicContact CD1-CG 4.36Å; L747-L751 HydrophobicContact CG-CD1 4.15Å; L747-L751 WeakPolarHBondContact O-CB 3.36Å; L747-L751 VanDerWaalsContact O-CG 3.26Å; L747-L751 WeakPolarHBondContact O-CG 3.38Å; L747-L751 PolarHBondContact O-N 2.75Å; L747-L751 VanDerWaalsContact O-N 3.09Å; V749-L751 PolarHBondContact O-N 3.24Å; L751-H754 PolarHBondContact O-N 3.08Å; L751-C755 WeakPolarHBondContact O-CB 3.41Å; L751-C755 PolarHBondContact O-N 2.99Å; L751-C755 PolarHBondContact O-SG 3.35Å; L751-V1712 HydrophobicContact CD1-CG2 4.42Å; L751-V1712 HydrophobicContact CD2-CG2 3.83Å; L751-Y1715 HydrophobicContact CD2-CD1 3.54Å; L751-Y1715 HydrophobicContact CD2-CD2 4.48Å; L751-Y1715 HydrophobicContact CD2-CE1 4.2Å; L751-Y1715 HydrophobicContact CD2-CG 3.72Å; L751-Y1715 HydrophobicContact CG-CD1 4.33Å
752	Q	94.5	Very high	92	Very high	3 Å²	3	55.3 Å²	55.3	1%	0.014	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-41.9	177.1	-170	-162.8	3.4	0	0	111.9	A748 V749 Y756 L767 F791 H794	A748-Q752 WeakPolarHBondContact O-CB 3.23Å; A748-Q752 PolarHBondContact O-N 3.43Å; A748-Q752 VanDerWaalsContact O-N 3.15Å; V749-Q752 WeakPolarHBondContact O-CB 3.45Å; V749-Q752 PolarHBondContact O-N 3.04Å; V749-Q752 VanDerWaalsContact O-N 3.09Å; Q752-Y756 WeakPolarHBondContact O-CB 3.14Å; Q752-Y756 PolarHBondContact O-N 3.01Å; Q752-L767 HydrophobicContact CG-CD1 4.14Å; Q752-F791 HydrophobicContact CB-CE2 3.95Å; Q752-F791 HydrophobicContact CB-CZ 4.49Å; Q752-F791 HydrophobicContact CG-CE2 4.12Å; Q752-F791 HydrophobicContact CG-CZ 4.22Å; Q752-F791 PolarHBondContact OE1-O 2.91Å; Q752-H794 PolarHBondContact NE2-ND1 2.9Å; Q752-H794 VanDerWaalsContact NE2-ND1 3.14Å; Q752-H794 PolarHBondContact OE1-ND1 2.95Å
753	D	94.1	Very high	91.9	Very high	46 Å²	46	52 Å²	52	25%	0.246	24%	0.244	C	C	.	.	H	α-helix	trans	-65.5	-45.7	173.6	-175	23	0	0	0	110.6	V749 C755 Y756 R757 H794	V749-D753 PolarHBondContact O-N 2.87Å; D753-C755 PolarHBondContact O-N 3.13Å; D753-Y756 PolarHBondContact O-N 2.91Å; D753-Y756 VanDerWaalsContact O-N 3.15Å; D753-R757 WeakPolarHBondContact O-CB 3.44Å; D753-R757 VanDerWaalsContact O-CG 3.31Å; D753-R757 WeakPolarHBondContact O-CG 3.26Å; D753-R757 PolarHBondContact O-N 2.87Å; D753-R757 IonicContact OD1-CZ 3.25Å; D753-R757 IonicContact OD1-NE 3.15Å; D753-R757 PolarHBondContact OD1-NE 2.83Å; D753-R757 IonicContact OD1-NH2 3.97Å; D753-R757 IonicContact OD2-CZ 2.74Å; D753-R757 IonicContact OD2-NE 3.44Å; D753-R757 PolarHBondContact OD2-NE 2.91Å; D753-R757 IonicContact OD2-NH2 3.64Å; D753-R757 PolarHBondContact OD2-NH2 3.31Å; D753-H794 IonicContact OD1-NE2 2.68Å
754	H	93.1	Very high	91.7	Very high	41 Å²	41	51.9 Å²	51.9	19%	0.19	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-47.5	176.9	-165.1	-81.4	0	0	0	112.7	D750 L751 Y756 R757 H758 C1711 Y1715	D750-H754 WeakPolarHBondContact O-CB 3.12Å; D750-H754 PolarHBondContact O-N 3.34Å; L751-H754 PolarHBondContact O-N 3.08Å; H754-Y756 PolarHBondContact O-N 2.81Å; H754-R757 PolarHBondContact O-N 3.37Å; H754-H758 PolarHBondContact O-N 3.11Å; H754-H758 VanDerWaalsContact O-N 3.12Å; H754-C1711 PolarHBondContact CE1-O 3.27Å; H754-C1711 PolarHBondContact ND1-O 3.03Å; H754-Y1715 HydrophobicContact CB-CD2 4.3Å
755	C	93.3	Very high	91.4	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.014	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-42.1	175.4	-64.4	0	0	0	0	111.7	L751 D753 R757 H758 D759 A763 L766 F1707 C1711	L751-C755 WeakPolarHBondContact O-CB 3.41Å; L751-C755 PolarHBondContact O-N 2.99Å; L751-C755 PolarHBondContact O-SG 3.35Å; D753-C755 PolarHBondContact O-N 3.13Å; C755-R757 PolarHBondContact O-N 3.21Å; C755-H758 PolarHBondContact O-N 2.98Å; C755-D759 PolarHBondContact O-N 2.8Å; C755-A763 HydrophobicContact CB-CB 4.23Å; C755-L766 HydrophobicContact CB-CD2 4.46Å; C755-F1707 HydrophobicContact CB-CE1 4.31Å; C755-F1707 HydrophobicContact CB-CZ 4.38Å; C755-C1711 VanDerWaalsContact SG-CB 3.6Å
756	Y	94	Very high	91.1	Very high	42 Å²	42	53.9 Å²	53.9	17%	0.165	24%	0.242	C	C	.	.	H	α-helix	trans	-68.6	-31	-179.8	-178.8	-115.7	0	0	0	113.2	Q752 D753 H754 Q760 P795 C796	Q752-Y756 WeakPolarHBondContact O-CB 3.14Å; Q752-Y756 PolarHBondContact O-N 3.01Å; D753-Y756 PolarHBondContact O-N 2.91Å; D753-Y756 VanDerWaalsContact O-N 3.15Å; H754-Y756 PolarHBondContact O-N 2.81Å; Y756-Q760 HydrophobicContact CD2-CB 4.04Å; Y756-Q760 HydrophobicContact CD2-CG 3.83Å; Y756-Q760 HydrophobicContact CE2-CB 3.75Å; Y756-Q760 HydrophobicContact CE2-CG 3.49Å; Y756-Q760 VanDerWaalsContact CE2-CG 3.49Å; Y756-Q760 VanDerWaalsContact O-CG 3.3Å; Y756-Q760 WeakPolarHBondContact O-CG 3.41Å; Y756-Q760 PolarHBondContact OH-OE1 3.1Å; Y756-P795 HydrophobicContact CE1-CB 4.23Å; Y756-C796 HydrophobicContact CD1-CB 4.24Å; Y756-C796 HydrophobicContact CD2-CB 3.54Å; Y756-C796 VanDerWaalsContact CD2-SG 3.54Å; Y756-C796 HydrophobicContact CE2-CB 4.04Å; Y756-C796 HydrophobicContact CG-CB 3.67Å
757	R	92.2	Very high	90.9	Very high	195 Å²	195	45.8 Å²	45.8	74%	0.736	21%	0.212	S	C	*	.	H	α-helix	trans	-73	-30.6	172.1	-70.1	176.8	-169	-149.7	11.7	112.8	D753 H754 C755	D753-R757 WeakPolarHBondContact O-CB 3.44Å; D753-R757 VanDerWaalsContact O-CG 3.31Å; D753-R757 WeakPolarHBondContact O-CG 3.26Å; D753-R757 PolarHBondContact O-N 2.87Å; D753-R757 IonicContact OD1-CZ 3.25Å; D753-R757 IonicContact OD1-NE 3.15Å; D753-R757 PolarHBondContact OD1-NE 2.83Å; D753-R757 IonicContact OD1-NH2 3.97Å; D753-R757 IonicContact OD2-CZ 2.74Å; D753-R757 IonicContact OD2-NE 3.44Å; D753-R757 PolarHBondContact OD2-NE 2.91Å; D753-R757 IonicContact OD2-NH2 3.64Å; D753-R757 PolarHBondContact OD2-NH2 3.31Å; H754-R757 PolarHBondContact O-N 3.37Å; C755-R757 PolarHBondContact O-N 3.21Å
758	H	90	Very high	90.4	Very high	99 Å²	99	45.2 Å²	45.2	46%	0.458	21%	0.209	S	C	.	.	H	α-helix	trans	-78.3	-57.5	178.7	-165.9	124.9	0	0	0	111.9	H754 C755 F1707	H754-H758 PolarHBondContact O-N 3.11Å; H754-H758 VanDerWaalsContact O-N 3.12Å; C755-H758 PolarHBondContact O-N 2.98Å; H758-F1707 HydrophobicContact CB-CE2 4.44Å; H758-F1707 AromaticContact CD2-CE2 3.98Å
759	D	90.1	Very high	89.8	Confident	57 Å²	57	45.6 Å²	45.6	31%	0.305	21%	0.21	S	C	.	.			trans	-144.2	112.7	174.5	-174.3	-42.3	0	0	0	110.3	C755 D761 Q762 A763 F1707	C755-D759 PolarHBondContact O-N 2.8Å; D759-D761 VanDerWaalsContact C-N 3.32Å; D759-D761 PolarHBondContact O-N 2.92Å; D759-D761 WeakPolarHBondContact OD1-CA 3.17Å; D759-D761 PolarHBondContact OD1-N 2.88Å; D759-Q762 HydrophobicContact CB-CB 4.18Å; D759-Q762 HydrophobicContact CB-CG 4.16Å; D759-Q762 PolarHBondContact OD1-N 3Å; D759-Q762 WeakPolarHBondContact OD2-CG 3.28Å; D759-A763 WeakPolarHBondContact O-CB 3.36Å; D759-A763 PolarHBondContact O-N 3.44Å; D759-F1707 HydrophobicContact CB-CE2 3.73Å; D759-F1707 HydrophobicContact CB-CZ 3.91Å
760	Q	89	Confident	89.1	Confident	98 Å²	98	46 Å²	46	46%	0.458	21%	0.211	S	C	.	.	H	α-helix	trans	-65.1	-31.8	-177.4	-64.7	-167	16.8	0	0	113.4	Y756 K764	Y756-Q760 HydrophobicContact CD2-CB 4.04Å; Y756-Q760 HydrophobicContact CD2-CG 3.83Å; Y756-Q760 HydrophobicContact CE2-CB 3.75Å; Y756-Q760 HydrophobicContact CE2-CG 3.49Å; Y756-Q760 VanDerWaalsContact CE2-CG 3.49Å; Y756-Q760 VanDerWaalsContact O-CG 3.3Å; Y756-Q760 WeakPolarHBondContact O-CG 3.41Å; Y756-Q760 PolarHBondContact OH-OE1 3.1Å; Q760-K764 WeakPolarHBondContact O-CE 3.44Å; Q760-K764 WeakPolarHBondContact O-CG 3.38Å; Q760-K764 PolarHBondContact O-N 3.1Å
761	D	83.2	Confident	88.6	Confident	90 Å²	90	42.6 Å²	42.6	48%	0.481	19%	0.193	S	C	.	.	H	α-helix	trans	-90.3	-35.2	-174.3	-74.1	-31.2	0	0	0	111.9	D759 A763 K764 R765	D759-D761 VanDerWaalsContact C-N 3.32Å; D759-D761 PolarHBondContact O-N 2.92Å; D759-D761 WeakPolarHBondContact OD1-CA 3.17Å; D759-D761 PolarHBondContact OD1-N 2.88Å; D761-A763 VanDerWaalsContact C-N 3.35Å; D761-K764 PolarHBondContact O-N 2.65Å; D761-K764 WeakPolarHBondContact OD1-CD 3.43Å; D761-K764 WeakPolarHBondContact OD1-CE 3.48Å; D761-K764 IonicContact OD1-NZ 2.72Å; D761-K764 PolarHBondContact OD1-NZ 3.34Å; D761-R765 WeakPolarHBondContact O-CG 3.05Å; D761-R765 PolarHBondContact O-N 2.85Å; D761-R765 VanDerWaalsContact O-N 3.08Å
762	Q	87.5	Confident	87.7	Confident	60 Å²	60	47 Å²	47	28%	0.28	21%	0.213	S	C	.	.	H	α-helix	trans	-66	-38.7	166.4	-53.8	-56.2	-16	0	0	110.9	D759 K764 R765 L766 L1704 F1707	D759-Q762 HydrophobicContact CB-CB 4.18Å; D759-Q762 HydrophobicContact CB-CG 4.16Å; D759-Q762 PolarHBondContact OD1-N 3Å; D759-Q762 WeakPolarHBondContact OD2-CG 3.28Å; Q762-K764 VanDerWaalsContact C-N 3.33Å; Q762-K764 PolarHBondContact O-N 3.23Å; Q762-R765 PolarHBondContact O-N 3.28Å; Q762-R765 VanDerWaalsContact O-N 3.1Å; Q762-L766 WeakPolarHBondContact O-CB 3.38Å; Q762-L766 PolarHBondContact O-N 3.02Å; Q762-L1704 HydrophobicContact CB-CD1 4.33Å; Q762-F1707 HydrophobicContact CB-CD1 3.8Å; Q762-F1707 HydrophobicContact CB-CD2 4.31Å; Q762-F1707 HydrophobicContact CB-CE1 3.62Å; Q762-F1707 HydrophobicContact CB-CE2 4.15Å; Q762-F1707 HydrophobicContact CB-CG 4.15Å; Q762-F1707 HydrophobicContact CB-CZ 3.81Å
763	A	90.5	Very high	86.6	Confident	2 Å²	2	47.6 Å²	47.6	2%	0.017	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-39.5	172.9	0	0	0	0	0	112.6	C755 D759 D761 R765 L766 L767	C755-A763 HydrophobicContact CB-CB 4.23Å; D759-A763 WeakPolarHBondContact O-CB 3.36Å; D759-A763 PolarHBondContact O-N 3.44Å; D761-A763 VanDerWaalsContact C-N 3.35Å; A763-R765 PolarHBondContact O-N 2.97Å; A763-L766 PolarHBondContact O-N 3.33Å; A763-L767 WeakPolarHBondContact O-CG 3.49Å; A763-L767 PolarHBondContact O-N 3.39Å; A763-L767 VanDerWaalsContact O-N 3.14Å
764	K	87.6	Confident	86	Confident	42 Å²	42	45.4 Å²	45.4	18%	0.183	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-40.8	172.4	-71.3	166.3	-156.7	168.8	0	112.3	Q760 D761 Q762 L767 T768 I800	Q760-K764 WeakPolarHBondContact O-CE 3.44Å; Q760-K764 WeakPolarHBondContact O-CG 3.38Å; Q760-K764 PolarHBondContact O-N 3.1Å; D761-K764 PolarHBondContact O-N 2.65Å; D761-K764 WeakPolarHBondContact OD1-CD 3.43Å; D761-K764 WeakPolarHBondContact OD1-CE 3.48Å; D761-K764 IonicContact OD1-NZ 2.72Å; D761-K764 PolarHBondContact OD1-NZ 3.34Å; Q762-K764 VanDerWaalsContact C-N 3.33Å; Q762-K764 PolarHBondContact O-N 3.23Å; K764-L767 PolarHBondContact O-N 3.47Å; K764-T768 WeakPolarHBondContact O-CG2 3.27Å; K764-T768 PolarHBondContact O-N 3.43Å; K764-T768 PolarHBondContact O-OG1 2.89Å; K764-I800 HydrophobicContact CB-CD1 4.42Å; K764-I800 HydrophobicContact CB-CG1 4.15Å; K764-I800 HydrophobicContact CG-CD1 4.36Å; K764-I800 HydrophobicContact CG-CG1 3.77Å
765	R	85.4	Confident	85	Confident	64 Å²	64	44.7 Å²	44.7	24%	0.242	21%	0.206	C	C	.	.	H	α-helix	trans	-66.7	-43	176.5	-65.4	171.1	87.9	-146.9	6.9	111.2	D761 Q762 A763 L767 T768 Y769 L1694 E1700 L1704	D761-R765 WeakPolarHBondContact O-CG 3.05Å; D761-R765 PolarHBondContact O-N 2.85Å; D761-R765 VanDerWaalsContact O-N 3.08Å; Q762-R765 PolarHBondContact O-N 3.28Å; Q762-R765 VanDerWaalsContact O-N 3.1Å; A763-R765 PolarHBondContact O-N 2.97Å; R765-L767 PolarHBondContact O-N 3.28Å; R765-T768 PolarHBondContact O-N 3.21Å; R765-T768 PolarHBondContact O-OG1 2.78Å; R765-Y769 PolarHBondContact O-N 3Å; R765-Y769 VanDerWaalsContact O-N 3.13Å; R765-L1694 HydrophobicContact CB-CD2 4.09Å; R765-L1694 HydrophobicContact CG-CD2 3.87Å; R765-E1700 IonicContact NH2-OE1 3.1Å; R765-E1700 PolarHBondContact NH2-OE1 3.18Å; R765-L1704 HydrophobicContact CB-CD1 4.16Å; R765-L1704 HydrophobicContact CB-CD2 4.26Å
766	L	87.9	Confident	84	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-57.8	-33.4	176.4	-169	73.2	0	0	0	112.4	I707 C755 Q762 A763 Y769 L1704 E1708	I707-L766 HydrophobicContact CD1-CD2 3.89Å; C755-L766 HydrophobicContact CB-CD2 4.46Å; Q762-L766 WeakPolarHBondContact O-CB 3.38Å; Q762-L766 PolarHBondContact O-N 3.02Å; A763-L766 PolarHBondContact O-N 3.33Å; L766-Y769 HydrophobicContact CD1-CE1 3.79Å; L766-Y769 HydrophobicContact CG-CE1 4.38Å; L766-Y769 WeakPolarHBondContact O-CD1 3.49Å; L766-Y769 VanDerWaalsContact O-CE1 3.22Å; L766-Y769 WeakPolarHBondContact O-CE1 3.35Å; L766-L1704 HydrophobicContact CB-CD1 4.08Å; L766-L1704 HydrophobicContact CB-CG 4.4Å; L766-L1704 HydrophobicContact CD1-CD1 4.25Å; L766-L1704 HydrophobicContact CD1-CG 3.87Å; L766-E1708 HydrophobicContact CD1-CB 4.01Å; L766-E1708 HydrophobicContact CD1-CG 4.35Å; L766-E1708 HydrophobicContact CD2-CB 4.4Å; L766-E1708 HydrophobicContact CD2-CG 4.24Å
767	L	88.5	Confident	83.1	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-83.7	-17.3	176.9	-63.4	178.8	0	0	0	114.1	Q752 A763 K764 R765 T778 C779 L780 F791 C796 T797 I800	Q752-L767 HydrophobicContact CG-CD1 4.14Å; A763-L767 WeakPolarHBondContact O-CG 3.49Å; A763-L767 PolarHBondContact O-N 3.39Å; A763-L767 VanDerWaalsContact O-N 3.14Å; K764-L767 PolarHBondContact O-N 3.47Å; R765-L767 PolarHBondContact O-N 3.28Å; L767-T778 PolarHBondContact O-OG1 2.78Å; L767-T778 VanDerWaalsContact O-OG1 3.13Å; L767-C779 HydrophobicContact CD2-CB 4.05Å; L767-L780 HydrophobicContact CB-CD2 4.24Å; L767-L780 HydrophobicContact CB-CG 4.14Å; L767-L780 WeakPolarHBondContact O-CG 3.49Å; L767-L780 PolarHBondContact O-N 2.82Å; L767-F791 HydrophobicContact CD2-CE1 4.05Å; L767-F791 HydrophobicContact CD2-CZ 3.67Å; L767-C796 HydrophobicContact CD1-CB 4.47Å; L767-T797 HydrophobicContact CD1-CG2 4.28Å; L767-I800 HydrophobicContact CB-CD1 3.88Å; L767-I800 HydrophobicContact CD1-CD1 3.98Å
768	T	82	Confident	82.7	Confident	4 Å²	4	39.8 Å²	39.8	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-113.2	-10.4	-168.4	53.1	0	0	0	0	116.7	K764 R765 L780 I800 P858 L1694	K764-T768 WeakPolarHBondContact O-CG2 3.27Å; K764-T768 PolarHBondContact O-N 3.43Å; K764-T768 PolarHBondContact O-OG1 2.89Å; R765-T768 PolarHBondContact O-N 3.21Å; R765-T768 PolarHBondContact O-OG1 2.78Å; T768-L780 HydrophobicContact CG2-CD1 3.9Å; T768-I800 HydrophobicContact CG2-CD1 4.25Å; T768-I800 HydrophobicContact CG2-CG2 4.02Å; T768-P858 HydrophobicContact CG2-CB 4.29Å; T768-L1694 PolarHBondContact O-N 3.14Å
769	Y	81.8	Confident	82.6	Confident	8 Å²	8	35.2 Å²	35.2	3%	0.031	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-32.1	162.6	162.4	-93.3	107.7	0	0	0	117.3	R765 L766 L771 T778 V1701 L1704 H1705	R765-Y769 PolarHBondContact O-N 3Å; R765-Y769 VanDerWaalsContact O-N 3.13Å; L766-Y769 HydrophobicContact CD1-CE1 3.79Å; L766-Y769 HydrophobicContact CG-CE1 4.38Å; L766-Y769 WeakPolarHBondContact O-CD1 3.49Å; L766-Y769 VanDerWaalsContact O-CE1 3.22Å; L766-Y769 WeakPolarHBondContact O-CE1 3.35Å; Y769-L771 HydrophobicContact CE1-CD2 4.35Å; Y769-L771 HydrophobicContact CE2-CD2 4.06Å; Y769-T778 WeakPolarHBondContact O-CB 3.42Å; Y769-T778 WeakPolarHBondContact O-CG2 3.33Å; Y769-V1701 HydrophobicContact CD2-CG1 4.45Å; Y769-V1701 HydrophobicContact CE2-CG1 4.07Å; Y769-L1704 HydrophobicContact CD1-CD2 3.56Å; Y769-L1704 HydrophobicContact CE1-CD2 3.97Å; Y769-L1704 HydrophobicContact CG-CD2 4.1Å; Y769-H1705 AromaticContact CE2-NE2 3.38Å; Y769-H1705 WeakPolarHBondContact CE2-NE2 3.3Å; Y769-H1705 AromaticContact CZ-CD2 3.89Å; Y769-H1705 AromaticContact CZ-NE2 3.38Å; Y769-H1705 PolarHBondContact OH-CD2 3.1Å; Y769-H1705 PolarHBondContact OH-NE2 3.41Å
770	E	79.7	Confident	82.4	Confident	30 Å²	30	33 Å²	33	14%	0.14	16%	0.16	C	C	.	.			trans	-90.3	108.8	145.9	-167.6	-175.2	96.2	0	0	113.9	Q772 K776 K1693 L1694	E770-Q772 PolarHBondContact O-N 3.3Å; E770-K776 HydrophobicContact CG-CB 3.76Å; E770-K776 HydrophobicContact CG-CG 4.28Å; E770-K776 WeakPolarHBondContact OE1-CG 3.49Å; E770-K776 IonicContact OE1-NZ 3.65Å; E770-K776 PolarHBondContact OE1-NZ 2.95Å; E770-K776 IonicContact OE2-NZ 3.96Å; E770-K1693 HydrophobicContact CG-CD 4.39Å; E770-L1694 PolarHBondContact N-O 3.3Å
771	L	82.3	Confident	82	Confident	1 Å²	1	29 Å²	29	1%	0.005	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-69	111.9	173	-66.6	163.5	0	0	0	111.1	E705 A708 Y769 A773 F774 K776 N777 C779	E705-L771 HydrophobicContact CB-CD2 4.5Å; E705-L771 HydrophobicContact CG-CD2 4.22Å; A708-L771 HydrophobicContact CB-CD1 3.67Å; A708-L771 HydrophobicContact CB-CD2 3.82Å; A708-L771 HydrophobicContact CB-CG 4.42Å; Y769-L771 HydrophobicContact CE1-CD2 4.35Å; Y769-L771 HydrophobicContact CE2-CD2 4.06Å; L771-A773 PolarHBondContact O-N 2.87Å; L771-F774 HydrophobicContact CB-CB 4.18Å; L771-F774 HydrophobicContact CB-CD2 4.25Å; L771-F774 HydrophobicContact CD1-CB 4.42Å; L771-F774 HydrophobicContact CD1-CD2 4.27Å; L771-F774 HydrophobicContact CD2-CD2 4.5Å; L771-K776 WeakPolarHBondContact O-CA 3.16Å; L771-K776 PolarHBondContact O-N 2.81Å; L771-N777 VanDerWaalsContact CB-O 3.26Å; L771-N777 WeakPolarHBondContact CB-O 3.36Å; L771-N777 PolarHBondContact N-O 3.29Å; L771-C779 HydrophobicContact CD1-CB 4.4Å
772	Q	74.2	Confident	82.1	Confident	92 Å²	92	24.8 Å²	24.8	43%	0.43	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-26.4	-171.5	-61.5	-170.5	9.8	0	0	113.3	E770	E770-Q772 PolarHBondContact O-N 3.3Å
773	A	72.6	Confident	82.1	Confident	16 Å²	16	21.9 Å²	21.9	13%	0.132	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-42.3	175.3	0	0	0	0	0	112.6	Y678 L771 S775	Y678-A773 HydrophobicContact CD2-CB 3.95Å; Y678-A773 HydrophobicContact CE2-CB 4.22Å; L771-A773 PolarHBondContact O-N 2.87Å; A773-S775 PolarHBondContact O-N 3.16Å; A773-S775 VanDerWaalsContact O-N 3.15Å
774	F	80.6	Confident	81.8	Confident	1 Å²	1	24.6 Å²	24.6	0%	0.004	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	67.4	-171.5	-59.2	-73.6	0	0	0	112	Y560 T681 E705 A708 K709 F712 L771 K776 N777	Y560-F774 HydrophobicContact CE2-CB 4.4Å; T681-F774 HydrophobicContact CG2-CE1 3.98Å; T681-F774 HydrophobicContact CG2-CE2 4.44Å; T681-F774 HydrophobicContact CG2-CZ 3.59Å; E705-F774 HydrophobicContact CB-CE2 4.28Å; E705-F774 WeakPolarHBondContact OE2-CD2 3.22Å; E705-F774 VanDerWaalsContact OE2-CE2 3.23Å; E705-F774 WeakPolarHBondContact OE2-CE2 3.26Å; A708-F774 HydrophobicContact CB-CD2 3.83Å; A708-F774 HydrophobicContact CB-CE2 3.67Å; A708-F774 HydrophobicContact CB-CZ 4.49Å; K709-F774 HydrophobicContact CG-CZ 4.16Å; F712-F774 HydrophobicContact CB-CD1 3.9Å; F712-F774 HydrophobicContact CB-CE1 3.54Å; F712-F774 HydrophobicContact CB-CZ 4.3Å; F712-F774 AromaticContact CD1-CE1 3.89Å; F712-F774 HydrophobicContact CD1-CE1 3.89Å; F712-F774 AromaticContact CD2-CD1 3.66Å; F712-F774 HydrophobicContact CD2-CD1 3.66Å; F712-F774 AromaticContact CD2-CE1 3.82Å; F712-F774 HydrophobicContact CD2-CE1 3.82Å; F712-F774 HydrophobicContact CE2-CD1 4.35Å; F712-F774 AromaticContact CG-CD1 3.79Å; F712-F774 HydrophobicContact CG-CD1 3.79Å; F712-F774 AromaticContact CG-CE1 3.46Å; F712-F774 HydrophobicContact CG-CE1 3.46Å; F712-F774 VanDerWaalsContact CG-CE1 3.46Å; L771-F774 HydrophobicContact CB-CB 4.18Å; L771-F774 HydrophobicContact CB-CD2 4.25Å; L771-F774 HydrophobicContact CD1-CB 4.42Å; L771-F774 HydrophobicContact CD1-CD2 4.27Å; L771-F774 HydrophobicContact CD2-CD2 4.5Å; F774-K776 PolarHBondContact O-N 3.34Å; F774-N777 WeakPolarHBondContact O-CB 3.46Å; F774-N777 PolarHBondContact O-N 2.68Å
775	S	73.1	Confident	81.5	Confident	25 Å²	25	23.5 Å²	23.5	18%	0.175	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	27.6	177.6	80.3	0	0	0	0	116.7	Y560 Q561 A773 N777	Y560-S775 WeakPolarHBondContact CD2-OG 3.13Å; Q561-S775 VanDerWaalsContact O-CB 3.27Å; Q561-S775 WeakPolarHBondContact O-CB 3.23Å; A773-S775 PolarHBondContact O-N 3.16Å; A773-S775 VanDerWaalsContact O-N 3.15Å; S775-N777 PolarHBondContact OG-ND2 3.29Å
776	K	71.2	Confident	81.4	Confident	107 Å²	107	20.5 Å²	20.5	47%	0.465	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	34.2	-174.7	-62.8	179.5	156.4	-76.6	0	113.7	E770 L771 F774 K1693	E770-K776 HydrophobicContact CG-CB 3.76Å; E770-K776 HydrophobicContact CG-CG 4.28Å; E770-K776 WeakPolarHBondContact OE1-CG 3.49Å; E770-K776 IonicContact OE1-NZ 3.65Å; E770-K776 PolarHBondContact OE1-NZ 2.95Å; E770-K776 IonicContact OE2-NZ 3.96Å; L771-K776 WeakPolarHBondContact O-CA 3.16Å; L771-K776 PolarHBondContact O-N 2.81Å; F774-K776 PolarHBondContact O-N 3.34Å; K776-K1693 WeakPolarHBondContact O-CE 3.3Å; K776-K1693 PolarHBondContact O-NZ 2.98Å
777	N	76.7	Confident	81.2	Confident	25 Å²	25	24.7 Å²	24.7	13%	0.134	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	-91.8	162	179.7	-78.4	-2	0	0	0	113.8	L771 F774 S775 S781 M785	L771-N777 VanDerWaalsContact CB-O 3.26Å; L771-N777 WeakPolarHBondContact CB-O 3.36Å; L771-N777 PolarHBondContact N-O 3.29Å; F774-N777 WeakPolarHBondContact O-CB 3.46Å; F774-N777 PolarHBondContact O-N 2.68Å; S775-N777 PolarHBondContact OG-ND2 3.29Å; N777-S781 WeakPolarHBondContact CB-OG 3.16Å; N777-M785 PolarHBondContact ND2-SD 3.49Å
778	T	83.5	Confident	81.1	Confident	4 Å²	4	24.6 Å²	24.6	3%	0.025	12%	0.121	C	C	.	.			trans	-49.3	141.6	151.5	137	0	0	0	0	116.5	L767 Y769 L780 S781 L782 L1692 K1693	L767-T778 PolarHBondContact O-OG1 2.78Å; L767-T778 VanDerWaalsContact O-OG1 3.13Å; Y769-T778 WeakPolarHBondContact O-CB 3.42Å; Y769-T778 WeakPolarHBondContact O-CG2 3.33Å; T778-L780 VanDerWaalsContact C-N 3.29Å; T778-L780 PolarHBondContact OG1-N 3.1Å; T778-S781 WeakPolarHBondContact CA-OG 3.34Å; T778-S781 PolarHBondContact N-OG 2.68Å; T778-S781 PolarHBondContact O-N 2.93Å; T778-S781 PolarHBondContact O-OG 3.08Å; T778-L782 VanDerWaalsContact O-CB 3.24Å; T778-L782 WeakPolarHBondContact O-CB 3.46Å; T778-L782 PolarHBondContact O-N 3.45Å; T778-L1692 WeakPolarHBondContact CG2-O 3.39Å; T778-K1693 HydrophobicContact CG2-CB 4.47Å; T778-K1693 HydrophobicContact CG2-CG 3.83Å
779	C	87.6	Confident	81.5	Confident	4 Å²	4	26.2 Å²	26.2	3%	0.027	13%	0.127	C	C	.	.	H	α-helix	trans	-61.3	-44	154.5	-168.3	0	0	0	0	109.7	L767 L771 S781 L782 A783	L767-C779 HydrophobicContact CD2-CB 4.05Å; L771-C779 HydrophobicContact CD1-CB 4.4Å; C779-S781 PolarHBondContact O-N 3.01Å; C779-L782 WeakPolarHBondContact O-CB 3.37Å; C779-L782 PolarHBondContact O-N 3.48Å; C779-A783 PolarHBondContact O-N 3.42Å
780	L	85.7	Confident	81.8	Confident	9 Å²	9	29.4 Å²	29.4	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-57.3	-47.5	172.4	-64.2	170.6	0	0	0	112.5	L767 T768 T778 L782 A783 Y784 T797 I800 Y1582	L767-L780 HydrophobicContact CB-CD2 4.24Å; L767-L780 HydrophobicContact CB-CG 4.14Å; L767-L780 WeakPolarHBondContact O-CG 3.49Å; L767-L780 PolarHBondContact O-N 2.82Å; T768-L780 HydrophobicContact CG2-CD1 3.9Å; T778-L780 VanDerWaalsContact C-N 3.29Å; T778-L780 PolarHBondContact OG1-N 3.1Å; L780-L782 VanDerWaalsContact C-N 3.28Å; L780-L782 PolarHBondContact O-N 3.27Å; L780-A783 PolarHBondContact O-N 3.13Å; L780-Y784 PolarHBondContact O-N 3.11Å; L780-T797 HydrophobicContact CD2-CG2 3.29Å; L780-I800 HydrophobicContact CD1-CD1 4.25Å; L780-I800 HydrophobicContact CD1-CG2 4.17Å; L780-I800 HydrophobicContact CD2-CD1 4.45Å; L780-Y1582 HydrophobicContact CB-CE2 3.9Å
781	S	80.9	Confident	82.4	Confident	15 Å²	15	28 Å²	28	11%	0.105	14%	0.141	C	C	.	.	H	α-helix	trans	-69.7	-27.8	179.6	73.5	0	0	0	0	112.7	N777 T778 C779 M785 Y1582	N777-S781 WeakPolarHBondContact CB-OG 3.16Å; T778-S781 WeakPolarHBondContact CA-OG 3.34Å; T778-S781 PolarHBondContact N-OG 2.68Å; T778-S781 PolarHBondContact O-N 2.93Å; T778-S781 PolarHBondContact O-OG 3.08Å; C779-S781 PolarHBondContact O-N 3.01Å; S781-M785 WeakPolarHBondContact O-CG 3.36Å; S781-M785 PolarHBondContact O-N 3.1Å; S781-Y1582 WeakPolarHBondContact CA-OH 3.42Å
782	L	84.4	Confident	82.8	Confident	1 Å²	1	28 Å²	28	1%	0.005	14%	0.141	C	C	.	.	H	α-helix	trans	-69.6	-45.7	172.1	-174.3	63.7	0	0	0	110.4	A708 L711 F712 T778 C779 L780 Y784 M785 C786	A708-L782 HydrophobicContact CB-CD2 4.3Å; A708-L782 WeakPolarHBondContact O-CD2 3.33Å; L711-L782 HydrophobicContact CB-CD2 3.9Å; L711-L782 HydrophobicContact CB-CG 4.01Å; F712-L782 HydrophobicContact CB-CD2 4.31Å; T778-L782 VanDerWaalsContact O-CB 3.24Å; T778-L782 WeakPolarHBondContact O-CB 3.46Å; T778-L782 PolarHBondContact O-N 3.45Å; C779-L782 WeakPolarHBondContact O-CB 3.37Å; C779-L782 PolarHBondContact O-N 3.48Å; L780-L782 VanDerWaalsContact C-N 3.28Å; L780-L782 PolarHBondContact O-N 3.27Å; L782-Y784 VanDerWaalsContact C-N 3.27Å; L782-Y784 PolarHBondContact O-N 3.49Å; L782-M785 CarbonylContact O-C 3.48Å; L782-M785 WeakPolarHBondContact O-CA 3.36Å; L782-M785 WeakPolarHBondContact O-CB 3.46Å; L782-M785 PolarHBondContact O-N 3.06Å; L782-C786 PolarHBondContact O-N 3.16Å; L782-C786 PolarHBondContact O-SG 3.45Å
783	A	88.6	Confident	83.4	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58.3	-38.5	174.4	0	0	0	0	0	112.7	L711 C779 L780 C786 E787 S788 F791 I792	L711-A783 HydrophobicContact CD1-CB 3.9Å; L711-A783 HydrophobicContact CD2-CB 4.19Å; C779-A783 PolarHBondContact O-N 3.42Å; L780-A783 PolarHBondContact O-N 3.13Å; A783-C786 WeakPolarHBondContact O-CB 3.37Å; A783-C786 PolarHBondContact O-N 3.3Å; A783-E787 PolarHBondContact O-N 3.22Å; A783-S788 PolarHBondContact O-N 3.43Å; A783-F791 HydrophobicContact CB-CB 4.44Å; A783-F791 HydrophobicContact CB-CD1 3.34Å; A783-F791 HydrophobicContact CB-CE1 3.77Å; A783-F791 HydrophobicContact CB-CG 4.08Å; A783-I792 HydrophobicContact CB-CD1 4.38Å; A783-I792 HydrophobicContact CB-CG1 4.18Å
784	Y	83.2	Confident	84.3	Confident	59 Å²	59	24.6 Å²	24.6	23%	0.231	13%	0.127	C	C	.	.	H	α-helix	trans	-66.1	-43.1	172.8	-173	-97.9	0	0	0	111.8	L780 L782 C786 E787 I792 Y1579 Y1582 A1583	L780-Y784 PolarHBondContact O-N 3.11Å; L782-Y784 VanDerWaalsContact C-N 3.27Å; L782-Y784 PolarHBondContact O-N 3.49Å; Y784-C786 PolarHBondContact O-N 3.31Å; Y784-E787 PolarHBondContact O-N 2.77Å; Y784-I792 HydrophobicContact CD2-CD1 4.09Å; Y784-Y1579 AromaticContact CD2-CE2 3.85Å; Y784-Y1579 HydrophobicContact CD2-CE2 3.85Å; Y784-Y1579 AromaticContact CD2-CZ 3.94Å; Y784-Y1579 HydrophobicContact CE2-CE1 4.32Å; Y784-Y1579 HydrophobicContact CE2-CE2 4.15Å; Y784-Y1579 AromaticContact CE2-CZ 3.78Å; Y784-Y1582 HydrophobicContact CD1-CE1 4.17Å; Y784-Y1582 AromaticContact CD2-CD1 3.42Å; Y784-Y1582 HydrophobicContact CD2-CD1 3.42Å; Y784-Y1582 VanDerWaalsContact CD2-CD1 3.42Å; Y784-Y1582 AromaticContact CD2-CE1 3.72Å; Y784-Y1582 HydrophobicContact CD2-CE1 3.72Å; Y784-Y1582 HydrophobicContact CD2-CG 4.42Å; Y784-Y1582 AromaticContact CE2-CD1 3.92Å; Y784-Y1582 HydrophobicContact CE2-CD1 3.92Å; Y784-Y1582 HydrophobicContact CE2-CE1 4.4Å; Y784-Y1582 AromaticContact CG-CD1 3.82Å; Y784-Y1582 HydrophobicContact CG-CD1 3.82Å; Y784-Y1582 AromaticContact CG-CE1 3.58Å; Y784-Y1582 HydrophobicContact CG-CE1 3.58Å; Y784-A1583 HydrophobicContact CE2-CB 4.17Å
785	M	81.6	Confident	84.8	Confident	19 Å²	19	28.4 Å²	28.4	9%	0.094	15%	0.152	C	C	.	.	H	α-helix	trans	-63.8	-22.5	171.3	-75.7	-180	58.8	0	0	113.6	V556 K715 N777 S781 L782 E787	V556-M785 HydrophobicContact CG1-CE 4.06Å; K715-M785 VanDerWaalsContact CD-O 3.22Å; K715-M785 WeakPolarHBondContact CD-O 3.45Å; K715-M785 WeakPolarHBondContact CE-O 3.44Å; K715-M785 PolarHBondContact NZ-O 2.9Å; N777-M785 PolarHBondContact ND2-SD 3.49Å; S781-M785 WeakPolarHBondContact O-CG 3.36Å; S781-M785 PolarHBondContact O-N 3.1Å; L782-M785 CarbonylContact O-C 3.48Å; L782-M785 WeakPolarHBondContact O-CA 3.36Å; L782-M785 WeakPolarHBondContact O-CB 3.46Å; L782-M785 PolarHBondContact O-N 3.06Å; M785-E787 VanDerWaalsContact C-N 3.3Å
786	C	83.4	Confident	85.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-10.4	173	-61.7	0	0	0	0	113.6	L711 R718 L782 A783 Y784 S788	L711-C786 PolarHBondContact O-SG 2.87Å; R718-C786 PolarHBondContact NH1-O 2.61Å; L782-C786 PolarHBondContact O-N 3.16Å; L782-C786 PolarHBondContact O-SG 3.45Å; A783-C786 WeakPolarHBondContact O-CB 3.37Å; A783-C786 PolarHBondContact O-N 3.3Å; Y784-C786 PolarHBondContact O-N 3.31Å; C786-S788 PolarHBondContact O-N 2.85Å
787	E	84.2	Confident	86.5	Confident	96 Å²	96	22.2 Å²	22.2	45%	0.449	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	32.9	-163.3	-62.1	102.6	-132	0	0	113	K715 A783 Y784 M785 K789	K715-E787 IonicContact NZ-OE1 3.29Å; K715-E787 PolarHBondContact NZ-OE1 3.23Å; K715-E787 IonicContact NZ-OE2 3.69Å; K715-E787 PolarHBondContact NZ-OE2 3.26Å; K715-E787 VanDerWaalsContact NZ-OE2 3.08Å; A783-E787 PolarHBondContact O-N 3.22Å; Y784-E787 PolarHBondContact O-N 2.77Å; M785-E787 VanDerWaalsContact C-N 3.3Å; E787-K789 PolarHBondContact O-N 3.16Å
788	S	86.6	Confident	87.1	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.007	12%	0.119	C	C	.	.			trans	-79.5	93.3	-179.4	-170.4	0	0	0	0	112	E745 A783 C786 F791 I792	E745-S788 VanDerWaalsContact OE1-CA 3.31Å; E745-S788 WeakPolarHBondContact OE1-CA 3.18Å; E745-S788 WeakPolarHBondContact OE1-CB 3.46Å; E745-S788 PolarHBondContact OE1-OG 2.97Å; A783-S788 PolarHBondContact O-N 3.43Å; C786-S788 PolarHBondContact O-N 2.85Å; S788-F791 WeakPolarHBondContact OG-CB 3.48Å; S788-I792 PolarHBondContact O-N 3.15Å
789	K	89	Confident	87.2	Confident	37 Å²	37	22.5 Å²	22.5	16%	0.161	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-42.1	179.3	-62.1	-174.3	172.8	-162.3	0	112.3	E787 G793 L1575 V1576 Y1579 V2367 D2368	E787-K789 PolarHBondContact O-N 3.16Å; K789-G793 PolarHBondContact O-N 3.01Å; K789-L1575 HydrophobicContact CB-CD2 4.19Å; K789-L1575 HydrophobicContact CB-CG 4.2Å; K789-V1576 HydrophobicContact CD-CG1 4.47Å; K789-V1576 HydrophobicContact CD-CG2 4.15Å; K789-Y1579 HydrophobicContact CG-CD2 4.32Å; K789-Y1579 HydrophobicContact CG-CG 4.28Å; K789-V2367 PolarHBondContact NZ-O 2.94Å; K789-D2368 VanDerWaalsContact CE-OD2 3.23Å; K789-D2368 WeakPolarHBondContact CE-OD2 3.25Å; K789-D2368 IonicContact NZ-OD2 3.93Å; K789-D2368 PolarHBondContact NZ-OD2 3.46Å
790	V	89.6	Confident	87	Confident	76 Å²	76	22.6 Å²	22.6	46%	0.461	13%	0.125	S	C	.	.	H	α-helix	trans	-65.1	-47.4	-178	-172.7	0	0	0	0	111.4	V749 I792 G793 H794 L1575	V749-V790 HydrophobicContact CG1-CG1 4.14Å; V749-V790 HydrophobicContact CG2-CB 4.27Å; V749-V790 HydrophobicContact CG2-CG1 3.95Å; V790-I792 VanDerWaalsContact C-N 3.34Å; V790-I792 PolarHBondContact O-N 3.32Å; V790-G793 PolarHBondContact O-N 3.44Å; V790-G793 VanDerWaalsContact O-N 3.16Å; V790-H794 PolarHBondContact O-N 2.58Å; V790-H794 VanDerWaalsContact O-N 3.16Å; V790-L1575 HydrophobicContact CG2-CD2 4.47Å
791	F	92.5	Very high	86.8	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.4	-38.2	-179.6	-169.3	-84.4	0	0	0	112.7	I707 L711 A748 V749 Q752 L767 A783 S788 H794 T797	I707-F791 HydrophobicContact CG2-CE2 3.6Å; I707-F791 HydrophobicContact CG2-CZ 3.7Å; L711-F791 HydrophobicContact CD1-CE1 4.16Å; L711-F791 HydrophobicContact CD1-CE2 4.19Å; L711-F791 HydrophobicContact CD1-CZ 3.94Å; L711-F791 HydrophobicContact CD2-CD2 4.26Å; L711-F791 HydrophobicContact CD2-CG 4.4Å; A748-F791 HydrophobicContact CB-CD2 4.16Å; A748-F791 HydrophobicContact CB-CE2 4.22Å; A748-F791 WeakPolarHBondContact O-CE2 3.33Å; V749-F791 HydrophobicContact CG2-CB 4.09Å; V749-F791 HydrophobicContact CG2-CD2 4.15Å; Q752-F791 HydrophobicContact CB-CE2 3.95Å; Q752-F791 HydrophobicContact CB-CZ 4.49Å; Q752-F791 HydrophobicContact CG-CE2 4.12Å; Q752-F791 HydrophobicContact CG-CZ 4.22Å; Q752-F791 PolarHBondContact OE1-O 2.91Å; L767-F791 HydrophobicContact CD2-CE1 4.05Å; L767-F791 HydrophobicContact CD2-CZ 3.67Å; A783-F791 HydrophobicContact CB-CB 4.44Å; A783-F791 HydrophobicContact CB-CD1 3.34Å; A783-F791 HydrophobicContact CB-CE1 3.77Å; A783-F791 HydrophobicContact CB-CG 4.08Å; S788-F791 WeakPolarHBondContact OG-CB 3.48Å; F791-H794 WeakPolarHBondContact O-CB 3.39Å; F791-T797 HydrophobicContact CD1-CG2 4.42Å; F791-T797 HydrophobicContact CE1-CG2 4.45Å; F791-T797 WeakPolarHBondContact O-CG2 3.32Å; F791-T797 PolarHBondContact O-OG1 2.85Å
792	I	89.9	Confident	86.7	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-79.6	-26	176.7	-62.3	-177.7	0	0	0	111.9	A783 Y784 S788 V790 H794 T797 Q798 Y1579	A783-I792 HydrophobicContact CB-CD1 4.38Å; A783-I792 HydrophobicContact CB-CG1 4.18Å; Y784-I792 HydrophobicContact CD2-CD1 4.09Å; S788-I792 PolarHBondContact O-N 3.15Å; V790-I792 VanDerWaalsContact C-N 3.34Å; V790-I792 PolarHBondContact O-N 3.32Å; I792-H794 VanDerWaalsContact C-N 3.29Å; I792-H794 PolarHBondContact O-N 3.14Å; I792-T797 VanDerWaalsContact C-OG1 3.28Å; I792-T797 PolarHBondContact O-OG1 2.74Å; I792-Q798 PolarHBondContact O-NE2 2.74Å; I792-Y1579 HydrophobicContact CB-CD2 4.17Å; I792-Y1579 HydrophobicContact CD1-CD2 3.91Å; I792-Y1579 HydrophobicContact CD1-CE2 3.98Å; I792-Y1579 HydrophobicContact CG1-CD2 4.5Å; I792-Y1579 HydrophobicContact CG2-CD2 4.41Å
793	G	86.8	Confident	86.2	Confident	17 Å²	17	26.2 Å²	26.2	18%	0.175	14%	0.143	C	C	.	.	H	α-helix	trans	-69.3	-20.1	171.8	0	0	0	0	0	115	K789 V790	K789-G793 PolarHBondContact O-N 3.01Å; V790-G793 PolarHBondContact O-N 3.44Å; V790-G793 VanDerWaalsContact O-N 3.16Å
794	H	92.3	Very high	85.2	Confident	20 Å²	20	27.9 Å²	27.9	9%	0.093	15%	0.152	C	C	.	.	S	Bend	trans	-57.4	146.5	-175.2	-173.9	-112.8	0	0	0	113.8	Q752 D753 V790 F791 I792 C796 T797 Q798	Q752-H794 PolarHBondContact NE2-ND1 2.9Å; Q752-H794 VanDerWaalsContact NE2-ND1 3.14Å; Q752-H794 PolarHBondContact OE1-ND1 2.95Å; D753-H794 IonicContact OD1-NE2 2.68Å; V790-H794 PolarHBondContact O-N 2.58Å; V790-H794 VanDerWaalsContact O-N 3.16Å; F791-H794 WeakPolarHBondContact O-CB 3.39Å; I792-H794 VanDerWaalsContact C-N 3.29Å; I792-H794 PolarHBondContact O-N 3.14Å; H794-C796 WeakPolarHBondContact ND1-CB 3.24Å; H794-C796 PolarHBondContact ND1-N 3.04Å; H794-C796 PolarHBondContact O-N 3.48Å; H794-C796 VanDerWaalsContact O-N 3.14Å; H794-T797 PolarHBondContact O-N 3.14Å; H794-T797 PolarHBondContact O-OG1 3.33Å; H794-Q798 PolarHBondContact O-N 3.35Å
795	P	90.2	Very high	84.6	Confident	81 Å²	81	30.3 Å²	30.3	53%	0.526	16%	0.161	S	C	.	.	H	α-helix	trans	-55.8	-32.6	-179.8	-30.9	38.7	0	0	0	115	Y756 Q798 A799	Y756-P795 HydrophobicContact CE1-CB 4.23Å; P795-Q798 PolarHBondContact O-N 3.13Å; P795-A799 VanDerWaalsContact O-CB 3.32Å; P795-A799 WeakPolarHBondContact O-CB 3.31Å; P795-A799 PolarHBondContact O-N 3.37Å
796	C	90.8	Very high	83.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.1	-47.4	177.8	-173.5	0	0	0	0	112.7	Y756 L767 H794 A799 I800	Y756-C796 HydrophobicContact CD1-CB 4.24Å; Y756-C796 HydrophobicContact CD2-CB 3.54Å; Y756-C796 VanDerWaalsContact CD2-SG 3.54Å; Y756-C796 HydrophobicContact CE2-CB 4.04Å; Y756-C796 HydrophobicContact CG-CB 3.67Å; L767-C796 HydrophobicContact CD1-CB 4.47Å; H794-C796 WeakPolarHBondContact ND1-CB 3.24Å; H794-C796 PolarHBondContact ND1-N 3.04Å; H794-C796 PolarHBondContact O-N 3.48Å; H794-C796 VanDerWaalsContact O-N 3.14Å; C796-A799 WeakPolarHBondContact O-CB 3.23Å; C796-A799 PolarHBondContact O-N 2.9Å; C796-I800 WeakPolarHBondContact O-CG1 3.2Å; C796-I800 PolarHBondContact O-N 3.1Å
797	T	90.1	Very high	82.9	Confident	1 Å²	1	34 Å²	34	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-64.7	-40.8	174.9	44.1	0	0	0	0	111.2	L767 L780 F791 I792 H794 A799 I800 L801	L767-T797 HydrophobicContact CD1-CG2 4.28Å; L780-T797 HydrophobicContact CD2-CG2 3.29Å; F791-T797 HydrophobicContact CD1-CG2 4.42Å; F791-T797 HydrophobicContact CE1-CG2 4.45Å; F791-T797 WeakPolarHBondContact O-CG2 3.32Å; F791-T797 PolarHBondContact O-OG1 2.85Å; I792-T797 VanDerWaalsContact C-OG1 3.28Å; I792-T797 PolarHBondContact O-OG1 2.74Å; H794-T797 PolarHBondContact O-N 3.14Å; H794-T797 PolarHBondContact O-OG1 3.33Å; T797-A799 VanDerWaalsContact C-N 3.29Å; T797-A799 PolarHBondContact O-N 3.48Å; T797-I800 PolarHBondContact O-N 3.4Å; T797-L801 WeakPolarHBondContact O-CG 3.34Å; T797-L801 PolarHBondContact O-N 3.13Å
798	Q	89.3	Confident	81.5	Confident	18 Å²	18	29.7 Å²	29.7	8%	0.084	17%	0.165	C	C	.	.	H	α-helix	trans	-66	-30.3	176	-66.4	-57.4	-41	0	0	112.6	I792 H794 P795 N802 N1578	I792-Q798 PolarHBondContact O-NE2 2.74Å; H794-Q798 PolarHBondContact O-N 3.35Å; P795-Q798 PolarHBondContact O-N 3.13Å; Q798-N802 WeakPolarHBondContact O-CB 3.25Å; Q798-N802 PolarHBondContact O-N 3.32Å; Q798-N802 PolarHBondContact O-ND2 2.81Å; Q798-N1578 PolarHBondContact NE2-O 2.78Å
799	A	85.2	Confident	80.2	Confident	18 Å²	18	31.7 Å²	31.7	15%	0.149	18%	0.175	C	C	.	.	H	α-helix	trans	-65.8	-46.6	170.3	0	0	0	0	0	111.8	P795 C796 T797 L801 N802 D803	P795-A799 VanDerWaalsContact O-CB 3.32Å; P795-A799 WeakPolarHBondContact O-CB 3.31Å; P795-A799 PolarHBondContact O-N 3.37Å; C796-A799 WeakPolarHBondContact O-CB 3.23Å; C796-A799 PolarHBondContact O-N 2.9Å; T797-A799 VanDerWaalsContact C-N 3.29Å; T797-A799 PolarHBondContact O-N 3.48Å; A799-L801 VanDerWaalsContact C-N 3.33Å; A799-L801 PolarHBondContact O-N 3.49Å; A799-N802 WeakPolarHBondContact O-CB 3.41Å; A799-N802 PolarHBondContact O-N 3.35Å; A799-N802 VanDerWaalsContact O-N 3.14Å; A799-D803 PolarHBondContact O-N 3Å
800	I	82.3	Confident	78.9	Confident	6 Å²	6	34.4 Å²	34.4	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-58.5	-45.6	174.4	-60.7	163.4	0	0	0	110.6	K764 L767 T768 L780 C796 T797 N802 D803 L804	K764-I800 HydrophobicContact CB-CD1 4.42Å; K764-I800 HydrophobicContact CB-CG1 4.15Å; K764-I800 HydrophobicContact CG-CD1 4.36Å; K764-I800 HydrophobicContact CG-CG1 3.77Å; L767-I800 HydrophobicContact CB-CD1 3.88Å; L767-I800 HydrophobicContact CD1-CD1 3.98Å; T768-I800 HydrophobicContact CG2-CD1 4.25Å; T768-I800 HydrophobicContact CG2-CG2 4.02Å; L780-I800 HydrophobicContact CD1-CD1 4.25Å; L780-I800 HydrophobicContact CD1-CG2 4.17Å; L780-I800 HydrophobicContact CD2-CD1 4.45Å; C796-I800 WeakPolarHBondContact O-CG1 3.2Å; C796-I800 PolarHBondContact O-N 3.1Å; T797-I800 PolarHBondContact O-N 3.4Å; I800-N802 VanDerWaalsContact C-N 3.32Å; I800-N802 PolarHBondContact O-N 3.39Å; I800-D803 PolarHBondContact O-N 3.47Å; I800-L804 VanDerWaalsContact O-CB 3.32Å; I800-L804 WeakPolarHBondContact O-CB 3.5Å; I800-L804 PolarHBondContact O-N 3.3Å
801	L	81	Confident	77.5	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-66.1	-31.3	177.4	-69.6	175.9	0	0	0	112.8	T797 A799 L804 W805 Y1582 I1585	T797-L801 WeakPolarHBondContact O-CG 3.34Å; T797-L801 PolarHBondContact O-N 3.13Å; A799-L801 VanDerWaalsContact C-N 3.33Å; A799-L801 PolarHBondContact O-N 3.49Å; L801-L804 HydrophobicContact CD2-CD2 4.48Å; L801-W805 WeakPolarHBondContact O-CB 3.31Å; L801-W805 PolarHBondContact O-N 3.39Å; L801-Y1582 HydrophobicContact CD2-CD2 4.1Å; L801-I1585 HydrophobicContact CB-CD1 3.97Å; L801-I1585 HydrophobicContact CD2-CD1 4.14Å
802	N	79.2	Confident	75.8	Confident	52 Å²	52	38 Å²	38	28%	0.278	20%	0.198	S	C	.	.	H	α-helix	trans	-68	-48.5	170.9	-71.7	-33	0	0	0	111.6	Q798 A799 I800 L804 W805 Y806 R1581	Q798-N802 WeakPolarHBondContact O-CB 3.25Å; Q798-N802 PolarHBondContact O-N 3.32Å; Q798-N802 PolarHBondContact O-ND2 2.81Å; A799-N802 WeakPolarHBondContact O-CB 3.41Å; A799-N802 PolarHBondContact O-N 3.35Å; A799-N802 VanDerWaalsContact O-N 3.14Å; I800-N802 VanDerWaalsContact C-N 3.32Å; I800-N802 PolarHBondContact O-N 3.39Å; N802-L804 VanDerWaalsContact C-N 3.29Å; N802-L804 PolarHBondContact O-N 2.78Å; N802-W805 PolarHBondContact O-N 3.32Å; N802-Y806 WeakPolarHBondContact O-CD2 3.46Å; N802-Y806 PolarHBondContact O-N 2.92Å; N802-R1581 PolarHBondContact OD1-NH1 3.41Å; N802-R1581 PolarHBondContact OD1-NH2 2.83Å
803	D	73.5	Confident	74.3	Confident	43 Å²	43	45 Å²	45	23%	0.23	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-32.7	179.4	-90	-51.4	0	0	0	112.6	A799 I800 G807 K849 Q857	A799-D803 PolarHBondContact O-N 3Å; I800-D803 PolarHBondContact O-N 3.47Å; D803-G807 PolarHBondContact O-N 3.25Å; D803-K849 IonicContact OD1-NZ 3.18Å; D803-K849 PolarHBondContact OD1-NZ 2.85Å; D803-Q857 PolarHBondContact O-NE2 3.25Å
804	L	69.1	Low	72.8	Confident	34 Å²	34	49.4 Å²	49.4	18%	0.178	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-47.4	170.2	177.8	57.6	0	0	0	111.5	I800 L801 N802 Y806 G807 I1585 L1692	I800-L804 VanDerWaalsContact O-CB 3.32Å; I800-L804 WeakPolarHBondContact O-CB 3.5Å; I800-L804 PolarHBondContact O-N 3.3Å; L801-L804 HydrophobicContact CD2-CD2 4.48Å; N802-L804 VanDerWaalsContact C-N 3.29Å; N802-L804 PolarHBondContact O-N 2.78Å; L804-Y806 VanDerWaalsContact C-N 3.34Å; L804-Y806 PolarHBondContact O-N 3Å; L804-G807 PolarHBondContact O-N 3.43Å; L804-G807 VanDerWaalsContact O-N 3.11Å; L804-I1585 HydrophobicContact CB-CG2 4.49Å; L804-I1585 HydrophobicContact CD2-CG2 3.46Å; L804-I1585 VanDerWaalsContact CD2-CG2 3.46Å; L804-I1585 HydrophobicContact CG-CG2 3.68Å; L804-L1692 HydrophobicContact CD1-CD1 3.83Å; L804-L1692 HydrophobicContact CD1-CD2 4.25Å; L804-L1692 HydrophobicContact CD1-CG 4.43Å; L804-L1692 HydrophobicContact CD2-CD1 3.51Å; L804-L1692 HydrophobicContact CD2-CD2 3.85Å; L804-L1692 HydrophobicContact CD2-CG 4.33Å; L804-L1692 HydrophobicContact CG-CD1 4.32Å; L804-L1692 HydrophobicContact CG-CD2 4.48Å
805	W	70.1	Confident	71.1	Confident	111 Å²	111	51.3 Å²	51.3	42%	0.42	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-34.8	-179.2	-178.4	-104.4	0	0	0	113.8	L801 N802 I1449 I1585	L801-W805 WeakPolarHBondContact O-CB 3.31Å; L801-W805 PolarHBondContact O-N 3.39Å; N802-W805 PolarHBondContact O-N 3.32Å; W805-I1449 HydrophobicContact CH2-CD1 4.29Å; W805-I1449 HydrophobicContact CH2-CG2 3.4Å; W805-I1449 HydrophobicContact CZ2-CG2 3.41Å; W805-I1449 VanDerWaalsContact CZ2-CG2 3.41Å; W805-I1449 HydrophobicContact CZ3-CG2 4.19Å; W805-I1585 HydrophobicContact CB-CD1 4.33Å; W805-I1585 HydrophobicContact CE3-CD1 4.46Å; W805-I1585 HydrophobicContact CE3-CG1 3.93Å; W805-I1585 HydrophobicContact CE3-CG2 4.49Å
806	Y	64.8	Low	69.5	Low	66 Å²	66	50.2 Å²	50.2	26%	0.259	27%	0.271	S	S	.	.	H	α-helix	trans	-81.3	-16.8	174.5	-72	-64.6	0	0	0	113.9	N802 L804 G808 L809 K811	N802-Y806 WeakPolarHBondContact O-CD2 3.46Å; N802-Y806 PolarHBondContact O-N 2.92Å; L804-Y806 VanDerWaalsContact C-N 3.34Å; L804-Y806 PolarHBondContact O-N 3Å; Y806-G808 PolarHBondContact O-N 2.66Å; Y806-L809 VanDerWaalsContact O-CB 3.29Å; Y806-L809 WeakPolarHBondContact O-CB 3.39Å; Y806-L809 PolarHBondContact O-N 2.84Å; Y806-K811 HydrophobicContact CD2-CB 4.26Å; Y806-K811 HydrophobicContact CD2-CG 4.49Å; Y806-K811 HydrophobicContact CE2-CB 4.24Å; Y806-K811 HydrophobicContact CE2-CD 4.45Å; Y806-K811 HydrophobicContact CE2-CG 3.99Å
807	G	63.5	Low	67.9	Low	30 Å²	30	52 Å²	52	31%	0.309	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	-128.8	-177.7	0	0	0	0	0	112.3	D803 L804 L809 Q857	D803-G807 PolarHBondContact O-N 3.25Å; L804-G807 PolarHBondContact O-N 3.43Å; L804-G807 VanDerWaalsContact O-N 3.11Å; G807-L809 PolarHBondContact O-N 3.05Å; G807-Q857 PolarHBondContact O-NE2 3Å; G807-Q857 PolarHBondContact O-OE1 3.47Å
808	G	55.3	Low	66.3	Low	6 Å²	6	53.6 Å²	53.6	6%	0.062	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	2.1	177.3	0	0	0	0	0	115.8	Y806 F848 K849	Y806-G808 PolarHBondContact O-N 2.66Å; G808-F848 CarbonylContact O-C 2.98Å; G808-F848 WeakPolarHBondContact O-CA 3.35Å; G808-K849 PolarHBondContact O-N 2.85Å
809	L	59.8	Low	64.9	Low	43 Å²	43	55.8 Å²	55.8	23%	0.225	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-88.9	137.1	179.9	-161.1	70.7	0	0	0	111.3	Y806 G807 K811 L846 F848	Y806-L809 VanDerWaalsContact O-CB 3.29Å; Y806-L809 WeakPolarHBondContact O-CB 3.39Å; Y806-L809 PolarHBondContact O-N 2.84Å; G807-L809 PolarHBondContact O-N 3.05Å; L809-K811 PolarHBondContact O-N 2.67Å; L809-L846 HydrophobicContact CD1-CD2 4.21Å; L809-F848 HydrophobicContact CD1-CD1 4.47Å; L809-F848 HydrophobicContact CD1-CE1 4.36Å
810	R	61.6	Low	63.7	Low	93 Å²	93	57.1 Å²	57.1	35%	0.351	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-74.1	123.1	175.2	-153.2	176.1	-163	108.9	21.7	110	G812 K818 E847 E853	R810-G812 PolarHBondContact O-N 3.21Å; R810-K818 PolarHBondContact O-NZ 3.33Å; R810-E847 HydrophobicContact CB-CB 4.16Å; R810-E847 VanDerWaalsContact CB-O 3.24Å; R810-E847 WeakPolarHBondContact CB-O 3.4Å; R810-E847 WeakPolarHBondContact CD-OE1 3.37Å; R810-E847 IonicContact CZ-OE1 3.55Å; R810-E847 PolarHBondContact N-O 2.84Å; R810-E847 IonicContact NE-OE1 2.66Å; R810-E847 PolarHBondContact NE-OE1 2.6Å; R810-E847 IonicContact NH1-OE1 2.71Å; R810-E847 PolarHBondContact NH1-OE1 3.37Å; R810-E853 IonicContact CZ-OE1 2.94Å; R810-E853 IonicContact NH1-OE1 3.06Å; R810-E853 PolarHBondContact NH1-OE1 2.81Å; R810-E853 IonicContact NH1-OE2 3.89Å; R810-E853 IonicContact NH2-OE1 2.77Å; R810-E853 PolarHBondContact NH2-OE1 2.89Å
811	K	61.1	Low	62.4	Low	137 Å²	137	60.4 Å²	60.4	60%	0.596	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-51.2	138.1	167.3	-176.9	-172.7	174.1	-167.1	0	108.4	Y806 L809	Y806-K811 HydrophobicContact CD2-CB 4.26Å; Y806-K811 HydrophobicContact CD2-CG 4.49Å; Y806-K811 HydrophobicContact CE2-CB 4.24Å; Y806-K811 HydrophobicContact CE2-CD 4.45Å; Y806-K811 HydrophobicContact CE2-CG 3.99Å; L809-K811 PolarHBondContact O-N 2.67Å
812	G	56.9	Low	61.2	Low	14 Å²	14	61.6 Å²	61.6	14%	0.144	34%	0.341	C	S	.	.			trans	178.4	150.4	177.2	0	0	0	0	0	110.7	R810 L814 V815 K818	R810-G812 PolarHBondContact O-N 3.21Å; G812-L814 PolarHBondContact O-N 2.83Å; G812-V815 WeakPolarHBondContact O-CG2 3.31Å; G812-K818 PolarHBondContact O-NZ 2.99Å
813	D	57.6	Low	60.3	Low	148 Å²	148	62.6 Å²	62.6	79%	0.791	35%	0.346	S	S	*	.	S	Bend	trans	-79.4	-23.6	-133.3	-44.2	-68.8	0	0	0	113.3	V815	D813-V815 PolarHBondContact O-N 2.98Å
814	L	54.5	Low	59.7	Low	110 Å²	110	65.3 Å²	65.3	58%	0.576	36%	0.36	S	S	*	.			trans	-77.2	44.6	175	-74	162.1	0	0	0	113.1	G812 G816 A817 K818	G812-L814 PolarHBondContact O-N 2.83Å; L814-G816 VanDerWaalsContact C-N 3.3Å; L814-G816 PolarHBondContact O-N 3.15Å; L814-A817 HydrophobicContact CB-CB 4.26Å; L814-A817 HydrophobicContact CD2-CB 4.31Å; L814-A817 PolarHBondContact O-N 3.02Å; L814-A817 VanDerWaalsContact O-N 3.15Å; L814-K818 WeakPolarHBondContact O-CG 3.4Å; L814-K818 PolarHBondContact O-N 3.44Å
815	V	57.5	Low	59.1	Low	60 Å²	60	63.9 Å²	63.9	36%	0.364	35%	0.353	S	S	.	.	H	α-helix	trans	-55.6	-43.9	-177.4	-177.8	0	0	0	0	111.5	G812 D813 K818 V819	G812-V815 WeakPolarHBondContact O-CG2 3.31Å; D813-V815 PolarHBondContact O-N 2.98Å; V815-K818 PolarHBondContact O-N 3.09Å; V815-V819 WeakPolarHBondContact O-CG2 3.45Å; V815-V819 PolarHBondContact O-N 2.75Å
816	G	56.8	Low	58.5	Low	59 Å²	59	60.7 Å²	60.7	61%	0.608	34%	0.344	S	S	*	.	H	α-helix	trans	-62	-43.8	177	0	0	0	0	0	113.4	L814 V819 A820	L814-G816 VanDerWaalsContact C-N 3.3Å; L814-G816 PolarHBondContact O-N 3.15Å; G816-V819 PolarHBondContact O-N 2.76Å; G816-A820 WeakPolarHBondContact O-CB 3.13Å; G816-A820 PolarHBondContact O-N 2.92Å
817	A	57.1	Low	58.3	Low	37 Å²	37	64.1 Å²	64.1	31%	0.306	37%	0.365	S	S	.	.	H	α-helix	trans	-71.5	-35	178.4	0	0	0	0	0	112.5	L814 A820 L821 F845	L814-A817 HydrophobicContact CB-CB 4.26Å; L814-A817 HydrophobicContact CD2-CB 4.31Å; L814-A817 PolarHBondContact O-N 3.02Å; L814-A817 VanDerWaalsContact O-N 3.15Å; A817-A820 PolarHBondContact O-N 3.44Å; A817-L821 WeakPolarHBondContact O-CB 3.19Å; A817-L821 PolarHBondContact O-N 3.17Å; A817-F845 HydrophobicContact CB-CZ 4.33Å
818	K	56.9	Low	58.2	Low	34 Å²	34	65.3 Å²	65.3	15%	0.148	37%	0.367	C	S	.	.	H	α-helix	trans	-57.2	-50.9	168.5	-74.4	174.5	176.2	174	0	110.1	R810 G812 L814 V815 A820 L821 I822 F845	R810-K818 PolarHBondContact O-NZ 3.33Å; G812-K818 PolarHBondContact O-NZ 2.99Å; L814-K818 WeakPolarHBondContact O-CG 3.4Å; L814-K818 PolarHBondContact O-N 3.44Å; V815-K818 PolarHBondContact O-N 3.09Å; K818-A820 PolarHBondContact O-N 2.84Å; K818-L821 PolarHBondContact O-N 3.38Å; K818-I822 WeakPolarHBondContact O-CB 3.36Å; K818-I822 WeakPolarHBondContact O-CD1 3.5Å; K818-I822 WeakPolarHBondContact O-CG1 3.36Å; K818-I822 PolarHBondContact O-N 3.09Å; K818-F845 HydrophobicContact CG-CD1 4.34Å; K818-F845 HydrophobicContact CG-CE1 3.98Å
819	V	59.3	Low	58.3	Low	64 Å²	64	68.9 Å²	68.9	39%	0.388	39%	0.389	S	S	.	.	H	α-helix	trans	-63.5	-38.3	178.2	173	0	0	0	0	112.3	V815 G816 I822 L823	V815-V819 WeakPolarHBondContact O-CG2 3.45Å; V815-V819 PolarHBondContact O-N 2.75Å; G816-V819 PolarHBondContact O-N 2.76Å; V819-I822 PolarHBondContact O-N 3.41Å; V819-L823 HydrophobicContact CG1-CD1 4.23Å; V819-L823 WeakPolarHBondContact O-CB 3.45Å; V819-L823 PolarHBondContact O-N 3.18Å
820	A	58.9	Low	58.3	Low	46 Å²	46	71.4 Å²	71.4	38%	0.38	41%	0.408	S	S	.	.	H	α-helix	trans	-65.9	-41.8	176.7	0	0	0	0	0	113.1	G816 A817 K818 L823 I824	G816-A820 WeakPolarHBondContact O-CB 3.13Å; G816-A820 PolarHBondContact O-N 2.92Å; A817-A820 PolarHBondContact O-N 3.44Å; K818-A820 PolarHBondContact O-N 2.84Å; A820-L823 WeakPolarHBondContact O-CB 3.45Å; A820-L823 PolarHBondContact O-N 3.25Å; A820-I824 WeakPolarHBondContact O-CG1 3.45Å; A820-I824 PolarHBondContact O-N 2.67Å; A820-I824 VanDerWaalsContact O-N 3.08Å
821	L	55.6	Low	58.1	Low	76 Å²	76	70.5 Å²	70.5	40%	0.398	41%	0.41	S	S	.	.	H	α-helix	trans	-71.5	-31.9	174.5	-75.2	165.6	0	0	0	112.3	A817 K818 I824 G825 F845	A817-L821 WeakPolarHBondContact O-CB 3.19Å; A817-L821 PolarHBondContact O-N 3.17Å; K818-L821 PolarHBondContact O-N 3.38Å; L821-I824 HydrophobicContact CD2-CD1 4.49Å; L821-I824 PolarHBondContact O-N 3.14Å; L821-G825 PolarHBondContact O-N 3.5Å; L821-F845 HydrophobicContact CD1-CD1 4.1Å; L821-F845 HydrophobicContact CD1-CE1 3.57Å; L821-F845 HydrophobicContact CD1-CZ 3.92Å
822	I	57.2	Low	57.9	Low	31 Å²	31	68.1 Å²	68.1	16%	0.159	40%	0.398	C	S	.	.	H	α-helix	trans	-64.1	-43.3	170.4	-72.5	164.7	0	0	0	110.8	K818 V819 I824 G825 L826 F1328	K818-I822 WeakPolarHBondContact O-CB 3.36Å; K818-I822 WeakPolarHBondContact O-CD1 3.5Å; K818-I822 WeakPolarHBondContact O-CG1 3.36Å; K818-I822 PolarHBondContact O-N 3.09Å; V819-I822 PolarHBondContact O-N 3.41Å; I822-I824 PolarHBondContact O-N 2.61Å; I822-G825 PolarHBondContact O-N 3.23Å; I822-L826 HydrophobicContact CG2-CD1 4.26Å; I822-L826 WeakPolarHBondContact O-CB 3.34Å; I822-L826 PolarHBondContact O-N 3.15Å; I822-F1328 HydrophobicContact CB-CE2 4.4Å; I822-F1328 HydrophobicContact CG1-CE2 4.1Å; I822-F1328 HydrophobicContact CG2-CE2 3.82Å; I822-F1328 HydrophobicContact CG2-CZ 4.08Å
823	L	58.5	Low	58	Low	73 Å²	73	71.4 Å²	71.4	38%	0.382	42%	0.416	S	S	.	.	H	α-helix	trans	-56.5	-48	172.8	-90.1	159.6	0	0	0	111.9	V819 A820 L826 I827 L1333	V819-L823 HydrophobicContact CG1-CD1 4.23Å; V819-L823 WeakPolarHBondContact O-CB 3.45Å; V819-L823 PolarHBondContact O-N 3.18Å; A820-L823 WeakPolarHBondContact O-CB 3.45Å; A820-L823 PolarHBondContact O-N 3.25Å; L823-L826 PolarHBondContact O-N 3.28Å; L823-I827 WeakPolarHBondContact O-CG1 3.41Å; L823-I827 PolarHBondContact O-N 3.13Å; L823-L1333 HydrophobicContact CD2-CD1 3.72Å; L823-L1333 HydrophobicContact CD2-CD2 3.86Å; L823-L1333 HydrophobicContact CD2-CG 4.36Å; L823-L1333 HydrophobicContact CG-CD1 3.92Å; L823-L1333 HydrophobicContact CG-CD2 4.45Å
824	I	62.2	Low	58	Low	99 Å²	99	68.2 Å²	68.2	51%	0.508	40%	0.399	S	S	.	.	H	α-helix	trans	-63.1	-42.6	177	-67.9	164.1	0	0	0	111.1	A820 L821 I822 L826 I827 I835	A820-I824 WeakPolarHBondContact O-CG1 3.45Å; A820-I824 PolarHBondContact O-N 2.67Å; A820-I824 VanDerWaalsContact O-N 3.08Å; L821-I824 HydrophobicContact CD2-CD1 4.49Å; L821-I824 PolarHBondContact O-N 3.14Å; I822-I824 PolarHBondContact O-N 2.61Å; I824-L826 VanDerWaalsContact C-N 3.28Å; I824-L826 PolarHBondContact O-N 3.45Å; I824-I827 PolarHBondContact O-N 2.89Å; I824-I835 HydrophobicContact CG2-CD1 4.34Å
825	G	56.9	Low	58.1	Low	4 Å²	4	65.4 Å²	65.4	4%	0.041	38%	0.384	C	S	.	.	H	α-helix	trans	-65.8	-25.4	175.2	0	0	0	0	0	114.5	L821 I822 V828	L821-G825 PolarHBondContact O-N 3.5Å; I822-G825 PolarHBondContact O-N 3.23Å; G825-V828 CarbonylContact O-C 3.3Å
826	L	56.4	Low	58	Low	45 Å²	45	64.5 Å²	64.5	24%	0.236	38%	0.383	C	S	.	.	H	α-helix	trans	-77.7	-32.2	178.6	-107.7	163.6	0	0	0	113.5	I822 L823 I824 V828 F1328 L1333	I822-L826 HydrophobicContact CG2-CD1 4.26Å; I822-L826 WeakPolarHBondContact O-CB 3.34Å; I822-L826 PolarHBondContact O-N 3.15Å; L823-L826 PolarHBondContact O-N 3.28Å; I824-L826 VanDerWaalsContact C-N 3.28Å; I824-L826 PolarHBondContact O-N 3.45Å; L826-V828 VanDerWaalsContact C-N 3.27Å; L826-V828 PolarHBondContact O-N 2.89Å; L826-F1328 HydrophobicContact CG-CE1 4.11Å; L826-F1328 HydrophobicContact CG-CZ 4.21Å; L826-L1333 HydrophobicContact CD1-CB 4.45Å; L826-L1333 HydrophobicContact CD1-CD1 3.54Å
827	I	61.5	Low	58	Low	137 Å²	137	69.2 Å²	69.2	70%	0.703	39%	0.386	S	S	*	.	H	α-helix	trans	-66.2	-33	179	-65	167.1	0	0	0	110.8	L823 I824	L823-I827 WeakPolarHBondContact O-CG1 3.41Å; L823-I827 PolarHBondContact O-N 3.13Å; I824-I827 PolarHBondContact O-N 2.89Å
828	V	61.1	Low	57.8	Low	55 Å²	55	75 Å²	75	33%	0.333	41%	0.405	S	S	.	.			trans	-135	86	176.3	-170.9	0	0	0	0	110.6	G825 L826 P830 L831	G825-V828 CarbonylContact O-C 3.3Å; L826-V828 VanDerWaalsContact C-N 3.27Å; L826-V828 PolarHBondContact O-N 2.89Å; V828-P830 VanDerWaalsContact C-CD 3.42Å; V828-P830 HydrophobicContact CG1-CG 3.88Å; V828-L831 HydrophobicContact CB-CB 3.99Å; V828-L831 HydrophobicContact CB-CD1 3.89Å; V828-L831 HydrophobicContact CB-CG 4.12Å; V828-L831 HydrophobicContact CG1-CB 3.87Å; V828-L831 HydrophobicContact CG1-CD1 3.82Å; V828-L831 HydrophobicContact CG1-CG 3.68Å; V828-L831 HydrophobicContact CG2-CD1 4.21Å; V828-L831 WeakPolarHBondContact O-CA 3.47Å; V828-L831 WeakPolarHBondContact O-CB 3.16Å; V828-L831 PolarHBondContact O-N 3.02Å
829	P	57.1	Low	57.7	Low	81 Å²	81	79.6 Å²	79.6	53%	0.526	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-51.3	-37.6	178.1	-28.5	36.4	0	0	0	116.3	L831 Y832	P829-L831 VanDerWaalsContact C-N 3.27Å; P829-L831 PolarHBondContact O-N 3.34Å; P829-Y832 WeakPolarHBondContact O-CB 3.43Å; P829-Y832 PolarHBondContact O-N 3.02Å
830	P	60.6	Low	57.4	Low	96 Å²	96	81.4 Å²	81.4	62%	0.623	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-74.2	-10.9	174.7	29.4	-34.9	0	0	0	114.3	V828 P833	V828-P830 VanDerWaalsContact C-CD 3.42Å; V828-P830 HydrophobicContact CG1-CG 3.88Å; P830-P833 WeakPolarHBondContact O-CD 3.4Å; P830-P833 WeakPolarHBondContact O-CG 3.47Å
831	L	57.5	Low	56.7	Low	75 Å²	75	88.9 Å²	88.9	39%	0.393	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-80.9	-19.6	168.2	-83.5	177.2	0	0	0	112.7	V828 P829 L834 I835	V828-L831 HydrophobicContact CB-CB 3.99Å; V828-L831 HydrophobicContact CB-CD1 3.89Å; V828-L831 HydrophobicContact CB-CG 4.12Å; V828-L831 HydrophobicContact CG1-CB 3.87Å; V828-L831 HydrophobicContact CG1-CD1 3.82Å; V828-L831 HydrophobicContact CG1-CG 3.68Å; V828-L831 HydrophobicContact CG2-CD1 4.21Å; V828-L831 WeakPolarHBondContact O-CA 3.47Å; V828-L831 WeakPolarHBondContact O-CB 3.16Å; V828-L831 PolarHBondContact O-N 3.02Å; P829-L831 VanDerWaalsContact C-N 3.27Å; P829-L831 PolarHBondContact O-N 3.34Å; L831-L834 HydrophobicContact CD2-CB 3.87Å; L831-L834 HydrophobicContact CD2-CD1 3.81Å; L831-L834 HydrophobicContact CD2-CG 4.44Å; L831-L834 CarbonylContact O-C 3.49Å; L831-L834 WeakPolarHBondContact O-CA 3.47Å; L831-L834 WeakPolarHBondContact O-CB 3.23Å; L831-L834 PolarHBondContact O-N 3.31Å; L831-I835 HydrophobicContact CB-CD1 4.09Å; L831-I835 HydrophobicContact CB-CG1 4.43Å; L831-I835 WeakPolarHBondContact O-CG1 3.32Å; L831-I835 PolarHBondContact O-N 3.46Å
832	Y	57	Low	55.9	Low	87 Å²	87	93.4 Å²	93.4	34%	0.341	48%	0.477	S	S	.	.	H	α-helix	trans	-52.4	-49.7	176.8	-172.7	-92.6	0	0	0	113.8	P829 L834 A836 F1328	P829-Y832 WeakPolarHBondContact O-CB 3.43Å; P829-Y832 PolarHBondContact O-N 3.02Å; Y832-L834 VanDerWaalsContact C-N 3.26Å; Y832-L834 PolarHBondContact O-N 3.29Å; Y832-A836 VanDerWaalsContact O-CB 3.28Å; Y832-A836 WeakPolarHBondContact O-CB 3.31Å; Y832-A836 PolarHBondContact O-N 3.31Å; Y832-F1328 HydrophobicContact CE2-CE2 4.18Å
833	P	57.3	Low	55.6	Low	83 Å²	83	94.4 Å²	94.4	54%	0.539	49%	0.487	S	S	.	.	H	α-helix	trans	-66.5	-24.4	173.9	27	-36	0	0	0	113.7	P830 F837	P830-P833 WeakPolarHBondContact O-CD 3.4Å; P830-P833 WeakPolarHBondContact O-CG 3.47Å; P833-F837 WeakPolarHBondContact O-CB 2.94Å; P833-F837 PolarHBondContact O-N 2.74Å
834	L	58.3	Low	55	Low	81 Å²	81	99.1 Å²	99.1	42%	0.424	50%	0.504	S	S	.	.	H	α-helix	trans	-77.8	-43.1	178.6	-115.4	166	0	0	0	111.7	L831 Y832 F837 F838	L831-L834 HydrophobicContact CD2-CB 3.87Å; L831-L834 HydrophobicContact CD2-CD1 3.81Å; L831-L834 HydrophobicContact CD2-CG 4.44Å; L831-L834 CarbonylContact O-C 3.49Å; L831-L834 WeakPolarHBondContact O-CA 3.47Å; L831-L834 WeakPolarHBondContact O-CB 3.23Å; L831-L834 PolarHBondContact O-N 3.31Å; Y832-L834 VanDerWaalsContact C-N 3.26Å; Y832-L834 PolarHBondContact O-N 3.29Å; L834-F837 PolarHBondContact O-N 3.03Å; L834-F838 HydrophobicContact CD2-CD2 3.94Å; L834-F838 HydrophobicContact CD2-CE2 3.56Å; L834-F838 VanDerWaalsContact O-CD2 3.28Å; L834-F838 WeakPolarHBondContact O-CD2 3.31Å; L834-F838 PolarHBondContact O-N 3.37Å
835	I	56.8	Low	54.4	Low	51 Å²	51	98 Å²	98	26%	0.262	50%	0.496	S	S	.	.	H	α-helix	trans	-63.5	-46	171.7	-65.5	166	0	0	0	109.1	I824 L831 F837 F838 F839	I824-I835 HydrophobicContact CG2-CD1 4.34Å; L831-I835 HydrophobicContact CB-CD1 4.09Å; L831-I835 HydrophobicContact CB-CG1 4.43Å; L831-I835 WeakPolarHBondContact O-CG1 3.32Å; L831-I835 PolarHBondContact O-N 3.46Å; I835-F837 VanDerWaalsContact C-N 3.32Å; I835-F837 PolarHBondContact O-N 3.09Å; I835-F838 PolarHBondContact O-N 3.27Å; I835-F839 HydrophobicContact CG2-CD2 3.88Å; I835-F839 HydrophobicContact CG2-CE2 4.19Å; I835-F839 WeakPolarHBondContact O-CD2 3.18Å; I835-F839 PolarHBondContact O-N 3.13Å
836	A	55.3	Low	54.3	Low	41 Å²	41	100.7 Å²	100.7	34%	0.339	51%	0.509	S	S	.	.	H	α-helix	trans	-57.6	-44	172.6	0	0	0	0	0	111.8	Y832 F838 F839 T840	Y832-A836 VanDerWaalsContact O-CB 3.28Å; Y832-A836 WeakPolarHBondContact O-CB 3.31Å; Y832-A836 PolarHBondContact O-N 3.31Å; A836-F838 PolarHBondContact O-N 3.46Å; A836-F839 PolarHBondContact O-N 3.36Å; A836-T840 VanDerWaalsContact O-CB 3.25Å; A836-T840 WeakPolarHBondContact O-CB 3.3Å; A836-T840 WeakPolarHBondContact O-CG2 3.22Å; A836-T840 PolarHBondContact O-N 3.08Å; A836-T840 PolarHBondContact O-OG1 3.37Å
837	F	56.2	Low	54.3	Low	157 Å²	157	102 Å²	102	69%	0.689	51%	0.514	S	S	*	.	H	α-helix	trans	-63.8	-36.3	177.2	-174.9	-98.1	0	0	0	113.4	P833 L834 I835 T840	P833-F837 WeakPolarHBondContact O-CB 2.94Å; P833-F837 PolarHBondContact O-N 2.74Å; L834-F837 PolarHBondContact O-N 3.03Å; I835-F837 VanDerWaalsContact C-N 3.32Å; I835-F837 PolarHBondContact O-N 3.09Å; F837-T840 PolarHBondContact O-OG1 3.47Å
838	F	53.7	Low	54.1	Low	158 Å²	158	97.3 Å²	97.3	69%	0.693	49%	0.488	S	S	*	.	H	α-helix	trans	-76.4	-34.8	177.5	-83.3	-63.7	0	0	0	114	L834 I835 A836	L834-F838 HydrophobicContact CD2-CD2 3.94Å; L834-F838 HydrophobicContact CD2-CE2 3.56Å; L834-F838 VanDerWaalsContact O-CD2 3.28Å; L834-F838 WeakPolarHBondContact O-CD2 3.31Å; L834-F838 PolarHBondContact O-N 3.37Å; I835-F838 PolarHBondContact O-N 3.27Å; A836-F838 PolarHBondContact O-N 3.46Å
839	F	55.5	Low	54	Low	131 Å²	131	95.8 Å²	95.8	58%	0.575	48%	0.477	S	S	*	.	H	α-helix	trans	-91.4	-11.8	-178.2	-77.7	-86.3	0	0	0	115	I835 A836 K841 S843	I835-F839 HydrophobicContact CG2-CD2 3.88Å; I835-F839 HydrophobicContact CG2-CE2 4.19Å; I835-F839 WeakPolarHBondContact O-CD2 3.18Å; I835-F839 PolarHBondContact O-N 3.13Å; A836-F839 PolarHBondContact O-N 3.36Å; F839-K841 PolarHBondContact O-N 3.17Å; F839-S843 PolarHBondContact O-OG 3.31Å
840	T	51.1	Low	53.8	Low	102 Å²	102	95.2 Å²	95.2	63%	0.626	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.5	-169.7	23.2	0	0	0	0	116.3	A836 F837	A836-T840 VanDerWaalsContact O-CB 3.25Å; A836-T840 WeakPolarHBondContact O-CB 3.3Å; A836-T840 WeakPolarHBondContact O-CG2 3.22Å; A836-T840 PolarHBondContact O-N 3.08Å; A836-T840 PolarHBondContact O-OG1 3.37Å; F837-T840 PolarHBondContact O-OG1 3.47Å
841	K	44.7	Very low	53.3	Low	203 Å²	203	96.5 Å²	96.5	88%	0.883	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-2.4	-174.1	-127	179.4	-176.2	-177.5	0	115.9	F839	F839-K841 PolarHBondContact O-N 3.17Å
842	K	39.5	Very low	53	Low	172 Å²	172	100.2 Å²	100.2	75%	0.748	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.3	-13.2	177.5	-123.9	-177	-179.4	-170.5	0	118.5
843	S	49.8	Very low	52.8	Low	52 Å²	52	98.3 Å²	98.3	36%	0.364	48%	0.478	S	S	.	.			trans	-119.4	120.4	-172	58.3	0	0	0	0	114.7	F839 F845	F839-S843 PolarHBondContact O-OG 3.31Å; S843-F845 PolarHBondContact O-N 3.02Å
844	K	46.5	Very low	52.5	Low	172 Å²	172	96 Å²	96	75%	0.748	46%	0.461	S	S	*	.			trans	-72.5	45.5	169.2	-64.5	-174.2	177.7	-176.1	0	112.8	L846	K844-L846 PolarHBondContact O-N 3.41Å
845	F	50.6	Low	52	Low	75 Å²	75	94.6 Å²	94.6	33%	0.329	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-25.3	-158.3	-146	-87.6	0	0	0	115.6	A817 K818 L821 S843	A817-F845 HydrophobicContact CB-CZ 4.33Å; K818-F845 HydrophobicContact CG-CD1 4.34Å; K818-F845 HydrophobicContact CG-CE1 3.98Å; L821-F845 HydrophobicContact CD1-CD1 4.1Å; L821-F845 HydrophobicContact CD1-CE1 3.57Å; L821-F845 HydrophobicContact CD1-CZ 3.92Å; S843-F845 PolarHBondContact O-N 3.02Å
846	L	54.4	Low	51.7	Low	61 Å²	61	99.4 Å²	99.4	32%	0.319	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	74.5	177.7	-77.6	169.8	0	0	0	109.9	L809 K844	L809-L846 HydrophobicContact CD1-CD2 4.21Å; K844-L846 PolarHBondContact O-N 3.41Å
847	E	56.7	Low	51.6	Low	72 Å²	72	98.6 Å²	98.6	34%	0.336	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-77.1	122.3	171.6	-154.8	169.6	124.9	0	0	109.9	R810	R810-E847 HydrophobicContact CB-CB 4.16Å; R810-E847 VanDerWaalsContact CB-O 3.24Å; R810-E847 WeakPolarHBondContact CB-O 3.4Å; R810-E847 WeakPolarHBondContact CD-OE1 3.37Å; R810-E847 IonicContact CZ-OE1 3.55Å; R810-E847 PolarHBondContact N-O 2.84Å; R810-E847 IonicContact NE-OE1 2.66Å; R810-E847 PolarHBondContact NE-OE1 2.6Å; R810-E847 IonicContact NH1-OE1 2.71Å; R810-E847 PolarHBondContact NH1-OE1 3.37Å
848	F	56.5	Low	51.2	Low	38 Å²	38	92.6 Å²	92.6	17%	0.167	45%	0.448	C	S	.	.	B	Isolated β-bridge	trans	-94.2	144.6	169.4	-69.8	-101	0	0	0	107.7	G808 L809 K1324	G808-F848 CarbonylContact O-C 2.98Å; G808-F848 WeakPolarHBondContact O-CA 3.35Å; L809-F848 HydrophobicContact CD1-CD1 4.47Å; L809-F848 HydrophobicContact CD1-CE1 4.36Å; F848-K1324 HydrophobicContact CD1-CG 4.11Å; F848-K1324 HydrophobicContact CD2-CD 4.02Å; F848-K1324 HydrophobicContact CD2-CG 4.37Å; F848-K1324 HydrophobicContact CE1-CB 3.96Å; F848-K1324 HydrophobicContact CE1-CG 3.88Å; F848-K1324 HydrophobicContact CE2-CB 4.41Å; F848-K1324 HydrophobicContact CE2-CD 3.89Å; F848-K1324 HydrophobicContact CE2-CG 4.16Å; F848-K1324 HydrophobicContact CG-CD 4.39Å; F848-K1324 HydrophobicContact CG-CG 4.35Å; F848-K1324 HydrophobicContact CZ-CB 3.82Å; F848-K1324 HydrophobicContact CZ-CD 4.15Å; F848-K1324 HydrophobicContact CZ-CG 3.91Å
849	K	58.6	Low	50.9	Low	23 Å²	23	86.6 Å²	86.6	10%	0.1	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-57.7	140.7	171.5	-69.2	178.6	177	-171.7	0	109.7	D803 G808 E853 L854	D803-K849 IonicContact OD1-NZ 3.18Å; D803-K849 PolarHBondContact OD1-NZ 2.85Å; G808-K849 PolarHBondContact O-N 2.85Å; K849-E853 HydrophobicContact CB-CB 3.98Å; K849-E853 HydrophobicContact CG-CB 4.44Å; K849-L854 HydrophobicContact CB-CG 4.06Å; K849-L854 WeakPolarHBondContact O-CD1 3.35Å
850	T	52.7	Low	50.6	Low	70 Å²	70	82.2 Å²	82.2	43%	0.429	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-66.9	166.5	176.2	58.8	0	0	0	0	110.9	E852 E853 L854	T850-E852 PolarHBondContact O-N 2.89Å; T850-E853 WeakPolarHBondContact CB-OE2 3.35Å; T850-E853 WeakPolarHBondContact CG2-OE2 3.46Å; T850-E853 PolarHBondContact N-OE2 2.87Å; T850-E853 PolarHBondContact O-N 2.83Å; T850-E853 WeakPolarHBondContact OG1-CB 3.36Å; T850-E853 VanDerWaalsContact OG1-CD 3.26Å; T850-E853 VanDerWaalsContact OG1-CG 3.26Å; T850-E853 WeakPolarHBondContact OG1-CG 3.47Å; T850-E853 PolarHBondContact OG1-N 3.33Å; T850-E853 PolarHBondContact OG1-OE2 3.09Å; T850-L854 VanDerWaalsContact O-CB 3.31Å; T850-L854 WeakPolarHBondContact O-CB 3.37Å; T850-L854 WeakPolarHBondContact O-CD1 3.47Å; T850-L854 WeakPolarHBondContact O-CG 3.26Å; T850-L854 PolarHBondContact O-N 2.94Å
851	K	51.5	Low	50.1	Low	122 Å²	122	80 Å²	80	53%	0.53	39%	0.391	S	S	.	.	H	α-helix	trans	-61.2	-29.9	178.3	-164.7	-174.6	-179.8	-71.4	0	112.1	A855 E867	K851-A855 WeakPolarHBondContact O-CB 3.41Å; K851-A855 PolarHBondContact O-N 3.12Å; K851-E867 WeakPolarHBondContact CE-OE1 3.2Å; K851-E867 IonicContact NZ-OE1 3.02Å; K851-E867 PolarHBondContact NZ-OE1 2.66Å; K851-E867 IonicContact NZ-OE2 2.73Å
852	E	49.8	Very low	50	Low	154 Å²	154	73.9 Å²	73.9	72%	0.72	37%	0.365	S	S	*	.	H	α-helix	trans	-75.7	-46.5	178.2	-72.7	153.2	-153.7	0	0	111.3	T850 L854 A855 Q856	T850-E852 PolarHBondContact O-N 2.89Å; E852-L854 PolarHBondContact O-N 3.23Å; E852-A855 WeakPolarHBondContact O-CB 3.4Å; E852-A855 PolarHBondContact O-N 2.75Å; E852-Q856 WeakPolarHBondContact O-CG 3.43Å; E852-Q856 PolarHBondContact O-N 2.95Å; E852-Q856 VanDerWaalsContact O-N 3.09Å
853	E	53.1	Low	50.4	Low	47 Å²	47	69 Å²	69	22%	0.22	35%	0.345	C	S	.	.	H	α-helix	trans	-61.2	-32.1	171.8	-68.8	162.5	141.1	0	0	112.4	R810 K849 T850 Q856 Q857	R810-E853 IonicContact CZ-OE1 2.94Å; R810-E853 IonicContact NH1-OE1 3.06Å; R810-E853 PolarHBondContact NH1-OE1 2.81Å; R810-E853 IonicContact NH1-OE2 3.89Å; R810-E853 IonicContact NH2-OE1 2.77Å; R810-E853 PolarHBondContact NH2-OE1 2.89Å; K849-E853 HydrophobicContact CB-CB 3.98Å; K849-E853 HydrophobicContact CG-CB 4.44Å; T850-E853 WeakPolarHBondContact CB-OE2 3.35Å; T850-E853 WeakPolarHBondContact CG2-OE2 3.46Å; T850-E853 PolarHBondContact N-OE2 2.87Å; T850-E853 PolarHBondContact O-N 2.83Å; T850-E853 WeakPolarHBondContact OG1-CB 3.36Å; T850-E853 VanDerWaalsContact OG1-CD 3.26Å; T850-E853 VanDerWaalsContact OG1-CG 3.26Å; T850-E853 WeakPolarHBondContact OG1-CG 3.47Å; T850-E853 PolarHBondContact OG1-N 3.33Å; T850-E853 PolarHBondContact OG1-OE2 3.09Å; E853-Q856 PolarHBondContact O-N 3.35Å; E853-Q857 PolarHBondContact O-N 3.41Å
854	L	50.6	Low	50.2	Low	35 Å²	35	69.4 Å²	69.4	18%	0.183	34%	0.341	C	S	.	.	H	α-helix	trans	-74.1	-25.8	172.6	-84.8	158.5	0	0	0	113.8	K849 T850 E852 Q856 L1319	K849-L854 HydrophobicContact CB-CG 4.06Å; K849-L854 WeakPolarHBondContact O-CD1 3.35Å; T850-L854 VanDerWaalsContact O-CB 3.31Å; T850-L854 WeakPolarHBondContact O-CB 3.37Å; T850-L854 WeakPolarHBondContact O-CD1 3.47Å; T850-L854 WeakPolarHBondContact O-CG 3.26Å; T850-L854 PolarHBondContact O-N 2.94Å; E852-L854 PolarHBondContact O-N 3.23Å; L854-Q856 VanDerWaalsContact C-N 3.33Å; L854-L1319 HydrophobicContact CD1-CD1 3.58Å; L854-L1319 HydrophobicContact CD1-CD2 3.64Å; L854-L1319 HydrophobicContact CD1-CG 4.19Å
855	A	49.2	Very low	50	Low	50 Å²	50	65.1 Å²	65.1	41%	0.413	33%	0.326	S	S	.	.	H	α-helix	trans	-79.4	-20	173	0	0	0	0	0	112.3	K851 E852	K851-A855 WeakPolarHBondContact O-CB 3.41Å; K851-A855 PolarHBondContact O-N 3.12Å; E852-A855 WeakPolarHBondContact O-CB 3.4Å; E852-A855 PolarHBondContact O-N 2.75Å
856	Q	49.3	Very low	49.7	Very low	152 Å²	152	64 Å²	64	71%	0.71	32%	0.323	S	S	*	.	H	α-helix	trans	-84.6	-20	172.3	-68.8	170	-17	0	0	113	E852 E853 L854	E852-Q856 WeakPolarHBondContact O-CG 3.43Å; E852-Q856 PolarHBondContact O-N 2.95Å; E852-Q856 VanDerWaalsContact O-N 3.09Å; E853-Q856 PolarHBondContact O-N 3.35Å; L854-Q856 VanDerWaalsContact C-N 3.33Å
857	Q	53.2	Low	49.6	Very low	24 Å²	24	63.5 Å²	63.5	11%	0.112	32%	0.319	C	S	.	.	S	Bend	trans	-70.7	152.8	168.2	-77.9	178.5	-79.7	0	0	111.6	D803 G807 E853 Q859	D803-Q857 PolarHBondContact O-NE2 3.25Å; G807-Q857 PolarHBondContact O-NE2 3Å; G807-Q857 PolarHBondContact O-OE1 3.47Å; E853-Q857 PolarHBondContact O-N 3.41Å; Q857-Q859 PolarHBondContact O-N 3.06Å
858	P	49.2	Very low	49.1	Very low	32 Å²	32	64.5 Å²	64.5	21%	0.208	33%	0.326	C	S	.	.			trans	-66.6	93.7	176.6	27.6	-34.7	0	0	0	110.9	T768 L1692	T768-P858 HydrophobicContact CG2-CB 4.29Å; P858-L1692 HydrophobicContact CB-CD2 4.06Å; P858-L1692 HydrophobicContact CG-CD2 3.74Å
859	Q	46.7	Very low	48.5	Very low	31 Å²	31	66.4 Å²	66.4	15%	0.145	34%	0.336	C	S	.	.			trans	-63.8	150	179.5	-70.1	-170.2	-1.6	0	0	112.6	Q857 E867	Q857-Q859 PolarHBondContact O-N 3.06Å; Q859-E867 PolarHBondContact NE2-OE2 3.46Å
860	T	48.6	Very low	47.8	Very low	39 Å²	39	70.6 Å²	70.6	24%	0.239	36%	0.359	C	S	.	.			trans	-73.8	151.9	170.1	65.5	0	0	0	0	111.4	Q862 E863 H864	T860-Q862 PolarHBondContact O-N 2.89Å; T860-Q862 VanDerWaalsContact O-N 3.1Å; T860-E863 PolarHBondContact O-N 2.96Å; T860-E863 WeakPolarHBondContact OG1-CG 3.47Å; T860-E863 PolarHBondContact OG1-N 3.18Å; T860-E863 PolarHBondContact OG1-OE2 3.07Å; T860-H864 PolarHBondContact O-N 3.48Å
861	L	40.4	Very low	47.4	Very low	57 Å²	57	71.2 Å²	71.2	30%	0.298	37%	0.366	S	S	.	.	H	α-helix	trans	-54.5	-31.7	174.5	176.7	59.3	0	0	0	112.8	L865 F1695	L861-L865 HydrophobicContact CD1-CD1 4.06Å; L861-L865 HydrophobicContact CD1-CG 4.13Å; L861-L865 HydrophobicContact CG-CD1 4.05Å; L861-L865 WeakPolarHBondContact O-CB 3.47Å; L861-L865 WeakPolarHBondContact O-CD1 3.18Å; L861-L865 WeakPolarHBondContact O-CG 3.49Å; L861-L865 PolarHBondContact O-N 2.94Å; L861-L865 VanDerWaalsContact O-N 3.1Å; L861-F1695 HydrophobicContact CB-CE2 3.73Å; L861-F1695 HydrophobicContact CB-CZ 4.22Å; L861-F1695 HydrophobicContact CD1-CD2 4.17Å; L861-F1695 HydrophobicContact CD1-CE1 4.44Å; L861-F1695 HydrophobicContact CD1-CE2 3.72Å; L861-F1695 HydrophobicContact CD1-CZ 3.87Å; L861-F1695 HydrophobicContact CD2-CZ 4.39Å; L861-F1695 HydrophobicContact CG-CE2 4.21Å; L861-F1695 HydrophobicContact CG-CZ 4.37Å
862	Q	42.2	Very low	46.8	Very low	74 Å²	74	68.7 Å²	68.7	35%	0.346	36%	0.364	S	S	.	.	H	α-helix	trans	-68.5	-39	177.1	178.3	59.7	74.9	0	0	111.2	T860 D866	T860-Q862 PolarHBondContact O-N 2.89Å; T860-Q862 VanDerWaalsContact O-N 3.1Å; Q862-D866 VanDerWaalsContact NE2-CG 3.32Å; Q862-D866 PolarHBondContact NE2-OD1 2.67Å; Q862-D866 PolarHBondContact NE2-OD2 2.85Å; Q862-D866 PolarHBondContact O-N 3.28Å; Q862-D866 VanDerWaalsContact O-OD2 3.08Å
863	E	48.7	Very low	46.3	Very low	68 Å²	68	69 Å²	69	32%	0.318	37%	0.365	S	S	.	.	H	α-helix	trans	-72.6	-44.2	177.1	-73.4	174.9	119.6	0	0	112	T860 L865 D866 E867 K1323	T860-E863 PolarHBondContact O-N 2.96Å; T860-E863 WeakPolarHBondContact OG1-CG 3.47Å; T860-E863 PolarHBondContact OG1-N 3.18Å; T860-E863 PolarHBondContact OG1-OE2 3.07Å; E863-L865 PolarHBondContact O-N 2.99Å; E863-D866 CarbonylContact O-C 3.51Å; E863-D866 PolarHBondContact O-N 3.09Å; E863-E867 WeakPolarHBondContact O-CB 3.43Å; E863-E867 VanDerWaalsContact O-CG 3.24Å; E863-E867 WeakPolarHBondContact O-CG 3.38Å; E863-E867 PolarHBondContact O-N 3.32Å; E863-K1323 IonicContact OE1-NZ 2.73Å; E863-K1323 PolarHBondContact OE1-NZ 3.06Å
864	H	45.7	Very low	45.5	Very low	61 Å²	61	71.4 Å²	71.4	28%	0.282	39%	0.387	S	S	.	.	H	α-helix	trans	-57.3	-38	173.6	-178.8	72	0	0	0	112.1	T860 L868	T860-H864 PolarHBondContact O-N 3.48Å; H864-L868 WeakPolarHBondContact O-CG 3.14Å; H864-L868 PolarHBondContact O-N 3.1Å
865	L	42.7	Very low	44.7	Very low	83 Å²	83	73.1 Å²	73.1	44%	0.435	40%	0.402	S	S	.	.	H	α-helix	trans	-69.9	-40.5	173.3	-73.8	170.7	0	0	0	113.3	L861 E863 E867 E869	L861-L865 HydrophobicContact CD1-CD1 4.06Å; L861-L865 HydrophobicContact CD1-CG 4.13Å; L861-L865 HydrophobicContact CG-CD1 4.05Å; L861-L865 WeakPolarHBondContact O-CB 3.47Å; L861-L865 WeakPolarHBondContact O-CD1 3.18Å; L861-L865 WeakPolarHBondContact O-CG 3.49Å; L861-L865 PolarHBondContact O-N 2.94Å; L861-L865 VanDerWaalsContact O-N 3.1Å; E863-L865 PolarHBondContact O-N 2.99Å; L865-E867 VanDerWaalsContact C-N 3.34Å; L865-E869 WeakPolarHBondContact O-CG 3.31Å; L865-E869 PolarHBondContact O-N 3.15Å; L865-E869 VanDerWaalsContact O-N 3.15Å
866	D	44.8	Very low	43.8	Very low	50 Å²	50	74.7 Å²	74.7	27%	0.267	41%	0.411	S	S	.	.	H	α-helix	trans	-67.7	-33.2	174.3	-74.1	-51.6	0	0	0	111	Q862 E863 E869 D870 R1212	Q862-D866 VanDerWaalsContact NE2-CG 3.32Å; Q862-D866 PolarHBondContact NE2-OD1 2.67Å; Q862-D866 PolarHBondContact NE2-OD2 2.85Å; Q862-D866 PolarHBondContact O-N 3.28Å; Q862-D866 VanDerWaalsContact O-OD2 3.08Å; E863-D866 CarbonylContact O-C 3.51Å; E863-D866 PolarHBondContact O-N 3.09Å; D866-E869 PolarHBondContact O-N 3.47Å; D866-D870 PolarHBondContact O-N 3.07Å; D866-R1212 IonicContact OD1-CZ 2.7Å; D866-R1212 IonicContact OD1-NH2 3.52Å; D866-R1212 PolarHBondContact OD1-NH2 2.88Å
867	E	51.6	Low	43	Very low	51 Å²	51	73.5 Å²	73.5	24%	0.238	42%	0.419	C	S	.	.	H	α-helix	trans	-70.4	-38.8	175.2	-65	-130.4	111.9	0	0	112.5	K851 Q859 E863 L865 E869 D870 S871	K851-E867 WeakPolarHBondContact CE-OE1 3.2Å; K851-E867 IonicContact NZ-OE1 3.02Å; K851-E867 PolarHBondContact NZ-OE1 2.66Å; K851-E867 IonicContact NZ-OE2 2.73Å; Q859-E867 PolarHBondContact NE2-OE2 3.46Å; E863-E867 WeakPolarHBondContact O-CB 3.43Å; E863-E867 VanDerWaalsContact O-CG 3.24Å; E863-E867 WeakPolarHBondContact O-CG 3.38Å; E863-E867 PolarHBondContact O-N 3.32Å; L865-E867 VanDerWaalsContact C-N 3.34Å; E867-E869 VanDerWaalsContact C-N 3.27Å; E867-E869 PolarHBondContact O-N 3.39Å; E867-D870 PolarHBondContact O-N 2.94Å; E867-S871 WeakPolarHBondContact O-CB 3.42Å; E867-S871 PolarHBondContact O-N 3.25Å; E867-S871 PolarHBondContact O-OG 2.85Å
868	L	46.7	Very low	41.9	Very low	93 Å²	93	77.8 Å²	77.8	49%	0.487	45%	0.451	S	S	.	.	H	α-helix	trans	-63.7	-33.4	171.4	-76.1	169.8	0	0	0	111.9	H864 S872	H864-L868 WeakPolarHBondContact O-CG 3.14Å; H864-L868 PolarHBondContact O-N 3.1Å; L868-S872 WeakPolarHBondContact O-CB 3.22Å; L868-S872 PolarHBondContact O-N 2.86Å; L868-S872 PolarHBondContact O-OG 2.56Å
869	E	43.6	Very low	41	Very low	79 Å²	79	82.2 Å²	82.2	37%	0.369	48%	0.483	S	S	.	.	H	α-helix	trans	-74.5	-44	174.4	-71.1	179.3	116.8	0	0	111.8	L865 D866 E867 S871 S872 E873 R1212	L865-E869 WeakPolarHBondContact O-CG 3.31Å; L865-E869 PolarHBondContact O-N 3.15Å; L865-E869 VanDerWaalsContact O-N 3.15Å; D866-E869 PolarHBondContact O-N 3.47Å; E867-E869 VanDerWaalsContact C-N 3.27Å; E867-E869 PolarHBondContact O-N 3.39Å; E869-S871 VanDerWaalsContact C-N 3.34Å; E869-S871 PolarHBondContact O-N 2.89Å; E869-S872 PolarHBondContact O-N 3.02Å; E869-S872 PolarHBondContact O-OG 2.86Å; E869-E873 PolarHBondContact O-N 2.8Å; E869-R1212 IonicContact OE1-CZ 3.08Å; E869-R1212 IonicContact OE1-NH1 2.71Å; E869-R1212 PolarHBondContact OE1-NH1 2.92Å; E869-R1212 IonicContact OE2-CZ 3.77Å; E869-R1212 IonicContact OE2-NH1 3.68Å; E869-R1212 PolarHBondContact OE2-NH1 2.85Å; E869-R1212 IonicContact OE2-NH2 2.73Å; E869-R1212 PolarHBondContact OE2-NH2 2.68Å
870	D	44.2	Very low	40.3	Very low	111 Å²	111	85.6 Å²	85.6	59%	0.594	51%	0.51	S	S	*	.	H	α-helix	trans	-64.6	-35	174.8	-82.3	-4.9	0	0	0	112.5	D866 E867 S872 S874	D866-D870 PolarHBondContact O-N 3.07Å; E867-D870 PolarHBondContact O-N 2.94Å; D870-S872 VanDerWaalsContact C-N 3.33Å; D870-S874 WeakPolarHBondContact O-CB 3.47Å; D870-S874 PolarHBondContact O-N 3.36Å; D870-S874 PolarHBondContact O-OG 3.39Å
871	S	43.8	Very low	39.6	Very low	82 Å²	82	88.8 Å²	88.8	57%	0.573	53%	0.534	S	S	*	.	H	α-helix	trans	-70.9	-26.7	176.1	-58.8	0	0	0	0	113	E867 E869 S874	E867-S871 WeakPolarHBondContact O-CB 3.42Å; E867-S871 PolarHBondContact O-N 3.25Å; E867-S871 PolarHBondContact O-OG 2.85Å; E869-S871 VanDerWaalsContact C-N 3.34Å; E869-S871 PolarHBondContact O-N 2.89Å; S871-S874 PolarHBondContact O-OG 3.27Å
872	S	39.6	Very low	39.2	Very low	70 Å²	70	91.3 Å²	91.3	49%	0.49	56%	0.557	S	S	.	*	H	α-helix	trans	-93.3	-26.4	179	52.2	0	0	0	0	113.7	L868 E869 D870	L868-S872 WeakPolarHBondContact O-CB 3.22Å; L868-S872 PolarHBondContact O-N 2.86Å; L868-S872 PolarHBondContact O-OG 2.56Å; E869-S872 PolarHBondContact O-N 3.02Å; E869-S872 PolarHBondContact O-OG 2.86Å; D870-S872 VanDerWaalsContact C-N 3.33Å
873	E	38.4	Very low	38.7	Very low	159 Å²	159	91.1 Å²	91.1	74%	0.743	56%	0.563	S	S	*	*	H	α-helix	trans	-78.4	-17.9	174.2	-70.3	-161.3	175.3	0	0	113.9	E869	E869-E873 PolarHBondContact O-N 2.8Å
874	S	36.2	Very low	38	Very low	98 Å²	98	92.8 Å²	92.8	69%	0.685	58%	0.583	S	S	*	*	S	Bend	trans	-83.2	-11	-172.5	46	0	0	0	0	116.2	D870 S871	D870-S874 WeakPolarHBondContact O-CB 3.47Å; D870-S874 PolarHBondContact O-N 3.36Å; D870-S874 PolarHBondContact O-OG 3.39Å; S871-S874 PolarHBondContact O-OG 3.27Å
875	S	33.9	Very low	37.3	Very low	71 Å²	71	95.2 Å²	95.2	50%	0.497	61%	0.606	S	S	.	*	S	Bend	trans	-105.1	-6.4	-169.7	58.2	0	0	0	0	116.4
876	S	31.3	Very low	36.7	Very low	84 Å²	84	95.8 Å²	95.8	59%	0.587	62%	0.618	S	S	*	*	S	Bend	trans	-151.5	72.5	-170	64.6	0	0	0	0	117
877	S	31.9	Very low	35.9	Very low	126 Å²	126	99.6 Å²	99.6	88%	0.881	64%	0.643	S	S	*	*			trans	179.6	116.4	136.9	41	0	0	0	0	114.8
878	S	29.3	Very low	35	Very low	114 Å²	114	101.2 Å²	101.2	80%	0.797	66%	0.66	S	S	*	*			trans	-148.6	163.4	160.4	66.7	0	0	0	0	111.1
879	S	31.5	Very low	34.3	Very low	126 Å²	126	100.4 Å²	100.4	88%	0.881	66%	0.662	S	S	*	*			trans	76	140.9	-157	79.6	0	0	0	0	113.8
880	S	31.7	Very low	33.7	Very low	101 Å²	101	100.6 Å²	100.6	71%	0.706	67%	0.67	S	S	*	*			cis	-148.4	131.8	3.5	55	0	0	0	0	108.3
881	S	33	Very low	33	Very low	106 Å²	106	98.6 Å²	98.6	74%	0.741	66%	0.664	S	S	*	*			cis	101.9	154.3	41.3	72.7	0	0	0	0	113.9
882	S	31.5	Very low	32.3	Very low	111 Å²	111	100.1 Å²	100.1	78%	0.776	67%	0.67	S	S	*	*			trans	77	145.2	-168.9	78.7	0	0	0	0	115.9
883	S	32.9	Very low	31.5	Very low	69 Å²	69	100.8 Å²	100.8	48%	0.483	68%	0.675	S	S	.	*			cis	-143	145.5	9	56.8	0	0	0	0	115.5	Y1221	S883-Y1221 PolarHBondContact N-OH 3.23Å; S883-Y1221 WeakPolarHBondContact O-CE1 3.41Å; S883-Y1221 PolarHBondContact O-OH 3.16Å
884	S	32.8	Very low	30.9	Very low	103 Å²	103	103.2 Å²	103.2	72%	0.72	68%	0.678	S	S	*	*			trans	57.1	143.2	157	55.6	0	0	0	0	119.8
885	S	31.3	Very low	30.3	Very low	112 Å²	112	108.5 Å²	108.5	78%	0.783	68%	0.683	S	S	*	*			cis	-168.8	157	-7.7	48	0	0	0	0	106.7
886	S	31	Very low	29.8	Very low	96 Å²	96	110.9 Å²	110.9	67%	0.671	70%	0.698	S	S	*	*			cis	-169.6	148.3	42.2	49.2	0	0	0	0	112.6
887	T	28.7	Very low	29.4	Very low	129 Å²	129	111.3 Å²	111.3	79%	0.791	70%	0.701	S	S	*	*			trans	52.8	132.8	148.5	54.2	0	0	0	0	120.9
888	S	32.7	Very low	29	Very low	85 Å²	85	111 Å²	111	59%	0.594	69%	0.693	S	S	*	*			cis	-179.1	122.2	-3	45.9	0	0	0	0	112.7
889	S	31.9	Very low	28.7	Very low	77 Å²	77	112.7 Å²	112.7	54%	0.538	69%	0.694	S	S	.	*				55.7	149.7	121.2	78.9	0	0	0	0	119.9	D1225	S889-D1225 PolarHBondContact N-OD2 3Å
890	P	31	Very low	28.4	Very low	83 Å²	83	115.1 Å²	115.1	54%	0.539	69%	0.691	S	S	.	*			cis	-158.5	112	38.9	40.1	-14.8	0	0	0	119.2
891	S	28.5	Very low	28.1	Very low	68 Å²	68	115.4 Å²	115.4	48%	0.476	69%	0.69	S	S	.	*			trans	63.2	135.9	133.6	70.3	0	0	0	0	119.6	E1226	S891-E1226 WeakPolarHBondContact CA-OE1 3.46Å; S891-E1226 WeakPolarHBondContact CA-OE2 3.31Å; S891-E1226 VanDerWaalsContact N-CD 3.31Å; S891-E1226 PolarHBondContact N-OE1 3.07Å; S891-E1226 PolarHBondContact N-OE2 3.15Å
892	T	28.6	Very low	27.7	Very low	114 Å²	114	116.6 Å²	116.6	70%	0.699	69%	0.688	S	S	*	*				177.3	151.9	99.4	33	0	0	0	0	114.6	E1226	T892-E1226 PolarHBondContact N-OE1 2.7Å; T892-E1226 VanDerWaalsContact N-OE1 3.1Å
893	S	24.3	Very low	27.4	Very low	85 Å²	85	118.9 Å²	118.9	59%	0.594	69%	0.691	S	S	*	*			trans	69.3	143.5	165.8	-69.3	0	0	0	0	116.3
894	R	24.5	Very low	27.2	Very low	209 Å²	209	119.9 Å²	119.9	79%	0.789	70%	0.696	S	S	*	*			cis	-157.6	151.1	-4.5	-129.6	166.2	-91.2	175.7	-3.2	109.8
895	R	23.1	Very low	26.9	Very low	210 Å²	210	121.6 Å²	121.6	79%	0.792	70%	0.697	S	S	*	*			trans	54.4	93.8	146.1	-160.7	167.4	-75.4	-158.7	-2.4	115
896	C	23.4	Very low	26.7	Very low	121 Å²	121	122.4 Å²	122.4	82%	0.818	69%	0.688	S	S	*	*			cis	49.9	156.6	35.4	-92.1	0	0	0	0	113.5
897	S	24.6	Very low	26.6	Very low	93 Å²	93	124.2 Å²	124.2	65%	0.65	68%	0.684	S	S	*	*			trans	61.9	132.9	-178.4	66.7	0	0	0	0	115.6
898	V	23.5	Very low	26.5	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.715	68%	0.681	S	S	*	*			cis	75.3	119.8	42.3	179.3	0	0	0	0	112.4
899	N	23.1	Very low	26.1	Very low	151 Å²	151	127.9 Å²	127.9	81%	0.807	69%	0.686	S	S	*	*			trans	73.7	138.9	167	-58.9	-15.5	0	0	0	119.8
900	H	24	Very low	25.9	Very low	177 Å²	177	129.3 Å²	129.3	82%	0.819	69%	0.692	S	S	*	*			trans	-44	145.5	141.1	-82.7	-97.4	0	0	0	109.8
901	P	25.6	Very low	25.7	Very low	107 Å²	107	131.8 Å²	131.8	70%	0.695	70%	0.701	S	S	*	*				-153.5	172.5	52.9	41.7	-21.2	0	0	0	117.9
902	N	25.8	Very low	25.6	Very low	130 Å²	130	136.8 Å²	136.8	70%	0.695	72%	0.717	S	S	*	*			trans	33.1	118.7	137.8	-52.8	-7	0	0	0	121.4
903	L	25	Very low	25.5	Very low	159 Å²	159	137.6 Å²	137.6	83%	0.832	72%	0.716	S	S	*	*			trans	64.2	-178.7	135.1	-85.8	72.1	0	0	0	116.7
904	P	28.5	Very low	25.6	Very low	91 Å²	91	142.4 Å²	142.4	59%	0.591	73%	0.727	S	S	*	*				-131.3	-172.5	-57.7	39.3	-24.5	0	0	0	111.7
905	N	25.7	Very low	25.6	Very low	138 Å²	138	138 Å²	138	74%	0.738	72%	0.719	S	S	*	*			trans	66.2	154.8	149.1	-73.8	9.9	0	0	0	118.1
906	E	27.1	Very low	25.8	Very low	130 Å²	130	133 Å²	133	61%	0.607	72%	0.715	S	S	*	*			cis	-164.5	175.9	-20.4	-133.6	-169.1	128.1	0	0	109.4
907	K	28.7	Very low	25.9	Very low	133 Å²	133	132.3 Å²	132.3	58%	0.578	70%	0.704	S	S	*	*			trans	69.5	136.9	144.4	-81.3	172.2	174	98.1	0	122.3
908	Q	26.7	Very low	26	Very low	158 Å²	158	135.9 Å²	135.9	74%	0.738	71%	0.71	S	S	*	*			trans	76.1	145.8	136.3	-73.7	168.8	-21.7	0	0	119.5
909	L	25	Very low	26	Very low	133 Å²	133	136.6 Å²	136.6	70%	0.696	71%	0.71	S	S	*	*			cis	-160.6	-175.9	-26.1	-155.1	57.4	0	0	0	108.5
910	T	27.7	Very low	26.1	Very low	108 Å²	108	135 Å²	135	66%	0.663	71%	0.705	S	S	*	*			trans	61.2	113.2	160.2	46.7	0	0	0	0	116.7
911	N	25.4	Very low	26.1	Very low	134 Å²	134	131.6 Å²	131.6	72%	0.717	70%	0.697	S	S	*	*				76.9	104.9	61.4	-65.3	15	0	0	0	112.2
912	E	27.6	Very low	26.1	Very low	174 Å²	174	134.9 Å²	134.9	81%	0.813	70%	0.703	S	S	*	*				178	121.5	114.4	-93	161.8	-151.5	0	0	106.4
913	N	25.3	Very low	26.1	Very low	130 Å²	130	136 Å²	136	70%	0.695	71%	0.709	S	S	*	*				64.3	73.1	51.3	-67.5	5.9	0	0	0	114.3
914	F	26.8	Very low	26.1	Very low	186 Å²	186	132.2 Å²	132.2	82%	0.816	70%	0.696	S	S	*	*			trans	-135.8	117.2	133.7	-90.3	-88.9	0	0	0	106.5
915	L	25.9	Very low	26	Very low	118 Å²	118	134.8 Å²	134.8	62%	0.618	70%	0.704	S	S	*	*				66.6	135.7	60.9	-65.2	155	0	0	0	111
916	S	26	Very low	26.1	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	70%	0.703	S	S	*	*			cis	-114.4	150.4	15.5	51.3	0	0	0	0	112.9
917	N	25.5	Very low	26.1	Very low	107 Å²	107	134 Å²	134	57%	0.572	70%	0.703	S	S	*	*				48	131.7	76.7	-43.8	-13.3	0	0	0	112
918	H	27	Very low	26	Very low	169 Å²	169	134.7 Å²	134.7	78%	0.782	71%	0.708	S	S	*	*			cis	-111.8	160.2	24.5	-71.3	-110.5	0	0	0	113.1	V920	H918-V920 HydrophobicContact CB-CG2 4.44Å
919	N	23.4	Very low	25.9	Very low	132 Å²	132	132.4 Å²	132.4	71%	0.706	71%	0.705	S	S	*	*			cis	65.2	69.9	4.9	-77.5	23.9	0	0	0	118.2
920	V	26.4	Very low	25.8	Very low	118 Å²	118	131.2 Å²	131.2	72%	0.715	71%	0.705	S	S	*	*			trans	-145.8	123.3	148.9	179	0	0	0	0	104.1	H918	H918-V920 HydrophobicContact CB-CG2 4.44Å
921	T	23.8	Very low	25.6	Very low	105 Å²	105	131.5 Å²	131.5	64%	0.644	71%	0.707	S	S	*	*			cis	75.2	119.8	-4.3	74	0	0	0	0	119.4
922	E	24.5	Very low	25.6	Very low	176 Å²	176	131.4 Å²	131.4	82%	0.822	71%	0.705	S	S	*	*			trans	78.7	142.1	176.3	-59.5	-179.4	140.3	0	0	116.3
923	D	25.1	Very low	25.2	Very low	153 Å²	153	133.9 Å²	133.9	82%	0.818	71%	0.707	S	S	*	*			trans	62.7	146.4	163.9	-64.8	-18.6	0	0	0	119.1
924	S	25.9	Very low	25.1	Very low	81 Å²	81	133.8 Å²	133.8	57%	0.566	71%	0.705	S	S	*	*			cis	-154.3	138.9	-5.5	-121.3	0	0	0	0	109.8
925	L	26.9	Very low	24.9	Very low	144 Å²	144	128.1 Å²	128.1	75%	0.754	68%	0.683	S	S	*	*				65.4	133.9	111	-70.3	177.6	0	0	0	116.9
926	L	27.8	Very low	24.9	Very low	139 Å²	139	124 Å²	124	73%	0.728	66%	0.664	S	S	*	*			trans	68.6	140.7	163.6	-84	76.6	0	0	0	115.4
927	D	27.4	Very low	24.8	Very low	112 Å²	112	125.3 Å²	125.3	60%	0.599	67%	0.67	S	S	*	*			cis	-153.7	171.4	-13	-138.3	-12.9	0	0	0	113.3
928	Q	26.6	Very low	25.3	Very low	148 Å²	148	124.2 Å²	124.2	69%	0.692	68%	0.677	S	S	*	*			trans	44.2	107.7	150.9	-70.1	166.1	70.3	0	0	118.4
929	V	24.8	Very low	25.2	Very low	111 Å²	111	118.5 Å²	118.5	67%	0.673	65%	0.654	S	S	*	*				61.4	110.3	80.1	173.1	0	0	0	0	110.8
930	P	22.7	Very low	25.2	Very low	108 Å²	108	112.8 Å²	112.8	70%	0.701	63%	0.625	S	S	*	*			cis	-115.2	149.8	48.4	14.5	5.4	0	0	0	114	I932	P930-I932 HydrophobicContact CB-CB 4.45Å; P930-I932 HydrophobicContact CB-CD1 4.27Å; P930-I932 HydrophobicContact CB-CG1 3.88Å
931	T	23.9	Very low	25.1	Very low	114 Å²	114	107.7 Å²	107.7	70%	0.699	60%	0.595	S	S	*	*			cis	66.8	36.9	5.4	-31.1	0	0	0	0	116.9
932	I	23.4	Very low	25.1	Very low	131 Å²	131	110.3 Å²	110.3	67%	0.672	60%	0.597	S	S	*	*			trans	-121.6	106.2	154.2	-65.1	174.4	0	0	0	106.1	P930 I934	P930-I932 HydrophobicContact CB-CB 4.45Å; P930-I932 HydrophobicContact CB-CD1 4.27Å; P930-I932 HydrophobicContact CB-CG1 3.88Å; I932-I934 HydrophobicContact CG2-CG1 4.45Å
933	R	20.9	Very low	25	Very low	226 Å²	226	103.8 Å²	103.8	85%	0.853	57%	0.571	S	S	*	*				58.2	48.8	75.6	-73.4	-167.1	171.1	-167.2	2.9	115.3
934	I	23.5	Very low	24.8	Very low	129 Å²	129	102.6 Å²	102.6	66%	0.662	57%	0.565	S	S	*	*			trans	-134.2	128.5	148.5	5.1	-178.9	0	0	0	106.4	I932	I932-I934 HydrophobicContact CG2-CG1 4.45Å
935	N	22.6	Very low	24.6	Very low	66 Å²	66	107.6 Å²	107.6	35%	0.353	58%	0.576	S	S	.	*			cis	56.1	73.2	42.5	-73	4.6	0	0	0	112.1	S940 R969	N935-S940 VanDerWaalsContact C-CB 3.49Å; N935-R969 WeakPolarHBondContact OD1-CD 3.26Å; N935-R969 PolarHBondContact OD1-NE 2.7Å
936	S	24	Very low	24.4	Very low	31 Å²	31	105.8 Å²	105.8	22%	0.217	57%	0.567	C	S	.	*			trans	65.1	130.3	-171.9	-48.4	0	0	0	0	111.7	A938 P939 S940	S936-A938 VanDerWaalsContact CB-O 3.26Å; S936-A938 WeakPolarHBondContact CB-O 3.43Å; S936-A938 PolarHBondContact OG-O 3.2Å; S936-P939 PolarHBondContact N-O 2.93Å; S936-P939 VanDerWaalsContact OG-C 3.32Å; S936-P939 WeakPolarHBondContact OG-CA 3.48Å; S936-S940 WeakPolarHBondContact OG-CB 3.22Å; S936-S940 PolarHBondContact OG-N 3.39Å
937	P	23.9	Very low	24.3	Very low	131 Å²	131	104.9 Å²	104.9	85%	0.851	57%	0.567	S	S	*	*	S	Bend	cis	-77.7	159.4	14.9	30.1	-36.6	0	0	0	114.3
938	A	36.2	Very low	24.3	Very low	85 Å²	85	104.9 Å²	104.9	70%	0.702	57%	0.566	S	S	*	*	S	Bend	cis	-72	-46.8	-20.5	0	0	0	0	0	109.6	S936	S936-A938 VanDerWaalsContact CB-O 3.26Å; S936-A938 WeakPolarHBondContact CB-O 3.43Å; S936-A938 PolarHBondContact OG-O 3.2Å
939	P	25.2	Very low	24.4	Very low	48 Å²	48	105.4 Å²	105.4	31%	0.312	57%	0.569	S	S	.	*			trans	-130.3	156.7	173.5	45.5	-26.6	0	0	0	108.6	S936 R969 N970 D971	S936-P939 PolarHBondContact N-O 2.93Å; S936-P939 VanDerWaalsContact OG-C 3.32Å; S936-P939 WeakPolarHBondContact OG-CA 3.48Å; P939-R969 VanDerWaalsContact C-C 3.44Å; P939-R969 CarbonylContact C-O 2.84Å; P939-R969 CarbonylContact O-C 3.16Å; P939-R969 VanDerWaalsContact O-C 3.23Å; P939-N970 HydrophobicContact CB-CB 3.92Å; P939-N970 HydrophobicContact CG-CB 3.85Å; P939-D971 VanDerWaalsContact CB-O 3.3Å; P939-D971 WeakPolarHBondContact CB-O 3.36Å
940	S	22.8	Very low	24.4	Very low	13 Å²	13	104.5 Å²	104.5	9%	0.091	57%	0.565	C	S	.	*			cis	88.7	60	8.9	-163.7	0	0	0	0	124.4	N935 S936 K942 R969 N970 D971	N935-S940 VanDerWaalsContact C-CB 3.49Å; S936-S940 WeakPolarHBondContact OG-CB 3.22Å; S936-S940 PolarHBondContact OG-N 3.39Å; S940-K942 PolarHBondContact O-N 2.82Å; S940-R969 VanDerWaalsContact N-C 3.35Å; S940-N970 VanDerWaalsContact C-CA 3.44Å; S940-N970 CarbonylContact C-O 3.54Å; S940-N970 VanDerWaalsContact N-N 3.15Å; S940-N970 CarbonylContact O-C 3.52Å; S940-D971 VanDerWaalsContact CA-N 3.3Å; S940-D971 VanDerWaalsContact CB-OD2 3.26Å; S940-D971 WeakPolarHBondContact CB-OD2 3Å; S940-D971 WeakPolarHBondContact O-CB 3.09Å; S940-D971 PolarHBondContact O-N 2.77Å; S940-D971 PolarHBondContact OG-OD2 2.75Å
941	A	25	Very low	24.7	Very low	10 Å²	10	106.3 Å²	106.3	8%	0.083	56%	0.564	C	S	.	*			trans	-82.2	124.3	-166.8	0	0	0	0	0	111.1	S943 R969	A941-S943 WeakPolarHBondContact CB-OG 3.23Å; A941-S943 PolarHBondContact O-N 3.18Å; A941-S943 PolarHBondContact O-OG 3.41Å; A941-R969 HydrophobicContact CB-CB 4.28Å; A941-R969 HydrophobicContact CB-CG 4.09Å
942	K	23.6	Very low	24.9	Very low	161 Å²	161	107.5 Å²	107.5	70%	0.7	57%	0.565	S	S	*	*			trans	-85.3	49.7	152.9	-62.2	-177.3	-171	67.4	0	109.4	S940 D971	S940-K942 PolarHBondContact O-N 2.82Å; K942-D971 IonicContact NZ-OD1 3.93Å; K942-D971 PolarHBondContact NZ-OD1 2.89Å; K942-D971 IonicContact NZ-OD2 3.05Å; K942-D971 PolarHBondContact NZ-OD2 3.15Å
943	S	22.5	Very low	25.1	Very low	39 Å²	39	104.7 Å²	104.7	27%	0.273	56%	0.558	S	S	.	*				-19.4	142.6	87.6	84.4	0	0	0	0	117.9	A941 K945	A941-S943 WeakPolarHBondContact CB-OG 3.23Å; A941-S943 PolarHBondContact O-N 3.18Å; A941-S943 PolarHBondContact O-OG 3.41Å; S943-K945 PolarHBondContact O-N 2.97Å
944	D	22.3	Very low	25.5	Very low	128 Å²	128	100.2 Å²	100.2	68%	0.684	55%	0.551	S	S	*	*			trans	55.9	44.2	168.2	-61.5	-3.5	0	0	0	116.2
945	K	20.5	Very low	25.9	Very low	186 Å²	186	100 Å²	100	81%	0.809	55%	0.551	S	S	*	*				-102	112.4	87.8	-74.4	-169.2	172.5	178.4	0	108.7	S943	S943-K945 PolarHBondContact O-N 2.97Å
946	L	22	Very low	26.3	Very low	105 Å²	105	102.7 Å²	102.7	55%	0.55	57%	0.565	S	S	.	*				57.4	122.5	69.3	-61.2	154.2	0	0	0	108.6	L948	L946-L948 HydrophobicContact CD2-CD1 3.69Å
947	V	26.7	Very low	26.5	Very low	121 Å²	121	107.8 Å²	107.8	73%	0.733	59%	0.589	S	S	*	*			cis	-129.1	143.2	39.4	169.4	0	0	0	0	112.9
948	L	27.1	Very low	26.7	Very low	111 Å²	111	105.9 Å²	105.9	58%	0.581	57%	0.574	S	S	*	*			trans	-7.1	141.5	148.9	-63.9	56.4	0	0	0	115.3	L946	L946-L948 HydrophobicContact CD2-CD1 3.69Å
949	H	28.8	Very low	26.2	Very low	160 Å²	160	111 Å²	111	74%	0.741	58%	0.575	S	S	*	*				-163.6	159.1	85.1	-99.1	-75.2	0	0	0	111.9
950	P	25.6	Very low	26.4	Very low	91 Å²	91	112.9 Å²	112.9	59%	0.591	59%	0.59	S	S	*	*			trans	-101.4	-140.2	-165.8	42.4	-35.7	0	0	0	110.1
951	H	28.5	Very low	26.5	Very low	147 Å²	147	119.1 Å²	119.1	68%	0.681	62%	0.622	S	S	*	*			trans	73.2	103.4	178.6	-61.7	-56.3	0	0	0	113
952	N	27.2	Very low	26.6	Very low	138 Å²	138	126.3 Å²	126.3	74%	0.738	66%	0.659	S	S	*	*				97	145	68.2	-87.1	7.6	0	0	0	109.3
953	S	27.9	Very low	26.8	Very low	73 Å²	73	123.2 Å²	123.2	51%	0.51	66%	0.657	S	S	.	*			cis	-173	-170.5	-16.2	51.6	0	0	0	0	106.3
954	N	30.2	Very low	27	Very low	132 Å²	132	127.4 Å²	127.4	71%	0.706	68%	0.677	S	S	*	*			trans	76.3	130.9	163.4	-44.9	-19.1	0	0	0	114.7
955	N	31.8	Very low	27.2	Very low	124 Å²	124	128.4 Å²	128.4	66%	0.663	68%	0.677	S	S	*	*			cis	-150.2	132.4	-3.4	-96.5	-6.2	0	0	0	109.7
956	D	30.8	Very low	27.6	Very low	123 Å²	123	126.1 Å²	126.1	66%	0.658	67%	0.672	S	S	*	*				64.5	131.5	125	-60	-36.5	0	0	0	123.8
957	I	28.6	Very low	27.8	Very low	138 Å²	138	127 Å²	127	71%	0.708	68%	0.677	S	S	*	*			trans	65.2	111.5	136.5	-62.5	166.5	0	0	0	115.3
958	V	27.2	Very low	27.9	Very low	90 Å²	90	127.9 Å²	127.9	55%	0.545	67%	0.674	S	S	.	*			cis	-145.3	132	48.3	-178.1	0	0	0	0	113.2
959	R	26.5	Very low	27.9	Very low	192 Å²	192	129 Å²	129	73%	0.725	67%	0.67	S	S	*	*			trans	5.4	148.6	140.5	-69.4	177.7	-172.7	99.4	4.6	119.8
960	S	28	Very low	27.9	Very low	89 Å²	89	126 Å²	126	62%	0.622	66%	0.66	S	S	*	*			cis	-165.5	140.4	11.1	32	0	0	0	0	116
961	N	26.8	Very low	28	Very low	143 Å²	143	124.1 Å²	124.1	77%	0.765	64%	0.644	S	S	*	*			trans	68.5	136.6	136.4	-58.1	17.2	0	0	0	119.1
962	L	26.7	Very low	28	Very low	162 Å²	162	123.9 Å²	123.9	85%	0.848	64%	0.644	S	S	*	*			cis	-147.3	151.2	-1.4	-152.5	70.3	0	0	0	111.3
963	S	26.6	Very low	28	Very low	95 Å²	95	127.5 Å²	127.5	66%	0.664	65%	0.653	S	S	*	*			trans	-135.7	-169.8	-171.4	58.9	0	0	0	0	112.5
964	N	27.1	Very low	28.1	Very low	128 Å²	128	132 Å²	132	68%	0.684	67%	0.666	S	S	*	*			trans	92.9	148.3	172.8	-59.9	38	0	0	0	113.7
965	E	27.2	Very low	27.8	Very low	148 Å²	148	131.1 Å²	131.1	69%	0.692	67%	0.67	S	S	*	*			cis	-158.3	-178.1	-5	-119.3	174.3	106.6	0	0	108.4
966	I	28.3	Very low	27.4	Very low	138 Å²	138	131.3 Å²	131.3	71%	0.708	67%	0.67	S	S	*	*			cis	-142.3	-147.9	12.9	-153.7	153.3	0	0	0	113.3
967	N	27.2	Very low	27.1	Very low	123 Å²	123	131.6 Å²	131.6	66%	0.658	67%	0.671	S	S	*	*			trans	-106.3	138.9	-164.6	-62.2	-55.5	0	0	0	116.9
968	Q	28.8	Very low	26.9	Very low	141 Å²	141	130.6 Å²	130.6	66%	0.659	67%	0.667	S	S	*	*			trans	47.2	131.4	132.8	-59.4	-175.1	6.5	0	0	123.9
969	R	26.4	Very low	26.7	Very low	133 Å²	133	132.1 Å²	132.1	50%	0.502	67%	0.671	S	S	.	*			trans	-171.4	147.1	132.6	-99.5	147.3	177	-174.1	-4.9	112.5	N935 P939 S940 A941	N935-R969 WeakPolarHBondContact OD1-CD 3.26Å; N935-R969 PolarHBondContact OD1-NE 2.7Å; P939-R969 VanDerWaalsContact C-C 3.44Å; P939-R969 CarbonylContact C-O 2.84Å; P939-R969 CarbonylContact O-C 3.16Å; P939-R969 VanDerWaalsContact O-C 3.23Å; S940-R969 VanDerWaalsContact N-C 3.35Å; A941-R969 HydrophobicContact CB-CB 4.28Å; A941-R969 HydrophobicContact CB-CG 4.09Å
970	N	28.8	Very low	26.6	Very low	99 Å²	99	130.4 Å²	130.4	53%	0.529	67%	0.671	S	S	.	*			trans	-152.1	102.6	176.4	53	-99.5	0	0	0	123	P939 S940	P939-N970 HydrophobicContact CB-CB 3.92Å; P939-N970 HydrophobicContact CG-CB 3.85Å; S940-N970 VanDerWaalsContact C-CA 3.44Å; S940-N970 CarbonylContact C-O 3.54Å; S940-N970 VanDerWaalsContact N-N 3.15Å; S940-N970 CarbonylContact O-C 3.52Å
971	D	27.2	Very low	26.3	Very low	50 Å²	50	131.5 Å²	131.5	27%	0.267	67%	0.67	S	S	.	*			trans	-122.2	-127.6	157.6	-67.5	-67.5	0	0	0	112.7	P939 S940 K942	P939-D971 VanDerWaalsContact CB-O 3.3Å; P939-D971 WeakPolarHBondContact CB-O 3.36Å; S940-D971 VanDerWaalsContact CA-N 3.3Å; S940-D971 VanDerWaalsContact CB-OD2 3.26Å; S940-D971 WeakPolarHBondContact CB-OD2 3Å; S940-D971 WeakPolarHBondContact O-CB 3.09Å; S940-D971 PolarHBondContact O-N 2.77Å; S940-D971 PolarHBondContact OG-OD2 2.75Å; K942-D971 IonicContact NZ-OD1 3.93Å; K942-D971 PolarHBondContact NZ-OD1 2.89Å; K942-D971 IonicContact NZ-OD2 3.05Å; K942-D971 PolarHBondContact NZ-OD2 3.15Å
972	H	29.6	Very low	26.1	Very low	143 Å²	143	134.2 Å²	134.2	66%	0.662	67%	0.67	S	S	*	*			trans	-139.2	144.1	-156.7	-65.4	-90.6	0	0	0	119.7
973	F	26.4	Very low	26	Very low	213 Å²	213	131.9 Å²	131.9	93%	0.934	67%	0.667	S	S	*	*				-157.7	174.3	114.7	-121	-85.1	0	0	0	110.2
974	E	29.5	Very low	25.9	Very low	167 Å²	167	132.9 Å²	132.9	78%	0.78	67%	0.671	S	S	*	*			trans	-152.5	134.2	-140.2	177.2	177.4	-102.6	0	0	117.1
975	S	25.1	Very low	25.7	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	68%	0.678	S	S	*	*			trans	-168.9	110.8	160	62.7	0	0	0	0	117.9
976	I	22.7	Very low	25.5	Very low	129 Å²	129	132.9 Å²	132.9	66%	0.662	68%	0.68	S	S	*	*			trans	22.7	111.2	146	-42.8	176.4	0	0	0	121.9
977	N	24.8	Very low	25.3	Very low	128 Å²	128	136.2 Å²	136.2	68%	0.684	69%	0.69	S	S	*	*				162.6	125.6	128.3	-91.2	-56.1	0	0	0	109.5
978	N	23.2	Very low	25.1	Very low	117 Å²	117	139.1 Å²	139.1	63%	0.626	69%	0.693	S	S	*	*				88.7	144.1	62.3	-87.5	-45	0	0	0	115.1
979	I	23.4	Very low	25	Very low	122 Å²	122	141 Å²	141	63%	0.626	70%	0.701	S	S	*	*			trans	78.5	88.7	168.1	-58.5	160.5	0	0	0	116.7
980	H	24.1	Very low	24.9	Very low	157 Å²	157	139.4 Å²	139.4	73%	0.727	71%	0.71	S	S	*	*				48.8	133.6	112.1	-90.3	-102.3	0	0	0	122.6
981	D	22.7	Very low	24.7	Very low	111 Å²	111	140.3 Å²	140.3	59%	0.594	71%	0.711	S	S	*	*			trans	83.3	116.2	134.8	-72.4	-31.5	0	0	0	123
982	W	22.6	Very low	24.7	Very low	200 Å²	200	142.7 Å²	142.7	76%	0.758	72%	0.724	S	S	*	*			trans	81.5	89.5	138.3	-54.4	1.8	0	0	0	119.3
983	S	25.5	Very low	24.5	Very low	114 Å²	114	140.6 Å²	140.6	80%	0.797	72%	0.722	S	S	*	*			trans	-139.4	144.2	135.7	55.2	0	0	0	0	107.7
984	P	23.5	Very low	24.5	Very low	115 Å²	115	133.5 Å²	133.5	75%	0.747	69%	0.693	S	S	*	*				-151.1	124.6	95.2	35.2	-15.1	0	0	0	116.6
985	T	24	Very low	24.4	Very low	134 Å²	134	135 Å²	135	82%	0.822	70%	0.697	S	S	*	*			trans	33.4	131.3	136	39.5	0	0	0	0	122.6
986	L	21.3	Very low	24.3	Very low	142 Å²	142	136.8 Å²	136.8	74%	0.743	70%	0.697	S	S	*	*			trans	-50	147.1	149.4	-65.3	82	0	0	0	112.7
987	K	24.4	Very low	24.4	Very low	209 Å²	209	136.2 Å²	136.2	91%	0.909	70%	0.696	S	S	*	*				-167.7	165.1	122.8	-108.2	161.4	-174.8	168.8	0	114.9
988	Y	22.5	Very low	24.6	Very low	184 Å²	184	138.2 Å²	138.2	72%	0.722	70%	0.698	S	S	*	*			trans	-91.2	164.8	-161.3	-85.5	-99.4	0	0	0	116.7
989	H	26.5	Very low	24.7	Very low	179 Å²	179	137.7 Å²	137.7	83%	0.829	70%	0.699	S	S	*	*			trans	75.9	170.1	145.3	-83.2	-54.3	0	0	0	121.4
990	S	24.3	Very low	24.8	Very low	100 Å²	100	138.7 Å²	138.7	70%	0.699	71%	0.706	S	S	*	*			trans	-161.1	151.9	-163	60.6	0	0	0	0	112.3
991	E	26.4	Very low	24.9	Very low	119 Å²	119	136.7 Å²	136.7	56%	0.556	71%	0.705	S	S	*	*			trans	-161.7	149.1	155.1	-127.3	-178.8	-113.8	0	0	113.7	S1253 R1670	E991-S1253 WeakPolarHBondContact O-CB 3.33Å; E991-S1253 PolarHBondContact O-OG 2.89Å; E991-R1670 IonicContact OE1-CZ 2.6Å; E991-R1670 IonicContact OE1-NH1 2.56Å; E991-R1670 PolarHBondContact OE1-NH1 3.17Å; E991-R1670 IonicContact OE1-NH2 3.97Å; E991-R1670 PolarHBondContact OE1-NH2 3.22Å; E991-R1670 IonicContact OE2-CZ 2.67Å; E991-R1670 IonicContact OE2-NH1 3.91Å; E991-R1670 PolarHBondContact OE2-NH1 2.92Å; E991-R1670 IonicContact OE2-NH2 2.61Å; E991-R1670 PolarHBondContact OE2-NH2 3.29Å
992	N	26.2	Very low	25.1	Very low	99 Å²	99	138.2 Å²	138.2	53%	0.529	71%	0.712	S	S	.	*			trans	-96.4	150.3	-161.9	-69	-35	0	0	0	116.5	S1253 S1254	N992-S1253 VanDerWaalsContact CA-OG 3.25Å; N992-S1253 WeakPolarHBondContact CA-OG 3.07Å; N992-S1254 WeakPolarHBondContact OD1-CA 3.49Å; N992-S1254 PolarHBondContact OD1-N 3.14Å
993	T	26.2	Very low	25.3	Very low	100 Å²	100	133.6 Å²	133.6	61%	0.613	71%	0.71	S	S	*	*				147.4	118.5	122.6	49.7	0	0	0	0	118.8	S1254	T993-S1254 VanDerWaalsContact CA-CB 3.45Å; T993-S1254 WeakPolarHBondContact CA-OG 3.44Å
994	D	24.8	Very low	25.4	Very low	64 Å²	64	134.9 Å²	134.9	34%	0.342	71%	0.708	S	S	.	*			trans	38.2	120.8	130.9	-70	-90.6	0	0	0	122.9	S1254 I1255	D994-S1254 PolarHBondContact N-OG 2.85Å; D994-I1255 WeakPolarHBondContact OD1-CG2 3.43Å
995	K	27.6	Very low	25.5	Very low	197 Å²	197	139.4 Å²	139.4	86%	0.857	72%	0.716	S	S	*	*				177.7	123.2	106.8	-99.7	173.3	-179	176.4	0	117.9
996	L	24.5	Very low	25.6	Very low	152 Å²	152	138 Å²	138	80%	0.796	71%	0.709	S	S	*	*				47.7	123.8	122.8	-126.8	80.7	0	0	0	123.5
997	D	25	Very low	25.6	Very low	118 Å²	118	136.1 Å²	136.1	63%	0.631	71%	0.708	S	S	*	*				106.8	138.1	121.7	-133.6	30.4	0	0	0	120.6
998	K	27.5	Very low	25.6	Very low	169 Å²	169	131.9 Å²	131.9	74%	0.735	71%	0.705	S	S	*	*			trans	74	137.9	161.1	-72.2	166.4	-172.1	169.4	0	120.3
999	T	26	Very low	25.6	Very low	106 Å²	106	127.9 Å²	127.9	65%	0.65	70%	0.704	S	S	*	*			cis	-167	158.8	-20.4	5.4	0	0	0	0	109.2
1000	D	25	Very low	25.4	Very low	144 Å²	144	123.6 Å²	123.6	77%	0.77	69%	0.694	S	S	*	*			trans	68.8	152.5	152.6	-62.2	-22	0	0	0	118.2
1001	V	27.4	Very low	25.4	Very low	115 Å²	115	125.2 Å²	125.2	70%	0.697	69%	0.691	S	S	*	*			cis	-153	142	9.4	94.4	0	0	0	0	115.2
1002	L	26.3	Very low	25.2	Very low	143 Å²	143	122.7 Å²	122.7	75%	0.749	68%	0.684	S	S	*	*			trans	68.1	141	151	-78.2	161	0	0	0	126.8
1003	S	27.5	Very low	24.9	Very low	103 Å²	103	119.4 Å²	119.4	72%	0.72	67%	0.669	S	S	*	*			trans	73.4	93.5	156.3	59.1	0	0	0	0	118.4
1004	N	25.7	Very low	24.7	Very low	141 Å²	141	123.6 Å²	123.6	75%	0.754	68%	0.675	S	S	*	*			cis	91.8	99.9	46.2	-68.6	-16.9	0	0	0	114.8
1005	F	26.4	Very low	24.5	Very low	210 Å²	210	125.8 Å²	125.8	92%	0.921	69%	0.686	S	S	*	*				-161.6	167.1	128.9	-101.4	-55.9	0	0	0	108.9
1006	P	26.6	Very low	24.2	Very low	103 Å²	103	125.2 Å²	125.2	67%	0.669	69%	0.687	S	S	*	*			trans	-95	150	-136.1	27.7	-12.8	0	0	0	114.1
1007	S	21.8	Very low	24.1	Very low	103 Å²	103	122.3 Å²	122.3	72%	0.72	68%	0.679	S	S	*	*			cis	91.8	140.6	27.3	87.8	0	0	0	0	115.8
1008	S	23	Very low	24.1	Very low	121 Å²	121	123.4 Å²	123.4	85%	0.846	68%	0.683	S	S	*	*			trans	76.4	150.8	179	85.6	0	0	0	0	115.7
1009	S	22.8	Very low	23.9	Very low	99 Å²	99	121.8 Å²	121.8	69%	0.692	68%	0.683	S	S	*	*			cis	-151.2	164.6	6.2	66.3	0	0	0	0	115
1010	S	22.9	Very low	24	Very low	89 Å²	89	125 Å²	125	62%	0.622	69%	0.69	S	S	*	*			trans	60.4	118.6	140	63.2	0	0	0	0	122.7
1011	Q	24	Very low	24.2	Very low	135 Å²	135	123.1 Å²	123.1	63%	0.631	69%	0.686	S	S	*	*			trans	-61.9	146.5	130.5	-63.8	175.2	-62.4	0	0	108.6
1012	P	21.2	Very low	24	Very low	65 Å²	65	124.2 Å²	124.2	42%	0.422	69%	0.686	S	S	.	*				-152.4	154.7	108.9	37.7	-21.5	0	0	0	115.8	Q658	Q658-P1012 VanDerWaalsContact CB-O 3.31Å; Q658-P1012 WeakPolarHBondContact CB-O 3.43Å; Q658-P1012 PolarHBondContact NE2-O 2.66Å; Q658-P1012 PolarHBondContact OE1-O 2.84Å
1013	C	20.9	Very low	23.9	Very low	30 Å²	30	123.7 Å²	123.7	20%	0.203	68%	0.684	C	S	.	*			trans	-77	136	143.6	-175.6	0	0	0	0	107.8	Q657 Q658 H659	Q657-C1013 PolarHBondContact O-SG 3.27Å; Q657-C1013 VanDerWaalsContact O-SG 3.38Å; Q658-C1013 HydrophobicContact CB-CB 4.42Å; Q658-C1013 WeakPolarHBondContact O-CB 3.24Å; Q658-C1013 PolarHBondContact O-SG 2.97Å; H659-C1013 HydrophobicContact CB-CB 3.94Å
1014	Y	21.3	Very low	23.9	Very low	188 Å²	188	128.4 Å²	128.4	74%	0.737	69%	0.688	S	S	*	*			trans	175.8	118.2	145.5	-81.7	-57.7	0	0	0	104.8
1015	N	21.3	Very low	23.8	Very low	111 Å²	111	129.8 Å²	129.8	59%	0.594	69%	0.687	S	S	*	*				57.7	134.2	70.5	-88	-29.8	0	0	0	115
1016	E	21.5	Very low	23.7	Very low	184 Å²	184	125.6 Å²	125.6	86%	0.86	67%	0.673	S	S	*	*			trans	66.2	150.7	171	-60.6	176.6	-169.1	0	0	116.6
1017	S	22	Very low	23.7	Very low	91 Å²	91	128.1 Å²	128.1	64%	0.636	68%	0.681	S	S	*	*			cis	-168.4	-158.4	-29.9	58	0	0	0	0	107.6
1018	I	25.1	Very low	24.1	Very low	141 Å²	141	127.9 Å²	127.9	72%	0.723	68%	0.677	S	S	*	*			trans	72.2	96.5	166.4	-55.3	157.3	0	0	0	117.5
1019	N	24.1	Very low	24.2	Very low	135 Å²	135	130.1 Å²	130.1	72%	0.722	67%	0.674	S	S	*	*				32.7	153.5	121	-53.2	-13.3	0	0	0	123.8
1020	H	26.1	Very low	24.2	Very low	174 Å²	174	131.9 Å²	131.9	81%	0.806	68%	0.675	S	S	*	*			trans	92.4	151.6	159.7	-69.5	-70.1	0	0	0	118.9
1021	P	30.2	Very low	24.2	Very low	104 Å²	104	134.2 Å²	134.2	68%	0.675	68%	0.68	S	S	*	*			trans	-126.1	-140.4	-157	37.2	-14.8	0	0	0	111.7
1022	I	23.5	Very low	24.2	Very low	139 Å²	139	134.1 Å²	134.1	71%	0.713	68%	0.684	S	S	*	*			trans	98	130.4	164.8	-58	157.2	0	0	0	115.7	Y1024	I1022-Y1024 HydrophobicContact CG2-CE2 4.49Å
1023	D	24.8	Very low	24.4	Very low	132 Å²	132	140 Å²	140	71%	0.706	70%	0.703	S	S	*	*			trans	-69.2	150.5	173.1	-40.5	-105.3	0	0	0	113.1
1024	Y	26	Very low	24.6	Very low	202 Å²	202	145 Å²	145	79%	0.792	72%	0.723	S	S	*	*			trans	-152.1	115.1	133.4	-89.5	-73.9	0	0	0	108.4	I1022	I1022-Y1024 HydrophobicContact CG2-CE2 4.49Å
1025	K	24.6	Very low	24.8	Very low	169 Å²	169	144.9 Å²	144.9	74%	0.735	72%	0.723	S	S	*	*			cis	101.5	154.5	24	-167.7	-171.8	-177.9	175	0	112.2
1026	I	24.6	Very low	25	Very low	122 Å²	122	147 Å²	147	63%	0.626	73%	0.731	S	S	*	*			trans	82	99	170	-45.3	177.9	0	0	0	115.8
1027	N	26	Very low	25.3	Very low	156 Å²	156	142.3 Å²	142.3	83%	0.834	72%	0.719	S	S	*	*				-162.1	105.1	96	-128	-8.1	0	0	0	112.9
1028	P	30.3	Very low	25.7	Very low	98 Å²	98	143.4 Å²	143.4	64%	0.636	72%	0.722	S	S	*	*			trans	-90.5	164.7	161.4	36.9	-31.9	0	0	0	111.1
1029	Q	24	Very low	25.9	Very low	169 Å²	169	143.7 Å²	143.7	79%	0.79	73%	0.725	S	S	*	*			trans	151.3	151.7	145.2	-80.9	-76.6	-1	0	0	112.4
1030	L	23.9	Very low	26.5	Very low	136 Å²	136	141.6 Å²	141.6	71%	0.712	72%	0.718	S	S	*	*			trans	53.8	98.2	164	-89.8	69	0	0	0	121.5
1031	N	23	Very low	26.9	Very low	137 Å²	137	141.9 Å²	141.9	73%	0.733	72%	0.72	S	S	*	*				46.3	139.2	103.5	-74.8	-7.2	0	0	0	123.2
1032	N	23.9	Very low	26.9	Very low	134 Å²	134	141.6 Å²	141.6	72%	0.717	72%	0.716	S	S	*	*			trans	72.9	95.1	140.3	-64.7	-15.1	0	0	0	120.2
1033	K	25.8	Very low	27.1	Very low	189 Å²	189	141.8 Å²	141.8	82%	0.822	72%	0.718	S	S	*	*				160.1	156.6	113.2	-87.1	160.6	-179.8	-179.8	0	110.8
1034	Q	24.5	Very low	27.3	Very low	133 Å²	133	143 Å²	143	62%	0.621	72%	0.716	S	S	*	*			cis	177.7	159.6	-34.5	-117.4	-176.7	-36.5	0	0	106
1035	Y	25.8	Very low	27.6	Very low	186 Å²	186	139.7 Å²	139.7	73%	0.729	71%	0.708	S	S	*	*			trans	69.2	136.2	177.1	-49.6	-80.3	0	0	0	115.6
1036	M	26.3	Very low	27.7	Very low	155 Å²	155	138.7 Å²	138.7	76%	0.764	71%	0.71	S	S	*	*			cis	-153.9	128.6	-7.6	-126.9	168.4	161.5	0	0	112
1037	S	26.5	Very low	27.7	Very low	87 Å²	87	138 Å²	138	61%	0.608	71%	0.711	S	S	*	*				37.9	145.2	123.4	83.6	0	0	0	0	120.7
1038	T	30.5	Very low	27.6	Very low	114 Å²	114	136.8 Å²	136.8	70%	0.699	71%	0.71	S	S	*	*			cis	-161.6	161.1	23.7	41.1	0	0	0	0	109.7
1039	N	29	Very low	27.5	Very low	147 Å²	147	137.7 Å²	137.7	79%	0.786	72%	0.716	S	S	*	*			cis	-160.6	169.1	-13.9	-104.6	-0.4	0	0	0	110.7
1040	P	38	Very low	27.4	Very low	90 Å²	90	134.3 Å²	134.3	58%	0.584	71%	0.711	S	S	*	*			trans	-124.1	-170.4	-163.2	44.9	-32.8	0	0	0	114.9	T1042	P1040-T1042 HydrophobicContact CG-CG2 4.42Å
1041	H	33.4	Very low	27.4	Very low	180 Å²	180	133.4 Å²	133.4	83%	0.833	71%	0.711	S	S	*	*			trans	-166.5	126.1	139.7	-88.9	-59.5	0	0	0	108.4
1042	T	29.9	Very low	27.5	Very low	98 Å²	98	134.1 Å²	134.1	60%	0.601	71%	0.71	S	S	*	*			cis	102.1	145.6	30.9	64.2	0	0	0	0	112.2	P1040	P1040-T1042 HydrophobicContact CG-CG2 4.42Å
1043	I	29.6	Very low	27.7	Very low	144 Å²	144	134.9 Å²	134.9	74%	0.738	71%	0.709	S	S	*	*			cis	-169.9	-179.9	8	-124	168.1	0	0	0	112.3
1044	K	28.4	Very low	27.7	Very low	156 Å²	156	131.3 Å²	131.3	68%	0.678	70%	0.699	S	S	*	*			trans	98.1	150.7	168.6	-67.8	170.3	167.3	-131.3	0	117.9
1045	E	32.4	Very low	27.8	Very low	133 Å²	133	132 Å²	132	62%	0.621	70%	0.702	S	S	*	*			cis	-151.8	147.9	-11.1	-114.1	142.3	-169.7	0	0	106
1046	L	25.2	Very low	27.8	Very low	148 Å²	148	128.1 Å²	128.1	78%	0.775	70%	0.697	S	S	*	*			cis	84.1	128	36.6	-84.1	70.1	0	0	0	114.9
1047	T	25	Very low	27.7	Very low	107 Å²	107	127.2 Å²	127.2	66%	0.656	70%	0.696	S	S	*	*			cis	-172.5	145.7	-20.8	2.5	0	0	0	0	112.4
1048	T	24.8	Very low	27.7	Very low	132 Å²	132	130.9 Å²	130.9	81%	0.81	71%	0.709	S	S	*	*			trans	61.8	171.4	166	65.7	0	0	0	0	117.3
1049	P	28.9	Very low	27.4	Very low	117 Å²	117	129.1 Å²	129.1	76%	0.76	71%	0.713	S	S	*	*			cis	-128.3	-167.4	-3.8	42	-24.5	0	0	0	115.1
1050	S	21.8	Very low	27.3	Very low	97 Å²	97	130.3 Å²	130.3	68%	0.678	72%	0.718	S	S	*	*			trans	-57.9	158.1	163.2	49.7	0	0	0	0	112.8
1051	T	23.6	Very low	27	Very low	117 Å²	117	131 Å²	131	72%	0.718	72%	0.722	S	S	*	*				-175.3	153.2	71.4	44.5	0	0	0	0	115.3
1052	H	25.4	Very low	26.5	Very low	153 Å²	153	128.7 Å²	128.7	71%	0.708	71%	0.71	S	S	*	*			trans	78.1	140.7	140.1	-94.5	-108.5	0	0	0	123.9
1053	H	27.1	Very low	26.3	Very low	150 Å²	150	127.3 Å²	127.3	69%	0.694	70%	0.696	S	S	*	*			trans	66	133.1	160.9	-61.1	-57.8	0	0	0	120.1
1054	D	25.2	Very low	26.1	Very low	114 Å²	114	122.7 Å²	122.7	61%	0.61	68%	0.677	S	S	*	*			cis	-165.2	173	-23.5	-134.6	-34.3	0	0	0	112.5
1055	H	28	Very low	25.8	Very low	148 Å²	148	121.7 Å²	121.7	69%	0.685	67%	0.668	S	S	*	*			trans	66.5	107.3	161.7	-74.8	-58.8	0	0	0	118.9
1056	T	26.1	Very low	25.3	Very low	104 Å²	104	124.1 Å²	124.1	64%	0.638	68%	0.677	S	S	*	*				65.3	140.2	82.2	63.5	0	0	0	0	114.6
1057	D	24.2	Very low	25.1	Very low	136 Å²	136	126.2 Å²	126.2	73%	0.727	68%	0.68	S	S	*	*			cis	-165.7	-175.9	-8.3	-105.6	-28.7	0	0	0	109.4
1058	D	26	Very low	24.9	Very low	164 Å²	164	131.4 Å²	131.4	88%	0.877	69%	0.687	S	S	*	*			trans	68.4	140.7	157.4	-69.6	-32.3	0	0	0	123
1059	G	24.3	Very low	24.7	Very low	76 Å²	76	131.9 Å²	131.9	78%	0.784	68%	0.682	S	S	*	*				110.4	110.3	127.7	0	0	0	0	0	121.1
1060	L	27.5	Very low	24.6	Very low	172 Å²	172	132.2 Å²	132.2	90%	0.901	68%	0.682	S	S	*	*			trans	-81.9	172.6	150	-64.9	141.6	0	0	0	109.1
1061	P	31.1	Very low	24.7	Very low	104 Å²	104	131.9 Å²	131.9	68%	0.675	68%	0.679	S	S	*	*			cis	-145.4	-167.5	11.2	44.1	-23	0	0	0	117
1062	F	23.2	Very low	24.7	Very low	133 Å²	133	133.1 Å²	133.1	58%	0.583	68%	0.682	S	S	*	*			trans	46	130.4	151.8	-75.8	-60.4	0	0	0	124.9	R652	R652-F1062 HydrophobicContact CG-CE1 3.79Å
1063	K	24.3	Very low	24.7	Very low	68 Å²	68	131.8 Å²	131.8	30%	0.296	68%	0.684	S	S	.	*			trans	55.5	116.7	141.1	-66.2	173.8	-170.8	-169.2	0	119.6	N648 N651	N648-K1063 WeakPolarHBondContact O-CE 3.14Å; N648-K1063 PolarHBondContact O-NZ 3.17Å; N648-K1063 WeakPolarHBondContact OD1-CD 3.14Å; N648-K1063 PolarHBondContact OD1-NZ 2.9Å; N651-K1063 HydrophobicContact CB-CB 4.15Å; N651-K1063 HydrophobicContact CB-CG 3.62Å; N651-K1063 VanDerWaalsContact O-CE 3.23Å; N651-K1063 WeakPolarHBondContact O-CE 3.26Å; N651-K1063 WeakPolarHBondContact O-CG 3.49Å
1064	S	25.1	Very low	24.6	Very low	48 Å²	48	131.3 Å²	131.3	34%	0.336	69%	0.686	S	S	.	*				159	-179.9	56.4	59	0	0	0	0	112.5	T647	T647-S1064 VanDerWaalsContact CG2-OG 3.29Å; T647-S1064 WeakPolarHBondContact CG2-OG 3.19Å; T647-S1064 WeakPolarHBondContact O-CB 3.38Å
1065	R	22.5	Very low	24.5	Very low	134 Å²	134	132.6 Å²	132.6	51%	0.506	69%	0.692	S	S	.	*			trans	53.1	130	151.6	-77.5	-168.4	178.1	177.3	-2.7	124.8	I646 T647	I646-R1065 VanDerWaalsContact C-NH2 3.28Å; I646-R1065 PolarHBondContact O-NE 3.09Å; I646-R1065 PolarHBondContact O-NH2 3.18Å; T647-R1065 HydrophobicContact CG2-CG 4.49Å; T647-R1065 PolarHBondContact OG1-NH1 2.87Å; T647-R1065 VanDerWaalsContact OG1-NH1 3.14Å; T647-R1065 PolarHBondContact OG1-NH2 3.4Å
1066	K	22.4	Very low	24.4	Very low	184 Å²	184	130.8 Å²	130.8	80%	0.8	69%	0.692	S	S	*	*				30.3	128.8	130	-76.1	178.4	176.1	171.4	0	123.6
1067	K	22.1	Very low	24.3	Very low	192 Å²	192	132.4 Å²	132.4	84%	0.835	70%	0.697	S	S	*	*			trans	84.4	142.5	138.9	-73.8	-179	174.4	-176.3	0	122.8
1068	R	20.3	Very low	24.2	Very low	216 Å²	216	132 Å²	132	82%	0.815	69%	0.694	S	S	*	*			trans	94.7	125.5	139.1	-103.7	-170.9	173.2	168.3	-3.7	122.9
1069	M	21.1	Very low	24.2	Very low	142 Å²	142	131.7 Å²	131.7	70%	0.7	69%	0.687	S	S	*	*				41.6	127.8	123.6	-70.8	176.2	72.9	0	0	123.7
1070	V	25.8	Very low	24.2	Very low	125 Å²	125	133.6 Å²	133.6	76%	0.758	68%	0.684	S	S	*	*			trans	70.5	143	133.4	-172.5	0	0	0	0	114.4
1071	S	24.7	Very low	24.2	Very low	89 Å²	89	131.5 Å²	131.5	62%	0.622	68%	0.678	S	S	*	*				-159.9	-178.8	57.6	-52	0	0	0	0	114.8
1072	D	23.6	Very low	24.2	Very low	144 Å²	144	131.4 Å²	131.4	77%	0.77	68%	0.677	S	S	*	*			trans	73.4	114.1	156	-51.7	-36.9	0	0	0	118.4
1073	T	24.1	Very low	24.2	Very low	124 Å²	124	130.8 Å²	130.8	76%	0.761	69%	0.685	S	S	*	*			cis	112.3	149.7	20.4	-60.8	0	0	0	0	110.9
1074	I	24.5	Very low	24.2	Very low	141 Å²	141	133.4 Å²	133.4	72%	0.723	71%	0.706	S	S	*	*			trans	99.8	91.1	171	-51.1	-173.9	0	0	0	117.7
1075	N	24.5	Very low	24.2	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	73%	0.727	S	S	*	*				78.6	137.7	129.9	-64.9	4.9	0	0	0	126
1076	T	24.9	Very low	24.3	Very low	110 Å²	110	139.2 Å²	139.2	68%	0.675	74%	0.739	S	S	*	*			trans	69.2	98.7	140.6	50.4	0	0	0	0	122.2
1077	D	23.5	Very low	24.3	Very low	139 Å²	139	137.9 Å²	137.9	74%	0.743	74%	0.74	S	S	*	*				101.7	140.6	103.9	-75.8	-7	0	0	0	124.7
1078	L	24	Very low	24.5	Very low	128 Å²	128	133.8 Å²	133.8	67%	0.67	73%	0.733	S	S	*	*			trans	72.2	106.9	147.8	-94	71.1	0	0	0	122.1
1079	Q	25.6	Very low	24.8	Very low	157 Å²	157	129.6 Å²	129.6	73%	0.734	73%	0.732	S	S	*	*				84.8	118.7	120	-81	175.6	16.5	0	0	122.6
1080	T	24.8	Very low	25	Very low	116 Å²	116	131.1 Å²	131.1	71%	0.712	74%	0.737	S	S	*	*				111	105.3	123.9	49.9	0	0	0	0	121.9
1081	V	26.9	Very low	24.9	Very low	128 Å²	128	133.2 Å²	133.2	78%	0.776	74%	0.741	S	S	*	*				70.3	133	118.9	169.4	0	0	0	0	119.5
1082	P	30.5	Very low	24.9	Very low	101 Å²	101	134.8 Å²	134.8	66%	0.656	74%	0.742	S	S	*	*			cis	-143.7	173.8	-27.5	42.6	-24.1	0	0	0	115.8
1083	T	23.6	Very low	24.8	Very low	121 Å²	121	133.1 Å²	133.1	74%	0.742	74%	0.742	S	S	*	*			trans	14	134	147.7	62.4	0	0	0	0	122.2
1084	V	24.8	Very low	24.7	Very low	122 Å²	122	130.6 Å²	130.6	74%	0.739	73%	0.733	S	S	*	*				174.5	128.1	102.5	154.2	0	0	0	0	112.5
1085	K	24.1	Very low	24.6	Very low	182 Å²	182	132.7 Å²	132.7	79%	0.791	74%	0.737	S	S	*	*			trans	50.1	85.1	157.4	-67.2	170.1	-173.7	171.1	0	121.3
1086	T	24.4	Very low	24.4	Very low	122 Å²	122	136 Å²	136	75%	0.748	74%	0.739	S	S	*	*				41.2	100.5	114.9	60.6	0	0	0	0	120.4
1087	L	23.3	Very low	24.2	Very low	156 Å²	156	139.8 Å²	139.8	82%	0.817	74%	0.742	S	S	*	*				-162.5	114.6	100.2	-137.5	76.1	0	0	0	109.4
1088	P	26.4	Very low	24.1	Very low	106 Å²	106	144 Å²	144	69%	0.688	75%	0.748	S	S	*	*			trans	-105.7	163	-168.6	39.3	-35.1	0	0	0	115.1
1089	T	26.9	Very low	24	Very low	129 Å²	129	143.6 Å²	143.6	79%	0.791	75%	0.754	S	S	*	*			trans	71	121.3	169.8	64.9	0	0	0	0	117.3
1090	E	23.6	Very low	23.8	Very low	173 Å²	173	145.2 Å²	145.2	81%	0.808	76%	0.762	S	S	*	*			cis	50.2	101.1	4.5	-81.6	-160.9	170.3	0	0	117
1091	M	23.8	Very low	24.2	Very low	170 Å²	170	144.6 Å²	144.6	84%	0.837	76%	0.76	S	S	*	*				-170.3	109.6	126.7	-104.5	-166.9	170.7	0	0	111.3
1092	N	24.6	Very low	23.9	Very low	121 Å²	121	146.1 Å²	146.1	65%	0.647	76%	0.763	S	S	*	*				50.2	103.1	106.8	-67.5	-38.3	0	0	0	119.4
1093	S	23.1	Very low	23.7	Very low	110 Å²	110	149.1 Å²	149.1	77%	0.769	76%	0.763	S	S	*	*				90.8	163.1	108.7	83.1	0	0	0	0	120.3
1094	A	22	Very low	23.6	Very low	70 Å²	70	150.6 Å²	150.6	58%	0.579	76%	0.759	S	S	*	*			trans	74.8	88.3	148.6	0	0	0	0	0	119.8
1095	K	21	Very low	23.5	Very low	186 Å²	186	149 Å²	149	81%	0.809	75%	0.753	S	S	*	*				79.8	125.8	123.1	-68.1	162.1	-175.8	168.2	0	119.5
1096	R	20.6	Very low	23.5	Very low	208 Å²	208	148.6 Å²	148.6	79%	0.785	76%	0.758	S	S	*	*			trans	92.7	128.7	131.5	-79.2	170.3	175.2	179.1	-2.1	121.4
1097	Y	21.8	Very low	23.5	Very low	190 Å²	190	152 Å²	152	75%	0.745	76%	0.758	S	S	*	*			trans	79	120.6	136.6	-77.4	-50.9	0	0	0	122.9
1098	R	20.4	Very low	23.6	Very low	229 Å²	229	150.7 Å²	150.7	86%	0.864	76%	0.759	S	S	*	*				84.2	151	125.9	-171.6	175.1	-75.9	-166.5	-3	118.5
1099	C	22.1	Very low	23.4	Very low	118 Å²	118	152.5 Å²	152.5	80%	0.797	76%	0.762	S	S	*	*			trans	-75.3	-178	-177.2	-44.5	0	0	0	0	114.9
1100	E	21.5	Very low	23.2	Very low	191 Å²	191	152.7 Å²	152.7	89%	0.893	76%	0.764	S	S	*	*			trans	96.6	147.8	168.4	-78.7	-162.7	-173.2	0	0	118.9
1101	P	32.3	Very low	23.2	Very low	104 Å²	104	148 Å²	148	68%	0.675	75%	0.747	S	S	*	*			trans	-105.2	158.8	-160.2	39.7	-34.1	0	0	0	114
1102	N	21.8	Very low	23.3	Very low	159 Å²	159	146.3 Å²	146.3	85%	0.85	74%	0.74	S	S	*	*				-172.8	172.2	126.7	-113.2	-77.1	0	0	0	115.7
1103	Y	25.1	Very low	23.3	Very low	165 Å²	165	149.8 Å²	149.8	65%	0.647	75%	0.749	S	S	*	*			trans	-68.1	165.3	-176.4	-122	-87.4	0	0	0	116.5	Q541	Q541-Y1103 PolarHBondContact NE2-OH 3.33Å
1104	K	21.7	Very low	23.4	Very low	152 Å²	152	151.3 Å²	151.3	66%	0.661	75%	0.748	S	S	*	*			trans	92.8	101.5	143.7	-112.9	160.6	-173.5	169.4	0	121.2
1105	S	23.5	Very low	23.6	Very low	87 Å²	87	158.9 Å²	158.9	61%	0.608	76%	0.762	S	S	*	*				64.5	135.5	126.3	66.9	0	0	0	0	122.4
1106	I	23	Very low	23.8	Very low	174 Å²	174	158.6 Å²	158.6	89%	0.892	76%	0.761	S	S	*	*			trans	-152.8	147.3	131.6	-101.4	149.2	0	0	0	109.1
1107	Y	24.2	Very low	24.1	Very low	194 Å²	194	155.7 Å²	155.7	76%	0.761	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-101.1	168.7	-179.2	-68.5	-103.5	0	0	0	111.8
1108	P	25.5	Very low	24.2	Very low	128 Å²	128	150.8 Å²	150.8	83%	0.831	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-97.7	119.1	139.3	33.2	-25.7	0	0	0	111.4
1109	L	22.4	Very low	24.4	Very low	144 Å²	144	148.2 Å²	148.2	75%	0.754	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-77.5	152.3	159.1	-95.2	69	0	0	0	109.5
1110	T	23.4	Very low	24.4	Very low	134 Å²	134	146.9 Å²	146.9	82%	0.822	74%	0.743	S	S	*	*				174.7	162.2	117.3	32.7	0	0	0	0	113.9
1111	T	22.7	Very low	24.5	Very low	75 Å²	75	142 Å²	142	46%	0.46	73%	0.73	S	S	.	*			trans	92.2	55.2	157.5	-33.2	0	0	0	0	119.3	R2001	T1111-R2001 VanDerWaalsContact CB-NH2 3.34Å; T1111-R2001 VanDerWaalsContact CG2-NH2 3.26Å; T1111-R2001 PolarHBondContact O-NH2 2.83Å
1112	I	25.8	Very low	24	Very low	134 Å²	134	142.1 Å²	142.1	69%	0.687	73%	0.734	S	S	*	*				59.6	98.1	108.1	-57.5	157.3	0	0	0	117.8
1113	K	25.6	Very low	24	Very low	194 Å²	194	141.4 Å²	141.4	84%	0.843	73%	0.73	S	S	*	*				-172.9	118.3	110.9	-97.6	165.6	-176.1	177.7	0	107.6
1114	N	25.6	Very low	23.8	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	74%	0.736	S	S	*	*				62.9	84	64.4	-71.6	-12.4	0	0	0	114.8
1115	R	26.3	Very low	23.8	Very low	229 Å²	229	138 Å²	138	86%	0.864	74%	0.736	S	S	*	*				-178	142.7	122.9	-96.2	172.3	-172.6	-156.1	3.9	109.4
1116	K	25.1	Very low	23.9	Very low	181 Å²	181	142.5 Å²	142.5	79%	0.787	75%	0.747	S	S	*	*			cis	-157.1	121.6	-26.4	-131	-176.6	-170.6	-172.8	0	108.5
1117	L	25.7	Very low	23.9	Very low	147 Å²	147	139.9 Å²	139.9	77%	0.77	74%	0.739	S	S	*	*				9.6	133.4	115.2	-101.3	68.9	0	0	0	114.7
1118	S	24	Very low	23.8	Very low	86 Å²	86	137.9 Å²	137.9	60%	0.601	74%	0.741	S	S	*	*				165.3	-172.6	57.8	41.8	0	0	0	0	107.4
1119	Q	25.5	Very low	23.9	Very low	175 Å²	175	136.6 Å²	136.6	82%	0.818	73%	0.732	S	S	*	*			cis	-131.5	173.7	15.7	-80.4	109.9	64.1	0	0	109.8
1120	S	22.7	Very low	24	Very low	90 Å²	90	137.9 Å²	137.9	63%	0.629	73%	0.734	S	S	*	*			cis	-149.2	178.7	20.2	72.4	0	0	0	0	110.1
1121	S	23.1	Very low	24.1	Very low	89 Å²	89	136.7 Å²	136.7	62%	0.622	73%	0.731	S	S	*	*			cis	-156.9	124.6	-5.4	16.1	0	0	0	0	106
1122	S	22.1	Very low	24.2	Very low	107 Å²	107	141.5 Å²	141.5	75%	0.748	75%	0.746	S	S	*	*				79.9	118.6	70.4	75.1	0	0	0	0	116.2
1123	N	21.1	Very low	24.2	Very low	144 Å²	144	140.3 Å²	140.3	77%	0.77	74%	0.74	S	S	*	*			trans	13.9	127.9	136.2	-65.3	-1.3	0	0	0	118
1124	I	21.7	Very low	24.2	Very low	150 Å²	150	138 Å²	138	77%	0.769	73%	0.732	S	S	*	*				57.8	108.4	87.1	-66.9	175.8	0	0	0	113.4
1125	S	21.5	Very low	24	Very low	94 Å²	94	137.1 Å²	137.1	66%	0.657	73%	0.732	S	S	*	*			trans	62.7	117.4	156.8	64.1	0	0	0	0	121.8
1126	Q	24.1	Very low	24.1	Very low	183 Å²	183	130.5 Å²	130.5	86%	0.855	72%	0.719	S	S	*	*			trans	98.5	129.9	137.8	-71.8	170.8	-7.8	0	0	121.7
1127	T	23	Very low	24	Very low	118 Å²	118	130 Å²	130	72%	0.724	72%	0.717	S	S	*	*			trans	73.7	101.6	154.2	49.5	0	0	0	0	123.4
1128	I	23	Very low	23.9	Very low	153 Å²	153	131.2 Å²	131.2	79%	0.785	72%	0.718	S	S	*	*				68.6	136.5	118.1	-67.1	168.4	0	0	0	119
1129	P	27.4	Very low	23.8	Very low	100 Å²	100	132.1 Å²	132.1	65%	0.649	72%	0.724	S	S	*	*			cis	-139.1	172.4	-14	38.6	-19	0	0	0	118
1130	Q	24.9	Very low	23.7	Very low	172 Å²	172	134.2 Å²	134.2	80%	0.804	73%	0.726	S	S	*	*			trans	59	103.9	141.8	-75.2	169.7	-17.8	0	0	123.7
1131	S	25.4	Very low	24.3	Very low	109 Å²	109	134.8 Å²	134.8	76%	0.762	73%	0.728	S	S	*	*				78.6	165.9	126.7	85.9	0	0	0	0	118.8
1132	F	24.8	Very low	24.3	Very low	176 Å²	176	136.3 Å²	136.3	77%	0.772	73%	0.729	S	S	*	*			cis	-142.6	136.7	13.8	-158.6	-105.1	0	0	0	111.8
1133	I	26.4	Very low	24.5	Very low	108 Å²	108	140.8 Å²	140.8	55%	0.554	73%	0.73	S	S	*	*			trans	49.4	108.8	155.2	-66.5	-161.3	0	0	0	118.8
1134	Q	24.1	Very low	24.6	Very low	147 Å²	147	140 Å²	140	69%	0.687	73%	0.726	S	S	*	*				79.8	120.1	63.7	-76.5	178.1	-27.6	0	0	115.4
1135	T	23.1	Very low	24.8	Very low	122 Å²	122	141.6 Å²	141.6	75%	0.748	73%	0.727	S	S	*	*			trans	71.8	176.5	134.3	67.9	0	0	0	0	118.2
1136	P	27.8	Very low	24.9	Very low	90 Å²	90	144.1 Å²	144.1	58%	0.584	73%	0.733	S	S	*	*				-141.3	175.5	-55.2	39.3	-24.5	0	0	0	115.2
1137	K	21.8	Very low	24.9	Very low	170 Å²	170	138.7 Å²	138.7	74%	0.739	73%	0.727	S	S	*	*			trans	47.3	156.7	139.7	-63.2	157.5	-172.8	175.9	0	121.3
1138	H	24.2	Very low	24.9	Very low	172 Å²	172	141.3 Å²	141.3	80%	0.796	74%	0.735	S	S	*	*			trans	71	146.2	166.3	-48.1	-74.5	0	0	0	114.6
1139	S	22.4	Very low	25	Very low	105 Å²	105	144 Å²	144	73%	0.734	74%	0.735	S	S	*	*			cis	-163.9	167.4	-17.5	45.7	0	0	0	0	111.4
1140	Y	23.8	Very low	24.8	Very low	219 Å²	219	145.8 Å²	145.8	86%	0.859	74%	0.735	S	S	*	*			trans	-39	168.5	153.8	-72.9	-82.4	0	0	0	115.5
1141	P	34.3	Very low	24.8	Very low	103 Å²	103	145.5 Å²	145.5	67%	0.669	73%	0.733	S	S	*	*			cis	-140.9	-168.7	-12.8	31.4	-7.3	0	0	0	115.8
1142	D	23.5	Very low	24.7	Very low	121 Å²	121	145 Å²	145	65%	0.647	73%	0.73	S	S	*	*			trans	72.7	121.5	137.2	-94.5	-24	0	0	0	124.3
1143	R	25.4	Very low	24.7	Very low	200 Å²	200	147 Å²	147	76%	0.755	73%	0.733	S	S	*	*				73.2	143.8	126	-75	168.4	-163.1	-135.8	-0.3	125.2
1144	N	24.6	Very low	24.6	Very low	129 Å²	129	147.5 Å²	147.5	69%	0.69	74%	0.736	S	S	*	*			trans	87	105.1	139.6	-76.1	-0.6	0	0	0	123
1145	F	24.4	Very low	24.8	Very low	182 Å²	182	147.5 Å²	147.5	80%	0.798	74%	0.736	S	S	*	*				65.8	148.8	121.7	-94.1	-89.2	0	0	0	123.4
1146	N	24.6	Very low	25	Very low	148 Å²	148	147.5 Å²	147.5	79%	0.791	73%	0.73	S	S	*	*			trans	77.6	87	159.3	-62	-31.7	0	0	0	120.6
1147	G	25.1	Very low	24.8	Very low	69 Å²	69	149.4 Å²	149.4	71%	0.711	73%	0.726	S	S	*	*				89.9	135.2	94.7	0	0	0	0	0	120.6
1148	L	22.8	Very low	25	Very low	173 Å²	173	145.3 Å²	145.3	91%	0.906	71%	0.708	S	S	*	*			trans	69.9	149.8	167.4	-56.9	161.8	0	0	0	114.2
1149	R	23.8	Very low	25.1	Very low	208 Å²	208	143.3 Å²	143.3	79%	0.785	70%	0.699	S	S	*	*			cis	-158.5	156.2	7.2	-135.3	-168.7	-178.2	178.5	-0.4	109.8
1150	H	24	Very low	25.1	Very low	139 Å²	139	147.3 Å²	147.3	64%	0.644	70%	0.698	S	S	*	*			trans	54.8	138.4	159.2	-86.5	-120.2	0	0	0	121.9
1151	E	23.8	Very low	25.1	Very low	165 Å²	165	145.1 Å²	145.1	77%	0.771	69%	0.689	S	S	*	*			trans	61	148.1	146	-72.6	159	-142.3	0	0	120.9
1152	S	24.3	Very low	24.5	Very low	100 Å²	100	142.2 Å²	142.2	70%	0.699	67%	0.67	S	S	*	*			cis	-155.3	159.4	-21.5	66.8	0	0	0	0	112.5
1153	R	24.2	Very low	24.4	Very low	217 Å²	217	146.1 Å²	146.1	82%	0.819	68%	0.681	S	S	*	*			trans	42.1	126.3	150.3	-81.4	-172.9	162.9	113.9	-4.1	122.5
1154	N	24.4	Very low	24.3	Very low	118 Å²	118	142.4 Å²	142.4	63%	0.631	67%	0.672	S	S	*	*				89.4	112	128	-67.5	7.9	0	0	0	122.3
1155	H	27.8	Very low	24.2	Very low	148 Å²	148	141 Å²	141	69%	0.685	67%	0.67	S	S	*	*				83.3	129.2	121.5	-78.8	-40.8	0	0	0	123.5
1156	I	27	Very low	24.1	Very low	121 Å²	121	138.6 Å²	138.6	62%	0.621	66%	0.657	S	S	*	*				77.2	136.7	128.6	-70.1	172.4	0	0	0	117.9
1157	R	25	Very low	24.1	Very low	131 Å²	131	136.2 Å²	136.2	49%	0.494	65%	0.652	S	S	.	*			cis	-169.1	162.8	-17.5	-115.7	176	177	145.6	-1.2	109.5
1158	K	26.1	Very low	24.1	Very low	84 Å²	84	137.7 Å²	137.7	37%	0.365	65%	0.647	S	S	.	*			trans	37.3	139.6	145	-62.3	-175.8	-179.7	-166.4	0	121.6	Y1161 A1383	K1158-Y1161 HydrophobicContact CD-CD2 4.31Å; K1158-A1383 VanDerWaalsContact CE-O 3.28Å; K1158-A1383 WeakPolarHBondContact CE-O 3.15Å; K1158-A1383 PolarHBondContact NZ-O 2.9Å
1159	Q	25	Very low	24.1	Very low	130 Å²	130	134 Å²	134	61%	0.607	64%	0.642	S	S	*	*	S	Bend		-168.2	149.6	117.6	-106.4	177.9	20.2	0	0	110.2	T1162	Q1159-T1162 HydrophobicContact CG-CG2 4.12Å
1160	R	23.4	Very low	24.2	Very low	189 Å²	189	127.3 Å²	127.3	71%	0.713	62%	0.621	S	S	*	*	S	Bend	cis	-78.2	-149.2	-14.6	-60.6	-160.5	168.8	-149	8.9	109.4	T1162	R1160-T1162 HydrophobicContact CB-CG2 4.05Å; R1160-T1162 WeakPolarHBondContact CD-OG1 3.34Å; R1160-T1162 HydrophobicContact CG-CG2 3.68Å; R1160-T1162 PolarHBondContact NH1-OG1 2.68Å
1161	Y	23.1	Very low	24.1	Very low	172 Å²	172	127.7 Å²	127.7	68%	0.675	63%	0.628	S	S	*	*				21.6	129.9	-65	-55.7	-92	0	0	0	117.1	K1158 A1383	K1158-Y1161 HydrophobicContact CD-CD2 4.31Å; Y1161-A1383 HydrophobicContact CD1-CB 4.44Å; Y1161-A1383 HydrophobicContact CD2-CB 4.38Å; Y1161-A1383 HydrophobicContact CE1-CB 3.89Å; Y1161-A1383 HydrophobicContact CE2-CB 3.81Å
1162	T	21.5	Very low	24.1	Very low	43 Å²	43	124.4 Å²	124.4	26%	0.264	62%	0.619	S	S	.	*			trans	-141.9	86	161.3	54.4	0	0	0	0	110.2	Q1159 R1160	Q1159-T1162 HydrophobicContact CG-CG2 4.12Å; R1160-T1162 HydrophobicContact CB-CG2 4.05Å; R1160-T1162 WeakPolarHBondContact CD-OG1 3.34Å; R1160-T1162 HydrophobicContact CG-CG2 3.68Å; R1160-T1162 PolarHBondContact NH1-OG1 2.68Å
1163	F	22.1	Very low	24	Very low	202 Å²	202	124.1 Å²	124.1	89%	0.886	62%	0.618	S	S	*	*				-56.6	132.6	129.9	-100	-101.3	0	0	0	106.6
1164	H	22.6	Very low	24	Very low	122 Å²	122	119.4 Å²	119.4	57%	0.565	61%	0.605	S	S	*	*			trans	-162.1	134.7	-177.6	-116.4	-32.7	0	0	0	109.8
1165	P	23.9	Very low	24	Very low	100 Å²	100	120.2 Å²	120.2	65%	0.649	61%	0.609	S	S	*	*				-135.1	160.1	-54.2	36.7	-25.2	0	0	0	112.5
1166	Y	22.3	Very low	23.8	Very low	131 Å²	131	117.4 Å²	117.4	51%	0.514	61%	0.611	S	S	.	*	S	Bend	trans	-78.1	148.8	152.5	-86.3	-58.6	0	0	0	111.5	D2376 S2377	Y1166-D2376 VanDerWaalsContact CE1-C 3.45Å; Y1166-D2376 WeakPolarHBondContact CE1-O 3.39Å; Y1166-D2376 VanDerWaalsContact OH-C 3.31Å; Y1166-D2376 PolarHBondContact OH-N 3.02Å; Y1166-S2377 PolarHBondContact OH-N 3.33Å; Y1166-S2377 PolarHBondContact OH-OG 2.9Å
1167	S	23.9	Very low	23.7	Very low	98 Å²	98	115.6 Å²	115.6	69%	0.685	62%	0.615	S	S	*	*	S	Bend	trans	79	110.6	174.6	72.2	0	0	0	0	119
1168	T	24.4	Very low	23.7	Very low	100 Å²	100	117.2 Å²	117.2	61%	0.613	63%	0.632	S	S	*	*			trans	46.2	128.2	131	56.4	0	0	0	0	121.9	L1170	T1168-L1170 HydrophobicContact CG2-CD1 4.09Å
1169	A	23.6	Very low	23.5	Very low	97 Å²	97	116.7 Å²	116.7	80%	0.802	64%	0.644	S	S	*	*			trans	-131.4	89.6	148.2	0	0	0	0	0	109.4
1170	L	25.7	Very low	23.5	Very low	66 Å²	66	121 Å²	121	35%	0.346	65%	0.654	S	S	.	*			trans	-77.4	124.8	167	-86.8	92.9	0	0	0	110.2	T1168 T1172 L2011 F2012	T1168-L1170 HydrophobicContact CG2-CD1 4.09Å; L1170-T1172 VanDerWaalsContact CD2-O 3.25Å; L1170-T1172 WeakPolarHBondContact CD2-O 3.32Å; L1170-L2011 HydrophobicContact CD1-CD2 3.87Å; L1170-L2011 HydrophobicContact CD2-CD2 4.29Å; L1170-L2011 HydrophobicContact CG-CD1 4.25Å; L1170-L2011 HydrophobicContact CG-CD2 4Å; L1170-F2012 HydrophobicContact CD1-CE2 4.31Å; L1170-F2012 HydrophobicContact CD1-CZ 3.97Å; L1170-F2012 HydrophobicContact CD2-CE2 3.67Å; L1170-F2012 HydrophobicContact CD2-CZ 4.08Å
1171	N	22.5	Very low	23.6	Very low	148 Å²	148	120.7 Å²	120.7	79%	0.791	66%	0.661	S	S	*	*	S	Bend		-86.2	129.4	112.4	-68.4	-33.7	0	0	0	105.3
1172	T	22.8	Very low	23.8	Very low	95 Å²	95	116.9 Å²	116.9	58%	0.583	67%	0.665	S	S	*	*	S	Bend	cis	-129.2	148.3	11.1	47.4	0	0	0	0	112.9	L1170	L1170-T1172 VanDerWaalsContact CD2-O 3.25Å; L1170-T1172 WeakPolarHBondContact CD2-O 3.32Å
1173	S	23.9	Very low	24	Very low	95 Å²	95	123.2 Å²	123.2	66%	0.664	69%	0.689	S	S	*	*			trans	2.3	138.8	149.7	64.2	0	0	0	0	118.6
1174	Q	23.2	Very low	24.3	Very low	118 Å²	118	119.9 Å²	119.9	55%	0.551	68%	0.679	S	S	*	*			cis	-148.5	161.3	40.8	-70.4	178	8.3	0	0	113.8	E2395	Q1174-E2395 PolarHBondContact NE2-O 2.69Å
1175	N	24.3	Very low	24.5	Very low	135 Å²	135	120.5 Å²	120.5	72%	0.722	69%	0.686	S	S	*	*			trans	14.8	150.2	133.8	-49.2	-22	0	0	0	119.9
1176	A	24.1	Very low	24.5	Very low	88 Å²	88	127 Å²	127	73%	0.727	70%	0.698	S	S	*	*			cis	179.1	-174.1	-13.2	0	0	0	0	0	107
1177	A	24.3	Very low	24.7	Very low	84 Å²	84	123.8 Å²	123.8	69%	0.694	70%	0.695	S	S	*	*			trans	72	131.1	157.6	0	0	0	0	0	118.7
1178	L	24.3	Very low	24.8	Very low	164 Å²	164	122.6 Å²	122.6	86%	0.859	68%	0.681	S	S	*	*				20.9	139.9	115.1	-74.7	77.3	0	0	0	118.7
1179	A	23.5	Very low	24.9	Very low	73 Å²	73	126 Å²	126	60%	0.603	69%	0.694	S	S	*	*			cis	-174.6	172.7	-6.7	0	0	0	0	0	112.4
1180	R	24.9	Very low	24.9	Very low	221 Å²	221	123.6 Å²	123.6	83%	0.834	67%	0.674	S	S	*	*			trans	68.8	122.4	143.3	-79.6	166.1	-169.8	176.3	3.1	120
1181	H	25.1	Very low	24.9	Very low	183 Å²	183	121.8 Å²	121.8	85%	0.847	67%	0.669	S	S	*	*			trans	67.1	153	157.6	-64.7	-128.8	0	0	0	114.1
1182	A	27.3	Very low	25	Very low	92 Å²	92	118 Å²	118	76%	0.76	65%	0.648	S	S	*	*			cis	-146.8	167.6	2.8	0	0	0	0	0	107
1183	F	25.7	Very low	25	Very low	176 Å²	176	117.4 Å²	117.4	77%	0.772	64%	0.641	S	S	*	*			cis	147.7	136.6	2.5	170	-115.7	0	0	0	104.8
1184	L	27.1	Very low	25	Very low	131 Å²	131	115.9 Å²	115.9	69%	0.686	63%	0.629	S	S	*	*			trans	76	149.3	-175.6	-50.1	171.5	0	0	0	114.6
1185	L	27.3	Very low	25	Very low	136 Å²	136	112.7 Å²	112.7	71%	0.712	62%	0.619	S	S	*	*			cis	-155.7	124.1	-15.4	-97.8	155.8	0	0	0	104.1
1186	R	25.2	Very low	25	Very low	235 Å²	235	110.3 Å²	110.3	89%	0.887	61%	0.606	S	S	*	*				91.2	81	55.2	-164.3	-164.5	-178.6	179.5	0.1	114.7
1187	S	26.1	Very low	25.2	Very low	64 Å²	64	107.9 Å²	107.9	45%	0.448	58%	0.58	S	S	.	*			trans	-153.8	176.9	154.6	50.6	0	0	0	0	109.5	L1189	S1187-L1189 PolarHBondContact O-N 2.99Å
1188	N	26.4	Very low	25.4	Very low	73 Å²	73	105.5 Å²	105.5	39%	0.39	55%	0.553	S	S	.	*	S	Bend	trans	54.9	-6.6	168.7	-58.6	14.4	0	0	0	119.9	A1190	N1188-A1190 PolarHBondContact O-N 2.79Å
1189	L	24.8	Very low	25.4	Very low	173 Å²	173	98.3 Å²	98.3	91%	0.906	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	53.2	-169.8	-131.1	172.5	0	0	0	114.8	S1187	S1187-L1189 PolarHBondContact O-N 2.99Å
1190	A	24.4	Very low	25.5	Very low	45 Å²	45	98.2 Å²	98.2	37%	0.372	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.1	-5.4	177.3	0	0	0	0	0	115.3	N1188 R1465 I1468	N1188-A1190 PolarHBondContact O-N 2.79Å; A1190-R1465 WeakPolarHBondContact O-CD 3.29Å; A1190-R1465 WeakPolarHBondContact O-CG 3.11Å; A1190-R1465 PolarHBondContact O-NE 2.75Å; A1190-R1465 PolarHBondContact O-NH1 3.32Å; A1190-I1468 HydrophobicContact CB-CD1 3.57Å
1191	A	25	Very low	25.6	Very low	29 Å²	29	90.1 Å²	90.1	24%	0.24	49%	0.488	C	S	.	.	S	Bend	trans	-91	-11.9	-158.4	0	0	0	0	0	117.1	R1465 P2369	A1191-R1465 HydrophobicContact CB-CG 4.45Å; A1191-R1465 PolarHBondContact O-NE 2.72Å; A1191-R1465 PolarHBondContact O-NH2 3.2Å; A1191-P2369 WeakPolarHBondContact O-CB 3.49Å
1192	L	24.4	Very low	25.5	Very low	67 Å²	67	82.9 Å²	82.9	35%	0.351	46%	0.459	S	S	.	.	S	Bend	trans	-130.9	7.8	-156.2	-80.3	152.5	0	0	0	118	D2370 D2372	L1192-D2370 VanDerWaalsContact O-OD1 3.11Å; L1192-D2372 HydrophobicContact CB-CB 4.09Å; L1192-D2372 WeakPolarHBondContact CB-OD2 3.34Å; L1192-D2372 HydrophobicContact CD2-CB 4.21Å
1193	I	24.1	Very low	25.3	Very low	84 Å²	84	79.3 Å²	79.3	43%	0.431	43%	0.43	S	S	.	.			trans	-138.4	127.3	173.1	-34.2	-179.7	0	0	0	111.8	S1394 R1465 D2370	I1193-S1394 VanDerWaalsContact CG2-CB 3.45Å; I1193-S1394 VanDerWaalsContact CG2-O 3.26Å; I1193-S1394 WeakPolarHBondContact CG2-O 3.25Å; I1193-R1465 PolarHBondContact O-NH1 3.02Å; I1193-D2370 VanDerWaalsContact CA-CG 3.47Å; I1193-D2370 WeakPolarHBondContact CA-OD1 3.5Å; I1193-D2370 VanDerWaalsContact CA-OD2 3.27Å; I1193-D2370 WeakPolarHBondContact CA-OD2 3.5Å; I1193-D2370 PolarHBondContact N-OD1 3.14Å; I1193-D2370 VanDerWaalsContact N-OD1 3.07Å
1194	P	24.3	Very low	25.2	Very low	63 Å²	63	74 Å²	74	41%	0.409	42%	0.415	S	S	.	.				-129.9	49.9	107.6	42.4	-35.2	0	0	0	115.4	S1394 F1396 D2370	P1194-S1394 WeakPolarHBondContact CA-O 3.24Å; P1194-F1396 HydrophobicContact CB-CB 4.13Å; P1194-D2370 VanDerWaalsContact C-OD2 3.28Å; P1194-D2370 WeakPolarHBondContact CD-OD1 3.47Å; P1194-D2370 VanDerWaalsContact CD-OD2 3.31Å; P1194-D2370 WeakPolarHBondContact CD-OD2 3.11Å; P1194-D2370 VanDerWaalsContact N-CG 3.28Å
1195	S	23.5	Very low	25	Very low	51 Å²	51	72.7 Å²	72.7	36%	0.357	41%	0.408	S	S	.	.			trans	-53	144.7	178.3	62.2	0	0	0	0	113.7	S1394 A1395 D2370	S1195-S1394 WeakPolarHBondContact O-CB 3.31Å; S1195-S1394 PolarHBondContact O-OG 3.34Å; S1195-S1394 VanDerWaalsContact OG-CB 3.23Å; S1195-S1394 WeakPolarHBondContact OG-CB 3.47Å; S1195-A1395 PolarHBondContact O-N 2.92Å; S1195-D2370 WeakPolarHBondContact CA-OD2 3.35Å; S1195-D2370 PolarHBondContact N-OD2 2.91Å
1196	N	24.2	Very low	24.7	Very low	84 Å²	84	72.6 Å²	72.6	45%	0.449	41%	0.409	S	S	.	.			trans	61.8	125.8	-179.6	-35.3	-96.6	0	0	0	116.6	V1391 S1394	N1196-V1391 HydrophobicContact CB-CB 4.36Å; N1196-V1391 HydrophobicContact CB-CG1 3.65Å; N1196-S1394 PolarHBondContact ND2-OG 3.23Å; N1196-S1394 VanDerWaalsContact ND2-OG 3.12Å
1197	H	26.8	Very low	24.7	Very low	38 Å²	38	66.4 Å²	66.4	18%	0.176	39%	0.388	C	S	.	.				-175.5	164.5	124.2	-108.2	-131.8	0	0	0	118	A1199 N1380 V1391 H1392	H1197-A1199 PolarHBondContact O-N 2.67Å; H1197-N1380 PolarHBondContact CE1-ND2 3.18Å; H1197-N1380 PolarHBondContact CE1-OD1 2.83Å; H1197-N1380 PolarHBondContact NE2-ND2 2.96Å; H1197-V1391 PolarHBondContact CD2-O 3.08Å; H1197-V1391 PolarHBondContact NE2-O 2.75Å; H1197-V1391 VanDerWaalsContact NE2-O 3.15Å; H1197-H1392 AromaticContact CE1-CG 3.81Å; H1197-H1392 AromaticContact CE1-ND1 3.24Å; H1197-H1392 PolarHBondContact CE1-ND1 3.41Å; H1197-H1392 AromaticContact ND1-ND1 3.81Å; H1197-H1392 WeakPolarHBondContact NE2-CA 3.41Å; H1197-H1392 PolarHBondContact NE2-N 2.89Å
1198	Y	28.2	Very low	24.6	Very low	33 Å²	33	65.2 Å²	65.2	13%	0.129	38%	0.375	C	S	.	.	S	Bend	trans	51.6	-25.9	163.5	-69.5	-50.7	0	0	0	125.2	E1376 N1380 H1392 E1587	Y1198-E1376 HydrophobicContact CE1-CG 4.15Å; Y1198-E1376 HydrophobicContact CE2-CB 4.32Å; Y1198-E1376 VanDerWaalsContact CE2-CD 3.45Å; Y1198-E1376 HydrophobicContact CE2-CG 3.71Å; Y1198-E1376 VanDerWaalsContact CZ-CG 3.42Å; Y1198-E1376 VanDerWaalsContact OH-CA 3.3Å; Y1198-E1376 WeakPolarHBondContact OH-CA 3.49Å; Y1198-E1376 WeakPolarHBondContact OH-CB 3.24Å; Y1198-E1376 VanDerWaalsContact OH-CG 3.29Å; Y1198-E1376 WeakPolarHBondContact OH-CG 3.41Å; Y1198-E1376 PolarHBondContact OH-O 3.18Å; Y1198-N1380 VanDerWaalsContact CE1-OD1 3.22Å; Y1198-N1380 WeakPolarHBondContact CE1-OD1 3.4Å; Y1198-N1380 PolarHBondContact OH-OD1 3.02Å; Y1198-H1392 PolarHBondContact OH-ND1 2.7Å; Y1198-E1587 HydrophobicContact CD2-CG 3.89Å; Y1198-E1587 HydrophobicContact CG-CG 4.23Å
1199	A	25.5	Very low	24.5	Very low	13 Å²	13	61.9 Å²	61.9	11%	0.107	36%	0.358	C	S	.	.	S	Bend	trans	-82.7	-17.6	-161.8	0	0	0	0	0	119.2	H1197 Y1582 I1586	H1197-A1199 PolarHBondContact O-N 2.67Å; A1199-Y1582 HydrophobicContact CB-CE1 4.46Å; A1199-I1586 HydrophobicContact CB-CG2 4.34Å
1200	S	25.7	Very low	24.4	Very low	72 Å²	72	55.5 Å²	55.5	50%	0.503	32%	0.322	S	S	.	.	S	Bend	trans	-136.4	-28	-169.3	62.5	0	0	0	0	117.4
1201	V	26.4	Very low	24.3	Very low	51 Å²	51	57.3 Å²	57.3	31%	0.309	32%	0.319	S	S	.	.			trans	-138.5	107.8	-178.4	-162.1	0	0	0	0	110.1	A1203 P1381	V1201-A1203 HydrophobicContact CG1-CB 3.97Å; V1201-P1381 HydrophobicContact CB-CB 3.8Å; V1201-P1381 HydrophobicContact CB-CG 4.2Å; V1201-P1381 HydrophobicContact CG1-CB 3.71Å; V1201-P1381 VanDerWaalsContact O-CB 3.24Å; V1201-P1381 WeakPolarHBondContact O-CB 3.4Å; V1201-P1381 WeakPolarHBondContact O-CD 3.48Å; V1201-P1381 WeakPolarHBondContact O-CG 3.46Å
1202	A	23.7	Very low	24.2	Very low	30 Å²	30	62.2 Å²	62.2	25%	0.248	33%	0.331	C	S	.	.			trans	-118.4	32	165.8	0	0	0	0	0	110.3	L1379 L1688	A1202-L1379 CarbonylContact C-O 3.55Å; A1202-L1379 VanDerWaalsContact C-O 3.32Å; A1202-L1379 WeakPolarHBondContact CA-O 3.21Å; A1202-L1688 WeakPolarHBondContact O-CD2 3.46Å
1203	A	23.6	Very low	24.2	Very low	17 Å²	17	65.5 Å²	65.5	14%	0.14	34%	0.34	C	S	.	.			trans	-126.7	18.5	-134.4	0	0	0	0	0	117.8	V1201 L1688	V1201-A1203 HydrophobicContact CG1-CB 3.97Å; A1203-L1688 VanDerWaalsContact CA-CB 3.49Å; A1203-L1688 HydrophobicContact CB-CB 3.86Å; A1203-L1688 WeakPolarHBondContact CB-O 3.21Å
1204	S	22.4	Very low	24.2	Very low	66 Å²	66	69.1 Å²	69.1	46%	0.462	36%	0.355	S	S	.	.			trans	-150.9	104.3	175.5	-173.5	0	0	0	0	112.9
1205	N	22.5	Very low	24.2	Very low	102 Å²	102	77.6 Å²	77.6	55%	0.545	38%	0.379	S	S	.	.	S	Bend		166.2	112	125.3	-89.3	-67.8	0	0	0	111
1206	D	22.1	Very low	24.2	Very low	135 Å²	135	84.7 Å²	84.7	72%	0.722	40%	0.398	S	S	*	.			trans	61.8	141	156.7	-103.8	-41.5	0	0	0	121.2
1207	F	24.1	Very low	24.2	Very low	104 Å²	104	91.7 Å²	91.7	46%	0.456	42%	0.418	S	S	.	.			trans	62	100.9	170.5	-65.3	-157.8	0	0	0	114.2	N1610 I1614 R1618	F1207-N1610 PolarHBondContact O-ND2 3.21Å; F1207-N1610 PolarHBondContact O-OD1 2.89Å; F1207-I1614 HydrophobicContact CD1-CD1 3.82Å; F1207-I1614 HydrophobicContact CE1-CD1 4.29Å; F1207-I1614 HydrophobicContact CG-CD1 4.1Å; F1207-R1618 VanDerWaalsContact CE1-NH2 3.27Å
1208	Q	24.4	Very low	24.1	Very low	39 Å²	39	96.4 Å²	96.4	18%	0.182	44%	0.444	C	S	.	.			cis	66.4	105.6	48.5	-155	-175.7	118	0	0	110.8	N1610 R1613 I1614 K1617	Q1208-N1610 PolarHBondContact N-OD1 3.49Å; Q1208-N1610 PolarHBondContact O-OD1 3.17Å; Q1208-R1613 HydrophobicContact CG-CB 4.46Å; Q1208-I1614 HydrophobicContact CB-CD1 4.49Å; Q1208-I1614 HydrophobicContact CB-CG1 3.95Å; Q1208-I1614 HydrophobicContact CG-CG1 3.75Å; Q1208-I1614 WeakPolarHBondContact O-CD1 3.36Å; Q1208-K1617 HydrophobicContact CG-CB 4.24Å; Q1208-K1617 HydrophobicContact CG-CD 4.24Å; Q1208-K1617 HydrophobicContact CG-CG 4.47Å
1209	Q	24.1	Very low	23.9	Very low	4 Å²	4	105.3 Å²	105.3	2%	0.019	48%	0.478	C	S	.	.	B	Isolated β-bridge		157.7	90.5	118	79.5	155.9	152.2	0	0	127.3	R1609 N1610 I1611 Y1612 R1613 I1614 R1615	Q1209-R1609 CarbonylContact C-O 3.55Å; Q1209-R1609 WeakPolarHBondContact CA-O 3.3Å; Q1209-R1609 PolarHBondContact N-O 3.14Å; Q1209-R1609 CarbonylContact O-C 3.51Å; Q1209-R1609 VanDerWaalsContact O-CA 3.27Å; Q1209-R1609 WeakPolarHBondContact O-CA 3.23Å; Q1209-R1609 VanDerWaalsContact O-O 3.13Å; Q1209-N1610 VanDerWaalsContact CG-CA 3.43Å; Q1209-N1610 WeakPolarHBondContact CG-O 3.27Å; Q1209-N1610 PolarHBondContact N-OD1 3.39Å; Q1209-N1610 CarbonylContact O-C 3.57Å; Q1209-N1610 WeakPolarHBondContact O-CA 3.4Å; Q1209-N1610 PolarHBondContact O-N 3.03Å; Q1209-N1610 PolarHBondContact OE1-O 2.73Å; Q1209-I1611 VanDerWaalsContact CD-CA 3.42Å; Q1209-I1611 PolarHBondContact NE2-O 3.48Å; Q1209-I1611 CarbonylContact O-C 3.48Å; Q1209-I1611 PolarHBondContact O-N 2.82Å; Q1209-Y1612 PolarHBondContact NE2-O 3.16Å; Q1209-Y1612 PolarHBondContact O-N 3.42Å; Q1209-R1613 VanDerWaalsContact CA-CB 3.48Å; Q1209-R1613 VanDerWaalsContact CB-C 3.49Å; Q1209-R1613 VanDerWaalsContact CB-CA 3.5Å; Q1209-R1613 HydrophobicContact CB-CB 3.75Å; Q1209-I1614 HydrophobicContact CB-CB 4.08Å; Q1209-I1614 HydrophobicContact CB-CD1 4.34Å; Q1209-I1614 HydrophobicContact CB-CG1 3.87Å; Q1209-I1614 HydrophobicContact CG-CB 3.95Å; Q1209-I1614 HydrophobicContact CG-CD1 3.73Å; Q1209-I1614 HydrophobicContact CG-CG1 3.75Å; Q1209-I1614 VanDerWaalsContact NE2-CB 3.3Å; Q1209-I1614 VanDerWaalsContact OE1-CD1 3.28Å; Q1209-R1615 VanDerWaalsContact NE2-NE 3.2Å
1210	R	23.1	Very low	23.8	Very low	39 Å²	39	110.2 Å²	110.2	15%	0.147	51%	0.506	C	S	.	.			trans	65.7	129.8	157.4	170.2	-85.6	-161.3	-173	-1.4	124.9	R1212 Y1213 E1214 I1608 R1609 Y1612	R1210-R1212 WeakPolarHBondContact CG-O 3.47Å; R1210-Y1213 VanDerWaalsContact NE-CB 3.34Å; R1210-Y1213 VanDerWaalsContact NH2-C 3.29Å; R1210-Y1213 PolarHBondContact NH2-O 2.68Å; R1210-E1214 IonicContact CZ-OE2 3.8Å; R1210-E1214 IonicContact NH1-OE2 2.75Å; R1210-E1214 IonicContact NH2-OE2 2.67Å; R1210-E1214 PolarHBondContact NH2-OE2 3.15Å; R1210-I1608 CarbonylContact O-C 3.56Å; R1210-R1609 PolarHBondContact N-O 3.43Å; R1210-R1609 WeakPolarHBondContact O-CA 3.38Å; R1210-R1609 PolarHBondContact O-N 3.14Å; R1210-Y1612 VanDerWaalsContact CD-CB 3.49Å; R1210-Y1612 HydrophobicContact CG-CD1 4.31Å; R1210-Y1612 HydrophobicContact CG-CG 4.39Å
1211	R	22.8	Very low	23.8	Very low	83 Å²	83	114 Å²	114	31%	0.313	51%	0.51	S	S	.	.	S	Bend	trans	-128.8	8.2	146.9	-101.8	-91.9	-168	135.5	8.4	116.2	I1604 Y1605 I1608 R1609	R1211-I1604 PolarHBondContact NH2-O 3.32Å; R1211-Y1605 HydrophobicContact CB-CD1 4.4Å; R1211-Y1605 HydrophobicContact CB-CD2 3.94Å; R1211-Y1605 HydrophobicContact CB-CE1 3.9Å; R1211-Y1605 HydrophobicContact CB-CE2 3.34Å; R1211-Y1605 HydrophobicContact CB-CG 4.41Å; R1211-Y1605 VanDerWaalsContact CD-CD2 3.49Å; R1211-Y1605 HydrophobicContact CG-CD1 4.24Å; R1211-Y1605 HydrophobicContact CG-CD2 3.54Å; R1211-Y1605 HydrophobicContact CG-CE1 4.25Å; R1211-Y1605 HydrophobicContact CG-CE2 3.52Å; R1211-Y1605 HydrophobicContact CG-CG 3.89Å; R1211-Y1605 VanDerWaalsContact CG-O 3.31Å; R1211-Y1605 WeakPolarHBondContact CG-O 3.4Å; R1211-I1608 HydrophobicContact CG-CB 4.27Å; R1211-I1608 HydrophobicContact CG-CG2 4.03Å; R1211-R1609 HydrophobicContact CB-CB 4.35Å; R1211-R1609 HydrophobicContact CG-CB 4.39Å
1212	R	22.9	Very low	23.7	Very low	132 Å²	132	116 Å²	116	50%	0.498	53%	0.526	S	S	.	.			trans	-89.4	93.8	162.3	-67.6	-174	-179.9	-171.9	2.5	111.5	D866 E869 R1210	D866-R1212 IonicContact OD1-CZ 2.7Å; D866-R1212 IonicContact OD1-NH2 3.52Å; D866-R1212 PolarHBondContact OD1-NH2 2.88Å; E869-R1212 IonicContact OE1-CZ 3.08Å; E869-R1212 IonicContact OE1-NH1 2.71Å; E869-R1212 PolarHBondContact OE1-NH1 2.92Å; E869-R1212 IonicContact OE2-CZ 3.77Å; E869-R1212 IonicContact OE2-NH1 3.68Å; E869-R1212 PolarHBondContact OE2-NH1 2.85Å; E869-R1212 IonicContact OE2-NH2 2.73Å; E869-R1212 PolarHBondContact OE2-NH2 2.68Å; R1210-R1212 WeakPolarHBondContact CG-O 3.47Å
1213	Y	24	Very low	23.9	Very low	135 Å²	135	121.7 Å²	121.7	53%	0.529	55%	0.553	S	S	.	*			trans	-169	45	151.6	-144.6	-92	0	0	0	113.6	R1210	R1210-Y1213 VanDerWaalsContact NE-CB 3.34Å; R1210-Y1213 VanDerWaalsContact NH2-C 3.29Å; R1210-Y1213 PolarHBondContact NH2-O 2.68Å
1214	E	24.2	Very low	24.5	Very low	161 Å²	161	125.3 Å²	125.3	75%	0.752	58%	0.575	S	S	*	*	S	Bend	trans	-159.3	58.6	176.9	-124.3	121.9	-150.5	0	0	115	R1210	R1210-E1214 IonicContact CZ-OE2 3.8Å; R1210-E1214 IonicContact NH1-OE2 2.75Å; R1210-E1214 IonicContact NH2-OE2 2.67Å; R1210-E1214 PolarHBondContact NH2-OE2 3.15Å
1215	R	24.5	Very low	24.7	Very low	241 Å²	241	126.8 Å²	126.8	91%	0.909	58%	0.577	S	S	*	*			trans	-155.7	39	152.5	-114.4	171	-162.6	174.3	5.5	113.4
1216	R	23.2	Very low	25	Very low	199 Å²	199	126.9 Å²	126.9	75%	0.751	58%	0.575	S	S	*	*			trans	-82.1	148.3	164.6	-80.4	-176.9	166.3	-174	-7.5	110.2
1217	R	24.3	Very low	25.4	Very low	231 Å²	231	126.6 Å²	126.6	87%	0.872	57%	0.573	S	S	*	*			trans	92.9	141	165.8	-53.9	175.4	-176.8	151.9	0.9	117.9
1218	N	23.6	Very low	25.8	Very low	138 Å²	138	128.8 Å²	128.8	74%	0.738	59%	0.59	S	S	*	*			trans	71.8	123.8	166	-51.4	-20.2	0	0	0	115.2
1219	R	24.9	Very low	26	Very low	220 Å²	220	133 Å²	133	83%	0.83	62%	0.618	S	S	*	*			cis	-143	142.1	-1.9	-92.3	161.1	-86.2	-153.9	-4.7	106.4
1220	V	23.6	Very low	26.2	Very low	115 Å²	115	139.6 Å²	139.6	70%	0.697	65%	0.653	S	S	*	*				67.8	126.3	62	-171.6	0	0	0	0	113
1221	Y	25.7	Very low	26.6	Very low	152 Å²	152	146.7 Å²	146.7	60%	0.596	69%	0.686	S	S	*	*			trans	76	146.3	-176.8	-63.6	-72	0	0	0	117.6	S883	S883-Y1221 PolarHBondContact N-OH 3.23Å; S883-Y1221 WeakPolarHBondContact O-CE1 3.41Å; S883-Y1221 PolarHBondContact O-OH 3.16Å
1222	S	23.8	Very low	26.9	Very low	92 Å²	92	148.9 Å²	148.9	64%	0.643	70%	0.702	S	S	*	*			cis	-177.2	143.1	-37.3	47.4	0	0	0	0	112.3
1223	N	27.8	Very low	27.2	Very low	151 Å²	151	149.3 Å²	149.3	81%	0.807	72%	0.719	S	S	*	*			trans	12.6	157.6	142.6	-92.6	51.9	0	0	0	122.3
1224	P	35.5	Very low	27.3	Very low	93 Å²	93	149.6 Å²	149.6	60%	0.604	73%	0.726	S	S	*	*			cis	-139.3	-167.1	-38.1	29	-3.9	0	0	0	111.6
1225	D	27.5	Very low	27.5	Very low	96 Å²	96	150.1 Å²	150.1	51%	0.513	73%	0.725	S	S	.	*				162.5	168.2	123.8	-84.1	-4.5	0	0	0	113.1	S889	S889-D1225 PolarHBondContact N-OD2 3Å
1226	E	29.4	Very low	27.8	Very low	105 Å²	105	144 Å²	144	49%	0.491	71%	0.71	S	S	.	*			trans	-67.7	166	-172	-67.7	143.4	128.9	0	0	112.9	S891 T892	S891-E1226 WeakPolarHBondContact CA-OE1 3.46Å; S891-E1226 WeakPolarHBondContact CA-OE2 3.31Å; S891-E1226 VanDerWaalsContact N-CD 3.31Å; S891-E1226 PolarHBondContact N-OE1 3.07Å; S891-E1226 PolarHBondContact N-OE2 3.15Å; T892-E1226 PolarHBondContact N-OE1 2.7Å; T892-E1226 VanDerWaalsContact N-OE1 3.1Å
1227	D	30.2	Very low	28.1	Very low	128 Å²	128	141.1 Å²	141.1	68%	0.684	71%	0.708	S	S	*	*				-170.6	-166.8	58.1	-131.8	-36.3	0	0	0	114.9
1228	D	32.8	Very low	28.3	Very low	150 Å²	150	136.1 Å²	136.1	80%	0.802	70%	0.698	S	S	*	*			trans	77.2	71.4	168.2	-90.4	-19.2	0	0	0	119.2
1229	T	29	Very low	28.6	Very low	127 Å²	127	135 Å²	135	78%	0.779	69%	0.693	S	S	*	*			trans	-80.1	136.1	154.1	55.2	0	0	0	0	112.3
1230	N	28.2	Very low	28.7	Very low	143 Å²	143	132.1 Å²	132.1	77%	0.765	69%	0.686	S	S	*	*			trans	-158.9	142.6	152.8	-105.9	-51.9	0	0	0	113.1
1231	K	31.1	Very low	28.9	Very low	189 Å²	189	135.2 Å²	135.2	82%	0.822	69%	0.69	S	S	*	*	S	Bend	trans	75.3	83.7	-162.7	-57.1	-180	178.3	-179.6	0	113.2
1232	I	29.1	Very low	28.8	Very low	128 Å²	128	134.5 Å²	134.5	66%	0.656	70%	0.696	S	S	*	*				54.8	105.3	66.8	-46.7	164.2	0	0	0	109.4	Q1234	I1232-Q1234 HydrophobicContact CG2-CB 4Å
1233	T	28.4	Very low	28.8	Very low	141 Å²	141	134 Å²	134	87%	0.865	69%	0.693	S	S	*	*			cis	63.5	52	13.8	22.1	0	0	0	0	116.3
1234	Q	27.1	Very low	28.7	Very low	141 Å²	141	130.7 Å²	130.7	66%	0.659	68%	0.677	S	S	*	*			trans	-166.4	105.4	153.5	-123.4	-174.7	85.9	0	0	115	I1232 I1236	I1232-Q1234 HydrophobicContact CG2-CB 4Å; Q1234-I1236 HydrophobicContact CG-CD1 4.17Å
1235	K	28.6	Very low	28.2	Very low	172 Å²	172	130.9 Å²	130.9	75%	0.748	68%	0.677	S	S	*	*				170.8	109.8	114.1	-92.2	166.1	178.4	172.8	0	109.4
1236	I	30.5	Very low	28	Very low	114 Å²	114	133 Å²	133	59%	0.585	69%	0.689	S	S	*	*				78.9	91.6	72	-68.6	165.3	0	0	0	111.1	Q1234	Q1234-I1236 HydrophobicContact CG-CD1 4.17Å
1237	I	29.6	Very low	27.7	Very low	138 Å²	138	133.2 Å²	133.2	71%	0.708	70%	0.7	S	S	*	*				38.4	111	112.2	-51	154.5	0	0	0	114.2
1238	N	28.3	Very low	27.4	Very low	126 Å²	126	133.9 Å²	133.9	67%	0.674	70%	0.704	S	S	*	*				178.5	145.3	118.2	-104.3	-67.6	0	0	0	113.3
1239	N	30	Very low	27.1	Very low	115 Å²	115	132.8 Å²	132.8	62%	0.615	70%	0.702	S	S	*	*			trans	68.1	145.9	151.7	-62.3	-34.7	0	0	0	118.8
1240	K	27.2	Very low	26.8	Very low	159 Å²	159	132.5 Å²	132.5	69%	0.691	70%	0.7	S	S	*	*			cis	-174.1	140.6	-23.7	-119.6	-179.6	-171.7	97.8	0	107.1
1241	K	26.6	Very low	26.6	Very low	180 Å²	180	135.5 Å²	135.5	78%	0.783	70%	0.702	S	S	*	*			trans	63	155.1	150.9	-71.8	-172.1	172.6	-169.3	0	117.4
1242	L	24	Very low	26.2	Very low	136 Å²	136	131.2 Å²	131.2	71%	0.712	69%	0.691	S	S	*	*			cis	-178.5	160.1	-18	-179.1	66.2	0	0	0	106.4
1243	S	24.1	Very low	26	Very low	83 Å²	83	127.4 Å²	127.4	58%	0.58	68%	0.677	S	S	*	*			trans	71.4	129.1	150.4	42.2	0	0	0	0	121.1
1244	T	25.9	Very low	25.8	Very low	80 Å²	80	122.8 Å²	122.8	49%	0.491	65%	0.65	S	S	.	*			trans	74.7	135.2	134.2	55.8	0	0	0	0	119.7
1245	T	23.9	Very low	25.7	Very low	98 Å²	98	121.6 Å²	121.6	60%	0.601	65%	0.647	S	S	*	*			cis	-165.9	154.3	-10.3	7.3	0	0	0	0	113.2
1246	N	24.1	Very low	25.4	Very low	141 Å²	141	118.1 Å²	118.1	75%	0.754	64%	0.642	S	S	*	*			trans	72	154.2	147	-64.6	-4	0	0	0	122.1
1247	C	23.8	Very low	25.1	Very low	109 Å²	109	118.5 Å²	118.5	74%	0.736	65%	0.649	S	S	*	*			trans	65.9	136	167.6	-65.7	0	0	0	0	117.8
1248	D	23.6	Very low	24.9	Very low	141 Å²	141	118.6 Å²	118.6	75%	0.754	65%	0.65	S	S	*	*			cis	-149.5	152.6	-24.4	-83.4	-49.1	0	0	0	105.2
1249	V	25.8	Very low	24.8	Very low	127 Å²	127	117.4 Å²	117.4	77%	0.77	65%	0.647	S	S	*	*				-167	133.9	64.8	160.6	0	0	0	0	110.1
1250	V	23	Very low	24.6	Very low	121 Å²	121	115.4 Å²	115.4	73%	0.733	64%	0.64	S	S	*	*			trans	33.9	104.9	150.2	-175.5	0	0	0	0	118.9
1251	Y	23.2	Very low	24.6	Very low	207 Å²	207	114.2 Å²	114.2	81%	0.812	64%	0.639	S	S	*	*				78.2	124.6	72.3	-83.3	-120.4	0	0	0	115.5
1252	V	24.1	Very low	24.5	Very low	98 Å²	98	112.3 Å²	112.3	59%	0.594	64%	0.638	S	S	*	*				79.9	118.5	62	162.1	0	0	0	0	112.2
1253	S	24.4	Very low	24.9	Very low	49 Å²	49	110.5 Å²	110.5	34%	0.343	63%	0.634	S	S	.	*			cis	96	168.7	28.9	80.7	0	0	0	0	116	E991 N992	E991-S1253 WeakPolarHBondContact O-CB 3.33Å; E991-S1253 PolarHBondContact O-OG 2.89Å; N992-S1253 VanDerWaalsContact CA-OG 3.25Å; N992-S1253 WeakPolarHBondContact CA-OG 3.07Å
1254	S	24.5	Very low	24.9	Very low	43 Å²	43	111.5 Å²	111.5	30%	0.301	64%	0.641	S	S	.	*			trans	72.9	165.9	-176.8	65.5	0	0	0	0	117.2	N992 T993 D994	N992-S1254 WeakPolarHBondContact OD1-CA 3.49Å; N992-S1254 PolarHBondContact OD1-N 3.14Å; T993-S1254 VanDerWaalsContact CA-CB 3.45Å; T993-S1254 WeakPolarHBondContact CA-OG 3.44Å; D994-S1254 PolarHBondContact N-OG 2.85Å
1255	I	24.5	Very low	24.8	Very low	116 Å²	116	114.1 Å²	114.1	60%	0.595	65%	0.651	S	S	*	*			cis	-149.8	142.7	36.6	-66.3	173.6	0	0	0	113.4	D994	D994-I1255 WeakPolarHBondContact OD1-CG2 3.43Å
1256	P	23.3	Very low	24.7	Very low	100 Å²	100	117.8 Å²	117.8	65%	0.649	66%	0.659	S	S	*	*			trans	-125.8	158.1	150.3	38.6	-27.2	0	0	0	114.1
1257	T	24.2	Very low	24.8	Very low	121 Å²	121	115.3 Å²	115.3	74%	0.742	65%	0.649	S	S	*	*			trans	-103.9	129	-147.7	-35.1	0	0	0	0	117.4
1258	I	25.3	Very low	24.7	Very low	140 Å²	140	119.7 Å²	119.7	72%	0.718	65%	0.651	S	S	*	*			trans	79.8	110.8	145.1	-83.6	175.7	0	0	0	122.8
1259	T	26.2	Very low	24.8	Very low	101 Å²	101	118 Å²	118	62%	0.62	64%	0.642	S	S	*	*			trans	65.7	163.9	139.3	69.2	0	0	0	0	121.6
1260	T	25.1	Very low	24.8	Very low	74 Å²	74	118.8 Å²	118.8	45%	0.454	64%	0.637	S	S	.	*			cis	-159.9	157.1	-23	21.7	0	0	0	0	112.6
1261	I	26.1	Very low	25	Very low	134 Å²	134	119.3 Å²	119.3	69%	0.687	63%	0.631	S	S	*	*			trans	57.2	100.8	146.9	-63.7	162.8	0	0	0	118.3
1262	N	25.3	Very low	25.1	Very low	140 Å²	140	114.9 Å²	114.9	75%	0.749	62%	0.622	S	S	*	*				98.9	164.3	83.3	-125	14	0	0	0	113
1263	P	32.8	Very low	25.2	Very low	97 Å²	97	117.4 Å²	117.4	63%	0.63	63%	0.625	S	S	*	*				-132	-158.9	-110.5	42.5	-23.7	0	0	0	114.8
1264	S	24.2	Very low	25.3	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	64%	0.64	S	S	*	*			trans	81.9	159.1	161.6	93	0	0	0	0	115.9
1265	I	23.3	Very low	25.4	Very low	135 Å²	135	126.1 Å²	126.1	69%	0.692	66%	0.659	S	S	*	*			cis	-162.6	145.7	-12	-123.5	172	0	0	0	109.7
1266	F	22.8	Very low	25.5	Very low	175 Å²	175	128.6 Å²	128.6	77%	0.768	67%	0.666	S	S	*	*			trans	60.5	170.4	156	-81	-139.7	0	0	0	119.1
1267	T	25	Very low	25.6	Very low	89 Å²	89	129.9 Å²	129.9	55%	0.546	67%	0.667	S	S	.	*			cis	-166.7	150.8	-38.8	35.6	0	0	0	0	108.9
1268	Y	22.9	Very low	25.6	Very low	201 Å²	201	130.9 Å²	130.9	79%	0.788	67%	0.668	S	S	*	*			trans	61.9	171.6	147.3	-80.8	-50.9	0	0	0	117.3
1269	N	24.8	Very low	25.7	Very low	106 Å²	106	128.9 Å²	128.9	57%	0.567	67%	0.666	S	S	*	*			cis	-152.5	156.1	-10.1	-133.1	-28.1	0	0	0	112.2
1270	H	26	Very low	25.7	Very low	143 Å²	143	130.2 Å²	130.2	66%	0.662	67%	0.674	S	S	*	*			trans	57.5	174.3	151.4	-86.7	-69.7	0	0	0	117.5
1271	H	26.4	Very low	25.8	Very low	132 Å²	132	133.6 Å²	133.6	61%	0.611	69%	0.689	S	S	*	*			cis	-154.1	151.6	-3.5	-130.1	-48.7	0	0	0	109.8
1272	N	25.8	Very low	25.7	Very low	113 Å²	113	136 Å²	136	60%	0.604	69%	0.694	S	S	*	*			trans	65.3	156.5	145.8	-67.4	-18.2	0	0	0	118.8
1273	K	26.9	Very low	25.6	Very low	152 Å²	152	134 Å²	134	66%	0.661	68%	0.684	S	S	*	*			cis	-160.8	145.1	-17.5	-118.1	173.8	172.4	-174.8	0	110.5
1274	Q	25.8	Very low	25.1	Very low	140 Å²	140	138.2 Å²	138.2	65%	0.654	69%	0.694	S	S	*	*			trans	48.2	141.2	136	-70.9	171	-36.4	0	0	122.4
1275	N	26.5	Very low	25	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	69%	0.692	S	S	*	*			trans	75.4	143.8	149.3	-61.4	-22.8	0	0	0	117.9
1276	K	26.7	Very low	24.9	Very low	169 Å²	169	140.2 Å²	140.2	74%	0.735	70%	0.697	S	S	*	*			cis	-161.7	153.7	-12.8	-124.4	-177.7	168.6	-175.9	0	110.8
1277	L	24.8	Very low	24.9	Very low	126 Å²	126	136.4 Å²	136.4	66%	0.66	69%	0.693	S	S	*	*			trans	61.7	136.4	155.1	-95.9	68.2	0	0	0	119.7
1278	N	24.6	Very low	24.7	Very low	143 Å²	143	136.1 Å²	136.1	77%	0.765	69%	0.694	S	S	*	*			trans	47.4	130.3	131.8	-53.7	0.2	0	0	0	119.6
1279	S	27.2	Very low	24.6	Very low	98 Å²	98	132.5 Å²	132.5	69%	0.685	69%	0.688	S	S	*	*			cis	-156	160.6	12.5	48.8	0	0	0	0	112.1	L1281	S1279-L1281 PolarHBondContact O-N 3.42Å
1280	T	27.6	Very low	24.4	Very low	129 Å²	129	131.3 Å²	131.3	79%	0.791	69%	0.687	S	S	*	*			trans	47.8	58.3	171.1	57.4	0	0	0	0	113
1281	L	25.6	Very low	24.2	Very low	144 Å²	144	134.9 Å²	134.9	75%	0.754	70%	0.697	S	S	*	*				54.8	72.4	71.7	-128.7	171.4	0	0	0	109	S1279	S1279-L1281 PolarHBondContact O-N 3.42Å
1282	K	23.8	Very low	24.1	Very low	186 Å²	186	136.5 Å²	136.5	81%	0.809	70%	0.704	S	S	*	*			cis	86.7	173.1	43.3	-152.9	-173.2	172.7	-172.4	0	111.2
1283	D	24.5	Very low	24.1	Very low	98 Å²	98	137.3 Å²	137.3	52%	0.524	70%	0.704	S	S	.	*			trans	85.3	57.2	169.5	-44.2	-25.2	0	0	0	115
1284	H	22.9	Very low	24	Very low	185 Å²	185	138.7 Å²	138.7	86%	0.856	71%	0.705	S	S	*	*	S	Bend		-60.3	148.8	120.5	-85.2	-98.4	0	0	0	109.2
1285	S	22.3	Very low	23.9	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	71%	0.71	S	S	*	*			trans	58.1	89.4	-177.5	66.6	0	0	0	0	115.8
1286	F	21.1	Very low	23.8	Very low	185 Å²	185	133.7 Å²	133.7	81%	0.811	69%	0.69	S	S	*	*				-157.2	106.7	129.9	-96.9	-74.7	0	0	0	105.2
1287	S	21.1	Very low	23.6	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	69%	0.687	S	S	*	*			cis	80.8	143.1	47.3	-54.1	0	0	0	0	113.9
1288	S	21.8	Very low	23.7	Very low	83 Å²	83	137.9 Å²	137.9	58%	0.58	70%	0.699	S	S	*	*			trans	58.9	91.6	162.3	54.6	0	0	0	0	118.6
1289	L	20.4	Very low	23.6	Very low	125 Å²	125	135.7 Å²	135.7	65%	0.654	69%	0.69	S	S	*	*				-130	46.3	114.3	-150.4	80.3	0	0	0	110.7
1290	S	21.3	Very low	24.1	Very low	80 Å²	80	136.6 Å²	136.6	56%	0.559	69%	0.694	S	S	*	*				44.9	89	96.6	70.6	0	0	0	0	114.8
1291	Y	22.1	Very low	23.8	Very low	218 Å²	218	135.7 Å²	135.7	86%	0.855	69%	0.692	S	S	*	*			trans	-108.1	147	147.6	-83.2	-76.6	0	0	0	110.7	H1293	Y1291-H1293 PolarHBondContact O-N 3.25Å
1292	H	24.2	Very low	23.8	Very low	167 Å²	167	135.1 Å²	135.1	77%	0.773	69%	0.689	S	S	*	*			trans	-72.4	106.4	-155.6	-110.9	-116.9	0	0	0	113.5	R1294	H1292-R1294 PolarHBondContact O-N 3.4Å
1293	H	24.9	Very low	23.8	Very low	129 Å²	129	133.5 Å²	133.5	60%	0.597	69%	0.689	S	S	*	*			trans	-75.8	100.3	157.3	-164.6	-72.2	0	0	0	109.7	Y1291 R1671 D1672	Y1291-H1293 PolarHBondContact O-N 3.25Å; H1293-R1671 PolarHBondContact CE1-O 2.94Å; H1293-R1671 PolarHBondContact NE2-O 3.5Å; H1293-D1672 PolarHBondContact CD2-O 3.32Å; H1293-D1672 WeakPolarHBondContact NE2-CA 3.21Å; H1293-D1672 WeakPolarHBondContact NE2-CB 3.42Å; H1293-D1672 PolarHBondContact NE2-N 3.49Å; H1293-D1672 PolarHBondContact NE2-O 3.05Å
1294	R	24.1	Very low	23.7	Very low	181 Å²	181	134.6 Å²	134.6	68%	0.683	70%	0.699	S	S	*	*			trans	-158.7	120.2	166.7	-114.7	177.4	-172.5	-169.1	2.4	112.7	H1292	H1292-R1294 PolarHBondContact O-N 3.4Å
1295	N	24.2	Very low	23.7	Very low	141 Å²	141	131.6 Å²	131.6	75%	0.754	69%	0.694	S	S	*	*	S	Bend	trans	63.5	55	155.5	-58.5	18.7	0	0	0	117.8	Q1297	N1295-Q1297 VanDerWaalsContact C-N 3.28Å; N1295-Q1297 PolarHBondContact O-N 3.18Å
1296	G	25.4	Very low	23.8	Very low	29 Å²	29	130.6 Å²	130.6	30%	0.299	70%	0.699	S	S	.	*	S	Bend	trans	73	-24.9	141.5	0	0	0	0	0	120.2	R1671	G1296-R1671 PolarHBondContact O-NH1 2.91Å; G1296-R1671 VanDerWaalsContact O-NH1 3.07Å
1297	Q	22.7	Very low	23.9	Very low	146 Å²	146	128 Å²	128	68%	0.682	68%	0.684	S	S	*	*			trans	-146.2	100.9	-178.4	-115.3	-171.6	-38.6	0	0	113.6	N1295 V1299	N1295-Q1297 VanDerWaalsContact C-N 3.28Å; N1295-Q1297 PolarHBondContact O-N 3.18Å; Q1297-V1299 HydrophobicContact CB-CG2 3.99Å; Q1297-V1299 HydrophobicContact CG-CG2 3.73Å
1298	W	26.2	Very low	23.9	Very low	236 Å²	236	126.3 Å²	126.3	89%	0.894	67%	0.668	S	S	*	*			trans	-144.7	80.8	150.4	-63.6	97.5	0	0	0	104.2
1299	V	23.3	Very low	24	Very low	98 Å²	98	127.1 Å²	127.1	59%	0.594	66%	0.661	S	S	*	*				64.3	114.7	66	-173.6	0	0	0	0	110.3	Q1297	Q1297-V1299 HydrophobicContact CB-CG2 3.99Å; Q1297-V1299 HydrophobicContact CG-CG2 3.73Å
1300	P	36.2	Very low	24.2	Very low	117 Å²	117	128.2 Å²	128.2	76%	0.76	66%	0.663	S	S	*	*			trans	-91.4	161.7	-169.3	38.1	-36.9	0	0	0	113.1
1301	C	22.8	Very low	24.3	Very low	110 Å²	110	128.2 Å²	128.2	74%	0.743	66%	0.663	S	S	*	*			trans	-155	141	158.2	-78.1	0	0	0	0	106.2
1302	D	24.3	Very low	24.4	Very low	132 Å²	132	123.1 Å²	123.1	71%	0.706	66%	0.655	S	S	*	*			cis	-148	135.8	-14.9	-83.2	-43.9	0	0	0	104.8
1303	L	24.2	Very low	24.4	Very low	152 Å²	152	121.8 Å²	121.8	80%	0.796	65%	0.653	S	S	*	*				62.7	138.6	81.6	-156	75.4	0	0	0	114.3
1304	T	21.9	Very low	24.4	Very low	120 Å²	120	121.5 Å²	121.5	74%	0.736	66%	0.656	S	S	*	*			trans	83	118.3	171.7	69.8	0	0	0	0	119.4
1305	V	24.3	Very low	24.6	Very low	123 Å²	123	121 Å²	121	75%	0.745	66%	0.661	S	S	*	*				47.9	74.5	125.6	-164.4	0	0	0	0	118.5	Y1307	V1305-Y1307 HydrophobicContact CG1-CD1 4.43Å
1306	G	23.2	Very low	24.7	Very low	76 Å²	76	118 Å²	118	78%	0.784	66%	0.663	S	S	*	*				54	-147.9	125.5	0	0	0	0	0	120.2
1307	Y	22.7	Very low	25.1	Very low	129 Å²	129	124.7 Å²	124.7	51%	0.506	69%	0.691	S	S	.	*			trans	44.9	109	155.4	-71.4	171.6	0	0	0	121.4	V1305 S1932 Y1933 Y1934	V1305-Y1307 HydrophobicContact CG1-CD1 4.43Å; Y1307-S1932 PolarHBondContact OH-O 2.71Å; Y1307-Y1933 PolarHBondContact OH-N 3.33Å; Y1307-Y1934 AromaticContact CD1-CD2 3.61Å; Y1307-Y1934 HydrophobicContact CD1-CD2 3.61Å; Y1307-Y1934 AromaticContact CD1-CE2 3.63Å; Y1307-Y1934 HydrophobicContact CD1-CE2 3.63Å; Y1307-Y1934 AromaticContact CD2-CD2 3.82Å; Y1307-Y1934 HydrophobicContact CD2-CD2 3.82Å; Y1307-Y1934 HydrophobicContact CE1-CD2 4.06Å; Y1307-Y1934 HydrophobicContact CE1-CE2 4.17Å; Y1307-Y1934 HydrophobicContact CE2-CD2 4.26Å; Y1307-Y1934 AromaticContact CG-CD2 3.46Å; Y1307-Y1934 HydrophobicContact CG-CD2 3.46Å; Y1307-Y1934 VanDerWaalsContact CG-CD2 3.46Å; Y1307-Y1934 AromaticContact CG-CE2 3.88Å; Y1307-Y1934 HydrophobicContact CG-CE2 3.88Å
1308	D	22	Very low	25.8	Very low	60 Å²	60	124.9 Å²	124.9	32%	0.321	69%	0.693	S	S	.	*			trans	71	142.1	142.7	-150.1	20.1	0	0	0	120.7	Y1934 R1936	D1308-Y1934 HydrophobicContact CB-CD1 3.93Å; D1308-Y1934 HydrophobicContact CB-CD2 3.97Å; D1308-Y1934 HydrophobicContact CB-CE1 4.42Å; D1308-Y1934 HydrophobicContact CB-CE2 4.47Å; D1308-Y1934 HydrophobicContact CB-CG 3.69Å; D1308-Y1934 WeakPolarHBondContact OD2-CD1 3.28Å; D1308-R1936 VanDerWaalsContact OD1-CB 3.29Å; D1308-R1936 WeakPolarHBondContact OD1-CB 3.46Å
1309	F	24.4	Very low	26.6	Very low	101 Å²	101	114.9 Å²	114.9	44%	0.443	66%	0.656	S	S	.	*			trans	30.3	136.8	152.4	-156.4	-139.6	0	0	0	124.8	M1937	F1309-M1937 HydrophobicContact CD1-CE 4.14Å; F1309-M1937 HydrophobicContact CD2-CE 3.94Å; F1309-M1937 HydrophobicContact CD2-CG 3.79Å; F1309-M1937 HydrophobicContact CD2-SD 3.79Å; F1309-M1937 HydrophobicContact CE1-CE 3.64Å; F1309-M1937 HydrophobicContact CE2-CE 3.45Å; F1309-M1937 VanDerWaalsContact CE2-CE 3.45Å; F1309-M1937 HydrophobicContact CE2-CG 3.88Å; F1309-M1937 HydrophobicContact CE2-SD 3.21Å; F1309-M1937 WeakPolarHBondContact CE2-SD 3.48Å; F1309-M1937 HydrophobicContact CG-CE 4.27Å; F1309-M1937 HydrophobicContact CZ-CE 3.26Å; F1309-M1937 HydrophobicContact CZ-SD 3.64Å
1310	Q	23.6	Very low	27.7	Very low	147 Å²	147	113.7 Å²	113.7	69%	0.687	65%	0.653	S	S	*	*			trans	70.6	144.5	153.7	-99.9	179	10.6	0	0	117.9
1311	S	23.1	Very low	28.1	Very low	81 Å²	81	116.5 Å²	116.5	57%	0.566	65%	0.648	S	S	*	*			cis	-158.5	141	16.8	-161.2	0	0	0	0	114.7
1312	T	24.6	Very low	29.4	Very low	111 Å²	111	119 Å²	119	68%	0.681	64%	0.642	S	S	*	*			trans	41.1	107.6	141.9	58	0	0	0	0	121.2
1313	N	23.6	Very low	30.5	Very low	138 Å²	138	117 Å²	117	74%	0.738	63%	0.627	S	S	*	*				159.3	129.4	119.9	-80.4	-18.8	0	0	0	110.2
1314	N	25.3	Very low	31.8	Very low	123 Å²	123	112 Å²	112	66%	0.658	60%	0.599	S	S	*	*	S	Bend	cis	-152	144.2	-5.9	-106.6	-35.4	0	0	0	110.5
1315	H	29.1	Very low	33.3	Very low	170 Å²	170	108.8 Å²	108.8	79%	0.787	58%	0.579	S	S	*	*			trans	52.6	101.3	174.4	-58.6	-63.4	0	0	0	117.8	L1317	H1315-L1317 PolarHBondContact O-N 3.03Å; H1315-L1317 VanDerWaalsContact O-N 3.11Å
1316	G	25.9	Very low	34.8	Very low	78 Å²	78	109.1 Å²	109.1	80%	0.804	57%	0.567	S	S	*	*			trans	-57.7	115.1	161.8	0	0	0	0	0	111.2	Q1318	G1316-Q1318 VanDerWaalsContact C-N 3.3Å; G1316-Q1318 PolarHBondContact O-N 3.42Å
1317	L	33.5	Very low	36.1	Very low	170 Å²	170	107.8 Å²	107.8	89%	0.89	54%	0.541	S	S	*	.			trans	-72.6	84	177.4	-83.3	159.7	0	0	0	110	H1315	H1315-L1317 PolarHBondContact O-N 3.03Å; H1315-L1317 VanDerWaalsContact O-N 3.11Å
1318	Q	37.9	Very low	37.5	Very low	151 Å²	151	104.1 Å²	104.1	71%	0.706	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-47.1	144.3	167.6	-62.5	-169.8	15.5	0	0	110.3	G1316 S1320	G1316-Q1318 VanDerWaalsContact C-N 3.3Å; G1316-Q1318 PolarHBondContact O-N 3.42Å; Q1318-S1320 PolarHBondContact O-N 3.03Å; Q1318-S1320 VanDerWaalsContact O-N 3.09Å
1319	L	41.8	Very low	39.1	Very low	25 Å²	25	106 Å²	106	13%	0.131	53%	0.533	C	S	.	.	P	Polyproline II helix	trans	-46.3	124.3	172.1	-88.5	71.4	0	0	0	109.5	L854 W1321 K1323 K1324	L854-L1319 HydrophobicContact CD1-CD1 3.58Å; L854-L1319 HydrophobicContact CD1-CD2 3.64Å; L854-L1319 HydrophobicContact CD1-CG 4.19Å; L1319-W1321 PolarHBondContact O-N 3.47Å; L1319-K1323 HydrophobicContact CB-CB 4.42Å; L1319-K1323 HydrophobicContact CD2-CB 4.23Å; L1319-K1323 HydrophobicContact CD2-CD 4.11Å; L1319-K1324 HydrophobicContact CB-CG 4.12Å; L1319-K1324 WeakPolarHBondContact O-CE 3.45Å
1320	S	47.4	Very low	40.5	Very low	74 Å²	74	105.4 Å²	105.4	52%	0.517	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-46.4	136.4	179.4	-173.5	0	0	0	0	109.1	Q1318 R1322 K1323 K1324	Q1318-S1320 PolarHBondContact O-N 3.03Å; Q1318-S1320 VanDerWaalsContact O-N 3.09Å; S1320-R1322 CarbonylContact O-C 3.59Å; S1320-R1322 PolarHBondContact O-N 3.44Å; S1320-K1323 PolarHBondContact O-N 2.92Å; S1320-K1324 PolarHBondContact O-N 2.85Å
1321	W	45.2	Very low	41.9	Very low	175 Å²	175	100 Å²	100	66%	0.663	52%	0.521	S	S	*	.	H	α-helix	trans	-51.4	-23.8	-176.9	71.2	-85.9	0	0	0	113.2	L1319 V1325	L1319-W1321 PolarHBondContact O-N 3.47Å; W1321-V1325 HydrophobicContact CE3-CG2 4.18Å; W1321-V1325 WeakPolarHBondContact O-CB 3.49Å; W1321-V1325 VanDerWaalsContact O-CG2 3.25Å; W1321-V1325 WeakPolarHBondContact O-CG2 3.34Å; W1321-V1325 PolarHBondContact O-N 3.12Å
1322	R	49.4	Very low	43.6	Very low	163 Å²	163	99.9 Å²	99.9	62%	0.615	52%	0.519	S	S	*	.	H	α-helix	trans	-67.9	-39	171.4	-64.6	-175.9	180	155.1	4.2	114.9	S1320 Y1326	S1320-R1322 CarbonylContact O-C 3.59Å; S1320-R1322 PolarHBondContact O-N 3.44Å; R1322-Y1326 WeakPolarHBondContact O-CB 3.22Å; R1322-Y1326 PolarHBondContact O-N 3.17Å
1323	K	48.4	Very low	45.1	Very low	90 Å²	90	96.3 Å²	96.3	39%	0.391	50%	0.495	S	S	.	.	H	α-helix	trans	-66.7	-46.2	170.9	-96.5	-148.9	173.3	-159.6	0	109.9	E863 L1319 S1320 V1325 Y1326 E1327	E863-K1323 IonicContact OE1-NZ 2.73Å; E863-K1323 PolarHBondContact OE1-NZ 3.06Å; L1319-K1323 HydrophobicContact CB-CB 4.42Å; L1319-K1323 HydrophobicContact CD2-CB 4.23Å; L1319-K1323 HydrophobicContact CD2-CD 4.11Å; S1320-K1323 PolarHBondContact O-N 2.92Å; K1323-V1325 VanDerWaalsContact C-N 3.3Å; K1323-V1325 PolarHBondContact O-N 3.18Å; K1323-Y1326 WeakPolarHBondContact O-CA 3.45Å; K1323-Y1326 WeakPolarHBondContact O-CB 3.13Å; K1323-Y1326 PolarHBondContact O-N 2.76Å; K1323-E1327 PolarHBondContact O-N 3.41Å
1324	K	50.7	Low	47.1	Very low	48 Å²	48	92.5 Å²	92.5	21%	0.209	48%	0.475	C	S	.	.	H	α-helix	trans	-55.4	-41.5	175.9	-63.8	-174.3	173.8	-174.2	0	113	F848 L1319 S1320 F1328	F848-K1324 HydrophobicContact CD1-CG 4.11Å; F848-K1324 HydrophobicContact CD2-CD 4.02Å; F848-K1324 HydrophobicContact CD2-CG 4.37Å; F848-K1324 HydrophobicContact CE1-CB 3.96Å; F848-K1324 HydrophobicContact CE1-CG 3.88Å; F848-K1324 HydrophobicContact CE2-CB 4.41Å; F848-K1324 HydrophobicContact CE2-CD 3.89Å; F848-K1324 HydrophobicContact CE2-CG 4.16Å; F848-K1324 HydrophobicContact CG-CD 4.39Å; F848-K1324 HydrophobicContact CG-CG 4.35Å; F848-K1324 HydrophobicContact CZ-CB 3.82Å; F848-K1324 HydrophobicContact CZ-CD 4.15Å; F848-K1324 HydrophobicContact CZ-CG 3.91Å; L1319-K1324 HydrophobicContact CB-CG 4.12Å; L1319-K1324 WeakPolarHBondContact O-CE 3.45Å; S1320-K1324 PolarHBondContact O-N 2.85Å; K1324-F1328 WeakPolarHBondContact O-CB 3Å; K1324-F1328 PolarHBondContact O-N 3.13Å
1325	V	54.1	Low	49.4	Very low	51 Å²	51	88.1 Å²	88.1	31%	0.309	45%	0.449	S	S	.	.	H	α-helix	trans	-75.7	-30.4	175.5	168.7	0	0	0	0	112.9	W1321 K1323 F1328 F1329	W1321-V1325 HydrophobicContact CE3-CG2 4.18Å; W1321-V1325 WeakPolarHBondContact O-CB 3.49Å; W1321-V1325 VanDerWaalsContact O-CG2 3.25Å; W1321-V1325 WeakPolarHBondContact O-CG2 3.34Å; W1321-V1325 PolarHBondContact O-N 3.12Å; K1323-V1325 VanDerWaalsContact C-N 3.3Å; K1323-V1325 PolarHBondContact O-N 3.18Å; V1325-F1328 PolarHBondContact O-N 2.92Å; V1325-F1329 HydrophobicContact CG1-CD2 3.68Å; V1325-F1329 HydrophobicContact CG1-CE2 3.54Å; V1325-F1329 VanDerWaalsContact O-CD2 3.27Å; V1325-F1329 WeakPolarHBondContact O-CD2 3.3Å; V1325-F1329 PolarHBondContact O-N 3.39Å
1326	Y	53.9	Low	51.6	Low	130 Å²	130	83.3 Å²	83.3	51%	0.51	43%	0.429	S	S	.	.	H	α-helix	trans	-68.2	-42.8	177.3	169.9	-93.3	0	0	0	112	R1322 K1323 L1593	R1322-Y1326 WeakPolarHBondContact O-CB 3.22Å; R1322-Y1326 PolarHBondContact O-N 3.17Å; K1323-Y1326 WeakPolarHBondContact O-CA 3.45Å; K1323-Y1326 WeakPolarHBondContact O-CB 3.13Å; K1323-Y1326 PolarHBondContact O-N 2.76Å; Y1326-L1593 HydrophobicContact CD1-CD2 3.97Å; Y1326-L1593 HydrophobicContact CD2-CD2 4.27Å; Y1326-L1593 HydrophobicContact CE1-CD2 3.52Å; Y1326-L1593 HydrophobicContact CE2-CD1 3.85Å; Y1326-L1593 HydrophobicContact CE2-CD2 3.85Å; Y1326-L1593 HydrophobicContact CE2-CG 4.37Å; Y1326-L1593 HydrophobicContact CG-CD2 4.33Å; Y1326-L1593 VanDerWaalsContact CZ-CD2 3.46Å; Y1326-L1593 VanDerWaalsContact OH-CD1 3.31Å; Y1326-L1593 WeakPolarHBondContact OH-CD1 3.35Å
1327	E	51.8	Low	54	Low	49 Å²	49	83 Å²	83	23%	0.229	41%	0.411	C	S	.	.	H	α-helix	trans	-64.9	-42.6	171.3	-71.5	159.8	-138.3	0	0	111.2	K1323 F1329 S1330	K1323-E1327 PolarHBondContact O-N 3.41Å; E1327-F1329 VanDerWaalsContact C-N 3.33Å; E1327-F1329 PolarHBondContact O-N 2.99Å; E1327-S1330 WeakPolarHBondContact O-CB 3.23Å; E1327-S1330 PolarHBondContact O-N 3.22Å; E1327-S1330 PolarHBondContact O-OG 3.3Å
1328	F	51.7	Low	56.3	Low	51 Å²	51	74.9 Å²	74.9	22%	0.224	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-32.2	-179.6	179.9	-87.7	0	0	0	114.5	I822 L826 Y832 K1324 V1325 S1330	I822-F1328 HydrophobicContact CB-CE2 4.4Å; I822-F1328 HydrophobicContact CG1-CE2 4.1Å; I822-F1328 HydrophobicContact CG2-CE2 3.82Å; I822-F1328 HydrophobicContact CG2-CZ 4.08Å; L826-F1328 HydrophobicContact CG-CE1 4.11Å; L826-F1328 HydrophobicContact CG-CZ 4.21Å; Y832-F1328 HydrophobicContact CE2-CE2 4.18Å; K1324-F1328 WeakPolarHBondContact O-CB 3Å; K1324-F1328 PolarHBondContact O-N 3.13Å; V1325-F1328 PolarHBondContact O-N 2.92Å; F1328-S1330 PolarHBondContact O-N 2.65Å
1329	F	55.2	Low	58.4	Low	101 Å²	101	68.8 Å²	68.8	44%	0.443	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-1.8	-179.1	-90.6	-61.7	0	0	0	115.1	V1325 E1327 A1331	V1325-F1329 HydrophobicContact CG1-CD2 3.68Å; V1325-F1329 HydrophobicContact CG1-CE2 3.54Å; V1325-F1329 VanDerWaalsContact O-CD2 3.27Å; V1325-F1329 WeakPolarHBondContact O-CD2 3.3Å; V1325-F1329 PolarHBondContact O-N 3.39Å; E1327-F1329 VanDerWaalsContact C-N 3.33Å; E1327-F1329 PolarHBondContact O-N 2.99Å; F1329-A1331 VanDerWaalsContact C-N 3.28Å; F1329-A1331 PolarHBondContact O-N 3.09Å
1330	S	54.5	Low	60.4	Low	88 Å²	88	72.3 Å²	72.3	62%	0.615	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-13.3	179.2	60.8	0	0	0	0	115.2	E1327 F1328	E1327-S1330 WeakPolarHBondContact O-CB 3.23Å; E1327-S1330 PolarHBondContact O-N 3.22Å; E1327-S1330 PolarHBondContact O-OG 3.3Å; F1328-S1330 PolarHBondContact O-N 2.65Å
1331	A	53.8	Low	62.2	Low	32 Å²	32	71.4 Å²	71.4	26%	0.264	35%	0.352	S	S	.	.			trans	-66.3	139.2	-168.5	0	0	0	0	0	114.3	F1329 L1333	F1329-A1331 VanDerWaalsContact C-N 3.28Å; F1329-A1331 PolarHBondContact O-N 3.09Å; A1331-L1333 HydrophobicContact CB-CD1 4.38Å; A1331-L1333 HydrophobicContact CB-CG 4.4Å; A1331-L1333 PolarHBondContact O-N 3.46Å
1332	P	57.6	Low	64.2	Low	79 Å²	79	63.1 Å²	63.1	51%	0.513	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-0.9	-176.7	27.6	-36.1	0	0	0	115.2	L1334 Y1335 L1446	P1332-L1334 PolarHBondContact O-N 3.34Å; P1332-L1334 VanDerWaalsContact O-N 3.11Å; P1332-Y1335 WeakPolarHBondContact O-CB 2.98Å; P1332-Y1335 PolarHBondContact O-N 3.35Å; P1332-L1446 HydrophobicContact CB-CD2 3.85Å
1333	L	57.1	Low	66	Low	36 Å²	36	58.1 Å²	58.1	19%	0.188	31%	0.306	C	S	.	.	H	α-helix	trans	-61.1	-24.2	-171.7	-64.9	173.5	0	0	0	114.4	L823 L826 A1331 Y1335 L1336 V1337	L823-L1333 HydrophobicContact CD2-CD1 3.72Å; L823-L1333 HydrophobicContact CD2-CD2 3.86Å; L823-L1333 HydrophobicContact CD2-CG 4.36Å; L823-L1333 HydrophobicContact CG-CD1 3.92Å; L823-L1333 HydrophobicContact CG-CD2 4.45Å; L826-L1333 HydrophobicContact CD1-CB 4.45Å; L826-L1333 HydrophobicContact CD1-CD1 3.54Å; A1331-L1333 HydrophobicContact CB-CD1 4.38Å; A1331-L1333 HydrophobicContact CB-CG 4.4Å; A1331-L1333 PolarHBondContact O-N 3.46Å; L1333-Y1335 PolarHBondContact O-N 3.46Å; L1333-L1336 HydrophobicContact CD2-CD1 4.21Å; L1333-L1336 PolarHBondContact O-N 3.21Å; L1333-V1337 PolarHBondContact O-N 2.89Å
1334	L	65.2	Low	67.6	Low	58 Å²	58	55.3 Å²	55.3	30%	0.304	30%	0.303	S	S	.	.	H	α-helix	trans	-70.9	-18.1	177.4	-73.1	167.2	0	0	0	113.7	P1332 F1338 P1595	P1332-L1334 PolarHBondContact O-N 3.34Å; P1332-L1334 VanDerWaalsContact O-N 3.11Å; L1334-F1338 PolarHBondContact O-N 3.2Å; L1334-P1595 HydrophobicContact CD1-CB 3.73Å; L1334-P1595 HydrophobicContact CD1-CG 3.28Å
1335	Y	73.3	Confident	69.2	Low	31 Å²	31	53.4 Å²	53.4	12%	0.122	29%	0.294	C	S	.	.	H	α-helix	trans	-71.3	-41	170.5	178.1	-96.1	0	0	0	111.8	P1332 L1333 V1337 F1338 L1339 W1439 R1442 F1443 L1446	P1332-Y1335 WeakPolarHBondContact O-CB 2.98Å; P1332-Y1335 PolarHBondContact O-N 3.35Å; L1333-Y1335 PolarHBondContact O-N 3.46Å; Y1335-V1337 VanDerWaalsContact C-N 3.31Å; Y1335-V1337 PolarHBondContact O-N 3.41Å; Y1335-F1338 WeakPolarHBondContact O-CB 3.3Å; Y1335-F1338 PolarHBondContact O-N 3.1Å; Y1335-L1339 HydrophobicContact CE1-CD1 4.14Å; Y1335-L1339 PolarHBondContact O-N 3.06Å; Y1335-W1439 HydrophobicContact CE2-CE3 4.19Å; Y1335-W1439 HydrophobicContact CE2-CZ3 4.29Å; Y1335-W1439 PolarHBondContact OH-O 2.86Å; Y1335-R1442 VanDerWaalsContact OH-CB 3.27Å; Y1335-R1442 WeakPolarHBondContact OH-CB 3.32Å; Y1335-F1443 HydrophobicContact CE1-CB 4.25Å; Y1335-F1443 HydrophobicContact CE1-CD2 4.3Å; Y1335-F1443 PolarHBondContact OH-N 2.99Å; Y1335-L1446 HydrophobicContact CD1-CD1 3.33Å; Y1335-L1446 HydrophobicContact CE1-CD1 3.84Å; Y1335-L1446 HydrophobicContact CG-CD1 3.84Å
1336	L	74.9	Confident	70.6	Confident	70 Å²	70	52.3 Å²	52.3	37%	0.366	29%	0.289	S	S	.	.	H	α-helix	trans	-61.2	-39.6	173.5	-72	173.1	0	0	0	111.7	L1333 F1338 L1339 V1340 F1443	L1333-L1336 HydrophobicContact CD2-CD1 4.21Å; L1333-L1336 PolarHBondContact O-N 3.21Å; L1336-F1338 VanDerWaalsContact C-N 3.35Å; L1336-F1338 PolarHBondContact O-N 2.89Å; L1336-L1339 PolarHBondContact O-N 3.3Å; L1336-V1340 WeakPolarHBondContact O-CG2 3.03Å; L1336-V1340 PolarHBondContact O-N 3.27Å; L1336-F1443 HydrophobicContact CD2-CD2 4.07Å; L1336-F1443 HydrophobicContact CD2-CE2 3.69Å; L1336-F1443 HydrophobicContact CD2-CZ 4.38Å; L1336-F1443 HydrophobicContact CG-CE2 4.46Å
1337	V	75.8	Confident	71.9	Confident	70 Å²	70	52.4 Å²	52.4	42%	0.424	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-42.1	174.9	177.5	0	0	0	0	111.4	L1333 Y1335 L1341	L1333-V1337 PolarHBondContact O-N 2.89Å; Y1335-V1337 VanDerWaalsContact C-N 3.31Å; Y1335-V1337 PolarHBondContact O-N 3.41Å; V1337-L1341 HydrophobicContact CG1-CD1 4.01Å; V1337-L1341 WeakPolarHBondContact O-CB 3.48Å; V1337-L1341 WeakPolarHBondContact O-CD1 3.37Å; V1337-L1341 VanDerWaalsContact O-CG 3.26Å; V1337-L1341 WeakPolarHBondContact O-CG 3.27Å; V1337-L1341 PolarHBondContact O-N 3.06Å; V1337-L1341 VanDerWaalsContact O-N 3.1Å
1338	F	82.4	Confident	73.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-47	173.3	160.5	-96.6	0	0	0	112.1	L1334 Y1335 L1336 V1340 L1341 F1342 V1362 H1365 I1366 W1439	L1334-F1338 PolarHBondContact O-N 3.2Å; Y1335-F1338 WeakPolarHBondContact O-CB 3.3Å; Y1335-F1338 PolarHBondContact O-N 3.1Å; L1336-F1338 VanDerWaalsContact C-N 3.35Å; L1336-F1338 PolarHBondContact O-N 2.89Å; F1338-V1340 PolarHBondContact O-N 2.7Å; F1338-L1341 PolarHBondContact O-N 2.96Å; F1338-F1342 HydrophobicContact CE1-CD1 4.4Å; F1338-F1342 AromaticContact CZ-CD1 3.93Å; F1338-F1342 HydrophobicContact CZ-CD1 3.93Å; F1338-F1342 PolarHBondContact O-N 3.41Å; F1338-V1362 HydrophobicContact CE2-CG1 4.08Å; F1338-H1365 HydrophobicContact CD2-CB 3.68Å; F1338-H1365 AromaticContact CD2-CD2 3.41Å; F1338-H1365 VanDerWaalsContact CD2-CD2 3.41Å; F1338-H1365 WeakPolarHBondContact CD2-CD2 3.41Å; F1338-H1365 AromaticContact CD2-CG 3.36Å; F1338-H1365 AromaticContact CD2-ND1 3.84Å; F1338-H1365 AromaticContact CD2-NE2 3.95Å; F1338-H1365 HydrophobicContact CE2-CB 3.89Å; F1338-H1365 AromaticContact CE2-CD2 3.76Å; F1338-H1365 AromaticContact CE2-CG 3.89Å; F1338-H1365 AromaticContact CG-CD2 3.71Å; F1338-H1365 AromaticContact CG-CE1 3.98Å; F1338-H1365 AromaticContact CG-CG 3.96Å; F1338-H1365 AromaticContact CG-NE2 3.75Å; F1338-I1366 HydrophobicContact CE2-CG1 4Å; F1338-I1366 HydrophobicContact CZ-CD1 4.5Å; F1338-I1366 HydrophobicContact CZ-CG1 3.97Å; F1338-W1439 HydrophobicContact CD1-CE3 4.4Å; F1338-W1439 AromaticContact CE1-CD2 3.78Å; F1338-W1439 HydrophobicContact CE1-CD2 3.78Å; F1338-W1439 AromaticContact CE1-CE3 3.41Å; F1338-W1439 HydrophobicContact CE1-CE3 3.41Å; F1338-W1439 VanDerWaalsContact CE1-CE3 3.41Å; F1338-W1439 HydrophobicContact CE1-CG 4.32Å; F1338-W1439 HydrophobicContact CE1-CH2 4.47Å; F1338-W1439 AromaticContact CE1-CZ3 3.79Å; F1338-W1439 HydrophobicContact CE1-CZ3 3.79Å; F1338-W1439 AromaticContact CZ-CD2 3.95Å; F1338-W1439 HydrophobicContact CZ-CD2 3.95Å; F1338-W1439 AromaticContact CZ-CE3 3.94Å; F1338-W1439 HydrophobicContact CZ-CE3 3.94Å; F1338-W1439 HydrophobicContact CZ-CG 4.48Å; F1338-W1439 HydrophobicContact CZ-CH2 4.39Å; F1338-W1439 HydrophobicContact CZ-CZ2 4.43Å; F1338-W1439 HydrophobicContact CZ-CZ3 4.15Å
1339	L	82.7	Confident	73.7	Confident	24 Å²	24	58.8 Å²	58.8	13%	0.126	34%	0.335	C	S	.	.	H	α-helix	trans	-62.2	-44.4	-178.3	-172.7	155.7	0	0	0	111.6	Y1335 L1336 L1341 F1342 I1343 Q1440	Y1335-L1339 HydrophobicContact CE1-CD1 4.14Å; Y1335-L1339 PolarHBondContact O-N 3.06Å; L1336-L1339 PolarHBondContact O-N 3.3Å; L1339-L1341 PolarHBondContact O-N 3.15Å; L1339-F1342 PolarHBondContact O-N 3.35Å; L1339-I1343 HydrophobicContact CD2-CD1 3.6Å; L1339-I1343 HydrophobicContact CD2-CG1 4.35Å; L1339-I1343 WeakPolarHBondContact O-CG1 3.42Å; L1339-I1343 PolarHBondContact O-N 2.87Å; L1339-Q1440 HydrophobicContact CD1-CG 4.29Å; L1339-Q1440 HydrophobicContact CD2-CG 4.46Å; L1339-Q1440 HydrophobicContact CG-CG 4.45Å
1340	V	83.9	Confident	74.2	Confident	99 Å²	99	55.3 Å²	55.3	60%	0.6	32%	0.321	S	S	*	.	H	α-helix	trans	-62.2	-42.1	174.9	171.3	0	0	0	0	111.7	L1336 F1338 I1343 G1344	L1336-V1340 WeakPolarHBondContact O-CG2 3.03Å; L1336-V1340 PolarHBondContact O-N 3.27Å; F1338-V1340 PolarHBondContact O-N 2.7Å; V1340-I1343 PolarHBondContact O-N 2.93Å; V1340-G1344 PolarHBondContact O-N 3.41Å
1341	L	84.7	Confident	74.8	Confident	54 Å²	54	53.6 Å²	53.6	28%	0.283	31%	0.308	S	S	.	.	H	α-helix	trans	-66.2	-35.7	176.3	-72.6	169	0	0	0	112.3	V1337 F1338 L1339 G1344 L1345 L1358 Y1361 V1362	V1337-L1341 HydrophobicContact CG1-CD1 4.01Å; V1337-L1341 WeakPolarHBondContact O-CB 3.48Å; V1337-L1341 WeakPolarHBondContact O-CD1 3.37Å; V1337-L1341 VanDerWaalsContact O-CG 3.26Å; V1337-L1341 WeakPolarHBondContact O-CG 3.27Å; V1337-L1341 PolarHBondContact O-N 3.06Å; V1337-L1341 VanDerWaalsContact O-N 3.1Å; F1338-L1341 PolarHBondContact O-N 2.96Å; L1339-L1341 PolarHBondContact O-N 3.15Å; L1341-G1344 PolarHBondContact O-N 3.02Å; L1341-L1345 PolarHBondContact O-N 3.39Å; L1341-L1358 HydrophobicContact CD2-CD1 4.06Å; L1341-L1358 HydrophobicContact CD2-CG 4.35Å; L1341-Y1361 HydrophobicContact CD1-CD1 3.87Å; L1341-Y1361 HydrophobicContact CD1-CE1 3.54Å; L1341-V1362 HydrophobicContact CB-CG2 4.33Å
1342	F	87.2	Confident	75.4	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-72.7	-38.8	177.4	-167.2	-169.4	0	0	0	112	F1338 L1339 G1344 L1345 C1346 V1362 I1366 L1432 C1435 C1436 W1439	F1338-F1342 HydrophobicContact CE1-CD1 4.4Å; F1338-F1342 AromaticContact CZ-CD1 3.93Å; F1338-F1342 HydrophobicContact CZ-CD1 3.93Å; F1338-F1342 PolarHBondContact O-N 3.41Å; L1339-F1342 PolarHBondContact O-N 3.35Å; F1342-G1344 VanDerWaalsContact C-N 3.32Å; F1342-G1344 PolarHBondContact O-N 3.35Å; F1342-L1345 HydrophobicContact CD2-CB 4.4Å; F1342-L1345 HydrophobicContact CD2-CD2 4.17Å; F1342-L1345 HydrophobicContact CE2-CD2 4.44Å; F1342-L1345 WeakPolarHBondContact O-CB 3Å; F1342-L1345 PolarHBondContact O-N 3.1Å; F1342-C1346 PolarHBondContact O-N 3.16Å; F1342-C1346 PolarHBondContact O-SG 2.89Å; F1342-V1362 HydrophobicContact CB-CG1 4.2Å; F1342-V1362 HydrophobicContact CD2-CG1 3.79Å; F1342-V1362 HydrophobicContact CE2-CG1 4.31Å; F1342-V1362 HydrophobicContact CG-CG1 3.93Å; F1342-I1366 HydrophobicContact CE1-CD1 4.45Å; F1342-L1432 WeakPolarHBondContact CZ-O 3.45Å; F1342-C1435 HydrophobicContact CZ-CB 4.32Å; F1342-C1436 HydrophobicContact CD1-CB 4.19Å; F1342-C1436 HydrophobicContact CD2-CB 4.3Å; F1342-C1436 HydrophobicContact CE1-CB 3.93Å; F1342-C1436 HydrophobicContact CE2-CB 4.03Å; F1342-C1436 HydrophobicContact CG-CB 4.37Å; F1342-C1436 HydrophobicContact CZ-CB 3.84Å; F1342-W1439 HydrophobicContact CD1-CB 4.3Å; F1342-W1439 HydrophobicContact CD1-CG 4.3Å; F1342-W1439 HydrophobicContact CE1-CB 4.28Å; F1342-W1439 AromaticContact CE1-CD1 3.6Å; F1342-W1439 HydrophobicContact CE1-CG 4.02Å
1343	I	86.4	Confident	76	Confident	58 Å²	58	56.3 Å²	56.3	30%	0.297	32%	0.316	S	S	.	.	H	α-helix	trans	-59.6	-44.7	169.1	-70	176.6	0	0	0	110.4	L1339 V1340 L1345 C1346 I1347	L1339-I1343 HydrophobicContact CD2-CD1 3.6Å; L1339-I1343 HydrophobicContact CD2-CG1 4.35Å; L1339-I1343 WeakPolarHBondContact O-CG1 3.42Å; L1339-I1343 PolarHBondContact O-N 2.87Å; V1340-I1343 PolarHBondContact O-N 2.93Å; I1343-L1345 VanDerWaalsContact C-N 3.31Å; I1343-L1345 PolarHBondContact O-N 2.9Å; I1343-C1346 PolarHBondContact O-N 3.4Å; I1343-C1346 VanDerWaalsContact O-N 3.15Å; I1343-I1347 HydrophobicContact CG2-CD1 3.64Å; I1343-I1347 HydrophobicContact CG2-CG1 4.32Å; I1343-I1347 WeakPolarHBondContact O-CG1 3.24Å; I1343-I1347 PolarHBondContact O-N 2.95Å
1344	G	83.3	Confident	76.9	Confident	31 Å²	31	58.6 Å²	58.6	32%	0.32	33%	0.332	S	S	.	.	H	α-helix	trans	-57.9	-40.1	174.4	0	0	0	0	0	113.4	V1340 L1341 F1342 H1348	V1340-G1344 PolarHBondContact O-N 3.41Å; L1341-G1344 PolarHBondContact O-N 3.02Å; F1342-G1344 VanDerWaalsContact C-N 3.32Å; F1342-G1344 PolarHBondContact O-N 3.35Å; G1344-H1348 VanDerWaalsContact O-CB 3.32Å; G1344-H1348 WeakPolarHBondContact O-CB 3.4Å; G1344-H1348 PolarHBondContact O-N 2.95Å
1345	L	83.9	Confident	77.5	Confident	7 Å²	7	60.5 Å²	60.5	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-63.6	-39.1	174.8	-175.5	65.2	0	0	0	112.6	L1341 F1342 I1343 L1350 L1358 E1359 V1362 Y1363	L1341-L1345 PolarHBondContact O-N 3.39Å; F1342-L1345 HydrophobicContact CD2-CB 4.4Å; F1342-L1345 HydrophobicContact CD2-CD2 4.17Å; F1342-L1345 HydrophobicContact CE2-CD2 4.44Å; F1342-L1345 WeakPolarHBondContact O-CB 3Å; F1342-L1345 PolarHBondContact O-N 3.1Å; I1343-L1345 VanDerWaalsContact C-N 3.31Å; I1343-L1345 PolarHBondContact O-N 2.9Å; L1345-L1350 HydrophobicContact CD1-CD1 3.76Å; L1345-L1350 HydrophobicContact CD1-CD2 3.79Å; L1345-L1350 HydrophobicContact CD1-CG 4.21Å; L1345-L1350 HydrophobicContact CG-CD1 4.2Å; L1345-L1358 HydrophobicContact CB-CD2 3.68Å; L1345-L1358 HydrophobicContact CD1-CD2 3.81Å; L1345-L1358 HydrophobicContact CG-CD2 4.26Å; L1345-E1359 HydrophobicContact CD1-CB 3.66Å; L1345-E1359 HydrophobicContact CD1-CG 4.08Å; L1345-E1359 HydrophobicContact CD2-CG 4.43Å; L1345-V1362 HydrophobicContact CD2-CB 3.97Å; L1345-V1362 HydrophobicContact CD2-CG1 3.89Å; L1345-V1362 HydrophobicContact CD2-CG2 4.18Å; L1345-Y1363 HydrophobicContact CD2-CE1 4.18Å
1346	C	82.7	Confident	77.9	Confident	29 Å²	29	61.3 Å²	61.3	20%	0.196	35%	0.348	C	S	.	.	H	α-helix	trans	-76.1	-34.1	-179.5	-72.2	0	0	0	0	113.5	F1342 I1343 I1433 C1436	F1342-C1346 PolarHBondContact O-N 3.16Å; F1342-C1346 PolarHBondContact O-SG 2.89Å; I1343-C1346 PolarHBondContact O-N 3.4Å; I1343-C1346 VanDerWaalsContact O-N 3.15Å; C1346-I1433 HydrophobicContact CB-CG1 4.19Å; C1346-C1436 VanDerWaalsContact SG-CB 3.56Å
1347	I	82.5	Confident	78.1	Confident	132 Å²	132	66.6 Å²	66.6	68%	0.677	37%	0.368	S	S	*	.	H	α-helix	trans	-73.5	-40.6	176.2	-67.1	172.2	0	0	0	110.8	I1343 T1349	I1343-I1347 HydrophobicContact CG2-CD1 3.64Å; I1343-I1347 HydrophobicContact CG2-CG1 4.32Å; I1343-I1347 WeakPolarHBondContact O-CG1 3.24Å; I1343-I1347 PolarHBondContact O-N 2.95Å; I1347-T1349 PolarHBondContact O-N 2.67Å
1348	H	75.9	Confident	78.5	Confident	122 Å²	122	66.3 Å²	66.3	57%	0.565	36%	0.364	S	S	*	.	S	Bend	trans	-68.4	128.1	-178.4	-166.9	72	0	0	0	111.4	G1344 L1350	G1344-H1348 VanDerWaalsContact O-CB 3.32Å; G1344-H1348 WeakPolarHBondContact O-CB 3.4Å; G1344-H1348 PolarHBondContact O-N 2.95Å; H1348-L1350 VanDerWaalsContact C-N 3.26Å; H1348-L1350 PolarHBondContact O-N 3.35Å
1349	T	65.7	Low	78.6	Confident	112 Å²	112	66.3 Å²	66.3	69%	0.687	36%	0.364	S	S	*	.			trans	-73.2	81.9	176.7	51.6	0	0	0	0	110.5	I1347	I1347-T1349 PolarHBondContact O-N 2.67Å
1350	L	65.1	Low	78.6	Confident	27 Å²	27	70 Å²	70	14%	0.141	38%	0.383	C	S	.	.			trans	-50.6	139.4	175.1	-71.6	152	0	0	0	111.3	L1345 H1348 E1359 Y1425	L1345-L1350 HydrophobicContact CD1-CD1 3.76Å; L1345-L1350 HydrophobicContact CD1-CD2 3.79Å; L1345-L1350 HydrophobicContact CD1-CG 4.21Å; L1345-L1350 HydrophobicContact CG-CD1 4.2Å; H1348-L1350 VanDerWaalsContact C-N 3.26Å; H1348-L1350 PolarHBondContact O-N 3.35Å; L1350-E1359 HydrophobicContact CD2-CB 4.5Å; L1350-Y1425 PolarHBondContact O-OH 3.38Å
1351	P	67.3	Low	78.6	Confident	53 Å²	53	69 Å²	69	34%	0.344	37%	0.369	S	S	.	.			trans	-68	156.5	168.3	30.6	-35.1	0	0	0	110.8	T1354 R1415 Y1425	P1351-T1354 VanDerWaalsContact CG-OG1 3.25Å; P1351-T1354 WeakPolarHBondContact CG-OG1 3.22Å; P1351-R1415 PolarHBondContact O-NH2 3Å; P1351-Y1425 PolarHBondContact O-OH 3.23Å
1352	P	65.7	Low	78.7	Confident	45 Å²	45	66.4 Å²	66.4	29%	0.292	36%	0.356	S	S	.	.	S	Bend	trans	-74.6	-28.4	174.8	28.2	-30.5	0	0	0	113.6	I1419 Y1425	P1352-I1419 WeakPolarHBondContact O-CG1 3.49Å; P1352-Y1425 VanDerWaalsContact CA-CE2 3.47Å; P1352-Y1425 HydrophobicContact CB-CD2 4.07Å; P1352-Y1425 HydrophobicContact CB-CE2 3.93Å; P1352-Y1425 HydrophobicContact CB-CG 4.48Å
1353	D	70.8	Confident	78.7	Confident	123 Å²	123	67.2 Å²	67.2	66%	0.658	36%	0.358	S	S	*	.	S	Bend	trans	-99	-4.2	-162.7	-44.3	-52.3	0	0	0	114.6
1354	T	75.7	Confident	78.7	Confident	84 Å²	84	68.1 Å²	68.1	52%	0.515	36%	0.364	S	S	.	.			trans	-144.7	149.3	-174.8	51.7	0	0	0	0	113.2	P1351	P1351-T1354 VanDerWaalsContact CG-OG1 3.25Å; P1351-T1354 WeakPolarHBondContact CG-OG1 3.22Å
1355	F	77.9	Confident	78.7	Confident	98 Å²	98	66.9 Å²	66.9	43%	0.43	35%	0.349	S	S	.	.			trans	-84.7	132.3	169.3	-68.6	-74.4	0	0	0	110.8	E1359 Y1363 Y1416 I1419	F1355-E1359 WeakPolarHBondContact CA-OE2 3.49Å; F1355-E1359 WeakPolarHBondContact CD1-OE1 3.4Å; F1355-Y1363 HydrophobicContact CD1-CE2 4.45Å; F1355-Y1363 HydrophobicContact CE1-CE2 4.34Å; F1355-Y1416 AromaticContact CZ-CD2 3.98Å; F1355-Y1416 HydrophobicContact CZ-CD2 3.98Å; F1355-I1419 HydrophobicContact CD1-CD1 4.3Å; F1355-I1419 HydrophobicContact CD2-CD1 4.16Å; F1355-I1419 HydrophobicContact CE1-CD1 3.65Å; F1355-I1419 HydrophobicContact CE2-CD1 3.49Å; F1355-I1419 VanDerWaalsContact CE2-CD1 3.49Å; F1355-I1419 HydrophobicContact CZ-CD1 3.19Å
1356	S	81.1	Confident	78.8	Confident	48 Å²	48	66.5 Å²	66.5	34%	0.336	35%	0.348	S	S	.	.			trans	-77.8	152.4	170.1	178.8	0	0	0	0	111.8	L1358 E1359 L1360	S1356-L1358 PolarHBondContact O-N 3.48Å; S1356-L1358 PolarHBondContact OG-N 2.67Å; S1356-E1359 PolarHBondContact N-OE2 3.14Å; S1356-E1359 WeakPolarHBondContact O-CB 3.24Å; S1356-E1359 PolarHBondContact O-N 2.89Å; S1356-L1360 PolarHBondContact O-N 3.28Å
1357	F	79.7	Confident	79	Confident	181 Å²	181	69.3 Å²	69.3	79%	0.794	36%	0.36	S	S	*	.	H	α-helix	trans	-64.7	-31.2	173.6	-141.3	-79.9	0	0	0	111.9	Y1361	F1357-Y1361 PolarHBondContact O-N 2.74Å
1358	L	83.5	Confident	79.1	Confident	63 Å²	63	63.1 Å²	63.1	33%	0.33	33%	0.329	S	S	.	.	H	α-helix	trans	-70.3	-40.9	173.7	-174.3	156.8	0	0	0	111.2	L1341 L1345 S1356 Y1361 V1362	L1341-L1358 HydrophobicContact CD2-CD1 4.06Å; L1341-L1358 HydrophobicContact CD2-CG 4.35Å; L1345-L1358 HydrophobicContact CB-CD2 3.68Å; L1345-L1358 HydrophobicContact CD1-CD2 3.81Å; L1345-L1358 HydrophobicContact CG-CD2 4.26Å; S1356-L1358 PolarHBondContact O-N 3.48Å; S1356-L1358 PolarHBondContact OG-N 2.67Å; L1358-Y1361 PolarHBondContact O-N 2.87Å; L1358-V1362 HydrophobicContact CD2-CG2 4.26Å; L1358-V1362 WeakPolarHBondContact O-CG2 3.45Å; L1358-V1362 PolarHBondContact O-N 3.36Å
1359	E	84.3	Confident	79.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-47.4	175.2	-177.7	-177.4	178.6	0	0	111.3	L1345 L1350 F1355 S1356 Y1361 V1362 Y1363 R1415	L1345-E1359 HydrophobicContact CD1-CB 3.66Å; L1345-E1359 HydrophobicContact CD1-CG 4.08Å; L1345-E1359 HydrophobicContact CD2-CG 4.43Å; L1350-E1359 HydrophobicContact CD2-CB 4.5Å; F1355-E1359 WeakPolarHBondContact CA-OE2 3.49Å; F1355-E1359 WeakPolarHBondContact CD1-OE1 3.4Å; S1356-E1359 PolarHBondContact N-OE2 3.14Å; S1356-E1359 WeakPolarHBondContact O-CB 3.24Å; S1356-E1359 PolarHBondContact O-N 2.89Å; E1359-Y1361 VanDerWaalsContact C-N 3.31Å; E1359-Y1361 PolarHBondContact O-N 2.87Å; E1359-V1362 PolarHBondContact O-N 2.73Å; E1359-Y1363 HydrophobicContact CG-CD2 4.03Å; E1359-Y1363 HydrophobicContact CG-CE1 4.02Å; E1359-Y1363 HydrophobicContact CG-CE2 3.36Å; E1359-Y1363 WeakPolarHBondContact CG-OH 3.32Å; E1359-Y1363 VanDerWaalsContact O-CG 3.27Å; E1359-Y1363 PolarHBondContact O-N 3.28Å; E1359-Y1363 VanDerWaalsContact OE1-CE2 3.25Å; E1359-Y1363 WeakPolarHBondContact OE1-CE2 3.4Å; E1359-Y1363 PolarHBondContact OE1-OH 3.43Å; E1359-R1415 IonicContact OE1-CZ 3.88Å; E1359-R1415 IonicContact OE1-NE 2.65Å; E1359-R1415 PolarHBondContact OE1-NE 3.21Å; E1359-R1415 IonicContact OE1-NH2 2.68Å; E1359-R1415 PolarHBondContact OE1-NH2 3.01Å; E1359-R1415 IonicContact OE2-CZ 3.34Å; E1359-R1415 IonicContact OE2-NE 3.4Å; E1359-R1415 IonicContact OE2-NH2 3.93Å; E1359-R1415 PolarHBondContact OE2-NH2 2.93Å; E1359-R1415 VanDerWaalsContact OE2-NH2 3.16Å
1360	L	83.3	Confident	80.5	Confident	101 Å²	101	57.1 Å²	57.1	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-60.3	-38	176.1	-176.4	63.3	0	0	0	112.6	S1356 L1364	S1356-L1360 PolarHBondContact O-N 3.28Å; L1360-L1364 VanDerWaalsContact O-CB 3.31Å; L1360-L1364 WeakPolarHBondContact O-CB 3.42Å; L1360-L1364 PolarHBondContact O-N 3.11Å
1361	Y	84.4	Confident	81.3	Confident	79 Å²	79	58.4 Å²	58.4	31%	0.31	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-46.9	175.8	176	-93.2	0	0	0	112.2	L1341 F1357 L1358 E1359 Y1363 L1364 H1365	L1341-Y1361 HydrophobicContact CD1-CD1 3.87Å; L1341-Y1361 HydrophobicContact CD1-CE1 3.54Å; F1357-Y1361 PolarHBondContact O-N 2.74Å; L1358-Y1361 PolarHBondContact O-N 2.87Å; E1359-Y1361 VanDerWaalsContact C-N 3.31Å; E1359-Y1361 PolarHBondContact O-N 2.87Å; Y1361-Y1363 PolarHBondContact O-N 3.41Å; Y1361-L1364 PolarHBondContact O-N 3.4Å; Y1361-H1365 PolarHBondContact O-N 2.93Å
1362	V	86.7	Confident	81.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-61.6	-43.8	177.9	171.6	0	0	0	0	110.7	F1338 L1341 F1342 L1345 L1358 E1359 H1365 I1366	F1338-V1362 HydrophobicContact CE2-CG1 4.08Å; L1341-V1362 HydrophobicContact CB-CG2 4.33Å; F1342-V1362 HydrophobicContact CB-CG1 4.2Å; F1342-V1362 HydrophobicContact CD2-CG1 3.79Å; F1342-V1362 HydrophobicContact CE2-CG1 4.31Å; F1342-V1362 HydrophobicContact CG-CG1 3.93Å; L1345-V1362 HydrophobicContact CD2-CB 3.97Å; L1345-V1362 HydrophobicContact CD2-CG1 3.89Å; L1345-V1362 HydrophobicContact CD2-CG2 4.18Å; L1358-V1362 HydrophobicContact CD2-CG2 4.26Å; L1358-V1362 WeakPolarHBondContact O-CG2 3.45Å; L1358-V1362 PolarHBondContact O-N 3.36Å; E1359-V1362 PolarHBondContact O-N 2.73Å; V1362-H1365 PolarHBondContact O-N 2.87Å; V1362-I1366 HydrophobicContact CG1-CD1 3.89Å; V1362-I1366 WeakPolarHBondContact O-CG1 3.47Å; V1362-I1366 PolarHBondContact O-N 3.37Å
1363	Y	87.6	Confident	82.5	Confident	18 Å²	18	54.9 Å²	54.9	7%	0.071	27%	0.271	C	S	.	.	H	α-helix	trans	-66.8	-37.5	178.1	-63.7	-7.5	0	0	0	112.7	L1345 F1355 E1359 Y1361 L1367 I1412 R1415 L1432	L1345-Y1363 HydrophobicContact CD2-CE1 4.18Å; F1355-Y1363 HydrophobicContact CD1-CE2 4.45Å; F1355-Y1363 HydrophobicContact CE1-CE2 4.34Å; E1359-Y1363 HydrophobicContact CG-CD2 4.03Å; E1359-Y1363 HydrophobicContact CG-CE1 4.02Å; E1359-Y1363 HydrophobicContact CG-CE2 3.36Å; E1359-Y1363 WeakPolarHBondContact CG-OH 3.32Å; E1359-Y1363 VanDerWaalsContact O-CG 3.27Å; E1359-Y1363 PolarHBondContact O-N 3.28Å; E1359-Y1363 VanDerWaalsContact OE1-CE2 3.25Å; E1359-Y1363 WeakPolarHBondContact OE1-CE2 3.4Å; E1359-Y1363 PolarHBondContact OE1-OH 3.43Å; Y1361-Y1363 PolarHBondContact O-N 3.41Å; Y1363-L1367 WeakPolarHBondContact O-CB 3.35Å; Y1363-L1367 PolarHBondContact O-N 3.46Å; Y1363-I1412 HydrophobicContact CD1-CD1 3.66Å; Y1363-I1412 HydrophobicContact CD1-CG1 3.54Å; Y1363-I1412 HydrophobicContact CD2-CG1 4.16Å; Y1363-I1412 HydrophobicContact CD2-CG2 3.91Å; Y1363-I1412 HydrophobicContact CE1-CD1 4.33Å; Y1363-I1412 HydrophobicContact CE1-CG1 3.71Å; Y1363-I1412 HydrophobicContact CE2-CG1 4.3Å; Y1363-I1412 HydrophobicContact CE2-CG2 4.18Å; Y1363-I1412 HydrophobicContact CG-CD1 3.78Å; Y1363-I1412 HydrophobicContact CG-CG1 3.8Å; Y1363-I1412 HydrophobicContact CG-CG2 4.24Å; Y1363-R1415 HydrophobicContact CE2-CG 4.49Å; Y1363-R1415 WeakPolarHBondContact OH-CG 3.4Å; Y1363-L1432 HydrophobicContact CE1-CD1 4.24Å; Y1363-L1432 HydrophobicContact CE1-CD2 4.32Å; Y1363-L1432 WeakPolarHBondContact OH-CD1 3.29Å
1364	L	85.1	Confident	82.9	Confident	78 Å²	78	54.2 Å²	54.2	41%	0.408	26%	0.262	S	S	.	.	H	α-helix	trans	-63.5	-43	172.8	-174.2	152.6	0	0	0	111	L1360 Y1361 L1367 T1368 P1597	L1360-L1364 VanDerWaalsContact O-CB 3.31Å; L1360-L1364 WeakPolarHBondContact O-CB 3.42Å; L1360-L1364 PolarHBondContact O-N 3.11Å; Y1361-L1364 PolarHBondContact O-N 3.4Å; L1364-L1367 PolarHBondContact O-N 3.02Å; L1364-T1368 HydrophobicContact CD2-CG2 4.03Å; L1364-T1368 WeakPolarHBondContact O-CG2 3.36Å; L1364-T1368 PolarHBondContact O-N 2.91Å; L1364-T1368 PolarHBondContact O-OG1 3.08Å; L1364-T1368 VanDerWaalsContact O-OG1 3.12Å; L1364-P1597 HydrophobicContact CD2-CB 4.06Å
1365	H	83.2	Confident	82.9	Confident	4 Å²	4	52 Å²	52	2%	0.019	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-50.3	178	-163.9	111.4	0	0	0	111.5	F1338 Y1361 V1362 L1367 T1368 Y1369	F1338-H1365 HydrophobicContact CD2-CB 3.68Å; F1338-H1365 AromaticContact CD2-CD2 3.41Å; F1338-H1365 VanDerWaalsContact CD2-CD2 3.41Å; F1338-H1365 WeakPolarHBondContact CD2-CD2 3.41Å; F1338-H1365 AromaticContact CD2-CG 3.36Å; F1338-H1365 AromaticContact CD2-ND1 3.84Å; F1338-H1365 AromaticContact CD2-NE2 3.95Å; F1338-H1365 HydrophobicContact CE2-CB 3.89Å; F1338-H1365 AromaticContact CE2-CD2 3.76Å; F1338-H1365 AromaticContact CE2-CG 3.89Å; F1338-H1365 AromaticContact CG-CD2 3.71Å; F1338-H1365 AromaticContact CG-CE1 3.98Å; F1338-H1365 AromaticContact CG-CG 3.96Å; F1338-H1365 AromaticContact CG-NE2 3.75Å; Y1361-H1365 PolarHBondContact O-N 2.93Å; V1362-H1365 PolarHBondContact O-N 2.87Å; H1365-L1367 VanDerWaalsContact C-N 3.32Å; H1365-L1367 PolarHBondContact O-N 3.45Å; H1365-T1368 WeakPolarHBondContact CA-OG1 3.35Å; H1365-T1368 PolarHBondContact O-N 2.92Å; H1365-T1368 VanDerWaalsContact O-N 3.17Å; H1365-T1368 PolarHBondContact O-OG1 2.68Å; H1365-Y1369 PolarHBondContact O-N 2.83Å
1366	I	87.4	Confident	82.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.3	-45.3	176.4	-68.9	165.3	0	0	0	110.9	F1338 F1342 V1362 Y1369 W1370 I1412 W1439	F1338-I1366 HydrophobicContact CE2-CG1 4Å; F1338-I1366 HydrophobicContact CZ-CD1 4.5Å; F1338-I1366 HydrophobicContact CZ-CG1 3.97Å; F1342-I1366 HydrophobicContact CE1-CD1 4.45Å; V1362-I1366 HydrophobicContact CG1-CD1 3.89Å; V1362-I1366 WeakPolarHBondContact O-CG1 3.47Å; V1362-I1366 PolarHBondContact O-N 3.37Å; I1366-Y1369 PolarHBondContact O-N 3.2Å; I1366-W1370 PolarHBondContact O-N 3.39Å; I1366-I1412 HydrophobicContact CD1-CD1 4.43Å; I1366-I1412 HydrophobicContact CG2-CD1 4.26Å; I1366-W1439 HydrophobicContact CB-CZ2 4.42Å; I1366-W1439 HydrophobicContact CG1-CZ2 3.88Å; I1366-W1439 HydrophobicContact CG2-CZ2 4.31Å
1367	L	86.7	Confident	82.4	Confident	88 Å²	88	45.7 Å²	45.7	46%	0.461	21%	0.212	S	C	.	.	H	α-helix	trans	-64.6	-41.1	177.9	-176.2	65	0	0	0	112.3	Y1363 L1364 H1365 W1370 L1371	Y1363-L1367 WeakPolarHBondContact O-CB 3.35Å; Y1363-L1367 PolarHBondContact O-N 3.46Å; L1364-L1367 PolarHBondContact O-N 3.02Å; H1365-L1367 VanDerWaalsContact C-N 3.32Å; H1365-L1367 PolarHBondContact O-N 3.45Å; L1367-W1370 HydrophobicContact CD1-CE3 4.25Å; L1367-L1371 WeakPolarHBondContact O-CG 3.43Å; L1367-L1371 PolarHBondContact O-N 2.67Å
1368	T	85	Confident	81.9	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-67.4	-35.5	176.9	49.5	0	0	0	0	113.4	L1364 H1365 L1371 D1372 P1596 I1600	L1364-T1368 HydrophobicContact CD2-CG2 4.03Å; L1364-T1368 WeakPolarHBondContact O-CG2 3.36Å; L1364-T1368 PolarHBondContact O-N 2.91Å; L1364-T1368 PolarHBondContact O-OG1 3.08Å; L1364-T1368 VanDerWaalsContact O-OG1 3.12Å; H1365-T1368 WeakPolarHBondContact CA-OG1 3.35Å; H1365-T1368 PolarHBondContact O-N 2.92Å; H1365-T1368 VanDerWaalsContact O-N 3.17Å; H1365-T1368 PolarHBondContact O-OG1 2.68Å; T1368-L1371 PolarHBondContact O-N 3.42Å; T1368-D1372 PolarHBondContact O-N 3.25Å; T1368-P1596 WeakPolarHBondContact CB-O 3.37Å; T1368-P1596 PolarHBondContact OG1-O 3.22Å; T1368-I1600 HydrophobicContact CG2-CD1 3.74Å; T1368-I1600 HydrophobicContact CG2-CG1 4Å
1369	Y	83.9	Confident	80.9	Confident	31 Å²	31	39.8 Å²	39.8	12%	0.122	19%	0.19	C	C	.	.	H	α-helix	trans	-69.2	-44	176.6	-174.3	-91.8	0	0	0	111.5	H1365 I1366 L1371 D1372 K1373 D1401 M1404 W1439 R1442 P1596	H1365-Y1369 PolarHBondContact O-N 2.83Å; I1366-Y1369 PolarHBondContact O-N 3.2Å; Y1369-L1371 VanDerWaalsContact C-N 3.33Å; Y1369-L1371 PolarHBondContact O-N 3.25Å; Y1369-D1372 PolarHBondContact O-N 2.7Å; Y1369-D1372 VanDerWaalsContact O-N 3.08Å; Y1369-K1373 HydrophobicContact CD1-CG 4.48Å; Y1369-K1373 HydrophobicContact CE1-CG 4.18Å; Y1369-K1373 PolarHBondContact O-N 2.66Å; Y1369-D1401 HydrophobicContact CE1-CB 4.39Å; Y1369-D1401 VanDerWaalsContact CE1-OD1 3.26Å; Y1369-D1401 WeakPolarHBondContact CE1-OD1 3.26Å; Y1369-D1401 PolarHBondContact OH-OD1 2.88Å; Y1369-D1401 PolarHBondContact OH-OD2 3.06Å; Y1369-D1401 VanDerWaalsContact OH-OD2 3.08Å; Y1369-M1404 HydrophobicContact CE1-CE 4.07Å; Y1369-W1439 AromaticContact CD1-CH2 3.52Å; Y1369-W1439 HydrophobicContact CD1-CH2 3.52Å; Y1369-W1439 HydrophobicContact CD1-CZ2 4.42Å; Y1369-W1439 HydrophobicContact CD1-CZ3 4.17Å; Y1369-W1439 HydrophobicContact CD2-CH2 4.47Å; Y1369-W1439 AromaticContact CE1-CH2 3.94Å; Y1369-W1439 HydrophobicContact CE1-CH2 3.94Å; Y1369-W1439 HydrophobicContact CE1-CZ3 4.23Å; Y1369-W1439 AromaticContact CG-CH2 3.8Å; Y1369-W1439 HydrophobicContact CG-CH2 3.8Å; Y1369-W1439 HydrophobicContact CG-CZ3 4.32Å; Y1369-R1442 PolarHBondContact OH-NE 2.92Å; Y1369-R1442 VanDerWaalsContact OH-NE 3.17Å; Y1369-P1596 HydrophobicContact CD2-CG 4.44Å
1370	W	85.5	Confident	79.6	Confident	77 Å²	77	39.8 Å²	39.8	29%	0.292	19%	0.19	S	C	.	.	H	α-helix	trans	-61	-40.8	173.9	-179	64.2	0	0	0	112.6	I1366 L1367 D1372 K1373 F1374 C1405 I1409	I1366-W1370 PolarHBondContact O-N 3.39Å; L1367-W1370 HydrophobicContact CD1-CE3 4.25Å; W1370-D1372 VanDerWaalsContact C-N 3.33Å; W1370-D1372 PolarHBondContact O-N 3.46Å; W1370-K1373 PolarHBondContact O-N 3.38Å; W1370-F1374 PolarHBondContact O-N 2.8Å; W1370-F1374 VanDerWaalsContact O-N 3.07Å; W1370-C1405 HydrophobicContact CB-CB 4.03Å; W1370-C1405 HydrophobicContact CG-CB 4.05Å; W1370-I1409 HydrophobicContact CB-CD1 4.25Å; W1370-I1409 HydrophobicContact CD2-CD1 3.76Å; W1370-I1409 HydrophobicContact CE3-CD1 4.1Å; W1370-I1409 HydrophobicContact CG-CD1 3.82Å
1371	L	83	Confident	78	Confident	53 Å²	53	37.3 Å²	37.3	28%	0.277	18%	0.18	S	C	.	.	H	α-helix	trans	-60.1	-43.5	172	-75.6	172.2	0	0	0	111.2	L1367 T1368 Y1369 F1374 R1375 W1603	L1367-L1371 WeakPolarHBondContact O-CG 3.43Å; L1367-L1371 PolarHBondContact O-N 2.67Å; T1368-L1371 PolarHBondContact O-N 3.42Å; Y1369-L1371 VanDerWaalsContact C-N 3.33Å; Y1369-L1371 PolarHBondContact O-N 3.25Å; L1371-F1374 CarbonylContact O-C 3.41Å; L1371-F1374 WeakPolarHBondContact O-CA 3.29Å; L1371-F1374 VanDerWaalsContact O-CB 3.25Å; L1371-F1374 WeakPolarHBondContact O-CB 3.46Å; L1371-F1374 PolarHBondContact O-N 2.87Å; L1371-R1375 PolarHBondContact O-N 3.34Å; L1371-W1603 HydrophobicContact CB-CH2 4.03Å; L1371-W1603 HydrophobicContact CB-CZ2 4.06Å; L1371-W1603 HydrophobicContact CD2-CH2 4.33Å; L1371-W1603 WeakPolarHBondContact O-CH2 3.4Å; L1371-W1603 WeakPolarHBondContact O-CZ2 3Å
1372	D	78.1	Confident	76.5	Confident	18 Å²	18	34.3 Å²	34.3	10%	0.096	17%	0.173	C	C	.	.	H	α-helix	trans	-69.6	-34.5	-178.1	-151.6	60.2	0	0	0	113.8	T1368 Y1369 W1370 F1374 R1375 E1376 I1599 W1603	T1368-D1372 PolarHBondContact O-N 3.25Å; Y1369-D1372 PolarHBondContact O-N 2.7Å; Y1369-D1372 VanDerWaalsContact O-N 3.08Å; W1370-D1372 VanDerWaalsContact C-N 3.33Å; W1370-D1372 PolarHBondContact O-N 3.46Å; D1372-F1374 VanDerWaalsContact C-N 3.26Å; D1372-F1374 PolarHBondContact O-N 3.04Å; D1372-R1375 WeakPolarHBondContact O-CA 3.46Å; D1372-R1375 WeakPolarHBondContact O-CB 3.45Å; D1372-R1375 PolarHBondContact O-N 2.71Å; D1372-R1375 IonicContact OD1-CZ 2.85Å; D1372-R1375 IonicContact OD1-NE 2.66Å; D1372-R1375 PolarHBondContact OD1-NE 2.66Å; D1372-R1375 IonicContact OD1-NH2 3.34Å; D1372-R1375 IonicContact OD2-CZ 2.74Å; D1372-R1375 IonicContact OD2-NE 3.01Å; D1372-R1375 IonicContact OD2-NH2 3.95Å; D1372-R1375 PolarHBondContact OD2-NH2 2.78Å; D1372-E1376 PolarHBondContact O-N 3.42Å; D1372-I1599 HydrophobicContact CB-CD1 3.96Å; D1372-I1599 VanDerWaalsContact OD1-CD1 3.23Å; D1372-I1599 WeakPolarHBondContact OD1-CD1 3.04Å; D1372-I1599 WeakPolarHBondContact OD2-CD1 3.47Å; D1372-W1603 PolarHBondContact OD1-NE1 2.83Å
1373	K	80.2	Confident	74.9	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-34.6	166.4	-71.4	-60.4	-175.2	170.5	0	112.6	Y1369 W1370 E1376 V1377 N1398 D1401 M1402	Y1369-K1373 HydrophobicContact CD1-CG 4.48Å; Y1369-K1373 HydrophobicContact CE1-CG 4.18Å; Y1369-K1373 PolarHBondContact O-N 2.66Å; W1370-K1373 PolarHBondContact O-N 3.38Å; K1373-E1376 WeakPolarHBondContact CD-OE2 3.34Å; K1373-E1376 WeakPolarHBondContact CE-OE2 3.34Å; K1373-E1376 IonicContact NZ-OE1 3.63Å; K1373-E1376 IonicContact NZ-OE2 3.4Å; K1373-E1376 PolarHBondContact NZ-OE2 2.84Å; K1373-E1376 WeakPolarHBondContact O-CB 3.18Å; K1373-E1376 PolarHBondContact O-N 2.71Å; K1373-V1377 WeakPolarHBondContact O-CG2 3.38Å; K1373-V1377 PolarHBondContact O-N 3.11Å; K1373-V1377 VanDerWaalsContact O-N 3.09Å; K1373-N1398 PolarHBondContact NZ-OD1 3Å; K1373-D1401 WeakPolarHBondContact CE-OD2 3.48Å; K1373-D1401 HydrophobicContact CG-CB 4.42Å; K1373-D1401 IonicContact NZ-OD2 3.4Å; K1373-D1401 PolarHBondContact NZ-OD2 2.68Å; K1373-M1402 HydrophobicContact CB-SD 4.17Å
1374	F	78.6	Confident	73.9	Confident	110 Å²	110	36.4 Å²	36.4	48%	0.482	19%	0.19	S	C	.	.	H	α-helix	trans	-67.1	-34.3	169.4	-164.5	-89.9	0	0	0	113.3	W1370 L1371 D1372 T1378	W1370-F1374 PolarHBondContact O-N 2.8Å; W1370-F1374 VanDerWaalsContact O-N 3.07Å; L1371-F1374 CarbonylContact O-C 3.41Å; L1371-F1374 WeakPolarHBondContact O-CA 3.29Å; L1371-F1374 VanDerWaalsContact O-CB 3.25Å; L1371-F1374 WeakPolarHBondContact O-CB 3.46Å; L1371-F1374 PolarHBondContact O-N 2.87Å; D1372-F1374 VanDerWaalsContact C-N 3.26Å; D1372-F1374 PolarHBondContact O-N 3.04Å; F1374-T1378 HydrophobicContact CD1-CG2 4.24Å; F1374-T1378 HydrophobicContact CE1-CG2 4.01Å; F1374-T1378 WeakPolarHBondContact O-CG2 3.45Å; F1374-T1378 PolarHBondContact O-N 2.76Å
1375	R	75.5	Confident	73	Confident	38 Å²	38	39.5 Å²	39.5	14%	0.143	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-48	169.9	171.6	-169.3	66.6	83.4	9.5	110.6	L1371 D1372 V1377 T1378 L1379 W1603	L1371-R1375 PolarHBondContact O-N 3.34Å; D1372-R1375 WeakPolarHBondContact O-CA 3.46Å; D1372-R1375 WeakPolarHBondContact O-CB 3.45Å; D1372-R1375 PolarHBondContact O-N 2.71Å; D1372-R1375 IonicContact OD1-CZ 2.85Å; D1372-R1375 IonicContact OD1-NE 2.66Å; D1372-R1375 PolarHBondContact OD1-NE 2.66Å; D1372-R1375 IonicContact OD1-NH2 3.34Å; D1372-R1375 IonicContact OD2-CZ 2.74Å; D1372-R1375 IonicContact OD2-NE 3.01Å; D1372-R1375 IonicContact OD2-NH2 3.95Å; D1372-R1375 PolarHBondContact OD2-NH2 2.78Å; R1375-V1377 VanDerWaalsContact C-N 3.33Å; R1375-V1377 PolarHBondContact O-N 2.59Å; R1375-T1378 WeakPolarHBondContact O-CA 3.14Å; R1375-T1378 PolarHBondContact O-N 3.39Å; R1375-T1378 PolarHBondContact O-OG1 3.08Å; R1375-L1379 HydrophobicContact CG-CD1 3.71Å; R1375-L1379 HydrophobicContact CG-CG 4.15Å; R1375-L1379 PolarHBondContact O-N 2.82Å; R1375-W1603 HydrophobicContact CB-CH2 4.27Å; R1375-W1603 HydrophobicContact CB-CZ2 3.52Å
1376	E	73	Confident	72.6	Confident	5 Å²	5	46 Å²	46	2%	0.023	23%	0.231	C	C	.	.	H	α-helix	trans	-48.9	-52.5	176.8	-107.1	-172.1	-164.3	0	0	110.7	Y1198 D1372 K1373 T1378 L1379 N1380 H1392 R1591	Y1198-E1376 HydrophobicContact CE1-CG 4.15Å; Y1198-E1376 HydrophobicContact CE2-CB 4.32Å; Y1198-E1376 VanDerWaalsContact CE2-CD 3.45Å; Y1198-E1376 HydrophobicContact CE2-CG 3.71Å; Y1198-E1376 VanDerWaalsContact CZ-CG 3.42Å; Y1198-E1376 VanDerWaalsContact OH-CA 3.3Å; Y1198-E1376 WeakPolarHBondContact OH-CA 3.49Å; Y1198-E1376 WeakPolarHBondContact OH-CB 3.24Å; Y1198-E1376 VanDerWaalsContact OH-CG 3.29Å; Y1198-E1376 WeakPolarHBondContact OH-CG 3.41Å; Y1198-E1376 PolarHBondContact OH-O 3.18Å; D1372-E1376 PolarHBondContact O-N 3.42Å; K1373-E1376 WeakPolarHBondContact CD-OE2 3.34Å; K1373-E1376 WeakPolarHBondContact CE-OE2 3.34Å; K1373-E1376 IonicContact NZ-OE1 3.63Å; K1373-E1376 IonicContact NZ-OE2 3.4Å; K1373-E1376 PolarHBondContact NZ-OE2 2.84Å; K1373-E1376 WeakPolarHBondContact O-CB 3.18Å; K1373-E1376 PolarHBondContact O-N 2.71Å; E1376-T1378 VanDerWaalsContact C-N 3.31Å; E1376-T1378 PolarHBondContact O-N 2.77Å; E1376-L1379 PolarHBondContact O-N 2.7Å; E1376-N1380 PolarHBondContact O-N 3.42Å; E1376-N1380 PolarHBondContact O-OD1 3.2Å; E1376-N1380 VanDerWaalsContact O-OD1 3.05Å; E1376-H1392 IonicContact OE2-CE1 3.11Å; E1376-R1591 IonicContact OE1-CZ 3.47Å; E1376-R1591 IonicContact OE1-NE 3.87Å; E1376-R1591 PolarHBondContact OE1-NE 3.45Å; E1376-R1591 IonicContact OE1-NH2 3.97Å; E1376-R1591 PolarHBondContact OE1-NH2 2.72Å; E1376-R1591 IonicContact OE2-NH2 2.8Å
1377	V	75.2	Confident	71.6	Confident	8 Å²	8	50.7 Å²	50.7	5%	0.048	25%	0.253	C	S	.	.	H	α-helix	trans	-55.2	-38.6	172.7	170.8	0	0	0	0	113.6	K1373 R1375 N1380 F1389 H1392	K1373-V1377 WeakPolarHBondContact O-CG2 3.38Å; K1373-V1377 PolarHBondContact O-N 3.11Å; K1373-V1377 VanDerWaalsContact O-N 3.09Å; R1375-V1377 VanDerWaalsContact C-N 3.33Å; R1375-V1377 PolarHBondContact O-N 2.59Å; V1377-N1380 WeakPolarHBondContact O-CB 3.47Å; V1377-F1389 HydrophobicContact CG1-CB 4.38Å; V1377-F1389 HydrophobicContact CG1-CD2 3.82Å; V1377-F1389 HydrophobicContact CG2-CD2 4.02Å; V1377-F1389 HydrophobicContact CG2-CE2 4.4Å; V1377-H1392 HydrophobicContact CG2-CB 3.89Å; V1377-H1392 WeakPolarHBondContact CG2-CD2 3.26Å; V1377-H1392 VanDerWaalsContact CG2-CG 3.48Å
1378	T	69.2	Low	70.9	Confident	49 Å²	49	47.4 Å²	47.4	30%	0.301	24%	0.235	S	C	.	.	H	α-helix	trans	-75.3	-31.3	-177.6	61.2	0	0	0	0	113.8	F1374 R1375 E1376 K1388	F1374-T1378 HydrophobicContact CD1-CG2 4.24Å; F1374-T1378 HydrophobicContact CE1-CG2 4.01Å; F1374-T1378 WeakPolarHBondContact O-CG2 3.45Å; F1374-T1378 PolarHBondContact O-N 2.76Å; R1375-T1378 WeakPolarHBondContact O-CA 3.14Å; R1375-T1378 PolarHBondContact O-N 3.39Å; R1375-T1378 PolarHBondContact O-OG1 3.08Å; E1376-T1378 VanDerWaalsContact C-N 3.31Å; E1376-T1378 PolarHBondContact O-N 2.77Å; T1378-K1388 PolarHBondContact O-NZ 2.98Å
1379	L	63.1	Low	70.4	Confident	70 Å²	70	51.3 Å²	51.3	37%	0.366	25%	0.252	S	S	.	.	H	α-helix	trans	-77.1	-26.5	-178.6	-70	174.1	0	0	0	113.1	A1202 R1375 E1376	A1202-L1379 CarbonylContact C-O 3.55Å; A1202-L1379 VanDerWaalsContact C-O 3.32Å; A1202-L1379 WeakPolarHBondContact CA-O 3.21Å; R1375-L1379 HydrophobicContact CG-CD1 3.71Å; R1375-L1379 HydrophobicContact CG-CG 4.15Å; R1375-L1379 PolarHBondContact O-N 2.82Å; E1376-L1379 PolarHBondContact O-N 2.7Å
1380	N	57.9	Low	69.9	Low	1 Å²	1	52.6 Å²	52.6	1%	0.005	27%	0.268	C	S	.	.	S	Bend	trans	-38.7	154.1	176.2	-81.6	7.6	0	0	0	115.8	H1197 Y1198 E1376 V1377 K1388	H1197-N1380 PolarHBondContact CE1-ND2 3.18Å; H1197-N1380 PolarHBondContact CE1-OD1 2.83Å; H1197-N1380 PolarHBondContact NE2-ND2 2.96Å; Y1198-N1380 VanDerWaalsContact CE1-OD1 3.22Å; Y1198-N1380 WeakPolarHBondContact CE1-OD1 3.4Å; Y1198-N1380 PolarHBondContact OH-OD1 3.02Å; E1376-N1380 PolarHBondContact O-N 3.42Å; E1376-N1380 PolarHBondContact O-OD1 3.2Å; E1376-N1380 VanDerWaalsContact O-OD1 3.05Å; V1377-N1380 WeakPolarHBondContact O-CB 3.47Å; N1380-K1388 HydrophobicContact CB-CB 3.95Å; N1380-K1388 HydrophobicContact CB-CD 4.06Å; N1380-K1388 HydrophobicContact CB-CG 3.93Å; N1380-K1388 PolarHBondContact ND2-O 2.83Å; N1380-K1388 WeakPolarHBondContact O-CD 3.33Å; N1380-K1388 WeakPolarHBondContact O-CE 3.41Å; N1380-K1388 PolarHBondContact O-NZ 2.79Å
1381	P	49.4	Very low	69	Low	48 Å²	48	50 Å²	50	31%	0.312	26%	0.261	S	S	.	.			trans	-72.8	142.7	170.8	33.1	-29.5	0	0	0	109.7	V1201 K1388	V1201-P1381 HydrophobicContact CB-CB 3.8Å; V1201-P1381 HydrophobicContact CB-CG 4.2Å; V1201-P1381 HydrophobicContact CG1-CB 3.71Å; V1201-P1381 VanDerWaalsContact O-CB 3.24Å; V1201-P1381 WeakPolarHBondContact O-CB 3.4Å; V1201-P1381 WeakPolarHBondContact O-CD 3.48Å; V1201-P1381 WeakPolarHBondContact O-CG 3.46Å; P1381-K1388 WeakPolarHBondContact O-CG 3.42Å
1382	G	51.6	Low	68.6	Low	17 Å²	17	47.4 Å²	47.4	18%	0.175	25%	0.247	C	C	.	.			trans	156.3	140.3	169.8	0	0	0	0	0	114.7	T1384 K1388	G1382-T1384 VanDerWaalsContact C-N 3.26Å; G1382-T1384 PolarHBondContact O-N 2.66Å; G1382-K1388 WeakPolarHBondContact O-CE 3.43Å
1383	A	54.6	Low	68.5	Low	19 Å²	19	50 Å²	50	16%	0.157	26%	0.261	C	S	.	.	S	Bend	trans	-80.2	-6.2	178.2	0	0	0	0	0	113.1	K1158 Y1161	K1158-A1383 VanDerWaalsContact CE-O 3.28Å; K1158-A1383 WeakPolarHBondContact CE-O 3.15Å; K1158-A1383 PolarHBondContact NZ-O 2.9Å; Y1161-A1383 HydrophobicContact CD1-CB 4.44Å; Y1161-A1383 HydrophobicContact CD2-CB 4.38Å; Y1161-A1383 HydrophobicContact CE1-CB 3.89Å; Y1161-A1383 HydrophobicContact CE2-CB 3.81Å
1384	T	66.5	Low	68.1	Low	42 Å²	42	50.5 Å²	50.5	26%	0.258	27%	0.265	S	S	.	.	S	Bend	trans	-138.4	148.8	173.4	64.4	0	0	0	0	110.1	G1382 I1386 Q1387 K1388	G1382-T1384 VanDerWaalsContact C-N 3.26Å; G1382-T1384 PolarHBondContact O-N 2.66Å; T1384-I1386 VanDerWaalsContact C-N 3.26Å; T1384-I1386 PolarHBondContact O-N 3.36Å; T1384-Q1387 PolarHBondContact O-N 3.3Å; T1384-Q1387 WeakPolarHBondContact OG1-CB 3.41Å; T1384-Q1387 PolarHBondContact OG1-N 3.29Å; T1384-Q1387 VanDerWaalsContact OG1-N 3.1Å; T1384-K1388 PolarHBondContact O-N 3.47Å
1385	Y	66.3	Low	67.6	Low	143 Å²	143	45.8 Å²	45.8	56%	0.561	25%	0.247	S	C	*	.	H	α-helix	trans	-66.2	-29.7	174.3	-79.3	-70.5	0	0	0	112.3	K1388 F1389	Y1385-K1388 HydrophobicContact CD1-CD 4.38Å; Y1385-K1388 PolarHBondContact O-N 3.39Å; Y1385-F1389 VanDerWaalsContact O-CB 3.23Å; Y1385-F1389 WeakPolarHBondContact O-CB 3.45Å; Y1385-F1389 PolarHBondContact O-N 3.06Å
1386	I	74	Confident	67.6	Low	141 Å²	141	48.6 Å²	48.6	72%	0.723	26%	0.26	S	S	*	.	H	α-helix	trans	-65.7	-45.1	175.8	-59.9	172.5	0	0	0	110	T1384 F1389 A1390	T1384-I1386 VanDerWaalsContact C-N 3.26Å; T1384-I1386 PolarHBondContact O-N 3.36Å; I1386-F1389 PolarHBondContact O-N 3.23Å; I1386-A1390 WeakPolarHBondContact O-CB 3.41Å; I1386-A1390 PolarHBondContact O-N 3.01Å
1387	Q	67.5	Low	67.9	Low	99 Å²	99	50.7 Å²	50.7	46%	0.463	27%	0.268	S	S	.	.	H	α-helix	trans	-61.1	-50.6	173.6	-171.5	178.5	19.4	0	0	110.4	T1384 F1389 A1390 V1391	T1384-Q1387 PolarHBondContact O-N 3.3Å; T1384-Q1387 WeakPolarHBondContact OG1-CB 3.41Å; T1384-Q1387 PolarHBondContact OG1-N 3.29Å; T1384-Q1387 VanDerWaalsContact OG1-N 3.1Å; Q1387-F1389 PolarHBondContact O-N 3.45Å; Q1387-F1389 VanDerWaalsContact O-N 3.13Å; Q1387-A1390 PolarHBondContact O-N 3.38Å; Q1387-V1391 HydrophobicContact CG-CG2 4.26Å; Q1387-V1391 WeakPolarHBondContact O-CB 3.3Å; Q1387-V1391 WeakPolarHBondContact O-CG2 3.32Å; Q1387-V1391 PolarHBondContact O-N 3.3Å
1388	K	71.4	Confident	68.3	Low	19 Å²	19	50.5 Å²	50.5	8%	0.083	27%	0.267	C	S	.	.	H	α-helix	trans	-52.6	-35.7	175.3	-70.9	-167	-175.3	-143.3	0	113.3	T1378 N1380 P1381 G1382 T1384 Y1385 H1392	T1378-K1388 PolarHBondContact O-NZ 2.98Å; N1380-K1388 HydrophobicContact CB-CB 3.95Å; N1380-K1388 HydrophobicContact CB-CD 4.06Å; N1380-K1388 HydrophobicContact CB-CG 3.93Å; N1380-K1388 PolarHBondContact ND2-O 2.83Å; N1380-K1388 WeakPolarHBondContact O-CD 3.33Å; N1380-K1388 WeakPolarHBondContact O-CE 3.41Å; N1380-K1388 PolarHBondContact O-NZ 2.79Å; P1381-K1388 WeakPolarHBondContact O-CG 3.42Å; G1382-K1388 WeakPolarHBondContact O-CE 3.43Å; T1384-K1388 PolarHBondContact O-N 3.47Å; Y1385-K1388 HydrophobicContact CD1-CD 4.38Å; Y1385-K1388 PolarHBondContact O-N 3.39Å; K1388-H1392 PolarHBondContact O-N 3.44Å
1389	F	75.1	Confident	68.9	Low	84 Å²	84	49.7 Å²	49.7	37%	0.368	26%	0.263	S	S	.	.	H	α-helix	trans	-85.8	-39.5	-175.6	-172	-119.1	0	0	0	113.1	V1377 Y1385 I1386 Q1387 V1391 H1392 L1393 M1402	V1377-F1389 HydrophobicContact CG1-CB 4.38Å; V1377-F1389 HydrophobicContact CG1-CD2 3.82Å; V1377-F1389 HydrophobicContact CG2-CD2 4.02Å; V1377-F1389 HydrophobicContact CG2-CE2 4.4Å; Y1385-F1389 VanDerWaalsContact O-CB 3.23Å; Y1385-F1389 WeakPolarHBondContact O-CB 3.45Å; Y1385-F1389 PolarHBondContact O-N 3.06Å; I1386-F1389 PolarHBondContact O-N 3.23Å; Q1387-F1389 PolarHBondContact O-N 3.45Å; Q1387-F1389 VanDerWaalsContact O-N 3.13Å; F1389-V1391 VanDerWaalsContact C-N 3.28Å; F1389-V1391 PolarHBondContact O-N 3.16Å; F1389-H1392 PolarHBondContact O-N 2.99Å; F1389-H1392 VanDerWaalsContact O-N 3.08Å; F1389-L1393 HydrophobicContact CD1-CD1 3.88Å; F1389-L1393 HydrophobicContact CD1-CG 4.39Å; F1389-L1393 HydrophobicContact CE1-CD1 3.44Å; F1389-L1393 VanDerWaalsContact CE1-CD1 3.44Å; F1389-L1393 HydrophobicContact CE1-CG 4.1Å; F1389-L1393 HydrophobicContact CE2-CD1 4.44Å; F1389-L1393 HydrophobicContact CE2-CD2 4.41Å; F1389-L1393 HydrophobicContact CE2-CG 4.25Å; F1389-L1393 HydrophobicContact CZ-CD1 3.76Å; F1389-L1393 HydrophobicContact CZ-CD2 4.19Å; F1389-L1393 HydrophobicContact CZ-CG 4.02Å; F1389-L1393 WeakPolarHBondContact O-CG 3.23Å; F1389-L1393 PolarHBondContact O-N 3Å; F1389-M1402 HydrophobicContact CE2-CE 3.89Å; F1389-M1402 HydrophobicContact CZ-CE 4.43Å
1390	A	72.7	Confident	70	Confident	57 Å²	57	48.4 Å²	48.4	47%	0.471	25%	0.253	S	S	.	.	H	α-helix	trans	-61.6	-40	170.9	0	0	0	0	0	111.2	I1386 Q1387 H1392 L1393 S1394	I1386-A1390 WeakPolarHBondContact O-CB 3.41Å; I1386-A1390 PolarHBondContact O-N 3.01Å; Q1387-A1390 PolarHBondContact O-N 3.38Å; A1390-H1392 VanDerWaalsContact C-N 3.28Å; A1390-H1392 PolarHBondContact O-N 2.91Å; A1390-L1393 PolarHBondContact O-N 3.21Å; A1390-S1394 PolarHBondContact O-N 3.42Å; A1390-S1394 VanDerWaalsContact O-N 3.1Å; A1390-S1394 PolarHBondContact O-OG 3.16Å
1391	V	67.4	Low	71.4	Confident	22 Å²	22	48.4 Å²	48.4	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-32.3	171.7	164.9	0	0	0	0	112	N1196 H1197 Q1387 F1389 S1394	N1196-V1391 HydrophobicContact CB-CB 4.36Å; N1196-V1391 HydrophobicContact CB-CG1 3.65Å; H1197-V1391 PolarHBondContact CD2-O 3.08Å; H1197-V1391 PolarHBondContact NE2-O 2.75Å; H1197-V1391 VanDerWaalsContact NE2-O 3.15Å; Q1387-V1391 HydrophobicContact CG-CG2 4.26Å; Q1387-V1391 WeakPolarHBondContact O-CB 3.3Å; Q1387-V1391 WeakPolarHBondContact O-CG2 3.32Å; Q1387-V1391 PolarHBondContact O-N 3.3Å; F1389-V1391 VanDerWaalsContact C-N 3.28Å; F1389-V1391 PolarHBondContact O-N 3.16Å; V1391-S1394 PolarHBondContact O-OG 3.01Å; V1391-S1394 VanDerWaalsContact O-OG 3.11Å
1392	H	72.6	Confident	73.1	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-84.4	-31.7	174.6	-176.9	83	0	0	0	114.1	H1197 Y1198 E1376 V1377 K1388 F1389 A1390 S1394 N1398	H1197-H1392 AromaticContact CE1-CG 3.81Å; H1197-H1392 AromaticContact CE1-ND1 3.24Å; H1197-H1392 PolarHBondContact CE1-ND1 3.41Å; H1197-H1392 AromaticContact ND1-ND1 3.81Å; H1197-H1392 WeakPolarHBondContact NE2-CA 3.41Å; H1197-H1392 PolarHBondContact NE2-N 2.89Å; Y1198-H1392 PolarHBondContact OH-ND1 2.7Å; E1376-H1392 IonicContact OE2-CE1 3.11Å; V1377-H1392 HydrophobicContact CG2-CB 3.89Å; V1377-H1392 WeakPolarHBondContact CG2-CD2 3.26Å; V1377-H1392 VanDerWaalsContact CG2-CG 3.48Å; K1388-H1392 PolarHBondContact O-N 3.44Å; F1389-H1392 PolarHBondContact O-N 2.99Å; F1389-H1392 VanDerWaalsContact O-N 3.08Å; A1390-H1392 VanDerWaalsContact C-N 3.28Å; A1390-H1392 PolarHBondContact O-N 2.91Å; H1392-S1394 VanDerWaalsContact C-N 3.32Å; H1392-N1398 VanDerWaalsContact CE1-CG 3.42Å; H1392-N1398 PolarHBondContact CE1-OD1 3.25Å; H1392-N1398 WeakPolarHBondContact O-CB 3.42Å
1393	L	77.7	Confident	74.9	Confident	72 Å²	72	50.9 Å²	50.9	38%	0.377	26%	0.259	S	S	.	.	H	α-helix	trans	-77.9	-15.8	179.1	-75	-177.3	0	0	0	113.8	F1389 A1390 S1399	F1389-L1393 HydrophobicContact CD1-CD1 3.88Å; F1389-L1393 HydrophobicContact CD1-CG 4.39Å; F1389-L1393 HydrophobicContact CE1-CD1 3.44Å; F1389-L1393 VanDerWaalsContact CE1-CD1 3.44Å; F1389-L1393 HydrophobicContact CE1-CG 4.1Å; F1389-L1393 HydrophobicContact CE2-CD1 4.44Å; F1389-L1393 HydrophobicContact CE2-CD2 4.41Å; F1389-L1393 HydrophobicContact CE2-CG 4.25Å; F1389-L1393 HydrophobicContact CZ-CD1 3.76Å; F1389-L1393 HydrophobicContact CZ-CD2 4.19Å; F1389-L1393 HydrophobicContact CZ-CG 4.02Å; F1389-L1393 WeakPolarHBondContact O-CG 3.23Å; F1389-L1393 PolarHBondContact O-N 3Å; A1390-L1393 PolarHBondContact O-N 3.21Å; L1393-S1399 WeakPolarHBondContact O-CB 3.47Å
1394	S	70.5	Confident	76.5	Confident	16 Å²	16	50.1 Å²	50.1	11%	0.112	25%	0.252	C	S	.	.	H	α-helix	trans	-71.2	-47.5	178.4	18	0	0	0	0	110.8	I1193 P1194 S1195 N1196 A1390 V1391 H1392 F1396	I1193-S1394 VanDerWaalsContact CG2-CB 3.45Å; I1193-S1394 VanDerWaalsContact CG2-O 3.26Å; I1193-S1394 WeakPolarHBondContact CG2-O 3.25Å; P1194-S1394 WeakPolarHBondContact CA-O 3.24Å; S1195-S1394 WeakPolarHBondContact O-CB 3.31Å; S1195-S1394 PolarHBondContact O-OG 3.34Å; S1195-S1394 VanDerWaalsContact OG-CB 3.23Å; S1195-S1394 WeakPolarHBondContact OG-CB 3.47Å; N1196-S1394 PolarHBondContact ND2-OG 3.23Å; N1196-S1394 VanDerWaalsContact ND2-OG 3.12Å; A1390-S1394 PolarHBondContact O-N 3.42Å; A1390-S1394 VanDerWaalsContact O-N 3.1Å; A1390-S1394 PolarHBondContact O-OG 3.16Å; V1391-S1394 PolarHBondContact O-OG 3.01Å; V1391-S1394 VanDerWaalsContact O-OG 3.11Å; H1392-S1394 VanDerWaalsContact C-N 3.32Å; S1394-F1396 PolarHBondContact O-N 2.89Å; S1394-F1396 VanDerWaalsContact O-N 3.16Å
1395	A	68.5	Low	77.6	Confident	12 Å²	12	48.1 Å²	48.1	10%	0.099	24%	0.239	C	C	.	.	S	Bend	trans	-55.7	116.5	173.4	0	0	0	0	0	113.4	S1195 W1397 N1398 S1399	S1195-A1395 PolarHBondContact O-N 2.92Å; A1395-W1397 PolarHBondContact O-N 2.58Å; A1395-N1398 HydrophobicContact CB-CB 4.18Å; A1395-N1398 PolarHBondContact O-N 3.48Å; A1395-S1399 PolarHBondContact O-N 3.34Å
1396	F	76.4	Confident	78.7	Confident	97 Å²	97	45.5 Å²	45.5	43%	0.425	24%	0.235	S	C	.	.	H	α-helix	trans	-49.6	-46.2	-176.8	176	-95.3	0	0	0	114.2	P1194 S1394 N1398 S1399 Y1400	P1194-F1396 HydrophobicContact CB-CB 4.13Å; S1394-F1396 PolarHBondContact O-N 2.89Å; S1394-F1396 VanDerWaalsContact O-N 3.16Å; F1396-N1398 VanDerWaalsContact C-N 3.33Å; F1396-N1398 PolarHBondContact O-N 3.36Å; F1396-S1399 PolarHBondContact O-OG 3.38Å; F1396-S1399 VanDerWaalsContact O-OG 3.04Å; F1396-Y1400 VanDerWaalsContact O-CB 3.27Å; F1396-Y1400 WeakPolarHBondContact O-CB 3.48Å; F1396-Y1400 PolarHBondContact O-N 3.06Å
1397	W	79.2	Confident	79.5	Confident	48 Å²	48	41.5 Å²	41.5	18%	0.182	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-34.6	178.8	-76	133.8	0	0	0	113.1	A1395 D1401 L1444 E1445	A1395-W1397 PolarHBondContact O-N 2.58Å; W1397-D1401 WeakPolarHBondContact O-CB 3.14Å; W1397-D1401 PolarHBondContact O-N 2.69Å; W1397-L1444 HydrophobicContact CH2-CB 4.08Å; W1397-E1445 HydrophobicContact CD2-CB 4.37Å; W1397-E1445 HydrophobicContact CZ2-CB 4.14Å
1398	N	82	Confident	80.5	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.027	19%	0.193	C	C	.	.	H	α-helix	trans	-76.7	-37.7	-179.4	-73.8	-38.9	0	0	0	112.2	K1373 H1392 A1395 F1396 M1402	K1373-N1398 PolarHBondContact NZ-OD1 3Å; H1392-N1398 VanDerWaalsContact CE1-CG 3.42Å; H1392-N1398 PolarHBondContact CE1-OD1 3.25Å; H1392-N1398 WeakPolarHBondContact O-CB 3.42Å; A1395-N1398 HydrophobicContact CB-CB 4.18Å; A1395-N1398 PolarHBondContact O-N 3.48Å; F1396-N1398 VanDerWaalsContact C-N 3.33Å; F1396-N1398 PolarHBondContact O-N 3.36Å; N1398-M1402 WeakPolarHBondContact O-CB 3.37Å; N1398-M1402 VanDerWaalsContact O-CG 3.25Å; N1398-M1402 WeakPolarHBondContact O-CG 3.41Å; N1398-M1402 PolarHBondContact O-N 3.49Å
1399	S	82.7	Confident	81.4	Confident	31 Å²	31	37.7 Å²	37.7	22%	0.217	20%	0.198	C	C	.	.	H	α-helix	trans	-67	-40.9	170.9	59.3	0	0	0	0	111.6	L1393 A1395 F1396 M1402 I1403	L1393-S1399 WeakPolarHBondContact O-CB 3.47Å; A1395-S1399 PolarHBondContact O-N 3.34Å; F1396-S1399 PolarHBondContact O-OG 3.38Å; F1396-S1399 VanDerWaalsContact O-OG 3.04Å; S1399-M1402 PolarHBondContact O-N 3.4Å; S1399-I1403 VanDerWaalsContact O-CG1 3.31Å; S1399-I1403 WeakPolarHBondContact O-CG1 3.46Å; S1399-I1403 PolarHBondContact O-N 3.04Å
1400	Y	86.6	Confident	82.2	Confident	44 Å²	44	37.5 Å²	37.5	17%	0.173	20%	0.2	C	C	.	.	H	α-helix	trans	-57.6	-50.3	171.7	-174.2	-89	0	0	0	112.3	F1396 M1402 I1403 M1404 L1438 R1442	F1396-Y1400 VanDerWaalsContact O-CB 3.27Å; F1396-Y1400 WeakPolarHBondContact O-CB 3.48Å; F1396-Y1400 PolarHBondContact O-N 3.06Å; Y1400-M1402 VanDerWaalsContact C-N 3.31Å; Y1400-M1402 PolarHBondContact O-N 3.2Å; Y1400-I1403 PolarHBondContact O-N 3.36Å; Y1400-M1404 HydrophobicContact CE1-CB 4.29Å; Y1400-M1404 HydrophobicContact CE1-SD 3.98Å; Y1400-M1404 VanDerWaalsContact O-CB 3.29Å; Y1400-M1404 WeakPolarHBondContact O-CB 3.25Å; Y1400-M1404 PolarHBondContact O-N 2.8Å; Y1400-L1438 WeakPolarHBondContact OH-CA 3.16Å; Y1400-L1438 WeakPolarHBondContact OH-CB 3.31Å; Y1400-L1438 WeakPolarHBondContact OH-CD2 3.33Å; Y1400-L1438 PolarHBondContact OH-O 2.75Å; Y1400-R1442 HydrophobicContact CE1-CB 4.49Å
1401	D	86.6	Confident	83	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55.2	-45.9	177.1	-91.2	-42	0	0	0	112.1	Y1369 K1373 W1397 M1404 C1405 R1442	Y1369-D1401 HydrophobicContact CE1-CB 4.39Å; Y1369-D1401 VanDerWaalsContact CE1-OD1 3.26Å; Y1369-D1401 WeakPolarHBondContact CE1-OD1 3.26Å; Y1369-D1401 PolarHBondContact OH-OD1 2.88Å; Y1369-D1401 PolarHBondContact OH-OD2 3.06Å; Y1369-D1401 VanDerWaalsContact OH-OD2 3.08Å; K1373-D1401 WeakPolarHBondContact CE-OD2 3.48Å; K1373-D1401 HydrophobicContact CG-CB 4.42Å; K1373-D1401 IonicContact NZ-OD2 3.4Å; K1373-D1401 PolarHBondContact NZ-OD2 2.68Å; W1397-D1401 WeakPolarHBondContact O-CB 3.14Å; W1397-D1401 PolarHBondContact O-N 2.69Å; D1401-M1404 PolarHBondContact O-N 3.11Å; D1401-M1404 WeakPolarHBondContact OD1-CE 3.29Å; D1401-C1405 WeakPolarHBondContact O-CB 3.49Å; D1401-C1405 PolarHBondContact O-N 2.67Å; D1401-C1405 PolarHBondContact O-SG 3.27Å; D1401-R1442 WeakPolarHBondContact OD1-CD 3.24Å; D1401-R1442 IonicContact OD1-CZ 3.02Å; D1401-R1442 IonicContact OD1-NE 3.88Å; D1401-R1442 PolarHBondContact OD1-NE 3.25Å; D1401-R1442 IonicContact OD1-NH2 2.98Å; D1401-R1442 IonicContact OD2-CZ 2.72Å; D1401-R1442 IonicContact OD2-NE 3.75Å; D1401-R1442 PolarHBondContact OD2-NE 3.04Å; D1401-R1442 IonicContact OD2-NH2 3.6Å; D1401-R1442 PolarHBondContact OD2-NH2 3.49Å
1402	M	85.4	Confident	84	Confident	18 Å²	18	35.5 Å²	35.5	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-66.8	-39.4	-179.1	-71.6	-71.2	-95.4	0	0	111.9	K1373 F1389 N1398 S1399 Y1400 L1406	K1373-M1402 HydrophobicContact CB-SD 4.17Å; F1389-M1402 HydrophobicContact CE2-CE 3.89Å; F1389-M1402 HydrophobicContact CZ-CE 4.43Å; N1398-M1402 WeakPolarHBondContact O-CB 3.37Å; N1398-M1402 VanDerWaalsContact O-CG 3.25Å; N1398-M1402 WeakPolarHBondContact O-CG 3.41Å; N1398-M1402 PolarHBondContact O-N 3.49Å; S1399-M1402 PolarHBondContact O-N 3.4Å; Y1400-M1402 VanDerWaalsContact C-N 3.31Å; Y1400-M1402 PolarHBondContact O-N 3.2Å; M1402-L1406 WeakPolarHBondContact O-CB 3.22Å; M1402-L1406 WeakPolarHBondContact O-CD1 3.12Å; M1402-L1406 WeakPolarHBondContact O-CG 3.28Å; M1402-L1406 PolarHBondContact O-N 3.34Å
1403	I	88.8	Confident	84.8	Confident	100 Å²	100	39.4 Å²	39.4	51%	0.513	20%	0.2	S	C	.	.	H	α-helix	trans	-65	-47.5	173.5	-67.7	164.5	0	0	0	110.7	S1399 Y1400 C1405 L1406 L1407	S1399-I1403 VanDerWaalsContact O-CG1 3.31Å; S1399-I1403 WeakPolarHBondContact O-CG1 3.46Å; S1399-I1403 PolarHBondContact O-N 3.04Å; Y1400-I1403 PolarHBondContact O-N 3.36Å; I1403-C1405 PolarHBondContact O-N 2.98Å; I1403-L1406 PolarHBondContact O-N 2.76Å; I1403-L1407 HydrophobicContact CG2-CD1 3.86Å; I1403-L1407 HydrophobicContact CG2-CG 4.36Å; I1403-L1407 WeakPolarHBondContact O-CG 3.36Å; I1403-L1407 PolarHBondContact O-N 3.32Å
1404	M	89.3	Confident	85.4	Confident	2 Å²	2	38 Å²	38	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-58.4	-45.2	178.1	-179.9	-175.6	68.2	0	0	111.7	Y1369 Y1400 D1401 S1408 L1438 W1439 R1442	Y1369-M1404 HydrophobicContact CE1-CE 4.07Å; Y1400-M1404 HydrophobicContact CE1-CB 4.29Å; Y1400-M1404 HydrophobicContact CE1-SD 3.98Å; Y1400-M1404 VanDerWaalsContact O-CB 3.29Å; Y1400-M1404 WeakPolarHBondContact O-CB 3.25Å; Y1400-M1404 PolarHBondContact O-N 2.8Å; D1401-M1404 PolarHBondContact O-N 3.11Å; D1401-M1404 WeakPolarHBondContact OD1-CE 3.29Å; M1404-S1408 WeakPolarHBondContact O-CB 3.29Å; M1404-S1408 PolarHBondContact O-N 3.1Å; M1404-S1408 PolarHBondContact O-OG 2.78Å; M1404-L1438 HydrophobicContact CG-CB 4.25Å; M1404-W1439 HydrophobicContact CE-CD2 3.68Å; M1404-W1439 HydrophobicContact CE-CE3 3.59Å; M1404-W1439 HydrophobicContact CE-CG 4.46Å; M1404-W1439 HydrophobicContact CE-CH2 3.75Å; M1404-W1439 HydrophobicContact CE-CZ2 3.8Å; M1404-W1439 HydrophobicContact CE-CZ3 3.64Å; M1404-W1439 HydrophobicContact CG-CD2 4.14Å; M1404-W1439 HydrophobicContact CG-CG 4.11Å; M1404-W1439 HydrophobicContact SD-CB 4.26Å; M1404-W1439 HydrophobicContact SD-CD2 3.51Å; M1404-W1439 VanDerWaalsContact SD-CD2 3.51Å; M1404-W1439 HydrophobicContact SD-CE3 3.88Å; M1404-W1439 HydrophobicContact SD-CG 3.65Å; M1404-W1439 HydrophobicContact SD-CZ2 4.49Å; M1404-R1442 HydrophobicContact CE-CB 4.4Å; M1404-R1442 HydrophobicContact CE-CG 4.13Å; M1404-R1442 HydrophobicContact SD-CB 4.06Å; M1404-R1442 HydrophobicContact SD-CG 4.45Å
1405	C	88.2	Confident	86.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.8	-46.8	174.2	-73.6	0	0	0	0	112.4	W1370 D1401 I1403 S1408 I1409	W1370-C1405 HydrophobicContact CB-CB 4.03Å; W1370-C1405 HydrophobicContact CG-CB 4.05Å; D1401-C1405 WeakPolarHBondContact O-CB 3.49Å; D1401-C1405 PolarHBondContact O-N 2.67Å; D1401-C1405 PolarHBondContact O-SG 3.27Å; I1403-C1405 PolarHBondContact O-N 2.98Å; C1405-S1408 PolarHBondContact O-N 2.92Å; C1405-I1409 WeakPolarHBondContact O-CB 3.46Å; C1405-I1409 VanDerWaalsContact O-CG1 3.25Å; C1405-I1409 WeakPolarHBondContact O-CG1 3.06Å; C1405-I1409 PolarHBondContact O-N 3.42Å
1406	L	89.2	Confident	87	Confident	89 Å²	89	43.2 Å²	43.2	47%	0.466	21%	0.208	S	C	.	.	H	α-helix	trans	-62.6	-45.8	-179.6	-75	168.2	0	0	0	111.8	M1402 I1403 S1408 I1409 I1410	M1402-L1406 WeakPolarHBondContact O-CB 3.22Å; M1402-L1406 WeakPolarHBondContact O-CD1 3.12Å; M1402-L1406 WeakPolarHBondContact O-CG 3.28Å; M1402-L1406 PolarHBondContact O-N 3.34Å; I1403-L1406 PolarHBondContact O-N 2.76Å; L1406-S1408 VanDerWaalsContact C-N 3.33Å; L1406-S1408 PolarHBondContact O-N 3.37Å; L1406-I1409 PolarHBondContact O-N 2.93Å; L1406-I1410 WeakPolarHBondContact O-CD1 3.05Å; L1406-I1410 VanDerWaalsContact O-CG1 3.25Å; L1406-I1410 WeakPolarHBondContact O-CG1 3.26Å; L1406-I1410 PolarHBondContact O-N 2.96Å
1407	L	91	Very high	87.4	Confident	57 Å²	57	44.4 Å²	44.4	30%	0.298	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-41.9	174.9	-69.5	172.8	0	0	0	111.7	I1403 I1410 G1411 L1438	I1403-L1407 HydrophobicContact CG2-CD1 3.86Å; I1403-L1407 HydrophobicContact CG2-CG 4.36Å; I1403-L1407 WeakPolarHBondContact O-CG 3.36Å; I1403-L1407 PolarHBondContact O-N 3.32Å; L1407-I1410 PolarHBondContact O-N 3.01Å; L1407-G1411 PolarHBondContact O-N 3.31Å; L1407-L1438 HydrophobicContact CD1-CD1 3.7Å
1408	S	89.7	Confident	87.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-63.1	-43	176.7	-57.6	0	0	0	0	112	M1404 C1405 L1406 G1411 I1412 W1439	M1404-S1408 WeakPolarHBondContact O-CB 3.29Å; M1404-S1408 PolarHBondContact O-N 3.1Å; M1404-S1408 PolarHBondContact O-OG 2.78Å; C1405-S1408 PolarHBondContact O-N 2.92Å; L1406-S1408 VanDerWaalsContact C-N 3.33Å; L1406-S1408 PolarHBondContact O-N 3.37Å; S1408-G1411 WeakPolarHBondContact O-CA 3.29Å; S1408-G1411 PolarHBondContact O-N 3.03Å; S1408-I1412 WeakPolarHBondContact O-CG1 3.04Å; S1408-I1412 PolarHBondContact O-N 3.21Å; S1408-W1439 PolarHBondContact OG-NE1 3.25Å
1409	I	90.6	Very high	87.5	Confident	37 Å²	37	44.7 Å²	44.7	19%	0.19	22%	0.216	C	C	.	.	H	α-helix	trans	-65	-40	176.4	-70.6	164.4	0	0	0	110.8	W1370 C1405 L1406 G1411 I1412 I1413	W1370-I1409 HydrophobicContact CB-CD1 4.25Å; W1370-I1409 HydrophobicContact CD2-CD1 3.76Å; W1370-I1409 HydrophobicContact CE3-CD1 4.1Å; W1370-I1409 HydrophobicContact CG-CD1 3.82Å; C1405-I1409 WeakPolarHBondContact O-CB 3.46Å; C1405-I1409 VanDerWaalsContact O-CG1 3.25Å; C1405-I1409 WeakPolarHBondContact O-CG1 3.06Å; C1405-I1409 PolarHBondContact O-N 3.42Å; L1406-I1409 PolarHBondContact O-N 2.93Å; I1409-G1411 VanDerWaalsContact C-N 3.32Å; I1409-G1411 PolarHBondContact O-N 2.76Å; I1409-I1412 PolarHBondContact O-N 2.95Å; I1409-I1413 HydrophobicContact CG2-CD1 3.79Å; I1409-I1413 HydrophobicContact CG2-CG1 4.48Å; I1409-I1413 WeakPolarHBondContact O-CB 3.08Å; I1409-I1413 VanDerWaalsContact O-CG1 3.27Å; I1409-I1413 WeakPolarHBondContact O-CG1 3.16Å; I1409-I1413 PolarHBondContact O-N 3Å
1410	I	91.4	Very high	87.3	Confident	80 Å²	80	48.4 Å²	48.4	41%	0.41	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-39.4	172.8	-65	161.7	0	0	0	110.5	L1406 L1407 I1413 L1414 L1431	L1406-I1410 WeakPolarHBondContact O-CD1 3.05Å; L1406-I1410 VanDerWaalsContact O-CG1 3.25Å; L1406-I1410 WeakPolarHBondContact O-CG1 3.26Å; L1406-I1410 PolarHBondContact O-N 2.96Å; L1407-I1410 PolarHBondContact O-N 3.01Å; I1410-I1413 PolarHBondContact O-N 3.25Å; I1410-L1414 HydrophobicContact CG2-CD1 4.09Å; I1410-L1414 HydrophobicContact CG2-CG 4.33Å; I1410-L1414 WeakPolarHBondContact O-CB 2.99Å; I1410-L1414 WeakPolarHBondContact O-CG 3.42Å; I1410-L1414 PolarHBondContact O-N 3.29Å; I1410-L1431 HydrophobicContact CB-CD2 4.11Å; I1410-L1431 HydrophobicContact CG2-CD2 3.67Å
1411	G	88.9	Confident	86.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-46.4	172	0	0	0	0	0	112.9	L1407 S1408 I1409 L1414 R1415	L1407-G1411 PolarHBondContact O-N 3.31Å; S1408-G1411 WeakPolarHBondContact O-CA 3.29Å; S1408-G1411 PolarHBondContact O-N 3.03Å; I1409-G1411 VanDerWaalsContact C-N 3.32Å; I1409-G1411 PolarHBondContact O-N 2.76Å; G1411-L1414 PolarHBondContact O-N 2.93Å; G1411-R1415 VanDerWaalsContact O-CB 3.28Å; G1411-R1415 WeakPolarHBondContact O-CB 3.45Å; G1411-R1415 PolarHBondContact O-N 2.82Å
1412	I	88.7	Confident	86.6	Confident	37 Å²	37	57.9 Å²	57.9	19%	0.19	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-39.7	175.9	-64.8	165.6	0	0	0	111.4	Y1363 I1366 S1408 I1409 R1415 Y1416 L1432	Y1363-I1412 HydrophobicContact CD1-CD1 3.66Å; Y1363-I1412 HydrophobicContact CD1-CG1 3.54Å; Y1363-I1412 HydrophobicContact CD2-CG1 4.16Å; Y1363-I1412 HydrophobicContact CD2-CG2 3.91Å; Y1363-I1412 HydrophobicContact CE1-CD1 4.33Å; Y1363-I1412 HydrophobicContact CE1-CG1 3.71Å; Y1363-I1412 HydrophobicContact CE2-CG1 4.3Å; Y1363-I1412 HydrophobicContact CE2-CG2 4.18Å; Y1363-I1412 HydrophobicContact CG-CD1 3.78Å; Y1363-I1412 HydrophobicContact CG-CG1 3.8Å; Y1363-I1412 HydrophobicContact CG-CG2 4.24Å; I1366-I1412 HydrophobicContact CD1-CD1 4.43Å; I1366-I1412 HydrophobicContact CG2-CD1 4.26Å; S1408-I1412 WeakPolarHBondContact O-CG1 3.04Å; S1408-I1412 PolarHBondContact O-N 3.21Å; I1409-I1412 PolarHBondContact O-N 2.95Å; I1412-R1415 WeakPolarHBondContact O-CB 3.23Å; I1412-R1415 PolarHBondContact O-N 3Å; I1412-Y1416 WeakPolarHBondContact O-CB 3.13Å; I1412-Y1416 PolarHBondContact O-N 2.95Å; I1412-L1432 HydrophobicContact CG1-CD2 4.26Å
1413	I	89.6	Confident	86.3	Confident	83 Å²	83	63.6 Å²	63.6	43%	0.426	31%	0.312	S	S	.	.	H	α-helix	trans	-69	-43.2	177.7	-70.6	166.8	0	0	0	111.2	I1409 I1410 R1415 Y1416 Y1417	I1409-I1413 HydrophobicContact CG2-CD1 3.79Å; I1409-I1413 HydrophobicContact CG2-CG1 4.48Å; I1409-I1413 WeakPolarHBondContact O-CB 3.08Å; I1409-I1413 VanDerWaalsContact O-CG1 3.27Å; I1409-I1413 WeakPolarHBondContact O-CG1 3.16Å; I1409-I1413 PolarHBondContact O-N 3Å; I1410-I1413 PolarHBondContact O-N 3.25Å; I1413-R1415 VanDerWaalsContact C-N 3.34Å; I1413-Y1416 WeakPolarHBondContact O-CB 3.34Å; I1413-Y1416 PolarHBondContact O-N 3.05Å; I1413-Y1417 HydrophobicContact CG2-CD2 3.72Å; I1413-Y1417 HydrophobicContact CG2-CE2 3.52Å; I1413-Y1417 VanDerWaalsContact O-CD2 3.23Å; I1413-Y1417 WeakPolarHBondContact O-CD2 3.36Å; I1413-Y1417 PolarHBondContact O-N 2.96Å
1414	L	89.6	Confident	86.1	Confident	41 Å²	41	64.5 Å²	64.5	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-66.9	-34.8	174.9	-72.2	177.3	0	0	0	112.1	I1410 G1411 G1418 L1431	I1410-L1414 HydrophobicContact CG2-CD1 4.09Å; I1410-L1414 HydrophobicContact CG2-CG 4.33Å; I1410-L1414 WeakPolarHBondContact O-CB 2.99Å; I1410-L1414 WeakPolarHBondContact O-CG 3.42Å; I1410-L1414 PolarHBondContact O-N 3.29Å; G1411-L1414 PolarHBondContact O-N 2.93Å; L1414-G1418 PolarHBondContact O-N 3.26Å; L1414-L1431 HydrophobicContact CD1-CD2 3.98Å
1415	R	86.7	Confident	85.9	Confident	1 Å²	1	65.6 Å²	65.6	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-48	169.1	178.5	91.2	176.6	143.9	17.9	110.9	P1351 E1359 Y1363 G1411 I1412 I1413 Y1417 G1418 I1419 Y1425 L1432	P1351-R1415 PolarHBondContact O-NH2 3Å; E1359-R1415 IonicContact OE1-CZ 3.88Å; E1359-R1415 IonicContact OE1-NE 2.65Å; E1359-R1415 PolarHBondContact OE1-NE 3.21Å; E1359-R1415 IonicContact OE1-NH2 2.68Å; E1359-R1415 PolarHBondContact OE1-NH2 3.01Å; E1359-R1415 IonicContact OE2-CZ 3.34Å; E1359-R1415 IonicContact OE2-NE 3.4Å; E1359-R1415 IonicContact OE2-NH2 3.93Å; E1359-R1415 PolarHBondContact OE2-NH2 2.93Å; E1359-R1415 VanDerWaalsContact OE2-NH2 3.16Å; Y1363-R1415 HydrophobicContact CE2-CG 4.49Å; Y1363-R1415 WeakPolarHBondContact OH-CG 3.4Å; G1411-R1415 VanDerWaalsContact O-CB 3.28Å; G1411-R1415 WeakPolarHBondContact O-CB 3.45Å; G1411-R1415 PolarHBondContact O-N 2.82Å; I1412-R1415 WeakPolarHBondContact O-CB 3.23Å; I1412-R1415 PolarHBondContact O-N 3Å; I1413-R1415 VanDerWaalsContact C-N 3.34Å; R1415-Y1417 PolarHBondContact O-N 3.29Å; R1415-G1418 WeakPolarHBondContact O-CA 3.3Å; R1415-G1418 PolarHBondContact O-N 2.84Å; R1415-G1418 VanDerWaalsContact O-N 3.08Å; R1415-I1419 PolarHBondContact O-N 3.05Å; R1415-Y1425 VanDerWaalsContact NH1-CZ 3.27Å; R1415-Y1425 PolarHBondContact NH1-OH 2.98Å; R1415-L1432 HydrophobicContact CB-CD1 4.17Å; R1415-L1432 HydrophobicContact CG-CD1 4.45Å
1416	Y	85.8	Confident	85.6	Confident	138 Å²	138	70.5 Å²	70.5	54%	0.541	34%	0.338	S	S	.	.	H	α-helix	trans	-60.1	-45.1	177	-176.7	-85.5	0	0	0	112.2	F1355 I1412 I1413 G1418 I1419 I1420	F1355-Y1416 AromaticContact CZ-CD2 3.98Å; F1355-Y1416 HydrophobicContact CZ-CD2 3.98Å; I1412-Y1416 WeakPolarHBondContact O-CB 3.13Å; I1412-Y1416 PolarHBondContact O-N 2.95Å; I1413-Y1416 WeakPolarHBondContact O-CB 3.34Å; I1413-Y1416 PolarHBondContact O-N 3.05Å; Y1416-G1418 VanDerWaalsContact C-N 3.3Å; Y1416-G1418 PolarHBondContact O-N 3.33Å; Y1416-I1419 PolarHBondContact O-N 2.86Å; Y1416-I1420 HydrophobicContact CE1-CD1 4.22Å
1417	Y	85.9	Confident	85.5	Confident	122 Å²	122	74.9 Å²	74.9	48%	0.478	35%	0.349	S	S	.	.	H	α-helix	trans	-67.7	-28.3	173	-74.7	-60.5	0	0	0	113.2	I1413 R1415 I1419 I1420 N1421	I1413-Y1417 HydrophobicContact CG2-CD2 3.72Å; I1413-Y1417 HydrophobicContact CG2-CE2 3.52Å; I1413-Y1417 VanDerWaalsContact O-CD2 3.23Å; I1413-Y1417 WeakPolarHBondContact O-CD2 3.36Å; I1413-Y1417 PolarHBondContact O-N 2.96Å; R1415-Y1417 PolarHBondContact O-N 3.29Å; Y1417-I1419 VanDerWaalsContact C-N 3.3Å; Y1417-I1419 PolarHBondContact O-N 3.42Å; Y1417-I1420 PolarHBondContact O-N 3.44Å; Y1417-I1420 VanDerWaalsContact O-N 3.12Å; Y1417-N1421 PolarHBondContact O-N 3.24Å
1418	G	83.2	Confident	85.3	Confident	3 Å²	3	72.2 Å²	72.2	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-30.4	175.9	0	0	0	0	0	114.2	L1414 R1415 Y1416 I1420 N1421	L1414-G1418 PolarHBondContact O-N 3.26Å; R1415-G1418 WeakPolarHBondContact O-CA 3.3Å; R1415-G1418 PolarHBondContact O-N 2.84Å; R1415-G1418 VanDerWaalsContact O-N 3.08Å; Y1416-G1418 VanDerWaalsContact C-N 3.3Å; Y1416-G1418 PolarHBondContact O-N 3.33Å; G1418-I1420 VanDerWaalsContact C-N 3.3Å; G1418-N1421 WeakPolarHBondContact CA-O 3.42Å; G1418-N1421 CarbonylContact O-C 3.34Å
1419	I	79.1	Confident	85	Confident	55 Å²	55	75.4 Å²	75.4	28%	0.282	35%	0.348	S	S	.	.	H	α-helix	trans	-69	-30.3	173.7	-61.1	164.3	0	0	0	111.1	P1352 F1355 R1415 Y1416 Y1417	P1352-I1419 WeakPolarHBondContact O-CG1 3.49Å; F1355-I1419 HydrophobicContact CD1-CD1 4.3Å; F1355-I1419 HydrophobicContact CD2-CD1 4.16Å; F1355-I1419 HydrophobicContact CE1-CD1 3.65Å; F1355-I1419 HydrophobicContact CE2-CD1 3.49Å; F1355-I1419 VanDerWaalsContact CE2-CD1 3.49Å; F1355-I1419 HydrophobicContact CZ-CD1 3.19Å; R1415-I1419 PolarHBondContact O-N 3.05Å; Y1416-I1419 PolarHBondContact O-N 2.86Å; Y1417-I1419 VanDerWaalsContact C-N 3.3Å; Y1417-I1419 PolarHBondContact O-N 3.42Å
1420	I	79.2	Confident	84.8	Confident	110 Å²	110	77.6 Å²	77.6	56%	0.564	36%	0.361	S	S	*	.	H	α-helix	trans	-84.9	-36.5	176.3	-55.9	174.7	0	0	0	110.8	Y1416 Y1417 G1418	Y1416-I1420 HydrophobicContact CE1-CD1 4.22Å; Y1417-I1420 PolarHBondContact O-N 3.44Å; Y1417-I1420 VanDerWaalsContact O-N 3.12Å; G1418-I1420 VanDerWaalsContact C-N 3.3Å
1421	N	78	Confident	84.7	Confident	88 Å²	88	75.4 Å²	75.4	47%	0.471	35%	0.349	S	S	.	.			trans	-138.7	100.9	-171.8	-76.4	-54.7	0	0	0	110.7	Y1417 G1418 N1423 Y1424	Y1417-N1421 PolarHBondContact O-N 3.24Å; G1418-N1421 WeakPolarHBondContact CA-O 3.42Å; G1418-N1421 CarbonylContact O-C 3.34Å; N1421-N1423 PolarHBondContact O-N 2.87Å; N1421-Y1424 HydrophobicContact CB-CD2 3.74Å; N1421-Y1424 HydrophobicContact CB-CE2 4.19Å; N1421-Y1424 PolarHBondContact O-N 3.41Å
1422	Q	80.3	Confident	84.6	Confident	154 Å²	154	75.9 Å²	75.9	72%	0.72	35%	0.352	S	S	*	.	H	α-helix	trans	-49.5	-30.1	-175.5	-169.1	177.9	5.1	0	0	114.6	Y1424 Y1425	Q1422-Y1424 VanDerWaalsContact C-N 3.29Å; Q1422-Y1424 PolarHBondContact O-N 2.98Å; Q1422-Y1425 WeakPolarHBondContact O-CB 3.26Å; Q1422-Y1425 PolarHBondContact O-N 3.02Å; Q1422-Y1425 VanDerWaalsContact O-N 3.12Å
1423	N	79.7	Confident	84.6	Confident	139 Å²	139	77.1 Å²	77.1	74%	0.743	36%	0.358	S	S	*	.	H	α-helix	trans	-60.2	-34.7	178.1	-66.4	-1.8	0	0	0	113.4	N1421	N1421-N1423 PolarHBondContact O-N 2.87Å
1424	Y	84.8	Confident	84.6	Confident	119 Å²	119	77.9 Å²	77.9	47%	0.467	36%	0.362	S	S	.	.	H	α-helix	trans	-84	-12.4	178.7	-61.4	-75.6	0	0	0	113.1	N1421 Q1422 M1426 W1427 G1428	N1421-Y1424 HydrophobicContact CB-CD2 3.74Å; N1421-Y1424 HydrophobicContact CB-CE2 4.19Å; N1421-Y1424 PolarHBondContact O-N 3.41Å; Q1422-Y1424 VanDerWaalsContact C-N 3.29Å; Q1422-Y1424 PolarHBondContact O-N 2.98Å; Y1424-M1426 VanDerWaalsContact C-N 3.35Å; Y1424-M1426 PolarHBondContact O-N 3.19Å; Y1424-W1427 WeakPolarHBondContact O-CB 3.46Å; Y1424-W1427 PolarHBondContact O-N 3.26Å; Y1424-W1427 VanDerWaalsContact O-N 3.12Å; Y1424-G1428 PolarHBondContact O-N 2.97Å
1425	Y	84.1	Confident	84.6	Confident	25 Å²	25	76 Å²	76	10%	0.098	35%	0.352	C	S	.	.	H	α-helix	trans	-54.6	-48.6	-179.3	-175.9	-103	0	0	0	112.6	L1350 P1351 P1352 R1415 Q1422 W1427 G1428 K1429	L1350-Y1425 PolarHBondContact O-OH 3.38Å; P1351-Y1425 PolarHBondContact O-OH 3.23Å; P1352-Y1425 VanDerWaalsContact CA-CE2 3.47Å; P1352-Y1425 HydrophobicContact CB-CD2 4.07Å; P1352-Y1425 HydrophobicContact CB-CE2 3.93Å; P1352-Y1425 HydrophobicContact CB-CG 4.48Å; R1415-Y1425 VanDerWaalsContact NH1-CZ 3.27Å; R1415-Y1425 PolarHBondContact NH1-OH 2.98Å; Q1422-Y1425 WeakPolarHBondContact O-CB 3.26Å; Q1422-Y1425 PolarHBondContact O-N 3.02Å; Q1422-Y1425 VanDerWaalsContact O-N 3.12Å; Y1425-W1427 VanDerWaalsContact C-N 3.33Å; Y1425-W1427 PolarHBondContact O-N 3.06Å; Y1425-G1428 PolarHBondContact O-N 3.18Å; Y1425-K1429 WeakPolarHBondContact O-CB 3.2Å; Y1425-K1429 PolarHBondContact O-N 2.68Å
1426	M	82.6	Confident	84.7	Confident	103 Å²	103	76.3 Å²	76.3	51%	0.507	35%	0.354	S	S	.	.	H	α-helix	trans	-67.4	-33.4	179.7	-65.9	-59.9	-67.1	0	0	112.2	Y1424 N1430	Y1424-M1426 VanDerWaalsContact C-N 3.35Å; Y1424-M1426 PolarHBondContact O-N 3.19Å; M1426-N1430 VanDerWaalsContact O-CB 3.28Å; M1426-N1430 WeakPolarHBondContact O-CB 3.45Å; M1426-N1430 PolarHBondContact O-N 2.93Å; M1426-N1430 PolarHBondContact O-OD1 3.37Å
1427	W	86.7	Confident	84.7	Confident	181 Å²	181	72.9 Å²	72.9	69%	0.686	35%	0.351	S	S	*	.	H	α-helix	trans	-68.6	-46.6	176.6	-68.1	68.6	0	0	0	111	Y1424 Y1425 N1430 L1431	Y1424-W1427 WeakPolarHBondContact O-CB 3.46Å; Y1424-W1427 PolarHBondContact O-N 3.26Å; Y1424-W1427 VanDerWaalsContact O-N 3.12Å; Y1425-W1427 VanDerWaalsContact C-N 3.33Å; Y1425-W1427 PolarHBondContact O-N 3.06Å; W1427-N1430 PolarHBondContact O-N 2.87Å; W1427-L1431 WeakPolarHBondContact O-CB 3.33Å; W1427-L1431 PolarHBondContact O-N 3.29Å
1428	G	86.1	Confident	84.8	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.5	-44	174.5	0	0	0	0	0	112.7	Y1424 Y1425 L1432	Y1424-G1428 PolarHBondContact O-N 2.97Å; Y1425-G1428 PolarHBondContact O-N 3.18Å; G1428-L1432 WeakPolarHBondContact O-CB 3.16Å; G1428-L1432 WeakPolarHBondContact O-CG 3.25Å; G1428-L1432 PolarHBondContact O-N 3Å
1429	K	84.1	Confident	85	Confident	67 Å²	67	69.2 Å²	69.2	29%	0.291	34%	0.338	S	S	.	.	H	α-helix	trans	-59.6	-51.9	174.9	-177.6	-177.2	176	-174.8	0	111.6	Y1425 L1431 L1432 I1433	Y1425-K1429 WeakPolarHBondContact O-CB 3.2Å; Y1425-K1429 PolarHBondContact O-N 2.68Å; K1429-L1431 VanDerWaalsContact C-N 3.35Å; K1429-L1431 PolarHBondContact O-N 2.94Å; K1429-L1432 PolarHBondContact O-N 3.28Å; K1429-I1433 HydrophobicContact CG-CD1 4.01Å; K1429-I1433 WeakPolarHBondContact O-CG1 3.18Å; K1429-I1433 PolarHBondContact O-N 3.44Å
1430	N	86.1	Confident	85.3	Confident	84 Å²	84	70.6 Å²	70.6	45%	0.449	34%	0.344	S	S	.	.	H	α-helix	trans	-64.9	-39.9	-176.7	-69.4	0.4	0	0	0	111.5	M1426 W1427 I1433 I1434	M1426-N1430 VanDerWaalsContact O-CB 3.28Å; M1426-N1430 WeakPolarHBondContact O-CB 3.45Å; M1426-N1430 PolarHBondContact O-N 2.93Å; M1426-N1430 PolarHBondContact O-OD1 3.37Å; W1427-N1430 PolarHBondContact O-N 2.87Å; N1430-I1433 PolarHBondContact O-N 2.8Å; N1430-I1434 WeakPolarHBondContact O-CG1 3.37Å; N1430-I1434 PolarHBondContact O-N 3.22Å
1431	L	89.9	Confident	85.4	Confident	33 Å²	33	70.2 Å²	70.2	17%	0.173	34%	0.341	C	S	.	.	H	α-helix	trans	-65.1	-39.9	176	-176.1	57.8	0	0	0	112	I1410 L1414 W1427 K1429 I1433 I1434 C1435	I1410-L1431 HydrophobicContact CB-CD2 4.11Å; I1410-L1431 HydrophobicContact CG2-CD2 3.67Å; L1414-L1431 HydrophobicContact CD1-CD2 3.98Å; W1427-L1431 WeakPolarHBondContact O-CB 3.33Å; W1427-L1431 PolarHBondContact O-N 3.29Å; K1429-L1431 VanDerWaalsContact C-N 3.35Å; K1429-L1431 PolarHBondContact O-N 2.94Å; L1431-I1433 VanDerWaalsContact C-N 3.33Å; L1431-I1433 PolarHBondContact O-N 3.09Å; L1431-I1434 PolarHBondContact O-N 2.86Å; L1431-C1435 WeakPolarHBondContact O-CB 3.21Å; L1431-C1435 PolarHBondContact O-N 2.8Å; L1431-C1435 PolarHBondContact O-SG 2.73Å
1432	L	87.3	Confident	85.6	Confident	10 Å²	10	66.4 Å²	66.4	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-65.2	-34.5	174.9	-74.6	169.4	0	0	0	112.8	F1342 Y1363 I1412 R1415 G1428 K1429 C1435 C1436	F1342-L1432 WeakPolarHBondContact CZ-O 3.45Å; Y1363-L1432 HydrophobicContact CE1-CD1 4.24Å; Y1363-L1432 HydrophobicContact CE1-CD2 4.32Å; Y1363-L1432 WeakPolarHBondContact OH-CD1 3.29Å; I1412-L1432 HydrophobicContact CG1-CD2 4.26Å; R1415-L1432 HydrophobicContact CB-CD1 4.17Å; R1415-L1432 HydrophobicContact CG-CD1 4.45Å; G1428-L1432 WeakPolarHBondContact O-CB 3.16Å; G1428-L1432 WeakPolarHBondContact O-CG 3.25Å; G1428-L1432 PolarHBondContact O-N 3Å; K1429-L1432 PolarHBondContact O-N 3.28Å; L1432-C1435 PolarHBondContact O-N 3.42Å; L1432-C1436 PolarHBondContact O-N 3.3Å
1433	I	88	Confident	85.6	Confident	64 Å²	64	62.3 Å²	62.3	33%	0.328	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-45.7	172.9	-67.9	167.1	0	0	0	110.6	C1346 K1429 N1430 L1431 C1435 C1436 S1437	C1346-I1433 HydrophobicContact CB-CG1 4.19Å; K1429-I1433 HydrophobicContact CG-CD1 4.01Å; K1429-I1433 WeakPolarHBondContact O-CG1 3.18Å; K1429-I1433 PolarHBondContact O-N 3.44Å; N1430-I1433 PolarHBondContact O-N 2.8Å; L1431-I1433 VanDerWaalsContact C-N 3.33Å; L1431-I1433 PolarHBondContact O-N 3.09Å; I1433-C1435 VanDerWaalsContact C-N 3.3Å; I1433-C1435 PolarHBondContact O-N 3Å; I1433-C1436 WeakPolarHBondContact O-CB 3.38Å; I1433-C1436 PolarHBondContact O-N 2.77Å; I1433-C1436 VanDerWaalsContact O-N 3.12Å; I1433-S1437 PolarHBondContact O-N 3.19Å
1434	I	88.9	Confident	85.6	Confident	99 Å²	99	58.2 Å²	58.2	51%	0.508	28%	0.278	S	S	.	.	H	α-helix	trans	-60.4	-41.7	174.8	-67.1	164.3	0	0	0	110.6	N1430 L1431 C1436 S1437 L1438	N1430-I1434 WeakPolarHBondContact O-CG1 3.37Å; N1430-I1434 PolarHBondContact O-N 3.22Å; L1431-I1434 PolarHBondContact O-N 2.86Å; I1434-C1436 VanDerWaalsContact C-N 3.33Å; I1434-C1436 PolarHBondContact O-N 3.29Å; I1434-S1437 PolarHBondContact O-N 2.67Å; I1434-L1438 PolarHBondContact O-N 2.87Å
1435	C	90	Very high	85.2	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-40	174.8	-65.6	0	0	0	0	111.7	F1342 L1431 L1432 I1433 S1437 L1438 W1439	F1342-C1435 HydrophobicContact CZ-CB 4.32Å; L1431-C1435 WeakPolarHBondContact O-CB 3.21Å; L1431-C1435 PolarHBondContact O-N 2.8Å; L1431-C1435 PolarHBondContact O-SG 2.73Å; L1432-C1435 PolarHBondContact O-N 3.42Å; I1433-C1435 VanDerWaalsContact C-N 3.3Å; I1433-C1435 PolarHBondContact O-N 3Å; C1435-S1437 VanDerWaalsContact C-N 3.27Å; C1435-S1437 PolarHBondContact O-N 2.92Å; C1435-L1438 WeakPolarHBondContact O-CB 3.44Å; C1435-L1438 PolarHBondContact O-N 2.95Å; C1435-W1439 VanDerWaalsContact O-CD1 3.24Å; C1435-W1439 PolarHBondContact O-N 2.67Å
1436	C	88.6	Confident	84.5	Confident	7 Å²	7	53.5 Å²	53.5	5%	0.047	26%	0.261	C	S	.	.	H	α-helix	trans	-58.4	-38.1	176.5	-169.1	0	0	0	0	112.3	F1342 C1346 L1432 I1433 I1434 W1439 Q1440	F1342-C1436 HydrophobicContact CD1-CB 4.19Å; F1342-C1436 HydrophobicContact CD2-CB 4.3Å; F1342-C1436 HydrophobicContact CE1-CB 3.93Å; F1342-C1436 HydrophobicContact CE2-CB 4.03Å; F1342-C1436 HydrophobicContact CG-CB 4.37Å; F1342-C1436 HydrophobicContact CZ-CB 3.84Å; C1346-C1436 VanDerWaalsContact SG-CB 3.56Å; L1432-C1436 PolarHBondContact O-N 3.3Å; I1433-C1436 WeakPolarHBondContact O-CB 3.38Å; I1433-C1436 PolarHBondContact O-N 2.77Å; I1433-C1436 VanDerWaalsContact O-N 3.12Å; I1434-C1436 VanDerWaalsContact C-N 3.33Å; I1434-C1436 PolarHBondContact O-N 3.29Å; C1436-W1439 PolarHBondContact O-N 3.13Å; C1436-Q1440 WeakPolarHBondContact O-CG 3.41Å; C1436-Q1440 PolarHBondContact O-N 3.41Å; C1436-Q1440 PolarHBondContact O-NE2 3.43Å
1437	S	86.8	Confident	84.1	Confident	66 Å²	66	50.9 Å²	50.9	46%	0.462	25%	0.248	S	C	.	.	H	α-helix	trans	-67.1	-37	172.2	-54.9	0	0	0	0	113.2	I1433 I1434 C1435 Q1440 M1441	I1433-S1437 PolarHBondContact O-N 3.19Å; I1434-S1437 PolarHBondContact O-N 2.67Å; C1435-S1437 VanDerWaalsContact C-N 3.27Å; C1435-S1437 PolarHBondContact O-N 2.92Å; S1437-Q1440 WeakPolarHBondContact O-CB 3.32Å; S1437-Q1440 PolarHBondContact O-N 3.11Å; S1437-M1441 PolarHBondContact O-N 3.26Å
1438	L	87.6	Confident	83.4	Confident	46 Å²	46	44.2 Å²	44.2	24%	0.241	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-42.8	174	-63.8	174.3	0	0	0	111.6	Y1400 M1404 L1407 I1434 C1435 Q1440 M1441 R1442	Y1400-L1438 WeakPolarHBondContact OH-CA 3.16Å; Y1400-L1438 WeakPolarHBondContact OH-CB 3.31Å; Y1400-L1438 WeakPolarHBondContact OH-CD2 3.33Å; Y1400-L1438 PolarHBondContact OH-O 2.75Å; M1404-L1438 HydrophobicContact CG-CB 4.25Å; L1407-L1438 HydrophobicContact CD1-CD1 3.7Å; I1434-L1438 PolarHBondContact O-N 2.87Å; C1435-L1438 WeakPolarHBondContact O-CB 3.44Å; C1435-L1438 PolarHBondContact O-N 2.95Å; L1438-Q1440 PolarHBondContact O-N 2.68Å; L1438-Q1440 VanDerWaalsContact O-N 3.16Å; L1438-M1441 PolarHBondContact O-N 3.15Å; L1438-M1441 VanDerWaalsContact O-N 3.09Å; L1438-R1442 PolarHBondContact O-N 2.87Å
1439	W	87.5	Confident	82.6	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-64	-16.5	173.7	-79.5	91.9	0	0	0	113.4	Y1335 F1338 F1342 I1366 Y1369 M1404 S1408 C1435 C1436	Y1335-W1439 HydrophobicContact CE2-CE3 4.19Å; Y1335-W1439 HydrophobicContact CE2-CZ3 4.29Å; Y1335-W1439 PolarHBondContact OH-O 2.86Å; F1338-W1439 HydrophobicContact CD1-CE3 4.4Å; F1338-W1439 AromaticContact CE1-CD2 3.78Å; F1338-W1439 HydrophobicContact CE1-CD2 3.78Å; F1338-W1439 AromaticContact CE1-CE3 3.41Å; F1338-W1439 HydrophobicContact CE1-CE3 3.41Å; F1338-W1439 VanDerWaalsContact CE1-CE3 3.41Å; F1338-W1439 HydrophobicContact CE1-CG 4.32Å; F1338-W1439 HydrophobicContact CE1-CH2 4.47Å; F1338-W1439 AromaticContact CE1-CZ3 3.79Å; F1338-W1439 HydrophobicContact CE1-CZ3 3.79Å; F1338-W1439 AromaticContact CZ-CD2 3.95Å; F1338-W1439 HydrophobicContact CZ-CD2 3.95Å; F1338-W1439 AromaticContact CZ-CE3 3.94Å; F1338-W1439 HydrophobicContact CZ-CE3 3.94Å; F1338-W1439 HydrophobicContact CZ-CG 4.48Å; F1338-W1439 HydrophobicContact CZ-CH2 4.39Å; F1338-W1439 HydrophobicContact CZ-CZ2 4.43Å; F1338-W1439 HydrophobicContact CZ-CZ3 4.15Å; F1342-W1439 HydrophobicContact CD1-CB 4.3Å; F1342-W1439 HydrophobicContact CD1-CG 4.3Å; F1342-W1439 HydrophobicContact CE1-CB 4.28Å; F1342-W1439 AromaticContact CE1-CD1 3.6Å; F1342-W1439 HydrophobicContact CE1-CG 4.02Å; I1366-W1439 HydrophobicContact CB-CZ2 4.42Å; I1366-W1439 HydrophobicContact CG1-CZ2 3.88Å; I1366-W1439 HydrophobicContact CG2-CZ2 4.31Å; Y1369-W1439 AromaticContact CD1-CH2 3.52Å; Y1369-W1439 HydrophobicContact CD1-CH2 3.52Å; Y1369-W1439 HydrophobicContact CD1-CZ2 4.42Å; Y1369-W1439 HydrophobicContact CD1-CZ3 4.17Å; Y1369-W1439 HydrophobicContact CD2-CH2 4.47Å; Y1369-W1439 AromaticContact CE1-CH2 3.94Å; Y1369-W1439 HydrophobicContact CE1-CH2 3.94Å; Y1369-W1439 HydrophobicContact CE1-CZ3 4.23Å; Y1369-W1439 AromaticContact CG-CH2 3.8Å; Y1369-W1439 HydrophobicContact CG-CH2 3.8Å; Y1369-W1439 HydrophobicContact CG-CZ3 4.32Å; M1404-W1439 HydrophobicContact CE-CD2 3.68Å; M1404-W1439 HydrophobicContact CE-CE3 3.59Å; M1404-W1439 HydrophobicContact CE-CG 4.46Å; M1404-W1439 HydrophobicContact CE-CH2 3.75Å; M1404-W1439 HydrophobicContact CE-CZ2 3.8Å; M1404-W1439 HydrophobicContact CE-CZ3 3.64Å; M1404-W1439 HydrophobicContact CG-CD2 4.14Å; M1404-W1439 HydrophobicContact CG-CG 4.11Å; M1404-W1439 HydrophobicContact SD-CB 4.26Å; M1404-W1439 HydrophobicContact SD-CD2 3.51Å; M1404-W1439 VanDerWaalsContact SD-CD2 3.51Å; M1404-W1439 HydrophobicContact SD-CE3 3.88Å; M1404-W1439 HydrophobicContact SD-CG 3.65Å; M1404-W1439 HydrophobicContact SD-CZ2 4.49Å; S1408-W1439 PolarHBondContact OG-NE1 3.25Å; C1435-W1439 VanDerWaalsContact O-CD1 3.24Å; C1435-W1439 PolarHBondContact O-N 2.67Å; C1436-W1439 PolarHBondContact O-N 3.13Å
1440	Q	84.7	Confident	82	Confident	85 Å²	85	50.4 Å²	50.4	40%	0.397	25%	0.249	S	C	.	.	H	α-helix	trans	-77.9	-38.4	170.2	-70.4	164.6	41.1	0	0	112.4	L1339 C1436 S1437 L1438 R1442 F1443	L1339-Q1440 HydrophobicContact CD1-CG 4.29Å; L1339-Q1440 HydrophobicContact CD2-CG 4.46Å; L1339-Q1440 HydrophobicContact CG-CG 4.45Å; C1436-Q1440 WeakPolarHBondContact O-CG 3.41Å; C1436-Q1440 PolarHBondContact O-N 3.41Å; C1436-Q1440 PolarHBondContact O-NE2 3.43Å; S1437-Q1440 WeakPolarHBondContact O-CB 3.32Å; S1437-Q1440 PolarHBondContact O-N 3.11Å; L1438-Q1440 PolarHBondContact O-N 2.68Å; L1438-Q1440 VanDerWaalsContact O-N 3.16Å; Q1440-R1442 PolarHBondContact O-N 3.3Å; Q1440-F1443 WeakPolarHBondContact O-CB 3.35Å; Q1440-F1443 PolarHBondContact O-N 3.46Å; Q1440-F1443 VanDerWaalsContact O-N 3.1Å
1441	M	82.6	Confident	81.2	Confident	102 Å²	102	54.6 Å²	54.6	50%	0.502	26%	0.258	S	S	.	.	H	α-helix	trans	-60.9	-32.3	176.3	-68	-61.6	-66	0	0	112.4	S1437 L1438 F1443 L1444	S1437-M1441 PolarHBondContact O-N 3.26Å; L1438-M1441 PolarHBondContact O-N 3.15Å; L1438-M1441 VanDerWaalsContact O-N 3.09Å; M1441-F1443 PolarHBondContact O-N 3.22Å; M1441-F1443 VanDerWaalsContact O-N 3.16Å; M1441-L1444 HydrophobicContact CE-CD1 3.79Å; M1441-L1444 WeakPolarHBondContact O-CB 3.29Å; M1441-L1444 WeakPolarHBondContact O-CG 3.46Å; M1441-L1444 PolarHBondContact O-N 2.94Å
1442	R	82.3	Confident	80.5	Confident	7 Å²	7	60.7 Å²	60.7	3%	0.026	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-17.8	177.8	-174.9	66	-178.5	140	0	113.6	Y1335 Y1369 Y1400 D1401 M1404 L1438 Q1440 L1444 E1445	Y1335-R1442 VanDerWaalsContact OH-CB 3.27Å; Y1335-R1442 WeakPolarHBondContact OH-CB 3.32Å; Y1369-R1442 PolarHBondContact OH-NE 2.92Å; Y1369-R1442 VanDerWaalsContact OH-NE 3.17Å; Y1400-R1442 HydrophobicContact CE1-CB 4.49Å; D1401-R1442 WeakPolarHBondContact OD1-CD 3.24Å; D1401-R1442 IonicContact OD1-CZ 3.02Å; D1401-R1442 IonicContact OD1-NE 3.88Å; D1401-R1442 PolarHBondContact OD1-NE 3.25Å; D1401-R1442 IonicContact OD1-NH2 2.98Å; D1401-R1442 IonicContact OD2-CZ 2.72Å; D1401-R1442 IonicContact OD2-NE 3.75Å; D1401-R1442 PolarHBondContact OD2-NE 3.04Å; D1401-R1442 IonicContact OD2-NH2 3.6Å; D1401-R1442 PolarHBondContact OD2-NH2 3.49Å; M1404-R1442 HydrophobicContact CE-CB 4.4Å; M1404-R1442 HydrophobicContact CE-CG 4.13Å; M1404-R1442 HydrophobicContact SD-CB 4.06Å; M1404-R1442 HydrophobicContact SD-CG 4.45Å; L1438-R1442 PolarHBondContact O-N 2.87Å; Q1440-R1442 PolarHBondContact O-N 3.3Å; R1442-L1444 PolarHBondContact O-N 3.39Å; R1442-E1445 IonicContact CZ-OE1 3.05Å; R1442-E1445 IonicContact CZ-OE2 2.8Å; R1442-E1445 IonicContact NH1-OE1 3.36Å; R1442-E1445 PolarHBondContact NH1-OE1 3.26Å; R1442-E1445 IonicContact NH1-OE2 3.9Å; R1442-E1445 VanDerWaalsContact NH2-CD 3.31Å; R1442-E1445 IonicContact NH2-OE1 2.91Å; R1442-E1445 PolarHBondContact NH2-OE1 2.92Å; R1442-E1445 IonicContact NH2-OE2 3.64Å; R1442-E1445 PolarHBondContact NH2-OE2 2.87Å; R1442-E1445 PolarHBondContact O-N 3.07Å
1443	F	79.9	Confident	80.1	Confident	68 Å²	68	61.3 Å²	61.3	30%	0.298	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-23.7	170.5	-178.9	-115.8	0	0	0	113.4	Y1335 L1336 Q1440 M1441 E1445 L1446 M1447	Y1335-F1443 HydrophobicContact CE1-CB 4.25Å; Y1335-F1443 HydrophobicContact CE1-CD2 4.3Å; Y1335-F1443 PolarHBondContact OH-N 2.99Å; L1336-F1443 HydrophobicContact CD2-CD2 4.07Å; L1336-F1443 HydrophobicContact CD2-CE2 3.69Å; L1336-F1443 HydrophobicContact CD2-CZ 4.38Å; L1336-F1443 HydrophobicContact CG-CE2 4.46Å; Q1440-F1443 WeakPolarHBondContact O-CB 3.35Å; Q1440-F1443 PolarHBondContact O-N 3.46Å; Q1440-F1443 VanDerWaalsContact O-N 3.1Å; M1441-F1443 PolarHBondContact O-N 3.22Å; M1441-F1443 VanDerWaalsContact O-N 3.16Å; F1443-E1445 VanDerWaalsContact C-N 3.32Å; F1443-E1445 PolarHBondContact O-N 2.93Å; F1443-L1446 HydrophobicContact CD2-CB 4.44Å; F1443-L1446 HydrophobicContact CD2-CD1 4.28Å; F1443-L1446 WeakPolarHBondContact O-CB 3.1Å; F1443-L1446 PolarHBondContact O-N 3.01Å; F1443-L1446 VanDerWaalsContact O-N 3.17Å; F1443-M1447 HydrophobicContact CD1-CG 3.97Å; F1443-M1447 HydrophobicContact CE1-CG 3.52Å; F1443-M1447 HydrophobicContact CE1-SD 3.79Å; F1443-M1447 HydrophobicContact CE2-CG 4.4Å; F1443-M1447 HydrophobicContact CE2-SD 4.37Å; F1443-M1447 HydrophobicContact CZ-CG 3.77Å; F1443-M1447 HydrophobicContact CZ-SD 3.55Å; F1443-M1447 VanDerWaalsContact CZ-SD 3.55Å; F1443-M1447 PolarHBondContact O-N 3.29Å
1444	L	79.6	Confident	79.6	Confident	54 Å²	54	58.3 Å²	58.3	28%	0.283	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-32.8	-180	-66	174.9	0	0	0	113.1	W1397 M1441 R1442 L1446 M1447 Q1448	W1397-L1444 HydrophobicContact CH2-CB 4.08Å; M1441-L1444 HydrophobicContact CE-CD1 3.79Å; M1441-L1444 WeakPolarHBondContact O-CB 3.29Å; M1441-L1444 WeakPolarHBondContact O-CG 3.46Å; M1441-L1444 PolarHBondContact O-N 2.94Å; R1442-L1444 PolarHBondContact O-N 3.39Å; L1444-L1446 VanDerWaalsContact C-N 3.32Å; L1444-L1446 PolarHBondContact O-N 3.34Å; L1444-M1447 CarbonylContact O-C 3.41Å; L1444-M1447 PolarHBondContact O-N 3.36Å; L1444-M1447 VanDerWaalsContact O-N 3.1Å; L1444-Q1448 PolarHBondContact O-N 3.49Å
1445	E	75.5	Confident	79.3	Confident	19 Å²	19	54.1 Å²	54.1	9%	0.089	25%	0.253	C	S	.	.	H	α-helix	trans	-62.4	-39.5	174.5	-168.5	-160.9	-97.7	0	0	111.3	W1397 R1442 F1443 M1447 Q1448 Y1588 R1591	W1397-E1445 HydrophobicContact CD2-CB 4.37Å; W1397-E1445 HydrophobicContact CZ2-CB 4.14Å; R1442-E1445 IonicContact CZ-OE1 3.05Å; R1442-E1445 IonicContact CZ-OE2 2.8Å; R1442-E1445 IonicContact NH1-OE1 3.36Å; R1442-E1445 PolarHBondContact NH1-OE1 3.26Å; R1442-E1445 IonicContact NH1-OE2 3.9Å; R1442-E1445 VanDerWaalsContact NH2-CD 3.31Å; R1442-E1445 IonicContact NH2-OE1 2.91Å; R1442-E1445 PolarHBondContact NH2-OE1 2.92Å; R1442-E1445 IonicContact NH2-OE2 3.64Å; R1442-E1445 PolarHBondContact NH2-OE2 2.87Å; R1442-E1445 PolarHBondContact O-N 3.07Å; F1443-E1445 VanDerWaalsContact C-N 3.32Å; F1443-E1445 PolarHBondContact O-N 2.93Å; E1445-M1447 VanDerWaalsContact C-N 3.26Å; E1445-M1447 PolarHBondContact O-N 3.25Å; E1445-Q1448 WeakPolarHBondContact O-CB 3.25Å; E1445-Q1448 PolarHBondContact O-N 3.08Å; E1445-Q1448 VanDerWaalsContact O-N 3.17Å; E1445-Y1588 PolarHBondContact OE2-OH 3.16Å; E1445-R1591 IonicContact OE2-NH1 2.65Å
1446	L	69.6	Low	79	Confident	25 Å²	25	61.4 Å²	61.4	13%	0.131	28%	0.281	C	S	.	.	H	α-helix	trans	-66.8	-29.3	175.3	-67.6	173	0	0	0	112.3	P1332 Y1335 F1443 L1444 I1449	P1332-L1446 HydrophobicContact CB-CD2 3.85Å; Y1335-L1446 HydrophobicContact CD1-CD1 3.33Å; Y1335-L1446 HydrophobicContact CE1-CD1 3.84Å; Y1335-L1446 HydrophobicContact CG-CD1 3.84Å; F1443-L1446 HydrophobicContact CD2-CB 4.44Å; F1443-L1446 HydrophobicContact CD2-CD1 4.28Å; F1443-L1446 WeakPolarHBondContact O-CB 3.1Å; F1443-L1446 PolarHBondContact O-N 3.01Å; F1443-L1446 VanDerWaalsContact O-N 3.17Å; L1444-L1446 VanDerWaalsContact C-N 3.32Å; L1444-L1446 PolarHBondContact O-N 3.34Å; L1446-I1449 HydrophobicContact CD2-CD1 4.37Å
1447	M	74.9	Confident	78.8	Confident	48 Å²	48	61.9 Å²	61.9	24%	0.236	28%	0.283	C	S	.	.	H	α-helix	trans	-80	-18.4	174.8	-66	-61.3	-60.9	0	0	113.2	F1443 L1444 E1445 I1449 W1450 S1453 I1457	F1443-M1447 HydrophobicContact CD1-CG 3.97Å; F1443-M1447 HydrophobicContact CE1-CG 3.52Å; F1443-M1447 HydrophobicContact CE1-SD 3.79Å; F1443-M1447 HydrophobicContact CE2-CG 4.4Å; F1443-M1447 HydrophobicContact CE2-SD 4.37Å; F1443-M1447 HydrophobicContact CZ-CG 3.77Å; F1443-M1447 HydrophobicContact CZ-SD 3.55Å; F1443-M1447 VanDerWaalsContact CZ-SD 3.55Å; F1443-M1447 PolarHBondContact O-N 3.29Å; L1444-M1447 CarbonylContact O-C 3.41Å; L1444-M1447 PolarHBondContact O-N 3.36Å; L1444-M1447 VanDerWaalsContact O-N 3.1Å; E1445-M1447 VanDerWaalsContact C-N 3.26Å; E1445-M1447 PolarHBondContact O-N 3.25Å; M1447-I1449 PolarHBondContact O-N 3.04Å; M1447-W1450 PolarHBondContact O-N 3.07Å; M1447-S1453 PolarHBondContact O-OG 2.92Å; M1447-I1457 HydrophobicContact CB-CD1 3.41Å; M1447-I1457 VanDerWaalsContact CB-CD1 3.41Å
1448	Q	72.3	Confident	78.4	Confident	41 Å²	41	60 Å²	60	19%	0.192	27%	0.266	C	S	.	.	H	α-helix	trans	-63.9	-27.4	171.1	-72.5	177.2	-34.2	0	0	111.8	L1444 E1445 W1450 G1454 I1457 Y1577	L1444-Q1448 PolarHBondContact O-N 3.49Å; E1445-Q1448 WeakPolarHBondContact O-CB 3.25Å; E1445-Q1448 PolarHBondContact O-N 3.08Å; E1445-Q1448 VanDerWaalsContact O-N 3.17Å; Q1448-W1450 VanDerWaalsContact C-N 3.3Å; Q1448-W1450 PolarHBondContact O-N 3.2Å; Q1448-G1454 WeakPolarHBondContact O-CA 3.43Å; Q1448-I1457 HydrophobicContact CG-CB 4.02Å; Q1448-I1457 HydrophobicContact CG-CD1 4.32Å; Q1448-I1457 HydrophobicContact CG-CG2 3.61Å; Q1448-Y1577 VanDerWaalsContact O-CE2 3.26Å; Q1448-Y1577 WeakPolarHBondContact O-CE2 3.25Å
1449	I	67.7	Low	78	Confident	35 Å²	35	58.6 Å²	58.6	18%	0.179	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-29.5	179.4	-59.4	172.5	0	0	0	112.2	W805 L1446 M1447 Y1577 V1584 Y1588	W805-I1449 HydrophobicContact CH2-CD1 4.29Å; W805-I1449 HydrophobicContact CH2-CG2 3.4Å; W805-I1449 HydrophobicContact CZ2-CG2 3.41Å; W805-I1449 VanDerWaalsContact CZ2-CG2 3.41Å; W805-I1449 HydrophobicContact CZ3-CG2 4.19Å; L1446-I1449 HydrophobicContact CD2-CD1 4.37Å; M1447-I1449 PolarHBondContact O-N 3.04Å; I1449-Y1577 PolarHBondContact O-OH 3.19Å; I1449-V1584 HydrophobicContact CG1-CG1 4.21Å; I1449-Y1588 HydrophobicContact CD1-CD2 4.37Å; I1449-Y1588 HydrophobicContact CD1-CE2 3.83Å
1450	W	71.5	Confident	77.9	Confident	163 Å²	163	63.1 Å²	63.1	62%	0.617	28%	0.282	S	S	*	.	S	Bend	trans	-76.2	125.4	-176.5	-76.9	65.7	0	0	0	111.3	M1447 Q1448 F1452 S1453 G1454	M1447-W1450 PolarHBondContact O-N 3.07Å; Q1448-W1450 VanDerWaalsContact C-N 3.3Å; Q1448-W1450 PolarHBondContact O-N 3.2Å; W1450-F1452 PolarHBondContact O-N 3.31Å; W1450-S1453 WeakPolarHBondContact CB-OG 3.42Å; W1450-S1453 PolarHBondContact O-N 3.28Å; W1450-S1453 VanDerWaalsContact O-N 3.09Å; W1450-G1454 PolarHBondContact O-N 3.45Å
1451	R	70.9	Confident	77.7	Confident	171 Å²	171	61.6 Å²	61.6	65%	0.645	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.9	-42	-175.9	175.9	177.1	166.4	85.6	3.2	114.5	P1455 Y1577	R1451-P1455 WeakPolarHBondContact O-CD 3.49Å; R1451-Y1577 WeakPolarHBondContact CA-OH 3.36Å
1452	F	75.2	Confident	77.5	Confident	161 Å²	161	57.2 Å²	57.2	71%	0.706	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-43.6	-177.2	-61.6	-74.4	0	0	0	113.1	W1450 Y1456	W1450-F1452 PolarHBondContact O-N 3.31Å; F1452-Y1456 WeakPolarHBondContact O-CD2 3.5Å; F1452-Y1456 WeakPolarHBondContact O-CE2 3.49Å
1453	S	78.8	Confident	77.5	Confident	23 Å²	23	57.2 Å²	57.2	16%	0.161	26%	0.258	C	S	.	.	H	α-helix	trans	-85.8	-15.5	-177.3	47.8	0	0	0	0	114.5	M1447 W1450 Y1456 I1457	M1447-S1453 PolarHBondContact O-OG 2.92Å; W1450-S1453 WeakPolarHBondContact CB-OG 3.42Å; W1450-S1453 PolarHBondContact O-N 3.28Å; W1450-S1453 VanDerWaalsContact O-N 3.09Å; S1453-Y1456 PolarHBondContact O-N 2.67Å; S1453-I1457 WeakPolarHBondContact O-CB 3.38Å; S1453-I1457 WeakPolarHBondContact O-CD1 3.42Å; S1453-I1457 VanDerWaalsContact O-CG1 3.23Å; S1453-I1457 WeakPolarHBondContact O-CG1 3.01Å; S1453-I1457 PolarHBondContact O-N 3.18Å
1454	G	77.1	Confident	77.6	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-52.2	-61.3	175.8	0	0	0	0	0	113.6	Q1448 W1450 Y1456 I1457 Y1458	Q1448-G1454 WeakPolarHBondContact O-CA 3.43Å; W1450-G1454 PolarHBondContact O-N 3.45Å; G1454-Y1456 PolarHBondContact O-N 3.48Å; G1454-I1457 PolarHBondContact O-N 3.47Å; G1454-Y1458 WeakPolarHBondContact O-CB 3.35Å; G1454-Y1458 PolarHBondContact O-N 3.46Å
1455	P	81.4	Confident	77.5	Confident	11 Å²	11	56.8 Å²	56.8	7%	0.071	26%	0.259	C	S	.	.	H	α-helix	trans	-57.7	-43.4	176.8	-24.9	34.1	0	0	0	112.9	R1451 I1457 Y1458 M1459 Y1577	R1451-P1455 WeakPolarHBondContact O-CD 3.49Å; P1455-I1457 PolarHBondContact O-N 3.49Å; P1455-Y1458 PolarHBondContact O-N 3.31Å; P1455-M1459 VanDerWaalsContact O-CB 3.28Å; P1455-M1459 WeakPolarHBondContact O-CB 2.97Å; P1455-M1459 PolarHBondContact O-N 2.98Å; P1455-Y1577 HydrophobicContact CG-CD1 3.79Å; P1455-Y1577 HydrophobicContact CG-CG 3.81Å
1456	Y	84.8	Confident	77.6	Confident	154 Å²	154	56 Å²	56	60%	0.604	26%	0.255	S	S	*	.	H	α-helix	trans	-66.4	-37.6	-179.4	-63.4	-52.5	0	0	0	113.8	F1452 S1453 G1454 M1459 L1460	F1452-Y1456 WeakPolarHBondContact O-CD2 3.5Å; F1452-Y1456 WeakPolarHBondContact O-CE2 3.49Å; S1453-Y1456 PolarHBondContact O-N 2.67Å; G1454-Y1456 PolarHBondContact O-N 3.48Å; Y1456-M1459 HydrophobicContact CD1-CE 3.87Å; Y1456-L1460 VanDerWaalsContact O-CB 3.25Å; Y1456-L1460 WeakPolarHBondContact O-CB 3.22Å; Y1456-L1460 PolarHBondContact O-N 3.08Å
1457	I	84	Confident	78.1	Confident	17 Å²	17	55.6 Å²	55.6	9%	0.087	25%	0.253	C	S	.	.	H	α-helix	trans	-73	-37.7	177.5	-66	163.4	0	0	0	110.3	M1447 Q1448 S1453 G1454 P1455 L1460 V1461	M1447-I1457 HydrophobicContact CB-CD1 3.41Å; M1447-I1457 VanDerWaalsContact CB-CD1 3.41Å; Q1448-I1457 HydrophobicContact CG-CB 4.02Å; Q1448-I1457 HydrophobicContact CG-CD1 4.32Å; Q1448-I1457 HydrophobicContact CG-CG2 3.61Å; S1453-I1457 WeakPolarHBondContact O-CB 3.38Å; S1453-I1457 WeakPolarHBondContact O-CD1 3.42Å; S1453-I1457 VanDerWaalsContact O-CG1 3.23Å; S1453-I1457 WeakPolarHBondContact O-CG1 3.01Å; S1453-I1457 PolarHBondContact O-N 3.18Å; G1454-I1457 PolarHBondContact O-N 3.47Å; P1455-I1457 PolarHBondContact O-N 3.49Å; I1457-L1460 PolarHBondContact O-N 2.62Å; I1457-V1461 HydrophobicContact CG2-CG2 4.39Å; I1457-V1461 WeakPolarHBondContact O-CB 3.49Å; I1457-V1461 VanDerWaalsContact O-CG2 3.28Å; I1457-V1461 WeakPolarHBondContact O-CG2 3.43Å; I1457-V1461 PolarHBondContact O-N 3.15Å
1458	Y	77.6	Confident	78.4	Confident	27 Å²	27	55.5 Å²	55.5	11%	0.106	25%	0.253	C	S	.	.	H	α-helix	trans	-62.7	-47.6	174	174	-111.8	0	0	0	111.7	G1454 P1455 V1461 K1462 V1576 L1580 V2367 D2368	G1454-Y1458 WeakPolarHBondContact O-CB 3.35Å; G1454-Y1458 PolarHBondContact O-N 3.46Å; P1455-Y1458 PolarHBondContact O-N 3.31Å; Y1458-V1461 PolarHBondContact O-N 3.01Å; Y1458-K1462 PolarHBondContact O-N 3.3Å; Y1458-V1576 HydrophobicContact CE1-CB 3.81Å; Y1458-V1576 HydrophobicContact CE1-CG1 4.37Å; Y1458-V1576 HydrophobicContact CE1-CG2 4.34Å; Y1458-V1576 VanDerWaalsContact OH-CB 3.32Å; Y1458-V1576 WeakPolarHBondContact OH-CB 3.23Å; Y1458-V1576 WeakPolarHBondContact OH-CG1 3.34Å; Y1458-L1580 HydrophobicContact CD2-CD1 3.65Å; Y1458-L1580 HydrophobicContact CE2-CD1 3.43Å; Y1458-L1580 VanDerWaalsContact CE2-CD1 3.43Å; Y1458-L1580 HydrophobicContact CG-CD1 4.39Å; Y1458-V2367 HydrophobicContact CE1-CB 4.43Å; Y1458-V2367 HydrophobicContact CE1-CG1 4.31Å; Y1458-V2367 HydrophobicContact CE1-CG2 3.9Å; Y1458-V2367 HydrophobicContact CE2-CG1 4.19Å; Y1458-V2367 WeakPolarHBondContact OH-CB 3.31Å; Y1458-V2367 WeakPolarHBondContact OH-CG1 3.49Å; Y1458-V2367 WeakPolarHBondContact OH-CG2 3.29Å; Y1458-D2368 PolarHBondContact OH-OD1 3.28Å
1459	M	79.6	Confident	78.8	Confident	17 Å²	17	54.7 Å²	54.7	8%	0.084	25%	0.252	C	S	.	.	H	α-helix	trans	-57.1	-51	171.6	177.1	177.2	82.2	0	0	111.4	P1455 Y1456 V1461 K1462 M1463 F1566 V1569	P1455-M1459 VanDerWaalsContact O-CB 3.28Å; P1455-M1459 WeakPolarHBondContact O-CB 2.97Å; P1455-M1459 PolarHBondContact O-N 2.98Å; Y1456-M1459 HydrophobicContact CD1-CE 3.87Å; M1459-V1461 PolarHBondContact O-N 3.19Å; M1459-K1462 CarbonylContact O-C 2.89Å; M1459-K1462 WeakPolarHBondContact O-CA 3.42Å; M1459-K1462 WeakPolarHBondContact O-CB 3.19Å; M1459-K1462 PolarHBondContact O-N 3.25Å; M1459-M1463 HydrophobicContact CE-SD 4.5Å; M1459-M1463 HydrophobicContact CG-CG 4.09Å; M1459-M1463 HydrophobicContact CG-SD 3.74Å; M1459-M1463 VanDerWaalsContact O-CG 3.28Å; M1459-M1463 WeakPolarHBondContact O-CG 3.09Å; M1459-M1463 PolarHBondContact O-N 2.94Å; M1459-M1463 HydrophobicContact SD-SD 4.47Å; M1459-F1566 HydrophobicContact CE-CD2 3.9Å; M1459-F1566 HydrophobicContact CE-CE2 3.4Å; M1459-F1566 VanDerWaalsContact CE-CE2 3.4Å; M1459-F1566 HydrophobicContact CE-CZ 4.33Å; M1459-F1566 HydrophobicContact SD-CD2 3.88Å; M1459-F1566 HydrophobicContact SD-CE2 3.79Å; M1459-V1569 HydrophobicContact CB-CG1 3.73Å; M1459-V1569 HydrophobicContact CG-CG1 3.55Å; M1459-V1569 HydrophobicContact SD-CG1 4.26Å
1460	L	85	Confident	79.3	Confident	96 Å²	96	53.5 Å²	53.5	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-58.4	-43.6	178.2	-179.5	153.1	0	0	0	112.7	Y1456 I1457 K1462 V1464	Y1456-L1460 VanDerWaalsContact O-CB 3.25Å; Y1456-L1460 WeakPolarHBondContact O-CB 3.22Å; Y1456-L1460 PolarHBondContact O-N 3.08Å; I1457-L1460 PolarHBondContact O-N 2.62Å; L1460-K1462 VanDerWaalsContact C-N 3.29Å; L1460-K1462 PolarHBondContact O-N 3.29Å; L1460-V1464 HydrophobicContact CD2-CG2 4.45Å; L1460-V1464 WeakPolarHBondContact O-CB 3.07Å; L1460-V1464 VanDerWaalsContact O-CG2 3.27Å; L1460-V1464 WeakPolarHBondContact O-CG2 3.36Å; L1460-V1464 PolarHBondContact O-N 3.45Å; L1460-V1464 VanDerWaalsContact O-N 3.08Å
1461	V	81.3	Confident	79.6	Confident	54 Å²	54	50 Å²	50	33%	0.327	24%	0.238	S	C	.	.	H	α-helix	trans	-66	-34	176.5	169	0	0	0	0	111.2	I1457 Y1458 M1459 R1465	I1457-V1461 HydrophobicContact CG2-CG2 4.39Å; I1457-V1461 WeakPolarHBondContact O-CB 3.49Å; I1457-V1461 VanDerWaalsContact O-CG2 3.28Å; I1457-V1461 WeakPolarHBondContact O-CG2 3.43Å; I1457-V1461 PolarHBondContact O-N 3.15Å; Y1458-V1461 PolarHBondContact O-N 3.01Å; M1459-V1461 PolarHBondContact O-N 3.19Å; V1461-R1465 WeakPolarHBondContact O-CB 3.48Å; V1461-R1465 PolarHBondContact O-N 2.82Å
1462	K	79	Confident	80.1	Confident	9 Å²	9	44.3 Å²	44.3	4%	0.039	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-64.7	170.1	176.5	134.9	-174.3	-40.7	0	111.2	Y1458 M1459 L1460 V1464 R1465 L1466 V1569 E2364 E2365 V2367	Y1458-K1462 PolarHBondContact O-N 3.3Å; M1459-K1462 CarbonylContact O-C 2.89Å; M1459-K1462 WeakPolarHBondContact O-CA 3.42Å; M1459-K1462 WeakPolarHBondContact O-CB 3.19Å; M1459-K1462 PolarHBondContact O-N 3.25Å; L1460-K1462 VanDerWaalsContact C-N 3.29Å; L1460-K1462 PolarHBondContact O-N 3.29Å; K1462-V1464 PolarHBondContact O-N 2.72Å; K1462-V1464 VanDerWaalsContact O-N 3.09Å; K1462-R1465 CarbonylContact O-C 3.22Å; K1462-R1465 VanDerWaalsContact O-CA 3.3Å; K1462-R1465 WeakPolarHBondContact O-CA 3.1Å; K1462-R1465 VanDerWaalsContact O-CB 3.28Å; K1462-R1465 WeakPolarHBondContact O-CB 3.26Å; K1462-R1465 PolarHBondContact O-N 3.03Å; K1462-L1466 HydrophobicContact CD-CD2 4.17Å; K1462-L1466 HydrophobicContact CG-CD1 4.01Å; K1462-L1466 HydrophobicContact CG-CD2 3.6Å; K1462-L1466 HydrophobicContact CG-CG 3.95Å; K1462-L1466 WeakPolarHBondContact O-CD2 3.48Å; K1462-L1466 VanDerWaalsContact O-CG 3.23Å; K1462-L1466 WeakPolarHBondContact O-CG 3.14Å; K1462-L1466 PolarHBondContact O-N 3.23Å; K1462-V1569 HydrophobicContact CD-CG2 3.67Å; K1462-V1569 HydrophobicContact CG-CG2 4.06Å; K1462-E2364 WeakPolarHBondContact CE-OE1 3.33Å; K1462-E2364 IonicContact NZ-OE1 2.95Å; K1462-E2364 PolarHBondContact NZ-OE1 3.17Å; K1462-E2365 IonicContact NZ-OE1 2.65Å; K1462-E2365 PolarHBondContact NZ-OE1 2.63Å; K1462-V2367 HydrophobicContact CD-CB 4.19Å; K1462-V2367 HydrophobicContact CD-CG1 3.3Å; K1462-V2367 HydrophobicContact CD-CG2 4.09Å
1463	M	81.2	Confident	80.3	Confident	8 Å²	8	39.7 Å²	39.7	4%	0.039	21%	0.205	C	C	.	.	H	α-helix	trans	-45.9	-47.8	-177.1	-62.3	177.8	88.4	0	0	112.2	M1459 R1465 L1466 M1467 F1562 I1565 F1566	M1459-M1463 HydrophobicContact CE-SD 4.5Å; M1459-M1463 HydrophobicContact CG-CG 4.09Å; M1459-M1463 HydrophobicContact CG-SD 3.74Å; M1459-M1463 VanDerWaalsContact O-CG 3.28Å; M1459-M1463 WeakPolarHBondContact O-CG 3.09Å; M1459-M1463 PolarHBondContact O-N 2.94Å; M1459-M1463 HydrophobicContact SD-SD 4.47Å; M1463-R1465 VanDerWaalsContact C-N 3.3Å; M1463-R1465 PolarHBondContact O-N 3.08Å; M1463-L1466 PolarHBondContact O-N 2.66Å; M1463-L1466 VanDerWaalsContact O-N 3.14Å; M1463-M1467 VanDerWaalsContact O-CG 3.29Å; M1463-M1467 WeakPolarHBondContact O-CG 2.84Å; M1463-M1467 PolarHBondContact O-N 3.06Å; M1463-F1562 HydrophobicContact CE-CD1 4.23Å; M1463-F1562 HydrophobicContact CE-CD2 3.47Å; M1463-F1562 VanDerWaalsContact CE-CD2 3.47Å; M1463-F1562 HydrophobicContact CE-CE1 3.96Å; M1463-F1562 HydrophobicContact CE-CE2 3.17Å; M1463-F1562 HydrophobicContact CE-CG 4.02Å; M1463-F1562 HydrophobicContact CE-CZ 3.45Å; M1463-F1562 VanDerWaalsContact CE-CZ 3.45Å; M1463-F1562 WeakPolarHBondContact CE-O 3.48Å; M1463-F1562 HydrophobicContact SD-CE2 4.07Å; M1463-F1562 HydrophobicContact SD-CZ 4.3Å; M1463-I1565 HydrophobicContact CB-CG2 4.2Å; M1463-I1565 HydrophobicContact CE-CG2 4.49Å; M1463-I1565 VanDerWaalsContact CE-O 3.3Å; M1463-I1565 WeakPolarHBondContact CE-O 3.2Å; M1463-I1565 HydrophobicContact CG-CG2 4.03Å; M1463-I1565 WeakPolarHBondContact CG-O 3.47Å; M1463-F1566 HydrophobicContact CE-CB 3.64Å; M1463-F1566 HydrophobicContact CE-CD2 3.89Å; M1463-F1566 HydrophobicContact CE-CG 4.28Å; M1463-F1566 HydrophobicContact SD-CD2 4.12Å
1464	V	81.7	Confident	80.3	Confident	82 Å²	82	40.3 Å²	40.3	50%	0.497	21%	0.206	S	C	.	.	H	α-helix	trans	-67.2	-26.2	178.2	173.6	0	0	0	0	113.6	L1460 K1462 I1468	L1460-V1464 HydrophobicContact CD2-CG2 4.45Å; L1460-V1464 WeakPolarHBondContact O-CB 3.07Å; L1460-V1464 VanDerWaalsContact O-CG2 3.27Å; L1460-V1464 WeakPolarHBondContact O-CG2 3.36Å; L1460-V1464 PolarHBondContact O-N 3.45Å; L1460-V1464 VanDerWaalsContact O-N 3.08Å; K1462-V1464 PolarHBondContact O-N 2.72Å; K1462-V1464 VanDerWaalsContact O-N 3.09Å; V1464-I1468 WeakPolarHBondContact O-CD1 3.36Å; V1464-I1468 WeakPolarHBondContact O-CG1 3.47Å
1465	R	78.5	Confident	80.5	Confident	30 Å²	30	45 Å²	45	11%	0.113	23%	0.226	C	C	.	.	H	α-helix	trans	-77.8	-25.5	173.9	176.3	168.1	166.7	145	-20.2	112.2	A1190 A1191 I1193 V1461 K1462 M1463 D2370	A1190-R1465 WeakPolarHBondContact O-CD 3.29Å; A1190-R1465 WeakPolarHBondContact O-CG 3.11Å; A1190-R1465 PolarHBondContact O-NE 2.75Å; A1190-R1465 PolarHBondContact O-NH1 3.32Å; A1191-R1465 HydrophobicContact CB-CG 4.45Å; A1191-R1465 PolarHBondContact O-NE 2.72Å; A1191-R1465 PolarHBondContact O-NH2 3.2Å; I1193-R1465 PolarHBondContact O-NH1 3.02Å; V1461-R1465 WeakPolarHBondContact O-CB 3.48Å; V1461-R1465 PolarHBondContact O-N 2.82Å; K1462-R1465 CarbonylContact O-C 3.22Å; K1462-R1465 VanDerWaalsContact O-CA 3.3Å; K1462-R1465 WeakPolarHBondContact O-CA 3.1Å; K1462-R1465 VanDerWaalsContact O-CB 3.28Å; K1462-R1465 WeakPolarHBondContact O-CB 3.26Å; K1462-R1465 PolarHBondContact O-N 3.03Å; M1463-R1465 VanDerWaalsContact C-N 3.3Å; M1463-R1465 PolarHBondContact O-N 3.08Å; R1465-D2370 IonicContact NH2-OD1 2.66Å; R1465-D2370 PolarHBondContact NH2-OD1 3.45Å
1466	L	77.9	Confident	80.6	Confident	2 Å²	2	50 Å²	50	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-83.1	-55.4	178.9	-34.5	-166.2	0	0	0	110.7	K1462 M1463 I1468 P1469 I1565 E2364 E2365	K1462-L1466 HydrophobicContact CD-CD2 4.17Å; K1462-L1466 HydrophobicContact CG-CD1 4.01Å; K1462-L1466 HydrophobicContact CG-CD2 3.6Å; K1462-L1466 HydrophobicContact CG-CG 3.95Å; K1462-L1466 WeakPolarHBondContact O-CD2 3.48Å; K1462-L1466 VanDerWaalsContact O-CG 3.23Å; K1462-L1466 WeakPolarHBondContact O-CG 3.14Å; K1462-L1466 PolarHBondContact O-N 3.23Å; M1463-L1466 PolarHBondContact O-N 2.66Å; M1463-L1466 VanDerWaalsContact O-N 3.14Å; L1466-I1468 PolarHBondContact O-N 2.8Å; L1466-P1469 WeakPolarHBondContact O-CD 3.33Å; L1466-I1565 HydrophobicContact CB-CD1 4.32Å; L1466-I1565 HydrophobicContact CB-CG2 4.36Å; L1466-I1565 HydrophobicContact CD1-CB 4.43Å; L1466-I1565 HydrophobicContact CD1-CD1 4.29Å; L1466-I1565 HydrophobicContact CD1-CG1 4.22Å; L1466-I1565 HydrophobicContact CD1-CG2 3.45Å; L1466-I1565 VanDerWaalsContact CD1-CG2 3.45Å; L1466-I1565 HydrophobicContact CG-CG2 4.14Å; L1466-E2364 HydrophobicContact CD1-CB 3.78Å; L1466-E2364 HydrophobicContact CD1-CG 4.44Å; L1466-E2364 VanDerWaalsContact CD2-CD 3.44Å; L1466-E2364 WeakPolarHBondContact CD2-OE1 3.41Å; L1466-E2364 WeakPolarHBondContact CD2-OE2 3.18Å; L1466-E2365 HydrophobicContact CD1-CG 4.04Å
1467	M	79.3	Confident	80.5	Confident	18 Å²	18	43.4 Å²	43.4	9%	0.089	23%	0.228	C	C	.	.	S	Bend	trans	-59.7	4.4	-176.1	-62.2	177	87.8	0	0	115.6	M1463 M1470 L1471 V1558 F1562 E2363	M1463-M1467 VanDerWaalsContact O-CG 3.29Å; M1463-M1467 WeakPolarHBondContact O-CG 2.84Å; M1463-M1467 PolarHBondContact O-N 3.06Å; M1467-M1470 PolarHBondContact O-N 3.18Å; M1467-L1471 HydrophobicContact CB-CD1 4.11Å; M1467-L1471 HydrophobicContact CB-CG 4.31Å; M1467-L1471 VanDerWaalsContact O-CB 3.25Å; M1467-L1471 WeakPolarHBondContact O-CB 3.49Å; M1467-L1471 WeakPolarHBondContact O-CG 3.44Å; M1467-L1471 PolarHBondContact O-N 2.71Å; M1467-V1558 HydrophobicContact CE-CG1 3.86Å; M1467-F1562 HydrophobicContact CE-CB 4.09Å; M1467-F1562 HydrophobicContact CE-CD2 3.8Å; M1467-F1562 HydrophobicContact CE-CG 4.37Å; M1467-F1562 HydrophobicContact SD-CD2 3.56Å; M1467-F1562 VanDerWaalsContact SD-CD2 3.56Å; M1467-F1562 HydrophobicContact SD-CE2 4.16Å; M1467-E2363 PolarHBondContact N-OE1 2.67Å
1468	I	82.1	Confident	80.6	Confident	45 Å²	45	43.2 Å²	43.2	23%	0.231	23%	0.227	C	C	.	.	H	α-helix	trans	-68	-41	-176.2	-82.9	165.8	0	0	0	113.8	A1190 V1464 L1466 T1472	A1190-I1468 HydrophobicContact CB-CD1 3.57Å; V1464-I1468 WeakPolarHBondContact O-CD1 3.36Å; V1464-I1468 WeakPolarHBondContact O-CG1 3.47Å; L1466-I1468 PolarHBondContact O-N 2.8Å; I1468-T1472 WeakPolarHBondContact O-CB 3.31Å; I1468-T1472 PolarHBondContact O-N 3.04Å; I1468-T1472 VanDerWaalsContact O-N 3.14Å; I1468-T1472 PolarHBondContact O-OG1 3.28Å
1469	P	79.6	Confident	81.1	Confident	25 Å²	25	45.3 Å²	45.3	16%	0.162	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-48	169.9	-20.6	35	0	0	0	110.2	L1466 L1471 T1472 L1473	L1466-P1469 WeakPolarHBondContact O-CD 3.33Å; P1469-L1471 PolarHBondContact O-N 3.1Å; P1469-T1472 CarbonylContact O-C 3.33Å; P1469-T1472 VanDerWaalsContact O-CA 3.25Å; P1469-T1472 WeakPolarHBondContact O-CA 3.36Å; P1469-T1472 WeakPolarHBondContact O-CB 3.23Å; P1469-T1472 PolarHBondContact O-N 3.19Å; P1469-L1473 PolarHBondContact O-N 3.44Å
1470	M	78.3	Confident	81.5	Confident	10 Å²	10	46.6 Å²	46.6	5%	0.049	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-42.9	-179.2	-159	-170.4	-148.5	0	0	114.2	M1467 T1472 L1473 L1474 V1557 V1558 V1561	M1467-M1470 PolarHBondContact O-N 3.18Å; M1470-T1472 PolarHBondContact O-N 3.22Å; M1470-L1473 WeakPolarHBondContact O-CB 3.45Å; M1470-L1473 PolarHBondContact O-N 3.39Å; M1470-L1473 VanDerWaalsContact O-N 3.16Å; M1470-L1474 PolarHBondContact O-N 3.33Å; M1470-V1557 HydrophobicContact CE-CB 4.42Å; M1470-V1557 HydrophobicContact CE-CG1 3.65Å; M1470-V1557 WeakPolarHBondContact CE-O 3.36Å; M1470-V1558 HydrophobicContact CE-CB 4.39Å; M1470-V1558 HydrophobicContact CE-CG2 3.96Å; M1470-V1558 HydrophobicContact CG-CG2 3.99Å; M1470-V1558 HydrophobicContact SD-CB 4.1Å; M1470-V1558 HydrophobicContact SD-CG1 4.42Å; M1470-V1558 HydrophobicContact SD-CG2 3.68Å; M1470-V1561 HydrophobicContact CE-CB 3.57Å; M1470-V1561 HydrophobicContact CE-CG1 3.92Å; M1470-V1561 HydrophobicContact CE-CG2 3.48Å; M1470-V1561 VanDerWaalsContact CE-CG2 3.48Å; M1470-V1561 HydrophobicContact SD-CB 3.84Å; M1470-V1561 HydrophobicContact SD-CG1 3.67Å; M1470-V1561 HydrophobicContact SD-CG2 4.36Å
1471	L	78	Confident	81.7	Confident	88 Å²	88	42.5 Å²	42.5	46%	0.461	23%	0.231	S	C	.	.	H	α-helix	trans	-67.9	-19.7	172.3	-71.9	169.7	0	0	0	112.5	M1467 P1469	M1467-L1471 HydrophobicContact CB-CD1 4.11Å; M1467-L1471 HydrophobicContact CB-CG 4.31Å; M1467-L1471 VanDerWaalsContact O-CB 3.25Å; M1467-L1471 WeakPolarHBondContact O-CB 3.49Å; M1467-L1471 WeakPolarHBondContact O-CG 3.44Å; M1467-L1471 PolarHBondContact O-N 2.71Å; P1469-L1471 PolarHBondContact O-N 3.1Å
1472	T	80.8	Confident	82	Confident	52 Å²	52	39.9 Å²	39.9	32%	0.319	22%	0.215	S	C	.	.	H	α-helix	trans	-79.5	-36.3	170.4	-54.6	0	0	0	0	111.1	I1468 P1469 M1470 L1474 F1475	I1468-T1472 WeakPolarHBondContact O-CB 3.31Å; I1468-T1472 PolarHBondContact O-N 3.04Å; I1468-T1472 VanDerWaalsContact O-N 3.14Å; I1468-T1472 PolarHBondContact O-OG1 3.28Å; P1469-T1472 CarbonylContact O-C 3.33Å; P1469-T1472 VanDerWaalsContact O-CA 3.25Å; P1469-T1472 WeakPolarHBondContact O-CA 3.36Å; P1469-T1472 WeakPolarHBondContact O-CB 3.23Å; P1469-T1472 PolarHBondContact O-N 3.19Å; M1470-T1472 PolarHBondContact O-N 3.22Å; T1472-L1474 VanDerWaalsContact C-N 3.3Å; T1472-L1474 PolarHBondContact O-N 3.07Å; T1472-F1475 VanDerWaalsContact O-CB 3.25Å; T1472-F1475 WeakPolarHBondContact O-CB 3.25Å; T1472-F1475 PolarHBondContact O-N 2.84Å
1473	L	79.6	Confident	82.4	Confident	64 Å²	64	42.5 Å²	42.5	34%	0.335	23%	0.232	S	C	.	.	H	α-helix	trans	-58.1	-41.6	172.7	-64.6	177.7	0	0	0	111.7	P1469 M1470 F1475 L1476 P1477 F1554 E2480	P1469-L1473 PolarHBondContact O-N 3.44Å; M1470-L1473 WeakPolarHBondContact O-CB 3.45Å; M1470-L1473 PolarHBondContact O-N 3.39Å; M1470-L1473 VanDerWaalsContact O-N 3.16Å; L1473-F1475 PolarHBondContact O-N 3.39Å; L1473-F1475 VanDerWaalsContact O-N 3.11Å; L1473-L1476 PolarHBondContact O-N 2.86Å; L1473-P1477 WeakPolarHBondContact O-CD 3.48Å; L1473-F1554 HydrophobicContact CB-CE1 4.26Å; L1473-E2480 VanDerWaalsContact CD1-OE1 3.24Å; L1473-E2480 WeakPolarHBondContact CD1-OE1 3.24Å
1474	L	79.9	Confident	82.7	Confident	37 Å²	37	46.1 Å²	46.1	19%	0.194	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-23.9	175.6	-175.8	62.3	0	0	0	113.8	M1470 T1472 L1512 F1554	M1470-L1474 PolarHBondContact O-N 3.33Å; T1472-L1474 VanDerWaalsContact C-N 3.3Å; T1472-L1474 PolarHBondContact O-N 3.07Å; L1474-L1512 HydrophobicContact CD1-CD2 4.16Å; L1474-L1512 HydrophobicContact CD2-CD2 4.15Å; L1474-F1554 HydrophobicContact CD1-CB 4.2Å
1475	F	80.7	Confident	82.8	Confident	99 Å²	99	42.9 Å²	42.9	43%	0.434	23%	0.23	S	C	.	.	H	α-helix	trans	-73.9	-28.2	177.6	-175.3	-105.4	0	0	0	112.9	T1472 L1473 L1478 L1479 M1505	T1472-F1475 VanDerWaalsContact O-CB 3.25Å; T1472-F1475 WeakPolarHBondContact O-CB 3.25Å; T1472-F1475 PolarHBondContact O-N 2.84Å; L1473-F1475 PolarHBondContact O-N 3.39Å; L1473-F1475 VanDerWaalsContact O-N 3.11Å; F1475-L1478 PolarHBondContact O-N 2.8Å; F1475-L1479 HydrophobicContact CE1-CD1 3.74Å; F1475-L1479 HydrophobicContact CZ-CD1 4.05Å; F1475-L1479 WeakPolarHBondContact O-CB 3.45Å; F1475-L1479 PolarHBondContact O-N 3.24Å; F1475-M1505 HydrophobicContact CE2-CE 4.14Å; F1475-M1505 HydrophobicContact CE2-SD 3.51Å; F1475-M1505 VanDerWaalsContact CE2-SD 3.51Å; F1475-M1505 HydrophobicContact CZ-CE 4.09Å; F1475-M1505 HydrophobicContact CZ-SD 3.6Å; F1475-M1505 VanDerWaalsContact CZ-SD 3.6Å
1476	L	84.5	Confident	83.1	Confident	116 Å²	116	42.6 Å²	42.6	61%	0.607	23%	0.23	S	C	*	.	H	α-helix	trans	-69.9	-49.3	-175.1	179.8	65.4	0	0	0	113.1	L1473 L1478 L1479 A1480	L1473-L1476 PolarHBondContact O-N 2.86Å; L1476-L1478 VanDerWaalsContact C-N 3.28Å; L1476-L1478 PolarHBondContact O-N 2.99Å; L1476-L1479 PolarHBondContact O-N 3.46Å; L1476-A1480 WeakPolarHBondContact O-CB 3.4Å; L1476-A1480 PolarHBondContact O-N 3.3Å
1477	P	82.6	Confident	83.3	Confident	15 Å²	15	44.7 Å²	44.7	10%	0.097	25%	0.252	C	S	.	.	H	α-helix	trans	-61.3	-36	173.3	-21.6	31.2	0	0	0	113	L1473 A1480 F1481 Y1546 Y1549 F1554	L1473-P1477 WeakPolarHBondContact O-CD 3.48Å; P1477-A1480 PolarHBondContact O-N 2.99Å; P1477-F1481 WeakPolarHBondContact O-CB 3.29Å; P1477-F1481 PolarHBondContact O-N 2.78Å; P1477-Y1546 HydrophobicContact CB-CE2 4.46Å; P1477-Y1549 HydrophobicContact CB-CE1 4.35Å; P1477-Y1549 HydrophobicContact CG-CE1 4.24Å; P1477-F1554 HydrophobicContact CB-CE2 4.43Å; P1477-F1554 HydrophobicContact CG-CD2 3.83Å; P1477-F1554 HydrophobicContact CG-CE2 3.32Å; P1477-F1554 HydrophobicContact CG-CZ 3.95Å
1478	L	85.4	Confident	83.4	Confident	14 Å²	14	45.5 Å²	45.5	7%	0.073	26%	0.256	C	S	.	.	H	α-helix	trans	-62.4	-45.1	177.4	-173.8	166.1	0	0	0	110.8	F1475 L1476 G1482 M1505 P1508 Y1509	F1475-L1478 PolarHBondContact O-N 2.8Å; L1476-L1478 VanDerWaalsContact C-N 3.28Å; L1476-L1478 PolarHBondContact O-N 2.99Å; L1478-G1482 PolarHBondContact O-N 3.02Å; L1478-M1505 HydrophobicContact CD2-CE 3.64Å; L1478-M1505 HydrophobicContact CD2-SD 4.29Å; L1478-P1508 HydrophobicContact CD2-CB 4.34Å; L1478-P1508 HydrophobicContact CG-CB 4.1Å; L1478-Y1509 HydrophobicContact CD1-CD2 4.01Å
1479	L	87.4	Confident	83.1	Confident	70 Å²	70	43.8 Å²	43.8	37%	0.366	25%	0.247	S	C	.	.	H	α-helix	trans	-68.3	-40.6	175.4	-167.3	146	0	0	0	112.3	F1475 L1476 G1482 T1483 M1505	F1475-L1479 HydrophobicContact CE1-CD1 3.74Å; F1475-L1479 HydrophobicContact CZ-CD1 4.05Å; F1475-L1479 WeakPolarHBondContact O-CB 3.45Å; F1475-L1479 PolarHBondContact O-N 3.24Å; L1476-L1479 PolarHBondContact O-N 3.46Å; L1479-G1482 PolarHBondContact O-N 3.33Å; L1479-T1483 HydrophobicContact CD2-CG2 4.29Å; L1479-T1483 WeakPolarHBondContact O-CB 3.23Å; L1479-T1483 WeakPolarHBondContact O-CG2 3.49Å; L1479-T1483 PolarHBondContact O-N 3.46Å; L1479-T1483 PolarHBondContact O-OG1 3.39Å; L1479-M1505 HydrophobicContact CB-CE 3.67Å; L1479-M1505 HydrophobicContact CD1-CE 3.85Å; L1479-M1505 HydrophobicContact CG-CE 3.73Å
1480	A	88.1	Confident	83	Confident	44 Å²	44	46.1 Å²	46.1	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-63.4	-54.4	177.9	0	0	0	0	0	112.2	L1476 P1477 G1482 T1483 I1484	L1476-A1480 WeakPolarHBondContact O-CB 3.4Å; L1476-A1480 PolarHBondContact O-N 3.3Å; P1477-A1480 PolarHBondContact O-N 2.99Å; A1480-G1482 VanDerWaalsContact C-N 3.33Å; A1480-G1482 PolarHBondContact O-N 2.96Å; A1480-T1483 PolarHBondContact O-N 2.91Å; A1480-T1483 PolarHBondContact O-OG1 3.36Å; A1480-I1484 WeakPolarHBondContact O-CD1 3.28Å; A1480-I1484 VanDerWaalsContact O-CG1 3.31Å; A1480-I1484 WeakPolarHBondContact O-CG1 3.22Å; A1480-I1484 PolarHBondContact O-N 3.38Å; A1480-I1484 VanDerWaalsContact O-N 3.13Å
1481	F	89.6	Confident	82.7	Confident	10 Å²	10	49.1 Å²	49.1	4%	0.044	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-40.1	176.1	172.8	-113.5	0	0	0	111.8	P1477 T1483 I1484 R1485 P1508 M1511 A1542 T1543 Y1546	P1477-F1481 WeakPolarHBondContact O-CB 3.29Å; P1477-F1481 PolarHBondContact O-N 2.78Å; F1481-T1483 PolarHBondContact O-N 3.4Å; F1481-I1484 PolarHBondContact O-N 3.39Å; F1481-R1485 HydrophobicContact CE2-CB 4.3Å; F1481-R1485 HydrophobicContact CE2-CG 4.49Å; F1481-R1485 HydrophobicContact CZ-CB 4.27Å; F1481-R1485 HydrophobicContact CZ-CG 4.14Å; F1481-R1485 VanDerWaalsContact O-CB 3.22Å; F1481-R1485 WeakPolarHBondContact O-CB 3.49Å; F1481-R1485 PolarHBondContact O-N 2.96Å; F1481-P1508 HydrophobicContact CD1-CB 3.9Å; F1481-P1508 HydrophobicContact CD1-CG 3.79Å; F1481-P1508 HydrophobicContact CE1-CB 4.34Å; F1481-P1508 HydrophobicContact CE1-CG 4.06Å; F1481-M1511 HydrophobicContact CE1-CE 3.74Å; F1481-M1511 HydrophobicContact CE1-SD 3.9Å; F1481-M1511 HydrophobicContact CZ-CE 3.87Å; F1481-M1511 HydrophobicContact CZ-SD 4.47Å; F1481-A1542 HydrophobicContact CD2-CB 4.45Å; F1481-A1542 HydrophobicContact CE2-CB 4.31Å; F1481-T1543 HydrophobicContact CZ-CG2 4.28Å; F1481-T1543 WeakPolarHBondContact CZ-OG1 3.42Å; F1481-Y1546 HydrophobicContact CB-CD2 3.48Å; F1481-Y1546 VanDerWaalsContact CB-CD2 3.48Å; F1481-Y1546 HydrophobicContact CB-CE2 4.02Å; F1481-Y1546 HydrophobicContact CB-CG 3.79Å; F1481-Y1546 AromaticContact CD1-CD1 3.37Å; F1481-Y1546 HydrophobicContact CD1-CD1 3.37Å; F1481-Y1546 AromaticContact CD1-CD2 3.87Å; F1481-Y1546 HydrophobicContact CD1-CD2 3.87Å; F1481-Y1546 AromaticContact CD1-CE1 3.72Å; F1481-Y1546 HydrophobicContact CD1-CE1 3.72Å; F1481-Y1546 HydrophobicContact CD1-CE2 4.18Å; F1481-Y1546 AromaticContact CD1-CG 3.46Å; F1481-Y1546 HydrophobicContact CD1-CG 3.46Å; F1481-Y1546 VanDerWaalsContact CD1-CG 3.46Å; F1481-Y1546 HydrophobicContact CD2-CG 4.08Å; F1481-Y1546 AromaticContact CE1-CD1 3.61Å; F1481-Y1546 HydrophobicContact CE1-CD1 3.61Å; F1481-Y1546 HydrophobicContact CE1-CE1 4.07Å; F1481-Y1546 HydrophobicContact CE1-CG 4.05Å; F1481-Y1546 AromaticContact CG-CD1 3.93Å; F1481-Y1546 HydrophobicContact CG-CD1 3.93Å; F1481-Y1546 AromaticContact CG-CD2 3.75Å; F1481-Y1546 HydrophobicContact CG-CD2 3.75Å; F1481-Y1546 HydrophobicContact CG-CE2 4.39Å; F1481-Y1546 AromaticContact CG-CG 3.49Å; F1481-Y1546 HydrophobicContact CG-CG 3.49Å; F1481-Y1546 VanDerWaalsContact CG-CG 3.49Å; F1481-Y1546 HydrophobicContact CZ-CD1 4.33Å
1482	G	87.9	Confident	82.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-42.5	177.6	0	0	0	0	0	114.4	L1478 L1479 A1480 Q1486 I1504	L1478-G1482 PolarHBondContact O-N 3.02Å; L1479-G1482 PolarHBondContact O-N 3.33Å; A1480-G1482 VanDerWaalsContact C-N 3.33Å; A1480-G1482 PolarHBondContact O-N 2.96Å; G1482-Q1486 VanDerWaalsContact O-CB 3.29Å; G1482-Q1486 WeakPolarHBondContact O-CB 3.32Å; G1482-Q1486 PolarHBondContact O-N 2.9Å; G1482-I1504 VanDerWaalsContact CA-O 3.23Å; G1482-I1504 WeakPolarHBondContact CA-O 3.26Å
1483	T	88	Confident	81.7	Confident	64 Å²	64	52.5 Å²	52.5	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-71.3	-41.1	177.7	48.7	0	0	0	0	112.2	L1479 A1480 F1481 G1487 I1504	L1479-T1483 HydrophobicContact CD2-CG2 4.29Å; L1479-T1483 WeakPolarHBondContact O-CB 3.23Å; L1479-T1483 WeakPolarHBondContact O-CG2 3.49Å; L1479-T1483 PolarHBondContact O-N 3.46Å; L1479-T1483 PolarHBondContact O-OG1 3.39Å; A1480-T1483 PolarHBondContact O-N 2.91Å; A1480-T1483 PolarHBondContact O-OG1 3.36Å; F1481-T1483 PolarHBondContact O-N 3.4Å; T1483-G1487 PolarHBondContact O-N 2.96Å; T1483-I1504 HydrophobicContact CG2-CD1 4.37Å; T1483-I1504 HydrophobicContact CG2-CG2 3.86Å
1484	I	87.1	Confident	81.1	Confident	84 Å²	84	56 Å²	56	43%	0.431	31%	0.306	S	S	.	.	H	α-helix	trans	-58.9	-52.4	173	-67.4	165.6	0	0	0	110.7	A1480 F1481 Q1486 G1487 I1488	A1480-I1484 WeakPolarHBondContact O-CD1 3.28Å; A1480-I1484 VanDerWaalsContact O-CG1 3.31Å; A1480-I1484 WeakPolarHBondContact O-CG1 3.22Å; A1480-I1484 PolarHBondContact O-N 3.38Å; A1480-I1484 VanDerWaalsContact O-N 3.13Å; F1481-I1484 PolarHBondContact O-N 3.39Å; I1484-Q1486 PolarHBondContact O-N 3.15Å; I1484-G1487 PolarHBondContact O-N 2.87Å; I1484-I1488 HydrophobicContact CG2-CD1 3.87Å; I1484-I1488 WeakPolarHBondContact O-CG1 3.32Å; I1484-I1488 PolarHBondContact O-N 2.98Å; I1484-I1488 VanDerWaalsContact O-N 3.07Å
1485	R	84.2	Confident	80.8	Confident	14 Å²	14	60.4 Å²	60.4	5%	0.053	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-47.8	-178	-164.7	-167.1	77.3	82.3	14	111.4	F1481 M1489 G1503 E1520 V1539	F1481-R1485 HydrophobicContact CE2-CB 4.3Å; F1481-R1485 HydrophobicContact CE2-CG 4.49Å; F1481-R1485 HydrophobicContact CZ-CB 4.27Å; F1481-R1485 HydrophobicContact CZ-CG 4.14Å; F1481-R1485 VanDerWaalsContact O-CB 3.22Å; F1481-R1485 WeakPolarHBondContact O-CB 3.49Å; F1481-R1485 PolarHBondContact O-N 2.96Å; R1485-M1489 WeakPolarHBondContact O-CB 3.22Å; R1485-M1489 PolarHBondContact O-N 3.39Å; R1485-M1489 VanDerWaalsContact O-N 3.15Å; R1485-G1503 PolarHBondContact NH2-O 3.08Å; R1485-E1520 IonicContact NH1-OE2 2.88Å; R1485-V1539 HydrophobicContact CG-CG1 3.99Å
1486	Q	85	Confident	80.3	Confident	23 Å²	23	62 Å²	62	11%	0.107	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-37.8	179	-169.7	70.3	24.4	0	0	112.1	G1482 I1484 Y1490 I1504	G1482-Q1486 VanDerWaalsContact O-CB 3.29Å; G1482-Q1486 WeakPolarHBondContact O-CB 3.32Å; G1482-Q1486 PolarHBondContact O-N 2.9Å; I1484-Q1486 PolarHBondContact O-N 3.15Å; Q1486-Y1490 HydrophobicContact CG-CD2 4.5Å; Q1486-Y1490 PolarHBondContact O-N 2.81Å; Q1486-Y1490 VanDerWaalsContact O-N 3.14Å; Q1486-I1504 HydrophobicContact CB-CD1 4.44Å; Q1486-I1504 HydrophobicContact CB-CG1 3.58Å; Q1486-I1504 HydrophobicContact CG-CD1 4.34Å; Q1486-I1504 HydrophobicContact CG-CG1 3.79Å
1487	G	81.4	Confident	79.9	Confident	46 Å²	46	59.3 Å²	59.3	47%	0.474	32%	0.324	S	S	.	.	H	α-helix	trans	-66.4	-43.7	-179.2	0	0	0	0	0	113.7	T1483 I1484	T1483-G1487 PolarHBondContact O-N 2.96Å; I1484-G1487 PolarHBondContact O-N 2.87Å
1488	I	81.2	Confident	79.5	Confident	35 Å²	35	64.8 Å²	64.8	18%	0.179	35%	0.352	C	S	.	.	H	α-helix	trans	-74.9	-40.3	179.2	-59.4	167.7	0	0	0	111.2	I1484 Y1490 W1526 I1538 V1539	I1484-I1488 HydrophobicContact CG2-CD1 3.87Å; I1484-I1488 WeakPolarHBondContact O-CG1 3.32Å; I1484-I1488 PolarHBondContact O-N 2.98Å; I1484-I1488 VanDerWaalsContact O-N 3.07Å; I1488-Y1490 VanDerWaalsContact C-N 3.34Å; I1488-Y1490 PolarHBondContact O-N 2.99Å; I1488-W1526 HydrophobicContact CG2-CZ3 4.37Å; I1488-I1538 HydrophobicContact CD1-CG2 4.4Å; I1488-V1539 HydrophobicContact CB-CG2 3.66Å; I1488-V1539 HydrophobicContact CD1-CG2 3.85Å; I1488-V1539 HydrophobicContact CG1-CG2 4.36Å; I1488-V1539 HydrophobicContact CG2-CG2 3.57Å
1489	M	75.8	Confident	79.1	Confident	10 Å²	10	69.9 Å²	69.9	5%	0.049	38%	0.375	C	S	.	.	H	α-helix	trans	-71.6	-25.7	-177.5	-165.7	-178	-162.5	0	0	113.1	R1485 E1520 S1530	R1485-M1489 WeakPolarHBondContact O-CB 3.22Å; R1485-M1489 PolarHBondContact O-N 3.39Å; R1485-M1489 VanDerWaalsContact O-N 3.15Å; M1489-E1520 HydrophobicContact CE-CB 4.27Å; M1489-S1530 VanDerWaalsContact O-CB 3.24Å; M1489-S1530 WeakPolarHBondContact O-CB 3.43Å
1490	Y	78.1	Confident	78.6	Confident	73 Å²	73	67.2 Å²	67.2	29%	0.286	36%	0.363	S	S	.	.			trans	-131.9	58.8	-174.6	-64.2	-78.1	0	0	0	113.7	Q1486 I1488 K1492 H1493	Q1486-Y1490 HydrophobicContact CG-CD2 4.5Å; Q1486-Y1490 PolarHBondContact O-N 2.81Å; Q1486-Y1490 VanDerWaalsContact O-N 3.14Å; I1488-Y1490 VanDerWaalsContact C-N 3.34Å; I1488-Y1490 PolarHBondContact O-N 2.99Å; Y1490-K1492 PolarHBondContact O-N 2.95Å; Y1490-H1493 AromaticContact CD1-CD2 4Å; Y1490-H1493 PolarHBondContact O-N 3.15Å
1491	P	71	Confident	78.2	Confident	74 Å²	74	68.1 Å²	68.1	48%	0.481	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-7.4	-168.6	28.8	-37.5	0	0	0	115.2	A1533	P1491-A1533 HydrophobicContact CG-CB 4.28Å
1492	K	68.2	Low	77.8	Confident	123 Å²	123	71.8 Å²	71.8	54%	0.535	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-3.2	177.6	-57.2	-178	-169.2	176.1	0	113.9	Y1490 T1494 E1529	Y1490-K1492 PolarHBondContact O-N 2.95Å; K1492-T1494 PolarHBondContact O-N 2.77Å; K1492-E1529 WeakPolarHBondContact CD-OE2 3.44Å; K1492-E1529 IonicContact NZ-OE2 2.66Å; K1492-E1529 PolarHBondContact NZ-OE2 2.78Å
1493	H	70.5	Confident	77.4	Confident	88 Å²	88	72.2 Å²	72.2	41%	0.407	39%	0.385	S	S	.	.			trans	-79.8	81.2	-178.6	-90.4	-97.7	0	0	0	112.1	Y1490 Y1495	Y1490-H1493 AromaticContact CD1-CD2 4Å; Y1490-H1493 PolarHBondContact O-N 3.15Å; H1493-Y1495 AromaticContact ND1-CE1 3.82Å; H1493-Y1495 PolarHBondContact O-N 3.15Å
1494	T	66.8	Low	77.3	Confident	137 Å²	137	70.9 Å²	70.9	84%	0.84	38%	0.375	S	S	*	.			trans	-79	4.6	178	53.5	0	0	0	0	114.8	K1492	K1492-T1494 PolarHBondContact O-N 2.77Å
1495	Y	72.5	Confident	77.1	Confident	129 Å²	129	69 Å²	69	51%	0.506	37%	0.365	S	S	.	.	S	Bend	trans	-134.3	130.1	-171.6	63.8	-69.3	0	0	0	111.7	H1493 N1497	H1493-Y1495 AromaticContact ND1-CE1 3.82Å; H1493-Y1495 PolarHBondContact O-N 3.15Å; Y1495-N1497 VanDerWaalsContact CD2-OD1 3.25Å; Y1495-N1497 WeakPolarHBondContact CD2-OD1 3.36Å; Y1495-N1497 WeakPolarHBondContact CE2-ND2 3.16Å; Y1495-N1497 VanDerWaalsContact CE2-OD1 3.24Å; Y1495-N1497 WeakPolarHBondContact CE2-OD1 3.27Å; Y1495-N1497 PolarHBondContact O-N 2.92Å
1496	V	70.8	Confident	77.1	Confident	133 Å²	133	72.4 Å²	72.4	81%	0.806	38%	0.384	S	S	*	.			trans	-80	84.1	-172.1	-173.1	0	0	0	0	110.7	V1501	V1496-V1501 HydrophobicContact CG1-CG2 4.01Å
1497	N	76.4	Confident	77	Confident	59 Å²	59	73.6 Å²	73.6	32%	0.316	39%	0.389	S	S	.	.			trans	-73.5	147.9	168.4	-72.7	-25.6	0	0	0	111.1	Y1495 E1499 A1500 V1501	Y1495-N1497 VanDerWaalsContact CD2-OD1 3.25Å; Y1495-N1497 WeakPolarHBondContact CD2-OD1 3.36Å; Y1495-N1497 WeakPolarHBondContact CE2-ND2 3.16Å; Y1495-N1497 VanDerWaalsContact CE2-OD1 3.24Å; Y1495-N1497 WeakPolarHBondContact CE2-OD1 3.27Å; Y1495-N1497 PolarHBondContact O-N 2.92Å; N1497-E1499 HydrophobicContact CB-CB 4.35Å; N1497-E1499 PolarHBondContact O-N 3.34Å; N1497-E1499 VanDerWaalsContact O-N 3.17Å; N1497-A1500 HydrophobicContact CB-CB 4.38Å; N1497-A1500 WeakPolarHBondContact O-CB 3.42Å; N1497-A1500 PolarHBondContact O-N 2.92Å; N1497-V1501 PolarHBondContact O-N 3.23Å; N1497-V1501 VanDerWaalsContact O-N 3.13Å
1498	L	74	Confident	77.2	Confident	131 Å²	131	71.4 Å²	71.4	69%	0.686	37%	0.366	S	S	*	.	H	α-helix	trans	-54.2	-33.1	165	-177.3	63.7	0	0	0	111.7	A1500 V1501 K1502	L1498-A1500 VanDerWaalsContact C-N 3.35Å; L1498-A1500 PolarHBondContact O-N 3.44Å; L1498-V1501 PolarHBondContact O-N 3.32Å; L1498-K1502 WeakPolarHBondContact O-CG 3.48Å; L1498-K1502 PolarHBondContact O-N 2.71Å
1499	E	76.6	Confident	77.4	Confident	120 Å²	120	74.5 Å²	74.5	56%	0.561	38%	0.376	S	S	*	.	H	α-helix	trans	-66.6	-32.6	175.5	-139.4	62.2	-149.1	0	0	113.4	N1497 K1502 G1503	N1497-E1499 HydrophobicContact CB-CB 4.35Å; N1497-E1499 PolarHBondContact O-N 3.34Å; N1497-E1499 VanDerWaalsContact O-N 3.17Å; E1499-K1502 WeakPolarHBondContact OE1-CD 3.4Å; E1499-K1502 IonicContact OE1-NZ 2.69Å; E1499-K1502 PolarHBondContact OE1-NZ 3.36Å; E1499-K1502 WeakPolarHBondContact OE2-CE 3.19Å; E1499-K1502 IonicContact OE2-NZ 3.1Å; E1499-K1502 PolarHBondContact OE2-NZ 3.39Å; E1499-G1503 PolarHBondContact O-N 3.27Å
1500	A	76.6	Confident	77.9	Confident	14 Å²	14	77.9 Å²	77.9	12%	0.116	39%	0.391	C	S	.	.	H	α-helix	trans	-71.3	-39.9	173.1	0	0	0	0	0	110.7	N1497 L1498 K1502 G1503 I1504	N1497-A1500 HydrophobicContact CB-CB 4.38Å; N1497-A1500 WeakPolarHBondContact O-CB 3.42Å; N1497-A1500 PolarHBondContact O-N 2.92Å; L1498-A1500 VanDerWaalsContact C-N 3.35Å; L1498-A1500 PolarHBondContact O-N 3.44Å; A1500-K1502 PolarHBondContact O-N 2.68Å; A1500-G1503 WeakPolarHBondContact O-CA 3.45Å; A1500-G1503 PolarHBondContact O-N 3.38Å; A1500-G1503 VanDerWaalsContact O-N 3.09Å; A1500-I1504 WeakPolarHBondContact O-CG1 3.36Å; A1500-I1504 PolarHBondContact O-N 3.29Å
1501	V	80.1	Confident	78.1	Confident	63 Å²	63	74.5 Å²	74.5	38%	0.382	38%	0.378	S	S	.	.	H	α-helix	trans	-63	-39.8	174.3	-179.4	0	0	0	0	111.4	V1496 N1497 L1498 I1504 M1505	V1496-V1501 HydrophobicContact CG1-CG2 4.01Å; N1497-V1501 PolarHBondContact O-N 3.23Å; N1497-V1501 VanDerWaalsContact O-N 3.13Å; L1498-V1501 PolarHBondContact O-N 3.32Å; V1501-I1504 PolarHBondContact O-N 2.93Å; V1501-M1505 WeakPolarHBondContact O-CG 3.01Å; V1501-M1505 PolarHBondContact O-N 2.82Å
1502	K	81.3	Confident	78.7	Confident	87 Å²	87	72.3 Å²	72.3	38%	0.378	36%	0.361	S	S	.	.	H	α-helix	trans	-61.5	-43.2	168.8	-68.9	174.1	-171.2	166.8	0	111.9	L1498 E1499 A1500 I1504 M1505 L1506	L1498-K1502 WeakPolarHBondContact O-CG 3.48Å; L1498-K1502 PolarHBondContact O-N 2.71Å; E1499-K1502 WeakPolarHBondContact OE1-CD 3.4Å; E1499-K1502 IonicContact OE1-NZ 2.69Å; E1499-K1502 PolarHBondContact OE1-NZ 3.36Å; E1499-K1502 WeakPolarHBondContact OE2-CE 3.19Å; E1499-K1502 IonicContact OE2-NZ 3.1Å; E1499-K1502 PolarHBondContact OE2-NZ 3.39Å; A1500-K1502 PolarHBondContact O-N 2.68Å; K1502-I1504 VanDerWaalsContact C-N 3.26Å; K1502-I1504 PolarHBondContact O-N 3.23Å; K1502-M1505 PolarHBondContact O-N 3.24Å; K1502-L1506 VanDerWaalsContact O-CB 3.22Å; K1502-L1506 WeakPolarHBondContact O-CB 3.08Å; K1502-L1506 PolarHBondContact O-N 3.49Å
1503	G	78.7	Confident	79.4	Confident	9 Å²	9	73.8 Å²	73.8	9%	0.093	37%	0.365	C	S	.	.	H	α-helix	trans	-63.2	-30.6	178.9	0	0	0	0	0	114	R1485 E1499 A1500	R1485-G1503 PolarHBondContact NH2-O 3.08Å; E1499-G1503 PolarHBondContact O-N 3.27Å; A1500-G1503 WeakPolarHBondContact O-CA 3.45Å; A1500-G1503 PolarHBondContact O-N 3.38Å; A1500-G1503 VanDerWaalsContact O-N 3.09Å
1504	I	86	Confident	79.8	Confident	36 Å²	36	72.1 Å²	72.1	19%	0.185	37%	0.371	C	S	.	.	H	α-helix	trans	-73.8	-51.1	172.3	-68.9	162.6	0	0	0	110.9	G1482 T1483 Q1486 A1500 V1501 K1502 P1508	G1482-I1504 VanDerWaalsContact CA-O 3.23Å; G1482-I1504 WeakPolarHBondContact CA-O 3.26Å; T1483-I1504 HydrophobicContact CG2-CD1 4.37Å; T1483-I1504 HydrophobicContact CG2-CG2 3.86Å; Q1486-I1504 HydrophobicContact CB-CD1 4.44Å; Q1486-I1504 HydrophobicContact CB-CG1 3.58Å; Q1486-I1504 HydrophobicContact CG-CD1 4.34Å; Q1486-I1504 HydrophobicContact CG-CG1 3.79Å; A1500-I1504 WeakPolarHBondContact O-CG1 3.36Å; A1500-I1504 PolarHBondContact O-N 3.29Å; V1501-I1504 PolarHBondContact O-N 2.93Å; K1502-I1504 VanDerWaalsContact C-N 3.26Å; K1502-I1504 PolarHBondContact O-N 3.23Å; I1504-P1508 VanDerWaalsContact O-CD 3.28Å; I1504-P1508 WeakPolarHBondContact O-CD 3.36Å; I1504-P1508 VanDerWaalsContact O-CG 3.26Å; I1504-P1508 WeakPolarHBondContact O-CG 3.32Å
1505	M	83.7	Confident	80.6	Confident	45 Å²	45	71.5 Å²	71.5	22%	0.222	36%	0.359	C	S	.	.	H	α-helix	trans	-87	-51.7	-170.7	-66	-84.9	93.4	0	0	113.9	F1475 L1478 L1479 V1501 K1502 Y1509	F1475-M1505 HydrophobicContact CE2-CE 4.14Å; F1475-M1505 HydrophobicContact CE2-SD 3.51Å; F1475-M1505 VanDerWaalsContact CE2-SD 3.51Å; F1475-M1505 HydrophobicContact CZ-CE 4.09Å; F1475-M1505 HydrophobicContact CZ-SD 3.6Å; F1475-M1505 VanDerWaalsContact CZ-SD 3.6Å; L1478-M1505 HydrophobicContact CD2-CE 3.64Å; L1478-M1505 HydrophobicContact CD2-SD 4.29Å; L1479-M1505 HydrophobicContact CB-CE 3.67Å; L1479-M1505 HydrophobicContact CD1-CE 3.85Å; L1479-M1505 HydrophobicContact CG-CE 3.73Å; V1501-M1505 WeakPolarHBondContact O-CG 3.01Å; V1501-M1505 PolarHBondContact O-N 2.82Å; K1502-M1505 PolarHBondContact O-N 3.24Å; M1505-Y1509 WeakPolarHBondContact O-CB 3.37Å; M1505-Y1509 PolarHBondContact O-N 3.47Å
1506	L	83.5	Confident	80.6	Confident	86 Å²	86	67.9 Å²	67.9	45%	0.45	35%	0.35	S	S	.	.	H	α-helix	trans	-78.1	-34.2	-160.9	-166.7	67.4	0	0	0	112.8	K1502 F1510	K1502-L1506 VanDerWaalsContact O-CB 3.22Å; K1502-L1506 WeakPolarHBondContact O-CB 3.08Å; K1502-L1506 PolarHBondContact O-N 3.49Å; L1506-F1510 HydrophobicContact CD1-CD2 4.19Å; L1506-F1510 HydrophobicContact CD1-CE2 3.67Å; L1506-F1510 HydrophobicContact CD2-CE2 4.32Å; L1506-F1510 HydrophobicContact CG-CD2 3.97Å; L1506-F1510 HydrophobicContact CG-CE2 3.76Å; L1506-F1510 VanDerWaalsContact O-CD2 3.25Å; L1506-F1510 WeakPolarHBondContact O-CD2 3.47Å; L1506-F1510 PolarHBondContact O-N 3.4Å
1507	K	83.1	Confident	80.8	Confident	48 Å²	48	64.9 Å²	64.9	21%	0.209	33%	0.325	C	S	.	.	H	α-helix	trans	-70.3	-53.2	179.6	-75.5	-178.6	166.2	-177.9	0	111.7	Y1509 F1510 M1511 Y1517 E1520	K1507-Y1509 VanDerWaalsContact C-N 3.29Å; K1507-Y1509 PolarHBondContact O-N 3.04Å; K1507-F1510 PolarHBondContact O-N 2.7Å; K1507-M1511 VanDerWaalsContact O-CG 3.25Å; K1507-M1511 WeakPolarHBondContact O-CG 3.12Å; K1507-M1511 PolarHBondContact O-N 3.05Å; K1507-Y1517 HydrophobicContact CB-CD2 4.38Å; K1507-Y1517 HydrophobicContact CB-CE2 3.96Å; K1507-Y1517 HydrophobicContact CG-CD2 4.47Å; K1507-Y1517 HydrophobicContact CG-CE1 4.4Å; K1507-Y1517 HydrophobicContact CG-CE2 3.94Å; K1507-Y1517 WeakPolarHBondContact O-CE2 3.44Å; K1507-E1520 WeakPolarHBondContact CE-OE2 3.41Å; K1507-E1520 IonicContact NZ-OE1 2.63Å; K1507-E1520 PolarHBondContact NZ-OE1 2.91Å; K1507-E1520 IonicContact NZ-OE2 3.81Å; K1507-E1520 PolarHBondContact NZ-OE2 2.72Å
1508	P	85.3	Confident	80.4	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-51.5	-43.6	169.3	-32.9	40.6	0	0	0	114.3	L1478 F1481 I1504 F1510 M1511 L1512 Y1546	L1478-P1508 HydrophobicContact CD2-CB 4.34Å; L1478-P1508 HydrophobicContact CG-CB 4.1Å; F1481-P1508 HydrophobicContact CD1-CB 3.9Å; F1481-P1508 HydrophobicContact CD1-CG 3.79Å; F1481-P1508 HydrophobicContact CE1-CB 4.34Å; F1481-P1508 HydrophobicContact CE1-CG 4.06Å; I1504-P1508 VanDerWaalsContact O-CD 3.28Å; I1504-P1508 WeakPolarHBondContact O-CD 3.36Å; I1504-P1508 VanDerWaalsContact O-CG 3.26Å; I1504-P1508 WeakPolarHBondContact O-CG 3.32Å; P1508-F1510 PolarHBondContact O-N 2.73Å; P1508-M1511 WeakPolarHBondContact O-CB 3.24Å; P1508-M1511 PolarHBondContact O-N 2.66Å; P1508-M1511 VanDerWaalsContact O-N 3.14Å; P1508-L1512 PolarHBondContact O-N 3.02Å; P1508-Y1546 HydrophobicContact CB-CE1 4.43Å; P1508-Y1546 PolarHBondContact O-OH 2.77Å
1509	Y	86.6	Confident	80.2	Confident	100 Å²	100	61.4 Å²	61.4	39%	0.392	33%	0.328	S	S	.	.	H	α-helix	trans	-55.4	-47.4	177.5	179.5	-101.9	0	0	0	112.6	L1478 M1505 K1507 L1512 Y1513	L1478-Y1509 HydrophobicContact CD1-CD2 4.01Å; M1505-Y1509 WeakPolarHBondContact O-CB 3.37Å; M1505-Y1509 PolarHBondContact O-N 3.47Å; K1507-Y1509 VanDerWaalsContact C-N 3.29Å; K1507-Y1509 PolarHBondContact O-N 3.04Å; Y1509-L1512 WeakPolarHBondContact O-CB 3.31Å; Y1509-L1512 PolarHBondContact O-N 3.13Å; Y1509-Y1513 HydrophobicContact CD1-CE2 4.34Å; Y1509-Y1513 HydrophobicContact CD2-CE2 4.37Å; Y1509-Y1513 HydrophobicContact CE1-CD2 4.44Å; Y1509-Y1513 AromaticContact CE1-CE2 3.82Å; Y1509-Y1513 HydrophobicContact CE1-CE2 3.82Å; Y1509-Y1513 AromaticContact CE2-CE2 3.87Å; Y1509-Y1513 HydrophobicContact CE2-CE2 3.87Å; Y1509-Y1513 AromaticContact CZ-CE2 3.57Å; Y1509-Y1513 VanDerWaalsContact O-CD2 3.28Å; Y1509-Y1513 WeakPolarHBondContact O-CD2 3.32Å; Y1509-Y1513 PolarHBondContact OH-OH 3.29Å
1510	F	85.8	Confident	79.8	Confident	81 Å²	81	58.6 Å²	58.6	36%	0.355	32%	0.315	S	S	.	.	H	α-helix	trans	-71.2	-29.8	178	-80.2	-59.4	0	0	0	113.4	L1506 K1507 P1508 L1512 Y1513 G1514 E1515 Y1517	L1506-F1510 HydrophobicContact CD1-CD2 4.19Å; L1506-F1510 HydrophobicContact CD1-CE2 3.67Å; L1506-F1510 HydrophobicContact CD2-CE2 4.32Å; L1506-F1510 HydrophobicContact CG-CD2 3.97Å; L1506-F1510 HydrophobicContact CG-CE2 3.76Å; L1506-F1510 VanDerWaalsContact O-CD2 3.25Å; L1506-F1510 WeakPolarHBondContact O-CD2 3.47Å; L1506-F1510 PolarHBondContact O-N 3.4Å; K1507-F1510 PolarHBondContact O-N 2.7Å; P1508-F1510 PolarHBondContact O-N 2.73Å; F1510-L1512 PolarHBondContact O-N 2.99Å; F1510-Y1513 PolarHBondContact O-N 3.28Å; F1510-G1514 PolarHBondContact O-N 2.88Å; F1510-E1515 HydrophobicContact CB-CB 4.05Å; F1510-E1515 PolarHBondContact O-N 2.97Å; F1510-Y1517 HydrophobicContact CB-CE2 4.03Å
1511	M	83.3	Confident	79.5	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-62.1	-31.8	174.9	-65.9	165.3	70.1	0	0	112.4	F1481 K1507 P1508 Y1513 G1514 E1515 Y1517 T1543 Y1546 L1547	F1481-M1511 HydrophobicContact CE1-CE 3.74Å; F1481-M1511 HydrophobicContact CE1-SD 3.9Å; F1481-M1511 HydrophobicContact CZ-CE 3.87Å; F1481-M1511 HydrophobicContact CZ-SD 4.47Å; K1507-M1511 VanDerWaalsContact O-CG 3.25Å; K1507-M1511 WeakPolarHBondContact O-CG 3.12Å; K1507-M1511 PolarHBondContact O-N 3.05Å; P1508-M1511 WeakPolarHBondContact O-CB 3.24Å; P1508-M1511 PolarHBondContact O-N 2.66Å; P1508-M1511 VanDerWaalsContact O-N 3.14Å; M1511-Y1513 PolarHBondContact O-N 3.38Å; M1511-G1514 PolarHBondContact O-N 2.81Å; M1511-E1515 WeakPolarHBondContact CA-O 3.49Å; M1511-E1515 VanDerWaalsContact CG-O 3.3Å; M1511-E1515 WeakPolarHBondContact CG-O 3.27Å; M1511-Y1517 HydrophobicContact CG-CD2 3.67Å; M1511-Y1517 HydrophobicContact CG-CE2 4.06Å; M1511-Y1517 HydrophobicContact SD-CD2 4.16Å; M1511-T1543 HydrophobicContact CE-CG2 3.32Å; M1511-Y1546 HydrophobicContact CB-CE1 4.45Å; M1511-L1547 HydrophobicContact CB-CD2 4.32Å; M1511-L1547 WeakPolarHBondContact O-CD2 3.36Å
1512	L	83.1	Confident	79.1	Confident	27 Å²	27	60.5 Å²	60.5	14%	0.141	32%	0.321	C	S	.	.	H	α-helix	trans	-61.5	-31.3	172.9	-169.9	68.5	0	0	0	112.9	L1474 P1508 Y1509 F1510 G1514 I1551 V1555	L1474-L1512 HydrophobicContact CD1-CD2 4.16Å; L1474-L1512 HydrophobicContact CD2-CD2 4.15Å; P1508-L1512 PolarHBondContact O-N 3.02Å; Y1509-L1512 WeakPolarHBondContact O-CB 3.31Å; Y1509-L1512 PolarHBondContact O-N 3.13Å; F1510-L1512 PolarHBondContact O-N 2.99Å; L1512-G1514 VanDerWaalsContact C-N 3.31Å; L1512-I1551 HydrophobicContact CD1-CG1 4.47Å; L1512-V1555 HydrophobicContact CD1-CG2 4.12Å
1513	Y	81.8	Confident	78.5	Confident	155 Å²	155	57.8 Å²	57.8	61%	0.608	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	6.8	175.9	-64.5	-87.3	0	0	0	113.4	Y1509 F1510 M1511	Y1509-Y1513 HydrophobicContact CD1-CE2 4.34Å; Y1509-Y1513 HydrophobicContact CD2-CE2 4.37Å; Y1509-Y1513 HydrophobicContact CE1-CD2 4.44Å; Y1509-Y1513 AromaticContact CE1-CE2 3.82Å; Y1509-Y1513 HydrophobicContact CE1-CE2 3.82Å; Y1509-Y1513 AromaticContact CE2-CE2 3.87Å; Y1509-Y1513 HydrophobicContact CE2-CE2 3.87Å; Y1509-Y1513 AromaticContact CZ-CE2 3.57Å; Y1509-Y1513 VanDerWaalsContact O-CD2 3.28Å; Y1509-Y1513 WeakPolarHBondContact O-CD2 3.32Å; Y1509-Y1513 PolarHBondContact OH-OH 3.29Å; F1510-Y1513 PolarHBondContact O-N 3.28Å; M1511-Y1513 PolarHBondContact O-N 3.38Å
1514	G	80.2	Confident	78.1	Confident	53 Å²	53	64 Å²	64	55%	0.546	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	1.7	178.6	0	0	0	0	0	115.7	F1510 M1511 L1512 V1516	F1510-G1514 PolarHBondContact O-N 2.88Å; M1511-G1514 PolarHBondContact O-N 2.81Å; L1512-G1514 VanDerWaalsContact C-N 3.31Å; G1514-V1516 VanDerWaalsContact C-N 3.28Å; G1514-V1516 PolarHBondContact O-N 3.11Å
1515	E	82.6	Confident	77.4	Confident	124 Å²	124	67.5 Å²	67.5	58%	0.579	36%	0.361	S	S	*	.			trans	-80.5	76.1	171.6	-72.5	-73.2	-175.4	0	0	109.7	F1510 M1511 Y1517	F1510-E1515 HydrophobicContact CB-CB 4.05Å; F1510-E1515 PolarHBondContact O-N 2.97Å; M1511-E1515 WeakPolarHBondContact CA-O 3.49Å; M1511-E1515 VanDerWaalsContact CG-O 3.3Å; M1511-E1515 WeakPolarHBondContact CG-O 3.27Å; E1515-Y1517 WeakPolarHBondContact O-CD2 3.23Å; E1515-Y1517 WeakPolarHBondContact O-CE2 3.3Å; E1515-Y1517 PolarHBondContact O-N 2.79Å; E1515-Y1517 VanDerWaalsContact O-N 3.17Å
1516	V	74.1	Confident	76.8	Confident	53 Å²	53	65.7 Å²	65.7	32%	0.321	35%	0.351	S	S	.	.			trans	-72.2	-5.8	-167.6	176.5	0	0	0	0	114.1	G1514 A1518 I1521 L1547	G1514-V1516 VanDerWaalsContact C-N 3.28Å; G1514-V1516 PolarHBondContact O-N 3.11Å; V1516-A1518 VanDerWaalsContact C-N 3.31Å; V1516-A1518 PolarHBondContact O-N 2.82Å; V1516-I1521 HydrophobicContact CG1-CD1 3.68Å; V1516-I1521 WeakPolarHBondContact O-CD1 3.37Å; V1516-L1547 HydrophobicContact CG1-CD1 4.24Å; V1516-L1547 HydrophobicContact CG2-CD1 4.16Å
1517	Y	74.2	Confident	76.2	Confident	70 Å²	70	64.5 Å²	64.5	28%	0.275	35%	0.349	S	S	.	.			trans	49.9	43.2	-178.2	-60.2	-81.6	0	0	0	114.1	K1507 F1510 M1511 E1515 G1519 E1520 I1521	K1507-Y1517 HydrophobicContact CB-CD2 4.38Å; K1507-Y1517 HydrophobicContact CB-CE2 3.96Å; K1507-Y1517 HydrophobicContact CG-CD2 4.47Å; K1507-Y1517 HydrophobicContact CG-CE1 4.4Å; K1507-Y1517 HydrophobicContact CG-CE2 3.94Å; K1507-Y1517 WeakPolarHBondContact O-CE2 3.44Å; F1510-Y1517 HydrophobicContact CB-CE2 4.03Å; M1511-Y1517 HydrophobicContact CG-CD2 3.67Å; M1511-Y1517 HydrophobicContact CG-CE2 4.06Å; M1511-Y1517 HydrophobicContact SD-CD2 4.16Å; E1515-Y1517 WeakPolarHBondContact O-CD2 3.23Å; E1515-Y1517 WeakPolarHBondContact O-CE2 3.3Å; E1515-Y1517 PolarHBondContact O-N 2.79Å; E1515-Y1517 VanDerWaalsContact O-N 3.17Å; Y1517-G1519 PolarHBondContact O-N 3.45Å; Y1517-G1519 VanDerWaalsContact O-N 3.14Å; Y1517-E1520 WeakPolarHBondContact O-CA 3.23Å; Y1517-E1520 WeakPolarHBondContact O-CB 3.07Å; Y1517-E1520 PolarHBondContact O-N 3.04Å; Y1517-I1521 PolarHBondContact O-N 3.48Å
1518	A	67.1	Low	75.5	Confident	67 Å²	67	68.8 Å²	68.8	55%	0.554	37%	0.373	S	S	*	.	H	α-helix	trans	-48.6	-47.2	-169.3	0	0	0	0	0	115	V1516 E1520 I1521 D1522	V1516-A1518 VanDerWaalsContact C-N 3.31Å; V1516-A1518 PolarHBondContact O-N 2.82Å; A1518-E1520 PolarHBondContact O-N 2.82Å; A1518-E1520 VanDerWaalsContact O-N 3.13Å; A1518-I1521 WeakPolarHBondContact O-CB 3.38Å; A1518-I1521 PolarHBondContact O-N 2.92Å; A1518-D1522 PolarHBondContact O-N 3.27Å
1519	G	69.8	Low	74.4	Confident	50 Å²	50	74.7 Å²	74.7	52%	0.515	40%	0.4	S	S	.	.	H	α-helix	trans	-72.2	5.3	176.9	0	0	0	0	0	116	Y1517	Y1517-G1519 PolarHBondContact O-N 3.45Å; Y1517-G1519 VanDerWaalsContact O-N 3.14Å
1520	E	68.3	Low	73.5	Confident	61 Å²	61	70.1 Å²	70.1	29%	0.285	38%	0.383	S	S	.	.	H	α-helix	trans	-107.6	-12.8	163.5	-63.1	-167	-180	0	0	112.8	R1485 M1489 K1507 Y1517 A1518 W1526	R1485-E1520 IonicContact NH1-OE2 2.88Å; M1489-E1520 HydrophobicContact CE-CB 4.27Å; K1507-E1520 WeakPolarHBondContact CE-OE2 3.41Å; K1507-E1520 IonicContact NZ-OE1 2.63Å; K1507-E1520 PolarHBondContact NZ-OE1 2.91Å; K1507-E1520 IonicContact NZ-OE2 3.81Å; K1507-E1520 PolarHBondContact NZ-OE2 2.72Å; Y1517-E1520 WeakPolarHBondContact O-CA 3.23Å; Y1517-E1520 WeakPolarHBondContact O-CB 3.07Å; Y1517-E1520 PolarHBondContact O-N 3.04Å; A1518-E1520 PolarHBondContact O-N 2.82Å; A1518-E1520 VanDerWaalsContact O-N 3.13Å; E1520-W1526 PolarHBondContact O-NE1 2.78Å
1521	I	70	Confident	72.5	Confident	26 Å²	26	70.2 Å²	70.2	13%	0.133	38%	0.384	C	S	.	.	H	α-helix	trans	-80.9	-43.3	178.4	-66.8	171	0	0	0	110.2	V1516 Y1517 A1518 P1523 W1526 P1540 T1543	V1516-I1521 HydrophobicContact CG1-CD1 3.68Å; V1516-I1521 WeakPolarHBondContact O-CD1 3.37Å; Y1517-I1521 PolarHBondContact O-N 3.48Å; A1518-I1521 WeakPolarHBondContact O-CB 3.38Å; A1518-I1521 PolarHBondContact O-N 2.92Å; I1521-P1523 WeakPolarHBondContact O-CD 3.16Å; I1521-W1526 PolarHBondContact O-NE1 3.03Å; I1521-W1526 VanDerWaalsContact O-NE1 3.17Å; I1521-P1540 HydrophobicContact CG2-CB 3.8Å; I1521-P1540 HydrophobicContact CG2-CG 3.82Å; I1521-T1543 HydrophobicContact CD1-CG2 3.69Å; I1521-T1543 HydrophobicContact CG1-CG2 4.47Å
1522	D	72.2	Confident	71.8	Confident	91 Å²	91	75.8 Å²	75.8	49%	0.487	42%	0.419	S	S	.	.	S	Bend	trans	-62.7	120.4	-175.1	-82.1	-28.4	0	0	0	111.7	A1518 I1524 D1525 W1526	A1518-D1522 PolarHBondContact O-N 3.27Å; D1522-I1524 PolarHBondContact O-N 2.76Å; D1522-D1525 PolarHBondContact O-N 3.05Å; D1522-W1526 PolarHBondContact O-NE1 2.66Å
1523	P	68.2	Low	71	Confident	29 Å²	29	75.1 Å²	75.1	19%	0.188	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-15	-176.7	-30.6	37.9	0	0	0	116.5	I1521 W1526 L1536 P1540	I1521-P1523 WeakPolarHBondContact O-CD 3.16Å; P1523-W1526 HydrophobicContact CG-CZ2 4.29Å; P1523-L1536 HydrophobicContact CB-CD2 3.61Å; P1523-L1536 HydrophobicContact CB-CG 3.87Å; P1523-L1536 HydrophobicContact CG-CG 4.47Å; P1523-P1540 HydrophobicContact CG-CG 4.18Å
1524	I	71	Confident	70.3	Confident	140 Å²	140	72.3 Å²	72.3	72%	0.718	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-38.8	178.8	-61.4	171.9	0	0	0	110.8	D1522 W1526 Q1531	D1522-I1524 PolarHBondContact O-N 2.76Å; I1524-W1526 VanDerWaalsContact C-N 3.32Å; I1524-Q1531 PolarHBondContact O-NE2 3.43Å
1525	D	70.9	Confident	69.8	Low	110 Å²	110	76.9 Å²	76.9	59%	0.588	42%	0.423	S	S	*	.	S	Bend	trans	-87.9	-1.7	-175.2	-71.1	-24	0	0	0	113	D1522	D1522-D1525 PolarHBondContact O-N 3.05Å
1526	W	72.7	Confident	69.4	Low	6 Å²	6	73 Å²	73	2%	0.023	41%	0.406	C	S	.	.	S	Bend	trans	-68.6	151.4	175.9	-66	11.5	0	0	0	111.5	I1488 E1520 I1521 D1522 P1523 I1524 I1528 Q1531 L1536 V1539	I1488-W1526 HydrophobicContact CG2-CZ3 4.37Å; E1520-W1526 PolarHBondContact O-NE1 2.78Å; I1521-W1526 PolarHBondContact O-NE1 3.03Å; I1521-W1526 VanDerWaalsContact O-NE1 3.17Å; D1522-W1526 PolarHBondContact O-NE1 2.66Å; P1523-W1526 HydrophobicContact CG-CZ2 4.29Å; I1524-W1526 VanDerWaalsContact C-N 3.32Å; W1526-I1528 PolarHBondContact O-N 2.88Å; W1526-Q1531 PolarHBondContact O-NE2 3.32Å; W1526-L1536 HydrophobicContact CE3-CD1 3.68Å; W1526-L1536 HydrophobicContact CE3-CG 4.24Å; W1526-L1536 HydrophobicContact CH2-CD1 4.45Å; W1526-L1536 HydrophobicContact CH2-CG 4.4Å; W1526-L1536 VanDerWaalsContact CH2-O 3.3Å; W1526-L1536 WeakPolarHBondContact CH2-O 3.19Å; W1526-L1536 HydrophobicContact CZ3-CD1 3.48Å; W1526-L1536 VanDerWaalsContact CZ3-CD1 3.48Å; W1526-L1536 HydrophobicContact CZ3-CG 3.86Å; W1526-V1539 HydrophobicContact CH2-CB 3.64Å; W1526-V1539 HydrophobicContact CH2-CG1 4.35Å; W1526-V1539 HydrophobicContact CH2-CG2 3.59Å; W1526-V1539 HydrophobicContact CZ2-CB 3.73Å; W1526-V1539 HydrophobicContact CZ2-CG1 4.04Å; W1526-V1539 HydrophobicContact CZ2-CG2 4.13Å
1527	P	70.6	Confident	69.5	Low	61 Å²	61	77.7 Å²	77.7	40%	0.396	42%	0.424	S	S	.	.			trans	-49.3	140.9	172.2	-27.3	34	0	0	0	112.4	E1529 S1530 Q1531	P1527-E1529 PolarHBondContact O-N 3.44Å; P1527-S1530 WeakPolarHBondContact CD-OG 3.33Å; P1527-S1530 PolarHBondContact O-N 2.96Å; P1527-S1530 PolarHBondContact O-OG 3.39Å; P1527-Q1531 PolarHBondContact O-N 2.73Å
1528	I	67	Low	69.9	Low	139 Å²	139	78 Å²	78	71%	0.713	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.3	-178.8	-56.5	169.1	0	0	0	111.5	W1526 S1530	W1526-I1528 PolarHBondContact O-N 2.88Å; I1528-S1530 VanDerWaalsContact C-N 3.33Å; I1528-S1530 PolarHBondContact O-N 3.16Å
1529	E	63.5	Low	70.5	Confident	123 Å²	123	75 Å²	75	58%	0.575	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-19.3	177.9	-61.6	-166.5	-129.8	0	0	115.3	K1492 P1527 T1532	K1492-E1529 WeakPolarHBondContact CD-OE2 3.44Å; K1492-E1529 IonicContact NZ-OE2 2.66Å; K1492-E1529 PolarHBondContact NZ-OE2 2.78Å; P1527-E1529 PolarHBondContact O-N 3.44Å; E1529-T1532 PolarHBondContact O-OG1 2.86Å
1530	S	66.4	Low	71.1	Confident	4 Å²	4	74.2 Å²	74.2	3%	0.028	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-16.8	176.6	37.4	0	0	0	0	113.1	M1489 P1527 I1528 T1532 A1533 L1536	M1489-S1530 VanDerWaalsContact O-CB 3.24Å; M1489-S1530 WeakPolarHBondContact O-CB 3.43Å; P1527-S1530 WeakPolarHBondContact CD-OG 3.33Å; P1527-S1530 PolarHBondContact O-N 2.96Å; P1527-S1530 PolarHBondContact O-OG 3.39Å; I1528-S1530 VanDerWaalsContact C-N 3.33Å; I1528-S1530 PolarHBondContact O-N 3.16Å; S1530-T1532 PolarHBondContact O-N 3.39Å; S1530-T1532 VanDerWaalsContact O-N 3.11Å; S1530-A1533 WeakPolarHBondContact O-CB 3.45Å; S1530-A1533 PolarHBondContact O-N 3.12Å; S1530-L1536 WeakPolarHBondContact O-CD1 3.4Å
1531	Q	66.2	Low	72	Confident	83 Å²	83	76 Å²	76	39%	0.388	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.8	170.8	-67.8	179.2	-4.1	0	0	113.1	I1524 W1526 P1527	I1524-Q1531 PolarHBondContact O-NE2 3.43Å; W1526-Q1531 PolarHBondContact O-NE2 3.32Å; P1527-Q1531 PolarHBondContact O-N 2.73Å
1532	T	67.6	Low	72.8	Confident	119 Å²	119	75.6 Å²	75.6	73%	0.73	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	8.7	172.2	60.8	0	0	0	0	113.9	E1529 S1530	E1529-T1532 PolarHBondContact O-OG1 2.86Å; S1530-T1532 PolarHBondContact O-N 3.39Å; S1530-T1532 VanDerWaalsContact O-N 3.11Å
1533	A	67	Low	73.4	Confident	13 Å²	13	71.4 Å²	71.4	11%	0.107	38%	0.38	C	S	.	.	S	Bend	trans	-71.4	138	176.6	0	0	0	0	0	110.8	P1491 S1530 L1536	P1491-A1533 HydrophobicContact CG-CB 4.28Å; S1530-A1533 WeakPolarHBondContact O-CB 3.45Å; S1530-A1533 PolarHBondContact O-N 3.12Å; A1533-L1536 HydrophobicContact CB-CD1 4.25Å
1534	P	67.2	Low	74.3	Confident	96 Å²	96	74.8 Å²	74.8	62%	0.623	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	148.6	168.6	30.4	-34.8	0	0	0	109.6
1535	F	70.2	Confident	75.1	Confident	150 Å²	150	73 Å²	73	66%	0.658	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	31	178.2	-47	-69.4	0	0	0	115.8	E1537 I1538	F1535-E1537 PolarHBondContact O-N 3.11Å; F1535-E1537 VanDerWaalsContact O-N 3.15Å; F1535-I1538 HydrophobicContact CB-CB 4.29Å; F1535-I1538 HydrophobicContact CB-CD1 3.75Å; F1535-I1538 HydrophobicContact CB-CG1 3.92Å; F1535-I1538 HydrophobicContact CD1-CD1 3.92Å; F1535-I1538 HydrophobicContact CG-CD1 4.07Å; F1535-I1538 WeakPolarHBondContact O-CB 3.22Å; F1535-I1538 PolarHBondContact O-N 3.03Å
1536	L	72.6	Confident	75.9	Confident	41 Å²	41	68.3 Å²	68.3	22%	0.215	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	-43.5	176.4	-148.3	79.1	0	0	0	113.9	P1523 W1526 S1530 A1533 I1538	P1523-L1536 HydrophobicContact CB-CD2 3.61Å; P1523-L1536 HydrophobicContact CB-CG 3.87Å; P1523-L1536 HydrophobicContact CG-CG 4.47Å; W1526-L1536 HydrophobicContact CE3-CD1 3.68Å; W1526-L1536 HydrophobicContact CE3-CG 4.24Å; W1526-L1536 HydrophobicContact CH2-CD1 4.45Å; W1526-L1536 HydrophobicContact CH2-CG 4.4Å; W1526-L1536 VanDerWaalsContact CH2-O 3.3Å; W1526-L1536 WeakPolarHBondContact CH2-O 3.19Å; W1526-L1536 HydrophobicContact CZ3-CD1 3.48Å; W1526-L1536 VanDerWaalsContact CZ3-CD1 3.48Å; W1526-L1536 HydrophobicContact CZ3-CG 3.86Å; S1530-L1536 WeakPolarHBondContact O-CD1 3.4Å; A1533-L1536 HydrophobicContact CB-CD1 4.25Å; L1536-I1538 VanDerWaalsContact C-N 3.26Å; L1536-I1538 PolarHBondContact O-N 3.42Å
1537	E	76.8	Confident	76.6	Confident	152 Å²	152	69.5 Å²	69.5	71%	0.71	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-13.5	-179	-62.9	175.9	172.3	0	0	114.1	F1535 P1540 I1541	F1535-E1537 PolarHBondContact O-N 3.11Å; F1535-E1537 VanDerWaalsContact O-N 3.15Å; E1537-P1540 WeakPolarHBondContact O-CD 3.41Å; E1537-I1541 WeakPolarHBondContact O-CD1 3.28Å; E1537-I1541 WeakPolarHBondContact O-CG1 3.5Å
1538	I	82.4	Confident	77.3	Confident	76 Å²	76	71.6 Å²	71.6	39%	0.39	38%	0.378	S	S	.	.	H	α-helix	trans	-74.2	-28.1	-177.3	-65.4	-167	0	0	0	112.1	I1488 F1535 L1536 I1541 A1542	I1488-I1538 HydrophobicContact CD1-CG2 4.4Å; F1535-I1538 HydrophobicContact CB-CB 4.29Å; F1535-I1538 HydrophobicContact CB-CD1 3.75Å; F1535-I1538 HydrophobicContact CB-CG1 3.92Å; F1535-I1538 HydrophobicContact CD1-CD1 3.92Å; F1535-I1538 HydrophobicContact CG-CD1 4.07Å; F1535-I1538 WeakPolarHBondContact O-CB 3.22Å; F1535-I1538 PolarHBondContact O-N 3.03Å; L1536-I1538 VanDerWaalsContact C-N 3.26Å; L1536-I1538 PolarHBondContact O-N 3.42Å; I1538-I1541 PolarHBondContact O-N 3.08Å; I1538-A1542 HydrophobicContact CG2-CB 4.48Å; I1538-A1542 WeakPolarHBondContact O-CB 3.5Å; I1538-A1542 PolarHBondContact O-N 2.73Å
1539	V	80.2	Confident	78.2	Confident	6 Å²	6	70.2 Å²	70.2	4%	0.036	37%	0.365	C	S	.	.	H	α-helix	trans	-67.3	-44.7	-177.3	178.7	0	0	0	0	112.9	R1485 I1488 W1526 I1541 T1543	R1485-V1539 HydrophobicContact CG-CG1 3.99Å; I1488-V1539 HydrophobicContact CB-CG2 3.66Å; I1488-V1539 HydrophobicContact CD1-CG2 3.85Å; I1488-V1539 HydrophobicContact CG1-CG2 4.36Å; I1488-V1539 HydrophobicContact CG2-CG2 3.57Å; W1526-V1539 HydrophobicContact CH2-CB 3.64Å; W1526-V1539 HydrophobicContact CH2-CG1 4.35Å; W1526-V1539 HydrophobicContact CH2-CG2 3.59Å; W1526-V1539 HydrophobicContact CZ2-CB 3.73Å; W1526-V1539 HydrophobicContact CZ2-CG1 4.04Å; W1526-V1539 HydrophobicContact CZ2-CG2 4.13Å; V1539-I1541 VanDerWaalsContact C-N 3.35Å; V1539-I1541 PolarHBondContact O-N 3.38Å; V1539-T1543 WeakPolarHBondContact O-CB 3.15Å; V1539-T1543 PolarHBondContact O-N 3.09Å; V1539-T1543 PolarHBondContact O-OG1 2.89Å
1540	P	83.1	Confident	79.1	Confident	33 Å²	33	64.4 Å²	64.4	21%	0.214	34%	0.338	C	S	.	.	H	α-helix	trans	-58.2	-43.5	169.6	-25.2	33.5	0	0	0	113.1	I1521 P1523 E1537 T1543 V1544	I1521-P1540 HydrophobicContact CG2-CB 3.8Å; I1521-P1540 HydrophobicContact CG2-CG 3.82Å; P1523-P1540 HydrophobicContact CG-CG 4.18Å; E1537-P1540 WeakPolarHBondContact O-CD 3.41Å; P1540-T1543 WeakPolarHBondContact O-CB 3.37Å; P1540-T1543 PolarHBondContact O-N 3Å; P1540-V1544 WeakPolarHBondContact O-CG2 3.38Å; P1540-V1544 PolarHBondContact O-N 3.39Å
1541	I	86.1	Confident	79.9	Confident	97 Å²	97	67.9 Å²	67.9	50%	0.497	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-48.2	180	-64	169.8	0	0	0	110.9	E1537 I1538 V1539 T1543 V1544 I1545	E1537-I1541 WeakPolarHBondContact O-CD1 3.28Å; E1537-I1541 WeakPolarHBondContact O-CG1 3.5Å; I1538-I1541 PolarHBondContact O-N 3.08Å; V1539-I1541 VanDerWaalsContact C-N 3.35Å; V1539-I1541 PolarHBondContact O-N 3.38Å; I1541-T1543 PolarHBondContact O-N 2.89Å; I1541-V1544 PolarHBondContact O-N 3.42Å; I1541-I1545 HydrophobicContact CG2-CD1 3.85Å; I1541-I1545 WeakPolarHBondContact O-CG1 3.48Å; I1541-I1545 PolarHBondContact O-N 2.85Å
1542	A	86.1	Confident	80.7	Confident	19 Å²	19	69 Å²	69	16%	0.157	36%	0.363	C	S	.	.	H	α-helix	trans	-62.8	-31.1	175.9	0	0	0	0	0	112.1	F1481 I1538 Y1546	F1481-A1542 HydrophobicContact CD2-CB 4.45Å; F1481-A1542 HydrophobicContact CE2-CB 4.31Å; I1538-A1542 HydrophobicContact CG2-CB 4.48Å; I1538-A1542 WeakPolarHBondContact O-CB 3.5Å; I1538-A1542 PolarHBondContact O-N 2.73Å; A1542-Y1546 WeakPolarHBondContact O-CB 3.37Å; A1542-Y1546 PolarHBondContact O-N 3.38Å
1543	T	85.5	Confident	81.4	Confident	3 Å²	3	67 Å²	67	2%	0.018	35%	0.348	C	S	.	.	H	α-helix	trans	-67.7	-45.6	173.6	-59.3	0	0	0	0	111.6	F1481 M1511 I1521 V1539 P1540 I1541 Y1546 L1547	F1481-T1543 HydrophobicContact CZ-CG2 4.28Å; F1481-T1543 WeakPolarHBondContact CZ-OG1 3.42Å; M1511-T1543 HydrophobicContact CE-CG2 3.32Å; I1521-T1543 HydrophobicContact CD1-CG2 3.69Å; I1521-T1543 HydrophobicContact CG1-CG2 4.47Å; V1539-T1543 WeakPolarHBondContact O-CB 3.15Å; V1539-T1543 PolarHBondContact O-N 3.09Å; V1539-T1543 PolarHBondContact O-OG1 2.89Å; P1540-T1543 WeakPolarHBondContact O-CB 3.37Å; P1540-T1543 PolarHBondContact O-N 3Å; I1541-T1543 PolarHBondContact O-N 2.89Å; T1543-Y1546 PolarHBondContact O-N 3.49Å; T1543-L1547 HydrophobicContact CG2-CD1 4.05Å; T1543-L1547 HydrophobicContact CG2-CG 4.49Å; T1543-L1547 WeakPolarHBondContact O-CB 3.4Å; T1543-L1547 WeakPolarHBondContact O-CG 3.18Å; T1543-L1547 PolarHBondContact O-N 3.27Å
1544	V	86.6	Confident	82.1	Confident	99 Å²	99	68.1 Å²	68.1	60%	0.6	35%	0.35	S	S	*	.	H	α-helix	trans	-62.3	-43.7	175.3	173	0	0	0	0	110.7	P1540 I1541 L1547 L1548	P1540-V1544 WeakPolarHBondContact O-CG2 3.38Å; P1540-V1544 PolarHBondContact O-N 3.39Å; I1541-V1544 PolarHBondContact O-N 3.42Å; V1544-L1547 PolarHBondContact O-N 3.46Å; V1544-L1548 VanDerWaalsContact O-CB 3.23Å; V1544-L1548 WeakPolarHBondContact O-CB 3.48Å; V1544-L1548 PolarHBondContact O-N 3.5Å
1545	I	87.8	Confident	82.9	Confident	103 Å²	103	65.8 Å²	65.8	53%	0.528	33%	0.334	S	S	.	.	H	α-helix	trans	-62.3	-46.1	175.8	-66.8	167	0	0	0	111.1	I1541 L1547 L1548 Y1549	I1541-I1545 HydrophobicContact CG2-CD1 3.85Å; I1541-I1545 WeakPolarHBondContact O-CG1 3.48Å; I1541-I1545 PolarHBondContact O-N 2.85Å; I1545-L1547 PolarHBondContact O-N 3.38Å; I1545-L1548 PolarHBondContact O-N 3.3Å; I1545-Y1549 WeakPolarHBondContact O-CB 3.36Å; I1545-Y1549 PolarHBondContact O-N 3.21Å
1546	Y	88.9	Confident	83.6	Confident	11 Å²	11	62.7 Å²	62.7	4%	0.043	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-45.4	178.2	169.6	-106.8	0	0	0	112.4	P1477 F1481 P1508 M1511 A1542 T1543 S1550	P1477-Y1546 HydrophobicContact CB-CE2 4.46Å; F1481-Y1546 HydrophobicContact CB-CD2 3.48Å; F1481-Y1546 VanDerWaalsContact CB-CD2 3.48Å; F1481-Y1546 HydrophobicContact CB-CE2 4.02Å; F1481-Y1546 HydrophobicContact CB-CG 3.79Å; F1481-Y1546 AromaticContact CD1-CD1 3.37Å; F1481-Y1546 HydrophobicContact CD1-CD1 3.37Å; F1481-Y1546 AromaticContact CD1-CD2 3.87Å; F1481-Y1546 HydrophobicContact CD1-CD2 3.87Å; F1481-Y1546 AromaticContact CD1-CE1 3.72Å; F1481-Y1546 HydrophobicContact CD1-CE1 3.72Å; F1481-Y1546 HydrophobicContact CD1-CE2 4.18Å; F1481-Y1546 AromaticContact CD1-CG 3.46Å; F1481-Y1546 HydrophobicContact CD1-CG 3.46Å; F1481-Y1546 VanDerWaalsContact CD1-CG 3.46Å; F1481-Y1546 HydrophobicContact CD2-CG 4.08Å; F1481-Y1546 AromaticContact CE1-CD1 3.61Å; F1481-Y1546 HydrophobicContact CE1-CD1 3.61Å; F1481-Y1546 HydrophobicContact CE1-CE1 4.07Å; F1481-Y1546 HydrophobicContact CE1-CG 4.05Å; F1481-Y1546 AromaticContact CG-CD1 3.93Å; F1481-Y1546 HydrophobicContact CG-CD1 3.93Å; F1481-Y1546 AromaticContact CG-CD2 3.75Å; F1481-Y1546 HydrophobicContact CG-CD2 3.75Å; F1481-Y1546 HydrophobicContact CG-CE2 4.39Å; F1481-Y1546 AromaticContact CG-CG 3.49Å; F1481-Y1546 HydrophobicContact CG-CG 3.49Å; F1481-Y1546 VanDerWaalsContact CG-CG 3.49Å; F1481-Y1546 HydrophobicContact CZ-CD1 4.33Å; P1508-Y1546 HydrophobicContact CB-CE1 4.43Å; P1508-Y1546 PolarHBondContact O-OH 2.77Å; M1511-Y1546 HydrophobicContact CB-CE1 4.45Å; A1542-Y1546 WeakPolarHBondContact O-CB 3.37Å; A1542-Y1546 PolarHBondContact O-N 3.38Å; T1543-Y1546 PolarHBondContact O-N 3.49Å; Y1546-S1550 WeakPolarHBondContact CD2-OG 3.26Å; Y1546-S1550 WeakPolarHBondContact CE2-OG 3.37Å; Y1546-S1550 WeakPolarHBondContact O-CB 3.36Å; Y1546-S1550 PolarHBondContact O-N 2.89Å; Y1546-S1550 PolarHBondContact O-OG 2.64Å
1547	L	85.9	Confident	84.2	Confident	32 Å²	32	62.8 Å²	62.8	17%	0.168	33%	0.326	C	S	.	.	H	α-helix	trans	-66.6	-45	177.7	-71.7	172.6	0	0	0	111.5	M1511 V1516 T1543 V1544 I1545 I1551	M1511-L1547 HydrophobicContact CB-CD2 4.32Å; M1511-L1547 WeakPolarHBondContact O-CD2 3.36Å; V1516-L1547 HydrophobicContact CG1-CD1 4.24Å; V1516-L1547 HydrophobicContact CG2-CD1 4.16Å; T1543-L1547 HydrophobicContact CG2-CD1 4.05Å; T1543-L1547 HydrophobicContact CG2-CG 4.49Å; T1543-L1547 WeakPolarHBondContact O-CB 3.4Å; T1543-L1547 WeakPolarHBondContact O-CG 3.18Å; T1543-L1547 PolarHBondContact O-N 3.27Å; V1544-L1547 PolarHBondContact O-N 3.46Å; I1545-L1547 PolarHBondContact O-N 3.38Å; L1547-I1551 HydrophobicContact CB-CD1 4.48Å; L1547-I1551 HydrophobicContact CD2-CD1 4.22Å; L1547-I1551 VanDerWaalsContact O-CB 3.26Å; L1547-I1551 WeakPolarHBondContact O-CB 3.27Å; L1547-I1551 VanDerWaalsContact O-CG1 3.3Å; L1547-I1551 WeakPolarHBondContact O-CG1 3.39Å; L1547-I1551 PolarHBondContact O-N 2.85Å
1548	L	85.8	Confident	84.5	Confident	104 Å²	104	56.7 Å²	56.7	55%	0.545	30%	0.3	S	S	.	.	H	α-helix	trans	-57.7	-51.1	176.6	-168.5	83	0	0	0	111	V1544 I1545 I1552	V1544-L1548 VanDerWaalsContact O-CB 3.23Å; V1544-L1548 WeakPolarHBondContact O-CB 3.48Å; V1544-L1548 PolarHBondContact O-N 3.5Å; I1545-L1548 PolarHBondContact O-N 3.3Å; L1548-I1552 HydrophobicContact CD1-CD1 3.49Å; L1548-I1552 VanDerWaalsContact CD1-CD1 3.49Å; L1548-I1552 HydrophobicContact CG-CD1 4.09Å; L1548-I1552 WeakPolarHBondContact O-CB 3.08Å; L1548-I1552 WeakPolarHBondContact O-CG1 3.4Å; L1548-I1552 PolarHBondContact O-N 3.33Å
1549	Y	85.6	Confident	84.7	Confident	111 Å²	111	57.1 Å²	57.1	44%	0.435	30%	0.302	S	S	.	.	H	α-helix	trans	-67.2	-45.9	-177.8	-178.4	-130	0	0	0	112.5	P1477 I1545 L1553 F1554	P1477-Y1549 HydrophobicContact CB-CE1 4.35Å; P1477-Y1549 HydrophobicContact CG-CE1 4.24Å; I1545-Y1549 WeakPolarHBondContact O-CB 3.36Å; I1545-Y1549 PolarHBondContact O-N 3.21Å; Y1549-L1553 HydrophobicContact CD2-CB 4.19Å; Y1549-L1553 HydrophobicContact CD2-CD1 4.32Å; Y1549-L1553 HydrophobicContact CE2-CB 4.5Å; Y1549-L1553 HydrophobicContact CE2-CD1 4.05Å; Y1549-L1553 HydrophobicContact CE2-CD2 4.35Å; Y1549-L1553 VanDerWaalsContact O-CB 3.3Å; Y1549-L1553 WeakPolarHBondContact O-CB 3.4Å; Y1549-L1553 PolarHBondContact O-N 3.4Å; Y1549-L1553 VanDerWaalsContact O-N 3.11Å; Y1549-F1554 HydrophobicContact CD1-CD2 4.4Å; Y1549-F1554 HydrophobicContact CD1-CE2 4.28Å; Y1549-F1554 HydrophobicContact CE1-CD2 4.1Å; Y1549-F1554 AromaticContact CE1-CE2 3.54Å; Y1549-F1554 HydrophobicContact CE1-CE2 3.54Å; Y1549-F1554 HydrophobicContact CE2-CE2 4.18Å; Y1549-F1554 AromaticContact CZ-CE2 3.47Å; Y1549-F1554 VanDerWaalsContact CZ-CE2 3.47Å; Y1549-F1554 PolarHBondContact O-N 3.35Å; Y1549-F1554 WeakPolarHBondContact OH-CE2 3.47Å
1550	S	83.7	Confident	85	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.007	31%	0.311	C	S	.	.	I	π-helix	trans	-71.2	-35.6	-177	-50.6	0	0	0	0	112.5	Y1546 V1555	Y1546-S1550 WeakPolarHBondContact CD2-OG 3.26Å; Y1546-S1550 WeakPolarHBondContact CE2-OG 3.37Å; Y1546-S1550 WeakPolarHBondContact O-CB 3.36Å; Y1546-S1550 PolarHBondContact O-N 2.89Å; Y1546-S1550 PolarHBondContact O-OG 2.64Å; S1550-V1555 WeakPolarHBondContact O-CG2 3.44Å; S1550-V1555 PolarHBondContact O-N 2.97Å
1551	I	83.2	Confident	85	Confident	77 Å²	77	57 Å²	57	40%	0.395	30%	0.303	S	S	.	.	I	π-helix	trans	-86.6	-44.5	-177.3	-60.6	171.1	0	0	0	111.6	L1512 L1547	L1512-I1551 HydrophobicContact CD1-CG1 4.47Å; L1547-I1551 HydrophobicContact CB-CD1 4.48Å; L1547-I1551 HydrophobicContact CD2-CD1 4.22Å; L1547-I1551 VanDerWaalsContact O-CB 3.26Å; L1547-I1551 WeakPolarHBondContact O-CB 3.27Å; L1547-I1551 VanDerWaalsContact O-CG1 3.3Å; L1547-I1551 WeakPolarHBondContact O-CG1 3.39Å; L1547-I1551 PolarHBondContact O-N 2.85Å
1552	I	83	Confident	84.9	Confident	105 Å²	105	56.1 Å²	56.1	54%	0.538	30%	0.296	S	S	.	.	I	π-helix	trans	-83.8	-31.8	-174.4	-55.8	-175.3	0	0	0	112.4	L1548 N1556	L1548-I1552 HydrophobicContact CD1-CD1 3.49Å; L1548-I1552 VanDerWaalsContact CD1-CD1 3.49Å; L1548-I1552 HydrophobicContact CG-CD1 4.09Å; L1548-I1552 WeakPolarHBondContact O-CB 3.08Å; L1548-I1552 WeakPolarHBondContact O-CG1 3.4Å; L1548-I1552 PolarHBondContact O-N 3.33Å; I1552-N1556 WeakPolarHBondContact O-CB 3.42Å; I1552-N1556 PolarHBondContact O-ND2 2.86Å
1553	L	81.3	Confident	84.9	Confident	79 Å²	79	59.5 Å²	59.5	41%	0.414	31%	0.311	S	S	.	.	I	π-helix	trans	-97.6	-75.3	176.2	-163.3	150.9	0	0	0	110.2	Y1549 V1555 N1556 V1557	Y1549-L1553 HydrophobicContact CD2-CB 4.19Å; Y1549-L1553 HydrophobicContact CD2-CD1 4.32Å; Y1549-L1553 HydrophobicContact CE2-CB 4.5Å; Y1549-L1553 HydrophobicContact CE2-CD1 4.05Å; Y1549-L1553 HydrophobicContact CE2-CD2 4.35Å; Y1549-L1553 VanDerWaalsContact O-CB 3.3Å; Y1549-L1553 WeakPolarHBondContact O-CB 3.4Å; Y1549-L1553 PolarHBondContact O-N 3.4Å; Y1549-L1553 VanDerWaalsContact O-N 3.11Å; L1553-V1555 PolarHBondContact O-N 3.17Å; L1553-N1556 PolarHBondContact O-N 3.06Å; L1553-V1557 HydrophobicContact CD2-CG2 4.33Å; L1553-V1557 WeakPolarHBondContact O-CG2 3.22Å; L1553-V1557 PolarHBondContact O-N 3.43Å
1554	F	82.2	Confident	85	Confident	35 Å²	35	60.1 Å²	60.1	15%	0.154	31%	0.314	C	S	.	.	I	π-helix	trans	-59.8	-48.6	-168.2	-84.3	-66.5	0	0	0	115	L1473 L1474 P1477 Y1549 N1556 V1557 V1558	L1473-F1554 HydrophobicContact CB-CE1 4.26Å; L1474-F1554 HydrophobicContact CD1-CB 4.2Å; P1477-F1554 HydrophobicContact CB-CE2 4.43Å; P1477-F1554 HydrophobicContact CG-CD2 3.83Å; P1477-F1554 HydrophobicContact CG-CE2 3.32Å; P1477-F1554 HydrophobicContact CG-CZ 3.95Å; Y1549-F1554 HydrophobicContact CD1-CD2 4.4Å; Y1549-F1554 HydrophobicContact CD1-CE2 4.28Å; Y1549-F1554 HydrophobicContact CE1-CD2 4.1Å; Y1549-F1554 AromaticContact CE1-CE2 3.54Å; Y1549-F1554 HydrophobicContact CE1-CE2 3.54Å; Y1549-F1554 HydrophobicContact CE2-CE2 4.18Å; Y1549-F1554 AromaticContact CZ-CE2 3.47Å; Y1549-F1554 VanDerWaalsContact CZ-CE2 3.47Å; Y1549-F1554 PolarHBondContact O-N 3.35Å; Y1549-F1554 WeakPolarHBondContact OH-CE2 3.47Å; F1554-N1556 VanDerWaalsContact C-N 3.31Å; F1554-N1556 PolarHBondContact O-N 2.62Å; F1554-V1557 PolarHBondContact O-N 2.96Å; F1554-V1558 WeakPolarHBondContact O-CB 3.32Å; F1554-V1558 WeakPolarHBondContact O-CG2 3.23Å; F1554-V1558 PolarHBondContact O-N 3.06Å
1555	V	83.6	Confident	84.7	Confident	47 Å²	47	55.4 Å²	55.4	29%	0.285	29%	0.286	S	S	.	.	H	α-helix	trans	-65	-35.3	-179.8	168.1	0	0	0	0	112	L1512 S1550 L1553 I1559	L1512-V1555 HydrophobicContact CD1-CG2 4.12Å; S1550-V1555 WeakPolarHBondContact O-CG2 3.44Å; S1550-V1555 PolarHBondContact O-N 2.97Å; L1553-V1555 PolarHBondContact O-N 3.17Å; V1555-I1559 HydrophobicContact CG1-CD1 3.97Å; V1555-I1559 WeakPolarHBondContact O-CD1 3.33Å; V1555-I1559 VanDerWaalsContact O-CG1 3.25Å; V1555-I1559 WeakPolarHBondContact O-CG1 3.07Å; V1555-I1559 PolarHBondContact O-N 3.38Å; V1555-I1559 VanDerWaalsContact O-N 3.11Å
1556	N	85.2	Confident	84.6	Confident	85 Å²	85	53.7 Å²	53.7	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-71.6	-43.4	177.1	-73.2	-23.5	0	0	0	112.2	I1552 L1553 F1554 V1558 I1559 A1560	I1552-N1556 WeakPolarHBondContact O-CB 3.42Å; I1552-N1556 PolarHBondContact O-ND2 2.86Å; L1553-N1556 PolarHBondContact O-N 3.06Å; F1554-N1556 VanDerWaalsContact C-N 3.31Å; F1554-N1556 PolarHBondContact O-N 2.62Å; N1556-V1558 VanDerWaalsContact C-N 3.33Å; N1556-V1558 PolarHBondContact O-N 3.11Å; N1556-I1559 WeakPolarHBondContact O-CB 3.14Å; N1556-I1559 PolarHBondContact O-N 2.86Å; N1556-A1560 PolarHBondContact O-N 2.64Å
1557	V	84.3	Confident	84.3	Confident	43 Å²	43	55.4 Å²	55.4	26%	0.261	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-41.5	175.8	178.6	0	0	0	0	110.1	M1470 L1553 F1554 I1559 A1560 V1561 V2482	M1470-V1557 HydrophobicContact CE-CB 4.42Å; M1470-V1557 HydrophobicContact CE-CG1 3.65Å; M1470-V1557 WeakPolarHBondContact CE-O 3.36Å; L1553-V1557 HydrophobicContact CD2-CG2 4.33Å; L1553-V1557 WeakPolarHBondContact O-CG2 3.22Å; L1553-V1557 PolarHBondContact O-N 3.43Å; F1554-V1557 PolarHBondContact O-N 2.96Å; V1557-I1559 PolarHBondContact O-N 3.35Å; V1557-A1560 PolarHBondContact O-N 2.65Å; V1557-V1561 HydrophobicContact CG1-CG2 4.41Å; V1557-V1561 WeakPolarHBondContact O-CB 3.25Å; V1557-V1561 PolarHBondContact O-N 2.78Å; V1557-V2482 HydrophobicContact CG1-CG1 4.31Å
1558	V	83.7	Confident	83.9	Confident	25 Å²	25	57.5 Å²	57.5	15%	0.152	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-30.7	172.3	170.7	0	0	0	0	113.1	M1467 M1470 F1554 N1556 F1562	M1467-V1558 HydrophobicContact CE-CG1 3.86Å; M1470-V1558 HydrophobicContact CE-CB 4.39Å; M1470-V1558 HydrophobicContact CE-CG2 3.96Å; M1470-V1558 HydrophobicContact CG-CG2 3.99Å; M1470-V1558 HydrophobicContact SD-CB 4.1Å; M1470-V1558 HydrophobicContact SD-CG1 4.42Å; M1470-V1558 HydrophobicContact SD-CG2 3.68Å; F1554-V1558 WeakPolarHBondContact O-CB 3.32Å; F1554-V1558 WeakPolarHBondContact O-CG2 3.23Å; F1554-V1558 PolarHBondContact O-N 3.06Å; N1556-V1558 VanDerWaalsContact C-N 3.33Å; N1556-V1558 PolarHBondContact O-N 3.11Å; V1558-F1562 WeakPolarHBondContact O-CB 3.37Å; V1558-F1562 PolarHBondContact O-N 2.67Å
1559	I	86.2	Confident	83.7	Confident	85 Å²	85	52.6 Å²	52.6	44%	0.436	27%	0.271	S	S	.	.	H	α-helix	trans	-78.4	-39.7	174.9	-70.9	163.2	0	0	0	111.4	V1555 N1556 V1557 F1562 N1563	V1555-I1559 HydrophobicContact CG1-CD1 3.97Å; V1555-I1559 WeakPolarHBondContact O-CD1 3.33Å; V1555-I1559 VanDerWaalsContact O-CG1 3.25Å; V1555-I1559 WeakPolarHBondContact O-CG1 3.07Å; V1555-I1559 PolarHBondContact O-N 3.38Å; V1555-I1559 VanDerWaalsContact O-N 3.11Å; N1556-I1559 WeakPolarHBondContact O-CB 3.14Å; N1556-I1559 PolarHBondContact O-N 2.86Å; V1557-I1559 PolarHBondContact O-N 3.35Å; I1559-F1562 PolarHBondContact O-N 3.05Å; I1559-N1563 PolarHBondContact O-N 3.07Å; I1559-N1563 PolarHBondContact O-ND2 3.01Å
1560	A	86.8	Confident	83.5	Confident	29 Å²	29	55 Å²	55	24%	0.24	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-51.3	-179.9	0	0	0	0	0	111.3	N1556 V1557 F1562 N1563 D1564 D2483	N1556-A1560 PolarHBondContact O-N 2.64Å; V1557-A1560 PolarHBondContact O-N 2.65Å; A1560-F1562 VanDerWaalsContact C-N 3.32Å; A1560-F1562 PolarHBondContact O-N 3.07Å; A1560-N1563 WeakPolarHBondContact O-CB 3.49Å; A1560-N1563 PolarHBondContact O-N 2.81Å; A1560-D1564 PolarHBondContact O-N 2.75Å; A1560-D1564 VanDerWaalsContact O-N 3.14Å; A1560-D2483 VanDerWaalsContact CB-OD1 3.24Å; A1560-D2483 WeakPolarHBondContact CB-OD1 3.15Å
1561	V	83.6	Confident	83.1	Confident	6 Å²	6	62.1 Å²	62.1	4%	0.036	31%	0.312	C	S	.	.	H	α-helix	trans	-59.5	-40	173.3	168.5	0	0	0	0	111.8	M1470 V1557 N1563 D1564 I1565 E2363 V2482	M1470-V1561 HydrophobicContact CE-CB 3.57Å; M1470-V1561 HydrophobicContact CE-CG1 3.92Å; M1470-V1561 HydrophobicContact CE-CG2 3.48Å; M1470-V1561 VanDerWaalsContact CE-CG2 3.48Å; M1470-V1561 HydrophobicContact SD-CB 3.84Å; M1470-V1561 HydrophobicContact SD-CG1 3.67Å; M1470-V1561 HydrophobicContact SD-CG2 4.36Å; V1557-V1561 HydrophobicContact CG1-CG2 4.41Å; V1557-V1561 WeakPolarHBondContact O-CB 3.25Å; V1557-V1561 PolarHBondContact O-N 2.78Å; V1561-N1563 VanDerWaalsContact C-N 3.25Å; V1561-N1563 PolarHBondContact O-N 2.77Å; V1561-D1564 PolarHBondContact O-N 3.29Å; V1561-I1565 HydrophobicContact CG1-CD1 3.46Å; V1561-I1565 VanDerWaalsContact CG1-CD1 3.46Å; V1561-I1565 HydrophobicContact CG1-CG1 4.34Å; V1561-I1565 WeakPolarHBondContact O-CB 3.49Å; V1561-I1565 VanDerWaalsContact O-CG1 3.26Å; V1561-I1565 WeakPolarHBondContact O-CG1 2.99Å; V1561-I1565 PolarHBondContact O-N 3.03Å; V1561-E2363 WeakPolarHBondContact CG1-OE2 3.5Å; V1561-V2482 HydrophobicContact CG2-CG1 3.94Å; V1561-V2482 HydrophobicContact CG2-CG2 4.16Å
1562	F	83.6	Confident	82.7	Confident	80 Å²	80	61.8 Å²	61.8	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-62.5	-28.4	173.3	179.4	-97.4	0	0	0	113.7	M1463 M1467 V1558 I1559 A1560 I1565 F1566	M1463-F1562 HydrophobicContact CE-CD1 4.23Å; M1463-F1562 HydrophobicContact CE-CD2 3.47Å; M1463-F1562 VanDerWaalsContact CE-CD2 3.47Å; M1463-F1562 HydrophobicContact CE-CE1 3.96Å; M1463-F1562 HydrophobicContact CE-CE2 3.17Å; M1463-F1562 HydrophobicContact CE-CG 4.02Å; M1463-F1562 HydrophobicContact CE-CZ 3.45Å; M1463-F1562 VanDerWaalsContact CE-CZ 3.45Å; M1463-F1562 WeakPolarHBondContact CE-O 3.48Å; M1463-F1562 HydrophobicContact SD-CE2 4.07Å; M1463-F1562 HydrophobicContact SD-CZ 4.3Å; M1467-F1562 HydrophobicContact CE-CB 4.09Å; M1467-F1562 HydrophobicContact CE-CD2 3.8Å; M1467-F1562 HydrophobicContact CE-CG 4.37Å; M1467-F1562 HydrophobicContact SD-CD2 3.56Å; M1467-F1562 VanDerWaalsContact SD-CD2 3.56Å; M1467-F1562 HydrophobicContact SD-CE2 4.16Å; V1558-F1562 WeakPolarHBondContact O-CB 3.37Å; V1558-F1562 PolarHBondContact O-N 2.67Å; I1559-F1562 PolarHBondContact O-N 3.05Å; A1560-F1562 VanDerWaalsContact C-N 3.32Å; A1560-F1562 PolarHBondContact O-N 3.07Å; F1562-I1565 CarbonylContact O-C 3.16Å; F1562-F1566 VanDerWaalsContact O-CB 3.3Å; F1562-F1566 WeakPolarHBondContact O-CB 3.01Å; F1562-F1566 PolarHBondContact O-N 2.86Å; F1562-F1566 VanDerWaalsContact O-N 3.08Å
1563	N	86.6	Confident	82.6	Confident	90 Å²	90	57.2 Å²	57.2	48%	0.481	29%	0.287	S	S	.	.	H	α-helix	trans	-79.1	-39.1	178.7	-68.9	-28.6	0	0	0	112.1	I1559 A1560 V1561 F1566 A1567	I1559-N1563 PolarHBondContact O-N 3.07Å; I1559-N1563 PolarHBondContact O-ND2 3.01Å; A1560-N1563 WeakPolarHBondContact O-CB 3.49Å; A1560-N1563 PolarHBondContact O-N 2.81Å; V1561-N1563 VanDerWaalsContact C-N 3.25Å; V1561-N1563 PolarHBondContact O-N 2.77Å; N1563-F1566 WeakPolarHBondContact O-CB 3.39Å; N1563-F1566 PolarHBondContact O-N 3.12Å; N1563-F1566 VanDerWaalsContact O-N 3.16Å; N1563-A1567 WeakPolarHBondContact O-CB 3.28Å; N1563-A1567 PolarHBondContact O-N 3.06Å
1564	D	86.3	Confident	82.5	Confident	15 Å²	15	59.5 Å²	59.5	8%	0.08	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-51	168.7	176.2	14.7	0	0	0	110.6	A1560 V1561 F1566 A1567 R1568 V2484	A1560-D1564 PolarHBondContact O-N 2.75Å; A1560-D1564 VanDerWaalsContact O-N 3.14Å; V1561-D1564 PolarHBondContact O-N 3.29Å; D1564-F1566 PolarHBondContact O-N 3.07Å; D1564-A1567 PolarHBondContact O-N 3.21Å; D1564-R1568 WeakPolarHBondContact O-CB 3.49Å; D1564-R1568 PolarHBondContact O-N 3.34Å; D1564-R1568 IonicContact OD1-CZ 3.62Å; D1564-R1568 IonicContact OD1-NE 2.94Å; D1564-R1568 PolarHBondContact OD1-NE 2.76Å; D1564-R1568 IonicContact OD1-NH2 2.73Å; D1564-R1568 PolarHBondContact OD1-NH2 3.48Å; D1564-R1568 IonicContact OD2-CZ 3.88Å; D1564-R1568 IonicContact OD2-NE 2.89Å; D1564-R1568 IonicContact OD2-NH2 3.21Å; D1564-R1568 PolarHBondContact OD2-NH2 3.41Å; D1564-V2484 HydrophobicContact CB-CB 4.04Å; D1564-V2484 WeakPolarHBondContact OD2-CG2 3.43Å
1565	I	81.8	Confident	82.5	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66	4.2	173.7	-63.6	172.2	0	0	0	113.1	M1463 L1466 V1561 F1562 E2363 E2365	M1463-I1565 HydrophobicContact CB-CG2 4.2Å; M1463-I1565 HydrophobicContact CE-CG2 4.49Å; M1463-I1565 VanDerWaalsContact CE-O 3.3Å; M1463-I1565 WeakPolarHBondContact CE-O 3.2Å; M1463-I1565 HydrophobicContact CG-CG2 4.03Å; M1463-I1565 WeakPolarHBondContact CG-O 3.47Å; L1466-I1565 HydrophobicContact CB-CD1 4.32Å; L1466-I1565 HydrophobicContact CB-CG2 4.36Å; L1466-I1565 HydrophobicContact CD1-CB 4.43Å; L1466-I1565 HydrophobicContact CD1-CD1 4.29Å; L1466-I1565 HydrophobicContact CD1-CG1 4.22Å; L1466-I1565 HydrophobicContact CD1-CG2 3.45Å; L1466-I1565 VanDerWaalsContact CD1-CG2 3.45Å; L1466-I1565 HydrophobicContact CG-CG2 4.14Å; V1561-I1565 HydrophobicContact CG1-CD1 3.46Å; V1561-I1565 VanDerWaalsContact CG1-CD1 3.46Å; V1561-I1565 HydrophobicContact CG1-CG1 4.34Å; V1561-I1565 WeakPolarHBondContact O-CB 3.49Å; V1561-I1565 VanDerWaalsContact O-CG1 3.26Å; V1561-I1565 WeakPolarHBondContact O-CG1 2.99Å; V1561-I1565 PolarHBondContact O-N 3.03Å; F1562-I1565 CarbonylContact O-C 3.16Å; I1565-E2363 HydrophobicContact CD1-CB 3.59Å; I1565-E2363 HydrophobicContact CD1-CG 3.77Å; I1565-E2363 WeakPolarHBondContact CD1-OE1 3.14Å; I1565-E2363 HydrophobicContact CG1-CB 4.15Å; I1565-E2365 VanDerWaalsContact CA-CD 3.49Å; I1565-E2365 VanDerWaalsContact CA-OE2 3.23Å; I1565-E2365 WeakPolarHBondContact CA-OE2 3.38Å; I1565-E2365 HydrophobicContact CB-CG 4.5Å; I1565-E2365 HydrophobicContact CG1-CG 4.39Å; I1565-E2365 VanDerWaalsContact O-CD 3.29Å
1566	F	84.4	Confident	82.5	Confident	68 Å²	68	58.5 Å²	58.5	30%	0.298	29%	0.289	S	S	.	.	H	α-helix	trans	-106.7	-48.3	166.1	-178.3	-94.1	0	0	0	111.5	M1459 M1463 F1562 N1563 D1564 R1568 R1570	M1459-F1566 HydrophobicContact CE-CD2 3.9Å; M1459-F1566 HydrophobicContact CE-CE2 3.4Å; M1459-F1566 VanDerWaalsContact CE-CE2 3.4Å; M1459-F1566 HydrophobicContact CE-CZ 4.33Å; M1459-F1566 HydrophobicContact SD-CD2 3.88Å; M1459-F1566 HydrophobicContact SD-CE2 3.79Å; M1463-F1566 HydrophobicContact CE-CB 3.64Å; M1463-F1566 HydrophobicContact CE-CD2 3.89Å; M1463-F1566 HydrophobicContact CE-CG 4.28Å; M1463-F1566 HydrophobicContact SD-CD2 4.12Å; F1562-F1566 VanDerWaalsContact O-CB 3.3Å; F1562-F1566 WeakPolarHBondContact O-CB 3.01Å; F1562-F1566 PolarHBondContact O-N 2.86Å; F1562-F1566 VanDerWaalsContact O-N 3.08Å; N1563-F1566 WeakPolarHBondContact O-CB 3.39Å; N1563-F1566 PolarHBondContact O-N 3.12Å; N1563-F1566 VanDerWaalsContact O-N 3.16Å; D1564-F1566 PolarHBondContact O-N 3.07Å; F1566-R1568 VanDerWaalsContact C-N 3.32Å; F1566-R1568 PolarHBondContact O-N 2.9Å; F1566-R1570 WeakPolarHBondContact O-CB 3.44Å; F1566-R1570 PolarHBondContact O-N 3.4Å; F1566-R1570 VanDerWaalsContact O-N 3.11Å
1567	A	83.4	Confident	82.4	Confident	46 Å²	46	55.4 Å²	55.4	38%	0.38	27%	0.271	S	S	.	.	H	α-helix	trans	-60.2	-43.2	-177	0	0	0	0	0	111.6	N1563 D1564	N1563-A1567 WeakPolarHBondContact O-CB 3.28Å; N1563-A1567 PolarHBondContact O-N 3.06Å; D1564-A1567 PolarHBondContact O-N 3.21Å
1568	R	78.4	Confident	82.4	Confident	77 Å²	77	54.8 Å²	54.8	29%	0.291	27%	0.266	S	S	.	.	H	α-helix	trans	-80.7	-32.1	-166.1	-153.8	-167.2	-42.1	176.5	-2.5	112	D1564 F1566 E2363 E2364 E2365 A2366	D1564-R1568 WeakPolarHBondContact O-CB 3.49Å; D1564-R1568 PolarHBondContact O-N 3.34Å; D1564-R1568 IonicContact OD1-CZ 3.62Å; D1564-R1568 IonicContact OD1-NE 2.94Å; D1564-R1568 PolarHBondContact OD1-NE 2.76Å; D1564-R1568 IonicContact OD1-NH2 2.73Å; D1564-R1568 PolarHBondContact OD1-NH2 3.48Å; D1564-R1568 IonicContact OD2-CZ 3.88Å; D1564-R1568 IonicContact OD2-NE 2.89Å; D1564-R1568 IonicContact OD2-NH2 3.21Å; D1564-R1568 PolarHBondContact OD2-NH2 3.41Å; F1566-R1568 VanDerWaalsContact C-N 3.32Å; F1566-R1568 PolarHBondContact O-N 2.9Å; R1568-E2363 PolarHBondContact NH1-O 3.17Å; R1568-E2363 PolarHBondContact NH2-O 2.96Å; R1568-E2364 VanDerWaalsContact CD-O 3.25Å; R1568-E2364 WeakPolarHBondContact CD-O 3.32Å; R1568-E2364 PolarHBondContact NE-O 3.13Å; R1568-E2364 PolarHBondContact NH1-O 3.41Å; R1568-E2365 HydrophobicContact CB-CB 3.56Å; R1568-E2365 HydrophobicContact CB-CG 4Å; R1568-E2365 WeakPolarHBondContact CD-O 3.33Å; R1568-E2365 HydrophobicContact CG-CB 3.81Å; R1568-A2366 WeakPolarHBondContact O-CB 3.49Å
1569	V	80.1	Confident	82.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-77.2	-36.8	168.2	141.9	0	0	0	0	112.7	M1459 K1462 Q1571 Q1572 S1573 E2365 A2366 V2367	M1459-V1569 HydrophobicContact CB-CG1 3.73Å; M1459-V1569 HydrophobicContact CG-CG1 3.55Å; M1459-V1569 HydrophobicContact SD-CG1 4.26Å; K1462-V1569 HydrophobicContact CD-CG2 3.67Å; K1462-V1569 HydrophobicContact CG-CG2 4.06Å; V1569-Q1571 PolarHBondContact O-N 3.39Å; V1569-Q1571 VanDerWaalsContact O-N 3.12Å; V1569-Q1572 PolarHBondContact O-N 3.08Å; V1569-S1573 WeakPolarHBondContact O-CB 3.37Å; V1569-S1573 PolarHBondContact O-N 3.15Å; V1569-E2365 WeakPolarHBondContact CA-OE2 3.25Å; V1569-E2365 VanDerWaalsContact CB-CD 3.49Å; V1569-E2365 VanDerWaalsContact CB-OE1 3.22Å; V1569-E2365 WeakPolarHBondContact CB-OE1 3.37Å; V1569-E2365 VanDerWaalsContact CB-OE2 3.25Å; V1569-E2365 WeakPolarHBondContact CB-OE2 3.37Å; V1569-E2365 HydrophobicContact CG2-CB 4.14Å; V1569-E2365 VanDerWaalsContact CG2-CD 3.47Å; V1569-E2365 HydrophobicContact CG2-CG 4.36Å; V1569-E2365 WeakPolarHBondContact CG2-OE1 3.21Å; V1569-E2365 PolarHBondContact N-OE2 3.09Å; V1569-A2366 HydrophobicContact CB-CB 4.39Å; V1569-A2366 HydrophobicContact CG2-CB 3.68Å; V1569-V2367 HydrophobicContact CG2-CG2 3.84Å
1570	R	83	Confident	82.2	Confident	163 Å²	163	53.1 Å²	53.1	62%	0.615	26%	0.256	S	S	*	.	H	α-helix	trans	-50.6	-42.6	180	-179.7	173.3	176.1	170.2	-3	110.7	F1566 Q1572 S1573	F1566-R1570 WeakPolarHBondContact O-CB 3.44Å; F1566-R1570 PolarHBondContact O-N 3.4Å; F1566-R1570 VanDerWaalsContact O-N 3.11Å; R1570-Q1572 VanDerWaalsContact C-N 3.34Å; R1570-Q1572 PolarHBondContact O-N 3.02Å; R1570-S1573 PolarHBondContact O-N 3.5Å; R1570-S1573 PolarHBondContact O-OG 3.24Å
1571	Q	73.7	Confident	81.9	Confident	150 Å²	150	53.6 Å²	53.6	70%	0.701	25%	0.252	S	S	*	.	H	α-helix	trans	-55.9	-36.2	177.1	-66.9	-179.5	10.6	0	0	115	V1569	V1569-Q1571 PolarHBondContact O-N 3.39Å; V1569-Q1571 VanDerWaalsContact O-N 3.12Å
1572	Q	76.1	Confident	81.7	Confident	70 Å²	70	54 Å²	54	33%	0.327	25%	0.252	S	S	.	.	H	α-helix	trans	-104.2	-14.8	179.4	-63.3	-165.7	37.8	0	0	114.2	V1569 R1570 E1574 L1575 V1576 A2366	V1569-Q1572 PolarHBondContact O-N 3.08Å; R1570-Q1572 VanDerWaalsContact C-N 3.34Å; R1570-Q1572 PolarHBondContact O-N 3.02Å; Q1572-E1574 VanDerWaalsContact C-N 3.29Å; Q1572-E1574 PolarHBondContact O-N 2.87Å; Q1572-E1574 VanDerWaalsContact O-N 3.15Å; Q1572-L1575 PolarHBondContact O-N 3.12Å; Q1572-V1576 HydrophobicContact CB-CG2 4.27Å; Q1572-V1576 WeakPolarHBondContact O-CG2 3.41Å; Q1572-V1576 PolarHBondContact O-N 3.38Å; Q1572-A2366 HydrophobicContact CB-CB 3.72Å; Q1572-A2366 HydrophobicContact CG-CB 3.75Å; Q1572-A2366 PolarHBondContact NE2-O 3.29Å; Q1572-A2366 VanDerWaalsContact NE2-O 3.15Å; Q1572-A2366 PolarHBondContact OE1-O 3.4Å
1573	S	79.5	Confident	81.1	Confident	9 Å²	9	51 Å²	51	6%	0.063	24%	0.243	C	C	.	.	H	α-helix	trans	-53	-40.1	-169.9	64.4	0	0	0	0	114	V1569 R1570 Y1577	V1569-S1573 WeakPolarHBondContact O-CB 3.37Å; V1569-S1573 PolarHBondContact O-N 3.15Å; R1570-S1573 PolarHBondContact O-N 3.5Å; R1570-S1573 PolarHBondContact O-OG 3.24Å; S1573-Y1577 WeakPolarHBondContact O-CB 3.36Å; S1573-Y1577 PolarHBondContact O-N 3.11Å
1574	E	80.4	Confident	80.4	Confident	127 Å²	127	49 Å²	49	59%	0.593	23%	0.234	S	C	*	.	H	α-helix	trans	-69.4	-42.7	176.3	-62	-153.7	155	0	0	112.8	Q1572 Y1577 N1578	Q1572-E1574 VanDerWaalsContact C-N 3.29Å; Q1572-E1574 PolarHBondContact O-N 2.87Å; Q1572-E1574 VanDerWaalsContact O-N 3.15Å; E1574-Y1577 PolarHBondContact O-N 3.47Å; E1574-N1578 WeakPolarHBondContact O-CB 3.46Å; E1574-N1578 VanDerWaalsContact O-CG 3.22Å; E1574-N1578 PolarHBondContact O-N 2.71Å; E1574-N1578 PolarHBondContact O-ND2 3.04Å; E1574-N1578 VanDerWaalsContact O-ND2 3.07Å
1575	L	82.8	Confident	79.6	Confident	60 Å²	60	48.7 Å²	48.7	31%	0.314	23%	0.232	S	C	.	.	H	α-helix	trans	-65.1	-44.9	-179.5	-177.6	62.8	0	0	0	110.8	K789 V790 Q1572 N1578 Y1579	K789-L1575 HydrophobicContact CB-CD2 4.19Å; K789-L1575 HydrophobicContact CB-CG 4.2Å; V790-L1575 HydrophobicContact CG2-CD2 4.47Å; Q1572-L1575 PolarHBondContact O-N 3.12Å; L1575-N1578 PolarHBondContact O-N 3.2Å; L1575-Y1579 PolarHBondContact O-N 2.92Å
1576	V	81.8	Confident	78.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-74.3	-30.3	178.1	-153.7	0	0	0	0	112.1	K789 Y1458 Q1572 Y1579 L1580 V2367 D2368	K789-V1576 HydrophobicContact CD-CG1 4.47Å; K789-V1576 HydrophobicContact CD-CG2 4.15Å; Y1458-V1576 HydrophobicContact CE1-CB 3.81Å; Y1458-V1576 HydrophobicContact CE1-CG1 4.37Å; Y1458-V1576 HydrophobicContact CE1-CG2 4.34Å; Y1458-V1576 VanDerWaalsContact OH-CB 3.32Å; Y1458-V1576 WeakPolarHBondContact OH-CB 3.23Å; Y1458-V1576 WeakPolarHBondContact OH-CG1 3.34Å; Q1572-V1576 HydrophobicContact CB-CG2 4.27Å; Q1572-V1576 WeakPolarHBondContact O-CG2 3.41Å; Q1572-V1576 PolarHBondContact O-N 3.38Å; V1576-Y1579 HydrophobicContact CG1-CD1 4.07Å; V1576-Y1579 WeakPolarHBondContact O-CB 3.22Å; V1576-Y1579 PolarHBondContact O-N 3.21Å; V1576-L1580 HydrophobicContact CG1-CD1 4.23Å; V1576-L1580 HydrophobicContact CG1-CG 4.22Å; V1576-L1580 WeakPolarHBondContact O-CB 3.43Å; V1576-L1580 VanDerWaalsContact O-CG 3.27Å; V1576-L1580 WeakPolarHBondContact O-CG 3.28Å; V1576-L1580 PolarHBondContact O-N 2.95Å; V1576-V2367 HydrophobicContact CG2-CG2 4.31Å; V1576-D2368 WeakPolarHBondContact CG1-OD2 2.89Å
1577	Y	83.7	Confident	78	Confident	21 Å²	21	47.3 Å²	47.3	8%	0.082	23%	0.227	C	C	.	.	H	α-helix	trans	-59.2	-48.2	167.8	169.9	-111.8	0	0	0	111.8	Q1448 I1449 R1451 P1455 S1573 E1574 Y1579 L1580 R1581	Q1448-Y1577 VanDerWaalsContact O-CE2 3.26Å; Q1448-Y1577 WeakPolarHBondContact O-CE2 3.25Å; I1449-Y1577 PolarHBondContact O-OH 3.19Å; R1451-Y1577 WeakPolarHBondContact CA-OH 3.36Å; P1455-Y1577 HydrophobicContact CG-CD1 3.79Å; P1455-Y1577 HydrophobicContact CG-CG 3.81Å; S1573-Y1577 WeakPolarHBondContact O-CB 3.36Å; S1573-Y1577 PolarHBondContact O-N 3.11Å; E1574-Y1577 PolarHBondContact O-N 3.47Å; Y1577-Y1579 VanDerWaalsContact C-N 3.26Å; Y1577-Y1579 PolarHBondContact O-N 2.9Å; Y1577-L1580 PolarHBondContact O-N 3.1Å; Y1577-R1581 VanDerWaalsContact O-CB 3.29Å; Y1577-R1581 WeakPolarHBondContact O-CB 3.45Å; Y1577-R1581 PolarHBondContact O-N 3.32Å
1578	N	84.2	Confident	77.1	Confident	29 Å²	29	48 Å²	48	16%	0.155	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-33.8	177.4	-72.5	-35.2	0	0	0	112.3	Q798 E1574 L1575	Q798-N1578 PolarHBondContact NE2-O 2.78Å; E1574-N1578 WeakPolarHBondContact O-CB 3.46Å; E1574-N1578 VanDerWaalsContact O-CG 3.22Å; E1574-N1578 PolarHBondContact O-N 2.71Å; E1574-N1578 PolarHBondContact O-ND2 3.04Å; E1574-N1578 VanDerWaalsContact O-ND2 3.07Å; L1575-N1578 PolarHBondContact O-N 3.2Å
1579	Y	84.3	Confident	76.3	Confident	20 Å²	20	47.6 Å²	47.6	8%	0.078	22%	0.221	C	C	.	.	H	α-helix	trans	-68	-54.8	171.2	170.9	-100.6	0	0	0	112.7	Y784 K789 I792 L1575 V1576 Y1577 R1581 Y1582	Y784-Y1579 AromaticContact CD2-CE2 3.85Å; Y784-Y1579 HydrophobicContact CD2-CE2 3.85Å; Y784-Y1579 AromaticContact CD2-CZ 3.94Å; Y784-Y1579 HydrophobicContact CE2-CE1 4.32Å; Y784-Y1579 HydrophobicContact CE2-CE2 4.15Å; Y784-Y1579 AromaticContact CE2-CZ 3.78Å; K789-Y1579 HydrophobicContact CG-CD2 4.32Å; K789-Y1579 HydrophobicContact CG-CG 4.28Å; I792-Y1579 HydrophobicContact CB-CD2 4.17Å; I792-Y1579 HydrophobicContact CD1-CD2 3.91Å; I792-Y1579 HydrophobicContact CD1-CE2 3.98Å; I792-Y1579 HydrophobicContact CG1-CD2 4.5Å; I792-Y1579 HydrophobicContact CG2-CD2 4.41Å; L1575-Y1579 PolarHBondContact O-N 2.92Å; V1576-Y1579 HydrophobicContact CG1-CD1 4.07Å; V1576-Y1579 WeakPolarHBondContact O-CB 3.22Å; V1576-Y1579 PolarHBondContact O-N 3.21Å; Y1577-Y1579 VanDerWaalsContact C-N 3.26Å; Y1577-Y1579 PolarHBondContact O-N 2.9Å; Y1579-R1581 PolarHBondContact O-N 3.13Å; Y1579-Y1582 VanDerWaalsContact O-CB 3.32Å; Y1579-Y1582 WeakPolarHBondContact O-CB 3.45Å; Y1579-Y1582 PolarHBondContact O-N 3.37Å
1580	L	81.9	Confident	75.3	Confident	55 Å²	55	49.9 Å²	49.9	29%	0.288	24%	0.237	S	C	.	.	H	α-helix	trans	-60.1	-31.3	-179	-72.1	168.9	0	0	0	112.6	Y1458 V1576 Y1577 Y1582 A1583 V1584	Y1458-L1580 HydrophobicContact CD2-CD1 3.65Å; Y1458-L1580 HydrophobicContact CE2-CD1 3.43Å; Y1458-L1580 VanDerWaalsContact CE2-CD1 3.43Å; Y1458-L1580 HydrophobicContact CG-CD1 4.39Å; V1576-L1580 HydrophobicContact CG1-CD1 4.23Å; V1576-L1580 HydrophobicContact CG1-CG 4.22Å; V1576-L1580 WeakPolarHBondContact O-CB 3.43Å; V1576-L1580 VanDerWaalsContact O-CG 3.27Å; V1576-L1580 WeakPolarHBondContact O-CG 3.28Å; V1576-L1580 PolarHBondContact O-N 2.95Å; Y1577-L1580 PolarHBondContact O-N 3.1Å; L1580-Y1582 PolarHBondContact O-N 2.85Å; L1580-A1583 PolarHBondContact O-N 3.1Å; L1580-V1584 PolarHBondContact O-N 3.22Å; L1580-V1584 VanDerWaalsContact O-N 3.08Å
1581	R	81.5	Confident	74.4	Confident	39 Å²	39	44.5 Å²	44.5	15%	0.147	22%	0.217	C	C	.	.	H	α-helix	trans	-53.7	-32.7	174.7	-174.2	175	-176.1	-128.2	-3.2	113.2	N802 Y1577 Y1579 I1585	N802-R1581 PolarHBondContact OD1-NH1 3.41Å; N802-R1581 PolarHBondContact OD1-NH2 2.83Å; Y1577-R1581 VanDerWaalsContact O-CB 3.29Å; Y1577-R1581 WeakPolarHBondContact O-CB 3.45Å; Y1577-R1581 PolarHBondContact O-N 3.32Å; Y1579-R1581 PolarHBondContact O-N 3.13Å; R1581-I1585 HydrophobicContact CG-CD1 3.69Å; R1581-I1585 HydrophobicContact CG-CG1 4.32Å; R1581-I1585 WeakPolarHBondContact O-CB 3.25Å; R1581-I1585 VanDerWaalsContact O-CG1 3.23Å; R1581-I1585 WeakPolarHBondContact O-CG1 3.4Å; R1581-I1585 PolarHBondContact O-N 3.37Å; R1581-I1585 VanDerWaalsContact O-N 3.08Å
1582	Y	78.1	Confident	73.8	Confident	14 Å²	14	38.8 Å²	38.8	6%	0.055	19%	0.193	C	C	.	.	H	α-helix	trans	-59.8	-50.6	173.3	172.2	-91.7	0	0	0	111.8	L780 S781 Y784 L801 A1199 Y1579 L1580 I1586	L780-Y1582 HydrophobicContact CB-CE2 3.9Å; S781-Y1582 WeakPolarHBondContact CA-OH 3.42Å; Y784-Y1582 HydrophobicContact CD1-CE1 4.17Å; Y784-Y1582 AromaticContact CD2-CD1 3.42Å; Y784-Y1582 HydrophobicContact CD2-CD1 3.42Å; Y784-Y1582 VanDerWaalsContact CD2-CD1 3.42Å; Y784-Y1582 AromaticContact CD2-CE1 3.72Å; Y784-Y1582 HydrophobicContact CD2-CE1 3.72Å; Y784-Y1582 HydrophobicContact CD2-CG 4.42Å; Y784-Y1582 AromaticContact CE2-CD1 3.92Å; Y784-Y1582 HydrophobicContact CE2-CD1 3.92Å; Y784-Y1582 HydrophobicContact CE2-CE1 4.4Å; Y784-Y1582 AromaticContact CG-CD1 3.82Å; Y784-Y1582 HydrophobicContact CG-CD1 3.82Å; Y784-Y1582 AromaticContact CG-CE1 3.58Å; Y784-Y1582 HydrophobicContact CG-CE1 3.58Å; L801-Y1582 HydrophobicContact CD2-CD2 4.1Å; A1199-Y1582 HydrophobicContact CB-CE1 4.46Å; Y1579-Y1582 VanDerWaalsContact O-CB 3.32Å; Y1579-Y1582 WeakPolarHBondContact O-CB 3.45Å; Y1579-Y1582 PolarHBondContact O-N 3.37Å; L1580-Y1582 PolarHBondContact O-N 2.85Å; Y1582-I1586 HydrophobicContact CD1-CD1 4.2Å; Y1582-I1586 HydrophobicContact CD2-CD1 4.17Å; Y1582-I1586 HydrophobicContact CE1-CD1 3.66Å; Y1582-I1586 HydrophobicContact CE2-CD1 3.61Å; Y1582-I1586 HydrophobicContact CG-CD1 4.42Å; Y1582-I1586 PolarHBondContact O-N 2.8Å
1583	A	72.3	Confident	72.9	Confident	19 Å²	19	39 Å²	39	16%	0.157	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-43.1	-178.4	0	0	0	0	0	111.7	Y784 L1580 I1585 I1586 E1587	Y784-A1583 HydrophobicContact CE2-CB 4.17Å; L1580-A1583 PolarHBondContact O-N 3.1Å; A1583-I1585 PolarHBondContact O-N 2.75Å; A1583-I1586 PolarHBondContact O-N 3.45Å; A1583-E1587 PolarHBondContact O-N 2.76Å
1584	V	71.5	Confident	72.2	Confident	47 Å²	47	41.8 Å²	41.8	29%	0.285	21%	0.21	S	C	.	.	H	α-helix	trans	-60.2	-46.4	178.3	174.6	0	0	0	0	111.4	I1449 L1580 I1586 E1587 Y1588	I1449-V1584 HydrophobicContact CG1-CG1 4.21Å; L1580-V1584 PolarHBondContact O-N 3.22Å; L1580-V1584 VanDerWaalsContact O-N 3.08Å; V1584-I1586 PolarHBondContact O-N 3.33Å; V1584-E1587 PolarHBondContact O-N 3.33Å; V1584-Y1588 HydrophobicContact CG1-CD2 3.85Å; V1584-Y1588 HydrophobicContact CG1-CE2 4.04Å; V1584-Y1588 WeakPolarHBondContact O-CD2 3.5Å; V1584-Y1588 PolarHBondContact O-N 3.06Å
1585	I	69.7	Low	71.3	Confident	9 Å²	9	36.7 Å²	36.7	5%	0.046	19%	0.188	C	C	.	.	H	α-helix	trans	-64.9	-43.4	-177.2	-67.5	170.8	0	0	0	111.2	L801 L804 W805 R1581 A1583 E1587 Y1588 E1589	L801-I1585 HydrophobicContact CB-CD1 3.97Å; L801-I1585 HydrophobicContact CD2-CD1 4.14Å; L804-I1585 HydrophobicContact CB-CG2 4.49Å; L804-I1585 HydrophobicContact CD2-CG2 3.46Å; L804-I1585 VanDerWaalsContact CD2-CG2 3.46Å; L804-I1585 HydrophobicContact CG-CG2 3.68Å; W805-I1585 HydrophobicContact CB-CD1 4.33Å; W805-I1585 HydrophobicContact CE3-CD1 4.46Å; W805-I1585 HydrophobicContact CE3-CG1 3.93Å; W805-I1585 HydrophobicContact CE3-CG2 4.49Å; R1581-I1585 HydrophobicContact CG-CD1 3.69Å; R1581-I1585 HydrophobicContact CG-CG1 4.32Å; R1581-I1585 WeakPolarHBondContact O-CB 3.25Å; R1581-I1585 VanDerWaalsContact O-CG1 3.23Å; R1581-I1585 WeakPolarHBondContact O-CG1 3.4Å; R1581-I1585 PolarHBondContact O-N 3.37Å; R1581-I1585 VanDerWaalsContact O-N 3.08Å; A1583-I1585 PolarHBondContact O-N 2.75Å; I1585-E1587 PolarHBondContact O-N 3.4Å; I1585-Y1588 PolarHBondContact O-N 3.36Å; I1585-E1589 WeakPolarHBondContact O-CB 3.4Å; I1585-E1589 PolarHBondContact O-N 3.08Å
1586	I	66.5	Low	70.4	Confident	9 Å²	9	35.5 Å²	35.5	5%	0.046	18%	0.183	C	C	.	.	H	α-helix	trans	-67.2	-35.8	177.8	-64.3	172.5	0	0	0	111.5	A1199 Y1582 A1583 V1584 E1589 S1590	A1199-I1586 HydrophobicContact CB-CG2 4.34Å; Y1582-I1586 HydrophobicContact CD1-CD1 4.2Å; Y1582-I1586 HydrophobicContact CD2-CD1 4.17Å; Y1582-I1586 HydrophobicContact CE1-CD1 3.66Å; Y1582-I1586 HydrophobicContact CE2-CD1 3.61Å; Y1582-I1586 HydrophobicContact CG-CD1 4.42Å; Y1582-I1586 PolarHBondContact O-N 2.8Å; A1583-I1586 PolarHBondContact O-N 3.45Å; V1584-I1586 PolarHBondContact O-N 3.33Å; I1586-E1589 PolarHBondContact O-N 2.91Å; I1586-S1590 WeakPolarHBondContact O-CB 3.45Å; I1586-S1590 PolarHBondContact O-N 3.05Å
1587	E	65.1	Low	69.7	Low	30 Å²	30	36.6 Å²	36.6	14%	0.14	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-48.3	172.6	-176.1	177	134.4	0	0	111.1	Y1198 A1583 V1584 I1585 S1590 R1591	Y1198-E1587 HydrophobicContact CD2-CG 3.89Å; Y1198-E1587 HydrophobicContact CG-CG 4.23Å; A1583-E1587 PolarHBondContact O-N 2.76Å; V1584-E1587 PolarHBondContact O-N 3.33Å; I1585-E1587 PolarHBondContact O-N 3.4Å; E1587-S1590 PolarHBondContact O-N 2.91Å; E1587-S1590 PolarHBondContact O-OG 3.38Å; E1587-R1591 PolarHBondContact O-N 2.87Å; E1587-R1591 IonicContact OE1-CZ 3.66Å; E1587-R1591 IonicContact OE1-NE 4Å; E1587-R1591 IonicContact OE1-NH1 3.93Å; E1587-R1591 PolarHBondContact OE1-NH1 2.66Å; E1587-R1591 IonicContact OE1-NH2 2.64Å; E1587-R1591 PolarHBondContact OE1-NH2 3.35Å
1588	Y	65.6	Low	69.1	Low	61 Å²	61	40.8 Å²	40.8	24%	0.239	21%	0.21	C	C	.	.	H	α-helix	trans	-66.8	-36	179.3	-87	-81.7	0	0	0	113.2	E1445 I1449 V1584 I1585 S1590 R1591	E1445-Y1588 PolarHBondContact OE2-OH 3.16Å; I1449-Y1588 HydrophobicContact CD1-CD2 4.37Å; I1449-Y1588 HydrophobicContact CD1-CE2 3.83Å; V1584-Y1588 HydrophobicContact CG1-CD2 3.85Å; V1584-Y1588 HydrophobicContact CG1-CE2 4.04Å; V1584-Y1588 WeakPolarHBondContact O-CD2 3.5Å; V1584-Y1588 PolarHBondContact O-N 3.06Å; I1585-Y1588 PolarHBondContact O-N 3.36Å; Y1588-S1590 VanDerWaalsContact C-N 3.32Å; Y1588-S1590 PolarHBondContact O-N 2.91Å; Y1588-R1591 PolarHBondContact O-N 2.92Å
1589	E	61.1	Low	68.5	Low	68 Å²	68	39.9 Å²	39.9	32%	0.318	20%	0.204	S	C	.	.	H	α-helix	trans	-62.2	-38.2	171.9	-172.2	-167.1	167.3	0	0	112.1	I1585 I1586 R1591 L1692	I1585-E1589 WeakPolarHBondContact O-CB 3.4Å; I1585-E1589 PolarHBondContact O-N 3.08Å; I1586-E1589 PolarHBondContact O-N 2.91Å; E1589-R1591 PolarHBondContact O-N 2.64Å; E1589-L1692 WeakPolarHBondContact OE2-CD1 3.03Å
1590	S	58.3	Low	67.9	Low	48 Å²	48	42.4 Å²	42.4	34%	0.336	22%	0.219	S	C	.	.	H	α-helix	trans	-71.1	-14	179.2	83.6	0	0	0	0	114.3	I1586 E1587 Y1588	I1586-S1590 WeakPolarHBondContact O-CB 3.45Å; I1586-S1590 PolarHBondContact O-N 3.05Å; E1587-S1590 PolarHBondContact O-N 2.91Å; E1587-S1590 PolarHBondContact O-OG 3.38Å; Y1588-S1590 VanDerWaalsContact C-N 3.32Å; Y1588-S1590 PolarHBondContact O-N 2.91Å
1591	R	63.9	Low	67.6	Low	49 Å²	49	44.4 Å²	44.4	19%	0.185	23%	0.229	C	C	.	.	S	Bend	trans	-80.8	139	-176.9	-77.3	176.2	167.2	161.3	5.6	111.4	E1376 E1445 E1587 Y1588 E1589 L1593	E1376-R1591 IonicContact OE1-CZ 3.47Å; E1376-R1591 IonicContact OE1-NE 3.87Å; E1376-R1591 PolarHBondContact OE1-NE 3.45Å; E1376-R1591 IonicContact OE1-NH2 3.97Å; E1376-R1591 PolarHBondContact OE1-NH2 2.72Å; E1376-R1591 IonicContact OE2-NH2 2.8Å; E1445-R1591 IonicContact OE2-NH1 2.65Å; E1587-R1591 PolarHBondContact O-N 2.87Å; E1587-R1591 IonicContact OE1-CZ 3.66Å; E1587-R1591 IonicContact OE1-NE 4Å; E1587-R1591 IonicContact OE1-NH1 3.93Å; E1587-R1591 PolarHBondContact OE1-NH1 2.66Å; E1587-R1591 IonicContact OE1-NH2 2.64Å; E1587-R1591 PolarHBondContact OE1-NH2 3.35Å; Y1588-R1591 PolarHBondContact O-N 2.92Å; E1589-R1591 PolarHBondContact O-N 2.64Å; R1591-L1593 PolarHBondContact O-N 3.19Å
1592	P	62.5	Low	67	Low	30 Å²	30	43.7 Å²	43.7	20%	0.195	23%	0.229	C	C	.	.			trans	-72.5	131.6	-176.3	30.6	-35.5	0	0	0	111	L1594 I1599	P1592-L1594 PolarHBondContact O-N 3.06Å; P1592-I1599 HydrophobicContact CG-CD1 3.7Å; P1592-I1599 HydrophobicContact CG-CG1 3.91Å
1593	L	57.2	Low	66.5	Low	76 Å²	76	46.3 Å²	46.3	40%	0.398	24%	0.239	S	C	.	.	S	Bend	trans	-62.9	10.6	-173	-39.3	91.8	0	0	0	117	Y1326 R1591	Y1326-L1593 HydrophobicContact CD1-CD2 3.97Å; Y1326-L1593 HydrophobicContact CD2-CD2 4.27Å; Y1326-L1593 HydrophobicContact CE1-CD2 3.52Å; Y1326-L1593 HydrophobicContact CE2-CD1 3.85Å; Y1326-L1593 HydrophobicContact CE2-CD2 3.85Å; Y1326-L1593 HydrophobicContact CE2-CG 4.37Å; Y1326-L1593 HydrophobicContact CG-CD2 4.33Å; Y1326-L1593 VanDerWaalsContact CZ-CD2 3.46Å; Y1326-L1593 VanDerWaalsContact OH-CD1 3.31Å; Y1326-L1593 WeakPolarHBondContact OH-CD1 3.35Å; R1591-L1593 PolarHBondContact O-N 3.19Å
1594	L	63.5	Low	66.7	Low	67 Å²	67	49.6 Å²	49.6	35%	0.351	25%	0.253	S	S	.	.	S	Bend	trans	-105.2	121	174.6	-77.4	179.8	0	0	0	109.9	P1592 F1598 I1601	P1592-L1594 PolarHBondContact O-N 3.06Å; L1594-F1598 HydrophobicContact CB-CB 4.27Å; L1594-F1598 HydrophobicContact CD2-CB 4.31Å; L1594-I1601 HydrophobicContact CD1-CB 3.93Å; L1594-I1601 HydrophobicContact CD1-CG2 4.26Å
1595	P	61.5	Low	66.7	Low	20 Å²	20	51.7 Å²	51.7	13%	0.13	26%	0.257	C	S	.	.			trans	-52.2	154.1	177.8	-26.9	33.4	0	0	0	112.5	L1334 P1597 F1598 I1599	L1334-P1595 HydrophobicContact CD1-CB 3.73Å; L1334-P1595 HydrophobicContact CD1-CG 3.28Å; P1595-P1597 VanDerWaalsContact C-CD 3.49Å; P1595-P1597 VanDerWaalsContact O-N 3.1Å; P1595-F1598 CarbonylContact O-C 3.54Å; P1595-F1598 WeakPolarHBondContact O-CA 3.4Å; P1595-F1598 PolarHBondContact O-N 3.25Å; P1595-I1599 PolarHBondContact O-N 3.1Å
1596	P	64.8	Low	66.5	Low	34 Å²	34	56 Å²	56	22%	0.221	28%	0.278	C	S	.	.	H	α-helix	trans	-40.7	-51.8	-173.9	-31.3	34.8	0	0	0	116.3	T1368 Y1369 F1598 I1599	T1368-P1596 WeakPolarHBondContact CB-O 3.37Å; T1368-P1596 PolarHBondContact OG1-O 3.22Å; Y1369-P1596 HydrophobicContact CD2-CG 4.44Å; P1596-F1598 PolarHBondContact O-N 3.37Å; P1596-F1598 VanDerWaalsContact O-N 3.07Å; P1596-I1599 WeakPolarHBondContact O-CB 3.35Å; P1596-I1599 WeakPolarHBondContact O-CG2 3.05Å; P1596-I1599 PolarHBondContact O-N 3.36Å
1597	P	67.1	Low	66.5	Low	23 Å²	23	58.7 Å²	58.7	15%	0.149	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-21.2	-179.7	25.5	-35.9	0	0	0	114.4	L1364 P1595	L1364-P1597 HydrophobicContact CD2-CB 4.06Å; P1595-P1597 VanDerWaalsContact C-CD 3.49Å; P1595-P1597 VanDerWaalsContact O-N 3.1Å
1598	F	71	Confident	67.1	Low	110 Å²	110	59.4 Å²	59.4	48%	0.482	30%	0.301	S	S	.	.	H	α-helix	trans	-103.7	-5.1	177.7	-57.6	-58.8	0	0	0	113.6	L1594 P1595 P1596 I1600 I1601	L1594-F1598 HydrophobicContact CB-CB 4.27Å; L1594-F1598 HydrophobicContact CD2-CB 4.31Å; P1595-F1598 CarbonylContact O-C 3.54Å; P1595-F1598 WeakPolarHBondContact O-CA 3.4Å; P1595-F1598 PolarHBondContact O-N 3.25Å; P1596-F1598 PolarHBondContact O-N 3.37Å; P1596-F1598 VanDerWaalsContact O-N 3.07Å; F1598-I1600 PolarHBondContact O-N 3.36Å; F1598-I1600 VanDerWaalsContact O-N 3.12Å; F1598-I1601 HydrophobicContact CB-CD1 4.42Å; F1598-I1601 HydrophobicContact CD1-CD1 4.32Å; F1598-I1601 VanDerWaalsContact O-CB 3.31Å; F1598-I1601 WeakPolarHBondContact O-CB 3.41Å; F1598-I1601 PolarHBondContact O-N 2.9Å
1599	I	71.2	Confident	67.3	Low	9 Å²	9	59.6 Å²	59.6	5%	0.046	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-26.7	-176.5	-147.6	150.6	0	0	0	112.2	D1372 P1592 P1595 P1596 I1601 S1602 W1603	D1372-I1599 HydrophobicContact CB-CD1 3.96Å; D1372-I1599 VanDerWaalsContact OD1-CD1 3.23Å; D1372-I1599 WeakPolarHBondContact OD1-CD1 3.04Å; D1372-I1599 WeakPolarHBondContact OD2-CD1 3.47Å; P1592-I1599 HydrophobicContact CG-CD1 3.7Å; P1592-I1599 HydrophobicContact CG-CG1 3.91Å; P1595-I1599 PolarHBondContact O-N 3.1Å; P1596-I1599 WeakPolarHBondContact O-CB 3.35Å; P1596-I1599 WeakPolarHBondContact O-CG2 3.05Å; P1596-I1599 PolarHBondContact O-N 3.36Å; I1599-I1601 PolarHBondContact O-N 2.91Å; I1599-S1602 CarbonylContact O-C 3.49Å; I1599-S1602 WeakPolarHBondContact O-CA 3.44Å; I1599-S1602 VanDerWaalsContact O-CB 3.25Å; I1599-S1602 WeakPolarHBondContact O-CB 3.31Å; I1599-S1602 PolarHBondContact O-N 3.09Å; I1599-W1603 PolarHBondContact O-N 3.04Å
1600	I	72.1	Confident	67.4	Low	74 Å²	74	59.8 Å²	59.8	38%	0.379	31%	0.305	S	S	.	.	H	α-helix	trans	-55	-33.9	171.1	-59.1	175	0	0	0	111.5	T1368 F1598 W1603 I1604	T1368-I1600 HydrophobicContact CG2-CD1 3.74Å; T1368-I1600 HydrophobicContact CG2-CG1 4Å; F1598-I1600 PolarHBondContact O-N 3.36Å; F1598-I1600 VanDerWaalsContact O-N 3.12Å; I1600-W1603 WeakPolarHBondContact O-CB 3.27Å; I1600-W1603 PolarHBondContact O-N 3.05Å; I1600-I1604 HydrophobicContact CG2-CD1 3.86Å; I1600-I1604 HydrophobicContact CG2-CG1 4.38Å; I1600-I1604 VanDerWaalsContact O-CG1 3.27Å; I1600-I1604 WeakPolarHBondContact O-CG1 3.37Å; I1600-I1604 PolarHBondContact O-N 3.48Å
1601	I	75.8	Confident	68.1	Low	97 Å²	97	61.2 Å²	61.2	50%	0.497	31%	0.308	S	S	.	.	H	α-helix	trans	-69.2	-37.8	175.7	-54.3	174.1	0	0	0	110.2	L1594 F1598 I1599 I1604 Y1605	L1594-I1601 HydrophobicContact CD1-CB 3.93Å; L1594-I1601 HydrophobicContact CD1-CG2 4.26Å; F1598-I1601 HydrophobicContact CB-CD1 4.42Å; F1598-I1601 HydrophobicContact CD1-CD1 4.32Å; F1598-I1601 VanDerWaalsContact O-CB 3.31Å; F1598-I1601 WeakPolarHBondContact O-CB 3.41Å; F1598-I1601 PolarHBondContact O-N 2.9Å; I1599-I1601 PolarHBondContact O-N 2.91Å; I1601-I1604 CarbonylContact O-C 3.47Å; I1601-I1604 PolarHBondContact O-N 2.77Å; I1601-Y1605 WeakPolarHBondContact O-CB 3.01Å; I1601-Y1605 PolarHBondContact O-N 2.74Å
1602	S	67.6	Low	68.4	Low	23 Å²	23	63.2 Å²	63.2	16%	0.161	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-39.5	170.3	-170.2	0	0	0	0	111.4	I1599 Y1605 M1606	I1599-S1602 CarbonylContact O-C 3.49Å; I1599-S1602 WeakPolarHBondContact O-CA 3.44Å; I1599-S1602 VanDerWaalsContact O-CB 3.25Å; I1599-S1602 WeakPolarHBondContact O-CB 3.31Å; I1599-S1602 PolarHBondContact O-N 3.09Å; S1602-Y1605 CarbonylContact O-C 3.54Å; S1602-Y1605 WeakPolarHBondContact O-CA 3.42Å; S1602-Y1605 VanDerWaalsContact O-CB 3.32Å; S1602-Y1605 WeakPolarHBondContact O-CB 3.44Å; S1602-Y1605 PolarHBondContact O-N 3.4Å; S1602-M1606 WeakPolarHBondContact O-CB 3.42Å; S1602-M1606 PolarHBondContact O-N 3.44Å
1603	W	67.9	Low	68.3	Low	70 Å²	70	66 Å²	66	27%	0.265	32%	0.323	S	S	.	.	H	α-helix	trans	-64.5	-41	174.1	-78.3	47.8	0	0	0	112.4	L1371 D1372 R1375 I1599 I1600 Y1605 S1607	L1371-W1603 HydrophobicContact CB-CH2 4.03Å; L1371-W1603 HydrophobicContact CB-CZ2 4.06Å; L1371-W1603 HydrophobicContact CD2-CH2 4.33Å; L1371-W1603 WeakPolarHBondContact O-CH2 3.4Å; L1371-W1603 WeakPolarHBondContact O-CZ2 3Å; D1372-W1603 PolarHBondContact OD1-NE1 2.83Å; R1375-W1603 HydrophobicContact CB-CH2 4.27Å; R1375-W1603 HydrophobicContact CB-CZ2 3.52Å; I1599-W1603 PolarHBondContact O-N 3.04Å; I1600-W1603 WeakPolarHBondContact O-CB 3.27Å; I1600-W1603 PolarHBondContact O-N 3.05Å; W1603-Y1605 VanDerWaalsContact C-N 3.25Å; W1603-Y1605 PolarHBondContact O-N 2.77Å; W1603-S1607 WeakPolarHBondContact O-CA 3.09Å; W1603-S1607 WeakPolarHBondContact O-CB 3.23Å; W1603-S1607 PolarHBondContact O-N 3.25Å; W1603-S1607 PolarHBondContact O-OG 3.35Å
1604	I	76.6	Confident	68.4	Low	87 Å²	87	62.9 Å²	62.9	45%	0.446	31%	0.307	S	S	.	.	H	α-helix	trans	-72.8	-22	172.8	-59.8	162.8	0	0	0	110.1	R1211 I1600 I1601 I1608	R1211-I1604 PolarHBondContact NH2-O 3.32Å; I1600-I1604 HydrophobicContact CG2-CD1 3.86Å; I1600-I1604 HydrophobicContact CG2-CG1 4.38Å; I1600-I1604 VanDerWaalsContact O-CG1 3.27Å; I1600-I1604 WeakPolarHBondContact O-CG1 3.37Å; I1600-I1604 PolarHBondContact O-N 3.48Å; I1601-I1604 CarbonylContact O-C 3.47Å; I1601-I1604 PolarHBondContact O-N 2.77Å; I1604-I1608 HydrophobicContact CG2-CD1 3.74Å; I1604-I1608 HydrophobicContact CG2-CG1 4.25Å; I1604-I1608 WeakPolarHBondContact O-CB 3.19Å; I1604-I1608 WeakPolarHBondContact O-CG1 3.37Å; I1604-I1608 PolarHBondContact O-N 3.43Å; I1604-I1608 VanDerWaalsContact O-N 3.1Å
1605	Y	71.9	Confident	68.2	Low	91 Å²	91	64.8 Å²	64.8	36%	0.357	31%	0.309	S	S	.	.	H	α-helix	trans	-71	-54.4	168.9	-174.6	-87	0	0	0	111.1	R1211 I1601 S1602 W1603 I1608 R1609	R1211-Y1605 HydrophobicContact CB-CD1 4.4Å; R1211-Y1605 HydrophobicContact CB-CD2 3.94Å; R1211-Y1605 HydrophobicContact CB-CE1 3.9Å; R1211-Y1605 HydrophobicContact CB-CE2 3.34Å; R1211-Y1605 HydrophobicContact CB-CG 4.41Å; R1211-Y1605 VanDerWaalsContact CD-CD2 3.49Å; R1211-Y1605 HydrophobicContact CG-CD1 4.24Å; R1211-Y1605 HydrophobicContact CG-CD2 3.54Å; R1211-Y1605 HydrophobicContact CG-CE1 4.25Å; R1211-Y1605 HydrophobicContact CG-CE2 3.52Å; R1211-Y1605 HydrophobicContact CG-CG 3.89Å; R1211-Y1605 VanDerWaalsContact CG-O 3.31Å; R1211-Y1605 WeakPolarHBondContact CG-O 3.4Å; I1601-Y1605 WeakPolarHBondContact O-CB 3.01Å; I1601-Y1605 PolarHBondContact O-N 2.74Å; S1602-Y1605 CarbonylContact O-C 3.54Å; S1602-Y1605 WeakPolarHBondContact O-CA 3.42Å; S1602-Y1605 VanDerWaalsContact O-CB 3.32Å; S1602-Y1605 WeakPolarHBondContact O-CB 3.44Å; S1602-Y1605 PolarHBondContact O-N 3.4Å; W1603-Y1605 VanDerWaalsContact C-N 3.25Å; W1603-Y1605 PolarHBondContact O-N 2.77Å; Y1605-I1608 CarbonylContact O-C 3.5Å; Y1605-I1608 PolarHBondContact O-N 3.17Å; Y1605-R1609 VanDerWaalsContact O-CB 3.32Å; Y1605-R1609 WeakPolarHBondContact O-CB 3.34Å; Y1605-R1609 PolarHBondContact O-N 3.47Å
1606	M	65.4	Low	67.7	Low	101 Å²	101	71.7 Å²	71.7	50%	0.498	34%	0.337	S	S	.	.	H	α-helix	trans	-73.4	-33.2	-176.9	-67.9	-64.2	-93.7	0	0	112.8	S1602 R1609 N1610	S1602-M1606 WeakPolarHBondContact O-CB 3.42Å; S1602-M1606 PolarHBondContact O-N 3.44Å; M1606-R1609 CarbonylContact O-C 3.57Å; M1606-R1609 VanDerWaalsContact O-CA 3.23Å; M1606-R1609 WeakPolarHBondContact O-CA 3.29Å; M1606-R1609 WeakPolarHBondContact O-CB 3.02Å; M1606-R1609 PolarHBondContact O-N 3.3Å; M1606-R1609 HydrophobicContact SD-CB 4.42Å; M1606-N1610 PolarHBondContact O-N 3.3Å
1607	S	67.4	Low	66.7	Low	64 Å²	64	72.4 Å²	72.4	45%	0.448	34%	0.337	S	S	.	.	H	α-helix	trans	-72.7	-33.4	169.5	-57.6	0	0	0	0	111.6	W1603 R1609 N1610 I1611	W1603-S1607 WeakPolarHBondContact O-CA 3.09Å; W1603-S1607 WeakPolarHBondContact O-CB 3.23Å; W1603-S1607 PolarHBondContact O-N 3.25Å; W1603-S1607 PolarHBondContact O-OG 3.35Å; S1607-R1609 VanDerWaalsContact C-N 3.31Å; S1607-N1610 CarbonylContact O-C 3.56Å; S1607-N1610 VanDerWaalsContact O-CA 3.23Å; S1607-N1610 WeakPolarHBondContact O-CA 3.12Å; S1607-N1610 PolarHBondContact O-N 2.87Å; S1607-I1611 WeakPolarHBondContact O-CG1 3.31Å; S1607-I1611 PolarHBondContact O-N 3.32Å
1608	I	77.3	Confident	65.5	Low	45 Å²	45	77 Å²	77	23%	0.231	35%	0.351	C	S	.	.	H	α-helix	trans	-73.2	-27.1	166.8	-66.8	175.7	0	0	0	111.4	R1210 R1211 I1604 Y1605 N1610 I1611	R1210-I1608 CarbonylContact O-C 3.56Å; R1211-I1608 HydrophobicContact CG-CB 4.27Å; R1211-I1608 HydrophobicContact CG-CG2 4.03Å; I1604-I1608 HydrophobicContact CG2-CD1 3.74Å; I1604-I1608 HydrophobicContact CG2-CG1 4.25Å; I1604-I1608 WeakPolarHBondContact O-CB 3.19Å; I1604-I1608 WeakPolarHBondContact O-CG1 3.37Å; I1604-I1608 PolarHBondContact O-N 3.43Å; I1604-I1608 VanDerWaalsContact O-N 3.1Å; Y1605-I1608 CarbonylContact O-C 3.5Å; Y1605-I1608 PolarHBondContact O-N 3.17Å; I1608-N1610 PolarHBondContact O-N 3.2Å; I1608-I1611 VanDerWaalsContact C-N 3.28Å; I1608-I1611 HydrophobicContact CG1-CD1 4.02Å; I1608-I1611 HydrophobicContact CG2-CB 4.46Å; I1608-I1611 VanDerWaalsContact O-CA 3.3Å; I1608-I1611 WeakPolarHBondContact O-CA 3.4Å; I1608-I1611 PolarHBondContact O-N 3.37Å
1609	R	69.4	Low	64	Low	65 Å²	65	78.8 Å²	78.8	25%	0.245	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	7.8	162.5	-155.2	177.5	-173.1	-160.6	5.2	113.3	Q1209 R1210 R1211 Y1605 M1606 S1607	Q1209-R1609 CarbonylContact C-O 3.55Å; Q1209-R1609 WeakPolarHBondContact CA-O 3.3Å; Q1209-R1609 PolarHBondContact N-O 3.14Å; Q1209-R1609 CarbonylContact O-C 3.51Å; Q1209-R1609 VanDerWaalsContact O-CA 3.27Å; Q1209-R1609 WeakPolarHBondContact O-CA 3.23Å; Q1209-R1609 VanDerWaalsContact O-O 3.13Å; R1210-R1609 PolarHBondContact N-O 3.43Å; R1210-R1609 WeakPolarHBondContact O-CA 3.38Å; R1210-R1609 PolarHBondContact O-N 3.14Å; R1211-R1609 HydrophobicContact CB-CB 4.35Å; R1211-R1609 HydrophobicContact CG-CB 4.39Å; Y1605-R1609 VanDerWaalsContact O-CB 3.32Å; Y1605-R1609 WeakPolarHBondContact O-CB 3.34Å; Y1605-R1609 PolarHBondContact O-N 3.47Å; M1606-R1609 CarbonylContact O-C 3.57Å; M1606-R1609 VanDerWaalsContact O-CA 3.23Å; M1606-R1609 WeakPolarHBondContact O-CA 3.29Å; M1606-R1609 WeakPolarHBondContact O-CB 3.02Å; M1606-R1609 PolarHBondContact O-N 3.3Å; M1606-R1609 HydrophobicContact SD-CB 4.42Å; S1607-R1609 VanDerWaalsContact C-N 3.31Å
1610	N	62.9	Low	62.5	Low	73 Å²	73	81.2 Å²	81.2	39%	0.39	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-126.3	28.8	152.8	-81.9	4.6	0	0	0	112.1	F1207 Q1208 Q1209 M1606 S1607 I1608	F1207-N1610 PolarHBondContact O-ND2 3.21Å; F1207-N1610 PolarHBondContact O-OD1 2.89Å; Q1208-N1610 PolarHBondContact N-OD1 3.49Å; Q1208-N1610 PolarHBondContact O-OD1 3.17Å; Q1209-N1610 VanDerWaalsContact CG-CA 3.43Å; Q1209-N1610 WeakPolarHBondContact CG-O 3.27Å; Q1209-N1610 PolarHBondContact N-OD1 3.39Å; Q1209-N1610 CarbonylContact O-C 3.57Å; Q1209-N1610 WeakPolarHBondContact O-CA 3.4Å; Q1209-N1610 PolarHBondContact O-N 3.03Å; Q1209-N1610 PolarHBondContact OE1-O 2.73Å; M1606-N1610 PolarHBondContact O-N 3.3Å; S1607-N1610 CarbonylContact O-C 3.56Å; S1607-N1610 VanDerWaalsContact O-CA 3.23Å; S1607-N1610 WeakPolarHBondContact O-CA 3.12Å; S1607-N1610 PolarHBondContact O-N 2.87Å; I1608-N1610 PolarHBondContact O-N 3.2Å
1611	I	73.2	Confident	60.9	Low	78 Å²	78	81.8 Å²	81.8	40%	0.4	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-10	162	-68.6	162.7	0	0	0	120.6	Q1209 S1607 I1608 R1615	Q1209-I1611 VanDerWaalsContact CD-CA 3.42Å; Q1209-I1611 PolarHBondContact NE2-O 3.48Å; Q1209-I1611 CarbonylContact O-C 3.48Å; Q1209-I1611 PolarHBondContact O-N 2.82Å; S1607-I1611 WeakPolarHBondContact O-CG1 3.31Å; S1607-I1611 PolarHBondContact O-N 3.32Å; I1608-I1611 VanDerWaalsContact C-N 3.28Å; I1608-I1611 HydrophobicContact CG1-CD1 4.02Å; I1608-I1611 HydrophobicContact CG2-CB 4.46Å; I1608-I1611 VanDerWaalsContact O-CA 3.3Å; I1608-I1611 WeakPolarHBondContact O-CA 3.4Å; I1608-I1611 PolarHBondContact O-N 3.37Å; I1611-R1615 WeakPolarHBondContact O-CD 3.49Å; I1611-R1615 PolarHBondContact O-NE 3.23Å; I1611-R1615 VanDerWaalsContact O-NE 3.07Å; I1611-R1615 PolarHBondContact O-NH1 3.04Å; I1611-R1615 PolarHBondContact O-NH2 2.95Å
1612	Y	70.6	Confident	59	Low	90 Å²	90	83 Å²	83	35%	0.353	39%	0.393	S	S	.	.	S	Bend	trans	-128.5	-32.1	167.6	-158.7	-85.9	0	0	0	124.8	Q1209 R1210 I1614 R1615 K1616 R1619	Q1209-Y1612 PolarHBondContact NE2-O 3.16Å; Q1209-Y1612 PolarHBondContact O-N 3.42Å; R1210-Y1612 VanDerWaalsContact CD-CB 3.49Å; R1210-Y1612 HydrophobicContact CG-CD1 4.31Å; R1210-Y1612 HydrophobicContact CG-CG 4.39Å; Y1612-I1614 PolarHBondContact O-N 2.82Å; Y1612-I1614 VanDerWaalsContact O-N 3.13Å; Y1612-R1615 HydrophobicContact CD1-CB 4.36Å; Y1612-R1615 HydrophobicContact CD2-CB 3.68Å; Y1612-R1615 HydrophobicContact CD2-CG 4.45Å; Y1612-R1615 HydrophobicContact CE1-CB 4.45Å; Y1612-R1615 HydrophobicContact CE2-CB 3.79Å; Y1612-R1615 HydrophobicContact CG-CB 3.98Å; Y1612-R1615 CarbonylContact O-C 3.57Å; Y1612-R1615 VanDerWaalsContact O-C 3.24Å; Y1612-R1615 WeakPolarHBondContact O-CA 3.34Å; Y1612-R1615 VanDerWaalsContact O-CB 3.26Å; Y1612-R1615 WeakPolarHBondContact O-CB 3.46Å; Y1612-R1615 PolarHBondContact O-N 3.2Å; Y1612-K1616 PolarHBondContact O-N 2.79Å; Y1612-R1619 PolarHBondContact OH-NH1 2.88Å
1613	R	60.5	Low	57.1	Low	88 Å²	88	89.5 Å²	89.5	33%	0.332	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.8	-29.2	162.3	-48.5	173.9	177.3	138.2	-5.8	118.1	Q1208 Q1209 R1615 K1616 K1617 E1687	Q1208-R1613 HydrophobicContact CG-CB 4.46Å; Q1209-R1613 VanDerWaalsContact CA-CB 3.48Å; Q1209-R1613 VanDerWaalsContact CB-C 3.49Å; Q1209-R1613 VanDerWaalsContact CB-CA 3.5Å; Q1209-R1613 HydrophobicContact CB-CB 3.75Å; R1613-R1615 PolarHBondContact O-N 3.08Å; R1613-K1616 VanDerWaalsContact C-N 3.34Å; R1613-K1616 CarbonylContact O-C 3.59Å; R1613-K1616 VanDerWaalsContact O-CA 3.22Å; R1613-K1616 WeakPolarHBondContact O-CA 3.23Å; R1613-K1616 VanDerWaalsContact O-CB 3.29Å; R1613-K1616 WeakPolarHBondContact O-CB 3.49Å; R1613-K1616 PolarHBondContact O-N 2.59Å; R1613-K1617 WeakPolarHBondContact O-CB 3.27Å; R1613-K1617 PolarHBondContact O-N 3.07Å; R1613-E1687 VanDerWaalsContact CZ-CD 3.46Å; R1613-E1687 IonicContact CZ-OE1 3.5Å; R1613-E1687 IonicContact CZ-OE2 2.82Å; R1613-E1687 IonicContact NE-OE1 3.95Å; R1613-E1687 PolarHBondContact NE-OE1 3.43Å; R1613-E1687 IonicContact NH1-OE1 3.38Å; R1613-E1687 PolarHBondContact NH1-OE1 3.04Å; R1613-E1687 VanDerWaalsContact NH1-OE1 3.08Å; R1613-E1687 IonicContact NH1-OE2 3.74Å; R1613-E1687 PolarHBondContact NH1-OE2 2.7Å; R1613-E1687 IonicContact NH2-OE1 2.73Å; R1613-E1687 PolarHBondContact NH2-OE1 3.12Å; R1613-E1687 IonicContact NH2-OE2 3.9Å
1614	I	59.6	Low	55.2	Low	11 Å²	11	90.9 Å²	90.9	6%	0.056	44%	0.439	C	S	.	.	H	α-helix	trans	-66.1	-31.1	171.6	-69.4	160.6	0	0	0	107.6	F1207 Q1208 Q1209 Y1612 K1616 K1617 R1618 R1619	F1207-I1614 HydrophobicContact CD1-CD1 3.82Å; F1207-I1614 HydrophobicContact CE1-CD1 4.29Å; F1207-I1614 HydrophobicContact CG-CD1 4.1Å; Q1208-I1614 HydrophobicContact CB-CD1 4.49Å; Q1208-I1614 HydrophobicContact CB-CG1 3.95Å; Q1208-I1614 HydrophobicContact CG-CG1 3.75Å; Q1208-I1614 WeakPolarHBondContact O-CD1 3.36Å; Q1209-I1614 HydrophobicContact CB-CB 4.08Å; Q1209-I1614 HydrophobicContact CB-CD1 4.34Å; Q1209-I1614 HydrophobicContact CB-CG1 3.87Å; Q1209-I1614 HydrophobicContact CG-CB 3.95Å; Q1209-I1614 HydrophobicContact CG-CD1 3.73Å; Q1209-I1614 HydrophobicContact CG-CG1 3.75Å; Q1209-I1614 VanDerWaalsContact NE2-CB 3.3Å; Q1209-I1614 VanDerWaalsContact OE1-CD1 3.28Å; Y1612-I1614 PolarHBondContact O-N 2.82Å; Y1612-I1614 VanDerWaalsContact O-N 3.13Å; I1614-K1616 PolarHBondContact O-N 2.96Å; I1614-K1617 PolarHBondContact O-N 2.88Å; I1614-K1617 VanDerWaalsContact O-N 3.11Å; I1614-R1618 HydrophobicContact CG2-CB 3.41Å; I1614-R1618 VanDerWaalsContact CG2-CB 3.41Å; I1614-R1618 HydrophobicContact CG2-CG 3.4Å; I1614-R1618 VanDerWaalsContact CG2-CG 3.4Å; I1614-R1618 CarbonylContact O-C 3.58Å; I1614-R1618 VanDerWaalsContact O-CA 3.29Å; I1614-R1618 WeakPolarHBondContact O-CA 3.35Å; I1614-R1618 WeakPolarHBondContact O-CB 3.36Å; I1614-R1618 PolarHBondContact O-N 2.78Å; I1614-R1619 PolarHBondContact O-N 3.12Å
1615	R	59.5	Low	52.8	Low	107 Å²	107	94.8 Å²	94.8	40%	0.404	46%	0.461	S	S	.	.	H	α-helix	trans	-80.2	14.1	168.1	-62.1	142.4	-129.1	-164.1	12.7	112.5	Q1209 I1611 Y1612 R1613 R1619	Q1209-R1615 VanDerWaalsContact NE2-NE 3.2Å; I1611-R1615 WeakPolarHBondContact O-CD 3.49Å; I1611-R1615 PolarHBondContact O-NE 3.23Å; I1611-R1615 VanDerWaalsContact O-NE 3.07Å; I1611-R1615 PolarHBondContact O-NH1 3.04Å; I1611-R1615 PolarHBondContact O-NH2 2.95Å; Y1612-R1615 HydrophobicContact CD1-CB 4.36Å; Y1612-R1615 HydrophobicContact CD2-CB 3.68Å; Y1612-R1615 HydrophobicContact CD2-CG 4.45Å; Y1612-R1615 HydrophobicContact CE1-CB 4.45Å; Y1612-R1615 HydrophobicContact CE2-CB 3.79Å; Y1612-R1615 HydrophobicContact CG-CB 3.98Å; Y1612-R1615 CarbonylContact O-C 3.57Å; Y1612-R1615 VanDerWaalsContact O-C 3.24Å; Y1612-R1615 WeakPolarHBondContact O-CA 3.34Å; Y1612-R1615 VanDerWaalsContact O-CB 3.26Å; Y1612-R1615 WeakPolarHBondContact O-CB 3.46Å; Y1612-R1615 PolarHBondContact O-N 3.2Å; R1613-R1615 PolarHBondContact O-N 3.08Å; R1615-R1619 VanDerWaalsContact O-CD 3.25Å; R1615-R1619 WeakPolarHBondContact O-CD 3.48Å; R1615-R1619 PolarHBondContact O-NH1 3.08Å
1616	K	51.2	Low	50.6	Low	166 Å²	166	96.1 Å²	96.1	72%	0.722	48%	0.478	S	S	*	.	H	α-helix	trans	-108.8	-45.2	145.1	-176	-171.6	179.2	-175.4	0	111.9	Y1612 R1613 I1614 R1619 A1620	Y1612-K1616 PolarHBondContact O-N 2.79Å; R1613-K1616 VanDerWaalsContact C-N 3.34Å; R1613-K1616 CarbonylContact O-C 3.59Å; R1613-K1616 VanDerWaalsContact O-CA 3.22Å; R1613-K1616 WeakPolarHBondContact O-CA 3.23Å; R1613-K1616 VanDerWaalsContact O-CB 3.29Å; R1613-K1616 WeakPolarHBondContact O-CB 3.49Å; R1613-K1616 PolarHBondContact O-N 2.59Å; I1614-K1616 PolarHBondContact O-N 2.96Å; K1616-R1619 CarbonylContact O-C 3.55Å; K1616-R1619 PolarHBondContact O-N 3.17Å; K1616-A1620 VanDerWaalsContact O-CB 3.22Å; K1616-A1620 WeakPolarHBondContact O-CB 3.23Å; K1616-A1620 PolarHBondContact O-N 3Å
1617	K	42.1	Very low	48.7	Very low	49 Å²	49	96.5 Å²	96.5	21%	0.213	48%	0.482	C	S	.	.	H	α-helix	trans	-95.1	-35.7	-163.6	-176.6	156.3	173.7	153.8	0	115.8	Q1208 R1613 I1614 R1619 S1621 D1682 S1683	Q1208-K1617 HydrophobicContact CG-CB 4.24Å; Q1208-K1617 HydrophobicContact CG-CD 4.24Å; Q1208-K1617 HydrophobicContact CG-CG 4.47Å; R1613-K1617 WeakPolarHBondContact O-CB 3.27Å; R1613-K1617 PolarHBondContact O-N 3.07Å; I1614-K1617 PolarHBondContact O-N 2.88Å; I1614-K1617 VanDerWaalsContact O-N 3.11Å; K1617-R1619 VanDerWaalsContact C-N 3.34Å; K1617-S1621 VanDerWaalsContact O-CB 3.26Å; K1617-S1621 WeakPolarHBondContact O-CB 3.1Å; K1617-S1621 PolarHBondContact O-N 3.05Å; K1617-S1621 PolarHBondContact O-OG 3.29Å; K1617-D1682 VanDerWaalsContact CE-OD2 3.28Å; K1617-D1682 WeakPolarHBondContact CE-OD2 3.19Å; K1617-D1682 IonicContact NZ-OD1 2.66Å; K1617-D1682 PolarHBondContact NZ-OD1 3.38Å; K1617-D1682 IonicContact NZ-OD2 3.35Å; K1617-D1682 PolarHBondContact NZ-OD2 3.12Å; K1617-S1683 PolarHBondContact NZ-O 2.9Å
1618	R	41.7	Very low	46.8	Very low	119 Å²	119	99.1 Å²	99.1	45%	0.449	49%	0.491	S	S	.	.	H	α-helix	trans	-74.7	-18.4	151.6	-74.9	-179.8	-147.3	174.1	5.6	112.8	F1207 I1614 S1621 I1622	F1207-R1618 VanDerWaalsContact CE1-NH2 3.27Å; I1614-R1618 HydrophobicContact CG2-CB 3.41Å; I1614-R1618 VanDerWaalsContact CG2-CB 3.41Å; I1614-R1618 HydrophobicContact CG2-CG 3.4Å; I1614-R1618 VanDerWaalsContact CG2-CG 3.4Å; I1614-R1618 CarbonylContact O-C 3.58Å; I1614-R1618 VanDerWaalsContact O-CA 3.29Å; I1614-R1618 WeakPolarHBondContact O-CA 3.35Å; I1614-R1618 WeakPolarHBondContact O-CB 3.36Å; I1614-R1618 PolarHBondContact O-N 2.78Å; R1618-S1621 WeakPolarHBondContact CA-OG 3.25Å; R1618-I1622 HydrophobicContact CB-CD1 3.99Å; R1618-I1622 HydrophobicContact CB-CG1 4.48Å; R1618-I1622 WeakPolarHBondContact O-CB 3.4Å; R1618-I1622 WeakPolarHBondContact O-CD1 3.4Å; R1618-I1622 WeakPolarHBondContact O-CG1 3.18Å; R1618-I1622 PolarHBondContact O-N 3.03Å
1619	R	40.6	Very low	44.5	Very low	147 Å²	147	104.9 Å²	104.9	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-76.4	-27.3	168.9	-79.7	-166	-166.4	151.4	-10.8	112.8	Y1612 I1614 R1615 K1616 K1617	Y1612-R1619 PolarHBondContact OH-NH1 2.88Å; I1614-R1619 PolarHBondContact O-N 3.12Å; R1615-R1619 VanDerWaalsContact O-CD 3.25Å; R1615-R1619 WeakPolarHBondContact O-CD 3.48Å; R1615-R1619 PolarHBondContact O-NH1 3.08Å; K1616-R1619 CarbonylContact O-C 3.55Å; K1616-R1619 PolarHBondContact O-N 3.17Å; K1617-R1619 VanDerWaalsContact C-N 3.34Å
1620	A	39.2	Very low	42.8	Very low	60 Å²	60	105.7 Å²	105.7	50%	0.496	54%	0.535	S	S	.	.	H	α-helix	trans	-77.4	-47.7	167.7	0	0	0	0	0	110.6	K1616 I1622 Q1623	K1616-A1620 VanDerWaalsContact O-CB 3.22Å; K1616-A1620 WeakPolarHBondContact O-CB 3.23Å; K1616-A1620 PolarHBondContact O-N 3Å; A1620-I1622 PolarHBondContact O-N 3.49Å; A1620-Q1623 PolarHBondContact O-N 3.43Å; A1620-Q1623 VanDerWaalsContact O-N 3.15Å
1621	S	39	Very low	41.1	Very low	87 Å²	87	108.3 Å²	108.3	61%	0.608	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	4.7	178.1	92.3	0	0	0	0	114.8	K1617 R1618	K1617-S1621 VanDerWaalsContact O-CB 3.26Å; K1617-S1621 WeakPolarHBondContact O-CB 3.1Å; K1617-S1621 PolarHBondContact O-N 3.05Å; K1617-S1621 PolarHBondContact O-OG 3.29Å; R1618-S1621 WeakPolarHBondContact CA-OG 3.25Å
1622	I	34.4	Very low	39.2	Very low	122 Å²	122	109.4 Å²	109.4	63%	0.626	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.6	34.3	169.1	-51.4	167.9	0	0	0	108.8	R1618 A1620 P1624	R1618-I1622 HydrophobicContact CB-CD1 3.99Å; R1618-I1622 HydrophobicContact CB-CG1 4.48Å; R1618-I1622 WeakPolarHBondContact O-CB 3.4Å; R1618-I1622 WeakPolarHBondContact O-CD1 3.4Å; R1618-I1622 WeakPolarHBondContact O-CG1 3.18Å; R1618-I1622 PolarHBondContact O-N 3.03Å; A1620-I1622 PolarHBondContact O-N 3.49Å; I1622-P1624 WeakPolarHBondContact O-CD 3.01Å
1623	Q	29.4	Very low	37.4	Very low	160 Å²	160	108.8 Å²	108.8	75%	0.748	56%	0.564	S	S	*	*	S	Bend	trans	-88.7	107.2	143.6	-76.5	-172.4	-35.5	0	0	107.6	A1620	A1620-Q1623 PolarHBondContact O-N 3.43Å; A1620-Q1623 VanDerWaalsContact O-N 3.15Å
1624	P	27.8	Very low	35.9	Very low	98 Å²	98	112 Å²	112	64%	0.636	59%	0.588	S	S	*	*			trans	-77.9	140.2	-179.8	31	-34.1	0	0	0	111.5	I1622 T1626	I1622-P1624 WeakPolarHBondContact O-CD 3.01Å; P1624-T1626 PolarHBondContact O-N 2.97Å; P1624-T1626 PolarHBondContact O-OG1 3.4Å
1625	N	24.9	Very low	34.5	Very low	170 Å²	170	115.7 Å²	115.7	91%	0.909	62%	0.62	S	S	*	*			trans	-58.8	99.9	172.2	-79	-29.1	0	0	0	111.4
1626	T	27.5	Very low	32.9	Very low	118 Å²	118	119.1 Å²	119.1	72%	0.724	64%	0.64	S	S	*	*			trans	-136.5	100.6	176	38.8	0	0	0	0	112.8	P1624	P1624-T1626 PolarHBondContact O-N 2.97Å; P1624-T1626 PolarHBondContact O-OG1 3.4Å
1627	L	25.5	Very low	31.7	Very low	110 Å²	110	120.1 Å²	120.1	58%	0.576	65%	0.645	S	S	*	*			trans	3.9	127.5	156.2	-71.4	76.5	0	0	0	120.5
1628	N	27.3	Very low	30.9	Very low	119 Å²	119	125.8 Å²	125.8	64%	0.636	67%	0.672	S	S	*	*				48.3	112	123.9	-53.4	-57.8	0	0	0	121.8
1629	L	27.8	Very low	30.1	Very low	165 Å²	165	126.2 Å²	126.2	86%	0.864	69%	0.688	S	S	*	*			trans	71.9	169.1	135.5	-118.4	72.3	0	0	0	118.1
1630	P	33.2	Very low	29.5	Very low	83 Å²	83	124.1 Å²	124.1	54%	0.539	70%	0.696	S	S	.	*				-132.4	172.5	-97.2	45.1	-30.7	0	0	0	117.9
1631	N	28.8	Very low	28.8	Very low	127 Å²	127	129.4 Å²	129.4	68%	0.679	71%	0.71	S	S	*	*			trans	66.4	134.5	149.2	-70.8	-2.4	0	0	0	123.8
1632	L	32.2	Very low	28.1	Very low	101 Å²	101	133.2 Å²	133.2	53%	0.529	72%	0.724	S	S	.	*				125.2	123.3	122.9	-134.5	77.5	0	0	0	119.4	N1648	L1632-N1648 VanDerWaalsContact CD2-O 3.27Å; L1632-N1648 WeakPolarHBondContact CD2-O 3.42Å
1633	S	32.4	Very low	27.9	Very low	78 Å²	78	130.7 Å²	130.7	55%	0.545	73%	0.728	S	S	.	*			trans	52.1	111.4	143	62.2	0	0	0	0	124.2
1634	D	30.8	Very low	27.9	Very low	155 Å²	155	130.3 Å²	130.3	83%	0.829	73%	0.731	S	S	*	*				68.1	120.5	114	-59.4	-51.8	0	0	0	125.4
1635	A	28.7	Very low	28	Very low	88 Å²	88	132.4 Å²	132.4	73%	0.727	74%	0.737	S	S	*	*				86.4	154.7	128.3	0	0	0	0	0	122.5
1636	Q	27.4	Very low	28.3	Very low	179 Å²	179	129.4 Å²	129.4	84%	0.836	73%	0.725	S	S	*	*			trans	66.9	103.3	171.1	-58.2	-171.7	8.8	0	0	115.2
1637	K	25.8	Very low	28.4	Very low	187 Å²	187	128 Å²	128	81%	0.813	71%	0.713	S	S	*	*				81.6	138.1	83.9	-88.9	-173.6	174.6	179.9	0	113.2
1638	Q	25	Very low	28.7	Very low	168 Å²	168	127.7 Å²	127.7	79%	0.785	71%	0.712	S	S	*	*			trans	68.6	92.5	162.9	-70.1	168.6	-33.7	0	0	117.5
1639	T	24.5	Very low	28.8	Very low	128 Å²	128	128 Å²	128	79%	0.785	71%	0.713	S	S	*	*				71	133.4	124	53.5	0	0	0	0	120.9
1640	S	27.3	Very low	29.2	Very low	103 Å²	103	126.8 Å²	126.8	72%	0.72	71%	0.708	S	S	*	*			trans	73.9	147.9	165.4	-62.1	0	0	0	0	117.7
1641	Q	25.6	Very low	29.1	Very low	172 Å²	172	129 Å²	129	80%	0.804	72%	0.715	S	S	*	*	S	Bend	trans	36.5	112.4	142.1	-61	171.2	-4.8	0	0	119.7
1642	N	24.3	Very low	29.3	Very low	166 Å²	166	129.3 Å²	129.3	89%	0.888	72%	0.717	S	S	*	*			trans	66	167.1	158	-51.1	-34.9	0	0	0	116.3
1643	G	30	Very low	29.2	Very low	70 Å²	70	130 Å²	130	72%	0.722	72%	0.722	S	S	*	*			trans	126.8	75.5	162.9	0	0	0	0	0	118.4
1644	N	28.5	Very low	29.1	Very low	152 Å²	152	132 Å²	132	81%	0.813	73%	0.726	S	S	*	*			trans	11.1	120.6	131.9	-60.4	-9.9	0	0	0	120.7
1645	N	29.9	Very low	29	Very low	142 Å²	142	130.7 Å²	130.7	76%	0.759	72%	0.719	S	S	*	*				55	139.8	114.6	-74.6	7	0	0	0	124.8
1646	T	31.1	Very low	29.1	Very low	106 Å²	106	132.4 Å²	132.4	65%	0.65	72%	0.716	S	S	*	*			trans	86.3	115.3	133.6	49.2	0	0	0	0	123.6
1647	N	29.9	Very low	29.1	Very low	89 Å²	89	130.5 Å²	130.5	48%	0.476	71%	0.711	S	S	.	*				61.2	133.3	127.5	-48.6	5.4	0	0	0	121.5
1648	N	31.3	Very low	29.4	Very low	104 Å²	104	128.8 Å²	128.8	56%	0.556	71%	0.711	S	S	*	*				162.1	152.6	102.5	-89	-46.7	0	0	0	116.8	L1632	L1632-N1648 VanDerWaalsContact CD2-O 3.27Å; L1632-N1648 WeakPolarHBondContact CD2-O 3.42Å
1649	N	31.2	Very low	29.7	Very low	124 Å²	124	125.3 Å²	125.3	66%	0.663	70%	0.703	S	S	*	*			trans	56.6	118.2	145.8	-60.8	-14.8	0	0	0	122.9
1650	N	36.1	Very low	30	Very low	141 Å²	141	125.5 Å²	125.5	75%	0.754	70%	0.699	S	S	*	*				-168.3	129.8	118.2	-93.4	-43.4	0	0	0	108.1
1651	N	30.6	Very low	29.9	Very low	129 Å²	129	125.4 Å²	125.4	69%	0.69	70%	0.699	S	S	*	*				54.9	104.1	76.6	-70.2	-25.1	0	0	0	114
1652	N	31.9	Very low	30.1	Very low	133 Å²	133	122.1 Å²	122.1	71%	0.711	69%	0.692	S	S	*	*				-170.9	129.6	92.8	-101.3	-22.6	0	0	0	114.6
1653	N	30.8	Very low	30.1	Very low	117 Å²	117	118.7 Å²	118.7	63%	0.626	68%	0.681	S	S	*	*				56.2	119.3	126.3	-63.2	-6	0	0	0	121.6
1654	N	29.3	Very low	29.9	Very low	120 Å²	120	124 Å²	124	64%	0.642	69%	0.685	S	S	*	*				84	110.5	117.2	-66.1	4.2	0	0	0	120
1655	N	29.6	Very low	29.7	Very low	127 Å²	127	121 Å²	121	68%	0.679	68%	0.676	S	S	*	*				89.5	150.6	114.1	-68.1	2.7	0	0	0	119.6
1656	N	30.6	Very low	29.3	Very low	124 Å²	124	120 Å²	120	66%	0.663	67%	0.67	S	S	*	*			trans	73.2	95.7	147.8	-68.8	4.7	0	0	0	118
1657	N	28.2	Very low	29.1	Very low	138 Å²	138	118.9 Å²	118.9	74%	0.738	67%	0.667	S	S	*	*				86.6	131.1	126.6	-47.9	-17.8	0	0	0	117.7
1658	D	31.4	Very low	28.9	Very low	151 Å²	151	123.6 Å²	123.6	81%	0.807	68%	0.678	S	S	*	*				-20.3	152.6	125.7	-69.1	-66.3	0	0	0	115.1
1659	P	31.3	Very low	28.7	Very low	95 Å²	95	125.7 Å²	125.7	62%	0.617	69%	0.689	S	S	*	*			cis	-138	-150.1	30.7	31.4	-6.8	0	0	0	111.9
1660	N	31	Very low	28.5	Very low	132 Å²	132	126.1 Å²	126.1	71%	0.706	68%	0.681	S	S	*	*			trans	68	84.8	164	-49.2	-25.4	0	0	0	112.7
1661	S	25.8	Very low	27.9	Very low	102 Å²	102	124.6 Å²	124.6	71%	0.713	67%	0.665	S	S	*	*			cis	57.3	154.1	38.8	111.8	0	0	0	0	112.4
1662	P	29.7	Very low	27.6	Very low	102 Å²	102	123.1 Å²	123.1	66%	0.662	66%	0.657	S	S	*	*			cis	-134	145.3	11.3	40.4	-23.4	0	0	0	116.3
1663	S	23.3	Very low	27.3	Very low	94 Å²	94	123.4 Å²	123.4	66%	0.657	66%	0.659	S	S	*	*				67.6	168.3	124.2	80.7	0	0	0	0	123
1664	K	26.4	Very low	27.2	Very low	183 Å²	183	125.9 Å²	125.9	80%	0.796	67%	0.672	S	S	*	*			trans	74.8	86.7	157.7	-69.4	174.7	-178	-178.4	0	118.3
1665	S	23.4	Very low	26.9	Very low	89 Å²	89	127.6 Å²	127.6	62%	0.622	68%	0.676	S	S	*	*				28.8	134.9	109.4	64.8	0	0	0	0	119.4
1666	D	23.2	Very low	26.8	Very low	120 Å²	120	127.6 Å²	127.6	64%	0.642	68%	0.683	S	S	*	*			trans	69.3	97.6	152.6	-45.5	-33.7	0	0	0	118.2
1667	S	26.1	Very low	26.4	Very low	83 Å²	83	129 Å²	129	58%	0.58	69%	0.686	S	S	*	*				176.6	140.5	101.8	45.3	0	0	0	0	116.2
1668	R	25.7	Very low	26.2	Very low	187 Å²	187	129 Å²	129	71%	0.706	69%	0.685	S	S	*	*			trans	65.1	114.9	141.1	-68.2	165.3	-176.2	166.1	-2.7	121.9
1669	N	26.7	Very low	25.9	Very low	148 Å²	148	126.7 Å²	126.7	79%	0.791	68%	0.677	S	S	*	*				61.8	130.2	122.4	-65	7.2	0	0	0	122.8
1670	R	26.3	Very low	25.7	Very low	133 Å²	133	127.2 Å²	127.2	50%	0.502	68%	0.678	S	S	.	*			trans	84.5	125.3	139.2	-114.3	-176.2	167.8	164.6	-3.5	118.8	E991	E991-R1670 IonicContact OE1-CZ 2.6Å; E991-R1670 IonicContact OE1-NH1 2.56Å; E991-R1670 PolarHBondContact OE1-NH1 3.17Å; E991-R1670 IonicContact OE1-NH2 3.97Å; E991-R1670 PolarHBondContact OE1-NH2 3.22Å; E991-R1670 IonicContact OE2-CZ 2.67Å; E991-R1670 IonicContact OE2-NH1 3.91Å; E991-R1670 PolarHBondContact OE2-NH1 2.92Å; E991-R1670 IonicContact OE2-NH2 2.61Å; E991-R1670 PolarHBondContact OE2-NH2 3.29Å
1671	R	25.5	Very low	25.3	Very low	110 Å²	110	127.5 Å²	127.5	42%	0.415	68%	0.678	S	S	.	*			trans	73.3	143.8	159.1	-56.9	-166.3	165	128.3	-5.9	116.2	H1293 G1296	H1293-R1671 PolarHBondContact CE1-O 2.94Å; H1293-R1671 PolarHBondContact NE2-O 3.5Å; G1296-R1671 PolarHBondContact O-NH1 2.91Å; G1296-R1671 VanDerWaalsContact O-NH1 3.07Å
1672	D	24	Very low	25.3	Very low	97 Å²	97	127 Å²	127	52%	0.519	67%	0.667	S	S	.	*			cis	-176.8	166.3	-11.5	-92.8	-21.4	0	0	0	105.5	H1293	H1293-D1672 PolarHBondContact CD2-O 3.32Å; H1293-D1672 WeakPolarHBondContact NE2-CA 3.21Å; H1293-D1672 WeakPolarHBondContact NE2-CB 3.42Å; H1293-D1672 PolarHBondContact NE2-N 3.49Å; H1293-D1672 PolarHBondContact NE2-O 3.05Å
1673	N	25	Very low	25.2	Very low	140 Å²	140	125.4 Å²	125.4	75%	0.749	66%	0.659	S	S	*	*			trans	50.7	106.6	157.6	-56.1	-7	0	0	0	119.4
1674	N	28.4	Very low	25.3	Very low	169 Å²	169	123.4 Å²	123.4	90%	0.904	65%	0.648	S	S	*	*				-163	122.8	128	-96.6	-57.2	0	0	0	108.9
1675	E	24.1	Very low	25.4	Very low	156 Å²	156	120.1 Å²	120.1	73%	0.729	64%	0.644	S	S	*	*			trans	-76.3	148	-176.2	-58.3	157.3	95.1	0	0	112.2	Q1677	E1675-Q1677 VanDerWaalsContact C-N 3.32Å; E1675-Q1677 PolarHBondContact O-N 3.07Å; E1675-Q1677 VanDerWaalsContact O-N 3.09Å
1676	P	26.1	Very low	25.7	Very low	126 Å²	126	120 Å²	120	82%	0.818	64%	0.639	S	S	*	*			trans	-73.9	89.8	154	32.5	-30.2	0	0	0	109.1
1677	Q	23.2	Very low	26.1	Very low	155 Å²	155	118.3 Å²	118.3	72%	0.724	63%	0.627	S	S	*	*			trans	-62.5	165.1	152	-64.3	-179	-5.9	0	0	109.3	E1675	E1675-Q1677 VanDerWaalsContact C-N 3.32Å; E1675-Q1677 PolarHBondContact O-N 3.07Å; E1675-Q1677 VanDerWaalsContact O-N 3.09Å
1678	D	24.4	Very low	26.5	Very low	137 Å²	137	117.8 Å²	117.8	73%	0.733	62%	0.618	S	S	*	*			trans	75.8	132.3	-161.1	-59.6	-40.8	0	0	0	113.1
1679	T	25	Very low	26.9	Very low	102 Å²	102	110.7 Å²	110.7	63%	0.626	60%	0.597	S	S	*	*			cis	-128.3	144.8	44	57.8	0	0	0	0	116.1
1680	V	26.4	Very low	27.5	Very low	106 Å²	106	107.6 Å²	107.6	64%	0.642	59%	0.592	S	S	*	*			trans	-106.8	76.3	-173.4	-172.9	0	0	0	0	111.6
1681	I	23.6	Very low	28.7	Very low	138 Å²	138	102.2 Å²	102.2	71%	0.708	58%	0.577	S	S	*	*			trans	-138.7	107.8	174.4	-54.5	89.4	0	0	0	110.7
1682	D	25.7	Very low	30.1	Very low	91 Å²	91	97.9 Å²	97.9	49%	0.487	56%	0.562	S	S	.	*			cis	-145.8	137	-14.9	166.7	42.7	0	0	0	108.3	K1617 A1684	K1617-D1682 VanDerWaalsContact CE-OD2 3.28Å; K1617-D1682 WeakPolarHBondContact CE-OD2 3.19Å; K1617-D1682 IonicContact NZ-OD1 2.66Å; K1617-D1682 PolarHBondContact NZ-OD1 3.38Å; K1617-D1682 IonicContact NZ-OD2 3.35Å; K1617-D1682 PolarHBondContact NZ-OD2 3.12Å; D1682-A1684 VanDerWaalsContact C-N 3.31Å; D1682-A1684 PolarHBondContact O-N 3.03Å
1683	S	25.9	Very low	32.1	Very low	69 Å²	69	94.6 Å²	94.6	48%	0.483	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	79.2	-176.9	-35.9	0	0	0	0	111.1	K1617	K1617-S1683 PolarHBondContact NZ-O 2.9Å
1684	A	27.1	Very low	34	Very low	53 Å²	53	89.1 Å²	89.1	44%	0.438	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.7	-34.5	-169.4	0	0	0	0	0	115.1	D1682	D1682-A1684 VanDerWaalsContact C-N 3.31Å; D1682-A1684 PolarHBondContact O-N 3.03Å
1685	T	27.6	Very low	35.8	Very low	114 Å²	114	84 Å²	84	70%	0.699	48%	0.484	S	S	*	.	S	Bend	trans	-105.6	-6	-173.2	48.5	0	0	0	0	114
1686	T	29.9	Very low	37.9	Very low	87 Å²	87	77.9 Å²	77.9	53%	0.534	46%	0.456	S	S	.	.	S	Bend	trans	-105.2	-11.4	-176.9	40	0	0	0	0	114.5	L1688	T1686-L1688 PolarHBondContact O-N 3.21Å
1687	E	32.3	Very low	40.1	Very low	83 Å²	83	76.7 Å²	76.7	39%	0.388	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	14.5	-171.3	-70.4	-156.4	129.5	0	0	115.9	R1613	R1613-E1687 VanDerWaalsContact CZ-CD 3.46Å; R1613-E1687 IonicContact CZ-OE1 3.5Å; R1613-E1687 IonicContact CZ-OE2 2.82Å; R1613-E1687 IonicContact NE-OE1 3.95Å; R1613-E1687 PolarHBondContact NE-OE1 3.43Å; R1613-E1687 IonicContact NH1-OE1 3.38Å; R1613-E1687 PolarHBondContact NH1-OE1 3.04Å; R1613-E1687 VanDerWaalsContact NH1-OE1 3.08Å; R1613-E1687 IonicContact NH1-OE2 3.74Å; R1613-E1687 PolarHBondContact NH1-OE2 2.7Å; R1613-E1687 IonicContact NH2-OE1 2.73Å; R1613-E1687 PolarHBondContact NH2-OE1 3.12Å; R1613-E1687 IonicContact NH2-OE2 3.9Å
1688	L	33.1	Very low	42.6	Very low	73 Å²	73	73.6 Å²	73.6	38%	0.382	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.6	7.4	-172.8	-68.6	100.8	0	0	0	116.1	A1202 A1203 T1686 A1690	A1202-L1688 WeakPolarHBondContact O-CD2 3.46Å; A1203-L1688 VanDerWaalsContact CA-CB 3.49Å; A1203-L1688 HydrophobicContact CB-CB 3.86Å; A1203-L1688 WeakPolarHBondContact CB-O 3.21Å; T1686-L1688 PolarHBondContact O-N 3.21Å; L1688-A1690 VanDerWaalsContact C-N 3.27Å; L1688-A1690 PolarHBondContact O-N 3.4Å
1689	S	34.7	Very low	45.1	Very low	38 Å²	38	72.1 Å²	72.1	27%	0.266	43%	0.429	S	S	.	.			trans	-78.1	76.8	173.5	56.5	0	0	0	0	110.9	G1691	S1689-G1691 PolarHBondContact O-N 3.18Å
1690	A	39.9	Very low	47.7	Very low	82 Å²	82	70 Å²	70	68%	0.678	41%	0.411	S	S	*	.			trans	-89.6	70.8	-175.1	0	0	0	0	0	112.3	L1688	L1688-A1690 VanDerWaalsContact C-N 3.27Å; L1688-A1690 PolarHBondContact O-N 3.4Å
1691	G	50.4	Low	50.3	Low	20 Å²	20	65.6 Å²	65.6	21%	0.206	39%	0.385	C	S	.	.	S	Bend	trans	-143.8	167.9	168.5	0	0	0	0	0	110.2	S1689 K1693	S1689-G1691 PolarHBondContact O-N 3.18Å; G1691-K1693 PolarHBondContact O-N 3.41Å; G1691-K1693 VanDerWaalsContact O-N 3.16Å
1692	L	56.4	Low	53.2	Low	19 Å²	19	65.1 Å²	65.1	10%	0.099	38%	0.38	C	S	.	.			trans	-53.5	120.2	179	-83.5	74.5	0	0	0	110.6	T778 L804 P858 E1589	T778-L1692 WeakPolarHBondContact CG2-O 3.39Å; L804-L1692 HydrophobicContact CD1-CD1 3.83Å; L804-L1692 HydrophobicContact CD1-CD2 4.25Å; L804-L1692 HydrophobicContact CD1-CG 4.43Å; L804-L1692 HydrophobicContact CD2-CD1 3.51Å; L804-L1692 HydrophobicContact CD2-CD2 3.85Å; L804-L1692 HydrophobicContact CD2-CG 4.33Å; L804-L1692 HydrophobicContact CG-CD1 4.32Å; L804-L1692 HydrophobicContact CG-CD2 4.48Å; P858-L1692 HydrophobicContact CB-CD2 4.06Å; P858-L1692 HydrophobicContact CG-CD2 3.74Å; E1589-L1692 WeakPolarHBondContact OE2-CD1 3.03Å
1693	K	66.1	Low	56.1	Low	29 Å²	29	67.4 Å²	67.4	13%	0.126	39%	0.385	C	S	.	.			trans	-147.4	116.2	169	-63.9	-167.8	-177.9	-173.3	0	108	E770 K776 T778 G1691 F1695	E770-K1693 HydrophobicContact CG-CD 4.39Å; K776-K1693 WeakPolarHBondContact O-CE 3.3Å; K776-K1693 PolarHBondContact O-NZ 2.98Å; T778-K1693 HydrophobicContact CG2-CB 4.47Å; T778-K1693 HydrophobicContact CG2-CG 3.83Å; G1691-K1693 PolarHBondContact O-N 3.41Å; G1691-K1693 VanDerWaalsContact O-N 3.16Å; K1693-F1695 HydrophobicContact CB-CD2 4.49Å; K1693-F1695 HydrophobicContact CB-CE1 4.48Å; K1693-F1695 HydrophobicContact CB-CE2 3.71Å; K1693-F1695 HydrophobicContact CB-CZ 3.7Å; K1693-F1695 HydrophobicContact CD-CZ 4.33Å; K1693-F1695 WeakPolarHBondContact O-CD2 3.42Å; K1693-F1695 WeakPolarHBondContact O-CE2 3.49Å; K1693-F1695 PolarHBondContact O-N 2.97Å
1694	L	64	Low	59.1	Low	25 Å²	25	64.2 Å²	64.2	13%	0.131	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-82.7	114	175	-175.3	58.7	0	0	0	108.9	R765 T768 E770 L1696	R765-L1694 HydrophobicContact CB-CD2 4.09Å; R765-L1694 HydrophobicContact CG-CD2 3.87Å; T768-L1694 PolarHBondContact O-N 3.14Å; E770-L1694 PolarHBondContact N-O 3.3Å; L1694-L1696 HydrophobicContact CD1-CD1 4.18Å; L1694-L1696 HydrophobicContact CD2-CD1 3.65Å; L1694-L1696 HydrophobicContact CG-CD1 3.49Å; L1694-L1696 VanDerWaalsContact CG-CD1 3.49Å; L1694-L1696 HydrophobicContact CG-CG 4.39Å; L1694-L1696 PolarHBondContact O-N 3.06Å
1695	F	66	Low	62	Low	60 Å²	60	62 Å²	62	26%	0.263	34%	0.343	S	S	.	.			trans	-89.1	87.5	-179.3	-64.2	-83.8	0	0	0	110	L861 K1693	L861-F1695 HydrophobicContact CB-CE2 3.73Å; L861-F1695 HydrophobicContact CB-CZ 4.22Å; L861-F1695 HydrophobicContact CD1-CD2 4.17Å; L861-F1695 HydrophobicContact CD1-CE1 4.44Å; L861-F1695 HydrophobicContact CD1-CE2 3.72Å; L861-F1695 HydrophobicContact CD1-CZ 3.87Å; L861-F1695 HydrophobicContact CD2-CZ 4.39Å; L861-F1695 HydrophobicContact CG-CE2 4.21Å; L861-F1695 HydrophobicContact CG-CZ 4.37Å; K1693-F1695 HydrophobicContact CB-CD2 4.49Å; K1693-F1695 HydrophobicContact CB-CE1 4.48Å; K1693-F1695 HydrophobicContact CB-CE2 3.71Å; K1693-F1695 HydrophobicContact CB-CZ 3.7Å; K1693-F1695 HydrophobicContact CD-CZ 4.33Å; K1693-F1695 WeakPolarHBondContact O-CD2 3.42Å; K1693-F1695 WeakPolarHBondContact O-CE2 3.49Å; K1693-F1695 PolarHBondContact O-N 2.97Å
1696	L	69.3	Low	65	Low	29 Å²	29	60.3 Å²	60.3	15%	0.152	33%	0.33	C	S	.	.			trans	-77.7	151.6	174.9	-64.3	-28.9	0	0	0	111.9	L1694 E1700 V1701 L1704	L1694-L1696 HydrophobicContact CD1-CD1 4.18Å; L1694-L1696 HydrophobicContact CD2-CD1 3.65Å; L1694-L1696 HydrophobicContact CG-CD1 3.49Å; L1694-L1696 VanDerWaalsContact CG-CD1 3.49Å; L1694-L1696 HydrophobicContact CG-CG 4.39Å; L1694-L1696 PolarHBondContact O-N 3.06Å; L1696-E1700 HydrophobicContact CB-CB 4.14Å; L1696-E1700 HydrophobicContact CD2-CB 3.87Å; L1696-V1701 HydrophobicContact CB-CG2 3.59Å; L1696-V1701 HydrophobicContact CG-CG2 4.44Å; L1696-L1704 HydrophobicContact CD2-CD2 3.78Å
1697	N	72	Confident	68	Low	100 Å²	100	57.2 Å²	57.2	54%	0.535	31%	0.309	S	S	.	.			trans	-70.6	154.5	165.6	-62	-80.1	0	0	0	110.4	D1699 E1700 V1701	N1697-D1699 VanDerWaalsContact C-N 3.29Å; N1697-D1699 PolarHBondContact O-N 3.37Å; N1697-E1700 HydrophobicContact CB-CG 4.25Å; N1697-E1700 WeakPolarHBondContact CB-OE2 3.28Å; N1697-E1700 PolarHBondContact N-OE2 2.96Å; N1697-E1700 PolarHBondContact ND2-OE2 3.08Å; N1697-E1700 WeakPolarHBondContact O-CA 3.44Å; N1697-E1700 WeakPolarHBondContact O-CB 3.25Å; N1697-E1700 PolarHBondContact O-N 3.41Å; N1697-V1701 PolarHBondContact O-N 3.35Å
1698	P	74.3	Confident	70.9	Confident	90 Å²	90	53.4 Å²	53.4	58%	0.584	29%	0.291	S	S	*	.	H	α-helix	trans	-52	-45	179	-27.6	36.2	0	0	0	113.4	E1700 V1701 E1702	P1698-E1700 PolarHBondContact O-N 3.21Å; P1698-E1700 VanDerWaalsContact O-N 3.16Å; P1698-V1701 PolarHBondContact O-N 3.04Å; P1698-V1701 VanDerWaalsContact O-N 3.09Å; P1698-E1702 PolarHBondContact O-N 3.46Å
1699	D	77.7	Confident	73.6	Confident	107 Å²	107	54.1 Å²	54.1	57%	0.572	29%	0.293	S	S	*	.	H	α-helix	trans	-63	-15.4	177.2	-51.5	30.9	0	0	0	114.3	N1697 K1703	N1697-D1699 VanDerWaalsContact C-N 3.29Å; N1697-D1699 PolarHBondContact O-N 3.37Å; D1699-K1703 VanDerWaalsContact O-CD 3.31Å; D1699-K1703 WeakPolarHBondContact O-CD 3.4Å; D1699-K1703 VanDerWaalsContact O-CE 3.31Å; D1699-K1703 WeakPolarHBondContact O-CE 3.28Å; D1699-K1703 WeakPolarHBondContact O-CG 3.3Å
1700	E	78.8	Confident	76.3	Confident	57 Å²	57	57.2 Å²	57.2	27%	0.266	30%	0.303	S	S	.	.	H	α-helix	trans	-99.5	-30.4	173.8	-58.9	179.3	90.9	0	0	111.9	R765 L1696 N1697 P1698 L1704	R765-E1700 IonicContact NH2-OE1 3.1Å; R765-E1700 PolarHBondContact NH2-OE1 3.18Å; L1696-E1700 HydrophobicContact CB-CB 4.14Å; L1696-E1700 HydrophobicContact CD2-CB 3.87Å; N1697-E1700 HydrophobicContact CB-CG 4.25Å; N1697-E1700 WeakPolarHBondContact CB-OE2 3.28Å; N1697-E1700 PolarHBondContact N-OE2 2.96Å; N1697-E1700 PolarHBondContact ND2-OE2 3.08Å; N1697-E1700 WeakPolarHBondContact O-CA 3.44Å; N1697-E1700 WeakPolarHBondContact O-CB 3.25Å; N1697-E1700 PolarHBondContact O-N 3.41Å; P1698-E1700 PolarHBondContact O-N 3.21Å; P1698-E1700 VanDerWaalsContact O-N 3.16Å; E1700-L1704 VanDerWaalsContact O-CB 3.31Å; E1700-L1704 WeakPolarHBondContact O-CB 3.28Å; E1700-L1704 PolarHBondContact O-N 2.95Å; E1700-L1704 VanDerWaalsContact O-N 3.08Å
1701	V	82.3	Confident	78.8	Confident	13 Å²	13	53.4 Å²	53.4	8%	0.079	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-41.2	169.3	178.7	0	0	0	0	110.2	Y769 L1696 N1697 P1698 L1704 H1705	Y769-V1701 HydrophobicContact CD2-CG1 4.45Å; Y769-V1701 HydrophobicContact CE2-CG1 4.07Å; L1696-V1701 HydrophobicContact CB-CG2 3.59Å; L1696-V1701 HydrophobicContact CG-CG2 4.44Å; N1697-V1701 PolarHBondContact O-N 3.35Å; P1698-V1701 PolarHBondContact O-N 3.04Å; P1698-V1701 VanDerWaalsContact O-N 3.09Å; V1701-L1704 PolarHBondContact O-N 3.48Å; V1701-L1704 VanDerWaalsContact O-N 3.15Å; V1701-H1705 WeakPolarHBondContact CG1-NE2 3.34Å; V1701-H1705 PolarHBondContact O-CD2 3.14Å; V1701-H1705 VanDerWaalsContact O-CD2 3.29Å; V1701-H1705 VanDerWaalsContact O-CG 3.31Å; V1701-H1705 PolarHBondContact O-N 3.28Å
1702	E	84.5	Confident	80.8	Confident	129 Å²	129	53 Å²	53	60%	0.603	26%	0.264	S	S	*	.	H	α-helix	trans	-56.7	-51.9	175.3	-168.9	168.2	-161	0	0	110.7	P1698 L1704 H1705 D1706	P1698-E1702 PolarHBondContact O-N 3.46Å; E1702-L1704 VanDerWaalsContact C-N 3.26Å; E1702-L1704 PolarHBondContact O-N 3.41Å; E1702-H1705 CarbonylContact O-C 3.47Å; E1702-H1705 WeakPolarHBondContact O-CB 3.23Å; E1702-H1705 PolarHBondContact O-N 3.48Å; E1702-H1705 VanDerWaalsContact O-N 3.07Å; E1702-D1706 VanDerWaalsContact O-CG 3.29Å; E1702-D1706 PolarHBondContact O-N 3.41Å
1703	K	86.7	Confident	82.4	Confident	138 Å²	138	57.7 Å²	57.7	60%	0.6	29%	0.286	S	S	*	.	H	α-helix	trans	-61	-31.1	175.1	-67.1	168.6	-170.7	160.3	0	114.3	D1699 F1707	D1699-K1703 VanDerWaalsContact O-CD 3.31Å; D1699-K1703 WeakPolarHBondContact O-CD 3.4Å; D1699-K1703 VanDerWaalsContact O-CE 3.31Å; D1699-K1703 WeakPolarHBondContact O-CE 3.28Å; D1699-K1703 WeakPolarHBondContact O-CG 3.3Å; K1703-F1707 WeakPolarHBondContact O-CB 3.2Å; K1703-F1707 PolarHBondContact O-N 2.72Å; K1703-F1707 VanDerWaalsContact O-N 3.07Å
1704	L	87.2	Confident	83.6	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-77.2	-28.9	178.5	-168.9	62.3	0	0	0	111.4	Q762 R765 L766 Y769 L1696 E1700 V1701 E1702 F1707 E1708	Q762-L1704 HydrophobicContact CB-CD1 4.33Å; R765-L1704 HydrophobicContact CB-CD1 4.16Å; R765-L1704 HydrophobicContact CB-CD2 4.26Å; L766-L1704 HydrophobicContact CB-CD1 4.08Å; L766-L1704 HydrophobicContact CB-CG 4.4Å; L766-L1704 HydrophobicContact CD1-CD1 4.25Å; L766-L1704 HydrophobicContact CD1-CG 3.87Å; Y769-L1704 HydrophobicContact CD1-CD2 3.56Å; Y769-L1704 HydrophobicContact CE1-CD2 3.97Å; Y769-L1704 HydrophobicContact CG-CD2 4.1Å; L1696-L1704 HydrophobicContact CD2-CD2 3.78Å; E1700-L1704 VanDerWaalsContact O-CB 3.31Å; E1700-L1704 WeakPolarHBondContact O-CB 3.28Å; E1700-L1704 PolarHBondContact O-N 2.95Å; E1700-L1704 VanDerWaalsContact O-N 3.08Å; V1701-L1704 PolarHBondContact O-N 3.48Å; V1701-L1704 VanDerWaalsContact O-N 3.15Å; E1702-L1704 VanDerWaalsContact C-N 3.26Å; E1702-L1704 PolarHBondContact O-N 3.41Å; L1704-F1707 HydrophobicContact CD1-CD1 4.4Å; L1704-E1708 PolarHBondContact O-N 3.1Å; L1704-E1708 VanDerWaalsContact O-N 3.17Å
1705	H	89.6	Confident	85	Confident	6 Å²	6	59 Å²	59	3%	0.028	29%	0.292	C	S	.	.	H	α-helix	trans	-76.2	-38.9	169.6	-66.7	-171.1	0	0	0	111.4	E704 Y769 V1701 E1702 F1707 E1708 E1709	E704-H1705 HydrophobicContact CG-CB 4.19Å; E704-H1705 IonicContact OE2-CE1 3.17Å; E704-H1705 PolarHBondContact OE2-CE1 3.27Å; E704-H1705 IonicContact OE2-CG 2.63Å; E704-H1705 IonicContact OE2-ND1 3.18Å; E704-H1705 PolarHBondContact OE2-ND1 3.46Å; Y769-H1705 AromaticContact CE2-NE2 3.38Å; Y769-H1705 WeakPolarHBondContact CE2-NE2 3.3Å; Y769-H1705 AromaticContact CZ-CD2 3.89Å; Y769-H1705 AromaticContact CZ-NE2 3.38Å; Y769-H1705 PolarHBondContact OH-CD2 3.1Å; Y769-H1705 PolarHBondContact OH-NE2 3.41Å; V1701-H1705 WeakPolarHBondContact CG1-NE2 3.34Å; V1701-H1705 PolarHBondContact O-CD2 3.14Å; V1701-H1705 VanDerWaalsContact O-CD2 3.29Å; V1701-H1705 VanDerWaalsContact O-CG 3.31Å; V1701-H1705 PolarHBondContact O-N 3.28Å; E1702-H1705 CarbonylContact O-C 3.47Å; E1702-H1705 WeakPolarHBondContact O-CB 3.23Å; E1702-H1705 PolarHBondContact O-N 3.48Å; E1702-H1705 VanDerWaalsContact O-N 3.07Å; H1705-F1707 VanDerWaalsContact C-N 3.31Å; H1705-F1707 PolarHBondContact O-N 2.94Å; H1705-E1708 PolarHBondContact O-N 2.94Å; H1705-E1709 WeakPolarHBondContact O-CB 3.2Å; H1705-E1709 PolarHBondContact O-N 3.16Å
1706	D	90	Very high	86.1	Confident	80 Å²	80	57.7 Å²	57.7	43%	0.428	29%	0.289	S	S	.	.	H	α-helix	trans	-56.5	-46.4	171.9	-64.4	-30.7	0	0	0	110.5	E1702 E1709 E1710	E1702-D1706 VanDerWaalsContact O-CG 3.29Å; E1702-D1706 PolarHBondContact O-N 3.41Å; D1706-E1709 PolarHBondContact O-N 3.09Å; D1706-E1710 PolarHBondContact O-N 3.01Å
1707	F	92.5	Very high	86.9	Confident	21 Å²	21	61 Å²	61	9%	0.092	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-40.4	175.1	167.5	-102.2	0	0	0	113.1	C755 H758 D759 Q762 K1703 L1704 H1705 C1711	C755-F1707 HydrophobicContact CB-CE1 4.31Å; C755-F1707 HydrophobicContact CB-CZ 4.38Å; H758-F1707 HydrophobicContact CB-CE2 4.44Å; H758-F1707 AromaticContact CD2-CE2 3.98Å; D759-F1707 HydrophobicContact CB-CE2 3.73Å; D759-F1707 HydrophobicContact CB-CZ 3.91Å; Q762-F1707 HydrophobicContact CB-CD1 3.8Å; Q762-F1707 HydrophobicContact CB-CD2 4.31Å; Q762-F1707 HydrophobicContact CB-CE1 3.62Å; Q762-F1707 HydrophobicContact CB-CE2 4.15Å; Q762-F1707 HydrophobicContact CB-CG 4.15Å; Q762-F1707 HydrophobicContact CB-CZ 3.81Å; K1703-F1707 WeakPolarHBondContact O-CB 3.2Å; K1703-F1707 PolarHBondContact O-N 2.72Å; K1703-F1707 VanDerWaalsContact O-N 3.07Å; L1704-F1707 HydrophobicContact CD1-CD1 4.4Å; H1705-F1707 VanDerWaalsContact C-N 3.31Å; H1705-F1707 PolarHBondContact O-N 2.94Å; F1707-C1711 WeakPolarHBondContact O-CB 3.15Å; F1707-C1711 PolarHBondContact O-N 2.94Å; F1707-C1711 PolarHBondContact O-SG 2.86Å
1708	E	93.2	Very high	87.7	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.019	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-43.1	174.2	-169.3	-174	-161.3	0	0	111.2	E705 S706 I707 L766 L1704 H1705 C1711 V1712	E705-E1708 WeakPolarHBondContact CA-OE2 3.42Å; E705-E1708 PolarHBondContact N-OE2 2.83Å; S706-E1708 WeakPolarHBondContact CA-OE1 3.23Å; S706-E1708 WeakPolarHBondContact CB-OE1 3.42Å; S706-E1708 VanDerWaalsContact N-CD 3.27Å; S706-E1708 PolarHBondContact N-OE1 2.88Å; S706-E1708 PolarHBondContact N-OE2 3.38Å; S706-E1708 VanDerWaalsContact N-OE2 3.1Å; S706-E1708 VanDerWaalsContact OG-CD 3.3Å; S706-E1708 PolarHBondContact OG-OE1 3.22Å; I707-E1708 PolarHBondContact N-OE1 3.18Å; L766-E1708 HydrophobicContact CD1-CB 4.01Å; L766-E1708 HydrophobicContact CD1-CG 4.35Å; L766-E1708 HydrophobicContact CD2-CB 4.4Å; L766-E1708 HydrophobicContact CD2-CG 4.24Å; L1704-E1708 PolarHBondContact O-N 3.1Å; L1704-E1708 VanDerWaalsContact O-N 3.17Å; H1705-E1708 PolarHBondContact O-N 2.94Å; E1708-C1711 PolarHBondContact O-N 3.32Å; E1708-V1712 HydrophobicContact CG-CG2 4.4Å; E1708-V1712 WeakPolarHBondContact O-CB 3.18Å; E1708-V1712 VanDerWaalsContact O-CG2 3.22Å; E1708-V1712 WeakPolarHBondContact O-CG2 3.49Å; E1708-V1712 PolarHBondContact O-N 3.44Å
1709	E	89.8	Confident	88.3	Confident	88 Å²	88	57.8 Å²	57.8	41%	0.411	28%	0.282	S	S	.	.	H	α-helix	trans	-66.7	-40.7	-179.7	-169.5	156	-137.5	0	0	111.7	H1705 D1706 V1712 E1713	H1705-E1709 WeakPolarHBondContact O-CB 3.2Å; H1705-E1709 PolarHBondContact O-N 3.16Å; D1706-E1709 PolarHBondContact O-N 3.09Å; E1709-V1712 PolarHBondContact O-N 3.27Å; E1709-E1713 PolarHBondContact O-N 3.38Å
1710	E	91.1	Very high	88.6	Confident	103 Å²	103	58.2 Å²	58.2	48%	0.481	28%	0.276	S	S	.	.	H	α-helix	trans	-60.7	-45.3	171.3	-176.1	164.9	-152.2	0	0	111.6	D1706 V1712 E1713 D1714	D1706-E1710 PolarHBondContact O-N 3.01Å; E1710-V1712 VanDerWaalsContact C-N 3.33Å; E1710-V1712 PolarHBondContact O-N 3.26Å; E1710-E1713 PolarHBondContact O-N 3.48Å; E1710-D1714 WeakPolarHBondContact O-CB 3.37Å; E1710-D1714 PolarHBondContact O-N 2.84Å
1711	C	92.9	Very high	88.8	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.007	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-35.6	175.1	-73.4	0	0	0	0	113.1	H754 C755 F1707 E1708 Y1715	H754-C1711 PolarHBondContact CE1-O 3.27Å; H754-C1711 PolarHBondContact ND1-O 3.03Å; C755-C1711 VanDerWaalsContact SG-CB 3.6Å; F1707-C1711 WeakPolarHBondContact O-CB 3.15Å; F1707-C1711 PolarHBondContact O-N 2.94Å; F1707-C1711 PolarHBondContact O-SG 2.86Å; E1708-C1711 PolarHBondContact O-N 3.32Å; C1711-Y1715 WeakPolarHBondContact O-CB 3.42Å; C1711-Y1715 PolarHBondContact O-N 3.24Å
1712	V	92.3	Very high	88.9	Confident	11 Å²	11	63.5 Å²	63.5	7%	0.067	31%	0.306	C	S	.	.	H	α-helix	trans	-74	-40.3	177.5	169.2	0	0	0	0	111.7	L701 S706 L751 E1708 E1709 E1710 T1716	L701-V1712 HydrophobicContact CD2-CG1 3.92Å; S706-V1712 VanDerWaalsContact OG-CG2 3.3Å; S706-V1712 WeakPolarHBondContact OG-CG2 3.22Å; L751-V1712 HydrophobicContact CD1-CG2 4.42Å; L751-V1712 HydrophobicContact CD2-CG2 3.83Å; E1708-V1712 HydrophobicContact CG-CG2 4.4Å; E1708-V1712 WeakPolarHBondContact O-CB 3.18Å; E1708-V1712 VanDerWaalsContact O-CG2 3.22Å; E1708-V1712 WeakPolarHBondContact O-CG2 3.49Å; E1708-V1712 PolarHBondContact O-N 3.44Å; E1709-V1712 PolarHBondContact O-N 3.27Å; E1710-V1712 VanDerWaalsContact C-N 3.33Å; E1710-V1712 PolarHBondContact O-N 3.26Å; V1712-T1716 HydrophobicContact CG1-CG2 4.45Å; V1712-T1716 WeakPolarHBondContact O-CB 3.45Å; V1712-T1716 VanDerWaalsContact O-CG2 3.3Å; V1712-T1716 WeakPolarHBondContact O-CG2 3.4Å; V1712-T1716 PolarHBondContact O-N 3.38Å; V1712-T1716 PolarHBondContact O-OG1 2.96Å
1713	E	90.4	Very high	88.5	Confident	119 Å²	119	62.3 Å²	62.3	56%	0.556	30%	0.301	S	S	*	.	H	α-helix	trans	-61.4	-45.5	173.1	-77.1	-150.4	168.9	0	0	111.1	E1709 E1710 T1716 R1717	E1709-E1713 PolarHBondContact O-N 3.38Å; E1710-E1713 PolarHBondContact O-N 3.48Å; E1713-T1716 PolarHBondContact O-N 3.31Å; E1713-T1716 PolarHBondContact O-OG1 3.02Å; E1713-R1717 VanDerWaalsContact O-CB 3.27Å; E1713-R1717 WeakPolarHBondContact O-CB 3.27Å; E1713-R1717 PolarHBondContact O-N 2.99Å
1714	D	90.9	Very high	88	Confident	45 Å²	45	59.7 Å²	59.7	24%	0.241	29%	0.293	C	S	.	.	H	α-helix	trans	-65.5	-47.3	177.7	-86.2	26	0	0	0	111.9	E1710 T1716 R1717 V1718	E1710-D1714 WeakPolarHBondContact O-CB 3.37Å; E1710-D1714 PolarHBondContact O-N 2.84Å; D1714-T1716 VanDerWaalsContact C-N 3.35Å; D1714-T1716 PolarHBondContact O-N 3.37Å; D1714-R1717 WeakPolarHBondContact O-CB 3.36Å; D1714-R1717 PolarHBondContact O-N 3.34Å; D1714-R1717 VanDerWaalsContact O-N 3.11Å; D1714-R1717 IonicContact OD1-CZ 2.71Å; D1714-R1717 IonicContact OD1-NH1 3.18Å; D1714-R1717 PolarHBondContact OD1-NH1 2.94Å; D1714-R1717 IonicContact OD1-NH2 3.64Å; D1714-R1717 PolarHBondContact OD1-NH2 2.76Å; D1714-R1717 IonicContact OD2-NH1 2.81Å; D1714-V1718 WeakPolarHBondContact O-CG2 2.99Å; D1714-V1718 PolarHBondContact O-N 3.17Å
1715	Y	92.4	Very high	87.6	Confident	35 Å²	35	66 Å²	66	14%	0.137	32%	0.322	C	S	.	.	H	α-helix	trans	-57.8	-45	176.1	172.6	-98.2	0	0	0	111.9	L747 D750 L751 H754 C1711 R1717 V1718 T1719	L747-Y1715 HydrophobicContact CD1-CE1 3.59Å; D750-Y1715 HydrophobicContact CB-CE2 3.73Å; D750-Y1715 WeakPolarHBondContact CB-OH 3.37Å; D750-Y1715 PolarHBondContact OD2-OH 3.02Å; L751-Y1715 HydrophobicContact CD2-CD1 3.54Å; L751-Y1715 HydrophobicContact CD2-CD2 4.48Å; L751-Y1715 HydrophobicContact CD2-CE1 4.2Å; L751-Y1715 HydrophobicContact CD2-CG 3.72Å; L751-Y1715 HydrophobicContact CG-CD1 4.33Å; H754-Y1715 HydrophobicContact CB-CD2 4.3Å; C1711-Y1715 WeakPolarHBondContact O-CB 3.42Å; C1711-Y1715 PolarHBondContact O-N 3.24Å; Y1715-R1717 VanDerWaalsContact C-N 3.33Å; Y1715-R1717 PolarHBondContact O-N 3.12Å; Y1715-V1718 PolarHBondContact O-N 2.9Å; Y1715-T1719 VanDerWaalsContact O-CB 3.27Å; Y1715-T1719 WeakPolarHBondContact O-CB 3.26Å; Y1715-T1719 PolarHBondContact O-N 3.06Å; Y1715-T1719 PolarHBondContact O-OG1 3.47Å
1716	T	89	Confident	87.1	Confident	33 Å²	33	71.4 Å²	71.4	20%	0.202	35%	0.345	C	S	.	.	H	α-helix	trans	-72.6	-24.6	178.5	60	0	0	0	0	113	L701 V1712 E1713 D1714 R1720	L701-T1716 HydrophobicContact CD1-CG2 4.05Å; L701-T1716 HydrophobicContact CD2-CG2 4.14Å; V1712-T1716 HydrophobicContact CG1-CG2 4.45Å; V1712-T1716 WeakPolarHBondContact O-CB 3.45Å; V1712-T1716 VanDerWaalsContact O-CG2 3.3Å; V1712-T1716 WeakPolarHBondContact O-CG2 3.4Å; V1712-T1716 PolarHBondContact O-N 3.38Å; V1712-T1716 PolarHBondContact O-OG1 2.96Å; E1713-T1716 PolarHBondContact O-N 3.31Å; E1713-T1716 PolarHBondContact O-OG1 3.02Å; D1714-T1716 VanDerWaalsContact C-N 3.35Å; D1714-T1716 PolarHBondContact O-N 3.37Å; T1716-R1720 WeakPolarHBondContact O-CB 3.32Å; T1716-R1720 PolarHBondContact O-N 2.92Å
1717	R	88	Confident	86.4	Confident	98 Å²	98	71.2 Å²	71.2	37%	0.37	36%	0.355	S	S	.	.	H	α-helix	trans	-72.6	-43.5	171.3	-160.6	-173.9	-49.1	119.6	11.9	111.5	E1713 D1714 Y1715 K1721	E1713-R1717 VanDerWaalsContact O-CB 3.27Å; E1713-R1717 WeakPolarHBondContact O-CB 3.27Å; E1713-R1717 PolarHBondContact O-N 2.99Å; D1714-R1717 WeakPolarHBondContact O-CB 3.36Å; D1714-R1717 PolarHBondContact O-N 3.34Å; D1714-R1717 VanDerWaalsContact O-N 3.11Å; D1714-R1717 IonicContact OD1-CZ 2.71Å; D1714-R1717 IonicContact OD1-NH1 3.18Å; D1714-R1717 PolarHBondContact OD1-NH1 2.94Å; D1714-R1717 IonicContact OD1-NH2 3.64Å; D1714-R1717 PolarHBondContact OD1-NH2 2.76Å; D1714-R1717 IonicContact OD2-NH1 2.81Å; Y1715-R1717 VanDerWaalsContact C-N 3.33Å; Y1715-R1717 PolarHBondContact O-N 3.12Å; R1717-K1721 WeakPolarHBondContact O-CG 3.48Å; R1717-K1721 PolarHBondContact O-N 2.73Å
1718	V	88.2	Confident	85.7	Confident	85 Å²	85	77.9 Å²	77.9	52%	0.515	39%	0.386	S	S	.	.	H	α-helix	trans	-67.5	-48.4	176.7	172.2	0	0	0	0	110.8	D1714 Y1715 R1720 K1721 A1722	D1714-V1718 WeakPolarHBondContact O-CG2 2.99Å; D1714-V1718 PolarHBondContact O-N 3.17Å; Y1715-V1718 PolarHBondContact O-N 2.9Å; V1718-R1720 PolarHBondContact O-N 3.11Å; V1718-K1721 WeakPolarHBondContact O-CB 3.36Å; V1718-K1721 PolarHBondContact O-N 3.27Å; V1718-K1721 VanDerWaalsContact O-N 3.11Å; V1718-A1722 PolarHBondContact O-N 2.95Å
1719	T	86.2	Confident	84.7	Confident	39 Å²	39	78.4 Å²	78.4	24%	0.239	39%	0.393	C	S	.	.	H	α-helix	trans	-60.9	-44.1	-179.6	-58.1	0	0	0	0	111.3	Y1715 K1721 A1722 E1723	Y1715-T1719 VanDerWaalsContact O-CB 3.27Å; Y1715-T1719 WeakPolarHBondContact O-CB 3.26Å; Y1715-T1719 PolarHBondContact O-N 3.06Å; Y1715-T1719 PolarHBondContact O-OG1 3.47Å; T1719-K1721 VanDerWaalsContact C-N 3.33Å; T1719-K1721 PolarHBondContact O-N 2.81Å; T1719-A1722 PolarHBondContact O-N 3.49Å; T1719-E1723 HydrophobicContact CG2-CG 4.49Å; T1719-E1723 WeakPolarHBondContact O-CG 3.25Å; T1719-E1723 PolarHBondContact O-N 3.26Å
1720	R	83.4	Confident	84.3	Confident	116 Å²	116	79.2 Å²	79.2	44%	0.438	40%	0.397	S	S	.	.	H	α-helix	trans	-62.4	-38.1	175.4	-170.4	-177.2	-54.5	117.6	15.5	112.4	T1716 V1718 L1724	T1716-R1720 WeakPolarHBondContact O-CB 3.32Å; T1716-R1720 PolarHBondContact O-N 2.92Å; V1718-R1720 PolarHBondContact O-N 3.11Å; R1720-L1724 HydrophobicContact CG-CD1 4.29Å; R1720-L1724 WeakPolarHBondContact O-CD1 3.46Å; R1720-L1724 WeakPolarHBondContact O-CG 3.16Å; R1720-L1724 PolarHBondContact O-N 3.49Å; R1720-L1724 VanDerWaalsContact O-N 3.09Å
1721	K	84.7	Confident	83.8	Confident	129 Å²	129	77.8 Å²	77.8	56%	0.561	40%	0.395	S	S	*	.	H	α-helix	trans	-63.7	-47.5	172.3	-76	179.7	176.3	-172.1	0	111	R1717 V1718 T1719 E1723 L1724 H1725	R1717-K1721 WeakPolarHBondContact O-CG 3.48Å; R1717-K1721 PolarHBondContact O-N 2.73Å; V1718-K1721 WeakPolarHBondContact O-CB 3.36Å; V1718-K1721 PolarHBondContact O-N 3.27Å; V1718-K1721 VanDerWaalsContact O-N 3.11Å; T1719-K1721 VanDerWaalsContact C-N 3.33Å; T1719-K1721 PolarHBondContact O-N 2.81Å; K1721-E1723 VanDerWaalsContact C-N 3.33Å; K1721-E1723 PolarHBondContact O-N 3.45Å; K1721-L1724 PolarHBondContact O-N 3.38Å; K1721-L1724 VanDerWaalsContact O-N 3.14Å; K1721-H1725 PolarHBondContact O-CD2 2.7Å; K1721-H1725 PolarHBondContact O-N 3.16Å
1722	A	84	Confident	83.1	Confident	52 Å²	52	82.8 Å²	82.8	43%	0.43	42%	0.419	S	S	.	.	H	α-helix	trans	-59.4	-42.2	178.2	0	0	0	0	0	112.2	V1718 T1719 L1724 H1725 K1726	V1718-A1722 PolarHBondContact O-N 2.95Å; T1719-A1722 PolarHBondContact O-N 3.49Å; A1722-L1724 PolarHBondContact O-N 3.21Å; A1722-H1725 PolarHBondContact O-N 3.19Å; A1722-H1725 VanDerWaalsContact O-N 3.17Å; A1722-K1726 PolarHBondContact O-N 2.94Å
1723	E	75.8	Confident	82.7	Confident	103 Å²	103	84.3 Å²	84.3	48%	0.481	43%	0.426	S	S	.	.	H	α-helix	trans	-61.9	-39.5	174.1	-72.2	175.3	152.6	0	0	112.7	T1719 K1721 H1725	T1719-E1723 HydrophobicContact CG2-CG 4.49Å; T1719-E1723 WeakPolarHBondContact O-CG 3.25Å; T1719-E1723 PolarHBondContact O-N 3.26Å; K1721-E1723 VanDerWaalsContact C-N 3.33Å; K1721-E1723 PolarHBondContact O-N 3.45Å; E1723-H1725 VanDerWaalsContact C-N 3.32Å
1724	L	77	Confident	82.4	Confident	83 Å²	83	83.1 Å²	83.1	44%	0.435	42%	0.423	S	S	.	.	H	α-helix	trans	-70.6	-25.4	174.2	-66.8	164.5	0	0	0	113.1	R1720 K1721 A1722 Q1730 I1733	R1720-L1724 HydrophobicContact CG-CD1 4.29Å; R1720-L1724 WeakPolarHBondContact O-CD1 3.46Å; R1720-L1724 WeakPolarHBondContact O-CG 3.16Å; R1720-L1724 PolarHBondContact O-N 3.49Å; R1720-L1724 VanDerWaalsContact O-N 3.09Å; K1721-L1724 PolarHBondContact O-N 3.38Å; K1721-L1724 VanDerWaalsContact O-N 3.14Å; A1722-L1724 PolarHBondContact O-N 3.21Å; L1724-Q1730 WeakPolarHBondContact O-CG 3.26Å; L1724-I1733 HydrophobicContact CB-CD1 4.48Å; L1724-I1733 HydrophobicContact CD2-CD1 3.83Å
1725	H	77.9	Confident	81.9	Confident	135 Å²	135	84.9 Å²	84.9	63%	0.625	43%	0.432	S	S	*	.	H	α-helix	trans	-86.9	-16.7	177.2	-80.5	-71.9	0	0	0	114.1	K1721 A1722 E1723 Q1730	K1721-H1725 PolarHBondContact O-CD2 2.7Å; K1721-H1725 PolarHBondContact O-N 3.16Å; A1722-H1725 PolarHBondContact O-N 3.19Å; A1722-H1725 VanDerWaalsContact O-N 3.17Å; E1723-H1725 VanDerWaalsContact C-N 3.32Å; H1725-Q1730 PolarHBondContact O-NE2 3.17Å
1726	K	79.3	Confident	81.1	Confident	119 Å²	119	88 Å²	88	52%	0.517	45%	0.446	S	S	.	.	S	Bend	trans	-59	147.4	170.8	-74.3	174.8	-176.5	176.6	0	111	A1722 E1728 G1729 Q1730	A1722-K1726 PolarHBondContact O-N 2.94Å; K1726-E1728 VanDerWaalsContact C-N 3.26Å; K1726-E1728 PolarHBondContact O-N 2.74Å; K1726-G1729 PolarHBondContact O-N 2.92Å; K1726-Q1730 PolarHBondContact O-N 2.87Å
1727	A	74.3	Confident	80.9	Confident	77 Å²	77	89.8 Å²	89.8	64%	0.636	45%	0.451	S	S	*	.	H	α-helix	trans	-52.2	-42.6	-179.9	0	0	0	0	0	112.9	G1729 Q1730 V1731	A1727-G1729 PolarHBondContact O-N 3.46Å; A1727-Q1730 PolarHBondContact O-N 3.02Å; A1727-V1731 WeakPolarHBondContact O-CB 3.19Å; A1727-V1731 VanDerWaalsContact O-CG2 3.26Å; A1727-V1731 WeakPolarHBondContact O-CG2 3.49Å; A1727-V1731 PolarHBondContact O-N 3.32Å
1728	E	78.1	Confident	80.8	Confident	160 Å²	160	88.3 Å²	88.3	75%	0.748	45%	0.45	S	S	*	.	H	α-helix	trans	-59.6	-45.7	175.8	-59	176.5	138.8	0	0	112.7	K1726 V1731 E1732	K1726-E1728 VanDerWaalsContact C-N 3.26Å; K1726-E1728 PolarHBondContact O-N 2.74Å; E1728-V1731 PolarHBondContact O-N 2.8Å; E1728-E1732 PolarHBondContact O-N 2.88Å
1729	G	73.5	Confident	80	Confident	16 Å²	16	87.7 Å²	87.7	17%	0.165	44%	0.444	C	S	.	.	H	α-helix	trans	-67	-41.2	177.8	0	0	0	0	0	112.1	K1726 A1727 E1732 I1733	K1726-G1729 PolarHBondContact O-N 2.92Å; A1727-G1729 PolarHBondContact O-N 3.46Å; G1729-E1732 PolarHBondContact O-N 2.97Å; G1729-I1733 WeakPolarHBondContact O-CB 3.28Å; G1729-I1733 WeakPolarHBondContact O-CD1 3.14Å; G1729-I1733 WeakPolarHBondContact O-CG1 3.34Å; G1729-I1733 PolarHBondContact O-N 2.95Å
1730	Q	80.8	Confident	79.5	Confident	105 Å²	105	92 Å²	92	49%	0.491	46%	0.461	S	S	.	.	H	α-helix	trans	-63.1	-41	173.1	-65.7	-164.6	31.8	0	0	111.9	L1724 H1725 K1726 A1727 I1733 L1734	L1724-Q1730 WeakPolarHBondContact O-CG 3.26Å; H1725-Q1730 PolarHBondContact O-NE2 3.17Å; K1726-Q1730 PolarHBondContact O-N 2.87Å; A1727-Q1730 PolarHBondContact O-N 3.02Å; Q1730-I1733 PolarHBondContact O-N 3.04Å; Q1730-L1734 WeakPolarHBondContact O-CB 3.34Å; Q1730-L1734 PolarHBondContact O-N 3.37Å
1731	V	81.4	Confident	79.3	Confident	73 Å²	73	92.1 Å²	92.1	44%	0.442	47%	0.47	S	S	.	.	H	α-helix	trans	-66.6	-39.8	175.4	167	0	0	0	0	111.4	A1727 E1728 L1734 N1735	A1727-V1731 WeakPolarHBondContact O-CB 3.19Å; A1727-V1731 VanDerWaalsContact O-CG2 3.26Å; A1727-V1731 WeakPolarHBondContact O-CG2 3.49Å; A1727-V1731 PolarHBondContact O-N 3.32Å; E1728-V1731 PolarHBondContact O-N 2.8Å; V1731-L1734 PolarHBondContact O-N 3.06Å; V1731-N1735 WeakPolarHBondContact O-CB 3.41Å; V1731-N1735 PolarHBondContact O-N 3.28Å; V1731-N1735 PolarHBondContact O-ND2 2.65Å
1732	E	77.9	Confident	78.8	Confident	106 Å²	106	90.2 Å²	90.2	50%	0.495	46%	0.463	S	S	.	.	H	α-helix	trans	-66.8	-39.8	176.1	-155.5	-144.7	-172.6	0	0	111.8	E1728 G1729 K1736	E1728-E1732 PolarHBondContact O-N 2.88Å; G1729-E1732 PolarHBondContact O-N 2.97Å; E1732-K1736 VanDerWaalsContact CD-CE 3.41Å; E1732-K1736 WeakPolarHBondContact O-CB 3.09Å; E1732-K1736 WeakPolarHBondContact O-CD 3.4Å; E1732-K1736 VanDerWaalsContact O-CG 3.25Å; E1732-K1736 WeakPolarHBondContact O-CG 3Å; E1732-K1736 PolarHBondContact O-N 3.27Å; E1732-K1736 WeakPolarHBondContact OE1-CE 3.41Å; E1732-K1736 IonicContact OE1-NZ 3.48Å; E1732-K1736 PolarHBondContact OE1-NZ 2.91Å; E1732-K1736 IonicContact OE2-NZ 3.59Å; E1732-K1736 PolarHBondContact OE2-NZ 3.3Å
1733	I	83.1	Confident	77.7	Confident	43 Å²	43	91.3 Å²	91.3	22%	0.221	46%	0.459	C	S	.	.	H	α-helix	trans	-66.1	-40.5	172.8	-66.4	162.2	0	0	0	110.9	L1724 G1729 Q1730 K1737	L1724-I1733 HydrophobicContact CB-CD1 4.48Å; L1724-I1733 HydrophobicContact CD2-CD1 3.83Å; G1729-I1733 WeakPolarHBondContact O-CB 3.28Å; G1729-I1733 WeakPolarHBondContact O-CD1 3.14Å; G1729-I1733 WeakPolarHBondContact O-CG1 3.34Å; G1729-I1733 PolarHBondContact O-N 2.95Å; Q1730-I1733 PolarHBondContact O-N 3.04Å; I1733-K1737 HydrophobicContact CG2-CD 4.07Å; I1733-K1737 WeakPolarHBondContact O-CB 3.13Å; I1733-K1737 VanDerWaalsContact O-CG 3.28Å; I1733-K1737 WeakPolarHBondContact O-CG 3.21Å; I1733-K1737 PolarHBondContact O-N 3.37Å
1734	L	84	Confident	77.6	Confident	94 Å²	94	93.5 Å²	93.5	49%	0.492	46%	0.462	S	S	.	.	H	α-helix	trans	-65.1	-45.8	177.6	179.4	60.9	0	0	0	110.6	Q1730 V1731 K1737 I1738	Q1730-L1734 WeakPolarHBondContact O-CB 3.34Å; Q1730-L1734 PolarHBondContact O-N 3.37Å; V1731-L1734 PolarHBondContact O-N 3.06Å; L1734-K1737 CarbonylContact O-C 3.1Å; L1734-K1737 WeakPolarHBondContact O-CB 3.26Å; L1734-K1737 PolarHBondContact O-N 2.68Å; L1734-K1737 VanDerWaalsContact O-N 3.16Å; L1734-I1738 HydrophobicContact CD1-CD1 4.06Å; L1734-I1738 HydrophobicContact CD1-CG1 4.28Å; L1734-I1738 HydrophobicContact CG-CD1 3.81Å; L1734-I1738 HydrophobicContact CG-CG1 4.44Å; L1734-I1738 WeakPolarHBondContact O-CB 3.21Å; L1734-I1738 VanDerWaalsContact O-CG1 3.28Å; L1734-I1738 WeakPolarHBondContact O-CG1 3.29Å; L1734-I1738 PolarHBondContact O-N 3.21Å
1735	N	81.8	Confident	77.5	Confident	82 Å²	82	94.1 Å²	94.1	44%	0.439	46%	0.464	S	S	.	.	H	α-helix	trans	-61.1	-47.9	175.4	-71	-14.3	0	0	0	110.9	V1731 K1737 I1738 D1739	V1731-N1735 WeakPolarHBondContact O-CB 3.41Å; V1731-N1735 PolarHBondContact O-N 3.28Å; V1731-N1735 PolarHBondContact O-ND2 2.65Å; N1735-K1737 VanDerWaalsContact C-N 3.26Å; N1735-K1737 PolarHBondContact O-N 3.02Å; N1735-I1738 CarbonylContact O-C 3.5Å; N1735-I1738 WeakPolarHBondContact O-CA 3.24Å; N1735-I1738 PolarHBondContact O-N 3.37Å; N1735-D1739 PolarHBondContact O-N 2.98Å
1736	K	74.9	Confident	77	Confident	99 Å²	99	90.3 Å²	90.3	43%	0.43	45%	0.449	S	S	.	.	H	α-helix	trans	-58.9	-35.2	173.9	-73.1	166.8	-177.2	170.9	0	112.9	E1732 Q1740	E1732-K1736 VanDerWaalsContact CD-CE 3.41Å; E1732-K1736 WeakPolarHBondContact O-CB 3.09Å; E1732-K1736 WeakPolarHBondContact O-CD 3.4Å; E1732-K1736 VanDerWaalsContact O-CG 3.25Å; E1732-K1736 WeakPolarHBondContact O-CG 3Å; E1732-K1736 PolarHBondContact O-N 3.27Å; E1732-K1736 WeakPolarHBondContact OE1-CE 3.41Å; E1732-K1736 IonicContact OE1-NZ 3.48Å; E1732-K1736 PolarHBondContact OE1-NZ 2.91Å; E1732-K1736 IonicContact OE2-NZ 3.59Å; E1732-K1736 PolarHBondContact OE2-NZ 3.3Å; K1736-Q1740 VanDerWaalsContact O-CG 3.24Å; K1736-Q1740 WeakPolarHBondContact O-CG 3.21Å; K1736-Q1740 PolarHBondContact O-N 2.97Å
1737	K	84.7	Confident	76.3	Confident	71 Å²	71	86.6 Å²	86.6	31%	0.309	43%	0.433	S	S	.	.	H	α-helix	trans	-72.9	-37.4	173.1	-76.4	173.5	-179.9	177	0	112.1	I1733 L1734 N1735 Q1740 L1741	I1733-K1737 HydrophobicContact CG2-CD 4.07Å; I1733-K1737 WeakPolarHBondContact O-CB 3.13Å; I1733-K1737 VanDerWaalsContact O-CG 3.28Å; I1733-K1737 WeakPolarHBondContact O-CG 3.21Å; I1733-K1737 PolarHBondContact O-N 3.37Å; L1734-K1737 CarbonylContact O-C 3.1Å; L1734-K1737 WeakPolarHBondContact O-CB 3.26Å; L1734-K1737 PolarHBondContact O-N 2.68Å; L1734-K1737 VanDerWaalsContact O-N 3.16Å; N1735-K1737 VanDerWaalsContact C-N 3.26Å; N1735-K1737 PolarHBondContact O-N 3.02Å; K1737-Q1740 PolarHBondContact O-N 2.94Å; K1737-L1741 VanDerWaalsContact O-CB 3.29Å; K1737-L1741 WeakPolarHBondContact O-CB 3.43Å; K1737-L1741 WeakPolarHBondContact O-CG 3.27Å; K1737-L1741 PolarHBondContact O-N 2.87Å
1738	I	86.3	Confident	76.4	Confident	67 Å²	67	86.9 Å²	86.9	34%	0.344	42%	0.423	S	S	.	.	H	α-helix	trans	-65.4	-44.5	175.1	-73.9	167.2	0	0	0	110	L1734 N1735 Q1740 L1741 Q1742	L1734-I1738 HydrophobicContact CD1-CD1 4.06Å; L1734-I1738 HydrophobicContact CD1-CG1 4.28Å; L1734-I1738 HydrophobicContact CG-CD1 3.81Å; L1734-I1738 HydrophobicContact CG-CG1 4.44Å; L1734-I1738 WeakPolarHBondContact O-CB 3.21Å; L1734-I1738 VanDerWaalsContact O-CG1 3.28Å; L1734-I1738 WeakPolarHBondContact O-CG1 3.29Å; L1734-I1738 PolarHBondContact O-N 3.21Å; N1735-I1738 CarbonylContact O-C 3.5Å; N1735-I1738 WeakPolarHBondContact O-CA 3.24Å; N1735-I1738 PolarHBondContact O-N 3.37Å; I1738-Q1740 VanDerWaalsContact C-N 3.34Å; I1738-Q1740 PolarHBondContact O-N 3.18Å; I1738-L1741 PolarHBondContact O-N 3.45Å; I1738-Q1742 WeakPolarHBondContact O-CB 3.35Å; I1738-Q1742 PolarHBondContact O-N 2.91Å
1739	D	70.6	Confident	76.2	Confident	73 Å²	73	83.2 Å²	83.2	39%	0.39	41%	0.406	S	S	.	.	H	α-helix	trans	-58.1	-45.8	173.8	-71	-32	0	0	0	111.4	N1735 F1743	N1735-D1739 PolarHBondContact O-N 2.98Å; D1739-F1743 VanDerWaalsContact O-CB 3.24Å; D1739-F1743 WeakPolarHBondContact O-CB 3.35Å; D1739-F1743 PolarHBondContact O-N 2.91Å
1740	Q	75.1	Confident	75.7	Confident	128 Å²	128	85.5 Å²	85.5	60%	0.598	42%	0.416	S	S	*	.	H	α-helix	trans	-65.9	-39.5	176	-73	173.7	18.5	0	0	112.8	K1736 K1737 I1738 R1744	K1736-Q1740 VanDerWaalsContact O-CG 3.24Å; K1736-Q1740 WeakPolarHBondContact O-CG 3.21Å; K1736-Q1740 PolarHBondContact O-N 2.97Å; K1737-Q1740 PolarHBondContact O-N 2.94Å; I1738-Q1740 VanDerWaalsContact C-N 3.34Å; I1738-Q1740 PolarHBondContact O-N 3.18Å; Q1740-R1744 WeakPolarHBondContact O-CB 3.1Å; Q1740-R1744 WeakPolarHBondContact O-CG 3.21Å; Q1740-R1744 PolarHBondContact O-N 3.3Å
1741	L	79.5	Confident	75.3	Confident	119 Å²	119	86.4 Å²	86.4	62%	0.623	42%	0.415	S	S	*	.	H	α-helix	trans	-70	-42.3	177.1	-76.9	168.9	0	0	0	111.5	K1737 I1738 F1743 R1744 M1745	K1737-L1741 VanDerWaalsContact O-CB 3.29Å; K1737-L1741 WeakPolarHBondContact O-CB 3.43Å; K1737-L1741 WeakPolarHBondContact O-CG 3.27Å; K1737-L1741 PolarHBondContact O-N 2.87Å; I1738-L1741 PolarHBondContact O-N 3.45Å; L1741-F1743 VanDerWaalsContact C-N 3.35Å; L1741-R1744 PolarHBondContact O-N 3.27Å; L1741-M1745 WeakPolarHBondContact O-CB 3.49Å; L1741-M1745 PolarHBondContact O-N 2.59Å
1742	Q	74.2	Confident	75.1	Confident	90 Å²	90	87.2 Å²	87.2	42%	0.421	41%	0.414	S	S	.	.	H	α-helix	trans	-60.4	-46.4	172.9	178.9	172.7	-44.1	0	0	109.8	I1738 M1745 D1746	I1738-Q1742 WeakPolarHBondContact O-CB 3.35Å; I1738-Q1742 PolarHBondContact O-N 2.91Å; Q1742-M1745 WeakPolarHBondContact O-CB 3.26Å; Q1742-M1745 PolarHBondContact O-N 2.99Å; Q1742-D1746 WeakPolarHBondContact O-CB 3.45Å; Q1742-D1746 PolarHBondContact O-N 3.21Å
1743	F	62.3	Low	74.7	Confident	75 Å²	75	89.3 Å²	89.3	33%	0.329	42%	0.417	S	S	.	.	H	α-helix	trans	-59.3	-49.8	175.9	177.4	-93.2	0	0	0	112.4	D429 D1739 L1741 M1745 D1746 E1747	D429-F1743 HydrophobicContact CB-CE2 3.71Å; D429-F1743 HydrophobicContact CB-CZ 3.8Å; D429-F1743 VanDerWaalsContact OD1-CZ 3.28Å; D429-F1743 WeakPolarHBondContact OD1-CZ 3.34Å; D429-F1743 VanDerWaalsContact OD2-CZ 3.23Å; D429-F1743 WeakPolarHBondContact OD2-CZ 2.9Å; D1739-F1743 VanDerWaalsContact O-CB 3.24Å; D1739-F1743 WeakPolarHBondContact O-CB 3.35Å; D1739-F1743 PolarHBondContact O-N 2.91Å; L1741-F1743 VanDerWaalsContact C-N 3.35Å; F1743-M1745 VanDerWaalsContact C-N 3.35Å; F1743-M1745 PolarHBondContact O-N 3.15Å; F1743-D1746 CarbonylContact O-C 3.57Å; F1743-D1746 WeakPolarHBondContact O-CA 3.45Å; F1743-D1746 VanDerWaalsContact O-CB 3.24Å; F1743-D1746 WeakPolarHBondContact O-CB 3.27Å; F1743-D1746 PolarHBondContact O-N 3.19Å; F1743-D1746 VanDerWaalsContact O-N 3.11Å; F1743-E1747 HydrophobicContact CE1-CB 4.43Å; F1743-E1747 PolarHBondContact O-N 3.14Å
1744	R	73.7	Confident	74	Confident	148 Å²	148	93.7 Å²	93.7	56%	0.558	44%	0.437	S	S	*	.	H	α-helix	trans	-68.5	-32.6	178.9	-68.3	-174.3	76.2	175.7	0.9	112.6	Q1740 L1741 D1746 E1747 I1748	Q1740-R1744 WeakPolarHBondContact O-CB 3.1Å; Q1740-R1744 WeakPolarHBondContact O-CG 3.21Å; Q1740-R1744 PolarHBondContact O-N 3.3Å; L1741-R1744 PolarHBondContact O-N 3.27Å; R1744-D1746 VanDerWaalsContact C-N 3.3Å; R1744-E1747 WeakPolarHBondContact O-CB 3.37Å; R1744-E1747 PolarHBondContact O-N 3.23Å; R1744-I1748 WeakPolarHBondContact O-CB 3.22Å; R1744-I1748 WeakPolarHBondContact O-CD1 3.49Å; R1744-I1748 VanDerWaalsContact O-CG1 3.23Å; R1744-I1748 WeakPolarHBondContact O-CG1 3.21Å; R1744-I1748 PolarHBondContact O-N 2.82Å
1745	M	74.7	Confident	73.5	Confident	97 Å²	97	94.5 Å²	94.5	48%	0.478	44%	0.441	S	S	.	.	H	α-helix	trans	-61.4	-42	169.6	-176.8	62.6	72.5	0	0	110.5	L1741 Q1742 F1743 I1748 H1749	L1741-M1745 WeakPolarHBondContact O-CB 3.49Å; L1741-M1745 PolarHBondContact O-N 2.59Å; Q1742-M1745 WeakPolarHBondContact O-CB 3.26Å; Q1742-M1745 PolarHBondContact O-N 2.99Å; F1743-M1745 VanDerWaalsContact C-N 3.35Å; F1743-M1745 PolarHBondContact O-N 3.15Å; M1745-I1748 PolarHBondContact O-N 3.4Å; M1745-H1749 PolarHBondContact O-N 3.19Å; M1745-H1749 PolarHBondContact O-ND1 3.37Å
1746	D	66.7	Low	73.3	Confident	55 Å²	55	98.1 Å²	98.1	29%	0.294	45%	0.448	S	S	.	.	H	α-helix	trans	-66.5	-40.1	176.6	-122.6	-33	0	0	0	112.8	K186 Q1742 F1743 R1744 H1749 V1750	K186-D1746 WeakPolarHBondContact CE-OD2 3.42Å; K186-D1746 IonicContact NZ-OD1 3.46Å; K186-D1746 PolarHBondContact NZ-OD1 3.48Å; K186-D1746 IonicContact NZ-OD2 3.51Å; K186-D1746 PolarHBondContact NZ-OD2 2.84Å; Q1742-D1746 WeakPolarHBondContact O-CB 3.45Å; Q1742-D1746 PolarHBondContact O-N 3.21Å; F1743-D1746 CarbonylContact O-C 3.57Å; F1743-D1746 WeakPolarHBondContact O-CA 3.45Å; F1743-D1746 VanDerWaalsContact O-CB 3.24Å; F1743-D1746 WeakPolarHBondContact O-CB 3.27Å; F1743-D1746 PolarHBondContact O-N 3.19Å; F1743-D1746 VanDerWaalsContact O-N 3.11Å; R1744-D1746 VanDerWaalsContact C-N 3.3Å; D1746-H1749 PolarHBondContact O-N 2.92Å; D1746-V1750 WeakPolarHBondContact O-CG2 3.41Å; D1746-V1750 PolarHBondContact O-N 3.43Å
1747	E	65.3	Low	73.2	Confident	40 Å²	40	95.4 Å²	95.4	19%	0.187	45%	0.449	C	S	.	.	H	α-helix	trans	-60.3	-46.1	172.5	-169.2	-160.7	-170.2	0	0	110.8	F1743 R1744 V1750 R1751	F1743-E1747 HydrophobicContact CE1-CB 4.43Å; F1743-E1747 PolarHBondContact O-N 3.14Å; R1744-E1747 WeakPolarHBondContact O-CB 3.37Å; R1744-E1747 PolarHBondContact O-N 3.23Å; E1747-V1750 PolarHBondContact O-N 2.92Å; E1747-R1751 PolarHBondContact O-N 3.32Å; E1747-R1751 IonicContact OE1-CZ 3.75Å; E1747-R1751 IonicContact OE1-NH1 3.47Å; E1747-R1751 PolarHBondContact OE1-NH1 3.37Å; E1747-R1751 IonicContact OE1-NH2 2.7Å; E1747-R1751 PolarHBondContact OE1-NH2 3.16Å; E1747-R1751 IonicContact OE2-NH1 3.97Å; E1747-R1751 PolarHBondContact OE2-NH1 3.28Å
1748	I	75.4	Confident	72.7	Confident	83 Å²	83	96.2 Å²	96.2	43%	0.426	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-41.2	173.1	-70	164.5	0	0	0	111	R1744 M1745 V1750 R1751 Q1752	R1744-I1748 WeakPolarHBondContact O-CB 3.22Å; R1744-I1748 WeakPolarHBondContact O-CD1 3.49Å; R1744-I1748 VanDerWaalsContact O-CG1 3.23Å; R1744-I1748 WeakPolarHBondContact O-CG1 3.21Å; R1744-I1748 PolarHBondContact O-N 2.82Å; M1745-I1748 PolarHBondContact O-N 3.4Å; I1748-V1750 VanDerWaalsContact C-N 3.33Å; I1748-V1750 PolarHBondContact O-N 3.14Å; I1748-R1751 PolarHBondContact O-N 2.86Å; I1748-Q1752 WeakPolarHBondContact O-CB 3.35Å; I1748-Q1752 PolarHBondContact O-N 2.89Å
1749	H	74.5	Confident	72.1	Confident	84 Å²	84	96.7 Å²	96.7	39%	0.389	46%	0.462	S	S	.	.	H	α-helix	trans	-63.9	-35.6	175.3	-82.9	83.4	0	0	0	112.6	M1745 D1746 R1753	M1745-H1749 PolarHBondContact O-N 3.19Å; M1745-H1749 PolarHBondContact O-ND1 3.37Å; D1746-H1749 PolarHBondContact O-N 2.92Å; H1749-R1753 VanDerWaalsContact O-CB 3.27Å; H1749-R1753 WeakPolarHBondContact O-CB 3.29Å; H1749-R1753 PolarHBondContact O-N 3.03Å
1750	V	63.6	Low	72.3	Confident	63 Å²	63	99.4 Å²	99.4	38%	0.382	47%	0.471	S	S	.	.	H	α-helix	trans	-66.8	-47.5	172.7	171.3	0	0	0	0	110.7	D1746 E1747 I1748 R1753 H1754	D1746-V1750 WeakPolarHBondContact O-CG2 3.41Å; D1746-V1750 PolarHBondContact O-N 3.43Å; E1747-V1750 PolarHBondContact O-N 2.92Å; I1748-V1750 VanDerWaalsContact C-N 3.33Å; I1748-V1750 PolarHBondContact O-N 3.14Å; V1750-R1753 PolarHBondContact O-N 3.46Å; V1750-H1754 PolarHBondContact O-N 2.97Å
1751	R	71.5	Confident	72.2	Confident	125 Å²	125	97.2 Å²	97.2	47%	0.472	46%	0.464	S	S	.	.	H	α-helix	trans	-62.5	-42.6	176.5	-71.4	-174.6	-179.9	119.3	15.9	112.6	E1747 I1748 R1753 H1754 L1755	E1747-R1751 PolarHBondContact O-N 3.32Å; E1747-R1751 IonicContact OE1-CZ 3.75Å; E1747-R1751 IonicContact OE1-NH1 3.47Å; E1747-R1751 PolarHBondContact OE1-NH1 3.37Å; E1747-R1751 IonicContact OE1-NH2 2.7Å; E1747-R1751 PolarHBondContact OE1-NH2 3.16Å; E1747-R1751 IonicContact OE2-NH1 3.97Å; E1747-R1751 PolarHBondContact OE2-NH1 3.28Å; I1748-R1751 PolarHBondContact O-N 2.86Å; R1751-R1753 PolarHBondContact O-N 3.39Å; R1751-H1754 PolarHBondContact O-N 3.38Å; R1751-L1755 WeakPolarHBondContact O-CB 3.37Å; R1751-L1755 WeakPolarHBondContact O-CG 3.31Å; R1751-L1755 PolarHBondContact O-N 3.38Å
1752	Q	76.6	Confident	71.9	Confident	90 Å²	90	95.7 Å²	95.7	42%	0.421	46%	0.459	S	S	.	.	H	α-helix	trans	-65.5	-38.1	176.4	-161.1	-163.6	50	0	0	111.2	I1748 H1754 L1755 R1756	I1748-Q1752 WeakPolarHBondContact O-CB 3.35Å; I1748-Q1752 PolarHBondContact O-N 2.89Å; Q1752-H1754 VanDerWaalsContact C-N 3.34Å; Q1752-L1755 PolarHBondContact O-N 3.2Å; Q1752-R1756 WeakPolarHBondContact O-CB 3.07Å; Q1752-R1756 WeakPolarHBondContact O-CG 3.34Å; Q1752-R1756 PolarHBondContact O-N 3.5Å
1753	R	69.5	Low	71.9	Confident	150 Å²	150	96 Å²	96	57%	0.566	46%	0.46	S	S	*	.	H	α-helix	trans	-65	-38.4	173.8	-169.2	-177.7	-64.5	102	-2.3	111.7	H1749 V1750 R1751 G1757	H1749-R1753 VanDerWaalsContact O-CB 3.27Å; H1749-R1753 WeakPolarHBondContact O-CB 3.29Å; H1749-R1753 PolarHBondContact O-N 3.03Å; V1750-R1753 PolarHBondContact O-N 3.46Å; R1751-R1753 PolarHBondContact O-N 3.39Å; R1753-G1757 PolarHBondContact O-N 2.92Å
1754	H	69.1	Low	72.4	Confident	135 Å²	135	98.2 Å²	98.2	63%	0.625	47%	0.472	S	S	*	.	H	α-helix	trans	-68.1	-43.1	175.6	-150.6	91.1	0	0	0	111.8	V1750 R1751 Q1752 G1757 L1758	V1750-H1754 PolarHBondContact O-N 2.97Å; R1751-H1754 PolarHBondContact O-N 3.38Å; Q1752-H1754 VanDerWaalsContact C-N 3.34Å; H1754-G1757 PolarHBondContact O-N 3.15Å; H1754-L1758 WeakPolarHBondContact O-CG 3.42Å; H1754-L1758 PolarHBondContact O-N 3.46Å
1755	L	73.9	Confident	72.2	Confident	110 Å²	110	97 Å²	97	58%	0.576	47%	0.472	S	S	*	.	H	α-helix	trans	-63.1	-43.2	173.3	-77.5	166.9	0	0	0	112.3	R1751 Q1752 G1757 L1758 V1759	R1751-L1755 WeakPolarHBondContact O-CB 3.37Å; R1751-L1755 WeakPolarHBondContact O-CG 3.31Å; R1751-L1755 PolarHBondContact O-N 3.38Å; Q1752-L1755 PolarHBondContact O-N 3.2Å; L1755-G1757 VanDerWaalsContact C-N 3.31Å; L1755-G1757 PolarHBondContact O-N 3.04Å; L1755-L1758 PolarHBondContact O-N 3.25Å; L1755-V1759 WeakPolarHBondContact O-CG2 3.27Å; L1755-V1759 PolarHBondContact O-N 3.42Å
1756	R	76.9	Confident	71.9	Confident	159 Å²	159	97.1 Å²	97.1	60%	0.6	47%	0.474	S	S	*	.	H	α-helix	trans	-61.5	-39.4	172	-73.8	-171.9	-156.9	-150.9	10.2	111.4	Q1752 L1758 V1759 H1760	Q1752-R1756 WeakPolarHBondContact O-CB 3.07Å; Q1752-R1756 WeakPolarHBondContact O-CG 3.34Å; Q1752-R1756 PolarHBondContact O-N 3.5Å; R1756-L1758 VanDerWaalsContact C-N 3.35Å; R1756-L1758 PolarHBondContact O-N 3.03Å; R1756-V1759 PolarHBondContact O-N 3.12Å; R1756-H1760 VanDerWaalsContact O-CB 3.3Å; R1756-H1760 WeakPolarHBondContact O-CB 3.31Å; R1756-H1760 PolarHBondContact O-N 3.25Å
1757	G	72.3	Confident	72.1	Confident	42 Å²	42	98.2 Å²	98.2	43%	0.433	48%	0.483	S	S	.	.	H	α-helix	trans	-61.3	-40.8	173.7	0	0	0	0	0	113	R1753 H1754 L1755 L1761	R1753-G1757 PolarHBondContact O-N 2.92Å; H1754-G1757 PolarHBondContact O-N 3.15Å; L1755-G1757 VanDerWaalsContact C-N 3.31Å; L1755-G1757 PolarHBondContact O-N 3.04Å; G1757-L1761 VanDerWaalsContact O-CB 3.31Å; G1757-L1761 WeakPolarHBondContact O-CB 3.38Å; G1757-L1761 PolarHBondContact O-N 2.86Å
1758	L	74.9	Confident	72	Confident	88 Å²	88	99.3 Å²	99.3	46%	0.461	49%	0.494	S	S	.	.	H	α-helix	trans	-68.4	-40.2	174.3	-70.5	169.6	0	0	0	112.4	H1754 L1755 R1756 L1761 V1762	H1754-L1758 WeakPolarHBondContact O-CG 3.42Å; H1754-L1758 PolarHBondContact O-N 3.46Å; L1755-L1758 PolarHBondContact O-N 3.25Å; R1756-L1758 VanDerWaalsContact C-N 3.35Å; R1756-L1758 PolarHBondContact O-N 3.03Å; L1758-L1761 PolarHBondContact O-N 3.4Å; L1758-V1762 WeakPolarHBondContact O-CB 3.19Å; L1758-V1762 VanDerWaalsContact O-CG2 3.31Å; L1758-V1762 WeakPolarHBondContact O-CG2 3.35Å; L1758-V1762 PolarHBondContact O-N 3.21Å
1759	V	74.5	Confident	71	Confident	77 Å²	77	100.8 Å²	100.8	47%	0.467	50%	0.501	S	S	.	.	H	α-helix	trans	-62.7	-47.1	173.3	169.7	0	0	0	0	110.4	L1755 R1756 L1761 V1762 E1763	L1755-V1759 WeakPolarHBondContact O-CG2 3.27Å; L1755-V1759 PolarHBondContact O-N 3.42Å; R1756-V1759 PolarHBondContact O-N 3.12Å; V1759-L1761 VanDerWaalsContact C-N 3.28Å; V1759-L1761 PolarHBondContact O-N 3.01Å; V1759-V1762 CarbonylContact O-C 3.44Å; V1759-V1762 WeakPolarHBondContact O-CA 3.45Å; V1759-V1762 WeakPolarHBondContact O-CB 3.37Å; V1759-V1762 PolarHBondContact O-N 3.03Å; V1759-E1763 HydrophobicContact CG1-CG 4.3Å; V1759-E1763 WeakPolarHBondContact O-CG 3.12Å; V1759-E1763 PolarHBondContact O-N 3.29Å
1760	H	74.2	Confident	70.3	Confident	129 Å²	129	101 Å²	101	60%	0.597	50%	0.502	S	S	*	.	H	α-helix	trans	-65.4	-31.5	-179.7	-144.5	-38	0	0	0	112.4	R1756 E1764	R1756-H1760 VanDerWaalsContact O-CB 3.3Å; R1756-H1760 WeakPolarHBondContact O-CB 3.31Å; R1756-H1760 PolarHBondContact O-N 3.25Å; H1760-E1764 VanDerWaalsContact O-CB 3.31Å; H1760-E1764 WeakPolarHBondContact O-CB 3.07Å; H1760-E1764 PolarHBondContact O-N 3.09Å
1761	L	71.9	Confident	69.9	Low	83 Å²	83	103.4 Å²	103.4	44%	0.435	51%	0.512	S	S	.	.	H	α-helix	trans	-71.5	-36.7	171.5	-174.7	71.5	0	0	0	111.9	G1757 L1758 V1759 H1765	G1757-L1761 VanDerWaalsContact O-CB 3.31Å; G1757-L1761 WeakPolarHBondContact O-CB 3.38Å; G1757-L1761 PolarHBondContact O-N 2.86Å; L1758-L1761 PolarHBondContact O-N 3.4Å; V1759-L1761 VanDerWaalsContact C-N 3.28Å; V1759-L1761 PolarHBondContact O-N 3.01Å; L1761-H1765 WeakPolarHBondContact O-CB 2.91Å; L1761-H1765 PolarHBondContact O-CD2 3.3Å; L1761-H1765 PolarHBondContact O-N 3.05Å
1762	V	74.8	Confident	69	Low	86 Å²	86	102.8 Å²	102.8	52%	0.521	52%	0.518	S	S	.	.	H	α-helix	trans	-69.6	-37.8	173.1	167.4	0	0	0	0	111	L1758 V1759 H1765 L1766	L1758-V1762 WeakPolarHBondContact O-CB 3.19Å; L1758-V1762 VanDerWaalsContact O-CG2 3.31Å; L1758-V1762 WeakPolarHBondContact O-CG2 3.35Å; L1758-V1762 PolarHBondContact O-N 3.21Å; V1759-V1762 CarbonylContact O-C 3.44Å; V1759-V1762 WeakPolarHBondContact O-CA 3.45Å; V1759-V1762 WeakPolarHBondContact O-CB 3.37Å; V1759-V1762 PolarHBondContact O-N 3.03Å; V1762-H1765 PolarHBondContact O-N 3.16Å; V1762-L1766 HydrophobicContact CG1-CD1 3.94Å; V1762-L1766 HydrophobicContact CG1-CG 4.45Å; V1762-L1766 VanDerWaalsContact O-CB 3.3Å; V1762-L1766 WeakPolarHBondContact O-CB 3.31Å; V1762-L1766 VanDerWaalsContact O-CG 3.27Å; V1762-L1766 WeakPolarHBondContact O-CG 3.31Å; V1762-L1766 PolarHBondContact O-N 3.34Å
1763	E	73.1	Confident	67.3	Low	97 Å²	97	104.5 Å²	104.5	45%	0.453	53%	0.53	S	S	.	.	H	α-helix	trans	-64.9	-45.1	171.6	-72.2	169.9	165.6	0	0	111.1	V1759 H1765 L1766 V1767	V1759-E1763 HydrophobicContact CG1-CG 4.3Å; V1759-E1763 WeakPolarHBondContact O-CG 3.12Å; V1759-E1763 PolarHBondContact O-N 3.29Å; E1763-H1765 VanDerWaalsContact C-N 3.34Å; E1763-H1765 PolarHBondContact O-N 3.47Å; E1763-L1766 PolarHBondContact O-N 3.28Å; E1763-V1767 WeakPolarHBondContact O-CB 3.12Å; E1763-V1767 WeakPolarHBondContact O-CG2 3.4Å; E1763-V1767 PolarHBondContact O-N 3.01Å
1764	E	72.6	Confident	66.2	Low	121 Å²	121	104.6 Å²	104.6	57%	0.565	54%	0.537	S	S	*	.	H	α-helix	trans	-61.5	-40.6	174.5	-174.3	175.7	-162.8	0	0	111.7	H1760 C1768	H1760-E1764 VanDerWaalsContact O-CB 3.31Å; H1760-E1764 WeakPolarHBondContact O-CB 3.07Å; H1760-E1764 PolarHBondContact O-N 3.09Å; E1764-C1768 VanDerWaalsContact O-CB 3.32Å; E1764-C1768 WeakPolarHBondContact O-CB 3.25Å; E1764-C1768 PolarHBondContact O-N 2.86Å; E1764-C1768 PolarHBondContact O-SG 2.88Å
1765	H	70.7	Confident	65.2	Low	122 Å²	122	103.8 Å²	103.8	57%	0.565	54%	0.541	S	S	*	.	H	α-helix	trans	-68.1	-36.1	172.7	-95.1	-88.4	0	0	0	113.4	L1761 V1762 E1763 M1769	L1761-H1765 WeakPolarHBondContact O-CB 2.91Å; L1761-H1765 PolarHBondContact O-CD2 3.3Å; L1761-H1765 PolarHBondContact O-N 3.05Å; V1762-H1765 PolarHBondContact O-N 3.16Å; E1763-H1765 VanDerWaalsContact C-N 3.34Å; E1763-H1765 PolarHBondContact O-N 3.47Å; H1765-M1769 WeakPolarHBondContact O-CB 3.49Å; H1765-M1769 WeakPolarHBondContact O-CG 3.45Å; H1765-M1769 PolarHBondContact O-N 3.48Å
1766	L	66.9	Low	63.5	Low	100 Å²	100	102.5 Å²	102.5	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-69	-45.7	176.2	-82.4	166.9	0	0	0	111.3	V1762 E1763 C1768 M1769 E1770	V1762-L1766 HydrophobicContact CG1-CD1 3.94Å; V1762-L1766 HydrophobicContact CG1-CG 4.45Å; V1762-L1766 VanDerWaalsContact O-CB 3.3Å; V1762-L1766 WeakPolarHBondContact O-CB 3.31Å; V1762-L1766 VanDerWaalsContact O-CG 3.27Å; V1762-L1766 WeakPolarHBondContact O-CG 3.31Å; V1762-L1766 PolarHBondContact O-N 3.34Å; E1763-L1766 PolarHBondContact O-N 3.28Å; L1766-C1768 VanDerWaalsContact C-N 3.33Å; L1766-C1768 PolarHBondContact O-N 2.68Å; L1766-M1769 CarbonylContact O-C 3.52Å; L1766-M1769 WeakPolarHBondContact O-CA 3.41Å; L1766-M1769 WeakPolarHBondContact O-CB 3.48Å; L1766-M1769 PolarHBondContact O-N 2.73Å; L1766-E1770 WeakPolarHBondContact O-CB 3.24Å; L1766-E1770 PolarHBondContact O-N 3.27Å
1767	V	71.8	Confident	61.5	Low	78 Å²	78	98.6 Å²	98.6	47%	0.473	56%	0.555	S	S	.	*	H	α-helix	trans	-60.2	-44.4	173.4	171.2	0	0	0	0	110.3	E1763 M1769 E1770 D1771	E1763-V1767 WeakPolarHBondContact O-CB 3.12Å; E1763-V1767 WeakPolarHBondContact O-CG2 3.4Å; E1763-V1767 PolarHBondContact O-N 3.01Å; V1767-M1769 VanDerWaalsContact C-N 3.26Å; V1767-M1769 PolarHBondContact O-N 2.84Å; V1767-E1770 PolarHBondContact O-N 3.3Å; V1767-D1771 WeakPolarHBondContact O-CB 2.9Å; V1767-D1771 PolarHBondContact O-N 2.91Å
1768	C	64.2	Low	60	Low	63 Å²	63	103.7 Å²	103.7	43%	0.426	58%	0.578	S	S	.	*	H	α-helix	trans	-61	-32	172.3	-73.1	0	0	0	0	112.9	E1764 L1766 N1772	E1764-C1768 VanDerWaalsContact O-CB 3.32Å; E1764-C1768 WeakPolarHBondContact O-CB 3.25Å; E1764-C1768 PolarHBondContact O-N 2.86Å; E1764-C1768 PolarHBondContact O-SG 2.88Å; L1766-C1768 VanDerWaalsContact C-N 3.33Å; L1766-C1768 PolarHBondContact O-N 2.68Å; C1768-N1772 WeakPolarHBondContact O-CB 3.21Å; C1768-N1772 PolarHBondContact O-N 3.43Å; C1768-N1772 PolarHBondContact O-ND2 3.06Å
1769	M	53.6	Low	57.9	Low	115 Å²	115	107.2 Å²	107.2	57%	0.567	60%	0.596	S	S	*	*	H	α-helix	trans	-75.9	-35.5	174.4	-79.3	179.9	57.6	0	0	112.5	H1765 L1766 V1767 N1772 L1773	H1765-M1769 WeakPolarHBondContact O-CB 3.49Å; H1765-M1769 WeakPolarHBondContact O-CG 3.45Å; H1765-M1769 PolarHBondContact O-N 3.48Å; L1766-M1769 CarbonylContact O-C 3.52Å; L1766-M1769 WeakPolarHBondContact O-CA 3.41Å; L1766-M1769 WeakPolarHBondContact O-CB 3.48Å; L1766-M1769 PolarHBondContact O-N 2.73Å; V1767-M1769 VanDerWaalsContact C-N 3.26Å; V1767-M1769 PolarHBondContact O-N 2.84Å; M1769-N1772 PolarHBondContact O-N 3.28Å; M1769-L1773 WeakPolarHBondContact O-CB 3.25Å; M1769-L1773 WeakPolarHBondContact O-CD1 3.46Å; M1769-L1773 PolarHBondContact O-N 2.73Å
1770	E	58.9	Low	56.2	Low	89 Å²	89	109.1 Å²	109.1	42%	0.416	61%	0.612	S	S	.	*	H	α-helix	trans	-69	-46.4	178.9	-163.4	161.5	-145.5	0	0	111	L1766 V1767 N1772 L1773 H1774	L1766-E1770 WeakPolarHBondContact O-CB 3.24Å; L1766-E1770 PolarHBondContact O-N 3.27Å; V1767-E1770 PolarHBondContact O-N 3.3Å; E1770-N1772 VanDerWaalsContact C-N 3.26Å; E1770-N1772 PolarHBondContact O-N 2.89Å; E1770-L1773 PolarHBondContact O-N 3.37Å; E1770-L1773 VanDerWaalsContact O-N 3.16Å; E1770-H1774 PolarHBondContact O-CD2 3.11Å; E1770-H1774 VanDerWaalsContact O-CD2 3.31Å; E1770-H1774 PolarHBondContact O-N 3.01Å; E1770-H1774 VanDerWaalsContact O-N 3.16Å
1771	D	55.4	Low	54.5	Low	112 Å²	112	108.7 Å²	108.7	60%	0.599	62%	0.621	S	S	*	*	H	α-helix	trans	-55.8	-38.5	170.5	-84.9	-23.5	0	0	0	112.3	V1767	V1767-D1771 WeakPolarHBondContact O-CB 2.9Å; V1767-D1771 PolarHBondContact O-N 2.91Å
1772	N	52.3	Low	52.7	Low	112 Å²	112	110.6 Å²	110.6	60%	0.599	64%	0.641	S	S	*	*	H	α-helix	trans	-76.2	-35.5	177.3	-83.6	-71.2	0	0	0	112.8	C1768 M1769 E1770 H1774 T1775	C1768-N1772 WeakPolarHBondContact O-CB 3.21Å; C1768-N1772 PolarHBondContact O-N 3.43Å; C1768-N1772 PolarHBondContact O-ND2 3.06Å; M1769-N1772 PolarHBondContact O-N 3.28Å; E1770-N1772 VanDerWaalsContact C-N 3.26Å; E1770-N1772 PolarHBondContact O-N 2.89Å; N1772-H1774 VanDerWaalsContact C-N 3.32Å; N1772-H1774 PolarHBondContact O-N 3.25Å; N1772-T1775 PolarHBondContact O-N 3.35Å; N1772-T1775 PolarHBondContact O-OG1 3.11Å
1773	L	41.8	Very low	50.9	Low	127 Å²	127	113 Å²	113	67%	0.665	66%	0.659	S	S	*	*	H	α-helix	trans	-65.5	-34	178.4	-111.7	72.5	0	0	0	112.5	M1769 E1770 T1775 A1776	M1769-L1773 WeakPolarHBondContact O-CB 3.25Å; M1769-L1773 WeakPolarHBondContact O-CD1 3.46Å; M1769-L1773 PolarHBondContact O-N 2.73Å; E1770-L1773 PolarHBondContact O-N 3.37Å; E1770-L1773 VanDerWaalsContact O-N 3.16Å; L1773-T1775 PolarHBondContact O-N 2.94Å; L1773-A1776 PolarHBondContact O-N 3.06Å
1774	H	45.8	Very low	49.3	Very low	152 Å²	152	111.7 Å²	111.7	70%	0.704	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-0.2	178.8	-84.3	-66.2	0	0	0	115.1	E1770 N1772	E1770-H1774 PolarHBondContact O-CD2 3.11Å; E1770-H1774 VanDerWaalsContact O-CD2 3.31Å; E1770-H1774 PolarHBondContact O-N 3.01Å; E1770-H1774 VanDerWaalsContact O-N 3.16Å; N1772-H1774 VanDerWaalsContact C-N 3.32Å; N1772-H1774 PolarHBondContact O-N 3.25Å
1775	T	49.6	Very low	47.6	Very low	117 Å²	117	112.4 Å²	112.4	72%	0.718	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	-4.4	-179.8	63.2	0	0	0	0	116.1	N1772 L1773	N1772-T1775 PolarHBondContact O-N 3.35Å; N1772-T1775 PolarHBondContact O-OG1 3.11Å; L1773-T1775 PolarHBondContact O-N 2.94Å
1776	A	38.1	Very low	45.7	Very low	84 Å²	84	113.6 Å²	113.6	69%	0.694	69%	0.692	S	S	*	*			trans	-156.1	135.4	176	0	0	0	0	0	114.2	L1773	L1773-A1776 PolarHBondContact O-N 3.06Å
1777	G	34.3	Very low	44	Very low	76 Å²	76	116.9 Å²	116.9	78%	0.784	71%	0.705	S	S	*	*			trans	-157.4	129.6	176.4	0	0	0	0	0	115.9
1778	V	39.8	Very low	42	Very low	150 Å²	150	120.3 Å²	120.3	91%	0.909	72%	0.715	S	S	*	*			trans	-150.6	140.8	168.4	-179.5	0	0	0	0	108.2
1779	I	30.9	Very low	40.2	Very low	162 Å²	162	123.2 Å²	123.2	83%	0.831	72%	0.723	S	S	*	*			trans	-138.1	144	-170.5	-59.9	172.7	0	0	0	111.6
1780	S	39	Very low	38.8	Very low	116 Å²	116	126.8 Å²	126.8	81%	0.811	73%	0.731	S	S	*	*			trans	-164.1	149.3	152.7	51.7	0	0	0	0	113.9
1781	P	39.2	Very low	37.3	Very low	120 Å²	120	128.6 Å²	128.6	78%	0.779	74%	0.744	S	S	*	*			trans	-129.3	174.2	-169.5	42.7	-28.3	0	0	0	117.2
1782	S	33.9	Very low	35.9	Very low	123 Å²	123	129.2 Å²	129.2	86%	0.86	75%	0.752	S	S	*	*			trans	-163.8	156.4	166.1	-73.7	0	0	0	0	114.3
1783	P	37.3	Very low	35	Very low	137 Å²	137	132.6 Å²	132.6	89%	0.89	76%	0.764	S	S	*	*			trans	-131.3	172.5	-162.8	42.9	-27.6	0	0	0	118.8
1784	G	39.6	Very low	34.3	Very low	70 Å²	70	133.3 Å²	133.3	72%	0.722	77%	0.768	S	S	*	*			trans	174.2	147.4	162.3	0	0	0	0	0	117.5
1785	V	35.7	Very low	33.3	Very low	135 Å²	135	134.5 Å²	134.5	82%	0.818	78%	0.776	S	S	*	*			trans	62.5	102.8	174.7	-167.2	0	0	0	0	115.5
1786	I	31.5	Very low	32.1	Very low	147 Å²	147	137.1 Å²	137.1	75%	0.754	78%	0.78	S	S	*	*			cis	91	88.5	36.2	-53.2	167.2	0	0	0	114.9
1787	H	30.9	Very low	31.5	Very low	170 Å²	170	139.5 Å²	139.5	79%	0.787	78%	0.777	S	S	*	*				-168.4	122	121.5	-120.9	-92.4	0	0	0	112.6
1788	H	31	Very low	30.9	Very low	150 Å²	150	142.3 Å²	142.3	69%	0.694	77%	0.773	S	S	*	*			trans	21.3	137.5	153.9	-78.8	-82.3	0	0	0	122.3
1789	Q	25.5	Very low	30.4	Very low	124 Å²	124	141.5 Å²	141.5	58%	0.579	77%	0.768	S	S	*	*			cis	-161.9	149.8	9.1	-154.8	159	-41.6	0	0	113.9
1790	Y	24.6	Very low	30.1	Very low	189 Å²	189	142.6 Å²	142.6	74%	0.741	77%	0.772	S	S	*	*			trans	65.9	137	172.8	-58.1	-68	0	0	0	118.6
1791	N	27.9	Very low	29.6	Very low	128 Å²	128	142.8 Å²	142.8	68%	0.684	77%	0.769	S	S	*	*			cis	-158.5	118.2	-33.4	-126	25.2	0	0	0	112.5
1792	T	25.6	Very low	28.8	Very low	124 Å²	124	143.1 Å²	143.1	76%	0.761	77%	0.769	S	S	*	*			trans	44.7	118.4	148.1	55.6	0	0	0	0	122.3
1793	H	32.2	Very low	28.3	Very low	184 Å²	184	141.7 Å²	141.7	85%	0.852	76%	0.759	S	S	*	*			trans	-48.1	147.1	170.8	-51.6	-80	0	0	0	117.9
1794	D	27.4	Very low	27.7	Very low	142 Å²	142	140.8 Å²	140.8	76%	0.759	75%	0.751	S	S	*	*				-164.7	133.5	126.2	-103.3	-30.6	0	0	0	109.7
1795	M	24.9	Very low	26.9	Very low	177 Å²	177	143.1 Å²	143.1	87%	0.872	75%	0.751	S	S	*	*			trans	64.6	171.7	175.4	-44.6	169.7	-74.5	0	0	114.8
1796	E	24.9	Very low	26.4	Very low	171 Å²	171	142.6 Å²	142.6	80%	0.799	75%	0.748	S	S	*	*			cis	-144.1	-138.7	-9.9	-147	-145.9	-113.6	0	0	112.3
1797	H	25.5	Very low	26	Very low	134 Å²	134	141.1 Å²	141.1	62%	0.62	75%	0.747	S	S	*	*			trans	-77.6	155.5	-172.9	-97.9	-98.1	0	0	0	117.7
1798	L	20.9	Very low	25.7	Very low	135 Å²	135	139.5 Å²	139.5	71%	0.707	75%	0.748	S	S	*	*	S	Bend	trans	70	55.9	150.2	-68.2	165.7	0	0	0	120.7
1799	T	30.4	Very low	25.4	Very low	133 Å²	133	139 Å²	139	82%	0.816	75%	0.751	S	S	*	*			trans	-152.7	144.1	150.4	44.8	0	0	0	0	113.2
1800	M	24.9	Very low	25.2	Very low	185 Å²	185	138 Å²	138	91%	0.911	76%	0.757	S	S	*	*			trans	-154.3	113.2	148.5	-88.6	-147.1	77	0	0	110.7
1801	T	28.1	Very low	25.7	Very low	120 Å²	120	136.9 Å²	136.9	74%	0.736	76%	0.759	S	S	*	*			trans	-140.2	176.8	172.7	54.9	0	0	0	0	109.6
1802	T	23.1	Very low	25.7	Very low	128 Å²	128	138.7 Å²	138.7	79%	0.785	76%	0.763	S	S	*	*			trans	87.9	142.8	175	73.9	0	0	0	0	119.8
1803	S	22.9	Very low	25.8	Very low	92 Å²	92	140.1 Å²	140.1	64%	0.643	77%	0.765	S	S	*	*			trans	53.7	93.6	145.8	56.4	0	0	0	0	123.1
1804	T	23.4	Very low	25.7	Very low	118 Å²	118	137 Å²	137	72%	0.724	76%	0.76	S	S	*	*				47.7	126.9	108.9	58	0	0	0	0	123.4
1805	T	24.6	Very low	25.8	Very low	119 Å²	119	134.5 Å²	134.5	73%	0.73	75%	0.754	S	S	*	*			trans	79.9	165.2	131.7	58.7	0	0	0	0	122.3
1806	T	23.7	Very low	25.9	Very low	124 Å²	124	133.2 Å²	133.2	76%	0.761	75%	0.751	S	S	*	*			trans	85.8	139.6	172.4	74.6	0	0	0	0	117
1807	T	23.2	Very low	25.9	Very low	117 Å²	117	129.3 Å²	129.3	72%	0.718	74%	0.743	S	S	*	*			cis	-168.9	131.3	-24.3	27.4	0	0	0	0	109.6
1808	V	25.9	Very low	25.9	Very low	135 Å²	135	129.8 Å²	129.8	82%	0.818	75%	0.748	S	S	*	*			trans	-150.5	97	151.9	-173.1	0	0	0	0	112.5
1809	N	23.2	Very low	26.2	Very low	139 Å²	139	129.1 Å²	129.1	74%	0.743	75%	0.749	S	S	*	*			trans	46.4	140.6	135.2	-50.6	-10.5	0	0	0	125.5
1810	S	22.8	Very low	25.9	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	74%	0.743	S	S	*	*			trans	97.2	139	136.9	68.9	0	0	0	0	122.7
1811	H	34.4	Very low	26	Very low	167 Å²	167	127 Å²	127	77%	0.773	74%	0.737	S	S	*	*			trans	66.2	110.8	-179.5	-59.6	-72.7	0	0	0	116.3
1812	E	27.5	Very low	26	Very low	165 Å²	165	125.7 Å²	125.7	77%	0.771	73%	0.733	S	S	*	*			cis	82.6	95	31.2	-53.6	-171.7	146	0	0	114.3
1813	I	28	Very low	26.1	Very low	155 Å²	155	128.4 Å²	128.4	80%	0.795	73%	0.733	S	S	*	*				85	128.5	84.9	-76.9	168.5	0	0	0	111.5
1814	P	29.3	Very low	26.2	Very low	117 Å²	117	131.5 Å²	131.5	76%	0.76	74%	0.738	S	S	*	*			cis	-137.6	176.6	46.9	29.2	-5.6	0	0	0	116.7
1815	S	30.2	Very low	26.2	Very low	91 Å²	91	134 Å²	134	64%	0.636	74%	0.739	S	S	*	*			cis	-170	134.9	-20.4	54	0	0	0	0	113.1
1816	N	27	Very low	26.2	Very low	149 Å²	149	132.9 Å²	132.9	80%	0.797	73%	0.728	S	S	*	*			trans	64	145.9	133.2	-63.7	7	0	0	0	122
1817	S	25.8	Very low	26.2	Very low	90 Å²	90	135 Å²	135	63%	0.629	73%	0.732	S	S	*	*			cis	-167.1	137.9	-1.5	37.3	0	0	0	0	115.5
1818	I	25.2	Very low	26.4	Very low	143 Å²	143	135.8 Å²	135.8	73%	0.733	73%	0.73	S	S	*	*				60.3	126	126.2	-50.9	165.3	0	0	0	117.2
1819	V	26	Very low	26.5	Very low	121 Å²	121	137.7 Å²	137.7	73%	0.733	73%	0.728	S	S	*	*				-152.8	128.2	73.8	168.4	0	0	0	0	113.8
1820	N	25.5	Very low	26.7	Very low	127 Å²	127	136.1 Å²	136.1	68%	0.679	72%	0.723	S	S	*	*			trans	39.2	145.8	143.9	-52.8	-5.4	0	0	0	126
1821	N	26.9	Very low	26.9	Very low	146 Å²	146	134.8 Å²	134.8	78%	0.781	71%	0.714	S	S	*	*			trans	63.9	125.3	156.3	-57.7	-3.8	0	0	0	118.8
1822	S	27.5	Very low	26.8	Very low	94 Å²	94	131.6 Å²	131.6	66%	0.657	71%	0.711	S	S	*	*			cis	102.6	127.4	6.7	90.7	0	0	0	0	117.5
1823	K	25.2	Very low	27.1	Very low	184 Å²	184	129.6 Å²	129.6	80%	0.8	71%	0.705	S	S	*	*			trans	71.7	154	178.4	-51.4	176.8	177.2	-169.2	0	114.6
1824	E	24.8	Very low	27.4	Very low	158 Å²	158	127.5 Å²	127.5	74%	0.738	69%	0.694	S	S	*	*			cis	-135.1	148.7	-9.7	-128.4	140.1	156.6	0	0	106.2
1825	K	24.3	Very low	27.9	Very low	169 Å²	169	130.2 Å²	130.2	74%	0.735	69%	0.689	S	S	*	*				64.4	112.9	52	-105.3	-157	171.9	-161.7	0	115.5
1826	D	24.1	Very low	28.4	Very low	97 Å²	97	131.1 Å²	131.1	52%	0.519	69%	0.686	S	S	.	*			trans	45.2	148.8	142.3	-46.3	-33.5	0	0	0	121.7
1827	M	24.6	Very low	28.8	Very low	169 Å²	169	128.8 Å²	128.8	83%	0.833	67%	0.674	S	S	*	*			trans	77.8	154.3	169.5	-44.1	-155	-48.3	0	0	115.8
1828	I	25.9	Very low	29	Very low	133 Å²	133	132.6 Å²	132.6	68%	0.682	68%	0.679	S	S	*	*			cis	-150.9	178	-16.7	-121.8	169.5	0	0	0	110.6
1829	F	29.5	Very low	29.9	Very low	174 Å²	174	134.5 Å²	134.5	76%	0.763	68%	0.677	S	S	*	*			trans	-49.3	173.1	163.2	-93.6	-133.3	0	0	0	113.8
1830	T	26.8	Very low	30.3	Very low	107 Å²	107	135.7 Å²	135.7	66%	0.656	68%	0.675	S	S	*	*			trans	71.2	93.9	169.1	65.5	0	0	0	0	117.9
1831	S	27	Very low	30.4	Very low	75 Å²	75	135.7 Å²	135.7	52%	0.524	67%	0.673	S	S	.	*	S	Bend	trans	-125.2	-27.8	143.7	56.9	0	0	0	0	112	L1833 L1834 W1835	S1831-L1833 PolarHBondContact O-N 3.01Å; S1831-L1834 PolarHBondContact O-N 3.49Å; S1831-W1835 PolarHBondContact O-N 2.81Å
1832	S	32.8	Very low	30.5	Very low	100 Å²	100	132.3 Å²	132.3	70%	0.699	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.8	4.1	170.9	-40	0	0	0	0	116.3
1833	L	33.1	Very low	30.5	Very low	123 Å²	123	137.7 Å²	137.7	64%	0.644	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.5	7.9	177.1	-143.7	89.4	0	0	0	114.2	S1831	S1831-L1833 PolarHBondContact O-N 3.01Å
1834	L	33.7	Very low	30.6	Very low	111 Å²	111	135.6 Å²	135.6	58%	0.581	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	-24.7	176.1	-152.6	74	0	0	0	113.9	S1831 L1836 L1837 K1838	S1831-L1834 PolarHBondContact O-N 3.49Å; L1834-L1836 VanDerWaalsContact C-N 3.33Å; L1834-L1837 HydrophobicContact CD1-CB 4.23Å; L1834-L1837 CarbonylContact O-C 3.54Å; L1834-L1837 PolarHBondContact O-N 3.39Å; L1834-K1838 WeakPolarHBondContact O-CB 3.41Å; L1834-K1838 PolarHBondContact O-N 3.44Å
1835	W	41	Very low	30.7	Very low	173 Å²	173	132.5 Å²	132.5	66%	0.655	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-43.1	161.5	-168.7	70.3	0	0	0	109.8	S1831 L1837 K1838 R1839	S1831-W1835 PolarHBondContact O-N 2.81Å; W1835-L1837 PolarHBondContact O-N 2.93Å; W1835-L1837 VanDerWaalsContact O-N 3.15Å; W1835-K1838 PolarHBondContact O-N 3.46Å; W1835-R1839 VanDerWaalsContact CH2-NH1 3.32Å; W1835-R1839 VanDerWaalsContact O-CB 3.28Å; W1835-R1839 WeakPolarHBondContact O-CB 3.45Å; W1835-R1839 PolarHBondContact O-N 2.93Å
1836	L	40.7	Very low	30.7	Very low	110 Å²	110	128.5 Å²	128.5	58%	0.576	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-8	169.5	-83.9	165.3	0	0	0	115.3	L1834	L1834-L1836 VanDerWaalsContact C-N 3.33Å
1837	L	34.5	Very low	30.8	Very low	101 Å²	101	129.1 Å²	129.1	53%	0.529	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.1	2.7	176	-106.7	165.3	0	0	0	113.3	L1834 W1835	L1834-L1837 HydrophobicContact CD1-CB 4.23Å; L1834-L1837 CarbonylContact O-C 3.54Å; L1834-L1837 PolarHBondContact O-N 3.39Å; W1835-L1837 PolarHBondContact O-N 2.93Å; W1835-L1837 VanDerWaalsContact O-N 3.15Å
1838	K	31	Very low	30.9	Very low	170 Å²	170	126.8 Å²	126.8	74%	0.739	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	-5.9	174.6	-143.5	-179	-177	-169.9	0	113.8	L1834 W1835	L1834-K1838 WeakPolarHBondContact O-CB 3.41Å; L1834-K1838 PolarHBondContact O-N 3.44Å; W1835-K1838 PolarHBondContact O-N 3.46Å
1839	R	43.9	Very low	31	Very low	182 Å²	182	126 Å²	126	69%	0.687	69%	0.685	S	S	*	*	S	Bend	trans	-77.9	-10.7	154.5	-171.6	171.7	176.8	179.4	-3	111.9	W1835	W1835-R1839 VanDerWaalsContact CH2-NH1 3.32Å; W1835-R1839 VanDerWaalsContact O-CB 3.28Å; W1835-R1839 WeakPolarHBondContact O-CB 3.45Å; W1835-R1839 PolarHBondContact O-N 2.93Å
1840	Q	32.7	Very low	30.8	Very low	147 Å²	147	123.8 Å²	123.8	69%	0.687	68%	0.681	S	S	*	*	S	Bend	trans	-92.6	-15.9	-176.8	-152.4	76.4	22.4	0	0	114.3
1841	I	27.7	Very low	31	Very low	126 Å²	126	126.2 Å²	126.2	65%	0.646	69%	0.685	S	S	*	*	S	Bend	trans	-145.1	133	-173.6	-56.5	-179.7	0	0	0	110.5
1842	A	29.1	Very low	31	Very low	76 Å²	76	129 Å²	129	63%	0.628	69%	0.694	S	S	*	*			trans	67.2	61.2	170.4	0	0	0	0	0	117
1843	Q	28.4	Very low	30.9	Very low	206 Å²	206	131 Å²	131	96%	0.963	70%	0.695	S	S	*	*	S	Bend		-84.9	73.3	126.2	-173.7	173.7	1.3	0	0	107.2
1844	D	27.2	Very low	30.8	Very low	140 Å²	140	132.1 Å²	132.1	75%	0.749	70%	0.702	S	S	*	*			trans	-161.8	166.6	-175	-155.7	-9.8	0	0	0	110.8
1845	S	26.4	Very low	30.3	Very low	94 Å²	94	137.4 Å²	137.4	66%	0.657	72%	0.716	S	S	*	*			trans	64.6	50.2	177.1	68.8	0	0	0	0	116.4	T1847	S1845-T1847 PolarHBondContact O-N 2.94Å
1846	G	25.4	Very low	29.9	Very low	85 Å²	85	134.3 Å²	134.3	88%	0.876	72%	0.718	S	S	*	*			trans	-67.8	22	163.6	0	0	0	0	0	115.6
1847	T	25.9	Very low	29.1	Very low	110 Å²	110	137.6 Å²	137.6	68%	0.675	73%	0.73	S	S	*	*	S	Bend	trans	-148	121.2	-175.4	34.5	0	0	0	0	114.2	S1845	S1845-T1847 PolarHBondContact O-N 2.94Å
1848	T	26.5	Very low	29	Very low	119 Å²	119	141.4 Å²	141.4	73%	0.73	75%	0.745	S	S	*	*			trans	57.5	130.6	143.3	55.8	0	0	0	0	122.6
1849	T	27.1	Very low	28.9	Very low	118 Å²	118	140.1 Å²	140.1	72%	0.724	75%	0.746	S	S	*	*			trans	71.5	112	144.8	49.4	0	0	0	0	121.8
1850	N	26.9	Very low	28.2	Very low	126 Å²	126	135.8 Å²	135.8	67%	0.674	75%	0.749	S	S	*	*				71.7	140.2	128.8	-72.4	22.9	0	0	0	122
1851	E	30.5	Very low	27.8	Very low	158 Å²	158	140.5 Å²	140.5	74%	0.738	76%	0.76	S	S	*	*			trans	64.1	140.4	149.1	-67.2	165.2	-122.6	0	0	116.5
1852	N	27.5	Very low	28	Very low	134 Å²	134	139 Å²	139	72%	0.717	76%	0.761	S	S	*	*			cis	170.3	-178.7	-11.4	-109.4	-23.8	0	0	0	103.9
1853	I	30.6	Very low	27.9	Very low	142 Å²	142	141.5 Å²	141.5	73%	0.728	76%	0.763	S	S	*	*			trans	75.6	93.9	160.2	-55.8	128.8	0	0	0	117.7
1854	D	29.7	Very low	28	Very low	146 Å²	146	138.5 Å²	138.5	78%	0.781	76%	0.758	S	S	*	*				57.1	132.8	118.1	-48	-33.4	0	0	0	124.9
1855	Y	24.4	Very low	28	Very low	223 Å²	223	136.7 Å²	136.7	88%	0.875	76%	0.757	S	S	*	*			trans	-31	153	139.6	-88.4	-93.1	0	0	0	114.2
1856	P	31.8	Very low	28.4	Very low	107 Å²	107	139.4 Å²	139.4	70%	0.695	76%	0.759	S	S	*	*				-160	-178.6	67.9	43.8	-22	0	0	0	120	Q1858	P1856-Q1858 PolarHBondContact O-N 3.26Å
1857	Q	24.3	Very low	28.4	Very low	179 Å²	179	142 Å²	142	84%	0.836	75%	0.752	S	S	*	*			trans	-27.1	112.7	161.3	-57.6	162.5	-13.6	0	0	116.6
1858	Q	32.8	Very low	28.5	Very low	182 Å²	182	139.3 Å²	139.3	85%	0.85	75%	0.747	S	S	*	*			trans	-156.3	24.5	160.4	-134.7	165.4	103.3	0	0	120	P1856	P1856-Q1858 PolarHBondContact O-N 3.26Å
1859	L	27.7	Very low	28.5	Very low	143 Å²	143	144.5 Å²	144.5	75%	0.749	75%	0.753	S	S	*	*			trans	-122.8	24.7	173.4	-123	169.9	0	0	0	116.4
1860	A	28.5	Very low	28.3	Very low	90 Å²	90	148.3 Å²	148.3	74%	0.744	75%	0.754	S	S	*	*	S	Bend	trans	-82.5	129.6	148.5	0	0	0	0	0	108.6
1861	R	26.1	Very low	28.2	Very low	246 Å²	246	146.8 Å²	146.8	93%	0.928	75%	0.753	S	S	*	*	S	Bend	trans	91.6	19.7	175.6	-50.4	177.6	172.3	130.7	-2.5	120
1862	S	30.3	Very low	28	Very low	95 Å²	95	148.6 Å²	148.6	66%	0.664	75%	0.753	S	S	*	*	S	Bend	trans	-142.1	27.3	175	-156.8	0	0	0	0	119.6
1863	L	28.5	Very low	27.9	Very low	129 Å²	129	149 Å²	149	68%	0.675	76%	0.76	S	S	*	*	S	Bend	trans	-145.5	13.3	152.7	-117.6	176.1	0	0	0	115.9	S1865 Q1866	L1863-S1865 PolarHBondContact O-N 3.43Å; L1863-Q1866 HydrophobicContact CD2-CB 4.25Å; L1863-Q1866 WeakPolarHBondContact CD2-O 3.45Å
1864	V	30.3	Very low	27.7	Very low	142 Å²	142	146 Å²	146	86%	0.861	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	119.5	148.9	176.1	0	0	0	0	106.2
1865	S	27.9	Very low	27.4	Very low	103 Å²	103	145.3 Å²	145.3	72%	0.72	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.1	45.3	-179.4	-164.6	0	0	0	0	118.1	L1863	L1863-S1865 PolarHBondContact O-N 3.43Å
1866	Q	32.8	Very low	27.3	Very low	150 Å²	150	138 Å²	138	70%	0.701	74%	0.744	S	S	*	*	S	Bend		-135.2	127.2	124.8	-77.4	-144.3	30.8	0	0	110.7	L1863	L1863-Q1866 HydrophobicContact CD2-CB 4.25Å; L1863-Q1866 WeakPolarHBondContact CD2-O 3.45Å
1867	L	26.9	Very low	26.9	Very low	140 Å²	140	136.8 Å²	136.8	73%	0.733	74%	0.738	S	S	*	*			cis	-149.5	144.6	-17.3	-126.1	173.1	0	0	0	108.4
1868	G	27.7	Very low	26.9	Very low	54 Å²	54	134 Å²	134	56%	0.557	72%	0.723	S	S	*	*			trans	-64.5	160.3	-176.4	0	0	0	0	0	113.6
1869	R	26.2	Very low	26.6	Very low	227 Å²	227	129.5 Å²	129.5	86%	0.857	71%	0.712	S	S	*	*				-154.8	151.9	70.3	-68	129.2	-171.5	-135.5	7	110.6
1870	R	23.2	Very low	26.4	Very low	198 Å²	198	126.8 Å²	126.8	75%	0.747	71%	0.705	S	S	*	*			cis	-162.5	129.7	-9.4	-107.7	170.4	-174.2	-178.6	1.6	104.7
1871	S	25	Very low	26.2	Very low	95 Å²	95	132 Å²	132	66%	0.664	71%	0.706	S	S	*	*				57.3	105.5	57.4	-173.7	0	0	0	0	113.6
1872	R	26.3	Very low	26.1	Very low	195 Å²	195	126.2 Å²	126.2	74%	0.736	69%	0.689	S	S	*	*			trans	145	152.2	142.9	-78.3	153.9	-166	-137.3	-4.4	111.7
1873	V	25.4	Very low	26	Very low	143 Å²	143	127.7 Å²	127.7	87%	0.867	69%	0.686	S	S	*	*			cis	19.2	103	6.1	-169.4	0	0	0	0	116
1874	P	25.6	Very low	25.8	Very low	79 Å²	79	128.4 Å²	128.4	51%	0.513	69%	0.685	S	S	.	*	S	Bend	cis	-114.9	162.1	37.8	41	-35.9	0	0	0	115.6
1875	T	23.2	Very low	25.6	Very low	131 Å²	131	127.2 Å²	127.2	80%	0.804	67%	0.674	S	S	*	*			trans	48.8	93.2	145.1	57.4	0	0	0	0	119.1
1876	G	23.7	Very low	25.8	Very low	71 Å²	71	130 Å²	130	73%	0.732	68%	0.675	S	S	*	*				90.1	161.5	119.5	0	0	0	0	0	120.2
1877	S	22.9	Very low	25.5	Very low	81 Å²	81	128.9 Å²	128.9	57%	0.566	67%	0.674	S	S	*	*			trans	60.2	113.1	154.3	61.2	0	0	0	0	120.5
1878	F	23.9	Very low	25.5	Very low	119 Å²	119	129 Å²	129	52%	0.522	68%	0.675	S	S	.	*				60.3	88.1	126.7	-76	-80.4	0	0	0	120.5	S2092 Q2093	F1878-S2092 VanDerWaalsContact CE1-C 3.43Å; F1878-Q2093 VanDerWaalsContact CD2-O 3.29Å; F1878-Q2093 WeakPolarHBondContact CD2-O 3.1Å; F1878-Q2093 WeakPolarHBondContact CE2-O 3.08Å; F1878-Q2093 WeakPolarHBondContact CZ-O 3.4Å
1879	S	25.6	Very low	25.5	Very low	88 Å²	88	131.9 Å²	131.9	62%	0.615	68%	0.684	S	S	*	*				75.8	165.7	108.2	84	0	0	0	0	120.7
1880	S	25.4	Very low	25.5	Very low	87 Å²	87	124.9 Å²	124.9	61%	0.608	68%	0.675	S	S	*	*			trans	82.3	98.4	150.5	-61.4	0	0	0	0	117.2
1881	R	24.1	Very low	25.6	Very low	199 Å²	199	121.9 Å²	121.9	75%	0.751	67%	0.667	S	S	*	*				79.6	148.8	110.5	-80.2	166.7	150.9	-128.3	3.3	117.8
1882	Q	24.3	Very low	25.5	Very low	124 Å²	124	120.6 Å²	120.6	58%	0.579	65%	0.651	S	S	*	*			trans	65.5	129.8	142.5	-71.8	169.5	-78.7	0	0	115.6
1883	H	26.7	Very low	25.5	Very low	127 Å²	127	118.8 Å²	118.8	59%	0.588	64%	0.644	S	S	*	*			cis	-151.6	138.9	8.3	-102.2	-57.5	0	0	0	106.1
1884	Q	24.6	Very low	25.5	Very low	143 Å²	143	116.5 Å²	116.5	67%	0.668	63%	0.634	S	S	*	*				70.1	151.4	82.8	-159.9	-164.7	12	0	0	113.2
1885	N	26.5	Very low	25.6	Very low	118 Å²	118	118.3 Å²	118.3	63%	0.631	65%	0.646	S	S	*	*			trans	96.5	140.2	164.3	-46.7	-55.1	0	0	0	116.9
1886	H	31.9	Very low	25.6	Very low	161 Å²	161	117.2 Å²	117.2	75%	0.745	64%	0.639	S	S	*	*			trans	61.3	97.3	180	-66.7	-81.8	0	0	0	116.1
1887	L	27.2	Very low	25.5	Very low	126 Å²	126	119.1 Å²	119.1	66%	0.66	64%	0.64	S	S	*	*				73.2	112.9	61.6	-68.3	150.7	0	0	0	111.7
1888	D	25.8	Very low	25.5	Very low	143 Å²	143	119.9 Å²	119.9	77%	0.765	65%	0.645	S	S	*	*				40.6	152.5	98.3	-60.4	7.7	0	0	0	119.2
1889	P	28.6	Very low	25.5	Very low	115 Å²	115	119.6 Å²	119.6	75%	0.747	65%	0.653	S	S	*	*			cis	-133.8	176.3	7.2	41.6	-26	0	0	0	115.7
1890	A	26	Very low	25.3	Very low	80 Å²	80	124.9 Å²	124.9	66%	0.661	66%	0.66	S	S	*	*			trans	74.4	138.1	139.5	0	0	0	0	0	121
1891	F	24.6	Very low	25.2	Very low	134 Å²	134	128 Å²	128	59%	0.588	67%	0.666	S	S	*	*			cis	95.6	145.8	36.7	-124.5	-84.4	0	0	0	113.3	N2302 N2303	F1891-N2302 WeakPolarHBondContact CD1-ND2 3.44Å; F1891-N2302 WeakPolarHBondContact CD1-OD1 3.36Å; F1891-N2302 WeakPolarHBondContact CE1-OD1 3.47Å; F1891-N2302 WeakPolarHBondContact CG-ND2 2.85Å; F1891-N2302 WeakPolarHBondContact CZ-OD1 3.2Å; F1891-N2303 WeakPolarHBondContact CE2-ND2 3.33Å
1892	E	23.3	Very low	25.3	Very low	69 Å²	69	126.7 Å²	126.7	32%	0.322	67%	0.666	S	S	.	*			trans	64.9	90.2	155.2	-122.3	173.8	-109.3	0	0	115.9	H2301 N2302	E1892-H2301 PolarHBondContact OE1-N 2.69Å; E1892-H2301 IonicContact OE1-ND1 3.25Å; E1892-H2301 IonicContact OE2-CE1 2.68Å; E1892-H2301 PolarHBondContact OE2-CE1 3.13Å; E1892-H2301 IonicContact OE2-CG 2.73Å; E1892-H2301 PolarHBondContact OE2-N 3.42Å; E1892-H2301 IonicContact OE2-ND1 3.61Å; E1892-H2301 PolarHBondContact OE2-ND1 3.29Å; E1892-N2302 VanDerWaalsContact OE1-CG 3.24Å; E1892-N2302 PolarHBondContact OE1-ND2 2.94Å; E1892-N2302 PolarHBondContact OE1-OD1 3.46Å
1893	R	25.3	Very low	25.5	Very low	157 Å²	157	128 Å²	128	59%	0.592	67%	0.672	S	S	*	*				-174.4	134.6	96.7	-95.2	147.8	-166.6	-134.6	-8.1	114.6	D2299 K2300	R1893-D2299 IonicContact CZ-OD1 3.86Å; R1893-D2299 IonicContact NH1-OD1 3.49Å; R1893-D2299 IonicContact NH2-OD1 2.82Å; R1893-D2299 PolarHBondContact NH2-OD1 3.46Å; R1893-K2300 VanDerWaalsContact NH2-CG 3.31Å
1894	S	27.1	Very low	25.6	Very low	95 Å²	95	130.9 Å²	130.9	66%	0.664	68%	0.678	S	S	*	*			trans	-67.5	154.9	152.2	46.7	0	0	0	0	111
1895	P	27	Very low	25.9	Very low	116 Å²	116	130.9 Å²	130.9	75%	0.753	68%	0.682	S	S	*	*				-117	129.3	112.6	-5.3	25.2	0	0	0	109.1
1896	T	22.6	Very low	26	Very low	109 Å²	109	127.3 Å²	127.3	67%	0.669	67%	0.673	S	S	*	*				63.5	123.4	63.3	72.4	0	0	0	0	116
1897	C	22.6	Very low	25.8	Very low	111 Å²	111	123.2 Å²	123.2	75%	0.75	65%	0.651	S	S	*	*			trans	73.7	105.1	137.7	-73.6	0	0	0	0	120.9
1898	S	22.9	Very low	25.8	Very low	96 Å²	96	119.1 Å²	119.1	67%	0.671	63%	0.631	S	S	*	*				85.2	159.2	104.8	80.5	0	0	0	0	120.1
1899	V	23	Very low	25.8	Very low	113 Å²	113	115.5 Å²	115.5	69%	0.685	61%	0.612	S	S	*	*			trans	68.7	129.9	147.6	159.1	0	0	0	0	114.8
1900	R	22.6	Very low	25.6	Very low	200 Å²	200	119.3 Å²	119.3	76%	0.755	62%	0.62	S	S	*	*			cis	-176.6	151.5	5.8	145.6	-171	-74.7	158.6	-5.2	109.3
1901	M	23.2	Very low	25.7	Very low	152 Å²	152	118.7 Å²	118.7	75%	0.749	60%	0.6	S	S	*	*			trans	20.3	135.1	152.3	-58.1	169.9	118.5	0	0	121.5
1902	K	26.2	Very low	25.8	Very low	172 Å²	172	117.4 Å²	117.4	75%	0.748	60%	0.596	S	S	*	*			trans	89.3	134.6	140.4	-79.4	172.1	173.8	-170	0	120.2
1903	H	28	Very low	26.3	Very low	150 Å²	150	117.2 Å²	117.2	69%	0.694	60%	0.602	S	S	*	*			trans	74.7	143.2	145.4	-84.3	-146.8	0	0	0	117.4
1904	R	28.7	Very low	26.5	Very low	189 Å²	189	114.5 Å²	114.5	71%	0.713	60%	0.599	S	S	*	*			cis	-174.8	157.6	-21.2	-142.3	-174.5	171.6	176	-4.6	109.2
1905	N	30.3	Very low	26.2	Very low	143 Å²	143	114.9 Å²	114.9	77%	0.765	60%	0.599	S	S	*	*			trans	69.4	124.5	165.2	-44.6	-21.2	0	0	0	115.2
1906	G	28.4	Very low	26.2	Very low	43 Å²	43	112.8 Å²	112.8	44%	0.443	58%	0.584	S	S	.	*			cis	160.2	137.6	-12.4	0	0	0	0	0	114.5
1907	R	28.9	Very low	26.2	Very low	74 Å²	74	117.4 Å²	117.4	28%	0.279	60%	0.595	S	S	.	*			trans	88.3	-166	-179.9	-115.2	82.9	-174.4	-126.9	-19.5	115.5	D1909 R1911 G2236 D2237 D2240 N2241 D2242	R1907-D1909 IonicContact CZ-OD1 2.7Å; R1907-D1909 IonicContact CZ-OD2 3.17Å; R1907-D1909 VanDerWaalsContact CZ-OD2 3.25Å; R1907-D1909 VanDerWaalsContact NE-CG 3.27Å; R1907-D1909 IonicContact NE-OD1 3.74Å; R1907-D1909 PolarHBondContact NE-OD1 3.5Å; R1907-D1909 IonicContact NE-OD2 3.35Å; R1907-D1909 PolarHBondContact NE-OD2 3.47Å; R1907-D1909 IonicContact NH2-OD1 3.75Å; R1907-D1909 PolarHBondContact NH2-OD1 2.92Å; R1907-D1909 IonicContact NH2-OD2 2.67Å; R1907-D1909 PolarHBondContact NH2-OD2 3.36Å; R1907-R1911 PolarHBondContact O-NH2 3.25Å; R1907-G2236 PolarHBondContact NH1-O 2.8Å; R1907-D2237 IonicContact CZ-OD1 2.69Å; R1907-D2237 IonicContact NH1-OD1 3.1Å; R1907-D2237 IonicContact NH2-OD1 3.7Å; R1907-D2237 PolarHBondContact NH2-OD1 3.43Å; R1907-D2240 VanDerWaalsContact C-C 3.41Å; R1907-D2240 CarbonylContact C-O 3.54Å; R1907-D2240 CarbonylContact O-C 3.53Å; R1907-N2241 CarbonylContact O-C 3.49Å; R1907-N2241 VanDerWaalsContact O-C 3.22Å; R1907-N2241 PolarHBondContact O-N 3.27Å; R1907-D2242 PolarHBondContact O-N 3.08Å
1908	T	26	Very low	26.5	Very low	40 Å²	40	119.1 Å²	119.1	25%	0.245	60%	0.597	C	S	.	*			cis	-62.9	170.4	-21.7	-41.2	0	0	0	0	110.7	R1911 D2239 D2240	T1908-R1911 PolarHBondContact O-NE 2.82Å; T1908-D2239 WeakPolarHBondContact CB-OD1 3.44Å; T1908-D2239 WeakPolarHBondContact CG2-OD1 3.48Å; T1908-D2239 PolarHBondContact OG1-OD1 3.41Å; T1908-D2240 WeakPolarHBondContact OG1-CA 2.89Å; T1908-D2240 VanDerWaalsContact OG1-CG 3.31Å; T1908-D2240 PolarHBondContact OG1-N 2.97Å; T1908-D2240 PolarHBondContact OG1-OD1 3.07Å
1909	D	26.1	Very low	26.4	Very low	68 Å²	68	118.3 Å²	118.3	36%	0.364	58%	0.58	S	S	.	*	S	Bend	trans	-83.1	160.2	171.8	-66.3	-42.7	0	0	0	112.9	R1907	R1907-D1909 IonicContact CZ-OD1 2.7Å; R1907-D1909 IonicContact CZ-OD2 3.17Å; R1907-D1909 VanDerWaalsContact CZ-OD2 3.25Å; R1907-D1909 VanDerWaalsContact NE-CG 3.27Å; R1907-D1909 IonicContact NE-OD1 3.74Å; R1907-D1909 PolarHBondContact NE-OD1 3.5Å; R1907-D1909 IonicContact NE-OD2 3.35Å; R1907-D1909 PolarHBondContact NE-OD2 3.47Å; R1907-D1909 IonicContact NH2-OD1 3.75Å; R1907-D1909 PolarHBondContact NH2-OD1 2.92Å; R1907-D1909 IonicContact NH2-OD2 2.67Å; R1907-D1909 PolarHBondContact NH2-OD2 3.36Å
1910	H	24.3	Very low	26.4	Very low	194 Å²	194	120 Å²	120	90%	0.898	58%	0.584	S	S	*	*	S	Bend	trans	79.6	45.4	-176.7	-51.1	-14.3	0	0	0	116.9
1911	R	29.4	Very low	26.6	Very low	67 Å²	67	115 Å²	115	25%	0.253	58%	0.58	S	S	.	*			trans	-73.6	156.9	156.4	-54.4	166.7	-171.6	-164.6	-4.4	109.2	R1907 T1908 D2242 D2245 E2246	R1907-R1911 PolarHBondContact O-NH2 3.25Å; T1908-R1911 PolarHBondContact O-NE 2.82Å; R1911-D2242 PolarHBondContact NE-O 3.03Å; R1911-D2242 PolarHBondContact NH1-O 3.43Å; R1911-D2242 VanDerWaalsContact NH2-CB 3.34Å; R1911-D2242 PolarHBondContact NH2-O 2.89Å; R1911-D2245 VanDerWaalsContact NH1-C 3.34Å; R1911-E2246 HydrophobicContact CB-CB 3.85Å; R1911-E2246 HydrophobicContact CB-CG 3.69Å; R1911-E2246 HydrophobicContact CG-CB 4.32Å; R1911-E2246 HydrophobicContact CG-CG 4.1Å
1912	H	25.9	Very low	26.8	Very low	108 Å²	108	117.8 Å²	117.8	50%	0.5	59%	0.588	S	S	.	*			cis	-131.9	163.9	18	-35.9	-140.5	0	0	0	112	E2246 I2250	H1912-E2246 IonicContact CE1-OE2 2.68Å; H1912-E2246 PolarHBondContact CE1-OE2 2.9Å; H1912-E2246 IonicContact ND1-OE2 3.65Å; H1912-E2246 IonicContact NE2-OE2 2.87Å; H1912-E2246 PolarHBondContact NE2-OE2 2.89Å; H1912-I2250 WeakPolarHBondContact ND1-CD1 3.35Å
1913	S	34.3	Very low	26.8	Very low	64 Å²	64	114.5 Å²	114.5	45%	0.448	58%	0.584	S	S	.	*			trans	-162.3	150.7	154.6	65.5	0	0	0	0	107.5	Y1919	S1913-Y1919 VanDerWaalsContact C-CE1 3.43Å; S1913-Y1919 WeakPolarHBondContact O-CE1 3.29Å; S1913-Y1919 PolarHBondContact O-OH 3.5Å
1914	L	29.7	Very low	26.5	Very low	100 Å²	100	115.7 Å²	115.7	52%	0.524	59%	0.59	S	S	.	*			cis	-171.3	-170.1	-3	-119.1	176.2	0	0	0	107.1	Y1919	L1914-Y1919 HydrophobicContact CB-CD1 3.55Å; L1914-Y1919 HydrophobicContact CB-CD2 3.92Å; L1914-Y1919 HydrophobicContact CB-CE1 3.57Å; L1914-Y1919 HydrophobicContact CB-CE2 3.92Å; L1914-Y1919 HydrophobicContact CB-CG 3.74Å; L1914-Y1919 HydrophobicContact CD1-CD1 4.48Å; L1914-Y1919 PolarHBondContact N-OH 3.47Å; L1914-Y1919 VanDerWaalsContact O-CE2 3.23Å; L1914-Y1919 WeakPolarHBondContact O-CE2 3.34Å; L1914-Y1919 PolarHBondContact O-OH 2.94Å
1915	P	21.2	Very low	26.3	Very low	104 Å²	104	112 Å²	112	68%	0.675	59%	0.593	S	S	*	*			trans	-113.8	136.1	142	33.3	-33	0	0	0	114
1916	T	25.8	Very low	25.9	Very low	71 Å²	71	114.8 Å²	114.8	44%	0.436	60%	0.602	S	S	.	*	S	Bend	trans	-70.7	146.1	156.6	-101.1	0	0	0	0	106.1	D1918 Y1919	T1916-D1918 PolarHBondContact OG1-N 3.4Å; T1916-D1918 VanDerWaalsContact OG1-N 3.14Å; T1916-Y1919 WeakPolarHBondContact OG1-CD2 3.41Å; T1916-Y1919 PolarHBondContact OG1-N 2.92Å
1917	F	22.2	Very low	25.7	Very low	206 Å²	206	116.5 Å²	116.5	90%	0.904	62%	0.619	S	S	*	*	S	Bend	cis	-77.4	118.7	27.7	-74.7	-91.2	0	0	0	115.9
1918	D	28.7	Very low	25.5	Very low	147 Å²	147	121.1 Å²	121.1	79%	0.786	64%	0.643	S	S	*	*	S	Bend	trans	66.9	68.6	-175.8	-62.7	-9.5	0	0	0	118.4	T1916	T1916-D1918 PolarHBondContact OG1-N 3.4Å; T1916-D1918 VanDerWaalsContact OG1-N 3.14Å
1919	Y	22.2	Very low	25.4	Very low	79 Å²	79	128.8 Å²	128.8	31%	0.31	67%	0.669	S	S	.	*			trans	-47.9	171.2	135.8	-92.8	-100.7	0	0	0	112.2	S1913 L1914 T1916	S1913-Y1919 VanDerWaalsContact C-CE1 3.43Å; S1913-Y1919 WeakPolarHBondContact O-CE1 3.29Å; S1913-Y1919 PolarHBondContact O-OH 3.5Å; L1914-Y1919 HydrophobicContact CB-CD1 3.55Å; L1914-Y1919 HydrophobicContact CB-CD2 3.92Å; L1914-Y1919 HydrophobicContact CB-CE1 3.57Å; L1914-Y1919 HydrophobicContact CB-CE2 3.92Å; L1914-Y1919 HydrophobicContact CB-CG 3.74Å; L1914-Y1919 HydrophobicContact CD1-CD1 4.48Å; L1914-Y1919 PolarHBondContact N-OH 3.47Å; L1914-Y1919 VanDerWaalsContact O-CE2 3.23Å; L1914-Y1919 WeakPolarHBondContact O-CE2 3.34Å; L1914-Y1919 PolarHBondContact O-OH 2.94Å; T1916-Y1919 WeakPolarHBondContact OG1-CD2 3.41Å; T1916-Y1919 PolarHBondContact OG1-N 2.92Å
1920	L	23.1	Very low	25.3	Very low	148 Å²	148	133.9 Å²	133.9	78%	0.775	69%	0.69	S	S	*	*			trans	78.4	141.4	157.8	-58.5	123.7	0	0	0	118.3
1921	S	25.6	Very low	25.4	Very low	96 Å²	96	127.2 Å²	127.2	67%	0.671	67%	0.674	S	S	*	*			cis	-170.7	121.6	-20.6	49.4	0	0	0	0	111
1922	F	27.1	Very low	25.2	Very low	211 Å²	211	128.7 Å²	128.7	93%	0.925	70%	0.695	S	S	*	*			trans	-99.4	136.6	136.5	-89.9	-88.1	0	0	0	104.9
1923	P	26.4	Very low	25.2	Very low	102 Å²	102	129.6 Å²	129.6	66%	0.662	70%	0.695	S	S	*	*				-145.7	-163.4	82.2	25.5	-0.2	0	0	0	114.7
1924	H	22	Very low	24.9	Very low	175 Å²	175	131.2 Å²	131.2	81%	0.81	69%	0.692	S	S	*	*			trans	65.4	86.8	170.8	-64.9	-85.5	0	0	0	119.7
1925	S	24.2	Very low	24.7	Very low	113 Å²	113	131 Å²	131	79%	0.79	69%	0.691	S	S	*	*				-162.2	124.2	114.3	6.7	0	0	0	0	111.2
1926	E	22.6	Very low	24.9	Very low	201 Å²	201	130.6 Å²	130.6	94%	0.939	68%	0.676	S	S	*	*			trans	39.8	128.1	149.5	-60.5	172.3	-163.5	0	0	121.4
1927	G	24.9	Very low	24.8	Very low	78 Å²	78	132.3 Å²	132.3	80%	0.804	68%	0.681	S	S	*	*			trans	167.8	74.6	168.3	0	0	0	0	0	116.4
1928	H	23.6	Very low	25	Very low	171 Å²	171	130.1 Å²	130.1	79%	0.792	67%	0.668	S	S	*	*			trans	-56.4	168.4	175.4	-67.9	-77	0	0	0	115.6
1929	Y	23.8	Very low	24.9	Very low	201 Å²	201	130.3 Å²	130.3	79%	0.788	66%	0.663	S	S	*	*			trans	75.5	139.8	161.3	-63.5	-77.5	0	0	0	117.4
1930	H	24.7	Very low	25	Very low	175 Å²	175	136.8 Å²	136.8	81%	0.81	69%	0.688	S	S	*	*			cis	-170.7	171.8	-24.1	-142.5	-112.5	0	0	0	108.4
1931	G	26.5	Very low	25.2	Very low	54 Å²	54	132.5 Å²	132.5	56%	0.557	68%	0.679	S	S	*	*			trans	84.2	82.7	161.8	0	0	0	0	0	114
1932	S	25.2	Very low	25.2	Very low	98 Å²	98	137.7 Å²	137.7	69%	0.685	68%	0.684	S	S	*	*				69	149.3	73.8	84.2	0	0	0	0	113.7	Y1307	Y1307-S1932 PolarHBondContact OH-O 2.71Å
1933	Y	26	Very low	25	Very low	128 Å²	128	134 Å²	134	50%	0.502	67%	0.674	S	S	.	*			cis	-148.3	-70.2	21.9	-159.9	-179.3	0	0	0	115.4	Y1307 D1935 R1936	Y1307-Y1933 PolarHBondContact OH-N 3.33Å; Y1933-D1935 WeakPolarHBondContact O-CB 3.16Å; Y1933-D1935 PolarHBondContact O-N 3.23Å; Y1933-R1936 VanDerWaalsContact CE2-NH2 3.28Å; Y1933-R1936 PolarHBondContact OH-NH2 3.41Å
1934	Y	27.3	Very low	25	Very low	98 Å²	98	138.1 Å²	138.1	38%	0.384	68%	0.676	S	S	.	*			trans	-40.1	102.6	-173.3	22.7	-134.3	0	0	0	117	Y1307 D1308	Y1307-Y1934 AromaticContact CD1-CD2 3.61Å; Y1307-Y1934 HydrophobicContact CD1-CD2 3.61Å; Y1307-Y1934 AromaticContact CD1-CE2 3.63Å; Y1307-Y1934 HydrophobicContact CD1-CE2 3.63Å; Y1307-Y1934 AromaticContact CD2-CD2 3.82Å; Y1307-Y1934 HydrophobicContact CD2-CD2 3.82Å; Y1307-Y1934 HydrophobicContact CE1-CD2 4.06Å; Y1307-Y1934 HydrophobicContact CE1-CE2 4.17Å; Y1307-Y1934 HydrophobicContact CE2-CD2 4.26Å; Y1307-Y1934 AromaticContact CG-CD2 3.46Å; Y1307-Y1934 HydrophobicContact CG-CD2 3.46Å; Y1307-Y1934 VanDerWaalsContact CG-CD2 3.46Å; Y1307-Y1934 AromaticContact CG-CE2 3.88Å; Y1307-Y1934 HydrophobicContact CG-CE2 3.88Å; D1308-Y1934 HydrophobicContact CB-CD1 3.93Å; D1308-Y1934 HydrophobicContact CB-CD2 3.97Å; D1308-Y1934 HydrophobicContact CB-CE1 4.42Å; D1308-Y1934 HydrophobicContact CB-CE2 4.47Å; D1308-Y1934 HydrophobicContact CB-CG 3.69Å; D1308-Y1934 WeakPolarHBondContact OD2-CD1 3.28Å
1935	D	24.9	Very low	25.2	Very low	96 Å²	96	137.4 Å²	137.4	51%	0.513	68%	0.677	S	S	.	*			cis	74.6	156.3	12.1	-175	32.7	0	0	0	115.7	Y1933	Y1933-D1935 WeakPolarHBondContact O-CB 3.16Å; Y1933-D1935 PolarHBondContact O-N 3.23Å
1936	R	25.2	Very low	25.6	Very low	95 Å²	95	136.9 Å²	136.9	36%	0.358	67%	0.671	S	S	.	*			trans	60.1	106.4	169.7	-80	161.3	-121.8	175.9	1.9	117.8	D1308 Y1933	D1308-R1936 VanDerWaalsContact OD1-CB 3.29Å; D1308-R1936 WeakPolarHBondContact OD1-CB 3.46Å; Y1933-R1936 VanDerWaalsContact CE2-NH2 3.28Å; Y1933-R1936 PolarHBondContact OH-NH2 3.41Å
1937	M	25.2	Very low	25.6	Very low	107 Å²	107	132.7 Å²	132.7	53%	0.527	66%	0.659	S	S	.	*				174.6	150.9	69.1	-90.4	-111.8	164.8	0	0	110.9	F1309	F1309-M1937 HydrophobicContact CD1-CE 4.14Å; F1309-M1937 HydrophobicContact CD2-CE 3.94Å; F1309-M1937 HydrophobicContact CD2-CG 3.79Å; F1309-M1937 HydrophobicContact CD2-SD 3.79Å; F1309-M1937 HydrophobicContact CE1-CE 3.64Å; F1309-M1937 HydrophobicContact CE2-CE 3.45Å; F1309-M1937 VanDerWaalsContact CE2-CE 3.45Å; F1309-M1937 HydrophobicContact CE2-CG 3.88Å; F1309-M1937 HydrophobicContact CE2-SD 3.21Å; F1309-M1937 WeakPolarHBondContact CE2-SD 3.48Å; F1309-M1937 HydrophobicContact CG-CE 4.27Å; F1309-M1937 HydrophobicContact CZ-CE 3.26Å; F1309-M1937 HydrophobicContact CZ-SD 3.64Å
1938	Y	27	Very low	25.6	Very low	160 Å²	160	136.5 Å²	136.5	63%	0.627	66%	0.661	S	S	*	*			cis	-162.7	160.3	-20.8	-147.8	-96.1	0	0	0	109.3
1939	E	25.3	Very low	25.6	Very low	150 Å²	150	138.3 Å²	138.3	70%	0.701	66%	0.661	S	S	*	*			trans	-70.5	160.1	-178	-43.9	169.4	94.8	0	0	115
1940	R	25.3	Very low	25.7	Very low	216 Å²	216	134.2 Å²	134.2	82%	0.815	65%	0.652	S	S	*	*				158.9	138.1	124.6	-86.1	162.6	-179.5	-179.4	0.1	110.8
1941	G	26.7	Very low	25.7	Very low	57 Å²	57	132.9 Å²	132.9	59%	0.588	65%	0.646	S	S	*	*			trans	-161.2	-57.3	-179.1	0	0	0	0	0	116.9
1942	R	24.9	Very low	25.7	Very low	206 Å²	206	138.9 Å²	138.9	78%	0.777	66%	0.659	S	S	*	*			trans	59.8	110	175.8	-76.9	-169.9	173.6	171.4	-3.9	119.8
1943	N	24.3	Very low	25.7	Very low	134 Å²	134	136.5 Å²	136.5	72%	0.717	65%	0.65	S	S	*	*				86	145	124.2	-57.9	15.8	0	0	0	121.5
1944	R	26.3	Very low	25.7	Very low	188 Å²	188	135.9 Å²	135.9	71%	0.709	66%	0.664	S	S	*	*			trans	76.4	112.6	170.5	-57.8	-179.1	179	-171.8	-4.6	114.4
1945	L	25.5	Very low	25.5	Very low	160 Å²	160	137 Å²	137	84%	0.838	67%	0.669	S	S	*	*				70.5	145.9	50.9	-63.2	165	0	0	0	113.2
1946	P	31.5	Very low	25.4	Very low	102 Å²	102	143.6 Å²	143.6	66%	0.662	69%	0.686	S	S	*	*			cis	-138.6	-153.9	-28.1	35	-13.7	0	0	0	112.5
1947	T	24.2	Very low	25.5	Very low	113 Å²	113	143.6 Å²	143.6	69%	0.693	71%	0.707	S	S	*	*			trans	84.7	110.9	168.3	70.9	0	0	0	0	118.5
1948	N	23.8	Very low	25.8	Very low	158 Å²	158	144.4 Å²	144.4	85%	0.845	72%	0.72	S	S	*	*			trans	46.4	114.2	137.6	-50.7	-13	0	0	0	117
1949	R	24	Very low	25.7	Very low	209 Å²	209	143.7 Å²	143.7	79%	0.789	73%	0.727	S	S	*	*				-177.1	134.2	62.7	179.1	176.9	-163.9	156.4	4.8	112.3
1950	I	25.7	Very low	25.7	Very low	114 Å²	114	143.3 Å²	143.3	59%	0.585	73%	0.729	S	S	*	*			trans	55.7	103.9	164.6	-60.2	165.6	0	0	0	114.7	E2264	I1950-E2264 HydrophobicContact CD1-CG 4.38Å; I1950-E2264 WeakPolarHBondContact CD1-OE1 3.43Å
1951	Q	25.7	Very low	25.5	Very low	147 Å²	147	138.3 Å²	138.3	69%	0.687	72%	0.722	S	S	*	*			trans	-150.3	137.1	-179.7	-161.2	-173.3	-27.8	0	0	107.4
1952	H	24.9	Very low	25.4	Very low	181 Å²	181	144.7 Å²	144.7	84%	0.838	73%	0.73	S	S	*	*			trans	65.3	165.6	-175.1	-42.8	-77.9	0	0	0	113.8
1953	G	26.4	Very low	25.4	Very low	48 Å²	48	142 Å²	142	50%	0.495	72%	0.72	S	S	.	*			cis	-135.7	163.2	-11	0	0	0	0	0	109.8
1954	S	24.9	Very low	25.4	Very low	114 Å²	114	140.1 Å²	140.1	80%	0.797	71%	0.707	S	S	*	*			cis	94.6	53.7	36.4	-169	0	0	0	0	114.9
1955	Y	23.3	Very low	25.4	Very low	122 Å²	122	140.2 Å²	140.2	48%	0.478	71%	0.708	S	S	.	*			trans	-87	151.6	167.8	-87.9	-78.3	0	0	0	113.3	L2254 A2257 E2258	Y1955-L2254 HydrophobicContact CE1-CD2 4.4Å; Y1955-L2254 HydrophobicContact CE1-CG 4.08Å; Y1955-L2254 PolarHBondContact OH-O 3.14Å; Y1955-L2254 VanDerWaalsContact OH-O 3.11Å; Y1955-A2257 HydrophobicContact CD2-CB 4.45Å; Y1955-A2257 HydrophobicContact CE2-CB 3.53Å; Y1955-A2257 WeakPolarHBondContact OH-CB 3.15Å; Y1955-E2258 WeakPolarHBondContact OH-CG 3.46Å; Y1955-E2258 PolarHBondContact OH-N 3.37Å
1956	R	23.4	Very low	25.5	Very low	235 Å²	235	136.9 Å²	136.9	89%	0.887	70%	0.695	S	S	*	*			trans	-160.7	109.2	-168.9	-178.4	-172.6	-169.6	-174.8	2.8	110.9
1957	A	28.4	Very low	25.2	Very low	95 Å²	95	137.2 Å²	137.2	79%	0.785	70%	0.695	S	S	*	*			trans	66.8	173.3	180	0	0	0	0	0	113.3
1958	P	30.8	Very low	25.3	Very low	123 Å²	123	138.6 Å²	138.6	80%	0.799	70%	0.697	S	S	*	*			cis	-129.9	-135	8.4	44.1	-25.4	0	0	0	115.2
1959	D	24.1	Very low	25.4	Very low	145 Å²	145	135.8 Å²	135.8	78%	0.775	69%	0.688	S	S	*	*			trans	-91	170.2	-148	-71.4	-80.5	0	0	0	118.8
1960	L	25.2	Very low	25.4	Very low	143 Å²	143	131.8 Å²	131.8	75%	0.749	68%	0.683	S	S	*	*			trans	74.9	122.6	144.7	-110.3	78.8	0	0	0	122.6
1961	T	22	Very low	25.4	Very low	110 Å²	110	133.7 Å²	133.7	68%	0.675	69%	0.694	S	S	*	*			trans	63.1	130.8	143.2	43.7	0	0	0	0	122.3
1962	Y	23.5	Very low	25.4	Very low	191 Å²	191	133.4 Å²	133.4	75%	0.749	70%	0.696	S	S	*	*			trans	73.8	155.5	147.1	-87	-148.5	0	0	0	117.7
1963	R	25.9	Very low	25.5	Very low	151 Å²	151	130.7 Å²	130.7	57%	0.57	69%	0.687	S	S	*	*			cis	-177.6	159.1	-24.8	173.5	174.6	151.6	159.8	-5.9	108
1964	E	24.6	Very low	25.5	Very low	93 Å²	93	135 Å²	135	44%	0.435	70%	0.698	S	S	.	*			trans	67.1	158.8	160.8	-96.9	149.9	-176.2	0	0	116.8	T1966	E1964-T1966 HydrophobicContact CG-CG2 3.82Å
1965	Y	26.2	Very low	25.4	Very low	190 Å²	190	132.3 Å²	132.3	75%	0.745	68%	0.68	S	S	*	*			cis	-112.2	112.9	-10.2	-91	-91.4	0	0	0	107.8
1966	T	26.6	Very low	25.4	Very low	91 Å²	91	130.2 Å²	130.2	56%	0.558	68%	0.682	S	S	*	*				82.5	176.8	80.4	68.1	0	0	0	0	112.9	E1964	E1964-T1966 HydrophobicContact CG-CG2 3.82Å
1967	T	26.1	Very low	25.5	Very low	108 Å²	108	124.2 Å²	124.2	66%	0.663	67%	0.667	S	S	*	*			cis	-164.4	169.9	24.4	-18.8	0	0	0	0	111.8
1968	I	26.2	Very low	25.3	Very low	143 Å²	143	121.3 Å²	121.3	73%	0.733	64%	0.641	S	S	*	*			trans	70	118.6	153.7	-70.9	160	0	0	0	114.5
1969	C	26.5	Very low	25	Very low	98 Å²	98	124.5 Å²	124.5	66%	0.662	64%	0.638	S	S	*	*			cis	-133.4	145.4	0.5	-88.8	0	0	0	0	108.7
1970	D	23.8	Very low	25	Very low	126 Å²	126	122.7 Å²	122.7	67%	0.674	64%	0.635	S	S	*	*				66.7	129.5	67.3	-39.7	-17.6	0	0	0	110.7
1971	D	24.4	Very low	24.9	Very low	153 Å²	153	122.7 Å²	122.7	82%	0.818	64%	0.635	S	S	*	*			cis	-165	-172	7.8	-141.4	-22.1	0	0	0	111.5
1972	I	26.4	Very low	24.9	Very low	141 Å²	141	121.8 Å²	121.8	72%	0.723	63%	0.633	S	S	*	*			trans	92.5	109.8	163.3	-55.3	177	0	0	0	118.7
1973	D	26.5	Very low	25	Very low	124 Å²	124	118.6 Å²	118.6	66%	0.663	64%	0.636	S	S	*	*			trans	59.9	80.6	144.1	-56.1	-8.7	0	0	0	121.8
1974	L	26	Very low	25.1	Very low	138 Å²	138	114.8 Å²	114.8	72%	0.723	63%	0.626	S	S	*	*				-45.3	157.7	128.3	-101	73.7	0	0	0	112.9
1975	S	23.1	Very low	25.1	Very low	59 Å²	59	112.6 Å²	112.6	41%	0.413	62%	0.617	S	S	.	*				-174.1	54	103.5	43.2	0	0	0	0	118.2	E2129 L2130	S1975-E2129 WeakPolarHBondContact CA-OE2 3.35Å; S1975-E2129 PolarHBondContact N-OE2 3.18Å; S1975-E2129 VanDerWaalsContact O-CB 3.24Å; S1975-E2129 WeakPolarHBondContact O-CB 3.25Å; S1975-L2130 WeakPolarHBondContact O-CB 3.4Å; S1975-L2130 WeakPolarHBondContact O-CD1 3.48Å
1976	C	23.8	Very low	25	Very low	77 Å²	77	106.4 Å²	106.4	52%	0.52	60%	0.601	S	S	.	*			trans	61.8	84.8	145.8	-54.7	0	0	0	0	122.7	E2129 L2130	C1976-E2129 VanDerWaalsContact N-CB 3.32Å; C1976-E2129 PolarHBondContact N-OE2 3.18Å; C1976-L2130 VanDerWaalsContact O-CB 3.31Å; C1976-L2130 WeakPolarHBondContact O-CB 3.39Å
1977	L	24.5	Very low	24.9	Very low	110 Å²	110	104.4 Å²	104.4	58%	0.576	59%	0.59	S	S	*	*			trans	-99.9	-176.8	176.1	-128	-174.2	0	0	0	113.2	E2129	L1977-E2129 HydrophobicContact CB-CB 3.9Å; L1977-E2129 HydrophobicContact CB-CG 3.62Å; L1977-E2129 HydrophobicContact CG-CB 4.33Å; L1977-E2129 HydrophobicContact CG-CG 4.46Å; L1977-E2129 VanDerWaalsContact N-CG 3.3Å
1978	S	24.6	Very low	25	Very low	34 Å²	34	106.4 Å²	106.4	24%	0.238	60%	0.597	C	S	.	*			trans	-154.5	134.1	-177.7	51.2	0	0	0	0	112	Y2131	S1978-Y2131 WeakPolarHBondContact CB-OH 3.25Å; S1978-Y2131 VanDerWaalsContact OG-CD1 3.28Å; S1978-Y2131 WeakPolarHBondContact OG-CD1 3.33Å; S1978-Y2131 WeakPolarHBondContact OG-CD2 3.16Å; S1978-Y2131 WeakPolarHBondContact OG-CE1 3.35Å; S1978-Y2131 WeakPolarHBondContact OG-CE2 3.44Å
1979	Y	24.6	Very low	24.9	Very low	189 Å²	189	103 Å²	103	74%	0.741	60%	0.597	S	S	*	*				168.9	128.3	105.6	-104.1	-79.3	0	0	0	109.4	Y2131	Y1979-Y2131 HydrophobicContact CD2-CE1 4.42Å; Y1979-Y2131 HydrophobicContact CE2-CD1 4.43Å; Y1979-Y2131 AromaticContact CE2-CE1 3.63Å; Y1979-Y2131 HydrophobicContact CE2-CE1 3.63Å
1980	P	24.7	Very low	24.7	Very low	108 Å²	108	102.6 Å²	102.6	70%	0.701	60%	0.595	S	S	*	*			trans	-72.1	139.4	175.2	29.7	-34.8	0	0	0	111.3
1981	N	23.9	Very low	24.7	Very low	142 Å²	142	105.2 Å²	105.2	76%	0.759	60%	0.595	S	S	*	*			trans	-178.9	140.1	139.2	-106.8	-72.4	0	0	0	114
1982	S	22	Very low	24.6	Very low	91 Å²	91	106 Å²	106	64%	0.636	60%	0.598	S	S	*	*			trans	71.1	134.6	174.6	81.3	0	0	0	0	117.5
1983	P	24.9	Very low	24.4	Very low	125 Å²	125	103.2 Å²	103.2	81%	0.812	59%	0.585	S	S	*	*				-135.7	145.5	101.3	37.2	-27.8	0	0	0	114.1
1984	I	26.8	Very low	24.3	Very low	70 Å²	70	104.7 Å²	104.7	36%	0.359	59%	0.591	S	S	.	*			trans	-122.8	134.4	167.4	-75.2	-175.6	0	0	0	110.4	N491	N491-I1984 HydrophobicContact CB-CD1 4.39Å; N491-I1984 VanDerWaalsContact O-CD1 3.31Å; N491-I1984 WeakPolarHBondContact O-CD1 3.47Å
1985	M	25.7	Very low	24.2	Very low	47 Å²	47	102.9 Å²	102.9	23%	0.232	59%	0.586	C	S	.	*			trans	-77.8	132.6	-169.1	-0.2	73.4	136.3	0	0	114.5	R314 N525 N526	R314-M1985 PolarHBondContact NH2-O 3.14Å; R314-M1985 PolarHBondContact NH2-SD 3.34Å; N525-M1985 HydrophobicContact CB-CB 4.42Å; N526-M1985 HydrophobicContact CB-CE 4.17Å; N526-M1985 VanDerWaalsContact CG-CE 3.5Å; N526-M1985 WeakPolarHBondContact OD1-CE 3.19Å; N526-M1985 WeakPolarHBondContact OD1-CG 2.75Å
1986	S	24	Very low	24.2	Very low	61 Å²	61	105.4 Å²	105.4	43%	0.427	60%	0.603	S	S	.	*			trans	-135.9	66.3	162.8	77	0	0	0	0	114.1	R166 N1988	R166-S1986 PolarHBondContact NH2-OG 3.37Å; S1986-N1988 PolarHBondContact O-N 3.22Å
1987	P	24.9	Very low	24.1	Very low	49 Å²	49	107.9 Å²	107.9	32%	0.318	62%	0.615	S	S	.	*			trans	-74.1	106.8	158.3	30.6	-31.6	0	0	0	109.6	N525	N525-P1987 HydrophobicContact CB-CG 3.67Å
1988	N	27	Very low	24.1	Very low	150 Å²	150	105.6 Å²	105.6	80%	0.802	62%	0.619	S	S	*	*			trans	-165.5	141.3	149.2	-102.8	-52.9	0	0	0	110.4	S1986	S1986-N1988 PolarHBondContact O-N 3.22Å
1989	G	24.6	Very low	24.1	Very low	72 Å²	72	111 Å²	111	74%	0.742	64%	0.644	S	S	*	*			trans	-68.6	179.1	-161.6	0	0	0	0	0	116.7
1990	S	22.8	Very low	24	Very low	88 Å²	88	107 Å²	107	62%	0.615	63%	0.634	S	S	*	*				-172	177.5	54.4	56.7	0	0	0	0	114.9	K164	K164-S1990 PolarHBondContact NZ-O 2.98Å
1991	R	23	Very low	24	Very low	181 Å²	181	108.8 Å²	108.8	68%	0.683	63%	0.627	S	S	*	*			trans	59.1	121.7	164.9	-61.4	-176.8	146.3	136.9	-0.3	115.8	K164 D1993	K164-R1991 PolarHBondContact NZ-O 2.94Å; R1991-D1993 HydrophobicContact CB-CB 4.12Å; R1991-D1993 HydrophobicContact CG-CB 3.97Å; R1991-D1993 IonicContact CZ-OD2 2.65Å; R1991-D1993 IonicContact NE-OD2 2.74Å; R1991-D1993 PolarHBondContact NE-OD2 2.96Å; R1991-D1993 IonicContact NH2-OD2 2.62Å; R1991-D1993 PolarHBondContact NH2-OD2 3.38Å
1992	I	23.7	Very low	23.9	Very low	170 Å²	170	108 Å²	108	87%	0.872	62%	0.623	S	S	*	*			cis	-113.2	131.1	45	-58.3	165.3	0	0	0	109
1993	D	22.2	Very low	24	Very low	83 Å²	83	108.3 Å²	108.3	44%	0.444	62%	0.621	S	S	.	*			cis	77.2	68.8	17.6	-135.7	8.4	0	0	0	115.7	R1991	R1991-D1993 HydrophobicContact CB-CB 4.12Å; R1991-D1993 HydrophobicContact CG-CB 3.97Å; R1991-D1993 IonicContact CZ-OD2 2.65Å; R1991-D1993 IonicContact NE-OD2 2.74Å; R1991-D1993 PolarHBondContact NE-OD2 2.96Å; R1991-D1993 IonicContact NH2-OD2 2.62Å; R1991-D1993 PolarHBondContact NH2-OD2 3.38Å
1994	L	24.2	Very low	23.9	Very low	154 Å²	154	109 Å²	109	81%	0.806	62%	0.618	S	S	*	*				-179.8	98.2	129.7	-109.4	103.3	0	0	0	108.9
1995	T	22.5	Very low	23.9	Very low	100 Å²	100	113.1 Å²	113.1	61%	0.613	64%	0.64	S	S	*	*				51.2	107.7	85.9	71.7	0	0	0	0	116
1996	C	22.9	Very low	24	Very low	113 Å²	113	115.7 Å²	115.7	76%	0.764	66%	0.66	S	S	*	*				-177.8	125.6	115.7	-94.6	0	0	0	0	108.4
1997	V	23.4	Very low	24	Very low	128 Å²	128	117.7 Å²	117.7	78%	0.776	67%	0.67	S	S	*	*				59.4	104.2	72.6	179.9	0	0	0	0	110.8
1998	G	22.9	Very low	23.9	Very low	63 Å²	63	122 Å²	122	65%	0.649	69%	0.69	S	S	*	*			cis	-172.1	-141.4	-1.7	0	0	0	0	0	113.1
1999	L	24.7	Very low	23.7	Very low	148 Å²	148	120.3 Å²	120.3	78%	0.775	69%	0.685	S	S	*	*				51.9	127.1	82.8	-62.6	167.4	0	0	0	111.3
2000	I	23.5	Very low	23.7	Very low	105 Å²	105	121.2 Å²	121.2	54%	0.538	68%	0.677	S	S	.	*			cis	-168.2	143.9	33	-142.9	156	0	0	0	110.5
2001	R	23.3	Very low	23.8	Very low	144 Å²	144	120.3 Å²	120.3	54%	0.543	67%	0.665	S	S	.	*			trans	65.8	160.8	156.3	-71.5	173.3	-172.1	126.6	3.7	115.6	T1111	T1111-R2001 VanDerWaalsContact CB-NH2 3.34Å; T1111-R2001 VanDerWaalsContact CG2-NH2 3.26Å; T1111-R2001 PolarHBondContact O-NH2 2.83Å
2002	N	22.8	Very low	23.8	Very low	127 Å²	127	116 Å²	116	68%	0.679	65%	0.651	S	S	*	*			cis	-170.2	168.1	-2.2	-110.2	-1.6	0	0	0	106
2003	T	23.1	Very low	23.9	Very low	97 Å²	97	112.4 Å²	112.4	60%	0.595	63%	0.629	S	S	*	*			cis	-164.9	154.9	10.6	-0.3	0	0	0	0	109.8
2004	N	24.5	Very low	24	Very low	138 Å²	138	112.3 Å²	112.3	74%	0.738	63%	0.631	S	S	*	*			trans	71.4	128.5	161.9	-46.7	-29	0	0	0	115.1
2005	L	26.7	Very low	24	Very low	157 Å²	157	107.6 Å²	107.6	82%	0.822	61%	0.605	S	S	*	*			cis	74.4	124.1	41	-161.4	74.1	0	0	0	110.5
2006	P	27.7	Very low	24.1	Very low	102 Å²	102	110.9 Å²	110.9	66%	0.662	61%	0.613	S	S	*	*			cis	-147.5	174.7	47.2	42.6	-22.7	0	0	0	119.9
2007	T	23.4	Very low	24.4	Very low	102 Å²	102	109.7 Å²	109.7	63%	0.626	59%	0.593	S	S	*	*			trans	55.3	126.1	144.5	46	0	0	0	0	123.9
2008	D	23	Very low	24.4	Very low	140 Å²	140	108.9 Å²	108.9	75%	0.749	58%	0.584	S	S	*	*			trans	67	148.6	135.4	-49.8	-18.1	0	0	0	118.7
2009	T	23.5	Very low	24.7	Very low	114 Å²	114	108.5 Å²	108.5	70%	0.699	57%	0.57	S	S	*	*			cis	-162.8	161.6	-4.7	8.8	0	0	0	0	110.2
2010	T	24	Very low	24.6	Very low	92 Å²	92	104.8 Å²	104.8	56%	0.564	55%	0.55	S	S	*	*			trans	50.5	131.9	158	49.8	0	0	0	0	120.7	H2380	T2010-H2380 PolarHBondContact O-CE1 2.9Å; T2010-H2380 PolarHBondContact O-NE2 3.13Å
2011	L	25.1	Very low	24.6	Very low	68 Å²	68	104.1 Å²	104.1	36%	0.356	55%	0.551	S	S	.	*			cis	82.9	92.2	38.8	-162.5	171.8	0	0	0	115.8	L1170 H2380	L1170-L2011 HydrophobicContact CD1-CD2 3.87Å; L1170-L2011 HydrophobicContact CD2-CD2 4.29Å; L1170-L2011 HydrophobicContact CG-CD1 4.25Å; L1170-L2011 HydrophobicContact CG-CD2 4Å; L2011-H2380 PolarHBondContact N-CE1 3.11Å
2012	F	22.8	Very low	24.7	Very low	91 Å²	91	103.9 Å²	103.9	40%	0.399	55%	0.554	S	S	.	*			trans	-165.2	-166.6	135.7	-113.5	-63.5	0	0	0	113.7	L1170 H2379 H2380 D2381	L1170-F2012 HydrophobicContact CD1-CE2 4.31Å; L1170-F2012 HydrophobicContact CD1-CZ 3.97Å; L1170-F2012 HydrophobicContact CD2-CE2 3.67Å; L1170-F2012 HydrophobicContact CD2-CZ 4.08Å; F2012-H2379 WeakPolarHBondContact CA-ND1 3.29Å; F2012-H2379 CarbonylContact O-C 3.46Å; F2012-H2379 VanDerWaalsContact O-C 3.3Å; F2012-H2379 VanDerWaalsContact O-CA 3.31Å; F2012-H2379 WeakPolarHBondContact O-CA 3.42Å; F2012-H2379 WeakPolarHBondContact O-CB 3.21Å; F2012-H2379 PolarHBondContact O-ND1 3.07Å; F2012-H2380 WeakPolarHBondContact O-CA 3.2Å; F2012-H2380 PolarHBondContact O-N 2.92Å; F2012-D2381 WeakPolarHBondContact CB-OD1 2.98Å; F2012-D2381 WeakPolarHBondContact CB-OD2 3.47Å
2013	K	25.3	Very low	24.8	Very low	95 Å²	95	107.2 Å²	107.2	41%	0.413	56%	0.558	S	S	.	*			trans	-118.3	135.4	-150.6	-148	-160	-172.6	-153	0	118.1	D2376 I2378 H2380	K2013-D2376 PolarHBondContact NZ-O 2.98Å; K2013-D2376 VanDerWaalsContact NZ-O 3.12Å; K2013-D2376 IonicContact NZ-OD2 3.16Å; K2013-D2376 PolarHBondContact NZ-OD2 2.99Å; K2013-I2378 WeakPolarHBondContact CE-O 3.33Å; K2013-I2378 WeakPolarHBondContact CG-O 3.5Å; K2013-H2380 CarbonylContact C-O 3.58Å; K2013-H2380 VanDerWaalsContact O-O 3.06Å
2014	T	23.8	Very low	24.7	Very low	80 Å²	80	108.2 Å²	108.2	49%	0.491	56%	0.556	S	S	.	*			trans	-151.6	151.1	156.2	38.1	0	0	0	0	108.2	H2380	T2014-H2380 WeakPolarHBondContact CB-O 3.37Å; T2014-H2380 WeakPolarHBondContact CG2-O 3.32Å; T2014-H2380 VanDerWaalsContact N-N 3.19Å; T2014-H2380 PolarHBondContact N-O 3.15Å; T2014-H2380 PolarHBondContact OG1-N 3.39Å; T2014-H2380 VanDerWaalsContact OG1-N 3.15Å; T2014-H2380 PolarHBondContact OG1-O 2.79Å
2015	K	25.3	Very low	24.6	Very low	56 Å²	56	106.6 Å²	106.6	24%	0.243	55%	0.547	C	S	.	.			trans	-161.9	104.2	162.8	-177.7	169.2	167.1	-53.6	0	108.8	D2376	K2015-D2376 WeakPolarHBondContact CD-OD1 3.38Å; K2015-D2376 WeakPolarHBondContact CE-OD1 3.25Å; K2015-D2376 WeakPolarHBondContact CG-OD1 3.36Å; K2015-D2376 IonicContact NZ-OD1 3.72Å; K2015-D2376 PolarHBondContact NZ-OD1 2.94Å
2016	E	23.8	Very low	24.6	Very low	169 Å²	169	104.1 Å²	104.1	79%	0.79	54%	0.539	S	S	*	.			trans	-146.3	115.2	171.8	-84.3	151.8	170.9	0	0	100.5
2017	Y	29.4	Very low	24.3	Very low	87 Å²	87	104.7 Å²	104.7	34%	0.341	54%	0.543	S	S	.	.				42.5	80.9	64.5	-82.7	-44.2	0	0	0	111	E2474 E2475	Y2017-E2474 WeakPolarHBondContact CA-OE2 3.48Å; Y2017-E2474 HydrophobicContact CD1-CG 3.53Å; Y2017-E2474 WeakPolarHBondContact CD1-OE1 3.25Å; Y2017-E2474 HydrophobicContact CE1-CG 3.72Å; Y2017-E2474 WeakPolarHBondContact CE1-OE1 3.49Å; Y2017-E2474 PolarHBondContact N-OE2 3.28Å; Y2017-E2474 VanDerWaalsContact N-OE2 3.12Å; Y2017-E2475 VanDerWaalsContact CB-CD 3.45Å; Y2017-E2475 VanDerWaalsContact CD1-CD 3.41Å; Y2017-E2475 HydrophobicContact CD1-CG 3.47Å; Y2017-E2475 VanDerWaalsContact CD1-CG 3.47Å; Y2017-E2475 WeakPolarHBondContact CD1-OE1 3.34Å; Y2017-E2475 HydrophobicContact CE1-CG 4.33Å; Y2017-E2475 HydrophobicContact CG-CG 4.2Å
2018	L	24.6	Very low	24.2	Very low	111 Å²	111	107 Å²	107	58%	0.581	54%	0.544	S	S	*	.			trans	-172.5	176.7	152.1	-123.9	90.6	0	0	0	109.7
2019	P	27.4	Very low	24.7	Very low	56 Å²	56	106.6 Å²	106.6	36%	0.364	54%	0.541	S	S	.	.				-130.1	-173	-102.9	36.9	-15.3	0	0	0	117.6	E2474 E2475	P2019-E2474 CarbonylContact C-O 3.54Å; P2019-E2474 VanDerWaalsContact CA-O 3.27Å; P2019-E2474 WeakPolarHBondContact CA-O 3.42Å; P2019-E2475 WeakPolarHBondContact CA-O 3.1Å; P2019-E2475 HydrophobicContact CB-CB 3.69Å; P2019-E2475 WeakPolarHBondContact CB-O 3.49Å
2020	I	23.8	Very low	24.7	Very low	70 Å²	70	106.7 Å²	106.7	36%	0.359	54%	0.543	S	S	.	.			trans	75.6	93.3	153.7	-43.4	-169.3	0	0	0	118.2	F2356 E2474 E2475	I2020-F2356 HydrophobicContact CB-CD1 4.24Å; I2020-F2356 HydrophobicContact CB-CE1 3.98Å; I2020-F2356 HydrophobicContact CB-CZ 4.43Å; I2020-F2356 HydrophobicContact CD1-CB 4.33Å; I2020-F2356 HydrophobicContact CD1-CD1 3.46Å; I2020-F2356 VanDerWaalsContact CD1-CD1 3.46Å; I2020-F2356 HydrophobicContact CD1-CE1 4.11Å; I2020-F2356 HydrophobicContact CD1-CG 3.89Å; I2020-F2356 HydrophobicContact CG1-CD1 3.45Å; I2020-F2356 VanDerWaalsContact CG1-CD1 3.45Å; I2020-F2356 HydrophobicContact CG1-CE1 3.57Å; I2020-F2356 HydrophobicContact CG1-CG 4.29Å; I2020-F2356 HydrophobicContact CG1-CZ 4.46Å; I2020-F2356 HydrophobicContact CG2-CD1 4.03Å; I2020-F2356 HydrophobicContact CG2-CD2 4.32Å; I2020-F2356 HydrophobicContact CG2-CE1 3.83Å; I2020-F2356 HydrophobicContact CG2-CE2 4.11Å; I2020-F2356 HydrophobicContact CG2-CG 4.31Å; I2020-F2356 HydrophobicContact CG2-CZ 3.89Å; I2020-E2474 PolarHBondContact N-O 3.37Å; I2020-E2475 PolarHBondContact N-O 3.46Å
2021	T	24.2	Very low	24.7	Very low	90 Å²	90	109.1 Å²	109.1	55%	0.552	55%	0.551	S	S	*	*			trans	67.8	-170	142.7	80	0	0	0	0	115.1	F2356	T2021-F2356 HydrophobicContact CG2-CE1 4.27Å; T2021-F2356 HydrophobicContact CG2-CE2 3.58Å; T2021-F2356 HydrophobicContact CG2-CZ 3.32Å
2022	K	24	Very low	24.5	Very low	139 Å²	139	112.9 Å²	112.9	60%	0.604	57%	0.567	S	S	*	*			cis	-137	161.4	8	-126.4	146.1	-165.6	174.5	0	109.6	E2351	K2022-E2351 IonicContact NZ-OE1 3.86Å; K2022-E2351 PolarHBondContact NZ-OE1 2.89Å
2023	Y	25.2	Very low	24.5	Very low	197 Å²	197	113.6 Å²	113.6	77%	0.773	58%	0.575	S	S	*	*			trans	-8.5	147.9	134.6	-70.9	-88.9	0	0	0	114.5
2024	Q	21.6	Very low	24.4	Very low	118 Å²	118	115.5 Å²	115.5	55%	0.551	59%	0.588	S	S	*	*				-176.1	177	53.3	-138.3	149.6	39.4	0	0	110.1	L2347	Q2024-L2347 HydrophobicContact CG-CD2 4.32Å
2025	N	21	Very low	24.4	Very low	104 Å²	104	116.8 Å²	116.8	56%	0.556	60%	0.596	S	S	*	*			trans	57	101.1	151.5	-60.1	-24.1	0	0	0	116.4
2026	V	26.7	Very low	24.3	Very low	105 Å²	105	120.5 Å²	120.5	64%	0.636	62%	0.619	S	S	*	*				46.5	111.9	56.2	-157.4	0	0	0	0	111.2	F2028	V2026-F2028 HydrophobicContact CG1-CD2 3.61Å; V2026-F2028 HydrophobicContact CG1-CE2 3.88Å
2027	P	21.9	Very low	24.2	Very low	115 Å²	115	123.4 Å²	123.4	75%	0.747	62%	0.623	S	S	*	*				-116.4	146.9	111	37.7	-37.3	0	0	0	109.6
2028	F	20.8	Very low	24.3	Very low	151 Å²	151	124.1 Å²	124.1	66%	0.662	64%	0.638	S	S	*	*				54.7	124.8	60.2	-69.8	-78	0	0	0	111.1	V2026	V2026-F2028 HydrophobicContact CG1-CD2 3.61Å; V2026-F2028 HydrophobicContact CG1-CE2 3.88Å
2029	I	33.6	Very low	24.3	Very low	131 Å²	131	124.3 Å²	124.3	67%	0.672	64%	0.643	S	S	*	*				42.8	112.8	89	-52.2	-176.3	0	0	0	109.9	I2031	I2029-I2031 HydrophobicContact CG2-CD1 4.19Å; I2029-I2031 HydrophobicContact CG2-CG1 4.4Å
2030	P	25	Very low	24.2	Very low	116 Å²	116	127.6 Å²	127.6	75%	0.753	66%	0.658	S	S	*	*				-122.9	165.9	52.5	8.1	17.6	0	0	0	114.1
2031	I	22.5	Very low	24.2	Very low	143 Å²	143	131.2 Å²	131.2	73%	0.733	67%	0.673	S	S	*	*				71.4	105.9	55.7	-50.8	173.9	0	0	0	113.7	I2029	I2029-I2031 HydrophobicContact CG2-CD1 4.19Å; I2029-I2031 HydrophobicContact CG2-CG1 4.4Å
2032	E	22.1	Very low	24.2	Very low	146 Å²	146	133.3 Å²	133.3	68%	0.682	68%	0.679	S	S	*	*			trans	61.2	135.8	152.5	-65.5	-152.6	157.9	0	0	126.4
2033	N	23	Very low	24.3	Very low	106 Å²	106	134 Å²	134	57%	0.567	69%	0.688	S	S	*	*			trans	72.7	145.2	133.5	-77.9	-34.7	0	0	0	124.7
2034	I	23.3	Very low	24.5	Very low	136 Å²	136	129.7 Å²	129.7	70%	0.697	68%	0.684	S	S	*	*			trans	45.1	119.5	134.1	-61.8	169.6	0	0	0	117.5
2035	T	22.8	Very low	24.7	Very low	107 Å²	107	128.7 Å²	128.7	66%	0.656	69%	0.69	S	S	*	*			cis	-164.6	177.1	7	11.4	0	0	0	0	112.3
2036	N	23.1	Very low	24.8	Very low	134 Å²	134	129 Å²	129	72%	0.717	70%	0.699	S	S	*	*			trans	33.9	121.9	141.3	-60	-27.9	0	0	0	121.2
2037	R	22.7	Very low	24.8	Very low	230 Å²	230	131.9 Å²	131.9	87%	0.868	71%	0.708	S	S	*	*				37.8	153	113	-77.3	-177.6	170.3	-175.5	-3.3	120.1
2038	P	31.7	Very low	25.2	Very low	102 Å²	102	129.6 Å²	129.6	66%	0.662	70%	0.699	S	S	*	*			cis	-148.3	-172.6	-21	38.6	-17.4	0	0	0	115.4
2039	V	23.5	Very low	25.5	Very low	114 Å²	114	128 Å²	128	69%	0.691	70%	0.701	S	S	*	*			trans	70.1	138.8	140.2	153.7	0	0	0	0	119.6
2040	N	25.2	Very low	25.2	Very low	126 Å²	126	128.4 Å²	128.4	67%	0.674	71%	0.705	S	S	*	*			trans	67.1	159.7	166.9	-69.2	-7.2	0	0	0	117.1
2041	Q	25	Very low	25.2	Very low	146 Å²	146	127.5 Å²	127.5	68%	0.682	70%	0.702	S	S	*	*			cis	-159.6	148.7	-26.4	-109.9	164.2	-20	0	0	109.4
2042	I	23.7	Very low	25.6	Very low	133 Å²	133	127.2 Å²	127.2	68%	0.682	70%	0.702	S	S	*	*			trans	43.8	107	137.1	-55.8	168	0	0	0	118.5
2043	I	26	Very low	25.8	Very low	153 Å²	153	125.6 Å²	125.6	79%	0.785	70%	0.702	S	S	*	*				39.3	132.5	114.7	-62.1	162.9	0	0	0	117.2
2044	P	28.7	Very low	26	Very low	107 Å²	107	124 Å²	124	70%	0.695	70%	0.703	S	S	*	*			cis	-144.5	-178.5	29.7	44.2	-25.3	0	0	0	118
2045	S	26.3	Very low	26.1	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	71%	0.708	S	S	*	*			trans	19.4	152	138.9	73.2	0	0	0	0	125.2
2046	C	24.2	Very low	26.2	Very low	110 Å²	110	125.4 Å²	125.4	74%	0.743	71%	0.705	S	S	*	*			trans	87.1	125.9	138.8	-77.8	0	0	0	0	121.1
2047	M	26.8	Very low	26.4	Very low	167 Å²	167	123.2 Å²	123.2	82%	0.823	71%	0.706	S	S	*	*			trans	59.8	120	130.5	-59.5	-161	80.5	0	0	121.7
2048	A	30.2	Very low	26.5	Very low	66 Å²	66	117.7 Å²	117.7	55%	0.545	70%	0.698	S	S	.	*				70.9	-179.8	125.6	0	0	0	0	0	118.3
2049	T	27.2	Very low	26.3	Very low	118 Å²	118	117.3 Å²	117.3	72%	0.724	70%	0.703	S	S	*	*			trans	56.9	72.5	-172.8	56.4	0	0	0	0	111.7
2050	D	27	Very low	26.5	Very low	139 Å²	139	120.9 Å²	120.9	74%	0.743	71%	0.709	S	S	*	*				66.3	155.3	75.1	-66.7	-72.3	0	0	0	113.3
2051	S	25.3	Very low	26.6	Very low	98 Å²	98	119.6 Å²	119.6	69%	0.685	72%	0.716	S	S	*	*			trans	74.2	128.8	166.9	96.9	0	0	0	0	112.5
2052	N	29.2	Very low	26.6	Very low	137 Å²	137	117.5 Å²	117.5	73%	0.733	72%	0.718	S	S	*	*	S	Bend	cis	-156.8	143.1	15.7	-96.7	-42.9	0	0	0	111.2
2053	T	27.7	Very low	26.6	Very low	112 Å²	112	119.1 Å²	119.1	69%	0.687	73%	0.727	S	S	*	*			cis	-164.4	163.1	-16.3	-14.9	0	0	0	0	112.1
2054	A	26.2	Very low	26.9	Very low	72 Å²	72	119.5 Å²	119.5	60%	0.595	73%	0.726	S	S	*	*			trans	61.4	-163.3	143.1	0	0	0	0	0	117.2
2055	I	25.6	Very low	27.1	Very low	154 Å²	154	119.2 Å²	119.2	79%	0.79	72%	0.723	S	S	*	*			trans	45.9	66	-177.1	-49.1	-173.4	0	0	0	110.9
2056	I	25.2	Very low	27.3	Very low	118 Å²	118	123.4 Å²	123.4	61%	0.605	73%	0.729	S	S	*	*				44.7	92.5	58.6	-58.2	175.9	0	0	0	108.4	T2058	I2056-T2058 VanDerWaalsContact CG2-OG1 3.29Å; I2056-T2058 WeakPolarHBondContact CG2-OG1 3.44Å
2057	A	27.1	Very low	27.5	Very low	88 Å²	88	123.2 Å²	123.2	73%	0.727	73%	0.73	S	S	*	*				59.2	177.4	66.3	0	0	0	0	0	112.9
2058	T	25.2	Very low	27.8	Very low	115 Å²	115	118.9 Å²	118.9	71%	0.706	72%	0.72	S	S	*	*			trans	55.8	79.9	172.7	61.2	0	0	0	0	116.8	I2056	I2056-T2058 VanDerWaalsContact CG2-OG1 3.29Å; I2056-T2058 WeakPolarHBondContact CG2-OG1 3.44Å
2059	A	27.4	Very low	27.8	Very low	93 Å²	93	121.3 Å²	121.3	77%	0.769	73%	0.73	S	S	*	*			trans	67.4	-176.2	135.8	0	0	0	0	0	115.6
2060	K	28.5	Very low	27.6	Very low	189 Å²	189	119.4 Å²	119.4	82%	0.822	73%	0.726	S	S	*	*			cis	-160.6	130.6	14.3	-154	161	-170.2	169.5	0	110.7
2061	A	26.4	Very low	27.6	Very low	100 Å²	100	118.8 Å²	118.8	83%	0.826	73%	0.728	S	S	*	*			trans	53.9	-156.9	172.9	0	0	0	0	0	113.8
2062	S	24.1	Very low	27.9	Very low	102 Å²	102	118.3 Å²	118.3	71%	0.713	72%	0.722	S	S	*	*			trans	60	80.8	-177.3	-61.9	0	0	0	0	114.3
2063	L	25.1	Very low	28	Very low	167 Å²	167	121.1 Å²	121.1	87%	0.874	73%	0.728	S	S	*	*				81	135.6	86.2	-92.1	74.9	0	0	0	114.3
2064	E	30.8	Very low	28	Very low	161 Å²	161	121.4 Å²	121.4	75%	0.752	72%	0.722	S	S	*	*			trans	-40.1	158.5	155.6	-64.7	-165.2	153.4	0	0	113.6
2065	P	33.1	Very low	27.9	Very low	100 Å²	100	124.2 Å²	124.2	65%	0.649	72%	0.722	S	S	*	*			cis	-158.1	155.1	41.3	41	-18.7	0	0	0	121.8
2066	K	31.2	Very low	27.9	Very low	185 Å²	185	126.3 Å²	126.3	80%	0.804	72%	0.72	S	S	*	*			trans	60.5	153.2	138.4	-64.4	164	-170.8	165.7	0	118.9
2067	S	27.3	Very low	28	Very low	107 Å²	107	124 Å²	124	75%	0.748	72%	0.719	S	S	*	*			cis	-134.9	128.7	5.4	49.9	0	0	0	0	110.1
2068	A	34.1	Very low	27.8	Very low	75 Å²	75	125.7 Å²	125.7	62%	0.62	72%	0.715	S	S	*	*				84.1	147.4	53.7	0	0	0	0	0	113.5	A2070	A2068-A2070 HydrophobicContact CB-CB 4.4Å
2069	P	29.3	Very low	27.8	Very low	118 Å²	118	123.8 Å²	123.8	77%	0.766	70%	0.7	S	S	*	*			cis	-76.9	145.6	-1.4	37.2	-37.2	0	0	0	110.7
2070	A	24.1	Very low	27.6	Very low	77 Å²	77	124.5 Å²	124.5	64%	0.636	69%	0.686	S	S	*	*			cis	68	161	34.4	0	0	0	0	0	113.6	A2068	A2068-A2070 HydrophobicContact CB-CB 4.4Å
2071	T	27.3	Very low	27.3	Very low	126 Å²	126	121.5 Å²	121.5	77%	0.773	68%	0.675	S	S	*	*			trans	67.4	147.4	171.6	60.4	0	0	0	0	115.4
2072	P	32.1	Very low	27.3	Very low	88 Å²	88	120.7 Å²	120.7	57%	0.571	66%	0.663	S	S	*	*				-137.8	-164.6	-83.8	24.2	1.1	0	0	0	112.9	E2074	P2072-E2074 PolarHBondContact O-N 2.72Å
2073	K	30.5	Very low	27.3	Very low	196 Å²	196	119.8 Å²	119.8	85%	0.852	66%	0.657	S	S	*	*				-22.2	120.9	125.8	-27.4	165.9	179.4	-178.7	0	112
2074	E	27.1	Very low	27.3	Very low	119 Å²	119	116.6 Å²	116.6	56%	0.556	64%	0.64	S	S	*	*			trans	-151.7	112.6	132.1	-106.2	150.7	-150.3	0	0	103.3	P2072 N2312	P2072-E2074 PolarHBondContact O-N 2.72Å; E2074-N2312 PolarHBondContact OE2-ND2 2.85Å
2075	E	25.2	Very low	27	Very low	130 Å²	130	112.5 Å²	112.5	61%	0.607	62%	0.623	S	S	*	*				59.5	121	91.2	-83.1	-151.8	149.9	0	0	112.5
2076	R	24.7	Very low	26.5	Very low	199 Å²	199	111.8 Å²	111.8	75%	0.751	61%	0.611	S	S	*	*			trans	70.1	158	141.4	-64.8	175.2	163	119	10.8	117.9
2077	A	26.7	Very low	26.1	Very low	69 Å²	69	109.2 Å²	109.2	57%	0.57	61%	0.606	S	S	*	*			trans	62.7	108.7	133.7	0	0	0	0	0	118.5
2078	L	24.1	Very low	26	Very low	123 Å²	123	106.9 Å²	106.9	64%	0.644	60%	0.599	S	S	*	*				76.6	97.3	117	-64.7	179.7	0	0	0	116.3
2079	L	23.9	Very low	25.5	Very low	76 Å²	76	109.2 Å²	109.2	40%	0.398	61%	0.606	S	S	.	*				94	130.4	120.9	-64.6	166	0	0	0	114.5	K2308	L2079-K2308 HydrophobicContact CB-CG 3.94Å; L2079-K2308 WeakPolarHBondContact O-CE 3.44Å
2080	F	23.6	Very low	25.4	Very low	108 Å²	108	111.4 Å²	111.4	47%	0.474	61%	0.606	S	S	.	*			trans	76.1	112.5	133.2	-85.6	-134.6	0	0	0	113.8	K2308	F2080-K2308 HydrophobicContact CB-CD 4.42Å; F2080-K2308 WeakPolarHBondContact O-CE 3.12Å; F2080-K2308 PolarHBondContact O-NZ 3.28Å
2081	Q	23.2	Very low	25.3	Very low	126 Å²	126	118.6 Å²	118.6	59%	0.589	62%	0.616	S	S	*	*				57.5	131.4	103.4	-73.2	-174.1	-13	0	0	117.2	K2308	Q2081-K2308 PolarHBondContact O-NZ 3.31Å; Q2081-K2308 VanDerWaalsContact O-NZ 3.12Å
2082	S	26.5	Very low	25.1	Very low	82 Å²	82	115.1 Å²	115.1	57%	0.573	60%	0.597	S	S	*	*			cis	172.9	-177.2	-11.6	39.5	0	0	0	0	105.3
2083	S	22.9	Very low	24.7	Very low	84 Å²	84	117.8 Å²	117.8	59%	0.587	60%	0.602	S	S	*	*			trans	70.9	170.9	132	66.4	0	0	0	0	117.3
2084	I	26	Very low	24.3	Very low	100 Å²	100	111.9 Å²	111.9	51%	0.513	59%	0.586	S	S	.	*			trans	51.3	107.6	134.6	-75	165.2	0	0	0	113.7	T2331	I2084-T2331 PolarHBondContact O-N 3.46Å
2085	N	24.1	Very low	24.2	Very low	75 Å²	75	113.8 Å²	113.8	40%	0.401	60%	0.599	S	S	.	*			cis	-175.8	178.1	37.9	-137.1	3.4	0	0	0	113.4	E2332	N2085-E2332 WeakPolarHBondContact O-CG 3.19Å
2086	E	22	Very low	24.1	Very low	84 Å²	84	111 Å²	111	39%	0.393	60%	0.598	S	S	.	*			trans	72	161.6	138.6	-79.7	170.5	-105	0	0	119.4	T2331	E2086-T2331 HydrophobicContact CB-CG2 3.8Å; E2086-T2331 HydrophobicContact CG-CG2 4.43Å
2087	N	22.9	Very low	24	Very low	131 Å²	131	107.1 Å²	107.1	70%	0.701	60%	0.597	S	S	*	*			cis	-143.1	157.4	-16.4	-137.9	-37.2	0	0	0	111.6
2088	G	24.9	Very low	23.8	Very low	58 Å²	58	110.7 Å²	110.7	60%	0.598	61%	0.606	S	S	*	*			trans	105.6	136.7	160.9	0	0	0	0	0	115.3
2089	T	24.8	Very low	23.9	Very low	125 Å²	125	111.8 Å²	111.8	77%	0.767	61%	0.607	S	S	*	*			cis	-149.2	139.6	12.8	35.7	0	0	0	0	114.4
2090	Q	26.6	Very low	24	Very low	164 Å²	164	112.8 Å²	112.8	77%	0.766	62%	0.616	S	S	*	*			trans	73.2	133.1	149.4	-67.1	176.2	26.9	0	0	115.9
2091	R	23.3	Very low	24	Very low	227 Å²	227	114.4 Å²	114.4	86%	0.857	63%	0.63	S	S	*	*				56.7	140.4	63.1	-71.2	-179.6	171.5	174.2	-3.2	111.9
2092	S	22.4	Very low	24	Very low	54 Å²	54	114.2 Å²	114.2	38%	0.378	64%	0.638	S	S	.	*			cis	-179	160.9	-13.6	49	0	0	0	0	107.4	F1878	F1878-S2092 VanDerWaalsContact CE1-C 3.43Å
2093	Q	24.4	Very low	23.9	Very low	143 Å²	143	119.3 Å²	119.3	67%	0.668	65%	0.649	S	S	*	*			trans	68.5	149.1	161.7	-61.7	152.3	-4.7	0	0	116.2	F1878	F1878-Q2093 VanDerWaalsContact CD2-O 3.29Å; F1878-Q2093 WeakPolarHBondContact CD2-O 3.1Å; F1878-Q2093 WeakPolarHBondContact CE2-O 3.08Å; F1878-Q2093 WeakPolarHBondContact CZ-O 3.4Å
2094	S	22	Very low	23.9	Very low	73 Å²	73	120.4 Å²	120.4	51%	0.51	66%	0.657	S	S	.	*			cis	-178.3	-179	-20.1	52.7	0	0	0	0	109.6
2095	L	24.6	Very low	23.8	Very low	158 Å²	158	122.3 Å²	122.3	83%	0.827	67%	0.667	S	S	*	*			trans	-53.1	137.7	140.8	-85.8	160.3	0	0	0	109.4
2096	A	23.1	Very low	23.8	Very low	73 Å²	73	124.2 Å²	124.2	60%	0.603	68%	0.677	S	S	*	*			cis	-148.1	172.6	-5.9	0	0	0	0	0	105.4
2097	T	22.4	Very low	23.8	Very low	117 Å²	117	126.9 Å²	126.9	72%	0.718	69%	0.69	S	S	*	*				-171.9	159.7	55	37.9	0	0	0	0	109.2
2098	L	22.4	Very low	23.8	Very low	144 Å²	144	128.2 Å²	128.2	75%	0.754	69%	0.692	S	S	*	*			trans	39.7	132.5	148	-76.3	79.6	0	0	0	118.2
2099	H	26.1	Very low	23.6	Very low	145 Å²	145	130.1 Å²	130.1	67%	0.671	70%	0.696	S	S	*	*				-164.2	137.8	57.1	-138.6	-80.5	0	0	0	111.7
2100	T	25	Very low	23.5	Very low	97 Å²	97	132.2 Å²	132.2	60%	0.595	70%	0.697	S	S	*	*			trans	52.3	119.9	150.7	40.3	0	0	0	0	119.4
2101	N	23.9	Very low	23.3	Very low	143 Å²	143	132.5 Å²	132.5	77%	0.765	70%	0.7	S	S	*	*				66.2	140.2	87.7	-64.2	-11.2	0	0	0	113.7
2102	T	24.8	Very low	23.6	Very low	121 Å²	121	126.4 Å²	126.4	74%	0.742	69%	0.69	S	S	*	*			cis	-153.2	164.3	18.1	-18.3	0	0	0	0	113
2103	K	23.4	Very low	23.5	Very low	189 Å²	189	129.3 Å²	129.3	82%	0.822	71%	0.705	S	S	*	*			trans	-34.8	173.1	148.6	-52.5	172	175.7	-178.9	0	114.5
2104	S	23	Very low	23.4	Very low	108 Å²	108	131 Å²	131	76%	0.755	71%	0.71	S	S	*	*			trans	107.9	146.1	151.7	83.9	0	0	0	0	115.2
2105	I	24.6	Very low	23.4	Very low	140 Å²	140	133.9 Å²	133.9	72%	0.718	72%	0.715	S	S	*	*			cis	-152.3	149.9	-15.3	-121.4	166.1	0	0	0	108.6
2106	D	22.9	Very low	23.3	Very low	115 Å²	115	135.7 Å²	135.7	62%	0.615	71%	0.713	S	S	*	*			trans	26.9	160.5	155.1	-52.7	-1.6	0	0	0	124.7
2107	Q	23.3	Very low	23.3	Very low	140 Å²	140	137.1 Å²	137.1	65%	0.654	71%	0.714	S	S	*	*			trans	81.6	120.9	136.8	-84.4	161.1	74.8	0	0	120.1
2108	Q	22.1	Very low	23.3	Very low	158 Å²	158	135.2 Å²	135.2	74%	0.738	71%	0.706	S	S	*	*			trans	75.9	105.9	133.3	-67	173.6	11.9	0	0	120
2109	S	21.1	Very low	23.4	Very low	98 Å²	98	138 Å²	138	69%	0.685	71%	0.708	S	S	*	*				101.9	149.5	117.7	80.6	0	0	0	0	119.4
2110	H	23	Very low	23.4	Very low	170 Å²	170	136.5 Å²	136.5	79%	0.787	70%	0.704	S	S	*	*			trans	57.5	116.3	163.7	-61.3	-67.8	0	0	0	120
2111	M	22.5	Very low	23.4	Very low	170 Å²	170	137 Å²	137	84%	0.837	71%	0.707	S	S	*	*				16.7	147.2	108.1	-78.8	-89.3	-172.7	0	0	118.1
2112	P	28.2	Very low	23.5	Very low	99 Å²	99	136.6 Å²	136.6	64%	0.643	71%	0.705	S	S	*	*			cis	-143.2	-176.1	11.3	39.5	-18.2	0	0	0	116.1
2113	T	21.3	Very low	23.4	Very low	114 Å²	114	137.2 Å²	137.2	70%	0.699	70%	0.703	S	S	*	*			trans	18.9	132.9	148.3	61.5	0	0	0	0	121
2114	K	21.1	Very low	23.5	Very low	179 Å²	179	134.8 Å²	134.8	78%	0.778	69%	0.694	S	S	*	*				169.2	141.4	103.5	-91.4	-173.4	179.1	175.8	0	115.1
2115	H	22.6	Very low	23.5	Very low	133 Å²	133	137.8 Å²	137.8	62%	0.616	69%	0.694	S	S	*	*			trans	33.3	136.7	139.1	-68.1	-78.8	0	0	0	123.3
2116	Y	22.2	Very low	23.6	Very low	197 Å²	197	137.6 Å²	137.6	77%	0.773	69%	0.693	S	S	*	*			trans	76.9	147.2	130.9	-80.7	-143.5	0	0	0	117.4
2117	T	23.4	Very low	23.6	Very low	103 Å²	103	139 Å²	139	63%	0.632	70%	0.701	S	S	*	*			cis	-162.8	150.8	-7.4	12.3	0	0	0	0	112.5
2118	S	22.4	Very low	24	Very low	77 Å²	77	134.8 Å²	134.8	54%	0.538	69%	0.685	S	S	.	*			trans	63.1	153.4	131	75.7	0	0	0	0	124
2119	Y	25	Very low	24.1	Very low	203 Å²	203	132 Å²	132	80%	0.796	67%	0.672	S	S	*	*			trans	76.6	142.2	145.7	-64.3	-43.2	0	0	0	117.4
2120	D	25.6	Very low	24.3	Very low	113 Å²	113	132.5 Å²	132.5	60%	0.604	67%	0.667	S	S	*	*			cis	-157.1	156.5	5.2	-131.4	-27.9	0	0	0	114.7
2121	T	24.9	Very low	24.4	Very low	106 Å²	106	130.6 Å²	130.6	65%	0.65	65%	0.654	S	S	*	*			trans	58.7	163.5	157.9	60.6	0	0	0	0	118.5
2122	N	25.2	Very low	24.8	Very low	136 Å²	136	128 Å²	128	73%	0.727	65%	0.65	S	S	*	*			cis	-169.2	163	-23	-97.8	-7.1	0	0	0	107.3
2123	L	24.3	Very low	24.8	Very low	133 Å²	133	131.6 Å²	131.6	70%	0.696	65%	0.652	S	S	*	*			cis	-173.3	171.8	-24.5	-171.1	57.5	0	0	0	108.1
2124	H	24.6	Very low	25	Very low	138 Å²	138	130 Å²	130	64%	0.639	64%	0.642	S	S	*	*			trans	80	100.4	164.8	-78.9	-80.1	0	0	0	121.6
2125	F	23.8	Very low	25.1	Very low	172 Å²	172	130 Å²	130	75%	0.754	65%	0.645	S	S	*	*				87.7	116.1	120	-84.9	-143.1	0	0	0	123.5
2126	I	25.3	Very low	25.2	Very low	136 Å²	136	130 Å²	130	70%	0.697	65%	0.648	S	S	*	*			trans	87.3	105.5	140.8	-59.2	168.6	0	0	0	119.9
2127	N	23.3	Very low	25.2	Very low	144 Å²	144	127.6 Å²	127.6	77%	0.77	65%	0.647	S	S	*	*			trans	58.1	160.6	152.3	-73.3	12.3	0	0	0	120.4
2128	P	32.2	Very low	25.2	Very low	51 Å²	51	128 Å²	128	33%	0.331	65%	0.65	S	S	.	*			cis	-134.1	-171.6	-24.4	29.8	-6.4	0	0	0	114.9
2129	E	23.7	Very low	25.3	Very low	99 Å²	99	131 Å²	131	46%	0.463	66%	0.66	S	S	.	*			trans	74.4	175.4	157.2	-61.6	131.9	-150.5	0	0	119.2	S1975 C1976 L1977	S1975-E2129 WeakPolarHBondContact CA-OE2 3.35Å; S1975-E2129 PolarHBondContact N-OE2 3.18Å; S1975-E2129 VanDerWaalsContact O-CB 3.24Å; S1975-E2129 WeakPolarHBondContact O-CB 3.25Å; C1976-E2129 VanDerWaalsContact N-CB 3.32Å; C1976-E2129 PolarHBondContact N-OE2 3.18Å; L1977-E2129 HydrophobicContact CB-CB 3.9Å; L1977-E2129 HydrophobicContact CB-CG 3.62Å; L1977-E2129 HydrophobicContact CG-CB 4.33Å; L1977-E2129 HydrophobicContact CG-CG 4.46Å; L1977-E2129 VanDerWaalsContact N-CG 3.3Å
2130	L	26	Very low	25.2	Very low	110 Å²	110	126.6 Å²	126.6	58%	0.576	65%	0.654	S	S	*	*			cis	-150.6	-176.4	11.7	128.5	166.9	0	0	0	117	S1975 C1976	S1975-L2130 WeakPolarHBondContact O-CB 3.4Å; S1975-L2130 WeakPolarHBondContact O-CD1 3.48Å; C1976-L2130 VanDerWaalsContact O-CB 3.31Å; C1976-L2130 WeakPolarHBondContact O-CB 3.39Å
2131	Y	25.8	Very low	25.2	Very low	129 Å²	129	128 Å²	128	51%	0.506	66%	0.662	S	S	.	*			trans	-63.7	166.2	177.3	-89.7	-78.6	0	0	0	117.8	S1978 Y1979	S1978-Y2131 WeakPolarHBondContact CB-OH 3.25Å; S1978-Y2131 VanDerWaalsContact OG-CD1 3.28Å; S1978-Y2131 WeakPolarHBondContact OG-CD1 3.33Å; S1978-Y2131 WeakPolarHBondContact OG-CD2 3.16Å; S1978-Y2131 WeakPolarHBondContact OG-CE1 3.35Å; S1978-Y2131 WeakPolarHBondContact OG-CE2 3.44Å; Y1979-Y2131 HydrophobicContact CD2-CE1 4.42Å; Y1979-Y2131 HydrophobicContact CE2-CD1 4.43Å; Y1979-Y2131 AromaticContact CE2-CE1 3.63Å; Y1979-Y2131 HydrophobicContact CE2-CE1 3.63Å
2132	P	30.5	Very low	25.2	Very low	116 Å²	116	128 Å²	128	75%	0.753	66%	0.662	S	S	*	*				-157.5	170	117.8	40.4	-23.2	0	0	0	118.4
2133	Y	27.6	Very low	25.2	Very low	174 Å²	174	128.2 Å²	128.2	68%	0.682	66%	0.663	S	S	*	*			trans	-144.9	130.8	149.8	-130.6	-95.2	0	0	0	113.1
2134	T	25.5	Very low	25.3	Very low	82 Å²	82	129.3 Å²	129.3	50%	0.503	66%	0.664	S	S	.	*			trans	46.1	111.4	165.3	47.7	0	0	0	0	122.2
2135	H	23.7	Very low	25.4	Very low	179 Å²	179	129.7 Å²	129.7	83%	0.829	67%	0.671	S	S	*	*				-155.2	98.9	126.2	-122.2	-87.3	0	0	0	114.6
2136	I	23.9	Very low	25.5	Very low	133 Å²	133	127 Å²	127	68%	0.682	67%	0.668	S	S	*	*			trans	31.8	119.5	133	-63.9	179.1	0	0	0	121
2137	L	23.5	Very low	25.4	Very low	146 Å²	146	129 Å²	129	76%	0.764	67%	0.672	S	S	*	*			trans	78.5	96.9	146.2	-70.6	171.4	0	0	0	124.6
2138	T	23.3	Very low	25.5	Very low	111 Å²	111	128 Å²	128	68%	0.681	67%	0.671	S	S	*	*				61.2	127.4	120.8	58.5	0	0	0	0	124.9
2139	N	22.9	Very low	25.2	Very low	140 Å²	140	132.5 Å²	132.5	75%	0.749	70%	0.697	S	S	*	*				111.2	133	119.3	-99.5	10.5	0	0	0	121.9
2140	T	24.3	Very low	25.3	Very low	111 Å²	111	136.4 Å²	136.4	68%	0.681	71%	0.713	S	S	*	*			trans	66.2	144.5	154.3	59.6	0	0	0	0	119
2141	D	24.7	Very low	25.3	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	72%	0.719	S	S	*	*			cis	-157.5	168.1	-17.7	-117.3	-23.3	0	0	0	113.4
2142	T	24.2	Very low	25.3	Very low	105 Å²	105	136.2 Å²	136.2	64%	0.644	73%	0.73	S	S	*	*			trans	-57.5	144.9	178.8	55.6	0	0	0	0	116.2
2143	N	26	Very low	25.2	Very low	140 Å²	140	134.7 Å²	134.7	75%	0.749	72%	0.718	S	S	*	*				173.5	146.3	103	-93	-60.1	0	0	0	117.9
2144	H	26.8	Very low	25.1	Very low	157 Å²	157	130.7 Å²	130.7	73%	0.727	71%	0.708	S	S	*	*			trans	-34.5	141.6	167.8	-60	-96.5	0	0	0	119.5
2145	N	26.5	Very low	25.3	Very low	146 Å²	146	130.7 Å²	130.7	78%	0.781	71%	0.705	S	S	*	*				168.7	147	94.4	-98.7	-48	0	0	0	118.1
2146	V	25.8	Very low	25.5	Very low	114 Å²	114	126.7 Å²	126.7	69%	0.691	69%	0.686	S	S	*	*			trans	73	103.5	141.9	175.3	0	0	0	0	122
2147	K	23.8	Very low	25.9	Very low	179 Å²	179	125.5 Å²	125.5	78%	0.778	68%	0.681	S	S	*	*			trans	59.2	127.9	131.7	-62.4	-176.3	180	178.6	0	123.8
2148	T	24.9	Very low	26.3	Very low	123 Å²	123	125 Å²	125	76%	0.755	68%	0.678	S	S	*	*			trans	79.9	149.4	135.6	49.4	0	0	0	0	122.4
2149	T	26.2	Very low	27	Very low	145 Å²	145	122.7 Å²	122.7	89%	0.89	66%	0.661	S	S	*	*			trans	91.3	166.6	174	70.9	0	0	0	0	116.6
2150	K	26.3	Very low	27.4	Very low	181 Å²	181	118.1 Å²	118.1	79%	0.787	64%	0.639	S	S	*	*			trans	-122.9	169.1	-153.8	-67.8	-174.1	172.7	-172	0	113.1
2151	N	26.2	Very low	27.7	Very low	132 Å²	132	118.5 Å²	118.5	71%	0.706	64%	0.637	S	S	*	*			trans	97.2	150.4	156.5	-72.1	15.2	0	0	0	117.4
2152	S	25.8	Very low	28.1	Very low	104 Å²	104	117.1 Å²	117.1	73%	0.727	63%	0.629	S	S	*	*			trans	51.6	108.1	158.1	50.2	0	0	0	0	117.8
2153	V	26.5	Very low	28.3	Very low	84 Å²	84	116.5 Å²	116.5	51%	0.509	62%	0.617	S	S	.	*				40.3	114.5	116	-179.4	0	0	0	0	115.1
2154	N	26.1	Very low	28.5	Very low	90 Å²	90	114.6 Å²	114.6	48%	0.481	61%	0.607	S	S	.	*				-135.4	108.4	111.6	-148	-1.5	0	0	0	111.1	Q2156	N2154-Q2156 HydrophobicContact CB-CB 4.44Å; N2154-Q2156 PolarHBondContact ND2-OE1 3.36Å; N2154-Q2156 PolarHBondContact O-N 3.12Å; N2154-Q2156 WeakPolarHBondContact OD1-CB 3.4Å; N2154-Q2156 WeakPolarHBondContact OD1-CG 3.32Å; N2154-Q2156 PolarHBondContact OD1-OE1 3.12Å
2155	I	30	Very low	28.6	Very low	82 Å²	82	117.1 Å²	117.1	42%	0.421	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	56.2	172.4	-69.1	170.5	0	0	0	107.1	I2159 E2501	I2155-I2159 HydrophobicContact CG2-CD1 3.63Å; I2155-I2159 HydrophobicContact CG2-CG1 4.15Å; I2155-I2159 WeakPolarHBondContact O-CB 3.17Å; I2155-E2501 WeakPolarHBondContact CD1-OE2 3.25Å
2156	Q	28	Very low	28.6	Very low	95 Å²	95	114.4 Å²	114.4	44%	0.444	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-149	3.7	-175.6	-67.7	-176.7	-10.9	0	0	112	N2154 I2159 T2160	N2154-Q2156 HydrophobicContact CB-CB 4.44Å; N2154-Q2156 PolarHBondContact ND2-OE1 3.36Å; N2154-Q2156 PolarHBondContact O-N 3.12Å; N2154-Q2156 WeakPolarHBondContact OD1-CB 3.4Å; N2154-Q2156 WeakPolarHBondContact OD1-CG 3.32Å; N2154-Q2156 PolarHBondContact OD1-OE1 3.12Å; Q2156-I2159 VanDerWaalsContact C-C 3.47Å; Q2156-I2159 CarbonylContact O-C 3.43Å; Q2156-T2160 WeakPolarHBondContact O-CB 3.4Å; Q2156-T2160 WeakPolarHBondContact O-CG2 3.36Å; Q2156-T2160 PolarHBondContact O-N 2.85Å; Q2156-T2160 VanDerWaalsContact O-N 3.08Å; Q2156-T2160 PolarHBondContact O-OG1 3.42Å
2157	N	32.5	Very low	28.9	Very low	107 Å²	107	116 Å²	116	57%	0.572	60%	0.6	S	S	*	*	S	Bend	trans	-115.3	-37.5	172	-89.9	83.4	0	0	0	114.3	T2160 D2161	N2157-T2160 WeakPolarHBondContact CA-OG1 3.39Å; N2157-T2160 CarbonylContact O-C 2.91Å; N2157-T2160 PolarHBondContact O-N 3.12Å; N2157-D2161 PolarHBondContact O-N 2.98Å
2158	L	30.9	Very low	29	Very low	135 Å²	135	112.6 Å²	112.6	71%	0.707	59%	0.591	S	S	*	*	H	α-helix	trans	-71	-28	154.5	-143.5	79.6	0	0	0	110.3	T2160 D2161 L2162	L2158-T2160 VanDerWaalsContact C-N 3.28Å; L2158-D2161 PolarHBondContact O-N 2.94Å; L2158-L2162 WeakPolarHBondContact O-CB 3.33Å; L2158-L2162 PolarHBondContact O-N 3.17Å
2159	I	38.1	Very low	28.9	Very low	63 Å²	63	113.3 Å²	113.3	32%	0.323	59%	0.587	S	S	.	*	H	α-helix	trans	-93.3	25.7	166.7	-61.3	-163.7	0	0	0	111.2	I2155 Q2156 K2163	I2155-I2159 HydrophobicContact CG2-CD1 3.63Å; I2155-I2159 HydrophobicContact CG2-CG1 4.15Å; I2155-I2159 WeakPolarHBondContact O-CB 3.17Å; Q2156-I2159 VanDerWaalsContact C-C 3.47Å; Q2156-I2159 CarbonylContact O-C 3.43Å; I2159-K2163 HydrophobicContact CG2-CD 3.81Å; I2159-K2163 HydrophobicContact CG2-CG 3.91Å; I2159-K2163 VanDerWaalsContact O-CB 3.26Å; I2159-K2163 WeakPolarHBondContact O-CB 3.45Å; I2159-K2163 WeakPolarHBondContact O-CD 3.35Å; I2159-K2163 VanDerWaalsContact O-CG 3.23Å; I2159-K2163 WeakPolarHBondContact O-CG 3.48Å
2160	T	32	Very low	28.7	Very low	45 Å²	45	110 Å²	110	28%	0.276	57%	0.569	S	S	.	*	H	α-helix	trans	-126.4	-6.1	143.7	48	0	0	0	0	113.6	Q2156 N2157 L2158 K2163 N2164	Q2156-T2160 WeakPolarHBondContact O-CB 3.4Å; Q2156-T2160 WeakPolarHBondContact O-CG2 3.36Å; Q2156-T2160 PolarHBondContact O-N 2.85Å; Q2156-T2160 VanDerWaalsContact O-N 3.08Å; Q2156-T2160 PolarHBondContact O-OG1 3.42Å; N2157-T2160 WeakPolarHBondContact CA-OG1 3.39Å; N2157-T2160 CarbonylContact O-C 2.91Å; N2157-T2160 PolarHBondContact O-N 3.12Å; L2158-T2160 VanDerWaalsContact C-N 3.28Å; T2160-K2163 HydrophobicContact CG2-CB 4.21Å; T2160-N2164 WeakPolarHBondContact O-CA 3.41Å; T2160-N2164 WeakPolarHBondContact O-CB 3.47Å; T2160-N2164 PolarHBondContact O-N 2.99Å; T2160-N2164 PolarHBondContact O-ND2 3.17Å
2161	D	31.2	Very low	28.6	Very low	119 Å²	119	107.4 Å²	107.4	64%	0.636	56%	0.563	S	S	*	*	H	α-helix	trans	-82.7	-20.3	157.6	-73.1	-29.3	0	0	0	112.1	N2157 L2158	N2157-D2161 PolarHBondContact O-N 2.98Å; L2158-D2161 PolarHBondContact O-N 2.94Å
2162	L	31.6	Very low	28.3	Very low	114 Å²	114	107.2 Å²	107.2	60%	0.597	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-12.8	163.8	-76.2	149.3	0	0	0	114.1	L2158 T2166	L2158-L2162 WeakPolarHBondContact O-CB 3.33Å; L2158-L2162 PolarHBondContact O-N 3.17Å; L2162-T2166 PolarHBondContact O-OG1 2.93Å
2163	K	28.4	Very low	28.1	Very low	91 Å²	91	106.7 Å²	106.7	40%	0.396	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.2	-19.5	164.7	-67.9	-174.5	176.9	175.5	0	114.9	I2159 T2160 Y2165 T2166 Q2167	I2159-K2163 HydrophobicContact CG2-CD 3.81Å; I2159-K2163 HydrophobicContact CG2-CG 3.91Å; I2159-K2163 VanDerWaalsContact O-CB 3.26Å; I2159-K2163 WeakPolarHBondContact O-CB 3.45Å; I2159-K2163 WeakPolarHBondContact O-CD 3.35Å; I2159-K2163 VanDerWaalsContact O-CG 3.23Å; I2159-K2163 WeakPolarHBondContact O-CG 3.48Å; T2160-K2163 HydrophobicContact CG2-CB 4.21Å; K2163-Y2165 PolarHBondContact O-N 3.35Å; K2163-Y2165 VanDerWaalsContact O-N 3.08Å; K2163-T2166 WeakPolarHBondContact CA-O 3.33Å; K2163-T2166 WeakPolarHBondContact CB-O 3.43Å; K2163-T2166 CarbonylContact O-C 3.46Å; K2163-T2166 WeakPolarHBondContact O-CA 3.25Å; K2163-T2166 PolarHBondContact O-N 2.84Å; K2163-Q2167 CarbonylContact C-O 3.42Å; K2163-Q2167 CarbonylContact O-C 2.94Å; K2163-Q2167 PolarHBondContact O-N 3.21Å
2164	N	31.3	Very low	28.2	Very low	101 Å²	101	111.6 Å²	111.6	54%	0.54	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	10.7	158.8	-64.9	-33.8	0	0	0	112	T2160	T2160-N2164 WeakPolarHBondContact O-CA 3.41Å; T2160-N2164 WeakPolarHBondContact O-CB 3.47Å; T2160-N2164 PolarHBondContact O-N 2.99Å; T2160-N2164 PolarHBondContact O-ND2 3.17Å
2165	Y	28.7	Very low	28	Very low	209 Å²	209	111.4 Å²	111.4	82%	0.82	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	2.5	155	-136.6	-92.6	0	0	0	113.4	K2163	K2163-Y2165 PolarHBondContact O-N 3.35Å; K2163-Y2165 VanDerWaalsContact O-N 3.08Å
2166	T	26.1	Very low	27.7	Very low	90 Å²	90	115.9 Å²	115.9	55%	0.552	59%	0.592	S	S	*	*	S	Bend	trans	-155.6	90.8	170.8	46.3	0	0	0	0	111.9	L2162 K2163	L2162-T2166 PolarHBondContact O-OG1 2.93Å; K2163-T2166 WeakPolarHBondContact CA-O 3.33Å; K2163-T2166 WeakPolarHBondContact CB-O 3.43Å; K2163-T2166 CarbonylContact O-C 3.46Å; K2163-T2166 WeakPolarHBondContact O-CA 3.25Å; K2163-T2166 PolarHBondContact O-N 2.84Å
2167	Q	31.8	Very low	27.6	Very low	148 Å²	148	117.6 Å²	117.6	69%	0.692	60%	0.603	S	S	*	*	S	Bend	trans	77.3	100	-175.6	-47.7	168	-21.1	0	0	114.1	K2163	K2163-Q2167 CarbonylContact C-O 3.42Å; K2163-Q2167 CarbonylContact O-C 2.94Å; K2163-Q2167 PolarHBondContact O-N 3.21Å
2168	D	25.2	Very low	27.4	Very low	107 Å²	107	119.1 Å²	119.1	57%	0.572	61%	0.61	S	S	*	*	S	Bend	cis	-68	170.7	8.8	-77.7	-16.4	0	0	0	115.2
2169	M	23.1	Very low	27.3	Very low	137 Å²	137	117 Å²	117	68%	0.675	60%	0.599	S	S	*	*			cis	-123.3	97.2	-10.6	-166	63.6	75.7	0	0	108.4
2170	S	22.2	Very low	26.6	Very low	75 Å²	75	122.4 Å²	122.4	52%	0.524	63%	0.628	S	S	.	*			trans	-53	144.5	151.6	48	0	0	0	0	109.8
2171	I	23.9	Very low	26.4	Very low	127 Å²	127	125.5 Å²	125.5	65%	0.651	64%	0.64	S	S	*	*			trans	64.9	71.4	163.9	-49.3	156	0	0	0	113.4	N2173	I2171-N2173 WeakPolarHBondContact CG2-OD1 3.28Å
2172	T	21.7	Very low	26.2	Very low	128 Å²	128	127.2 Å²	127.2	79%	0.785	64%	0.643	S	S	*	*				-101.4	89.7	108.4	57.1	0	0	0	0	106
2173	N	21.7	Very low	25.9	Very low	94 Å²	94	128.3 Å²	128.3	50%	0.503	65%	0.65	S	S	.	*				81.6	111.7	95	-70.8	1.4	0	0	0	109.6	I2171 S2175	I2171-N2173 WeakPolarHBondContact CG2-OD1 3.28Å; N2173-S2175 WeakPolarHBondContact O-CB 3.39Å; N2173-S2175 PolarHBondContact O-N 2.98Å
2174	E	27.4	Very low	25.7	Very low	186 Å²	186	129.6 Å²	129.6	87%	0.869	66%	0.661	S	S	*	*				21.2	59.2	86.8	-60.4	-175.8	152.5	0	0	113.2
2175	S	22.3	Very low	25.5	Very low	86 Å²	86	131.2 Å²	131.2	60%	0.601	67%	0.67	S	S	*	*			trans	-137.9	62.2	-178.3	-177	0	0	0	0	110.6	N2173	N2173-S2175 WeakPolarHBondContact O-CB 3.39Å; N2173-S2175 PolarHBondContact O-N 2.98Å
2176	Y	24.1	Very low	25.4	Very low	176 Å²	176	127 Å²	127	69%	0.69	66%	0.662	S	S	*	*				72.3	163.9	127.7	-71.2	-65.9	0	0	0	116
2177	I	24.4	Very low	25.5	Very low	131 Å²	131	131.9 Å²	131.9	67%	0.672	68%	0.675	S	S	*	*			cis	-147.9	131.8	1.8	9.4	179.1	0	0	0	101.7
2178	I	28.6	Very low	25.3	Very low	140 Å²	140	127.6 Å²	127.6	72%	0.718	67%	0.671	S	S	*	*	S	Bend		-178.6	152.5	50.8	-98.3	142.7	0	0	0	105
2179	D	29.2	Very low	25.5	Very low	90 Å²	90	130.4 Å²	130.4	48%	0.481	69%	0.686	S	S	.	*			cis	-156.5	129.8	-26.6	-96.1	-23.3	0	0	0	106.5	H2181	D2179-H2181 HydrophobicContact CB-CB 4.13Å
2180	D	23.3	Very low	25.7	Very low	176 Å²	176	127 Å²	127	94%	0.941	69%	0.687	S	S	*	*	S	Bend	trans	-99.7	48.9	148.5	-115.1	-25.9	0	0	0	107.9
2181	H	27.2	Very low	26.2	Very low	111 Å²	111	130 Å²	130	51%	0.514	70%	0.696	S	S	.	*			trans	-126.9	82.8	179.4	-103.6	-58.7	0	0	0	110.5	D2179	D2179-H2181 HydrophobicContact CB-CB 4.13Å
2182	Q	27.1	Very low	26.5	Very low	154 Å²	154	131 Å²	131	72%	0.72	70%	0.703	S	S	*	*			trans	57.8	90.1	133.8	-62.5	171.5	-57.2	0	0	117.1
2183	D	26.1	Very low	26.8	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	70%	0.701	S	S	*	*				43.2	110.9	94.5	-142.7	39.1	0	0	0	116.1
2184	N	25.4	Very low	27.1	Very low	117 Å²	117	131.8 Å²	131.8	63%	0.626	71%	0.706	S	S	*	*			trans	72.5	107.5	167.4	-41.8	-78.1	0	0	0	116
2185	N	26.3	Very low	27.2	Very low	136 Å²	136	129.6 Å²	129.6	73%	0.727	70%	0.699	S	S	*	*				-174.2	159	55.6	-77	-76.9	0	0	0	114
2186	D	26.5	Very low	27.4	Very low	121 Å²	121	130.9 Å²	130.9	65%	0.647	70%	0.699	S	S	*	*			trans	74.9	111.9	136.2	-79.8	5.5	0	0	0	124.1
2187	F	27.5	Very low	27.7	Very low	191 Å²	191	133.3 Å²	133.3	84%	0.838	71%	0.709	S	S	*	*			trans	60.9	120.5	145.5	-59	-65	0	0	0	118.9
2188	G	28.1	Very low	28	Very low	58 Å²	58	133 Å²	133	60%	0.598	71%	0.708	S	S	*	*			cis	147.9	132.4	36.6	0	0	0	0	0	114
2189	N	28.7	Very low	28.2	Very low	166 Å²	166	132.8 Å²	132.8	89%	0.888	71%	0.709	S	S	*	*			trans	71.8	144.9	157.7	-45.2	-9.7	0	0	0	117.6
2190	G	29.3	Very low	28.1	Very low	67 Å²	67	136.5 Å²	136.5	69%	0.691	72%	0.723	S	S	*	*			trans	173.1	-10.6	-178.3	0	0	0	0	0	119.3
2191	D	31.1	Very low	28.4	Very low	136 Å²	136	134.3 Å²	134.3	73%	0.727	71%	0.707	S	S	*	*			trans	63.4	135.1	155.4	-46.1	-14.9	0	0	0	119.5
2192	D	31	Very low	28.5	Very low	148 Å²	148	133.3 Å²	133.3	79%	0.791	71%	0.706	S	S	*	*			trans	67.3	140.3	143.4	-60.4	5.6	0	0	0	122.1
2193	D	28	Very low	28.4	Very low	138 Å²	138	137 Å²	137	74%	0.738	71%	0.713	S	S	*	*			cis	-170.8	168.2	-22.9	-142.5	-5	0	0	0	113
2194	V	28.4	Very low	28.5	Very low	101 Å²	101	139.1 Å²	139.1	61%	0.612	71%	0.711	S	S	*	*			trans	65.5	94.2	142.8	164.9	0	0	0	0	122.1
2195	I	27.9	Very low	28.8	Very low	140 Å²	140	140 Å²	140	72%	0.718	72%	0.715	S	S	*	*				70.5	130.7	100.8	-72.6	165.9	0	0	0	123.3
2196	N	28.2	Very low	29	Very low	114 Å²	114	138.3 Å²	138.3	61%	0.61	71%	0.709	S	S	*	*			trans	31.5	135.3	147.6	-53.9	18.9	0	0	0	124.1
2197	Y	30.3	Very low	29.4	Very low	227 Å²	227	139.4 Å²	139.4	89%	0.89	72%	0.715	S	S	*	*				-159	115.9	115.6	-93.8	-79.7	0	0	0	106
2198	D	30.7	Very low	29.6	Very low	123 Å²	123	136.3 Å²	136.3	66%	0.658	71%	0.707	S	S	*	*				81.4	146.7	61.9	-80.8	-52.2	0	0	0	115.6
2199	D	32.3	Very low	29.9	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	71%	0.711	S	S	*	*			trans	69.7	141	-179.3	-74.4	-46.7	0	0	0	118.2	H2201	D2199-H2201 IonicContact OD1-CE1 2.72Å; D2199-H2201 IonicContact OD1-ND1 2.68Å
2200	E	26.9	Very low	30.1	Very low	168 Å²	168	138.4 Å²	138.4	79%	0.785	70%	0.7	S	S	*	*			cis	-126.6	124.1	12.8	-90.1	-159.2	123.9	0	0	115.3
2201	H	30.5	Very low	30.3	Very low	131 Å²	131	141.1 Å²	141.1	61%	0.606	70%	0.699	S	S	*	*				77.7	109.5	125.6	-78.1	23.5	0	0	0	124.1	D2199	D2199-H2201 IonicContact OD1-CE1 2.72Å; D2199-H2201 IonicContact OD1-ND1 2.68Å
2202	N	27.9	Very low	30.4	Very low	90 Å²	90	141.7 Å²	141.7	48%	0.481	70%	0.702	S	S	.	*			trans	73.5	114.7	135.1	-59.9	-57.2	0	0	0	119.1	R2204	N2202-R2204 PolarHBondContact OD1-NE 3.06Å; N2202-R2204 PolarHBondContact OD1-NH2 3.3Å
2203	R	25.4	Very low	30.7	Very low	230 Å²	230	139.2 Å²	139.2	87%	0.868	69%	0.694	S	S	*	*			cis	-130.6	132.5	12.5	-68.3	177.9	-177.8	166.9	0.9	109.4
2204	R	28.3	Very low	30.8	Very low	184 Å²	184	139.3 Å²	139.3	69%	0.694	70%	0.695	S	S	*	*				71.1	127.3	58	-67.1	-158.2	-97.4	162.3	-15.1	112.4	N2202	N2202-R2204 PolarHBondContact OD1-NE 3.06Å; N2202-R2204 PolarHBondContact OD1-NH2 3.3Å
2205	N	31.2	Very low	30.8	Very low	134 Å²	134	142 Å²	142	72%	0.717	70%	0.701	S	S	*	*			cis	-172.6	169	5.7	-123.4	34.3	0	0	0	112.4
2206	V	32	Very low	30.8	Very low	101 Å²	101	141.3 Å²	141.3	61%	0.612	70%	0.698	S	S	*	*			trans	87	109.3	139.6	156.5	0	0	0	0	119.9
2207	D	33.7	Very low	30.9	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	70%	0.702	S	S	*	*				57.9	148.2	122.1	-46.6	-4.3	0	0	0	121.5
2208	D	32.9	Very low	30.7	Very low	126 Å²	126	138 Å²	138	67%	0.674	69%	0.691	S	S	*	*			cis	-175.4	175.7	-22.5	-163.2	3.3	0	0	0	108.1
2209	Q	32.8	Very low	30.6	Very low	144 Å²	144	138.8 Å²	138.8	67%	0.673	69%	0.693	S	S	*	*			trans	71.6	128.2	150.3	-80.2	155.8	45.9	0	0	123.1
2210	D	33.8	Very low	30.4	Very low	124 Å²	124	139.6 Å²	139.6	66%	0.663	69%	0.69	S	S	*	*				89.9	106	128.4	-75.3	13.6	0	0	0	123.6
2211	N	33.3	Very low	30.3	Very low	124 Å²	124	139.2 Å²	139.2	66%	0.663	69%	0.688	S	S	*	*				70.5	116	122	-60	-40.6	0	0	0	121
2212	D	33.6	Very low	30.2	Very low	149 Å²	149	139.6 Å²	139.6	80%	0.797	69%	0.692	S	S	*	*				42.6	151.5	113.9	-79.9	3.4	0	0	0	122.1
2213	P	37.3	Very low	30.2	Very low	95 Å²	95	142.5 Å²	142.5	62%	0.617	70%	0.702	S	S	*	*			cis	-141.3	-162.7	-23.2	35.5	-13.9	0	0	0	112.7
2214	D	29.1	Very low	30.3	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	69%	0.693	S	S	*	*			trans	78.3	148.4	139.1	-84.4	-24.1	0	0	0	123.2
2215	E	29.6	Very low	30.1	Very low	157 Å²	157	137 Å²	137	73%	0.734	70%	0.698	S	S	*	*			trans	65.7	101.5	145	-76.9	-152.9	-150.5	0	0	121.7
2216	N	28.2	Very low	30	Very low	125 Å²	125	136 Å²	136	67%	0.668	70%	0.698	S	S	*	*				91.5	153.9	111.7	-92.5	-36	0	0	0	122.3
2217	E	28.7	Very low	29.8	Very low	148 Å²	148	137.8 Å²	137.8	69%	0.692	70%	0.704	S	S	*	*			trans	58.1	110.7	148.2	-71.1	-147.5	-152.7	0	0	121.6
2218	N	26.7	Very low	29.6	Very low	124 Å²	124	137.1 Å²	137.1	66%	0.663	70%	0.7	S	S	*	*				60.8	136.4	114.5	-58.8	-34.7	0	0	0	121.6
2219	M	28.4	Very low	29.4	Very low	139 Å²	139	138.4 Å²	138.4	69%	0.685	70%	0.697	S	S	*	*			trans	101	118	131	-156.4	163.4	-62.3	0	0	119.5
2220	K	29	Very low	29.5	Very low	153 Å²	153	137.4 Å²	137.4	67%	0.665	70%	0.696	S	S	*	*			trans	70.5	128.6	152.2	-74.8	168.3	-165.3	150.2	0	119.4
2221	E	24.4	Very low	29.4	Very low	160 Å²	160	136.9 Å²	136.9	75%	0.748	69%	0.693	S	S	*	*				21.6	128.6	107.5	-48.7	169.3	133.2	0	0	116.1
2222	M	28.6	Very low	29.4	Very low	140 Å²	140	137.1 Å²	137.1	69%	0.69	69%	0.694	S	S	*	*				166.5	128.1	96.3	-173.5	150.1	-83.1	0	0	111.8
2223	E	27.2	Very low	29.6	Very low	150 Å²	150	135.9 Å²	135.9	70%	0.701	69%	0.687	S	S	*	*			trans	65.8	146.8	149.4	-74.9	158.8	-168.9	0	0	122.9
2224	D	27.4	Very low	29.7	Very low	127 Å²	127	136.7 Å²	136.7	68%	0.679	69%	0.687	S	S	*	*			trans	60.8	114.8	141	-61.4	2.5	0	0	0	124.1
2225	E	24.2	Very low	30.1	Very low	171 Å²	171	137.7 Å²	137.7	80%	0.799	69%	0.692	S	S	*	*				52.4	177.8	120.2	-56.3	-158.3	144	0	0	121
2226	T	28.2	Very low	30.6	Very low	115 Å²	115	132.8 Å²	132.8	71%	0.706	68%	0.684	S	S	*	*			trans	67.9	119.7	-178.9	63.7	0	0	0	0	114
2227	D	28	Very low	31.1	Very low	138 Å²	138	131.8 Å²	131.8	74%	0.738	68%	0.679	S	S	*	*				73.9	138.5	80.4	-52.6	-20.9	0	0	0	110.8
2228	D	30	Very low	31.6	Very low	129 Å²	129	129.7 Å²	129.7	69%	0.69	67%	0.672	S	S	*	*			cis	-152.4	-169	-6.3	-138.4	-16.7	0	0	0	111.4
2229	Y	30.1	Very low	32.2	Very low	154 Å²	154	128.9 Å²	128.9	60%	0.604	67%	0.668	S	S	*	*			trans	-11.3	146	157	-76.1	-80.2	0	0	0	121.3
2230	D	32.9	Very low	32.5	Very low	122 Å²	122	127 Å²	127	65%	0.652	66%	0.661	S	S	*	*			trans	106.9	124.5	130.1	-85.7	13.3	0	0	0	121.1
2231	N	31.9	Very low	32.7	Very low	113 Å²	113	125.8 Å²	125.8	60%	0.604	66%	0.661	S	S	*	*			trans	81.5	109.6	135.2	-58.7	-10.4	0	0	0	121.1
2232	D	33.8	Very low	33	Very low	130 Å²	130	120.5 Å²	120.5	70%	0.695	64%	0.638	S	S	*	*				81.8	109.1	113.4	-60.6	-4.8	0	0	0	119.6
2233	N	37	Very low	33.3	Very low	122 Å²	122	119.6 Å²	119.6	65%	0.652	64%	0.636	S	S	*	*				112.3	128.9	120.9	-79.3	30.9	0	0	0	120
2234	D	39.8	Very low	33.7	Very low	113 Å²	113	118 Å²	118	60%	0.604	63%	0.628	S	S	*	*			trans	62	108.5	132.2	-47.6	-10	0	0	0	119.8
2235	D	37.6	Very low	34.3	Very low	161 Å²	161	114.4 Å²	114.4	86%	0.861	61%	0.609	S	S	*	*				62.9	165.2	121	-49.7	-13.8	0	0	0	120
2236	G	40	Very low	34.9	Very low	55 Å²	55	108.1 Å²	108.1	57%	0.567	58%	0.58	S	S	*	*			trans	128.9	95.8	-177.9	0	0	0	0	0	111.1	R1907	R1907-G2236 PolarHBondContact NH1-O 2.8Å
2237	D	39.9	Very low	35.3	Very low	104 Å²	104	107.6 Å²	107.6	56%	0.556	57%	0.569	S	S	*	*			trans	-91.8	-178.1	178.6	-57.2	-42.6	0	0	0	111.3	R1907	R1907-D2237 IonicContact CZ-OD1 2.69Å; R1907-D2237 IonicContact NH1-OD1 3.1Å; R1907-D2237 IonicContact NH2-OD1 3.7Å; R1907-D2237 PolarHBondContact NH2-OD1 3.43Å
2238	D	38.7	Very low	35.6	Very low	104 Å²	104	105.1 Å²	105.1	56%	0.556	55%	0.549	S	S	*	.			trans	66.8	158.8	165.8	-40.8	-38.3	0	0	0	116.5
2239	D	39.5	Very low	36.1	Very low	106 Å²	106	104.3 Å²	104.3	57%	0.567	54%	0.54	S	S	*	.			cis	-144.4	143.1	-14.5	-133.3	-25.2	0	0	0	112.1	T1908	T1908-D2239 WeakPolarHBondContact CB-OD1 3.44Å; T1908-D2239 WeakPolarHBondContact CG2-OD1 3.48Å; T1908-D2239 PolarHBondContact OG1-OD1 3.41Å
2240	D	35.3	Very low	36.4	Very low	101 Å²	101	101 Å²	101	54%	0.54	53%	0.532	S	S	.	.			trans	56.1	159.1	173.6	-94.9	-49.5	0	0	0	122.2	R1907 T1908	R1907-D2240 VanDerWaalsContact C-C 3.41Å; R1907-D2240 CarbonylContact C-O 3.54Å; R1907-D2240 CarbonylContact O-C 3.53Å; T1908-D2240 WeakPolarHBondContact OG1-CA 2.89Å; T1908-D2240 VanDerWaalsContact OG1-CG 3.31Å; T1908-D2240 PolarHBondContact OG1-N 2.97Å; T1908-D2240 PolarHBondContact OG1-OD1 3.07Å
2241	N	33	Very low	36.7	Very low	126 Å²	126	100 Å²	100	67%	0.674	52%	0.523	S	S	*	.			trans	67.4	86.7	174.8	-48.6	-75.4	0	0	0	117.1	R1907	R1907-N2241 CarbonylContact O-C 3.49Å; R1907-N2241 VanDerWaalsContact O-C 3.22Å; R1907-N2241 PolarHBondContact O-N 3.27Å
2242	D	30.9	Very low	36.9	Very low	50 Å²	50	98.9 Å²	98.9	27%	0.267	52%	0.517	S	S	.	.				-175.7	81.5	123.1	-112.6	-16.7	0	0	0	109.7	R1907 R1911 E2244 D2245 R2248	R1907-D2242 PolarHBondContact O-N 3.08Å; R1911-D2242 PolarHBondContact NE-O 3.03Å; R1911-D2242 PolarHBondContact NH1-O 3.43Å; R1911-D2242 VanDerWaalsContact NH2-CB 3.34Å; R1911-D2242 PolarHBondContact NH2-O 2.89Å; D2242-E2244 PolarHBondContact O-N 3.5Å; D2242-D2245 HydrophobicContact CB-CB 3.52Å; D2242-D2245 PolarHBondContact O-N 3.37Å; D2242-D2245 WeakPolarHBondContact OD2-CB 3.46Å; D2242-R2248 IonicContact OD2-NH1 3.84Å
2243	L	33.3	Very low	37.1	Very low	121 Å²	121	94.8 Å²	94.8	63%	0.634	51%	0.505	S	S	*	.	H	α-helix	trans	-55.7	-34.8	161	-92	159.2	0	0	0	109.4	D2245 E2247	L2243-D2245 PolarHBondContact O-N 3.13Å; L2243-E2247 VanDerWaalsContact O-CB 3.23Å; L2243-E2247 WeakPolarHBondContact O-CB 3.4Å; L2243-E2247 PolarHBondContact O-N 3.48Å
2244	E	37.2	Very low	37.3	Very low	116 Å²	116	93 Å²	93	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-59.3	-12.1	168.7	-76.3	-164.9	-132.8	0	0	116.3	D2242 E2247 R2248	D2242-E2244 PolarHBondContact O-N 3.5Å; E2244-E2247 CarbonylContact O-C 3.54Å; E2244-R2248 WeakPolarHBondContact O-CA 3.27Å; E2244-R2248 WeakPolarHBondContact O-CB 3.48Å; E2244-R2248 WeakPolarHBondContact O-CG 3.26Å; E2244-R2248 PolarHBondContact O-N 2.86Å; E2244-R2248 PolarHBondContact O-NE 2.92Å; E2244-R2248 IonicContact OE2-CZ 2.92Å; E2244-R2248 IonicContact OE2-NE 2.64Å; E2244-R2248 IonicContact OE2-NH2 2.8Å; E2244-R2248 PolarHBondContact OE2-NH2 3.31Å
2245	D	38.9	Very low	37.2	Very low	52 Å²	52	92.6 Å²	92.6	28%	0.278	49%	0.489	S	S	.	.	H	α-helix	trans	-115.9	-1.5	-178.1	-136.2	58.3	0	0	0	114.4	R1911 D2242 L2243 R2248 K2249	R1911-D2245 VanDerWaalsContact NH1-C 3.34Å; D2242-D2245 HydrophobicContact CB-CB 3.52Å; D2242-D2245 PolarHBondContact O-N 3.37Å; D2242-D2245 WeakPolarHBondContact OD2-CB 3.46Å; L2243-D2245 PolarHBondContact O-N 3.13Å; D2245-R2248 WeakPolarHBondContact OD1-CB 3.34Å; D2245-R2248 IonicContact OD1-CZ 3.27Å; D2245-R2248 IonicContact OD1-NH1 3.23Å; D2245-R2248 PolarHBondContact OD1-NH1 2.87Å; D2245-K2249 WeakPolarHBondContact O-CD 3.26Å; D2245-K2249 VanDerWaalsContact O-CG 3.3Å; D2245-K2249 WeakPolarHBondContact O-CG 3.33Å; D2245-K2249 PolarHBondContact O-N 2.98Å
2246	E	37.8	Very low	37.2	Very low	39 Å²	39	92.1 Å²	92.1	18%	0.182	48%	0.482	C	S	.	.	H	α-helix	trans	-100.6	-19.6	148.3	-78.7	-68.9	166.9	0	0	112	R1911 H1912 R2248 K2249 I2250	R1911-E2246 HydrophobicContact CB-CB 3.85Å; R1911-E2246 HydrophobicContact CB-CG 3.69Å; R1911-E2246 HydrophobicContact CG-CB 4.32Å; R1911-E2246 HydrophobicContact CG-CG 4.1Å; H1912-E2246 IonicContact CE1-OE2 2.68Å; H1912-E2246 PolarHBondContact CE1-OE2 2.9Å; H1912-E2246 IonicContact ND1-OE2 3.65Å; H1912-E2246 IonicContact NE2-OE2 2.87Å; H1912-E2246 PolarHBondContact NE2-OE2 2.89Å; E2246-R2248 VanDerWaalsContact C-N 3.33Å; E2246-K2249 HydrophobicContact CG-CD 4.28Å; E2246-K2249 PolarHBondContact O-N 3.35Å; E2246-K2249 WeakPolarHBondContact OE1-CD 3.38Å; E2246-K2249 WeakPolarHBondContact OE1-CE 3.34Å; E2246-K2249 IonicContact OE1-NZ 3.59Å; E2246-K2249 PolarHBondContact OE1-NZ 3.41Å; E2246-K2249 VanDerWaalsContact OE2-CB 3.27Å; E2246-K2249 WeakPolarHBondContact OE2-CB 3.47Å; E2246-K2249 VanDerWaalsContact OE2-CD 3.3Å; E2246-K2249 WeakPolarHBondContact OE2-CD 3.44Å; E2246-I2250 WeakPolarHBondContact O-CB 3.25Å; E2246-I2250 WeakPolarHBondContact O-CG1 3.23Å; E2246-I2250 PolarHBondContact O-N 3.39Å
2247	E	35.3	Very low	37.1	Very low	104 Å²	104	90.2 Å²	90.2	49%	0.486	46%	0.461	S	S	.	.	H	α-helix	trans	-73.7	-22.6	155.7	-166.4	155.2	-144	0	0	111.7	L2243 E2244 Q2251	L2243-E2247 VanDerWaalsContact O-CB 3.23Å; L2243-E2247 WeakPolarHBondContact O-CB 3.4Å; L2243-E2247 PolarHBondContact O-N 3.48Å; E2244-E2247 CarbonylContact O-C 3.54Å; E2247-Q2251 WeakPolarHBondContact O-CA 3.22Å; E2247-Q2251 WeakPolarHBondContact O-CB 3.23Å; E2247-Q2251 WeakPolarHBondContact O-CG 3.47Å; E2247-Q2251 PolarHBondContact O-N 2.99Å
2248	R	35.1	Very low	37	Very low	86 Å²	86	90.2 Å²	90.2	33%	0.325	46%	0.458	S	S	.	.	H	α-helix	trans	-93.2	10.9	161.1	-67.8	174	-117.9	124.4	-10.8	114.9	D2242 E2244 D2245 E2246 L2252	D2242-R2248 IonicContact OD2-NH1 3.84Å; E2244-R2248 WeakPolarHBondContact O-CA 3.27Å; E2244-R2248 WeakPolarHBondContact O-CB 3.48Å; E2244-R2248 WeakPolarHBondContact O-CG 3.26Å; E2244-R2248 PolarHBondContact O-N 2.86Å; E2244-R2248 PolarHBondContact O-NE 2.92Å; E2244-R2248 IonicContact OE2-CZ 2.92Å; E2244-R2248 IonicContact OE2-NE 2.64Å; E2244-R2248 IonicContact OE2-NH2 2.8Å; E2244-R2248 PolarHBondContact OE2-NH2 3.31Å; D2245-R2248 WeakPolarHBondContact OD1-CB 3.34Å; D2245-R2248 IonicContact OD1-CZ 3.27Å; D2245-R2248 IonicContact OD1-NH1 3.23Å; D2245-R2248 PolarHBondContact OD1-NH1 2.87Å; E2246-R2248 VanDerWaalsContact C-N 3.33Å; R2248-L2252 WeakPolarHBondContact O-CA 3.3Å; R2248-L2252 WeakPolarHBondContact O-CB 3.49Å; R2248-L2252 VanDerWaalsContact O-CD1 3.29Å; R2248-L2252 WeakPolarHBondContact O-CD1 3.18Å; R2248-L2252 WeakPolarHBondContact O-CG 2.99Å; R2248-L2252 PolarHBondContact O-N 3.41Å
2249	K	40.2	Very low	37	Very low	111 Å²	111	89 Å²	89	48%	0.483	45%	0.451	S	S	.	.	H	α-helix	trans	-108.8	-18.6	154.6	-74.6	160.7	-175.7	174.1	0	113.1	D2245 E2246 G2253	D2245-K2249 WeakPolarHBondContact O-CD 3.26Å; D2245-K2249 VanDerWaalsContact O-CG 3.3Å; D2245-K2249 WeakPolarHBondContact O-CG 3.33Å; D2245-K2249 PolarHBondContact O-N 2.98Å; E2246-K2249 HydrophobicContact CG-CD 4.28Å; E2246-K2249 PolarHBondContact O-N 3.35Å; E2246-K2249 WeakPolarHBondContact OE1-CD 3.38Å; E2246-K2249 WeakPolarHBondContact OE1-CE 3.34Å; E2246-K2249 IonicContact OE1-NZ 3.59Å; E2246-K2249 PolarHBondContact OE1-NZ 3.41Å; E2246-K2249 VanDerWaalsContact OE2-CB 3.27Å; E2246-K2249 WeakPolarHBondContact OE2-CB 3.47Å; E2246-K2249 VanDerWaalsContact OE2-CD 3.3Å; E2246-K2249 WeakPolarHBondContact OE2-CD 3.44Å; K2249-G2253 VanDerWaalsContact O-CA 3.23Å; K2249-G2253 WeakPolarHBondContact O-CA 3.38Å; K2249-G2253 PolarHBondContact O-N 3.4Å
2250	I	37.1	Very low	37	Very low	85 Å²	85	86.2 Å²	86.2	44%	0.436	44%	0.443	S	S	.	.	H	α-helix	trans	-73.4	-39	154.4	-70.1	178.4	0	0	0	109.4	H1912 E2246 G2253 L2254	H1912-I2250 WeakPolarHBondContact ND1-CD1 3.35Å; E2246-I2250 WeakPolarHBondContact O-CB 3.25Å; E2246-I2250 WeakPolarHBondContact O-CG1 3.23Å; E2246-I2250 PolarHBondContact O-N 3.39Å; I2250-G2253 CarbonylContact O-C 3.57Å; I2250-G2253 PolarHBondContact O-N 2.82Å; I2250-L2254 HydrophobicContact CG2-CD1 3.95Å; I2250-L2254 VanDerWaalsContact O-CB 3.3Å; I2250-L2254 WeakPolarHBondContact O-CB 3.46Å; I2250-L2254 WeakPolarHBondContact O-CD1 3.46Å; I2250-L2254 PolarHBondContact O-N 3.28Å
2251	Q	38.5	Very low	37	Very low	102 Å²	102	88.6 Å²	88.6	48%	0.477	45%	0.451	S	S	.	.	H	α-helix	trans	-81.2	-29.2	171.6	-63.7	164.6	16.6	0	0	113	E2247 G2253 Q2255	E2247-Q2251 WeakPolarHBondContact O-CA 3.22Å; E2247-Q2251 WeakPolarHBondContact O-CB 3.23Å; E2247-Q2251 WeakPolarHBondContact O-CG 3.47Å; E2247-Q2251 PolarHBondContact O-N 2.99Å; Q2251-G2253 VanDerWaalsContact C-N 3.32Å; Q2251-Q2255 VanDerWaalsContact O-CA 3.31Å; Q2251-Q2255 WeakPolarHBondContact O-CA 3.28Å; Q2251-Q2255 WeakPolarHBondContact O-CB 3.41Å; Q2251-Q2255 PolarHBondContact O-N 3.34Å
2252	L	36.4	Very low	37.1	Very low	89 Å²	89	92.2 Å²	92.2	47%	0.466	46%	0.455	S	S	.	.	H	α-helix	trans	-72.7	-28.5	162.7	-76.5	164.3	0	0	0	111	R2248 E2256	R2248-L2252 WeakPolarHBondContact O-CA 3.3Å; R2248-L2252 WeakPolarHBondContact O-CB 3.49Å; R2248-L2252 VanDerWaalsContact O-CD1 3.29Å; R2248-L2252 WeakPolarHBondContact O-CD1 3.18Å; R2248-L2252 WeakPolarHBondContact O-CG 2.99Å; R2248-L2252 PolarHBondContact O-N 3.41Å; L2252-E2256 WeakPolarHBondContact O-CA 3.3Å; L2252-E2256 WeakPolarHBondContact O-CB 3.21Å; L2252-E2256 WeakPolarHBondContact O-CG 3.45Å; L2252-E2256 PolarHBondContact O-N 2.92Å
2253	G	37.8	Very low	37.5	Very low	43 Å²	43	95.4 Å²	95.4	44%	0.443	47%	0.471	S	S	.	.	H	α-helix	trans	-67.6	-38.1	171.4	0	0	0	0	0	113.2	K2249 I2250 Q2251 A2257	K2249-G2253 VanDerWaalsContact O-CA 3.23Å; K2249-G2253 WeakPolarHBondContact O-CA 3.38Å; K2249-G2253 PolarHBondContact O-N 3.4Å; I2250-G2253 CarbonylContact O-C 3.57Å; I2250-G2253 PolarHBondContact O-N 2.82Å; Q2251-G2253 VanDerWaalsContact C-N 3.32Å; G2253-A2257 VanDerWaalsContact O-CB 3.25Å; G2253-A2257 WeakPolarHBondContact O-CB 3.39Å; G2253-A2257 PolarHBondContact O-N 2.77Å
2254	L	41	Very low	37.5	Very low	86 Å²	86	94.9 Å²	94.9	45%	0.45	47%	0.465	S	S	.	.	H	α-helix	trans	-81.7	-30.4	172.7	-92.4	76.6	0	0	0	111.9	Y1955 I2250 A2257 E2258	Y1955-L2254 HydrophobicContact CE1-CD2 4.4Å; Y1955-L2254 HydrophobicContact CE1-CG 4.08Å; Y1955-L2254 PolarHBondContact OH-O 3.14Å; Y1955-L2254 VanDerWaalsContact OH-O 3.11Å; I2250-L2254 HydrophobicContact CG2-CD1 3.95Å; I2250-L2254 VanDerWaalsContact O-CB 3.3Å; I2250-L2254 WeakPolarHBondContact O-CB 3.46Å; I2250-L2254 WeakPolarHBondContact O-CD1 3.46Å; I2250-L2254 PolarHBondContact O-N 3.28Å; L2254-A2257 CarbonylContact O-C 3.5Å; L2254-A2257 PolarHBondContact O-N 3.48Å; L2254-E2258 WeakPolarHBondContact O-CB 3.38Å; L2254-E2258 WeakPolarHBondContact O-CG 3.49Å; L2254-E2258 PolarHBondContact O-N 2.72Å
2255	Q	37	Very low	37.2	Very low	104 Å²	104	96.1 Å²	96.1	49%	0.486	48%	0.475	S	S	.	.	H	α-helix	trans	-89.4	-23.6	-177.8	-167.3	164.1	85.2	0	0	112.4	Q2251 A2257 N2259	Q2251-Q2255 VanDerWaalsContact O-CA 3.31Å; Q2251-Q2255 WeakPolarHBondContact O-CA 3.28Å; Q2251-Q2255 WeakPolarHBondContact O-CB 3.41Å; Q2251-Q2255 PolarHBondContact O-N 3.34Å; Q2255-A2257 VanDerWaalsContact C-N 3.28Å; Q2255-N2259 VanDerWaalsContact CG-ND2 3.33Å; Q2255-N2259 WeakPolarHBondContact CG-ND2 3.41Å; Q2255-N2259 WeakPolarHBondContact O-CB 3.28Å; Q2255-N2259 PolarHBondContact O-N 3.22Å; Q2255-N2259 PolarHBondContact O-ND2 3.48Å
2256	E	37.7	Very low	36.9	Very low	150 Å²	150	101.5 Å²	101.5	70%	0.701	50%	0.498	S	S	*	.	H	α-helix	trans	-71.5	-24.4	158	-70.3	-163	147.6	0	0	111.2	L2252 A2260	L2252-E2256 WeakPolarHBondContact O-CA 3.3Å; L2252-E2256 WeakPolarHBondContact O-CB 3.21Å; L2252-E2256 WeakPolarHBondContact O-CG 3.45Å; L2252-E2256 PolarHBondContact O-N 2.92Å; E2256-A2260 VanDerWaalsContact O-CB 3.22Å; E2256-A2260 WeakPolarHBondContact O-CB 3.1Å; E2256-A2260 PolarHBondContact O-N 3.15Å
2257	A	39.3	Very low	36.7	Very low	16 Å²	16	101.2 Å²	101.2	13%	0.132	51%	0.506	C	S	.	.	H	α-helix	trans	-82.9	-39	174	0	0	0	0	0	113.7	Y1955 G2253 L2254 Q2255 A2260 E2261	Y1955-A2257 HydrophobicContact CD2-CB 4.45Å; Y1955-A2257 HydrophobicContact CE2-CB 3.53Å; Y1955-A2257 WeakPolarHBondContact OH-CB 3.15Å; G2253-A2257 VanDerWaalsContact O-CB 3.25Å; G2253-A2257 WeakPolarHBondContact O-CB 3.39Å; G2253-A2257 PolarHBondContact O-N 2.77Å; L2254-A2257 CarbonylContact O-C 3.5Å; L2254-A2257 PolarHBondContact O-N 3.48Å; Q2255-A2257 VanDerWaalsContact C-N 3.28Å; A2257-A2260 WeakPolarHBondContact O-CB 3.49Å; A2257-A2260 PolarHBondContact O-N 3.07Å; A2257-E2261 PolarHBondContact O-N 3.29Å
2258	E	37.2	Very low	36.5	Very low	104 Å²	104	99.4 Å²	99.4	49%	0.486	51%	0.509	S	S	.	.	H	α-helix	trans	-68.6	-41	171.2	-77	-164.6	103.3	0	0	111.3	Y1955 L2254 A2260 E2261 R2262	Y1955-E2258 WeakPolarHBondContact OH-CG 3.46Å; Y1955-E2258 PolarHBondContact OH-N 3.37Å; L2254-E2258 WeakPolarHBondContact O-CB 3.38Å; L2254-E2258 WeakPolarHBondContact O-CG 3.49Å; L2254-E2258 PolarHBondContact O-N 2.72Å; E2258-A2260 VanDerWaalsContact C-N 3.27Å; E2258-A2260 PolarHBondContact O-N 3.28Å; E2258-E2261 PolarHBondContact O-N 2.65Å; E2258-R2262 PolarHBondContact O-N 2.86Å
2259	N	39.8	Very low	36.3	Very low	77 Å²	77	102.6 Å²	102.6	41%	0.412	53%	0.529	S	S	.	.	H	α-helix	trans	-73.5	-17.6	172.5	-71.5	-68.1	0	0	0	112.8	Q2255 I2263	Q2255-N2259 VanDerWaalsContact CG-ND2 3.33Å; Q2255-N2259 WeakPolarHBondContact CG-ND2 3.41Å; Q2255-N2259 WeakPolarHBondContact O-CB 3.28Å; Q2255-N2259 PolarHBondContact O-N 3.22Å; Q2255-N2259 PolarHBondContact O-ND2 3.48Å; N2259-I2263 HydrophobicContact CB-CD1 4.28Å; N2259-I2263 VanDerWaalsContact O-CB 3.25Å; N2259-I2263 WeakPolarHBondContact O-CB 3.5Å; N2259-I2263 WeakPolarHBondContact O-CG1 3.12Å; N2259-I2263 PolarHBondContact O-N 3.02Å; N2259-I2263 VanDerWaalsContact O-N 3.16Å
2260	A	39.6	Very low	36.1	Very low	49 Å²	49	103.5 Å²	103.5	41%	0.405	54%	0.539	S	S	.	.	H	α-helix	trans	-65.5	-43.5	168.3	0	0	0	0	0	111.7	E2256 A2257 E2258	E2256-A2260 VanDerWaalsContact O-CB 3.22Å; E2256-A2260 WeakPolarHBondContact O-CB 3.1Å; E2256-A2260 PolarHBondContact O-N 3.15Å; A2257-A2260 WeakPolarHBondContact O-CB 3.49Å; A2257-A2260 PolarHBondContact O-N 3.07Å; E2258-A2260 VanDerWaalsContact C-N 3.27Å; E2258-A2260 PolarHBondContact O-N 3.28Å
2261	E	35.1	Very low	35.9	Very low	150 Å²	150	110 Å²	110	70%	0.701	56%	0.557	S	S	*	*	H	α-helix	trans	-77.5	-35	176.2	-75.5	-157.4	117.2	0	0	113.4	A2257 E2258 I2263	A2257-E2261 PolarHBondContact O-N 3.29Å; E2258-E2261 PolarHBondContact O-N 2.65Å; E2261-I2263 VanDerWaalsContact C-N 3.33Å; E2261-I2263 PolarHBondContact O-N 2.88Å
2262	R	33.5	Very low	35.6	Very low	203 Å²	203	116.7 Å²	116.7	77%	0.766	58%	0.579	S	S	*	*	H	α-helix	trans	-75.5	-11.2	177.7	-70.9	-166.4	176.5	-156	-0.3	115.2	E2258	E2258-R2262 PolarHBondContact O-N 2.86Å
2263	I	40.2	Very low	35.3	Very low	117 Å²	117	118.5 Å²	118.5	60%	0.6	59%	0.588	S	S	*	*	H	α-helix	trans	-101.9	-20.9	-179.8	-67	-179	0	0	0	115	N2259 E2261	N2259-I2263 HydrophobicContact CB-CD1 4.28Å; N2259-I2263 VanDerWaalsContact O-CB 3.25Å; N2259-I2263 WeakPolarHBondContact O-CB 3.5Å; N2259-I2263 WeakPolarHBondContact O-CG1 3.12Å; N2259-I2263 PolarHBondContact O-N 3.02Å; N2259-I2263 VanDerWaalsContact O-N 3.16Å; E2261-I2263 VanDerWaalsContact C-N 3.33Å; E2261-I2263 PolarHBondContact O-N 2.88Å
2264	E	33.9	Very low	34.8	Very low	109 Å²	109	127.9 Å²	127.9	51%	0.509	61%	0.61	S	S	.	*	H	α-helix	trans	-80.1	-24.4	170.2	-76.6	-122	108.1	0	0	113.6	I1950 G2267 A2268	I1950-E2264 HydrophobicContact CD1-CG 4.38Å; I1950-E2264 WeakPolarHBondContact CD1-OE1 3.43Å; E2264-G2267 PolarHBondContact O-N 3.09Å; E2264-A2268 PolarHBondContact O-N 2.94Å
2265	L	30.6	Very low	34.2	Very low	143 Å²	143	133.2 Å²	133.2	75%	0.749	63%	0.629	S	S	*	*	H	α-helix	trans	-82.1	-11	-175.6	-103.4	168.1	0	0	0	116.9
2266	Q	31.4	Very low	33.8	Very low	164 Å²	164	136.3 Å²	136.3	77%	0.766	65%	0.648	S	S	*	*	H	α-helix	trans	-108.7	-10.7	161.7	-69.9	-165.3	-2.1	0	0	113.6
2267	G	33.6	Very low	33.3	Very low	33 Å²	33	134.5 Å²	134.5	34%	0.34	65%	0.653	S	S	.	*	H	α-helix	trans	-80.4	-38.2	-178.2	0	0	0	0	0	115.1	E2264	E2264-G2267 PolarHBondContact O-N 3.09Å
2268	A	31.4	Very low	32.7	Very low	67 Å²	67	140 Å²	140	55%	0.554	69%	0.685	S	S	*	*	S	Bend	trans	-89	-44	-170.7	0	0	0	0	0	114.1	E2264 L2270	E2264-A2268 PolarHBondContact O-N 2.94Å; A2268-L2270 VanDerWaalsContact C-N 3.34Å; A2268-L2270 PolarHBondContact O-N 2.93Å
2269	M	31.8	Very low	32.2	Very low	152 Å²	152	140 Å²	140	75%	0.749	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-25.9	-172.4	-158.1	169.8	-174.3	0	0	113.4
2270	L	34.6	Very low	31.8	Very low	130 Å²	130	142.8 Å²	142.8	68%	0.681	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	9.2	-179.2	-79.2	167.4	0	0	0	115.1	A2268	A2268-L2270 VanDerWaalsContact C-N 3.34Å; A2268-L2270 PolarHBondContact O-N 2.93Å
2271	R	33.3	Very low	31.6	Very low	221 Å²	221	145.7 Å²	145.7	83%	0.834	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	1.1	173.9	-73.5	-174.2	175.2	176.1	1.2	115.8
2272	R	31.9	Very low	31.4	Very low	244 Å²	244	143.4 Å²	143.4	92%	0.921	73%	0.731	S	S	*	*	S	Bend	trans	-109.4	-15	161.2	-94.7	-175.9	172.5	172.6	-0.8	114.8
2273	L	31.4	Very low	31.3	Very low	127 Å²	127	143.2 Å²	143.2	67%	0.665	74%	0.736	S	S	*	*	S	Bend	trans	-85.1	113.4	160.7	-77.3	168.3	0	0	0	109.8
2274	R	26.5	Very low	30.9	Very low	240 Å²	240	143 Å²	143	91%	0.906	74%	0.742	S	S	*	*	S	Bend	trans	80.2	54.9	161.7	-153.3	-176.8	-66.5	150.8	-0.4	118.7
2275	K	29.2	Very low	30.6	Very low	197 Å²	197	142.5 Å²	142.5	86%	0.857	75%	0.749	S	S	*	*			trans	-158.6	137.8	141.8	-111.7	164.7	-173.3	177.3	0	111.4
2276	L	27.3	Very low	30.4	Very low	169 Å²	169	143.7 Å²	143.7	89%	0.885	75%	0.751	S	S	*	*	S	Bend	trans	64.9	128.4	-165.5	-55.4	170.6	0	0	0	113.7
2277	S	28.1	Very low	30.1	Very low	113 Å²	113	142.8 Å²	142.8	79%	0.79	75%	0.75	S	S	*	*			cis	-98.7	139.1	-2	52.6	0	0	0	0	113.2
2278	T	26.1	Very low	29.7	Very low	132 Å²	132	146.2 Å²	146.2	81%	0.81	77%	0.769	S	S	*	*			trans	-105.1	108.1	170.9	44.7	0	0	0	0	110.6
2279	S	28	Very low	29.5	Very low	103 Å²	103	146.1 Å²	146.1	72%	0.72	78%	0.775	S	S	*	*			trans	-160.2	104.4	160.4	53.6	0	0	0	0	110.2
2280	V	29.7	Very low	29.3	Very low	135 Å²	135	144.9 Å²	144.9	82%	0.818	78%	0.776	S	S	*	*				84.1	133.7	65.9	161.7	0	0	0	0	111.9
2281	P	35.6	Very low	28.8	Very low	110 Å²	110	144.9 Å²	144.9	71%	0.714	78%	0.776	S	S	*	*			cis	-134.6	178.4	-18.8	35	-13.7	0	0	0	114.1
2282	S	32.3	Very low	28.4	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	77%	0.773	S	S	*	*				166.4	160.2	77.3	58.1	0	0	0	0	116.3
2283	K	30.4	Very low	28.1	Very low	199 Å²	199	133.5 Å²	133.5	87%	0.865	76%	0.757	S	S	*	*			trans	83.2	144.4	159.6	-75.4	-177.6	177.1	178.3	0	119.5
2284	P	31.7	Very low	27.8	Very low	112 Å²	112	133.2 Å²	133.2	73%	0.727	76%	0.76	S	S	*	*				-145.8	-165.6	-129.2	39.7	-16.5	0	0	0	115.5
2285	C	27.7	Very low	27.7	Very low	99 Å²	99	126.2 Å²	126.2	67%	0.669	75%	0.753	S	S	*	*			trans	127.1	124.5	145.6	-67.9	0	0	0	0	115
2286	H	26.7	Very low	27.5	Very low	168 Å²	168	121.3 Å²	121.3	78%	0.778	74%	0.744	S	S	*	*			trans	45.1	141.3	143.3	-58.5	-71.4	0	0	0	120.5
2287	L	25.6	Very low	27.5	Very low	145 Å²	145	121.2 Å²	121.2	76%	0.759	74%	0.739	S	S	*	*			cis	-153.3	179.2	13.8	-155.5	65.8	0	0	0	111
2288	S	25.2	Very low	27.4	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	73%	0.732	S	S	*	*			trans	-49.1	156.5	166	53.4	0	0	0	0	114.1
2289	G	26.7	Very low	27.5	Very low	65 Å²	65	119.4 Å²	119.4	67%	0.67	72%	0.715	S	S	*	*			cis	145.3	-154.2	9.3	0	0	0	0	0	109.5
2290	V	26.8	Very low	27.5	Very low	127 Å²	127	119.9 Å²	119.9	77%	0.77	70%	0.704	S	S	*	*			trans	68.1	88.4	174.3	-172	0	0	0	0	112.6
2291	N	24.9	Very low	27.5	Very low	129 Å²	129	117.8 Å²	117.8	69%	0.69	69%	0.685	S	S	*	*				86.2	139.6	76.4	-73	4.8	0	0	0	113
2292	N	25.3	Very low	27.2	Very low	145 Å²	145	115 Å²	115	78%	0.775	66%	0.664	S	S	*	*			trans	70.3	147.1	145.2	-68.7	10.5	0	0	0	119.1
2293	S	24.8	Very low	27	Very low	82 Å²	82	114.5 Å²	114.5	57%	0.573	65%	0.653	S	S	*	*			cis	-171.1	172	-15.6	51.3	0	0	0	0	110.9
2294	T	25.3	Very low	26.7	Very low	120 Å²	120	108.4 Å²	108.4	74%	0.736	63%	0.633	S	S	*	*			trans	53.6	136.5	140.3	51.5	0	0	0	0	121
2295	A	24.8	Very low	26.5	Very low	93 Å²	93	109.2 Å²	109.2	77%	0.769	63%	0.625	S	S	*	*			trans	71.9	152.7	139.2	0	0	0	0	0	116.3
2296	S	24.6	Very low	26.5	Very low	95 Å²	95	109.8 Å²	109.8	66%	0.664	62%	0.62	S	S	*	*			cis	-178.6	167.3	-14.7	49.4	0	0	0	0	106.9
2297	H	27.4	Very low	26.3	Very low	167 Å²	167	106.6 Å²	106.6	77%	0.773	61%	0.608	S	S	*	*			trans	67.1	154.8	163	-94	-140.6	0	0	0	114.1
2298	L	26.9	Very low	26.3	Very low	124 Å²	124	103.9 Å²	103.9	65%	0.649	59%	0.59	S	S	*	*			cis	-157	153.1	-15.2	-165.1	62	0	0	0	108.6
2299	D	26.4	Very low	26.2	Very low	82 Å²	82	105.3 Å²	105.3	44%	0.439	58%	0.584	S	S	.	*			trans	38.7	126.9	152	-87.6	-22	0	0	0	123.4	R1893	R1893-D2299 IonicContact CZ-OD1 3.86Å; R1893-D2299 IonicContact NH1-OD1 3.49Å; R1893-D2299 IonicContact NH2-OD1 2.82Å; R1893-D2299 PolarHBondContact NH2-OD1 3.46Å
2300	K	27.8	Very low	26.1	Very low	113 Å²	113	105.6 Å²	105.6	49%	0.491	59%	0.588	S	S	.	*				94	134.6	119.7	-77.3	171.4	-178	135.8	0	122.8	R1893	R1893-K2300 VanDerWaalsContact NH2-CG 3.31Å
2301	H	29.7	Very low	26	Very low	91 Å²	91	106.1 Å²	106.1	42%	0.421	58%	0.58	S	S	.	*			trans	70.2	87.5	135.7	-61.1	-18	0	0	0	120.9	E1892 W2322	E1892-H2301 PolarHBondContact OE1-N 2.69Å; E1892-H2301 IonicContact OE1-ND1 3.25Å; E1892-H2301 IonicContact OE2-CE1 2.68Å; E1892-H2301 PolarHBondContact OE2-CE1 3.13Å; E1892-H2301 IonicContact OE2-CG 2.73Å; E1892-H2301 PolarHBondContact OE2-N 3.42Å; E1892-H2301 IonicContact OE2-ND1 3.61Å; E1892-H2301 PolarHBondContact OE2-ND1 3.29Å; H2301-W2322 WeakPolarHBondContact O-CH2 3.38Å; H2301-W2322 WeakPolarHBondContact O-CZ3 3.3Å
2302	N	29.6	Very low	26.1	Very low	52 Å²	52	105.4 Å²	105.4	28%	0.278	58%	0.576	S	S	.	*				67.3	127.6	107.9	-73.4	-36.5	0	0	0	124.8	F1891 E1892	F1891-N2302 WeakPolarHBondContact CD1-ND2 3.44Å; F1891-N2302 WeakPolarHBondContact CD1-OD1 3.36Å; F1891-N2302 WeakPolarHBondContact CE1-OD1 3.47Å; F1891-N2302 WeakPolarHBondContact CG-ND2 2.85Å; F1891-N2302 WeakPolarHBondContact CZ-OD1 3.2Å; E1892-N2302 VanDerWaalsContact OE1-CG 3.24Å; E1892-N2302 PolarHBondContact OE1-ND2 2.94Å; E1892-N2302 PolarHBondContact OE1-OD1 3.46Å
2303	N	28.3	Very low	26.4	Very low	91 Å²	91	105.2 Å²	105.2	49%	0.487	57%	0.57	S	S	.	*				82.2	163.3	127.5	-68.1	-25.3	0	0	0	122.1	F1891	F1891-N2303 WeakPolarHBondContact CE2-ND2 3.33Å
2304	V	25	Very low	26.6	Very low	72 Å²	72	107.9 Å²	107.9	44%	0.436	58%	0.577	S	S	.	*			trans	73.4	94	173.8	-160	0	0	0	0	113
2305	K	28.1	Very low	26.9	Very low	129 Å²	129	109.1 Å²	109.1	56%	0.561	58%	0.579	S	S	*	*				55	109.2	84.2	-68.2	-175.3	175.3	179.6	0	113.7	H2495	K2305-H2495 VanDerWaalsContact CE-CD2 3.46Å; K2305-H2495 WeakPolarHBondContact CE-CD2 3.47Å; K2305-H2495 WeakPolarHBondContact CE-NE2 3.25Å; K2305-H2495 PolarHBondContact NZ-NE2 3.5Å
2306	I	26	Very low	27.3	Very low	110 Å²	110	108.6 Å²	108.6	56%	0.564	57%	0.57	S	S	*	*			trans	-177.2	117.7	154.8	-96.9	146.7	0	0	0	105.1	T2324	I2306-T2324 VanDerWaalsContact CD1-O 3.31Å; I2306-T2324 WeakPolarHBondContact CD1-O 3.26Å
2307	I	24.1	Very low	27.7	Very low	102 Å²	102	111.1 Å²	111.1	52%	0.523	57%	0.571	S	S	.	*				98.1	123.6	52.4	-73.7	167	0	0	0	112.3
2308	K	23.9	Very low	27.6	Very low	88 Å²	88	111.2 Å²	111.2	38%	0.383	57%	0.569	S	S	.	*			trans	14.7	129.7	161.7	-69.3	172.5	165.3	166.6	0	119	L2079 F2080 Q2081	L2079-K2308 HydrophobicContact CB-CG 3.94Å; L2079-K2308 WeakPolarHBondContact O-CE 3.44Å; F2080-K2308 HydrophobicContact CB-CD 4.42Å; F2080-K2308 WeakPolarHBondContact O-CE 3.12Å; F2080-K2308 PolarHBondContact O-NZ 3.28Å; Q2081-K2308 PolarHBondContact O-NZ 3.31Å; Q2081-K2308 VanDerWaalsContact O-NZ 3.12Å
2309	H	24.8	Very low	27.5	Very low	134 Å²	134	110.9 Å²	110.9	62%	0.62	57%	0.573	S	S	*	*				-144.4	145.8	121.8	-97.8	-78.4	0	0	0	108.5	F2311	H2309-F2311 HydrophobicContact CB-CB 4.29Å; H2309-F2311 HydrophobicContact CB-CD2 4.03Å; H2309-F2311 AromaticContact CE1-CD2 3.8Å; H2309-F2311 AromaticContact CE1-CE2 3.7Å; H2309-F2311 AromaticContact CG-CD2 3.64Å; H2309-F2311 AromaticContact ND1-CD2 3.26Å; H2309-F2311 VanDerWaalsContact ND1-CD2 3.26Å; H2309-F2311 WeakPolarHBondContact ND1-CD2 3.28Å; H2309-F2311 AromaticContact ND1-CE2 3.64Å
2310	G	24.8	Very low	27.6	Very low	72 Å²	72	111.8 Å²	111.8	74%	0.742	59%	0.585	S	S	*	*			cis	80.9	22.5	16.8	0	0	0	0	0	113.1
2311	F	23.8	Very low	27.5	Very low	138 Å²	138	111.5 Å²	111.5	61%	0.605	60%	0.596	S	S	*	*			trans	-165.7	123.6	173.9	-92.3	-75.6	0	0	0	103.5	H2309 Q2313	H2309-F2311 HydrophobicContact CB-CB 4.29Å; H2309-F2311 HydrophobicContact CB-CD2 4.03Å; H2309-F2311 AromaticContact CE1-CD2 3.8Å; H2309-F2311 AromaticContact CE1-CE2 3.7Å; H2309-F2311 AromaticContact CG-CD2 3.64Å; H2309-F2311 AromaticContact ND1-CD2 3.26Å; H2309-F2311 VanDerWaalsContact ND1-CD2 3.26Å; H2309-F2311 WeakPolarHBondContact ND1-CD2 3.28Å; H2309-F2311 AromaticContact ND1-CE2 3.64Å; F2311-Q2313 WeakPolarHBondContact CB-O 3.25Å; F2311-Q2313 HydrophobicContact CD1-CB 4.29Å; F2311-Q2313 WeakPolarHBondContact CD1-O 3.22Å
2312	N	27.7	Very low	27.3	Very low	113 Å²	113	115.5 Å²	115.5	60%	0.604	61%	0.608	S	S	*	*			cis	47	93.8	12.7	-145.9	-49.3	0	0	0	114.2	E2074	E2074-N2312 PolarHBondContact OE2-ND2 2.85Å
2313	Q	31.7	Very low	27.2	Very low	141 Å²	141	117.6 Å²	117.6	66%	0.659	62%	0.619	S	S	*	*			trans	75.9	144.2	-161.1	-52.6	-176.5	12	0	0	114.1	F2311	F2311-Q2313 WeakPolarHBondContact CB-O 3.25Å; F2311-Q2313 HydrophobicContact CD1-CB 4.29Å; F2311-Q2313 WeakPolarHBondContact CD1-O 3.22Å
2314	I	28.4	Very low	27.2	Very low	138 Å²	138	116.6 Å²	116.6	71%	0.708	62%	0.616	S	S	*	*			cis	-160	170.5	-16	-110.7	161.9	0	0	0	105.5
2315	N	31.1	Very low	27.2	Very low	147 Å²	147	120.1 Å²	120.1	79%	0.786	63%	0.628	S	S	*	*			trans	-3.4	141.9	161.5	-65.7	-35.1	0	0	0	119.1
2316	S	33	Very low	27.2	Very low	81 Å²	81	119.8 Å²	119.8	57%	0.566	63%	0.632	S	S	*	*			cis	173.9	170.1	1.1	55.3	0	0	0	0	109.1
2317	Q	32.5	Very low	27.4	Very low	149 Å²	149	122.1 Å²	122.1	70%	0.696	65%	0.645	S	S	*	*			trans	71.7	139.6	163.8	-55.1	166.6	52.9	0	0	117.8
2318	K	26.1	Very low	27.9	Very low	169 Å²	169	122 Å²	122	74%	0.735	65%	0.651	S	S	*	*			trans	66.3	128.8	146.9	-70.4	165.1	178.8	164.3	0	120.8
2319	T	25.6	Very low	27.9	Very low	117 Å²	117	124 Å²	124	72%	0.718	67%	0.666	S	S	*	*			trans	51.9	118.7	131.6	68.5	0	0	0	0	122.3
2320	S	27.4	Very low	27.9	Very low	100 Å²	100	120.2 Å²	120.2	70%	0.699	65%	0.654	S	S	*	*				72.1	130.1	120.7	73.7	0	0	0	0	123.9
2321	C	26.6	Very low	28	Very low	107 Å²	107	120.2 Å²	120.2	72%	0.723	64%	0.64	S	S	*	*			trans	89	121.6	134	-71.8	0	0	0	0	124.5
2322	W	24.5	Very low	28	Very low	176 Å²	176	118 Å²	118	67%	0.667	63%	0.632	S	S	*	*			trans	63.7	141.5	135.3	-67.2	65.4	0	0	0	124.3	H2301	H2301-W2322 WeakPolarHBondContact O-CH2 3.38Å; H2301-W2322 WeakPolarHBondContact O-CZ3 3.3Å
2323	N	27.5	Very low	27.9	Very low	95 Å²	95	119.6 Å²	119.6	51%	0.508	63%	0.633	S	S	.	*			trans	95.6	115.8	145.4	-72.5	-13.1	0	0	0	126
2324	T	28.2	Very low	27.6	Very low	71 Å²	71	117.5 Å²	117.5	44%	0.436	63%	0.634	S	S	.	*				72.9	126.6	126.9	61	0	0	0	0	126.6	I2306	I2306-T2324 VanDerWaalsContact CD1-O 3.31Å; I2306-T2324 WeakPolarHBondContact CD1-O 3.26Å
2325	E	25	Very low	27.7	Very low	146 Å²	146	115.7 Å²	115.7	68%	0.682	63%	0.631	S	S	*	*			trans	90.5	124.7	136.2	-82.7	-166.2	-155.3	0	0	126.1
2326	N	29.2	Very low	27.5	Very low	121 Å²	121	114.9 Å²	114.9	65%	0.647	63%	0.625	S	S	*	*			trans	74.9	121.6	131.3	-76.1	-38.6	0	0	0	127.5
2327	L	28.4	Very low	27.3	Very low	160 Å²	160	115.8 Å²	115.8	84%	0.838	63%	0.629	S	S	*	*			trans	76	158.4	143.5	-91.3	72.9	0	0	0	123
2328	P	34.7	Very low	26.9	Very low	100 Å²	100	115.4 Å²	115.4	65%	0.649	63%	0.631	S	S	*	*			trans	-120.1	-176.8	-164.7	45.7	-35	0	0	0	115.2
2329	D	24.8	Very low	26.9	Very low	129 Å²	129	114.2 Å²	114.2	69%	0.69	63%	0.631	S	S	*	*				169	153.2	123.4	-100.2	-21.7	0	0	0	115.3
2330	S	25.6	Very low	26.8	Very low	54 Å²	54	111.8 Å²	111.8	38%	0.378	63%	0.63	S	S	.	*			trans	70.6	121.4	142.5	68.8	0	0	0	0	123.7
2331	T	25.3	Very low	26.7	Very low	73 Å²	73	115 Å²	115	45%	0.448	63%	0.633	S	S	.	*			trans	72.3	148.3	131.7	65.8	0	0	0	0	119.2	I2084 E2086	I2084-T2331 PolarHBondContact O-N 3.46Å; E2086-T2331 HydrophobicContact CB-CG2 3.8Å; E2086-T2331 HydrophobicContact CG-CG2 4.43Å
2332	E	24.7	Very low	26.5	Very low	91 Å²	91	114.5 Å²	114.5	43%	0.425	63%	0.627	S	S	.	*			cis	-166.4	157.6	-11.8	-114.8	-179.6	166.9	0	0	108.3	N2085	N2085-E2332 WeakPolarHBondContact O-CG 3.19Å
2333	K	25.2	Very low	26.4	Very low	146 Å²	146	113 Å²	113	64%	0.635	63%	0.627	S	S	*	*			trans	52.4	124.3	148	-61.5	161.5	-170.7	154.3	0	117.7
2334	S	26.6	Very low	26.2	Very low	98 Å²	98	115.4 Å²	115.4	69%	0.685	64%	0.635	S	S	*	*				50.9	156.6	63.1	95.3	0	0	0	0	113.9
2335	P	30	Very low	25.9	Very low	99 Å²	99	118 Å²	118	64%	0.643	65%	0.651	S	S	*	*			cis	-142.1	169.2	15.9	31.3	-6.4	0	0	0	117.3
2336	I	26.8	Very low	25.8	Very low	130 Å²	130	114 Å²	114	67%	0.667	65%	0.649	S	S	*	*				28.4	153.8	119	-38.8	159.3	0	0	0	118.6
2337	P	28.7	Very low	25.6	Very low	100 Å²	100	113.3 Å²	113.3	65%	0.649	64%	0.644	S	S	*	*			cis	-110	-157.9	-26.2	30.4	-11.7	0	0	0	111
2338	I	24.6	Very low	25.4	Very low	141 Å²	141	112.4 Å²	112.4	72%	0.723	64%	0.639	S	S	*	*				-166.4	117	77.9	-87	178.9	0	0	0	110.5
2339	I	25	Very low	24.9	Very low	144 Å²	144	112 Å²	112	74%	0.738	64%	0.639	S	S	*	*				39.5	112.2	126.8	-50.2	163.3	0	0	0	118.8
2340	G	24.5	Very low	24.9	Very low	67 Å²	67	109.6 Å²	109.6	69%	0.691	63%	0.632	S	S	*	*			trans	73.8	174.6	147	0	0	0	0	0	116.6
2341	H	24.1	Very low	24.9	Very low	166 Å²	166	112.7 Å²	112.7	77%	0.769	64%	0.64	S	S	*	*			cis	-150.2	157.2	-15	-132.8	-86.6	0	0	0	108.6
2342	T	22.2	Very low	25	Very low	97 Å²	97	115 Å²	115	60%	0.595	65%	0.65	S	S	*	*			trans	-17.8	144.8	155.7	59.7	0	0	0	0	116
2343	H	23.6	Very low	25.2	Very low	146 Å²	146	118.7 Å²	118.7	68%	0.676	67%	0.669	S	S	*	*				-169.4	172.6	52.1	-123.1	-80.6	0	0	0	110.9
2344	E	22.5	Very low	25.5	Very low	144 Å²	144	115 Å²	115	67%	0.673	67%	0.673	S	S	*	*			trans	58.5	132.8	165.2	-89.5	72.1	-96.2	0	0	118
2345	V	23.1	Very low	25.6	Very low	126 Å²	126	114.8 Å²	114.8	76%	0.764	66%	0.664	S	S	*	*				55.1	110.8	76.9	-175.8	0	0	0	0	112.4
2346	G	22.9	Very low	25.4	Very low	63 Å²	63	115.2 Å²	115.2	65%	0.649	66%	0.656	S	S	*	*			cis	154.8	-169.2	-3	0	0	0	0	0	111.3
2347	L	23.6	Very low	25.2	Very low	105 Å²	105	112.5 Å²	112.5	55%	0.55	64%	0.642	S	S	.	*			trans	64	158.1	170.5	-76.6	167.7	0	0	0	117.8	Q2024	Q2024-L2347 HydrophobicContact CG-CD2 4.32Å
2348	I	24.4	Very low	25.1	Very low	142 Å²	142	109.6 Å²	109.6	73%	0.728	62%	0.624	S	S	*	*			trans	66.4	129.1	150	-74.8	159.4	0	0	0	117.1
2349	S	24.5	Very low	25.1	Very low	91 Å²	91	107.5 Å²	107.5	64%	0.636	61%	0.611	S	S	*	*			cis	-164.1	-172.2	-12.1	60.9	0	0	0	0	108.9
2350	S	24.6	Very low	25.1	Very low	78 Å²	78	105.9 Å²	105.9	55%	0.545	61%	0.608	S	S	.	*			trans	72.9	121	157.4	-61.8	0	0	0	0	115.4
2351	E	26.7	Very low	25.1	Very low	120 Å²	120	104.6 Å²	104.6	56%	0.561	59%	0.591	S	S	*	*				69	126.2	64.2	-63.4	140.4	-171.9	0	0	110.7	K2022	K2022-E2351 IonicContact NZ-OE1 3.86Å; K2022-E2351 PolarHBondContact NZ-OE1 2.89Å
2352	D	26.9	Very low	25.1	Very low	120 Å²	120	99.9 Å²	99.9	64%	0.642	57%	0.571	S	S	*	*			cis	-161.7	168.8	-0.1	-94.1	-30.1	0	0	0	110.3
2353	M	28.9	Very low	25.2	Very low	169 Å²	169	96.8 Å²	96.8	83%	0.833	55%	0.55	S	S	*	.	S	Bend		143.8	134.5	121.5	-78.4	-175.6	-75.4	0	0	111.4
2354	G	32	Very low	25.3	Very low	69 Å²	69	92 Å²	92	71%	0.711	53%	0.528	S	S	*	.	S	Bend	trans	68.6	48.5	-149.1	0	0	0	0	0	108.6
2355	D	27.7	Very low	25.4	Very low	94 Å²	94	86.4 Å²	86.4	50%	0.503	50%	0.502	S	S	.	.				47.4	81.6	75.6	-58.1	-59.3	0	0	0	106.2	L2357	D2355-L2357 VanDerWaalsContact O-CD2 3.28Å; D2355-L2357 WeakPolarHBondContact O-CD2 3.22Å; D2355-L2357 WeakPolarHBondContact O-CG 3.23Å
2356	F	25.4	Very low	25.4	Very low	107 Å²	107	81.1 Å²	81.1	47%	0.469	47%	0.472	S	S	.	.				69.8	85.6	63.1	-151.6	-63.9	0	0	0	111.7	I2020 T2021	I2020-F2356 HydrophobicContact CB-CD1 4.24Å; I2020-F2356 HydrophobicContact CB-CE1 3.98Å; I2020-F2356 HydrophobicContact CB-CZ 4.43Å; I2020-F2356 HydrophobicContact CD1-CB 4.33Å; I2020-F2356 HydrophobicContact CD1-CD1 3.46Å; I2020-F2356 VanDerWaalsContact CD1-CD1 3.46Å; I2020-F2356 HydrophobicContact CD1-CE1 4.11Å; I2020-F2356 HydrophobicContact CD1-CG 3.89Å; I2020-F2356 HydrophobicContact CG1-CD1 3.45Å; I2020-F2356 VanDerWaalsContact CG1-CD1 3.45Å; I2020-F2356 HydrophobicContact CG1-CE1 3.57Å; I2020-F2356 HydrophobicContact CG1-CG 4.29Å; I2020-F2356 HydrophobicContact CG1-CZ 4.46Å; I2020-F2356 HydrophobicContact CG2-CD1 4.03Å; I2020-F2356 HydrophobicContact CG2-CD2 4.32Å; I2020-F2356 HydrophobicContact CG2-CE1 3.83Å; I2020-F2356 HydrophobicContact CG2-CE2 4.11Å; I2020-F2356 HydrophobicContact CG2-CG 4.31Å; I2020-F2356 HydrophobicContact CG2-CZ 3.89Å; T2021-F2356 HydrophobicContact CG2-CE1 4.27Å; T2021-F2356 HydrophobicContact CG2-CE2 3.58Å; T2021-F2356 HydrophobicContact CG2-CZ 3.32Å
2357	L	24.5	Very low	25.5	Very low	73 Å²	73	79.2 Å²	79.2	38%	0.382	45%	0.447	S	S	.	.			trans	-137.3	-145.2	-157.7	-51.2	-176.3	0	0	0	114.1	D2355 K2476 E2477 E2478	D2355-L2357 VanDerWaalsContact O-CD2 3.28Å; D2355-L2357 WeakPolarHBondContact O-CD2 3.22Å; D2355-L2357 WeakPolarHBondContact O-CG 3.23Å; L2357-K2476 CarbonylContact O-C 3.54Å; L2357-E2477 VanDerWaalsContact CA-N 3.29Å; L2357-E2477 VanDerWaalsContact CB-C 3.46Å; L2357-E2477 WeakPolarHBondContact CB-O 3.11Å; L2357-E2477 WeakPolarHBondContact CD1-O 3.25Å; L2357-E2477 HydrophobicContact CD2-CB 4.42Å; L2357-E2477 WeakPolarHBondContact CD2-O 3.11Å; L2357-E2477 VanDerWaalsContact CG-O 3.29Å; L2357-E2477 WeakPolarHBondContact CG-O 3.24Å; L2357-E2478 WeakPolarHBondContact CB-O 3.41Å
2358	S	26.3	Very low	25.5	Very low	39 Å²	39	77.9 Å²	77.9	27%	0.273	44%	0.441	S	S	.	.			trans	-126.6	166.9	-145	-65.9	0	0	0	0	123.6	K2476 E2477 E2478	S2358-K2476 WeakPolarHBondContact OG-CA 3.47Å; S2358-K2476 WeakPolarHBondContact OG-CB 3.39Å; S2358-K2476 WeakPolarHBondContact OG-CG 3.3Å; S2358-K2476 PolarHBondContact OG-NZ 2.84Å; S2358-E2477 WeakPolarHBondContact OG-CA 3.38Å; S2358-E2477 PolarHBondContact OG-N 2.99Å; S2358-E2478 PolarHBondContact N-O 2.95Å; S2358-E2478 PolarHBondContact OG-N 3.18Å
2359	H	24.4	Very low	25.5	Very low	98 Å²	98	72.9 Å²	72.9	45%	0.454	42%	0.417	S	S	.	.	S	Bend		-23.4	131.9	121.9	-59	-34.1	0	0	0	117.4	E2475 K2476	H2359-E2475 IonicContact CD2-OE1 2.81Å; H2359-K2476 HydrophobicContact CB-CG 4.34Å
2360	V	24.1	Very low	25.6	Very low	110 Å²	110	70.9 Å²	70.9	67%	0.667	40%	0.4	S	S	*	.			trans	63.1	106.7	145.9	179.6	0	0	0	0	115.3
2361	A	25.7	Very low	25.7	Very low	40 Å²	40	74.3 Å²	74.3	33%	0.331	41%	0.411	S	S	.	.			cis	-168.7	-162.1	7	0	0	0	0	0	112.7	E2479	A2361-E2479 PolarHBondContact N-OE1 2.66Å
2362	N	24.1	Very low	25.8	Very low	66 Å²	66	73.8 Å²	73.8	35%	0.353	41%	0.412	S	S	.	.			trans	70.7	167.7	148.4	-63.3	-2.6	0	0	0	115.6	E2364	N2362-E2364 HydrophobicContact CB-CG 3.91Å; N2362-E2364 VanDerWaalsContact CG-CG 3.45Å; N2362-E2364 VanDerWaalsContact CG-OE2 3.23Å; N2362-E2364 PolarHBondContact ND2-OE2 2.93Å; N2362-E2364 VanDerWaalsContact OD1-CG 3.22Å; N2362-E2364 WeakPolarHBondContact OD1-CG 3.31Å; N2362-E2364 PolarHBondContact OD1-OE2 3.31Å
2363	E	23.9	Very low	25.8	Very low	32 Å²	32	74.9 Å²	74.9	15%	0.15	42%	0.417	C	S	.	.			cis	-107	102.1	-2.9	-73.3	174.6	121.4	0	0	110.5	M1467 V1561 I1565 R1568	M1467-E2363 PolarHBondContact N-OE1 2.67Å; V1561-E2363 WeakPolarHBondContact CG1-OE2 3.5Å; I1565-E2363 HydrophobicContact CD1-CB 3.59Å; I1565-E2363 HydrophobicContact CD1-CG 3.77Å; I1565-E2363 WeakPolarHBondContact CD1-OE1 3.14Å; I1565-E2363 HydrophobicContact CG1-CB 4.15Å; R1568-E2363 PolarHBondContact NH1-O 3.17Å; R1568-E2363 PolarHBondContact NH2-O 2.96Å
2364	E	24.6	Very low	25.6	Very low	45 Å²	45	73.6 Å²	73.6	21%	0.21	41%	0.414	C	S	.	.				84.8	167.2	76.8	-89.8	-151.7	72.2	0	0	116.6	K1462 L1466 R1568 N2362	K1462-E2364 WeakPolarHBondContact CE-OE1 3.33Å; K1462-E2364 IonicContact NZ-OE1 2.95Å; K1462-E2364 PolarHBondContact NZ-OE1 3.17Å; L1466-E2364 HydrophobicContact CD1-CB 3.78Å; L1466-E2364 HydrophobicContact CD1-CG 4.44Å; L1466-E2364 VanDerWaalsContact CD2-CD 3.44Å; L1466-E2364 WeakPolarHBondContact CD2-OE1 3.41Å; L1466-E2364 WeakPolarHBondContact CD2-OE2 3.18Å; R1568-E2364 VanDerWaalsContact CD-O 3.25Å; R1568-E2364 WeakPolarHBondContact CD-O 3.32Å; R1568-E2364 PolarHBondContact NE-O 3.13Å; R1568-E2364 PolarHBondContact NH1-O 3.41Å; N2362-E2364 HydrophobicContact CB-CG 3.91Å; N2362-E2364 VanDerWaalsContact CG-CG 3.45Å; N2362-E2364 VanDerWaalsContact CG-OE2 3.23Å; N2362-E2364 PolarHBondContact ND2-OE2 2.93Å; N2362-E2364 VanDerWaalsContact OD1-CG 3.22Å; N2362-E2364 WeakPolarHBondContact OD1-CG 3.31Å; N2362-E2364 PolarHBondContact OD1-OE2 3.31Å
2365	E	25.8	Very low	25.3	Very low	27 Å²	27	76.9 Å²	76.9	13%	0.126	41%	0.409	C	S	.	.			trans	86.4	134.7	178.9	-34.3	-125.7	93.5	0	0	114.4	K1462 L1466 I1565 R1568 V1569	K1462-E2365 IonicContact NZ-OE1 2.65Å; K1462-E2365 PolarHBondContact NZ-OE1 2.63Å; L1466-E2365 HydrophobicContact CD1-CG 4.04Å; I1565-E2365 VanDerWaalsContact CA-CD 3.49Å; I1565-E2365 VanDerWaalsContact CA-OE2 3.23Å; I1565-E2365 WeakPolarHBondContact CA-OE2 3.38Å; I1565-E2365 HydrophobicContact CB-CG 4.5Å; I1565-E2365 HydrophobicContact CG1-CG 4.39Å; I1565-E2365 VanDerWaalsContact O-CD 3.29Å; R1568-E2365 HydrophobicContact CB-CB 3.56Å; R1568-E2365 HydrophobicContact CB-CG 4Å; R1568-E2365 WeakPolarHBondContact CD-O 3.33Å; R1568-E2365 HydrophobicContact CG-CB 3.81Å; V1569-E2365 WeakPolarHBondContact CA-OE2 3.25Å; V1569-E2365 VanDerWaalsContact CB-CD 3.49Å; V1569-E2365 VanDerWaalsContact CB-OE1 3.22Å; V1569-E2365 WeakPolarHBondContact CB-OE1 3.37Å; V1569-E2365 VanDerWaalsContact CB-OE2 3.25Å; V1569-E2365 WeakPolarHBondContact CB-OE2 3.37Å; V1569-E2365 HydrophobicContact CG2-CB 4.14Å; V1569-E2365 VanDerWaalsContact CG2-CD 3.47Å; V1569-E2365 HydrophobicContact CG2-CG 4.36Å; V1569-E2365 WeakPolarHBondContact CG2-OE1 3.21Å; V1569-E2365 PolarHBondContact N-OE2 3.09Å
2366	A	23.3	Very low	25.2	Very low	16 Å²	16	75 Å²	75	13%	0.132	40%	0.398	C	S	.	.	S	Bend	cis	-122.2	119.2	-0.1	0	0	0	0	0	111.1	R1568 V1569 Q1572	R1568-A2366 WeakPolarHBondContact O-CB 3.49Å; V1569-A2366 HydrophobicContact CB-CB 4.39Å; V1569-A2366 HydrophobicContact CG2-CB 3.68Å; Q1572-A2366 HydrophobicContact CB-CB 3.72Å; Q1572-A2366 HydrophobicContact CG-CB 3.75Å; Q1572-A2366 PolarHBondContact NE2-O 3.29Å; Q1572-A2366 VanDerWaalsContact NE2-O 3.15Å; Q1572-A2366 PolarHBondContact OE1-O 3.4Å
2367	V	24.3	Very low	25.1	Very low	23 Å²	23	72.8 Å²	72.8	14%	0.139	40%	0.396	C	S	.	.	S	Bend	trans	41.7	140.4	144.5	-104	0	0	0	0	120.1	K789 Y1458 K1462 V1569 V1576	K789-V2367 PolarHBondContact NZ-O 2.94Å; Y1458-V2367 HydrophobicContact CE1-CB 4.43Å; Y1458-V2367 HydrophobicContact CE1-CG1 4.31Å; Y1458-V2367 HydrophobicContact CE1-CG2 3.9Å; Y1458-V2367 HydrophobicContact CE2-CG1 4.19Å; Y1458-V2367 WeakPolarHBondContact OH-CB 3.31Å; Y1458-V2367 WeakPolarHBondContact OH-CG1 3.49Å; Y1458-V2367 WeakPolarHBondContact OH-CG2 3.29Å; K1462-V2367 HydrophobicContact CD-CB 4.19Å; K1462-V2367 HydrophobicContact CD-CG1 3.3Å; K1462-V2367 HydrophobicContact CD-CG2 4.09Å; V1569-V2367 HydrophobicContact CG2-CG2 3.84Å; V1576-V2367 HydrophobicContact CG2-CG2 4.31Å
2368	D	23.4	Very low	25.2	Very low	76 Å²	76	74.8 Å²	74.8	41%	0.406	41%	0.406	S	S	.	.			cis	-107.8	138.9	15.9	-62.7	-78	0	0	0	112.8	K789 Y1458 V1576	K789-D2368 VanDerWaalsContact CE-OD2 3.23Å; K789-D2368 WeakPolarHBondContact CE-OD2 3.25Å; K789-D2368 IonicContact NZ-OD2 3.93Å; K789-D2368 PolarHBondContact NZ-OD2 3.46Å; Y1458-D2368 PolarHBondContact OH-OD1 3.28Å; V1576-D2368 WeakPolarHBondContact CG1-OD2 2.89Å
2369	P	24.7	Very low	25.2	Very low	37 Å²	37	76.4 Å²	76.4	24%	0.24	41%	0.409	C	S	.	.			trans	-69	135.9	161.8	31.7	-33.8	0	0	0	109	A1191	A1191-P2369 WeakPolarHBondContact O-CB 3.49Å
2370	D	25.7	Very low	25.4	Very low	50 Å²	50	77.2 Å²	77.2	27%	0.267	41%	0.413	S	S	.	.			trans	165.1	82.9	151.9	-99.6	35.7	0	0	0	110.6	L1192 I1193 P1194 S1195 R1465	L1192-D2370 VanDerWaalsContact O-OD1 3.11Å; I1193-D2370 VanDerWaalsContact CA-CG 3.47Å; I1193-D2370 WeakPolarHBondContact CA-OD1 3.5Å; I1193-D2370 VanDerWaalsContact CA-OD2 3.27Å; I1193-D2370 WeakPolarHBondContact CA-OD2 3.5Å; I1193-D2370 PolarHBondContact N-OD1 3.14Å; I1193-D2370 VanDerWaalsContact N-OD1 3.07Å; P1194-D2370 VanDerWaalsContact C-OD2 3.28Å; P1194-D2370 WeakPolarHBondContact CD-OD1 3.47Å; P1194-D2370 VanDerWaalsContact CD-OD2 3.31Å; P1194-D2370 WeakPolarHBondContact CD-OD2 3.11Å; P1194-D2370 VanDerWaalsContact N-CG 3.28Å; S1195-D2370 WeakPolarHBondContact CA-OD2 3.35Å; S1195-D2370 PolarHBondContact N-OD2 2.91Å; R1465-D2370 IonicContact NH2-OD1 2.66Å; R1465-D2370 PolarHBondContact NH2-OD1 3.45Å
2371	L	27.4	Very low	25.4	Very low	150 Å²	150	76.2 Å²	76.2	79%	0.785	40%	0.404	S	S	*	.			trans	-150.5	61.2	169.8	-141.8	108	0	0	0	112
2372	D	28.1	Very low	25.3	Very low	108 Å²	108	78.9 Å²	78.9	58%	0.578	42%	0.42	S	S	*	.			trans	-84	153.2	-178.7	-144.8	-10.6	0	0	0	112.9	L1192	L1192-D2372 HydrophobicContact CB-CB 4.09Å; L1192-D2372 WeakPolarHBondContact CB-OD2 3.34Å; L1192-D2372 HydrophobicContact CD2-CB 4.21Å
2373	L	26.9	Very low	25.3	Very low	144 Å²	144	81.2 Å²	81.2	75%	0.754	44%	0.442	S	S	*	.			trans	-98.2	139.7	-162.7	-73.8	161.7	0	0	0	114.6
2374	D	24.9	Very low	25.3	Very low	141 Å²	141	84 Å²	84	75%	0.754	47%	0.465	S	S	*	.			trans	-103.5	96.2	-177.2	-163.7	15.8	0	0	0	111.5
2375	F	25.9	Very low	25.4	Very low	139 Å²	139	89.8 Å²	89.8	61%	0.61	50%	0.496	S	S	*	.			trans	-144.2	130.3	174	-95.5	-77.6	0	0	0	110.4
2376	D	24.8	Very low	25.4	Very low	53 Å²	53	93.4 Å²	93.4	28%	0.283	52%	0.524	S	S	.	.			trans	-166.7	69	137	-136.6	57.4	0	0	0	119.7	Y1166 K2013 K2015	Y1166-D2376 VanDerWaalsContact CE1-C 3.45Å; Y1166-D2376 WeakPolarHBondContact CE1-O 3.39Å; Y1166-D2376 VanDerWaalsContact OH-C 3.31Å; Y1166-D2376 PolarHBondContact OH-N 3.02Å; K2013-D2376 PolarHBondContact NZ-O 2.98Å; K2013-D2376 VanDerWaalsContact NZ-O 3.12Å; K2013-D2376 IonicContact NZ-OD2 3.16Å; K2013-D2376 PolarHBondContact NZ-OD2 2.99Å; K2015-D2376 WeakPolarHBondContact CD-OD1 3.38Å; K2015-D2376 WeakPolarHBondContact CE-OD1 3.25Å; K2015-D2376 WeakPolarHBondContact CG-OD1 3.36Å; K2015-D2376 IonicContact NZ-OD1 3.72Å; K2015-D2376 PolarHBondContact NZ-OD1 2.94Å
2377	S	24.5	Very low	25.6	Very low	61 Å²	61	97.6 Å²	97.6	43%	0.427	55%	0.553	S	S	.	*			trans	-125.7	137.8	166	26.5	0	0	0	0	110.4	Y1166	Y1166-S2377 PolarHBondContact OH-N 3.33Å; Y1166-S2377 PolarHBondContact OH-OG 2.9Å
2378	I	26.1	Very low	25.9	Very low	116 Å²	116	101.2 Å²	101.2	60%	0.595	58%	0.579	S	S	*	*			cis	-135.6	-87.4	13.6	-114.6	156.8	0	0	0	116.9	K2013	K2013-I2378 WeakPolarHBondContact CE-O 3.33Å; K2013-I2378 WeakPolarHBondContact CG-O 3.5Å
2379	H	27.3	Very low	26	Very low	72 Å²	72	103.5 Å²	103.5	33%	0.333	59%	0.592	S	S	.	*			trans	-155.6	126.8	-145.1	-90.5	-126.4	0	0	0	121	F2012	F2012-H2379 WeakPolarHBondContact CA-ND1 3.29Å; F2012-H2379 CarbonylContact O-C 3.46Å; F2012-H2379 VanDerWaalsContact O-C 3.3Å; F2012-H2379 VanDerWaalsContact O-CA 3.31Å; F2012-H2379 WeakPolarHBondContact O-CA 3.42Å; F2012-H2379 WeakPolarHBondContact O-CB 3.21Å; F2012-H2379 PolarHBondContact O-ND1 3.07Å
2380	H	28.2	Very low	26	Very low	115 Å²	115	108.8 Å²	108.8	53%	0.532	62%	0.615	S	S	.	*				-164.7	174.3	122.3	-128.8	-24.5	0	0	0	119	T2010 L2011 F2012 K2013 T2014	T2010-H2380 PolarHBondContact O-CE1 2.9Å; T2010-H2380 PolarHBondContact O-NE2 3.13Å; L2011-H2380 PolarHBondContact N-CE1 3.11Å; F2012-H2380 WeakPolarHBondContact O-CA 3.2Å; F2012-H2380 PolarHBondContact O-N 2.92Å; K2013-H2380 CarbonylContact C-O 3.58Å; K2013-H2380 VanDerWaalsContact O-O 3.06Å; T2014-H2380 WeakPolarHBondContact CB-O 3.37Å; T2014-H2380 WeakPolarHBondContact CG2-O 3.32Å; T2014-H2380 VanDerWaalsContact N-N 3.19Å; T2014-H2380 PolarHBondContact N-O 3.15Å; T2014-H2380 PolarHBondContact OG1-N 3.39Å; T2014-H2380 VanDerWaalsContact OG1-N 3.15Å; T2014-H2380 PolarHBondContact OG1-O 2.79Å
2381	D	23.1	Very low	26.1	Very low	90 Å²	90	115 Å²	115	48%	0.481	64%	0.635	S	S	.	*			trans	-92.5	176.7	-172.5	-84.2	-40.9	0	0	0	117.1	F2012	F2012-D2381 WeakPolarHBondContact CB-OD1 2.98Å; F2012-D2381 WeakPolarHBondContact CB-OD2 3.47Å
2382	S	24	Very low	26.2	Very low	95 Å²	95	111.3 Å²	111.3	66%	0.664	62%	0.621	S	S	*	*			cis	-174.4	157.3	-13.5	55.3	0	0	0	0	115.5
2383	S	24.9	Very low	26.3	Very low	115 Å²	115	116.9 Å²	116.9	80%	0.804	64%	0.636	S	S	*	*			trans	75.3	157.2	153.7	88.4	0	0	0	0	119.6
2384	S	24.3	Very low	26.6	Very low	92 Å²	92	114.9 Å²	114.9	64%	0.643	63%	0.629	S	S	*	*			cis	-156.6	172.1	12.3	68.6	0	0	0	0	114.7
2385	L	25.3	Very low	26.6	Very low	166 Å²	166	115.7 Å²	115.7	87%	0.869	63%	0.628	S	S	*	*			trans	70	130.6	169.7	-63.6	148.8	0	0	0	117
2386	S	26.2	Very low	26.7	Very low	102 Å²	102	113.7 Å²	113.7	71%	0.713	63%	0.632	S	S	*	*			cis	-168.9	168.2	-11	99.5	0	0	0	0	107.1
2387	S	28.7	Very low	26.9	Very low	105 Å²	105	116 Å²	116	73%	0.734	65%	0.65	S	S	*	*			cis	-170.1	-171.6	-10.2	50	0	0	0	0	106.2
2388	S	29.3	Very low	26.9	Very low	99 Å²	99	118.8 Å²	118.8	69%	0.692	66%	0.664	S	S	*	*			cis	-154.7	141.1	10.6	58.1	0	0	0	0	113.8
2389	D	26	Very low	27.1	Very low	124 Å²	124	120 Å²	120	66%	0.663	67%	0.667	S	S	*	*			trans	74	127.9	144	-89.2	29.6	0	0	0	126.3	R2391	D2389-R2391 IonicContact OD2-NH2 2.77Å
2390	M	24.8	Very low	26.9	Very low	148 Å²	148	124.3 Å²	124.3	73%	0.729	69%	0.687	S	S	*	*			trans	87.5	138.8	150.3	-56.1	-126.9	-161	0	0	122.9
2391	R	27	Very low	27	Very low	180 Å²	180	123.5 Å²	123.5	68%	0.679	70%	0.7	S	S	*	*			cis	-173.4	163.5	-28.1	-98.3	-146.5	178.8	87.9	19	107.6	D2389	D2389-R2391 IonicContact OD2-NH2 2.77Å
2392	S	30.6	Very low	27.1	Very low	72 Å²	72	123 Å²	123	50%	0.503	72%	0.717	S	S	.	*				177.1	109.8	-52	51.9	0	0	0	0	108.9
2393	Y	29.2	Very low	27.2	Very low	226 Å²	226	124.9 Å²	124.9	89%	0.886	72%	0.724	S	S	*	*			trans	-150.4	142.7	174.9	-99.3	-75.1	0	0	0	113.8
2394	V	33.2	Very low	27.4	Very low	102 Å²	102	124.2 Å²	124.2	62%	0.618	72%	0.72	S	S	*	*				-173.2	136.5	-62.3	142.3	0	0	0	0	108.6
2395	E	26.1	Very low	27.6	Very low	157 Å²	157	126.6 Å²	126.6	73%	0.734	73%	0.725	S	S	*	*			trans	-172	163.6	153.3	-112.8	169.3	-144.9	0	0	109.5	Q1174	Q1174-E2395 PolarHBondContact NE2-O 2.69Å
2396	S	26.4	Very low	27.9	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	72%	0.716	S	S	*	*				-168.5	-179.9	-81.6	64.9	0	0	0	0	109.6
2397	P	29.7	Very low	28.2	Very low	103 Å²	103	126.6 Å²	126.6	67%	0.669	72%	0.717	S	S	*	*			cis	-132.7	-159.1	-45.5	34.3	-13.8	0	0	0	111.7
2398	V	24	Very low	28.3	Very low	119 Å²	119	126.8 Å²	126.8	72%	0.721	71%	0.71	S	S	*	*			trans	72.2	142.8	145.5	156	0	0	0	0	118.3
2399	E	30	Very low	28.3	Very low	142 Å²	142	127.3 Å²	127.3	66%	0.664	70%	0.704	S	S	*	*			cis	-163.1	161.6	-21.8	-110.9	178.9	150.6	0	0	110.2
2400	Q	25.1	Very low	28.3	Very low	161 Å²	161	128 Å²	128	75%	0.752	71%	0.708	S	S	*	*			trans	29	149.6	140.4	-55.5	174.9	33	0	0	123.7
2401	A	28.5	Very low	28.3	Very low	98 Å²	98	127.3 Å²	127.3	81%	0.81	71%	0.706	S	S	*	*			trans	80.3	64.7	147.5	0	0	0	0	0	119.3
2402	G	25.8	Very low	28.3	Very low	80 Å²	80	126.2 Å²	126.2	83%	0.825	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-74.3	137.9	144.8	0	0	0	0	0	111.7
2403	T	27.5	Very low	28	Very low	134 Å²	134	129.1 Å²	129.1	82%	0.822	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-48	150.7	174.8	44.1	0	0	0	0	116.6
2404	S	27.9	Very low	28	Very low	102 Å²	102	125.7 Å²	125.7	71%	0.713	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-58.5	164.4	155.6	56.5	0	0	0	0	112.7
2405	L	29.8	Very low	27.5	Very low	142 Å²	142	124.1 Å²	124.1	74%	0.743	71%	0.707	S	S	*	*			trans	87.6	101.1	-175.6	-55.2	165	0	0	0	111.2
2406	N	30.4	Very low	27.5	Very low	130 Å²	130	126.5 Å²	126.5	70%	0.695	71%	0.709	S	S	*	*				75.1	131.8	75.4	-73.9	34.2	0	0	0	110.5
2407	L	32.8	Very low	27.5	Very low	138 Å²	138	127 Å²	127	72%	0.723	70%	0.704	S	S	*	*			cis	-140.7	136.6	24	-134	58.9	0	0	0	108.7
2408	N	29.7	Very low	27.3	Very low	109 Å²	109	131 Å²	131	58%	0.583	72%	0.719	S	S	*	*				51.5	149.8	111.8	-61.2	50.2	0	0	0	121
2409	D	29.7	Very low	27.6	Very low	109 Å²	109	135 Å²	135	58%	0.583	72%	0.721	S	S	*	*			cis	-154.8	157.8	-9.4	-94.9	-20.4	0	0	0	108.3
2410	D	26.4	Very low	27.9	Very low	138 Å²	138	133.7 Å²	133.7	74%	0.738	73%	0.728	S	S	*	*			cis	-156.1	173.6	-45	-160.5	4.4	0	0	0	107.6	E2412	D2410-E2412 PolarHBondContact O-N 3.04Å
2411	I	24.9	Very low	28.4	Very low	134 Å²	134	131.2 Å²	131.2	69%	0.687	73%	0.728	S	S	*	*			trans	-67.2	117.3	159.6	-62.9	166.3	0	0	0	108.5	L2413	I2411-L2413 HydrophobicContact CG2-CD1 4.01Å
2412	E	26.7	Very low	29	Very low	157 Å²	157	131.8 Å²	131.8	73%	0.734	73%	0.726	S	S	*	*			trans	-108.1	84.2	163.5	-160.9	169.5	-144.9	0	0	113.5	D2410 S2415	D2410-E2412 PolarHBondContact O-N 3.04Å; E2412-S2415 WeakPolarHBondContact OE1-CB 3.49Å
2413	L	25	Very low	29.6	Very low	134 Å²	134	131.6 Å²	131.6	70%	0.702	72%	0.724	S	S	*	*			trans	-72.7	129.7	139.1	-89	101.6	0	0	0	109.2	I2411	I2411-L2413 HydrophobicContact CG2-CD1 4.01Å
2414	I	29.5	Very low	30	Very low	154 Å²	154	134 Å²	134	79%	0.79	72%	0.723	S	S	*	*			trans	53.1	76.6	145.3	-46	176	0	0	0	115.3
2415	S	22.6	Very low	30.5	Very low	69 Å²	69	135.5 Å²	135.5	48%	0.483	72%	0.722	S	S	.	*			trans	-114.6	86.8	142.6	-174.6	0	0	0	0	110.5	E2412	E2412-S2415 WeakPolarHBondContact OE1-CB 3.49Å
2416	R	25.7	Very low	31	Very low	207 Å²	207	134.8 Å²	134.8	78%	0.781	72%	0.719	S	S	*	*	S	Bend	trans	67	136.3	167.6	-59.6	-178	-177.3	106	-1.7	115.1
2417	N	27	Very low	31.5	Very low	108 Å²	108	133.8 Å²	133.8	58%	0.578	72%	0.717	S	S	*	*			cis	-157.7	116.9	15.8	-116.2	-9.9	0	0	0	112.4	R2419	N2417-R2419 HydrophobicContact CB-CB 4.4Å; N2417-R2419 WeakPolarHBondContact CB-O 3.48Å; N2417-R2419 PolarHBondContact ND2-O 3.46Å; N2417-R2419 PolarHBondContact O-N 3.17Å; N2417-R2419 VanDerWaalsContact O-N 3.13Å
2418	L	25.6	Very low	31.8	Very low	185 Å²	185	133.3 Å²	133.3	97%	0.969	72%	0.716	S	S	*	*	S	Bend	trans	-76.8	71.3	137.3	-87.5	170.4	0	0	0	108.4
2419	R	30.3	Very low	32.4	Very low	205 Å²	205	134.9 Å²	134.9	77%	0.774	72%	0.722	S	S	*	*	S	Bend	trans	-170	116.7	167.2	-106.1	166.6	-149.5	-119	5.4	110.3	N2417	N2417-R2419 HydrophobicContact CB-CB 4.4Å; N2417-R2419 WeakPolarHBondContact CB-O 3.48Å; N2417-R2419 PolarHBondContact ND2-O 3.46Å; N2417-R2419 PolarHBondContact O-N 3.17Å; N2417-R2419 VanDerWaalsContact O-N 3.13Å
2420	S	34.8	Very low	32.8	Very low	114 Å²	114	135.9 Å²	135.9	80%	0.797	73%	0.728	S	S	*	*			trans	-30.6	143.3	173.8	54	0	0	0	0	119
2421	S	36.9	Very low	33.2	Very low	108 Å²	108	135.9 Å²	135.9	76%	0.755	73%	0.728	S	S	*	*			trans	95.5	124.1	144.7	-160.1	0	0	0	0	121.3
2422	S	39.8	Very low	33.3	Very low	111 Å²	111	135.3 Å²	135.3	78%	0.776	73%	0.726	S	S	*	*			trans	67.6	114.2	135.8	61.1	0	0	0	0	123.9
2423	G	38.4	Very low	33.6	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	73%	0.731	S	S	*	*			trans	92.9	159.6	141.4	0	0	0	0	0	117.7
2424	K	36.9	Very low	33.8	Very low	183 Å²	183	135.3 Å²	135.3	80%	0.796	73%	0.732	S	S	*	*			cis	-174.3	146.2	-6	-152.3	-176.8	177.7	-173.7	0	109.6
2425	I	37.7	Very low	33.8	Very low	135 Å²	135	135.1 Å²	135.1	69%	0.692	73%	0.733	S	S	*	*			trans	66	144.7	156.6	-81.8	160.9	0	0	0	116.7
2426	N	40.4	Very low	34.2	Very low	126 Å²	126	139 Å²	139	67%	0.674	75%	0.748	S	S	*	*			cis	-179.1	156	-26.4	-131	36.4	0	0	0	107.2
2427	T	40.3	Very low	34.3	Very low	109 Å²	109	132.5 Å²	132.5	67%	0.669	74%	0.738	S	S	*	*			trans	61.9	152.6	153.3	57.6	0	0	0	0	119.3
2428	N	40.4	Very low	34.1	Very low	129 Å²	129	134.6 Å²	134.6	69%	0.69	75%	0.749	S	S	*	*			cis	-176.1	177.2	-13.6	-101.5	7.6	0	0	0	107.2
2429	I	41.8	Very low	34	Very low	141 Å²	141	131.2 Å²	131.2	72%	0.723	74%	0.741	S	S	*	*			trans	73.5	133	147.3	-74.6	149.6	0	0	0	116.9
2430	D	37	Very low	33.6	Very low	131 Å²	131	128.9 Å²	128.9	70%	0.701	74%	0.743	S	S	*	*			cis	-162.4	-177.5	-13.1	-95.3	-18.9	0	0	0	108.3
2431	D	35.9	Very low	33.4	Very low	138 Å²	138	128.4 Å²	128.4	74%	0.738	74%	0.739	S	S	*	*			trans	89.5	87.5	154.1	-73.3	-43.3	0	0	0	122.2
2432	N	26.9	Very low	33.2	Very low	121 Å²	121	128.8 Å²	128.8	65%	0.647	74%	0.739	S	S	*	*			trans	69.8	110.5	137.5	-41.7	-71	0	0	0	122
2433	D	31.9	Very low	32.5	Very low	157 Å²	157	128.8 Å²	128.8	84%	0.84	74%	0.736	S	S	*	*				171.2	62.6	118.8	-88	-1.8	0	0	0	110.7
2434	D	29.1	Very low	31.8	Very low	134 Å²	134	131.8 Å²	131.8	72%	0.717	73%	0.734	S	S	*	*			trans	31.3	153.8	140.2	-44.3	-2.8	0	0	0	121.9
2435	D	30.4	Very low	31.3	Very low	150 Å²	150	129.9 Å²	129.9	80%	0.802	73%	0.732	S	S	*	*			cis	-174.1	149.3	-16.3	-109.8	10.1	0	0	0	106.3
2436	D	31.8	Very low	30.7	Very low	152 Å²	152	127.4 Å²	127.4	81%	0.813	73%	0.727	S	S	*	*			cis	-146.9	-179.4	-22.7	-174.6	28.2	0	0	0	108.7
2437	A	26.8	Very low	29.9	Very low	69 Å²	69	128.6 Å²	128.6	57%	0.57	73%	0.733	S	S	*	*			trans	-87.9	-173.2	-163.4	0	0	0	0	0	118.4
2438	L	23.4	Very low	29.1	Very low	152 Å²	152	128.6 Å²	128.6	80%	0.796	73%	0.733	S	S	*	*			trans	6.8	128.8	141.6	-62.2	157.7	0	0	0	117.2
2439	S	22.4	Very low	28.4	Very low	115 Å²	115	127.6 Å²	127.6	80%	0.804	73%	0.731	S	S	*	*				170.5	172.4	104.2	56.3	0	0	0	0	115.5
2440	L	22.8	Very low	27.6	Very low	156 Å²	156	126.9 Å²	126.9	82%	0.817	73%	0.729	S	S	*	*			trans	-66.6	118.4	-171.2	-58.7	70.5	0	0	0	114.5
2441	S	30	Very low	27.2	Very low	104 Å²	104	126 Å²	126	73%	0.727	73%	0.725	S	S	*	*			trans	60	-171.9	140.1	74	0	0	0	0	118.4
2442	P	32.6	Very low	26.8	Very low	116 Å²	116	124 Å²	124	75%	0.753	72%	0.717	S	S	*	*				-79.9	-137.3	-75.2	39.6	-28	0	0	0	107.4
2443	P	25.7	Very low	26.9	Very low	110 Å²	110	124.5 Å²	124.5	71%	0.714	72%	0.719	S	S	*	*			cis	-127.4	-175.7	-20.3	38.7	-20.3	0	0	0	115
2444	L	23.3	Very low	26.8	Very low	139 Å²	139	122.4 Å²	122.4	73%	0.728	71%	0.711	S	S	*	*			trans	-47.1	165.2	163.2	-51.1	91.9	0	0	0	114.5
2445	N	26.4	Very low	26.6	Very low	143 Å²	143	122 Å²	122	77%	0.765	71%	0.709	S	S	*	*			trans	70.1	137.5	149.7	-65.3	-19.4	0	0	0	115.6
2446	S	24.8	Very low	26.3	Very low	84 Å²	84	120.3 Å²	120.3	59%	0.587	70%	0.7	S	S	*	*			cis	157.5	161.2	7	55	0	0	0	0	104.5
2447	L	23.6	Very low	26	Very low	151 Å²	151	118.8 Å²	118.8	79%	0.791	69%	0.692	S	S	*	*			trans	63.8	142.6	166.2	-83.2	72.7	0	0	0	113.8
2448	T	24.6	Very low	25.9	Very low	108 Å²	108	121.8 Å²	121.8	66%	0.663	70%	0.698	S	S	*	*			cis	-158.7	-172.5	-3.1	1.6	0	0	0	0	107.3
2449	T	25.1	Very low	26.1	Very low	108 Å²	108	121 Å²	121	66%	0.663	70%	0.695	S	S	*	*			trans	25.3	124.4	143.4	61.5	0	0	0	0	117.5
2450	D	25.4	Very low	26.2	Very low	126 Å²	126	122.1 Å²	122.1	67%	0.674	69%	0.692	S	S	*	*			cis	-179.8	-176.1	24.6	-129.6	-4.2	0	0	0	109.7
2451	N	28.4	Very low	26.3	Very low	114 Å²	114	121.9 Å²	121.9	61%	0.61	69%	0.691	S	S	*	*			trans	39.1	122.5	141.2	-64.2	-43.8	0	0	0	118.7
2452	T	28.6	Very low	26	Very low	94 Å²	94	121 Å²	121	58%	0.577	69%	0.685	S	S	*	*			cis	179.5	155.4	30.3	6.2	0	0	0	0	112.1
2453	I	28.1	Very low	25.6	Very low	133 Å²	133	122 Å²	122	68%	0.682	68%	0.684	S	S	*	*			trans	67.8	122	142.4	-69.6	162.3	0	0	0	116.6
2454	V	29.3	Very low	25.5	Very low	113 Å²	113	123.4 Å²	123.4	69%	0.685	68%	0.684	S	S	*	*			cis	-153.1	137.7	2.6	102.1	0	0	0	0	113.3
2455	N	25.4	Very low	25.5	Very low	126 Å²	126	124.3 Å²	124.3	67%	0.674	68%	0.684	S	S	*	*			trans	29.2	119.6	143	-67.2	46.8	0	0	0	121.9
2456	N	24.4	Very low	25.4	Very low	113 Å²	113	124 Å²	124	60%	0.604	68%	0.682	S	S	*	*				80.4	114.3	121.2	-68.8	69.2	0	0	0	121
2457	D	24.6	Very low	25.3	Very low	120 Å²	120	125.7 Å²	125.7	64%	0.642	69%	0.694	S	S	*	*				80	126.9	118.5	-54.2	-6.7	0	0	0	122
2458	N	24.8	Very low	25.4	Very low	133 Å²	133	128.9 Å²	128.9	71%	0.711	70%	0.697	S	S	*	*			trans	75.6	106.8	141.9	-62.9	-23.5	0	0	0	120.7
2459	N	27.4	Very low	25.6	Very low	136 Å²	136	129.5 Å²	129.5	73%	0.727	70%	0.703	S	S	*	*			trans	80.4	141.8	135.3	-61.3	-23.2	0	0	0	120.9
2460	N	24.6	Very low	25.5	Very low	138 Å²	138	129.2 Å²	129.2	74%	0.738	71%	0.705	S	S	*	*			trans	78.7	138.7	153.4	-58	-40.1	0	0	0	120.2
2461	N	25.3	Very low	25.8	Very low	151 Å²	151	128.3 Å²	128.3	81%	0.807	71%	0.706	S	S	*	*			trans	74.5	141.8	142.5	-71.9	-22.5	0	0	0	119.1
2462	S	23.7	Very low	25.5	Very low	85 Å²	85	129.6 Å²	129.6	59%	0.594	71%	0.712	S	S	*	*			cis	-174	168.1	-0	50.4	0	0	0	0	114.4
2463	N	24.1	Very low	25.3	Very low	138 Å²	138	131.5 Å²	131.5	74%	0.738	72%	0.718	S	S	*	*			trans	82.3	126.8	135.5	-84.2	-36.5	0	0	0	123.3
2464	I	23.3	Very low	25.1	Very low	139 Å²	139	128.1 Å²	128.1	71%	0.713	70%	0.699	S	S	*	*				106.4	119.3	125.8	-78.1	168.2	0	0	0	121.9
2465	H	23.2	Very low	24.8	Very low	157 Å²	157	124.2 Å²	124.2	73%	0.727	67%	0.673	S	S	*	*			trans	72.6	112.8	147.7	-90.7	-122.2	0	0	0	125
2466	L	25.2	Very low	24.8	Very low	136 Å²	136	119.9 Å²	119.9	71%	0.712	65%	0.648	S	S	*	*				37.6	116.9	113.5	-77.7	145.5	0	0	0	121.1
2467	S	21.8	Very low	24.9	Very low	121 Å²	121	119.6 Å²	119.6	85%	0.846	64%	0.643	S	S	*	*				-178.1	159.5	110.3	43.1	0	0	0	0	115.3
2468	Y	26.3	Very low	25	Very low	218 Å²	218	116.6 Å²	116.6	86%	0.855	63%	0.625	S	S	*	*			trans	-71.1	174.4	171.1	-76.6	-95.8	0	0	0	112.5
2469	P	27.8	Very low	25.2	Very low	121 Å²	121	114 Å²	114	79%	0.786	61%	0.609	S	S	*	*			cis	-142.9	-170.6	19	43.8	-23	0	0	0	118.2
2470	S	24.3	Very low	25.1	Very low	101 Å²	101	113.3 Å²	113.3	71%	0.706	60%	0.601	S	S	*	*			trans	-67.8	-169.8	166.2	-29	0	0	0	0	114
2471	P	31.2	Very low	25.2	Very low	108 Å²	108	114.4 Å²	114.4	70%	0.701	60%	0.602	S	S	*	*			cis	-142.8	-157.1	-1.8	34.9	-9.4	0	0	0	115.2
2472	I	22.2	Very low	25.2	Very low	140 Å²	140	110.3 Å²	110.3	72%	0.718	58%	0.582	S	S	*	*			trans	85.7	104.5	157.7	-67.7	164.2	0	0	0	116.1
2473	L	23.7	Very low	25.3	Very low	134 Å²	134	111.4 Å²	111.4	70%	0.702	58%	0.582	S	S	*	*				72.3	138.1	89.6	-61.3	171.6	0	0	0	113.4
2474	E	24.2	Very low	25.3	Very low	62 Å²	62	108.1 Å²	108.1	29%	0.29	57%	0.566	S	S	.	*			cis	-163.8	173.2	16.2	-123.1	156.9	-154.5	0	0	114.1	Y2017 P2019 I2020	Y2017-E2474 WeakPolarHBondContact CA-OE2 3.48Å; Y2017-E2474 HydrophobicContact CD1-CG 3.53Å; Y2017-E2474 WeakPolarHBondContact CD1-OE1 3.25Å; Y2017-E2474 HydrophobicContact CE1-CG 3.72Å; Y2017-E2474 WeakPolarHBondContact CE1-OE1 3.49Å; Y2017-E2474 PolarHBondContact N-OE2 3.28Å; Y2017-E2474 VanDerWaalsContact N-OE2 3.12Å; P2019-E2474 CarbonylContact C-O 3.54Å; P2019-E2474 VanDerWaalsContact CA-O 3.27Å; P2019-E2474 WeakPolarHBondContact CA-O 3.42Å; I2020-E2474 PolarHBondContact N-O 3.37Å
2475	E	23.4	Very low	25.3	Very low	31 Å²	31	109.8 Å²	109.8	15%	0.145	57%	0.571	C	S	.	*			trans	57.7	-179.5	143.2	-64.3	-108.4	127.3	0	0	124.7	Y2017 P2019 I2020 H2359	Y2017-E2475 VanDerWaalsContact CB-CD 3.45Å; Y2017-E2475 VanDerWaalsContact CD1-CD 3.41Å; Y2017-E2475 HydrophobicContact CD1-CG 3.47Å; Y2017-E2475 VanDerWaalsContact CD1-CG 3.47Å; Y2017-E2475 WeakPolarHBondContact CD1-OE1 3.34Å; Y2017-E2475 HydrophobicContact CE1-CG 4.33Å; Y2017-E2475 HydrophobicContact CG-CG 4.2Å; P2019-E2475 WeakPolarHBondContact CA-O 3.1Å; P2019-E2475 HydrophobicContact CB-CB 3.69Å; P2019-E2475 WeakPolarHBondContact CB-O 3.49Å; I2020-E2475 PolarHBondContact N-O 3.46Å; H2359-E2475 IonicContact CD2-OE1 2.81Å
2476	K	26	Very low	25.3	Very low	35 Å²	35	107.3 Å²	107.3	15%	0.152	57%	0.567	C	S	.	*			cis	-170.3	173.8	-39.6	-94.3	-160.8	103.8	-65.5	0	108.2	L2357 S2358 H2359 E2478	L2357-K2476 CarbonylContact O-C 3.54Å; S2358-K2476 WeakPolarHBondContact OG-CA 3.47Å; S2358-K2476 WeakPolarHBondContact OG-CB 3.39Å; S2358-K2476 WeakPolarHBondContact OG-CG 3.3Å; S2358-K2476 PolarHBondContact OG-NZ 2.84Å; H2359-K2476 HydrophobicContact CB-CG 4.34Å; K2476-E2478 IonicContact NZ-OE1 3.92Å; K2476-E2478 PolarHBondContact NZ-OE1 3.48Å
2477	E	26.5	Very low	25.1	Very low	107 Å²	107	109.3 Å²	109.3	50%	0.5	57%	0.566	S	S	.	*			cis	-137.1	95.8	29.2	-163.2	90	-52.8	0	0	116.5	L2357 S2358	L2357-E2477 VanDerWaalsContact CA-N 3.29Å; L2357-E2477 VanDerWaalsContact CB-C 3.46Å; L2357-E2477 WeakPolarHBondContact CB-O 3.11Å; L2357-E2477 WeakPolarHBondContact CD1-O 3.25Å; L2357-E2477 HydrophobicContact CD2-CB 4.42Å; L2357-E2477 WeakPolarHBondContact CD2-O 3.11Å; L2357-E2477 VanDerWaalsContact CG-O 3.29Å; L2357-E2477 WeakPolarHBondContact CG-O 3.24Å; S2358-E2477 WeakPolarHBondContact OG-CA 3.38Å; S2358-E2477 PolarHBondContact OG-N 2.99Å
2478	E	26.8	Very low	25.2	Very low	57 Å²	57	108.7 Å²	108.7	27%	0.266	56%	0.559	S	S	.	*			trans	77.8	-149.4	177.9	-80	83.6	-94.2	0	0	125.1	L2357 S2358 K2476	L2357-E2478 WeakPolarHBondContact CB-O 3.41Å; S2358-E2478 PolarHBondContact N-O 2.95Å; S2358-E2478 PolarHBondContact OG-N 3.18Å; K2476-E2478 IonicContact NZ-OE1 3.92Å; K2476-E2478 PolarHBondContact NZ-OE1 3.48Å
2479	E	27.3	Very low	25.1	Very low	78 Å²	78	104.2 Å²	104.2	36%	0.364	55%	0.55	S	S	.	*				-129.8	-171.3	-105.7	-86.7	166.3	168.6	0	0	107.8	A2361	A2361-E2479 PolarHBondContact N-OE1 2.66Å
2480	E	26.6	Very low	24.9	Very low	122 Å²	122	104.8 Å²	104.8	57%	0.57	55%	0.547	S	S	*	.			cis	-162.1	155.5	31.1	-176.4	179.4	-139.4	0	0	109.2	L1473 V2482	L1473-E2480 VanDerWaalsContact CD1-OE1 3.24Å; L1473-E2480 WeakPolarHBondContact CD1-OE1 3.24Å; E2480-V2482 HydrophobicContact CG-CG2 4.18Å
2481	E	26.8	Very low	25	Very low	162 Å²	162	105.7 Å²	105.7	76%	0.757	54%	0.543	S	S	*	.			trans	-132.5	136.3	178.7	177.6	175.6	-135	0	0	109.4
2482	V	25.6	Very low	24.8	Very low	64 Å²	64	106.3 Å²	106.3	39%	0.388	54%	0.541	S	S	.	.			trans	-144.1	142	-170.1	175.9	0	0	0	0	113.7	V1557 V1561 E2480	V1557-V2482 HydrophobicContact CG1-CG1 4.31Å; V1561-V2482 HydrophobicContact CG2-CG1 3.94Å; V1561-V2482 HydrophobicContact CG2-CG2 4.16Å; E2480-V2482 HydrophobicContact CG-CG2 4.18Å
2483	D	25.1	Very low	25	Very low	109 Å²	109	106.3 Å²	106.3	58%	0.583	54%	0.542	S	S	*	.			trans	84	132.7	169.3	-68.6	-25.1	0	0	0	120	A1560	A1560-D2483 VanDerWaalsContact CB-OD1 3.24Å; A1560-D2483 WeakPolarHBondContact CB-OD1 3.15Å
2484	V	24.5	Very low	25.1	Very low	68 Å²	68	106.1 Å²	106.1	41%	0.412	54%	0.542	S	S	.	.			trans	-135.2	137.3	-178.4	152.1	0	0	0	0	108.5	D1564	D1564-V2484 HydrophobicContact CB-CB 4.04Å; D1564-V2484 WeakPolarHBondContact OD2-CG2 3.43Å
2485	E	23.4	Very low	25.3	Very low	175 Å²	175	109 Å²	109	82%	0.818	56%	0.555	S	S	*	*			trans	-126.5	130.3	160.7	-74	-166.1	139.7	0	0	111.4
2486	V	22	Very low	25.5	Very low	104 Å²	104	113.9 Å²	113.9	63%	0.63	58%	0.578	S	S	*	*			trans	-132	130.2	159.5	175.4	0	0	0	0	104.7
2487	Y	22.6	Very low	25.3	Very low	178 Å²	178	117.1 Å²	117.1	70%	0.698	60%	0.604	S	S	*	*			trans	70.8	138.4	-156.2	-56.6	-80.1	0	0	0	111.7	D2489	Y2487-D2489 HydrophobicContact CD1-CB 4.48Å
2488	P	23.8	Very low	25.2	Very low	108 Å²	108	120.2 Å²	120.2	70%	0.701	62%	0.618	S	S	*	*			cis	-100.5	131.2	42.4	-5.3	25.5	0	0	0	116.4
2489	D	23	Very low	25.2	Very low	125 Å²	125	122 Å²	122	67%	0.668	63%	0.633	S	S	*	*				-54.3	117.5	116.2	-95.6	-40.3	0	0	0	107.8	Y2487	Y2487-D2489 HydrophobicContact CD1-CB 4.48Å
2490	N	24.7	Very low	25.1	Very low	133 Å²	133	124.7 Å²	124.7	71%	0.711	65%	0.645	S	S	*	*				167.8	146.4	123.6	-92.6	-72	0	0	0	112.2
2491	N	25.5	Very low	25.3	Very low	119 Å²	119	124.4 Å²	124.4	64%	0.636	64%	0.644	S	S	*	*			trans	75.1	120	149.5	-78.9	54.6	0	0	0	121.1
2492	D	26.5	Very low	25.8	Very low	121 Å²	121	120.5 Å²	120.5	65%	0.647	63%	0.633	S	S	*	*				79.7	91.7	128.2	-51.9	-9.9	0	0	0	118.9
2493	D	26.5	Very low	26.1	Very low	140 Å²	140	124 Å²	124	75%	0.749	65%	0.648	S	S	*	*				75.9	117.5	116.1	-82.7	6.4	0	0	0	121.1
2494	N	26.9	Very low	26.5	Very low	130 Å²	130	124.7 Å²	124.7	70%	0.695	65%	0.65	S	S	*	*			trans	83.6	125.1	148.1	-66.9	-65.2	0	0	0	120.9
2495	H	27.7	Very low	26.7	Very low	123 Å²	123	128.1 Å²	128.1	57%	0.569	66%	0.664	S	S	*	*			trans	89.5	116.5	135.6	-75.6	-4.6	0	0	0	121.5	K2305	K2305-H2495 VanDerWaalsContact CE-CD2 3.46Å; K2305-H2495 WeakPolarHBondContact CE-CD2 3.47Å; K2305-H2495 WeakPolarHBondContact CE-NE2 3.25Å; K2305-H2495 PolarHBondContact NZ-NE2 3.5Å
2496	H	26.9	Very low	26.9	Very low	134 Å²	134	128.8 Å²	128.8	62%	0.62	66%	0.664	S	S	*	*			trans	69.5	109.1	135.8	-68.8	-60.9	0	0	0	120.5
2497	C	23.5	Very low	27.1	Very low	103 Å²	103	130.5 Å²	130.5	70%	0.696	67%	0.668	S	S	*	*				45.6	136.9	109.8	-54.2	0	0	0	0	120.8
2498	E	23.2	Very low	27.1	Very low	172 Å²	172	127.2 Å²	127.2	80%	0.804	67%	0.667	S	S	*	*			trans	73.8	138	146.5	-74.8	178.8	-177.6	0	0	118.7
2499	V	26.4	Very low	26.9	Very low	95 Å²	95	130 Å²	130	58%	0.576	67%	0.67	S	S	*	*			cis	-164.7	161.9	-15.4	83.2	0	0	0	0	109.8
2500	E	25.8	Very low	26.8	Very low	133 Å²	133	129.5 Å²	129.5	62%	0.621	67%	0.672	S	S	*	*			trans	63.3	130.1	166.7	-72.3	151.6	-154.5	0	0	117.3
2501	E	31.4	Very low	26.7	Very low	116 Å²	116	131.7 Å²	131.7	54%	0.542	67%	0.67	S	S	.	*				62.8	157.6	57.7	-95.5	-168.4	-125.8	0	0	113.8	I2155	I2155-E2501 WeakPolarHBondContact CD1-OE2 3.25Å
2502	P	36.3	Very low	26.5	Very low	81 Å²	81	135 Å²	135	53%	0.526	68%	0.679	S	S	.	*			cis	-138.2	-160.7	-13	24.2	0.8	0	0	0	113.3
2503	I	32.7	Very low	26.8	Very low	136 Å²	136	130.5 Å²	130.5	70%	0.697	66%	0.657	S	S	*	*				116.6	109.9	118.2	-115.5	178.2	0	0	0	118.3
2504	I	34.2	Very low	27	Very low	125 Å²	125	129.2 Å²	129.2	64%	0.641	65%	0.649	S	S	*	*			trans	86.1	111.4	135.1	-82.7	167.8	0	0	0	121.3
2505	M	28.6	Very low	27	Very low	140 Å²	140	129.2 Å²	129.2	69%	0.69	65%	0.647	S	S	*	*			trans	57.3	109.2	140.2	-57.6	176.6	-160.3	0	0	120.1
2506	K	26.6	Very low	27	Very low	188 Å²	188	129.5 Å²	129.5	82%	0.817	65%	0.651	S	S	*	*				-161	140.7	93.7	-98.6	147.6	-173.2	170.9	0	109.1
2507	I	26.7	Very low	27	Very low	140 Å²	140	129.2 Å²	129.2	72%	0.718	65%	0.653	S	S	*	*			cis	53.3	67.2	44.3	-41.7	175.2	0	0	0	112.3
2508	T	21.4	Very low	27.2	Very low	110 Å²	110	130.8 Å²	130.8	68%	0.675	65%	0.65	S	S	*	*			trans	-170.7	154.2	131.4	24.2	0	0	0	0	109.7
2509	E	21.3	Very low	27.5	Very low	165 Å²	165	128.2 Å²	128.2	77%	0.771	64%	0.641	S	S	*	*			trans	32.7	128.2	132.8	-53.8	178.1	151.9	0	0	118
2510	T	20.8	Very low	27.6	Very low	115 Å²	115	130.4 Å²	130.4	71%	0.706	65%	0.645	S	S	*	*			cis	-175.6	157.4	18.5	1.5	0	0	0	0	112.5	K2512	T2510-K2512 PolarHBondContact O-N 3.23Å
2511	R	22.3	Very low	27.7	Very low	179 Å²	179	130.2 Å²	130.2	68%	0.675	65%	0.647	S	S	*	*				26.2	84.7	126.3	-178.3	-161	179.7	-172.7	-1	116.2	E728	E728-R2511 IonicContact OE2-CZ 3.51Å; E728-R2511 IonicContact OE2-NE 3.09Å; E728-R2511 IonicContact OE2-NH2 3.36Å; E728-R2511 PolarHBondContact OE2-NH2 3.33Å
2512	K	21.6	Very low	27.4	Very low	190 Å²	190	131.3 Å²	131.3	83%	0.826	66%	0.655	S	S	*	*			trans	-149.4	129.3	136.9	-107.3	-177	-178.1	179	0	106.6	T2510	T2510-K2512 PolarHBondContact O-N 3.23Å
2513	S	32.4	Very low	26.6	Very low	26 Å²	26	135.5 Å²	135.5	18%	0.182	67%	0.665	C	S	.	*			cis	65.6	126	30.3	-34.3	0	0	0	0	111.6	I731	I731-S2513 WeakPolarHBondContact CD1-OG 3.28Å; I731-S2513 WeakPolarHBondContact CG1-OG 2.99Å
2514	L	31.1	Very low	26.1	Very low	112 Å²	112	135.5 Å²	135.5	59%	0.586	66%	0.662	S	S	*	*			cis	-118.7	0	12.6	-69.5	80.8	0	0	0	111.7	L725 L734	L725-L2514 HydrophobicContact CB-CD2 3.97Å; L725-L2514 HydrophobicContact CD2-CB 3.75Å; L725-L2514 HydrophobicContact CD2-CD2 3.55Å; L725-L2514 HydrophobicContact CD2-CG 4.3Å; L725-L2514 HydrophobicContact CG-CD2 4.36Å; L725-L2514 WeakPolarHBondContact O-CD2 3.41Å; L734-L2514 HydrophobicContact CD2-CB 4.47Å; L734-L2514 VanDerWaalsContact CD2-OXT 3.22Å; L734-L2514 WeakPolarHBondContact CD2-OXT 3.43Å

Retrieved 2,514 of 2,514 residues in 1344.6 ms (Link to these results)

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