A0A3Q0KU70_SCHMA Loading...

HAP2-GCS1 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KU70, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,047 aa.

						>A0A3Q0KU70_SCHMA|A0A3Q0KU70
MYTERSTKSVLSKTLLILIWLHEQGQFVFGFKRSINYDMFGIKNGEIMKSSMICINQNIYGCSRNSDLRFNDSILFQDNKSTHDCDLFSMDMNQDLSHGVKECIDIFINNMNSTGNTKQYQIRLKNQEAVKLLVSENVIFENLLTISDIFQSSLINETASVLKFHSIRNSGIHVNVELSELNLYPIYEDINYDGVNDVILNASPGTYAFRLKQPLLQIANQFCRYPLPSRYLLSLKAFRRRQTYGYKRSCREPTQTSTILCQTDEHLNYHGDEKQKTYFYERSLNDQCGRNLAAILSDEPNSFYCTRDTPLINEIFGEYVNEQIVQSHTSSCDTYEKLCSKCFNRMTENSKCNSKYMNMNEFSEIGVNHDEGERNVTDVQCCGISCYNTPVCLSYYSSMCQSNKTKTITLEDKVCMDGNTFQISITPEFDFHNGTFMCHLKQTNYSRGFRLKFSIDLSELFKQKISDNYVNSRTIISVESQHNFGAYEKYKLNINALNVEILVDEPNKSIFRSFKEVILLGRKVKKYNAYEFVVHKPPSTTEIKSIQSSVEHVLHTDSAFTTIQSNKPHAFSSINWKHKGCDLDIFQNTKVTKALSEFLSKGYPVDIYPASNVKTNTPRSMSGKEDNVYSNILHRFRLNDKHANLPRANIKLSGNHSVLRSIFCNNENFPANFKLHTITEGKSLGQFRITRKVIEASVKFATNSLGQEILHIFVTGYVTGTPAYINFKLIWPANSLILSNHDVVVLNSQTKDYFRPNKKIESFQLTYQIDINSINEIPFKTLFSSSFQPTLIFDLIIQECDANVGLRIYTPLFSNRKKDKMLQGGVVKGSIVSIHSNKSTVEESSHWVMFSPLLFITIGISLLYFLVLIIFVYIKHCIISNKGYPISVEYQKQISNNHYGNDLQYHQLLLHPFPIKLNNRTLYYTTSRKGGDYIQTFPPTRQTLYHPTIVAKHPYHHYGNESQSPYRKFSSNSTWLNHNTWNTNNSQIKRIFLFTHLAFRVFYTFLFTFSVAVSLIFSLQPSGRISTVDNILQWPKINRESIEFNSLYNSMHRPSQISVLTTSSLPMHETEIDQIHLVGPILRLQAEVHWIEEFTEQELKRQLDYVERMKLACQHAMTVELTDALREGRHLVNTRLEKWQFNSSSQNTDTLNDNTLRSVNELANIHFNRQRTLFDHLYEQMSQKLNFRDSESYKIYANMLNSVFHSGWLQYVKRMLNTSDNLERNPRHFSNHKVHTETKLNFHDSMRRYYEFGQQRSGIKAPYVALMNYMNFYQADAVHLLPMQLLENLKKVFSSPNHYRSLFHLSPEASSHPMNSESTFKANHQVNSFKTLQSQKTQQERVFLTTNDLEEYTDGTISSVSDKSTQDFFNEQNTLVSENFIQYIKHNSQQNVQSHSNYPNKHPMLPVMTLTHIRLSLLILDCFIIAYRFFHTYEILKAFWTGQTLFVDASSWLERQTHTTVDNERDNGNFHEASKTTVEPFDSHSCRRFSEKGKYLESNLSDFNETPNNRFSRIALFHCLPQHQNLYECRHEKQALYQPSMYSSGIPRNSQSSETTSSSILSNQVTDSQSKNKSKQSFHLNSLCDHSATNPCEALPDRSLIPIGPPLCLPPSSSFSIEQNTGCILGIRSACCRKSHYISSVIGFTVIVLLFGLVLVQMYKPHVATPKKISPPTSTYSKQSSSQVLANKIPYLSTPIGFFLPYYELLIRDHSNRLNEDWLEWTKRNELAMRGRVLNYLSRFKHELNYLDQQMDTENSVVQSLLSQVESSSPIIKSEKSHNKPTNYPTSPIFNSEFLFRQQICHFLPVTSVPLNEENISLNKEGTITSLHKKIRPNNIKRIIWTSAISTFVDFDWNSEEQANNLFITAIIVGIVMISCIGIVDIGGKILKISYINPTVSMFDIKKWKSHSKASSNTEEPMDYVRNIENIILISPQPAPIIPWPTKRLLNMNSQLNPINRQKLSPESSVSVIKEPENQLPLTAFYLDSNLVLTPNNTTPIINNKTVQLDDISHSVPVFIAHSPSSTPVIALKTDSWASTNQLSGIFFEKT
					

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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	31.5	Very low	30.8	Very low	229 Å²	229	156.4 Å²	156.4	100%	1.128	80%	0.797	S	S	*	*				0	118.1	0	-71.7	162.7	163.5	0	0	106.8
2	Y	28.5	Very low	31	Very low	218 Å²	218	148.4 Å²	148.4	86%	0.855	77%	0.766	S	S	*	*				61.6	125.3	62.6	-73.4	-89.1	0	0	0	111.9
3	T	27.9	Very low	31.2	Very low	107 Å²	107	151.1 Å²	151.1	66%	0.656	77%	0.769	S	S	*	*			cis	-172.3	164.1	-22.1	6.2	0	0	0	0	109.7
4	E	34	Very low	31.7	Very low	138 Å²	138	147.9 Å²	147.9	65%	0.645	76%	0.761	S	S	*	*			trans	61.6	133.2	145.6	-73	-160.9	94.1	0	0	125.3
5	R	30.9	Very low	32.1	Very low	215 Å²	215	145.3 Å²	145.3	81%	0.811	75%	0.748	S	S	*	*			trans	69.2	129.6	133.7	-74.7	-175.5	158.5	133.7	-13.5	124
6	S	32.8	Very low	32.4	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	74%	0.738	S	S	*	*			trans	84.9	92.5	142.2	71.7	0	0	0	0	120.5	K8	S6-K8 PolarHBondContact O-N 3.21Å
7	T	27.5	Very low	32.9	Very low	135 Å²	135	141.8 Å²	141.8	83%	0.828	73%	0.73	S	S	*	*				16.1	97.7	125.5	53.3	0	0	0	0	118.8
8	K	28.7	Very low	33.1	Very low	195 Å²	195	140.8 Å²	140.8	85%	0.848	73%	0.726	S	S	*	*			trans	-166.1	121	136.1	-110.8	164.1	-173.6	177.4	0	114	S6	S6-K8 PolarHBondContact O-N 3.21Å
9	S	28.6	Very low	33.5	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	72%	0.717	S	S	*	*			trans	65.4	-170	147	78.3	0	0	0	0	120.1
10	V	31.9	Very low	33.5	Very low	110 Å²	110	143.1 Å²	143.1	67%	0.667	72%	0.722	S	S	*	*			trans	72.3	113.5	174.4	-151.3	0	0	0	0	118.8	S12	V10-S12 PolarHBondContact O-N 2.87Å
11	L	36	Very low	33.8	Very low	157 Å²	157	142.9 Å²	142.9	82%	0.822	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	7.9	165.7	-77.3	59.9	0	0	0	115.8
12	S	34.1	Very low	34	Very low	61 Å²	61	140 Å²	140	43%	0.427	71%	0.706	S	S	.	*	H	α-helix	trans	-67.4	-40.6	-167.7	166	0	0	0	0	113.5	V10 T14 L15	V10-S12 PolarHBondContact O-N 2.87Å; S12-T14 VanDerWaalsContact C-N 3.25Å; S12-T14 PolarHBondContact O-N 3.23Å; S12-L15 WeakPolarHBondContact O-CB 3.32Å; S12-L15 PolarHBondContact O-N 3.16Å
13	K	33.5	Very low	34.3	Very low	183 Å²	183	137.6 Å²	137.6	80%	0.796	70%	0.703	S	S	*	*	H	α-helix	trans	-70.4	-16.8	-173.4	-70.6	-171.2	175.3	-177.2	0	114.6
14	T	37.5	Very low	34.6	Very low	107 Å²	107	142.2 Å²	142.2	66%	0.656	72%	0.717	S	S	*	*	H	α-helix	trans	-81.5	-25.6	172.5	-37.8	0	0	0	0	111.8	S12	S12-T14 VanDerWaalsContact C-N 3.25Å; S12-T14 PolarHBondContact O-N 3.23Å
15	L	38	Very low	34.4	Very low	109 Å²	109	138.8 Å²	138.8	57%	0.571	72%	0.718	S	S	*	*	H	α-helix	trans	-76.1	-39.3	-177.7	-149.2	77.5	0	0	0	112.2	S12 I17 L18 I19	S12-L15 WeakPolarHBondContact O-CB 3.32Å; S12-L15 PolarHBondContact O-N 3.16Å; L15-I17 PolarHBondContact O-N 3.3Å; L15-L18 PolarHBondContact O-N 2.86Å; L15-L18 VanDerWaalsContact O-N 3.1Å; L15-I19 HydrophobicContact CD2-CD1 4.46Å; L15-I19 HydrophobicContact CG-CD1 4.45Å; L15-I19 PolarHBondContact O-N 3.21Å; L15-I19 VanDerWaalsContact O-N 3.13Å
16	L	37.1	Very low	34.5	Very low	113 Å²	113	138 Å²	138	59%	0.592	72%	0.724	S	S	*	*	H	α-helix	trans	-60.4	-31.3	179.5	-94.5	90.1	0	0	0	113.7	L18 I19 W20	L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 2.77Å; L16-I19 PolarHBondContact O-N 3.26Å; L16-W20 PolarHBondContact O-N 3.42Å
17	I	40.4	Very low	34.2	Very low	118 Å²	118	141.8 Å²	141.8	61%	0.605	73%	0.728	S	S	*	*	H	α-helix	trans	-72.2	-27.3	179.5	-65.2	171.7	0	0	0	111.4	L15	L15-I17 PolarHBondContact O-N 3.3Å
18	L	36.5	Very low	34.3	Very low	124 Å²	124	142.1 Å²	142.1	65%	0.649	73%	0.729	S	S	*	*	H	α-helix	trans	-80.5	-30	172.7	-78.6	161.3	0	0	0	112.6	L15 L16	L15-L18 PolarHBondContact O-N 2.86Å; L15-L18 VanDerWaalsContact O-N 3.1Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 2.77Å
19	I	41.5	Very low	34.1	Very low	107 Å²	107	142 Å²	142	55%	0.549	73%	0.729	S	S	.	*	H	α-helix	trans	-71.3	-43.3	175.9	-66	167.6	0	0	0	110.8	L15 L16 L21 H22	L15-I19 HydrophobicContact CD2-CD1 4.46Å; L15-I19 HydrophobicContact CG-CD1 4.45Å; L15-I19 PolarHBondContact O-N 3.21Å; L15-I19 VanDerWaalsContact O-N 3.13Å; L16-I19 PolarHBondContact O-N 3.26Å; I19-L21 PolarHBondContact O-N 2.92Å; I19-H22 WeakPolarHBondContact O-CB 3.49Å; I19-H22 PolarHBondContact O-N 2.72Å
20	W	33.6	Very low	34	Very low	220 Å²	220	140.2 Å²	140.2	83%	0.833	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-15.5	180	-164	65.4	0	0	0	114.3	L16	L16-W20 PolarHBondContact O-N 3.42Å
21	L	39.2	Very low	33.9	Very low	138 Å²	138	144.2 Å²	144.2	72%	0.723	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	2.9	174.3	-80.3	167.6	0	0	0	113.9	I19	I19-L21 PolarHBondContact O-N 2.92Å
22	H	36.6	Very low	33.4	Very low	168 Å²	168	145.6 Å²	145.6	78%	0.778	74%	0.737	S	S	*	*	S	Bend	trans	-96.2	-7.6	-176.5	-165.2	-87.2	0	0	0	113.9	I19	I19-H22 WeakPolarHBondContact O-CB 3.49Å; I19-H22 PolarHBondContact O-N 2.72Å
23	E	33.3	Very low	33.1	Very low	169 Å²	169	153.8 Å²	153.8	79%	0.79	76%	0.758	S	S	*	*	S	Bend	trans	-106.8	10.1	-160.2	-146.2	167.3	-136.9	0	0	116.1
24	Q	34.5	Very low	32.8	Very low	203 Å²	203	149.6 Å²	149.6	95%	0.949	75%	0.752	S	S	*	*			trans	-128.6	83.6	165.3	-73.4	-156.7	-1.3	0	0	112.4
25	G	29.7	Very low	32.5	Very low	66 Å²	66	153 Å²	153	68%	0.68	77%	0.765	S	S	*	*			trans	-143.7	116.4	166.6	0	0	0	0	0	111.8
26	Q	32.6	Very low	31.9	Very low	198 Å²	198	153.2 Å²	153.2	93%	0.925	77%	0.766	S	S	*	*			trans	-145.3	132.5	149.5	-110.8	178.6	20.8	0	0	110.2
27	F	26.5	Very low	31.6	Very low	183 Å²	183	156.8 Å²	156.8	80%	0.803	77%	0.773	S	S	*	*			trans	-88.4	167.2	176.4	-78	-117.4	0	0	0	110.1
28	V	29.4	Very low	31	Very low	142 Å²	142	157.5 Å²	157.5	86%	0.861	78%	0.778	S	S	*	*				176.7	154.7	111.8	151.8	0	0	0	0	111.2
29	F	26.4	Very low	30.7	Very low	193 Å²	193	160.4 Å²	160.4	85%	0.846	79%	0.791	S	S	*	*			trans	-83.6	157.9	-178.9	-71.2	-120.2	0	0	0	112.5
30	G	26	Very low	30.1	Very low	76 Å²	76	164.1 Å²	164.1	78%	0.784	80%	0.803	S	S	*	*			trans	174.5	99	163.5	0	0	0	0	0	119.6
31	F	29.8	Very low	30	Very low	193 Å²	193	157.3 Å²	157.3	85%	0.846	80%	0.801	S	S	*	*			trans	-4.6	129.8	156.9	-79.9	-100.7	0	0	0	123.5
32	K	25.3	Very low	29.5	Very low	187 Å²	187	156.9 Å²	156.9	81%	0.813	80%	0.799	S	S	*	*				38.5	141.9	128.8	-80	-178.1	175.3	174	0	123.2
33	R	28.4	Very low	29.2	Very low	232 Å²	232	158.2 Å²	158.2	88%	0.875	80%	0.802	S	S	*	*			trans	92.9	101.8	150.3	-85	-176.6	168.4	167.9	-4.9	120
34	S	26.5	Very low	29.1	Very low	96 Å²	96	157.5 Å²	157.5	67%	0.671	80%	0.804	S	S	*	*				30.5	127.4	122.4	61.1	0	0	0	0	121.5
35	I	30	Very low	29	Very low	178 Å²	178	151.6 Å²	151.6	91%	0.913	80%	0.797	S	S	*	*				-159.8	179.3	123.3	-101.1	154.7	0	0	0	108.8
36	N	26.6	Very low	29	Very low	114 Å²	114	157.3 Å²	157.3	61%	0.61	81%	0.806	S	S	*	*			trans	-132.4	177	-151.5	-167.7	46.7	0	0	0	114
37	Y	29.8	Very low	28.9	Very low	188 Å²	188	155 Å²	155	74%	0.737	80%	0.799	S	S	*	*			trans	95.1	109.2	162	-60.5	-72.7	0	0	0	120.6
38	D	27.9	Very low	29	Very low	133 Å²	133	153.2 Å²	153.2	71%	0.711	79%	0.794	S	S	*	*				33.5	134.6	112.8	-50.6	-26	0	0	0	121.7
39	M	29.8	Very low	29	Very low	184 Å²	184	155 Å²	155	91%	0.906	79%	0.791	S	S	*	*				-164.7	160.3	107.3	-108.7	-175.6	67.3	0	0	114.1
40	F	29	Very low	28.9	Very low	186 Å²	186	151.6 Å²	151.6	82%	0.816	79%	0.791	S	S	*	*			trans	-91	158.4	-177.9	-89.2	-112	0	0	0	113.6	I42	F40-I42 HydrophobicContact CD1-CD1 4.11Å; F40-I42 HydrophobicContact CD1-CG1 4.3Å
41	G	31.7	Very low	29.1	Very low	77 Å²	77	153.9 Å²	153.9	79%	0.794	80%	0.795	S	S	*	*			trans	-145.5	129.7	162.9	0	0	0	0	0	111.3
42	I	29.2	Very low	28.9	Very low	129 Å²	129	152.6 Å²	152.6	66%	0.662	79%	0.794	S	S	*	*			trans	-140.9	136.8	-169.4	-53.6	170.4	0	0	0	109.6	F40	F40-I42 HydrophobicContact CD1-CD1 4.11Å; F40-I42 HydrophobicContact CD1-CG1 4.3Å
43	K	31.1	Very low	29.1	Very low	195 Å²	195	151.3 Å²	151.3	85%	0.848	79%	0.794	S	S	*	*			trans	173.8	122.2	133.6	-96.4	161.9	-175.5	-178.9	0	115.6
44	N	31.5	Very low	29	Very low	154 Å²	154	144.4 Å²	144.4	82%	0.824	78%	0.78	S	S	*	*			trans	21.8	138.5	131.7	-50.9	10.3	0	0	0	121.4
45	G	32.7	Very low	29.3	Very low	79 Å²	79	147 Å²	147	81%	0.814	79%	0.785	S	S	*	*			trans	-163.6	130.2	155.7	0	0	0	0	0	110.2
46	E	29.4	Very low	29.2	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	77%	0.773	S	S	*	*			trans	-105.8	-168.5	-174.9	-61.1	178.1	129.9	0	0	111.9
47	I	30.6	Very low	29.3	Very low	149 Å²	149	145.4 Å²	145.4	76%	0.764	77%	0.774	S	S	*	*			trans	117.9	103.5	149.2	-65.3	166.9	0	0	0	118.4
48	M	28.9	Very low	29.5	Very low	145 Å²	145	142.3 Å²	142.3	71%	0.714	77%	0.77	S	S	*	*			trans	73.6	125.7	135.7	-75.4	-173.2	-173.5	0	0	125.8
49	K	27.9	Very low	29.7	Very low	180 Å²	180	142.1 Å²	142.1	78%	0.783	77%	0.768	S	S	*	*				110	153.2	117.4	-88.1	170.4	-178.4	165.2	0	120.8
50	S	25.5	Very low	29.8	Very low	122 Å²	122	144 Å²	144	85%	0.853	77%	0.767	S	S	*	*			trans	-123.7	167.9	-165.3	-32.5	0	0	0	0	112
51	S	29.6	Very low	29.8	Very low	124 Å²	124	138.3 Å²	138.3	87%	0.867	76%	0.76	S	S	*	*			trans	-133.6	163	163.4	53.2	0	0	0	0	110.2
52	M	25.4	Very low	29.6	Very low	166 Å²	166	141.2 Å²	141.2	82%	0.818	77%	0.766	S	S	*	*			trans	-161.6	132.7	-165.5	163.4	173.5	134.8	0	0	112.8
53	I	29.5	Very low	29.6	Very low	160 Å²	160	140 Å²	140	82%	0.821	77%	0.77	S	S	*	*			trans	-167.4	119.4	159.3	-94.4	141.4	0	0	0	105.6
54	C	26	Very low	29.4	Very low	86 Å²	86	141.1 Å²	141.1	58%	0.581	77%	0.768	S	S	*	*				74.5	136.7	62.8	-65.6	0	0	0	0	112.2
55	I	32.9	Very low	29.2	Very low	150 Å²	150	140.6 Å²	140.6	77%	0.769	77%	0.765	S	S	*	*			cis	-155.3	139.7	18.9	-118.4	151.8	0	0	0	108.3
56	N	29.2	Very low	29.2	Very low	123 Å²	123	142.5 Å²	142.5	66%	0.658	77%	0.767	S	S	*	*				57.9	143.4	102.3	-120.4	31.1	0	0	0	116.1
57	Q	28.6	Very low	29.1	Very low	136 Å²	136	140.9 Å²	140.9	64%	0.636	76%	0.764	S	S	*	*			cis	-173.5	-179.4	-8.3	-140.4	173.7	6.5	0	0	109.9
58	N	34	Very low	29	Very low	123 Å²	123	142 Å²	142	66%	0.658	77%	0.771	S	S	*	*			trans	72.5	155.9	151.1	-64.9	-12.1	0	0	0	119.8
59	I	32.5	Very low	28.8	Very low	130 Å²	130	144.9 Å²	144.9	67%	0.667	77%	0.773	S	S	*	*			cis	-154.7	141.6	-12.3	-109.6	162.3	0	0	0	110.4
60	Y	30.6	Very low	28.8	Very low	224 Å²	224	144.8 Å²	144.8	88%	0.878	77%	0.773	S	S	*	*			trans	21.7	143.5	154.8	-65	-116.2	0	0	0	123.9
61	G	29.6	Very low	28.9	Very low	65 Å²	65	145 Å²	145	67%	0.67	77%	0.765	S	S	*	*				143.3	102.1	114.3	0	0	0	0	0	120.6
62	C	27.2	Very low	28.9	Very low	138 Å²	138	146.4 Å²	146.4	93%	0.932	76%	0.763	S	S	*	*			trans	60.9	171.1	145.9	-68.6	0	0	0	0	119
63	S	28.3	Very low	28.9	Very low	105 Å²	105	143.5 Å²	143.5	73%	0.734	76%	0.759	S	S	*	*			cis	-160.3	155.7	-32	172.8	0	0	0	0	109.8
64	R	28.1	Very low	28.8	Very low	218 Å²	218	143.9 Å²	143.9	82%	0.823	76%	0.761	S	S	*	*			trans	-4.7	140.7	166.4	-82.6	-179.3	171.3	165.9	-3.7	121.3
65	N	27.8	Very low	28.8	Very low	142 Å²	142	146 Å²	146	76%	0.759	77%	0.766	S	S	*	*			trans	65.9	114.3	143.2	-59	17.3	0	0	0	119.7
66	S	31.5	Very low	28.5	Very low	120 Å²	120	147.1 Å²	147.1	84%	0.839	77%	0.765	S	S	*	*				-178.8	159.6	106.2	38.1	0	0	0	0	111.6
67	D	27.8	Very low	28.4	Very low	152 Å²	152	148.4 Å²	148.4	81%	0.813	77%	0.767	S	S	*	*			trans	-71.4	146.6	175.4	-50.1	-99.2	0	0	0	112.5
68	L	28.9	Very low	28.3	Very low	174 Å²	174	147.5 Å²	147.5	91%	0.911	77%	0.767	S	S	*	*				-175.8	154.5	127.1	-100.1	159.2	0	0	0	112
69	R	24.5	Very low	28.2	Very low	204 Å²	204	146.6 Å²	146.6	77%	0.77	76%	0.762	S	S	*	*			trans	-92.2	150.3	173.1	-59.7	173.9	178.1	178.8	-3.4	109.7
70	F	27.2	Very low	28.1	Very low	179 Å²	179	149.3 Å²	149.3	79%	0.785	77%	0.769	S	S	*	*				171.2	166.8	110.7	-97.6	-72.1	0	0	0	112.4
71	N	26.7	Very low	28.1	Very low	125 Å²	125	143 Å²	143	67%	0.668	76%	0.757	S	S	*	*			trans	-39.7	148.1	-178.4	-43.9	-16.5	0	0	0	117
72	D	30.3	Very low	28	Very low	155 Å²	155	144.6 Å²	144.6	83%	0.829	76%	0.755	S	S	*	*				-177	168.7	99.2	-91.6	-22.5	0	0	0	112.2
73	S	24.9	Very low	28.3	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	74%	0.743	S	S	*	*			trans	-120.5	140	-164.7	54.7	0	0	0	0	114.9
74	I	28.8	Very low	28.3	Very low	167 Å²	167	146 Å²	146	86%	0.856	74%	0.74	S	S	*	*			trans	-137.3	162.3	177.2	-83.1	103	0	0	0	110
75	L	24.7	Very low	28.4	Very low	131 Å²	131	138.4 Å²	138.4	69%	0.686	72%	0.719	S	S	*	*			trans	-138.9	178	-149	-86.8	157.5	0	0	0	114.7
76	F	27	Very low	28.6	Very low	174 Å²	174	139.3 Å²	139.3	76%	0.763	72%	0.724	S	S	*	*			trans	77.7	153.2	163.2	-52.2	-63.6	0	0	0	116.7
77	Q	27.4	Very low	28.5	Very low	149 Å²	149	141.1 Å²	141.1	70%	0.696	72%	0.723	S	S	*	*			cis	-154.9	154.6	-4.2	-137	172.9	-71.7	0	0	112.5
78	D	27.6	Very low	28.6	Very low	118 Å²	118	143.3 Å²	143.3	63%	0.631	73%	0.726	S	S	*	*			trans	59.4	151.7	149.4	-81.9	-37.7	0	0	0	121.5
79	N	30.8	Very low	28.5	Very low	103 Å²	103	140.9 Å²	140.9	55%	0.551	72%	0.724	S	S	*	*			cis	-148.6	124	8.4	-140.4	-68.3	0	0	0	111
80	K	29.7	Very low	28.6	Very low	187 Å²	187	139 Å²	139	81%	0.813	73%	0.725	S	S	*	*			trans	57.2	134.1	161.9	-64.6	160	-171.3	163.8	0	119.4
81	S	30.6	Very low	28.8	Very low	91 Å²	91	136.7 Å²	136.7	64%	0.636	72%	0.721	S	S	*	*			cis	-170.6	138.6	-6.3	48.7	0	0	0	0	111.3
82	T	29.1	Very low	29	Very low	100 Å²	100	138.6 Å²	138.6	61%	0.613	73%	0.728	S	S	*	*			trans	52.8	129.7	145.3	59.8	0	0	0	0	119.7
83	H	32.5	Very low	29.2	Very low	150 Å²	150	137.3 Å²	137.3	69%	0.694	72%	0.721	S	S	*	*			cis	-155.2	161.4	-5.4	-75.8	-68.4	0	0	0	107.6
84	D	28.5	Very low	29.7	Very low	123 Å²	123	140.7 Å²	140.7	66%	0.658	73%	0.726	S	S	*	*			cis	-161.9	151.5	-36.5	-94.9	-17.3	0	0	0	107
85	C	30.2	Very low	30.1	Very low	57 Å²	57	138 Å²	138	39%	0.385	71%	0.713	S	S	.	*			trans	-167.7	-25.5	175.1	-147.1	0	0	0	0	112.9	L87	C85-L87 VanDerWaalsContact C-N 3.32Å; C85-L87 PolarHBondContact O-N 3.1Å
86	D	31.9	Very low	30.6	Very low	162 Å²	162	138.3 Å²	138.3	87%	0.866	71%	0.714	S	S	*	*			trans	-80	54.4	-168.8	-61.5	-57.3	0	0	0	114.9
87	L	29.7	Very low	31	Very low	157 Å²	157	134.6 Å²	134.6	82%	0.822	71%	0.71	S	S	*	*			trans	-151.8	58.1	174.7	-149.8	81.5	0	0	0	117.1	C85	C85-L87 VanDerWaalsContact C-N 3.32Å; C85-L87 PolarHBondContact O-N 3.1Å
88	F	29.1	Very low	31.6	Very low	198 Å²	198	132.5 Å²	132.5	87%	0.868	70%	0.7	S	S	*	*			trans	-132	100.9	157.2	-91.5	-75.3	0	0	0	112.7	M90	F88-M90 HydrophobicContact CD1-SD 4.42Å
89	S	27.4	Very low	32	Very low	124 Å²	124	129 Å²	129	87%	0.867	69%	0.692	S	S	*	*			trans	-98.7	103.7	163.7	167.6	0	0	0	0	108.2
90	M	27.1	Very low	32.5	Very low	164 Å²	164	128 Å²	128	81%	0.808	69%	0.689	S	S	*	*			trans	-146.3	164	174.4	-102.8	170.7	-172.9	0	0	111.9	F88	F88-M90 HydrophobicContact CD1-SD 4.42Å
91	D	30.7	Very low	32.9	Very low	131 Å²	131	125.1 Å²	125.1	70%	0.701	68%	0.677	S	S	*	*			trans	-65.7	142.3	-154.4	-151.5	-43.1	0	0	0	114.7	N93	D91-N93 PolarHBondContact O-N 2.93Å; D91-N93 PolarHBondContact OD1-ND2 2.6Å; D91-N93 VanDerWaalsContact OD1-ND2 3.09Å
92	M	32.1	Very low	33.3	Very low	164 Å²	164	125.7 Å²	125.7	81%	0.808	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	3.3	-169.7	-68.3	-151.4	-65.7	0	0	115
93	N	34.5	Very low	33.7	Very low	128 Å²	128	123.7 Å²	123.7	68%	0.684	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-0.3	-165.9	-76.7	-68.6	0	0	0	116.6	D91	D91-N93 PolarHBondContact O-N 2.93Å; D91-N93 PolarHBondContact OD1-ND2 2.6Å; D91-N93 VanDerWaalsContact OD1-ND2 3.09Å
94	Q	34.8	Very low	34.3	Very low	177 Å²	177	119.7 Å²	119.7	83%	0.827	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.5	-45.4	178.4	-115.8	133.8	55.2	0	0	118.3
95	D	35.9	Very low	34.9	Very low	110 Å²	110	116.7 Å²	116.7	59%	0.588	63%	0.626	S	S	*	*			trans	-114.3	28.4	-159.8	-83.4	-62.5	0	0	0	117.8	S97 H98	D95-S97 PolarHBondContact O-N 3.44Å; D95-H98 PolarHBondContact O-N 3.47Å
96	L	35.2	Very low	35.5	Very low	137 Å²	137	117 Å²	117	72%	0.717	62%	0.623	S	S	*	*	H	α-helix	trans	-55	-23.7	178.7	-150.4	88.5	0	0	0	114	V100	L96-V100 VanDerWaalsContact O-CG2 3.27Å; L96-V100 WeakPolarHBondContact O-CG2 3.12Å
97	S	36.8	Very low	35.9	Very low	97 Å²	97	113.7 Å²	113.7	68%	0.678	60%	0.601	S	S	*	*	H	α-helix	trans	-78.4	-20.6	178.6	75.6	0	0	0	0	114.8	D95 K101	D95-S97 PolarHBondContact O-N 3.44Å; S97-K101 WeakPolarHBondContact O-CB 3.49Å
98	H	39.9	Very low	36.5	Very low	104 Å²	104	108.6 Å²	108.6	48%	0.481	57%	0.574	S	S	.	*	H	α-helix	trans	-86.9	-53.7	-177	-144.1	-79.2	0	0	0	111.5	D95 V100 K101 E102	D95-H98 PolarHBondContact O-N 3.47Å; H98-V100 PolarHBondContact O-N 2.81Å; H98-K101 WeakPolarHBondContact O-CA 3.34Å; H98-K101 WeakPolarHBondContact O-CB 3.33Å; H98-K101 PolarHBondContact O-N 3.08Å; H98-E102 IonicContact CE1-OE2 3.28Å; H98-E102 IonicContact ND1-OE2 2.71Å; H98-E102 PolarHBondContact ND1-OE2 2.96Å; H98-E102 PolarHBondContact O-N 3.33Å
99	G	35.4	Very low	37.1	Very low	45 Å²	45	104 Å²	104	46%	0.464	56%	0.558	S	S	.	*	H	α-helix	trans	-63.2	-36.5	-179.3	0	0	0	0	0	113.9	K101 C103	G99-K101 VanDerWaalsContact C-N 3.3Å; G99-K101 PolarHBondContact O-N 2.92Å; G99-C103 VanDerWaalsContact O-CB 3.3Å; G99-C103 WeakPolarHBondContact O-CB 3.17Å; G99-C103 PolarHBondContact O-N 3.43Å
100	V	40.6	Very low	37.5	Very low	81 Å²	81	102.1 Å²	102.1	49%	0.491	54%	0.539	S	S	.	.	H	α-helix	trans	-66	-34.5	173.8	173.9	0	0	0	0	111.3	L96 H98 I104	L96-V100 VanDerWaalsContact O-CG2 3.27Å; L96-V100 WeakPolarHBondContact O-CG2 3.12Å; H98-V100 PolarHBondContact O-N 2.81Å; V100-I104 HydrophobicContact CG1-CD1 3.88Å; V100-I104 WeakPolarHBondContact O-CB 3.12Å; V100-I104 WeakPolarHBondContact O-CD1 2.94Å; V100-I104 VanDerWaalsContact O-CG1 3.25Å; V100-I104 WeakPolarHBondContact O-CG1 3.49Å; V100-I104 PolarHBondContact O-N 2.81Å; V100-I104 VanDerWaalsContact O-N 3.11Å
101	K	38.9	Very low	37.9	Very low	127 Å²	127	100.2 Å²	100.2	55%	0.552	53%	0.53	S	S	*	.	H	α-helix	trans	-69.1	-50.7	176.7	-174.3	-171.1	170.8	-163.9	0	111.1	S97 H98 G99 C103 I104 D105	S97-K101 WeakPolarHBondContact O-CB 3.49Å; H98-K101 WeakPolarHBondContact O-CA 3.34Å; H98-K101 WeakPolarHBondContact O-CB 3.33Å; H98-K101 PolarHBondContact O-N 3.08Å; G99-K101 VanDerWaalsContact C-N 3.3Å; G99-K101 PolarHBondContact O-N 2.92Å; K101-C103 VanDerWaalsContact C-N 3.31Å; K101-C103 PolarHBondContact O-N 2.86Å; K101-I104 PolarHBondContact O-N 2.86Å; K101-I104 VanDerWaalsContact O-N 3.16Å; K101-D105 PolarHBondContact O-N 3.13Å
102	E	39.5	Very low	38.2	Very low	104 Å²	104	100.3 Å²	100.3	49%	0.486	53%	0.53	S	S	.	.	H	α-helix	trans	-59.7	-40.6	178	-76.4	174.2	103.3	0	0	112.1	H98 I104 D105 I106	H98-E102 IonicContact CE1-OE2 3.28Å; H98-E102 IonicContact ND1-OE2 2.71Å; H98-E102 PolarHBondContact ND1-OE2 2.96Å; H98-E102 PolarHBondContact O-N 3.33Å; E102-I104 PolarHBondContact O-N 3.05Å; E102-D105 PolarHBondContact O-N 2.92Å; E102-I106 WeakPolarHBondContact O-CB 3.45Å; E102-I106 VanDerWaalsContact O-CG1 3.27Å; E102-I106 WeakPolarHBondContact O-CG1 3.45Å; E102-I106 PolarHBondContact O-N 3.04Å
103	C	36.2	Very low	38.6	Very low	58 Å²	58	96.9 Å²	96.9	39%	0.392	52%	0.522	S	S	.	.	H	α-helix	trans	-66.3	-36.4	177.3	-163.8	0	0	0	0	112.5	G99 K101 F107	G99-C103 VanDerWaalsContact O-CB 3.3Å; G99-C103 WeakPolarHBondContact O-CB 3.17Å; G99-C103 PolarHBondContact O-N 3.43Å; K101-C103 VanDerWaalsContact C-N 3.31Å; K101-C103 PolarHBondContact O-N 2.86Å; C103-F107 WeakPolarHBondContact O-CB 3.27Å; C103-F107 PolarHBondContact O-N 3.06Å
104	I	45.6	Very low	38.6	Very low	66 Å²	66	95 Å²	95	34%	0.338	52%	0.516	S	S	.	.	H	α-helix	trans	-69.9	-42.7	173	-71.5	170	0	0	0	111.4	V100 K101 E102 I106 F107 I108	V100-I104 HydrophobicContact CG1-CD1 3.88Å; V100-I104 WeakPolarHBondContact O-CB 3.12Å; V100-I104 WeakPolarHBondContact O-CD1 2.94Å; V100-I104 VanDerWaalsContact O-CG1 3.25Å; V100-I104 WeakPolarHBondContact O-CG1 3.49Å; V100-I104 PolarHBondContact O-N 2.81Å; V100-I104 VanDerWaalsContact O-N 3.11Å; K101-I104 PolarHBondContact O-N 2.86Å; K101-I104 VanDerWaalsContact O-N 3.16Å; E102-I104 PolarHBondContact O-N 3.05Å; I104-I106 VanDerWaalsContact C-N 3.33Å; I104-I106 PolarHBondContact O-N 3.07Å; I104-F107 PolarHBondContact O-N 2.87Å; I104-I108 HydrophobicContact CG2-CD1 3.86Å; I104-I108 HydrophobicContact CG2-CG1 4.49Å; I104-I108 WeakPolarHBondContact O-CG1 3.37Å; I104-I108 PolarHBondContact O-N 2.86Å
105	D	42.1	Very low	38.4	Very low	59 Å²	59	90.8 Å²	90.8	32%	0.316	52%	0.519	S	S	.	.	H	α-helix	trans	-62	-40.4	177.4	-74.6	-27.2	0	0	0	110.8	K101 E102 I108 N109	K101-D105 PolarHBondContact O-N 3.13Å; E102-D105 PolarHBondContact O-N 2.92Å; D105-I108 PolarHBondContact O-N 2.96Å; D105-N109 WeakPolarHBondContact O-CB 3.36Å; D105-N109 VanDerWaalsContact O-CG 3.29Å; D105-N109 PolarHBondContact O-N 3.3Å; D105-N109 PolarHBondContact O-ND2 3.17Å
106	I	42.1	Very low	38.2	Very low	65 Å²	65	91.7 Å²	91.7	33%	0.333	52%	0.524	S	S	.	.	H	α-helix	trans	-68.3	-39.6	174	-67.1	166	0	0	0	111.6	E102 I104 I108 N109 N110	E102-I106 WeakPolarHBondContact O-CB 3.45Å; E102-I106 VanDerWaalsContact O-CG1 3.27Å; E102-I106 WeakPolarHBondContact O-CG1 3.45Å; E102-I106 PolarHBondContact O-N 3.04Å; I104-I106 VanDerWaalsContact C-N 3.33Å; I104-I106 PolarHBondContact O-N 3.07Å; I106-I108 VanDerWaalsContact C-N 3.34Å; I106-I108 PolarHBondContact O-N 3.13Å; I106-N109 PolarHBondContact O-N 2.84Å; I106-N110 PolarHBondContact O-N 2.78Å
107	F	39.8	Very low	37.9	Very low	91 Å²	91	92.3 Å²	92.3	40%	0.399	53%	0.534	S	S	.	.	H	α-helix	trans	-61.6	-40.6	175.3	-170.7	-93.3	0	0	0	112.2	C103 I104 M111 Y120	C103-F107 WeakPolarHBondContact O-CB 3.27Å; C103-F107 PolarHBondContact O-N 3.06Å; I104-F107 PolarHBondContact O-N 2.87Å; F107-M111 HydrophobicContact CE1-CE 3.76Å; F107-M111 HydrophobicContact CE1-SD 4.39Å; F107-M111 HydrophobicContact CZ-CE 4.04Å; F107-M111 PolarHBondContact O-N 3.32Å; F107-Y120 HydrophobicContact CE2-CD2 4.47Å
108	I	42.7	Very low	37.3	Very low	50 Å²	50	95 Å²	95	26%	0.256	53%	0.533	S	S	.	.	H	α-helix	trans	-66.8	-43.9	174.8	-69.1	168.4	0	0	0	110.9	I104 D105 I106 N110 M111 N112	I104-I108 HydrophobicContact CG2-CD1 3.86Å; I104-I108 HydrophobicContact CG2-CG1 4.49Å; I104-I108 WeakPolarHBondContact O-CG1 3.37Å; I104-I108 PolarHBondContact O-N 2.86Å; D105-I108 PolarHBondContact O-N 2.96Å; I106-I108 VanDerWaalsContact C-N 3.34Å; I106-I108 PolarHBondContact O-N 3.13Å; I108-N110 VanDerWaalsContact C-N 3.35Å; I108-N110 PolarHBondContact O-N 2.91Å; I108-M111 PolarHBondContact O-N 3.21Å; I108-N112 PolarHBondContact O-N 2.05Å; I108-N112 PolarHBondContact O-ND2 2.92Å
109	N	41	Very low	36.8	Very low	101 Å²	101	99.5 Å²	99.5	54%	0.54	55%	0.554	S	S	.	*	H	α-helix	trans	-62.1	-39.5	177.6	-76.3	-39.3	0	0	0	112.6	D105 I106 N112 S113	D105-N109 WeakPolarHBondContact O-CB 3.36Å; D105-N109 VanDerWaalsContact O-CG 3.29Å; D105-N109 PolarHBondContact O-N 3.3Å; D105-N109 PolarHBondContact O-ND2 3.17Å; I106-N109 PolarHBondContact O-N 2.84Å; N109-N112 PolarHBondContact O-N 2.84Å; N109-S113 PolarHBondContact O-N 2.82Å
110	N	36.2	Very low	36.4	Very low	85 Å²	85	105.3 Å²	105.3	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-70.8	-31.7	177.5	-81.5	-25	0	0	0	113.5	I106 I108 N112 S113 T114	I106-N110 PolarHBondContact O-N 2.78Å; I108-N110 VanDerWaalsContact C-N 3.35Å; I108-N110 PolarHBondContact O-N 2.91Å; N110-N112 VanDerWaalsContact C-N 3.3Å; N110-N112 PolarHBondContact O-N 2.87Å; N110-S113 PolarHBondContact O-N 2.86Å; N110-T114 PolarHBondContact O-N 2.85Å
111	M	36.3	Very low	35.7	Very low	125 Å²	125	108.7 Å²	108.7	62%	0.616	57%	0.574	S	S	*	*	H	α-helix	trans	-62.8	-35.6	170.1	-83.6	-160.5	170.1	0	0	112.7	F107 I108 S113	F107-M111 HydrophobicContact CE1-CE 3.76Å; F107-M111 HydrophobicContact CE1-SD 4.39Å; F107-M111 HydrophobicContact CZ-CE 4.04Å; F107-M111 PolarHBondContact O-N 3.32Å; I108-M111 PolarHBondContact O-N 3.21Å; M111-S113 VanDerWaalsContact C-N 3.26Å; M111-S113 PolarHBondContact O-N 2.82Å
112	N	37.7	Very low	35.1	Very low	132 Å²	132	108.6 Å²	108.6	71%	0.706	58%	0.578	S	S	*	*	H	α-helix	trans	-72.8	-17.7	176.1	-67	-32.2	0	0	0	113.2	I108 N109 N110	I108-N112 PolarHBondContact O-N 2.05Å; I108-N112 PolarHBondContact O-ND2 2.92Å; N109-N112 PolarHBondContact O-N 2.84Å; N110-N112 VanDerWaalsContact C-N 3.3Å; N110-N112 PolarHBondContact O-N 2.87Å
113	S	39.1	Very low	34.5	Very low	93 Å²	93	113.3 Å²	113.3	65%	0.65	59%	0.592	S	S	*	*	H	α-helix	trans	-88.1	-34.9	-177.7	-170.9	0	0	0	0	113.3	N109 N110 M111	N109-S113 PolarHBondContact O-N 2.82Å; N110-S113 PolarHBondContact O-N 2.86Å; M111-S113 VanDerWaalsContact C-N 3.26Å; M111-S113 PolarHBondContact O-N 2.82Å
114	T	34.1	Very low	34.3	Very low	89 Å²	89	118.6 Å²	118.6	55%	0.546	62%	0.615	S	S	.	*			trans	-131.9	112.3	-175.5	60	0	0	0	0	112.7	N110 N116	N110-T114 PolarHBondContact O-N 2.85Å; T114-N116 PolarHBondContact O-N 2.93Å
115	G	30.6	Very low	33.6	Very low	87 Å²	87	124.2 Å²	124.2	90%	0.897	64%	0.637	S	S	*	*			trans	-71.2	29.7	-179.4	0	0	0	0	0	116
116	N	31.9	Very low	33.3	Very low	130 Å²	130	128 Å²	128	70%	0.695	66%	0.657	S	S	*	*			trans	-116.5	109.8	-179	-81	-39.8	0	0	0	110.4	T114 K118	T114-N116 PolarHBondContact O-N 2.93Å; N116-K118 VanDerWaalsContact C-N 3.33Å; N116-K118 PolarHBondContact O-N 2.86Å
117	T	28.6	Very low	32.7	Very low	149 Å²	149	133.5 Å²	133.5	91%	0.914	68%	0.682	S	S	*	*			trans	-72.5	78.9	180	52.1	0	0	0	0	112.9
118	K	26	Very low	32.2	Very low	154 Å²	154	138.6 Å²	138.6	67%	0.67	71%	0.707	S	S	*	*			trans	-80.3	132	163.9	-71.4	-173.4	176.6	-178.6	0	110.2	N116 Y120	N116-K118 VanDerWaalsContact C-N 3.33Å; N116-K118 PolarHBondContact O-N 2.86Å; K118-Y120 HydrophobicContact CB-CE2 3.97Å
119	Q	28	Very low	31.4	Very low	198 Å²	198	140.7 Å²	140.7	93%	0.925	73%	0.732	S	S	*	*			trans	-75.3	121.5	171	-72.6	-179.6	-29.9	0	0	109.9
120	Y	26.7	Very low	30.6	Very low	167 Å²	167	141.6 Å²	141.6	66%	0.655	74%	0.74	S	S	*	*			trans	-105.4	126.7	170	-67.7	-78.2	0	0	0	109.8	F107 K118	F107-Y120 HydrophobicContact CE2-CD2 4.47Å; K118-Y120 HydrophobicContact CB-CE2 3.97Å
121	Q	27	Very low	30	Very low	152 Å²	152	146 Å²	146	71%	0.71	76%	0.755	S	S	*	*			trans	-105.2	92.7	-179.7	-175.6	179.9	60.9	0	0	110.1	R123	Q121-R123 HydrophobicContact CG-CG 4.48Å; Q121-R123 PolarHBondContact O-N 3.34Å
122	I	26.7	Very low	29.3	Very low	126 Å²	126	146.2 Å²	146.2	65%	0.646	76%	0.759	S	S	*	*			trans	-67.7	121.9	176.9	-57.8	175.9	0	0	0	109.4	L124	I122-L124 HydrophobicContact CG2-CG 4.46Å
123	R	26.9	Very low	28.6	Very low	202 Å²	202	145.4 Å²	145.4	76%	0.762	75%	0.753	S	S	*	*			trans	-122.8	87.8	174.3	-79.1	-178	170.9	176.7	-2.1	110.1	Q121	Q121-R123 HydrophobicContact CG-CG 4.48Å; Q121-R123 PolarHBondContact O-N 3.34Å
124	L	31.2	Very low	28	Very low	170 Å²	170	147.3 Å²	147.3	89%	0.89	76%	0.761	S	S	*	*			trans	-65.8	139.2	163.2	-71.2	164.4	0	0	0	109.1	I122	I122-L124 HydrophobicContact CG2-CG 4.46Å
125	K	31.6	Very low	27.6	Very low	184 Å²	184	146.8 Å²	146.8	80%	0.8	76%	0.761	S	S	*	*			trans	-125.6	136.9	-161	-155.1	-176.4	-179.5	-172.6	0	111.4
126	N	35.1	Very low	27.3	Very low	138 Å²	138	151 Å²	151	74%	0.738	76%	0.757	S	S	*	*	S	Bend	trans	72.1	106.4	174.1	-62.2	-3.2	0	0	0	117.8
127	Q	29.6	Very low	27	Very low	180 Å²	180	152 Å²	152	84%	0.841	76%	0.763	S	S	*	*	S	Bend	trans	74.6	116.1	154.1	-68.6	175.3	-31.8	0	0	120.4
128	E	28.6	Very low	26.9	Very low	199 Å²	199	150.7 Å²	150.7	93%	0.93	75%	0.754	S	S	*	*			trans	58.7	63.9	148.9	-51.5	-157.2	164.9	0	0	120.7
129	A	26.9	Very low	27	Very low	94 Å²	94	150.2 Å²	150.2	78%	0.777	76%	0.757	S	S	*	*	S	Bend	trans	-135.2	116.3	151.5	0	0	0	0	0	111.9	K131	A129-K131 PolarHBondContact O-N 3.06Å
130	V	24.5	Very low	26.9	Very low	120 Å²	120	150.6 Å²	150.6	73%	0.727	76%	0.756	S	S	*	*			trans	25.3	70.7	170.1	-163.3	0	0	0	0	116.6	L132	V130-L132 HydrophobicContact CG1-CB 4.5Å; V130-L132 HydrophobicContact CG1-CG 4.39Å; V130-L132 PolarHBondContact O-N 3.25Å
131	K	22.4	Very low	27.1	Very low	176 Å²	176	150.3 Å²	150.3	77%	0.765	76%	0.761	S	S	*	*			trans	-75.4	90.5	164	-171.3	-177.3	-174.8	-172.3	0	109.5	A129 L133	A129-K131 PolarHBondContact O-N 3.06Å; K131-L133 HydrophobicContact CD-CD1 3.91Å; K131-L133 HydrophobicContact CD-CG 4.38Å; K131-L133 VanDerWaalsContact CE-CD1 3.47Å; K131-L133 HydrophobicContact CG-CD1 4.32Å; K131-L133 HydrophobicContact CG-CG 4.26Å; K131-L133 PolarHBondContact O-N 3.01Å
132	L	23	Very low	27.1	Very low	131 Å²	131	148.9 Å²	148.9	69%	0.686	76%	0.758	S	S	*	*			trans	-74.7	59.7	-179.1	-127.4	172.4	0	0	0	112.7	V130 V134	V130-L132 HydrophobicContact CG1-CB 4.5Å; V130-L132 HydrophobicContact CG1-CG 4.39Å; V130-L132 PolarHBondContact O-N 3.25Å; L132-V134 HydrophobicContact CD2-CG2 3.86Å; L132-V134 PolarHBondContact O-N 3.49Å; L132-V134 VanDerWaalsContact O-N 3.15Å
133	L	22.6	Very low	27.3	Very low	114 Å²	114	150.8 Å²	150.8	60%	0.597	77%	0.769	S	S	*	*			trans	-67.6	100.1	160.6	-86.9	169	0	0	0	108.4	K131 S135	K131-L133 HydrophobicContact CD-CD1 3.91Å; K131-L133 HydrophobicContact CD-CG 4.38Å; K131-L133 VanDerWaalsContact CE-CD1 3.47Å; K131-L133 HydrophobicContact CG-CD1 4.32Å; K131-L133 HydrophobicContact CG-CG 4.26Å; K131-L133 PolarHBondContact O-N 3.01Å; L133-S135 PolarHBondContact O-N 3.34Å; L133-S135 VanDerWaalsContact O-N 3.09Å
134	V	26.2	Very low	27.3	Very low	133 Å²	133	146 Å²	146	81%	0.806	76%	0.758	S	S	*	*			trans	-78.7	79.4	152.9	-175.8	0	0	0	0	106.4	L132	L132-V134 HydrophobicContact CD2-CG2 3.86Å; L132-V134 PolarHBondContact O-N 3.49Å; L132-V134 VanDerWaalsContact O-N 3.15Å
135	S	24.8	Very low	27.1	Very low	79 Å²	79	143.9 Å²	143.9	55%	0.552	75%	0.752	S	S	*	*			trans	-72.9	133.2	179.3	52.2	0	0	0	0	111.1	L133 N137	L133-S135 PolarHBondContact O-N 3.34Å; L133-S135 VanDerWaalsContact O-N 3.09Å; S135-N137 PolarHBondContact O-N 3.23Å; S135-N137 VanDerWaalsContact O-N 3.11Å
136	E	26.1	Very low	27	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.813	75%	0.751	S	S	*	*	S	Bend	trans	36.6	66.1	140.5	-62	175.1	-167.8	0	0	116.1
137	N	25.1	Very low	26.8	Very low	153 Å²	153	139.5 Å²	139.5	82%	0.818	74%	0.742	S	S	*	*			trans	-171.7	143.7	138.3	-96.1	-43.8	0	0	0	113.2	S135	S135-N137 PolarHBondContact O-N 3.23Å; S135-N137 VanDerWaalsContact O-N 3.11Å
138	V	26.1	Very low	27	Very low	120 Å²	120	136.7 Å²	136.7	73%	0.727	73%	0.733	S	S	*	*			trans	-19.4	115.1	173.5	-173.8	0	0	0	0	117.1
139	I	28.4	Very low	27.4	Very low	144 Å²	144	131 Å²	131	74%	0.738	71%	0.708	S	S	*	*			trans	-129.5	89.9	140.3	-57.8	-176.8	0	0	0	108	E141	I139-E141 HydrophobicContact CG2-CB 3.96Å; I139-E141 HydrophobicContact CG2-CG 3.95Å; I139-E141 PolarHBondContact O-N 3.05Å
140	F	26.6	Very low	28	Very low	206 Å²	206	131.4 Å²	131.4	90%	0.904	69%	0.692	S	S	*	*			trans	-84.8	89.6	162	-110.4	-87.2	0	0	0	107.1
141	E	29.3	Very low	28.9	Very low	162 Å²	162	128.8 Å²	128.8	76%	0.757	67%	0.672	S	S	*	*			trans	-130.3	155.1	172.3	-76.4	-151.6	127.4	0	0	113	I139 L143	I139-E141 HydrophobicContact CG2-CB 3.96Å; I139-E141 HydrophobicContact CG2-CG 3.95Å; I139-E141 PolarHBondContact O-N 3.05Å; E141-L143 PolarHBondContact O-N 3.24Å
142	N	27.5	Very low	30.1	Very low	121 Å²	121	124.4 Å²	124.4	65%	0.647	66%	0.664	S	S	*	*			trans	-63.7	115.5	-163.5	-72.4	-59.4	0	0	0	113.6	L144	N142-L144 HydrophobicContact CB-CB 4.15Å; N142-L144 PolarHBondContact O-N 3.1Å
143	L	30	Very low	31.4	Very low	167 Å²	167	119.5 Å²	119.5	87%	0.874	64%	0.64	S	S	*	*			trans	-75.2	36.7	154	-71.9	170.6	0	0	0	111.4	E141	E141-L143 PolarHBondContact O-N 3.24Å
144	L	27.9	Very low	32.6	Very low	100 Å²	100	118.4 Å²	118.4	52%	0.524	63%	0.634	S	S	.	*			trans	-109.2	143.1	174.5	-72.6	169.4	0	0	0	109.8	N142	N142-L144 HydrophobicContact CB-CB 4.15Å; N142-L144 PolarHBondContact O-N 3.1Å
145	T	27.9	Very low	33.9	Very low	126 Å²	126	112.3 Å²	112.3	77%	0.773	60%	0.597	S	S	*	*	S	Bend	trans	80.5	130.7	177.7	75.2	0	0	0	0	117
146	I	29.1	Very low	35.1	Very low	153 Å²	153	112.5 Å²	112.5	79%	0.785	59%	0.592	S	S	*	*	S	Bend	trans	76.4	89.2	163	-52.7	163.3	0	0	0	116.2
147	S	30.9	Very low	36.3	Very low	78 Å²	78	111 Å²	111	55%	0.545	59%	0.586	S	S	.	*			trans	57.7	112.7	161.5	57.1	0	0	0	0	118.3	I149	S147-I149 VanDerWaalsContact C-N 3.32Å; S147-I149 PolarHBondContact O-N 3.11Å; S147-I149 WeakPolarHBondContact OG-CG1 3.13Å
148	D	32.7	Very low	37.5	Very low	120 Å²	120	104.5 Å²	104.5	64%	0.642	55%	0.551	S	S	*	*			trans	-51.8	104.9	131.8	-77.3	-44.5	0	0	0	107.7	F150	D148-F150 HydrophobicContact CB-CD2 3.49Å; D148-F150 VanDerWaalsContact CB-CD2 3.49Å; D148-F150 HydrophobicContact CB-CE2 3.48Å; D148-F150 VanDerWaalsContact CB-CE2 3.48Å; D148-F150 HydrophobicContact CB-CG 4.43Å; D148-F150 HydrophobicContact CB-CZ 4.43Å; D148-F150 PolarHBondContact O-N 3.5Å
149	I	37.4	Very low	38.7	Very low	80 Å²	80	102.4 Å²	102.4	41%	0.41	55%	0.546	S	S	.	.			trans	-76.1	71.4	171	-57	-175.6	0	0	0	107.8	S147 Q151	S147-I149 VanDerWaalsContact C-N 3.32Å; S147-I149 PolarHBondContact O-N 3.11Å; S147-I149 WeakPolarHBondContact OG-CG1 3.13Å; I149-Q151 HydrophobicContact CG2-CB 4.11Å; I149-Q151 HydrophobicContact CG2-CG 3.53Å; I149-Q151 VanDerWaalsContact CG2-NE2 3.32Å; I149-Q151 PolarHBondContact O-N 3.31Å
150	F	39.2	Very low	39.9	Very low	102 Å²	102	97 Å²	97	45%	0.447	52%	0.521	S	S	.	.			trans	-66.2	72.3	157.8	-72.9	-67.9	0	0	0	108.4	D148 S152	D148-F150 HydrophobicContact CB-CD2 3.49Å; D148-F150 VanDerWaalsContact CB-CD2 3.49Å; D148-F150 HydrophobicContact CB-CE2 3.48Å; D148-F150 VanDerWaalsContact CB-CE2 3.48Å; D148-F150 HydrophobicContact CB-CG 4.43Å; D148-F150 HydrophobicContact CB-CZ 4.43Å; D148-F150 PolarHBondContact O-N 3.5Å; F150-S152 PolarHBondContact O-N 3.38Å
151	Q	44.1	Very low	41.5	Very low	66 Å²	66	91 Å²	91	31%	0.308	50%	0.501	S	S	.	.			trans	-71.8	71.2	164.2	-91.4	169.4	24.4	0	0	108.6	I149 S153 F164 H165 L652	I149-Q151 HydrophobicContact CG2-CB 4.11Å; I149-Q151 HydrophobicContact CG2-CG 3.53Å; I149-Q151 VanDerWaalsContact CG2-NE2 3.32Å; I149-Q151 PolarHBondContact O-N 3.31Å; Q151-S153 PolarHBondContact O-N 3.05Å; Q151-F164 HydrophobicContact CB-CD1 3.91Å; Q151-F164 HydrophobicContact CB-CE1 4.44Å; Q151-F164 HydrophobicContact CG-CD1 4.48Å; Q151-F164 VanDerWaalsContact OE1-CA 3.25Å; Q151-F164 VanDerWaalsContact OE1-CB 3.31Å; Q151-H165 PolarHBondContact NE2-O 2.75Å; Q151-L652 HydrophobicContact CB-CD1 4.26Å
152	S	46.9	Very low	43.2	Very low	83 Å²	83	85 Å²	85	58%	0.58	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	92.1	162.4	58.5	0	0	0	0	108.7	F150 L154 I650	F150-S152 PolarHBondContact O-N 3.38Å; S152-L154 PolarHBondContact O-N 2.85Å; S152-I650 VanDerWaalsContact CA-O 3.31Å; S152-I650 WeakPolarHBondContact CA-O 3.34Å
153	S	51.1	Low	45	Very low	28 Å²	28	84.5 Å²	84.5	20%	0.196	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	119	168.1	57.7	0	0	0	0	109.1	Q151 I155 F164	Q151-S153 PolarHBondContact O-N 3.05Å; S153-I155 PolarHBondContact O-N 3.49Å; S153-F164 WeakPolarHBondContact OG-CE1 3.14Å; S153-F164 VanDerWaalsContact OG-CZ 3.25Å; S153-F164 WeakPolarHBondContact OG-CZ 3.34Å
154	L	47.5	Very low	46.6	Very low	91 Å²	91	77.2 Å²	77.2	48%	0.476	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	105.9	163.8	176.3	66.8	0	0	0	107.5	S152 N156 R647	S152-L154 PolarHBondContact O-N 2.85Å; L154-N156 PolarHBondContact O-N 3.48Å; L154-R647 HydrophobicContact CD1-CB 4.13Å; L154-R647 HydrophobicContact CD1-CG 4.25Å
155	I	52.9	Low	48.2	Very low	5 Å²	5	76.9 Å²	76.9	3%	0.026	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	109.2	-174.8	-43	167.8	0	0	0	109.6	S153 L162 L178 L181 A648 I650	S153-I155 PolarHBondContact O-N 3.49Å; I155-L162 HydrophobicContact CB-CD1 4.42Å; I155-L162 HydrophobicContact CD1-CD1 3.21Å; I155-L162 HydrophobicContact CG1-CD1 3.52Å; I155-L162 HydrophobicContact CG2-CD1 4.05Å; I155-L178 HydrophobicContact CD1-CD2 4.4Å; I155-L181 HydrophobicContact CB-CD2 4.33Å; I155-L181 HydrophobicContact CD1-CD2 3.66Å; I155-L181 HydrophobicContact CG2-CD2 3.81Å; I155-A648 HydrophobicContact CB-CB 4.31Å; I155-A648 HydrophobicContact CD1-CB 4.11Å; I155-A648 PolarHBondContact N-O 3.12Å; I155-I650 HydrophobicContact CD1-CB 4.43Å; I155-I650 HydrophobicContact CD1-CD1 3.48Å; I155-I650 VanDerWaalsContact CD1-CD1 3.48Å; I155-I650 HydrophobicContact CD1-CG1 3.6Å
156	N	49.7	Very low	49.5	Very low	84 Å²	84	72.5 Å²	72.5	45%	0.449	40%	0.398	S	S	.	.			trans	-98.7	-7.7	174.9	-61.5	-35.4	0	0	0	112.8	L154	L154-N156 PolarHBondContact O-N 3.48Å
157	E	51.6	Low	50.5	Low	143 Å²	143	70.3 Å²	70.3	67%	0.668	39%	0.386	S	S	*	.			trans	-129.2	118.7	-168.1	-66.4	-178.7	-173.9	0	0	113.1	A159 S160	E157-A159 PolarHBondContact O-N 3.38Å; E157-S160 PolarHBondContact O-N 2.87Å; E157-S160 PolarHBondContact O-OG 2.6Å
158	T	50.5	Low	51.3	Low	16 Å²	16	71.3 Å²	71.3	10%	0.098	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	35.4	-174.2	50.2	0	0	0	0	114.7	L181 L183 Y184 R637	T158-L181 WeakPolarHBondContact CB-O 3.5Å; T158-L183 HydrophobicContact CG2-CB 3.77Å; T158-L183 HydrophobicContact CG2-CD1 3.9Å; T158-L183 HydrophobicContact CG2-CG 3.86Å; T158-Y184 HydrophobicContact CG2-CD2 3.69Å; T158-Y184 HydrophobicContact CG2-CE2 3.66Å; T158-R637 PolarHBondContact O-NH2 3.32Å
159	A	51.5	Low	52	Low	75 Å²	75	73.3 Å²	73.3	62%	0.62	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.8	3.5	175.5	0	0	0	0	0	113.4	E157	E157-A159 PolarHBondContact O-N 3.38Å
160	S	54.3	Low	52.5	Low	31 Å²	31	72.6 Å²	72.6	22%	0.217	39%	0.391	C	S	.	.			trans	-79.7	124.2	-177.4	50.3	0	0	0	0	111.8	E157	E157-S160 PolarHBondContact O-N 2.87Å; E157-S160 PolarHBondContact O-OG 2.6Å
161	V	60.5	Low	53.1	Low	80 Å²	80	68.4 Å²	68.4	49%	0.485	38%	0.377	S	S	.	.			trans	-85.4	108.2	163.5	178.6	0	0	0	0	107.3	K163 E177 L178	V161-K163 HydrophobicContact CG1-CG 4.2Å; V161-E177 HydrophobicContact CG1-CG 3.87Å; V161-E177 WeakPolarHBondContact CG1-OE1 3.43Å; V161-L178 CarbonylContact C-O 3.47Å; V161-L178 WeakPolarHBondContact CA-O 3.27Å
162	L	64.6	Low	53.5	Low	35 Å²	35	67 Å²	67	18%	0.183	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	108.4	-171.9	-67.1	161.5	0	0	0	109.1	I155 F164 V176 E177 L178	I155-L162 HydrophobicContact CB-CD1 4.42Å; I155-L162 HydrophobicContact CD1-CD1 3.21Å; I155-L162 HydrophobicContact CG1-CD1 3.52Å; I155-L162 HydrophobicContact CG2-CD1 4.05Å; L162-F164 HydrophobicContact CB-CE2 4.09Å; L162-F164 HydrophobicContact CB-CZ 4.12Å; L162-V176 VanDerWaalsContact O-O 3.11Å; L162-E177 WeakPolarHBondContact O-CA 3.36Å; L162-L178 HydrophobicContact CB-CB 4.42Å; L162-L178 HydrophobicContact CD1-CD2 4.16Å; L162-L178 PolarHBondContact N-O 2.8Å; L162-L178 PolarHBondContact O-N 2.87Å
163	K	63.9	Low	54.1	Low	111 Å²	111	65.4 Å²	65.4	48%	0.483	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	91	-179.7	-53.5	-163	-169	-141.1	0	110.4	V161 H165 V176 E177	V161-K163 HydrophobicContact CG1-CG 4.2Å; K163-H165 PolarHBondContact O-ND1 3.27Å; K163-V176 WeakPolarHBondContact CA-O 3.32Å; K163-E177 WeakPolarHBondContact CE-OE1 3.31Å; K163-E177 HydrophobicContact CG-CB 4.33Å; K163-E177 HydrophobicContact CG-CG 4.24Å; K163-E177 VanDerWaalsContact NZ-CD 3.33Å; K163-E177 IonicContact NZ-OE1 2.7Å; K163-E177 PolarHBondContact NZ-OE1 2.86Å; K163-E177 IonicContact NZ-OE2 2.83Å
164	F	64.1	Low	54.6	Low	14 Å²	14	64.8 Å²	64.8	6%	0.061	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	130.5	171.1	-50.7	-76.6	0	0	0	109	Q151 S153 L162 N175 V176 L178 I650 L652	Q151-F164 HydrophobicContact CB-CD1 3.91Å; Q151-F164 HydrophobicContact CB-CE1 4.44Å; Q151-F164 HydrophobicContact CG-CD1 4.48Å; Q151-F164 VanDerWaalsContact OE1-CA 3.25Å; Q151-F164 VanDerWaalsContact OE1-CB 3.31Å; S153-F164 WeakPolarHBondContact OG-CE1 3.14Å; S153-F164 VanDerWaalsContact OG-CZ 3.25Å; S153-F164 WeakPolarHBondContact OG-CZ 3.34Å; L162-F164 HydrophobicContact CB-CE2 4.09Å; L162-F164 HydrophobicContact CB-CZ 4.12Å; F164-N175 CarbonylContact O-C 3.58Å; F164-N175 WeakPolarHBondContact O-CA 3.43Å; F164-V176 HydrophobicContact CB-CB 4.22Å; F164-V176 HydrophobicContact CD2-CB 4.24Å; F164-V176 WeakPolarHBondContact CD2-O 3.46Å; F164-V176 PolarHBondContact N-O 2.79Å; F164-V176 PolarHBondContact O-N 2.84Å; F164-L178 HydrophobicContact CE2-CB 4.38Å; F164-I650 HydrophobicContact CE2-CG2 4.13Å; F164-I650 HydrophobicContact CZ-CB 4.26Å; F164-I650 HydrophobicContact CZ-CD1 4.45Å; F164-I650 HydrophobicContact CZ-CG2 3.83Å; F164-L652 HydrophobicContact CB-CD1 3.41Å; F164-L652 VanDerWaalsContact CB-CD1 3.41Å; F164-L652 HydrophobicContact CD1-CD1 3.64Å; F164-L652 HydrophobicContact CD2-CD1 3.92Å; F164-L652 HydrophobicContact CE1-CD1 4.31Å; F164-L652 HydrophobicContact CG-CD1 3.38Å; F164-L652 HydrophobicContact CG-CG 4.44Å
165	H	61	Low	55.6	Low	93 Å²	93	62.2 Å²	62.2	43%	0.431	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.4	178.5	-67.3	76.3	0	0	0	108.2	Q151 K163 N175	Q151-H165 PolarHBondContact NE2-O 2.75Å; K163-H165 PolarHBondContact O-ND1 3.27Å; H165-N175 PolarHBondContact CD2-OD1 3.25Å
166	S	55.6	Low	56.2	Low	35 Å²	35	62.3 Å²	62.3	25%	0.245	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	108.4	174.4	-179	0	0	0	0	108.5	V174	S166-V174 PolarHBondContact N-O 2.81Å; S166-V174 PolarHBondContact O-N 2.75Å
167	I	51.4	Low	57.2	Low	106 Å²	106	60 Å²	60	54%	0.544	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126.2	170.6	-52.1	178.6	0	0	0	106.5
168	R	47.2	Very low	58.1	Low	99 Å²	99	53.3 Å²	53.3	37%	0.374	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	145.6	170.9	-63.2	-174.9	175.2	-162.1	-4.4	109.2	S170 G171 I172 A496	R168-S170 PolarHBondContact O-N 2.88Å; R168-G171 PolarHBondContact O-N 2.83Å; R168-I172 HydrophobicContact CB-CB 4.4Å; R168-I172 PolarHBondContact N-O 2.83Å; R168-A496 PolarHBondContact NH2-O 3.36Å
169	N	46.4	Very low	59	Low	163 Å²	163	53.2 Å²	53.2	87%	0.872	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-17.6	175.5	-63.6	10.2	0	0	0	113.3	G171	N169-G171 VanDerWaalsContact C-N 3.26Å; N169-G171 PolarHBondContact O-N 2.84Å
170	S	48.7	Very low	59.7	Low	64 Å²	64	53.1 Å²	53.1	45%	0.448	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	18	172.7	70.1	0	0	0	0	115.2	R168 I172 L460	R168-S170 PolarHBondContact O-N 2.88Å; S170-I172 PolarHBondContact O-N 3.39Å; S170-L460 WeakPolarHBondContact O-CD1 3.39Å; S170-L460 WeakPolarHBondContact O-CG 3.23Å
171	G	50.7	Low	60.1	Low	14 Å²	14	51.8 Å²	51.8	14%	0.144	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	17.2	-179.9	0	0	0	0	0	115.6	R168 N169	R168-G171 PolarHBondContact O-N 2.83Å; N169-G171 VanDerWaalsContact C-N 3.26Å; N169-G171 PolarHBondContact O-N 2.84Å
172	I	52.3	Low	60.3	Low	38 Å²	38	49 Å²	49	20%	0.195	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	121.4	174.9	-58.2	171.6	0	0	0	108.6	R168 S170 V174 I455 L457 L460	R168-I172 HydrophobicContact CB-CB 4.4Å; R168-I172 PolarHBondContact N-O 2.83Å; S170-I172 PolarHBondContact O-N 3.39Å; I172-V174 HydrophobicContact CG2-CG2 3.81Å; I172-I455 HydrophobicContact CG2-CG2 3.71Å; I172-L457 HydrophobicContact CG1-CD2 4.3Å; I172-L457 HydrophobicContact CG2-CD2 4.28Å; I172-L460 HydrophobicContact CD1-CD1 4.15Å; I172-L460 HydrophobicContact CG1-CD1 3.54Å
173	H	60	Low	60.2	Low	49 Å²	49	47.8 Å²	47.8	23%	0.227	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	116.6	172.2	-67.9	-110.4	0	0	0	108.9	I455 D456	H173-I455 CarbonylContact O-C 3.5Å; H173-I455 WeakPolarHBondContact O-CA 3.24Å; H173-D456 HydrophobicContact CB-CB 4.09Å; H173-D456 PolarHBondContact N-O 2.65Å; H173-D456 PolarHBondContact O-N 3.41Å
174	V	63	Low	60.3	Low	14 Å²	14	43.1 Å²	43.1	9%	0.085	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	111.6	175.7	-175	0	0	0	0	108.9	S166 I172 V176 F453	S166-V174 PolarHBondContact N-O 2.81Å; S166-V174 PolarHBondContact O-N 2.75Å; I172-V174 HydrophobicContact CG2-CG2 3.81Å; V174-V176 HydrophobicContact CG1-CG2 4.26Å; V174-F453 HydrophobicContact CG1-CD2 4.26Å; V174-F453 HydrophobicContact CG1-CE2 3.51Å; V174-F453 HydrophobicContact CG1-CZ 4.03Å
175	N	67.3	Low	60.4	Low	38 Å²	38	42.8 Å²	42.8	20%	0.203	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.7	177.8	-51.2	-27.8	0	0	0	108.7	F164 H165 S454	F164-N175 CarbonylContact O-C 3.58Å; F164-N175 WeakPolarHBondContact O-CA 3.43Å; H165-N175 PolarHBondContact CD2-OD1 3.25Å; N175-S454 PolarHBondContact N-O 3.27Å; N175-S454 PolarHBondContact O-N 2.84Å
176	V	67	Low	61	Low	7 Å²	7	39.3 Å²	39.3	4%	0.042	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	105.6	177.1	-166.5	0	0	0	0	108	L162 K163 F164 V174 L451 F453 L497	L162-V176 VanDerWaalsContact O-O 3.11Å; K163-V176 WeakPolarHBondContact CA-O 3.32Å; F164-V176 HydrophobicContact CB-CB 4.22Å; F164-V176 HydrophobicContact CD2-CB 4.24Å; F164-V176 WeakPolarHBondContact CD2-O 3.46Å; F164-V176 PolarHBondContact N-O 2.79Å; F164-V176 PolarHBondContact O-N 2.84Å; V174-V176 HydrophobicContact CG1-CG2 4.26Å; V176-L451 HydrophobicContact CG1-CD1 3.61Å; V176-F453 HydrophobicContact CG2-CD2 3.93Å; V176-F453 HydrophobicContact CG2-CE2 4.44Å; V176-L497 HydrophobicContact CG2-CD2 4Å
177	E	70.4	Confident	62.1	Low	36 Å²	36	37.6 Å²	37.6	17%	0.168	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	102.8	179.7	174	165.2	-143.2	0	0	109	V161 L162 K163 K452	V161-E177 HydrophobicContact CG1-CG 3.87Å; V161-E177 WeakPolarHBondContact CG1-OE1 3.43Å; L162-E177 WeakPolarHBondContact O-CA 3.36Å; K163-E177 WeakPolarHBondContact CE-OE1 3.31Å; K163-E177 HydrophobicContact CG-CB 4.33Å; K163-E177 HydrophobicContact CG-CG 4.24Å; K163-E177 VanDerWaalsContact NZ-CD 3.33Å; K163-E177 IonicContact NZ-OE1 2.7Å; K163-E177 PolarHBondContact NZ-OE1 2.86Å; K163-E177 IonicContact NZ-OE2 2.83Å; E177-K452 HydrophobicContact CB-CB 4.2Å; E177-K452 PolarHBondContact N-O 2.87Å; E177-K452 PolarHBondContact O-N 3.37Å; E177-K452 WeakPolarHBondContact OE2-CE 3.25Å; E177-K452 IonicContact OE2-NZ 3.31Å; E177-K452 PolarHBondContact OE2-NZ 3.46Å
178	L	68.8	Low	63.6	Low	1 Å²	1	34.9 Å²	34.9	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	126.7	169.7	-173.2	117.9	0	0	0	109.2	I155 V161 L162 F164 L181 F449 L451 I501 I650	I155-L178 HydrophobicContact CD1-CD2 4.4Å; V161-L178 CarbonylContact C-O 3.47Å; V161-L178 WeakPolarHBondContact CA-O 3.27Å; L162-L178 HydrophobicContact CB-CB 4.42Å; L162-L178 HydrophobicContact CD1-CD2 4.16Å; L162-L178 PolarHBondContact N-O 2.8Å; L162-L178 PolarHBondContact O-N 2.87Å; F164-L178 HydrophobicContact CE2-CB 4.38Å; L178-L181 HydrophobicContact CD2-CB 4.12Å; L178-L181 HydrophobicContact CD2-CD1 4.29Å; L178-L181 HydrophobicContact CD2-CD2 4.01Å; L178-L181 HydrophobicContact CD2-CG 4.36Å; L178-F449 HydrophobicContact CD1-CB 4.26Å; L178-F449 HydrophobicContact CD1-CD2 3.52Å; L178-F449 HydrophobicContact CD1-CE2 4.15Å; L178-F449 HydrophobicContact CD1-CG 4.12Å; L178-F449 HydrophobicContact CG-CD2 4.47Å; L178-L451 HydrophobicContact CD1-CD1 4.08Å; L178-I501 HydrophobicContact CD1-CD1 3.87Å; L178-I650 HydrophobicContact CD1-CD1 3.72Å; L178-I650 HydrophobicContact CD2-CD1 3.67Å; L178-I650 HydrophobicContact CG-CD1 4.22Å
179	S	70.4	Confident	65.3	Low	14 Å²	14	30.4 Å²	30.4	10%	0.098	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	169.9	-173.6	61.9	0	0	0	0	111.1	L181 R450	S179-L181 PolarHBondContact O-N 2.77Å; S179-R450 PolarHBondContact N-O 2.81Å; S179-R450 PolarHBondContact O-N 3.3Å; S179-R450 WeakPolarHBondContact OG-CB 3.49Å; S179-R450 WeakPolarHBondContact OG-CG 3.31Å; S179-R450 PolarHBondContact OG-O 3.49Å
180	E	65.7	Low	66.7	Low	73 Å²	73	24.3 Å²	24.3	34%	0.341	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.7	31.4	175.6	-57.4	-179	-148.3	0	0	114.9	N182 R450	E180-N182 PolarHBondContact O-N 2.84Å; E180-N182 PolarHBondContact O-ND2 2.9Å; E180-R450 HydrophobicContact CB-CB 4.02Å; E180-R450 HydrophobicContact CG-CB 4.33Å; E180-R450 WeakPolarHBondContact OE1-CD 3.45Å; E180-R450 IonicContact OE1-CZ 3.13Å; E180-R450 IonicContact OE1-NE 3.66Å; E180-R450 IonicContact OE1-NH1 2.69Å; E180-R450 PolarHBondContact OE1-NH1 3.4Å
181	L	64.1	Low	67.9	Low	3 Å²	3	25.5 Å²	25.5	2%	0.016	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	93.1	-176	-178	65.4	0	0	0	112.5	I155 T158 L178 S179 L183 G448 F449 F484 A648	I155-L181 HydrophobicContact CB-CD2 4.33Å; I155-L181 HydrophobicContact CD1-CD2 3.66Å; I155-L181 HydrophobicContact CG2-CD2 3.81Å; T158-L181 WeakPolarHBondContact CB-O 3.5Å; L178-L181 HydrophobicContact CD2-CB 4.12Å; L178-L181 HydrophobicContact CD2-CD1 4.29Å; L178-L181 HydrophobicContact CD2-CD2 4.01Å; L178-L181 HydrophobicContact CD2-CG 4.36Å; S179-L181 PolarHBondContact O-N 2.77Å; L181-L183 HydrophobicContact CD1-CD2 3.86Å; L181-L183 HydrophobicContact CD1-CG 4.29Å; L181-L183 HydrophobicContact CD2-CD1 4.44Å; L181-L183 HydrophobicContact CD2-CG 4.44Å; L181-L183 HydrophobicContact CG-CD2 4.2Å; L181-L183 HydrophobicContact CG-CG 4.08Å; L181-G448 CarbonylContact C-O 3.56Å; L181-F449 HydrophobicContact CD1-CB 3.8Å; L181-F484 HydrophobicContact CD1-CE2 3.88Å; L181-F484 HydrophobicContact CD1-CZ 3.82Å; L181-A648 HydrophobicContact CD2-CB 4.48Å
182	N	64.5	Low	68.7	Low	23 Å²	23	26.7 Å²	26.7	12%	0.123	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	87.6	177.8	-70.8	-55.4	0	0	0	110.7	E180 Y184 R447 G448 R637	E180-N182 PolarHBondContact O-N 2.84Å; E180-N182 PolarHBondContact O-ND2 2.9Å; N182-Y184 VanDerWaalsContact C-N 3.33Å; N182-R447 CarbonylContact O-C 3.56Å; N182-R447 WeakPolarHBondContact O-CA 3.5Å; N182-R447 WeakPolarHBondContact O-CB 3.28Å; N182-G448 PolarHBondContact N-O 2.89Å; N182-G448 PolarHBondContact O-N 3.45Å; N182-R637 PolarHBondContact OD1-NE 2.89Å; N182-R637 PolarHBondContact OD1-NH2 3.37Å
183	L	62.7	Low	69.3	Low	9 Å²	9	29.8 Å²	29.8	5%	0.047	15%	0.151	C	C	.	.			trans	-75.1	-23.7	173.3	-58.6	174	0	0	0	112.9	T158 L181 R447 F484 V503 P646 A648	T158-L183 HydrophobicContact CG2-CB 3.77Å; T158-L183 HydrophobicContact CG2-CD1 3.9Å; T158-L183 HydrophobicContact CG2-CG 3.86Å; L181-L183 HydrophobicContact CD1-CD2 3.86Å; L181-L183 HydrophobicContact CD1-CG 4.29Å; L181-L183 HydrophobicContact CD2-CD1 4.44Å; L181-L183 HydrophobicContact CD2-CG 4.44Å; L181-L183 HydrophobicContact CG-CD2 4.2Å; L181-L183 HydrophobicContact CG-CG 4.08Å; L183-R447 WeakPolarHBondContact O-CD 3.14Å; L183-R447 PolarHBondContact O-NE 3.4Å; L183-F484 HydrophobicContact CD2-CE2 3.83Å; L183-F484 HydrophobicContact CD2-CZ 4.08Å; L183-V503 HydrophobicContact CD2-CG1 4.42Å; L183-V503 HydrophobicContact CD2-CG2 4.4Å; L183-P646 HydrophobicContact CB-CG 4.07Å; L183-A648 HydrophobicContact CD1-CB 4.1Å; L183-A648 HydrophobicContact CD2-CB 4.08Å
184	Y	64.7	Low	69.2	Low	12 Å²	12	27.8 Å²	27.8	5%	0.047	14%	0.144	C	C	.	.	S	Bend	trans	-103.4	145.2	-177.3	-57.9	-63	0	0	0	111.6	T158 N182 R637 N639 P646	T158-Y184 HydrophobicContact CG2-CD2 3.69Å; T158-Y184 HydrophobicContact CG2-CE2 3.66Å; N182-Y184 VanDerWaalsContact C-N 3.33Å; Y184-R637 HydrophobicContact CD2-CB 4.27Å; Y184-R637 HydrophobicContact CG-CB 4.41Å; Y184-N639 HydrophobicContact CD1-CB 4.15Å; Y184-N639 HydrophobicContact CE1-CB 3.64Å; Y184-N639 WeakPolarHBondContact CE1-OD1 3.39Å; Y184-P646 HydrophobicContact CD1-CG 4.34Å; Y184-P646 HydrophobicContact CE1-CG 3.64Å
185	P	66.4	Low	69.2	Low	8 Å²	8	27.7 Å²	27.7	5%	0.052	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-62.7	137.4	167.4	29.3	-33.9	0	0	0	110.2	Y187	P185-Y187 HydrophobicContact CB-CE2 3.98Å; P185-Y187 HydrophobicContact CG-CE2 3.83Å
186	I	72.6	Confident	69.5	Low	19 Å²	19	26.6 Å²	26.6	10%	0.097	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.6	175.8	-60.9	169.6	0	0	0	108.8	T443 A610 R635 F636 R637	I186-T443 HydrophobicContact CG2-CG2 4.09Å; I186-T443 WeakPolarHBondContact O-CB 3.25Å; I186-T443 WeakPolarHBondContact O-CG2 3.37Å; I186-T443 PolarHBondContact O-N 3.37Å; I186-T443 PolarHBondContact O-OG1 3.27Å; I186-A610 HydrophobicContact CG2-CB 4.03Å; I186-R635 HydrophobicContact CG2-CB 4.42Å; I186-F636 WeakPolarHBondContact CA-O 3.4Å; I186-R637 HydrophobicContact CG1-CG 4.06Å
187	Y	79.8	Confident	69.6	Low	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	145.6	174.5	-71.3	-99.5	0	0	0	110.3	P185 L440 K441 Q442 F511 F514 V517 R635 F636 L638	P185-Y187 HydrophobicContact CB-CE2 3.98Å; P185-Y187 HydrophobicContact CG-CE2 3.83Å; Y187-L440 HydrophobicContact CD1-CB 4.3Å; Y187-K441 CarbonylContact C-O 3.6Å; Y187-K441 WeakPolarHBondContact CA-O 3.12Å; Y187-Q442 HydrophobicContact CD1-CB 4.09Å; Y187-Q442 HydrophobicContact CE1-CB 3.82Å; Y187-Q442 HydrophobicContact CE1-CG 4.4Å; Y187-F511 PolarHBondContact OH-O 3.31Å; Y187-F514 PolarHBondContact OH-O 2.79Å; Y187-V517 HydrophobicContact CD1-CG2 3.56Å; Y187-V517 HydrophobicContact CE1-CB 4.3Å; Y187-V517 HydrophobicContact CE1-CG1 3.84Å; Y187-V517 HydrophobicContact CE1-CG2 3.51Å; Y187-V517 HydrophobicContact CG-CG2 4.37Å; Y187-R635 CarbonylContact O-C 3.51Å; Y187-R635 WeakPolarHBondContact O-CA 3.43Å; Y187-F636 PolarHBondContact N-O 2.95Å; Y187-F636 PolarHBondContact O-N 2.71Å; Y187-L638 HydrophobicContact CD2-CB 4.45Å; Y187-L638 HydrophobicContact CD2-CD1 3.56Å; Y187-L638 HydrophobicContact CD2-CG 3.85Å; Y187-L638 HydrophobicContact CE2-CB 4.46Å; Y187-L638 HydrophobicContact CE2-CD1 3.73Å; Y187-L638 HydrophobicContact CE2-CG 4.23Å; Y187-L638 HydrophobicContact CG-CD1 4Å
188	E	83.2	Confident	69.7	Low	48 Å²	48	29.6 Å²	29.6	22%	0.224	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	152.1	176.2	71.1	-168.5	167.5	0	0	111.6	L440 K441 T443 L633 H634 R635	E188-L440 CarbonylContact O-C 3.58Å; E188-L440 VanDerWaalsContact O-CA 3.27Å; E188-L440 WeakPolarHBondContact O-CA 3.43Å; E188-K441 PolarHBondContact N-O 2.86Å; E188-K441 PolarHBondContact O-N 2.7Å; E188-T443 HydrophobicContact CB-CG2 3.81Å; E188-T443 HydrophobicContact CG-CG2 3.74Å; E188-L633 HydrophobicContact CB-CD1 4.37Å; E188-H634 WeakPolarHBondContact CA-O 3.28Å; E188-R635 HydrophobicContact CB-CG 3.92Å; E188-R635 IonicContact OE2-CZ 2.8Å; E188-R635 IonicContact OE2-NE 3.92Å; E188-R635 PolarHBondContact OE2-NE 3.41Å; E188-R635 IonicContact OE2-NH2 3.55Å; E188-R635 PolarHBondContact OE2-NH2 3.26Å
189	D	81.8	Confident	69.9	Low	6 Å²	6	29.7 Å²	29.7	3%	0.032	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	139.7	-177.8	75	-36	0	0	0	113.1	C223 R224 L440 H634	D189-C223 HydrophobicContact CB-CB 3.95Å; D189-R224 PolarHBondContact O-NH2 2.76Å; D189-R224 IonicContact OD1-CZ 3.59Å; D189-R224 IonicContact OD1-NE 2.72Å; D189-R224 PolarHBondContact OD1-NE 2.84Å; D189-R224 VanDerWaalsContact OD1-NE 3.17Å; D189-R224 IonicContact OD1-NH2 3.53Å; D189-R224 PolarHBondContact OD1-NH2 3.3Å; D189-R224 WeakPolarHBondContact OD2-CB 3.28Å; D189-R224 WeakPolarHBondContact OD2-CG 3.43Å; D189-R224 IonicContact OD2-CZ 3.76Å; D189-R224 PolarHBondContact OD2-N 3.4Å; D189-R224 IonicContact OD2-NE 3.63Å; D189-R224 PolarHBondContact OD2-NE 3.2Å; D189-R224 IonicContact OD2-NH2 2.66Å; D189-L440 HydrophobicContact CB-CD2 3.88Å; D189-H634 HydrophobicContact CB-CB 4.26Å; D189-H634 PolarHBondContact N-O 3.23Å; D189-H634 VanDerWaalsContact N-O 3.09Å; D189-H634 PolarHBondContact OD1-N 2.92Å; D189-H634 IonicContact OD2-CD2 2.77Å
190	I	77.4	Confident	70.2	Confident	35 Å²	35	30.3 Å²	30.3	18%	0.179	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-83.9	137.9	-178.7	-69	162.6	0	0	0	110.4	Y192 H439 K441	I190-Y192 HydrophobicContact CB-CE2 4.29Å; I190-Y192 HydrophobicContact CG2-CD1 4.28Å; I190-Y192 HydrophobicContact CG2-CE1 3.61Å; I190-Y192 HydrophobicContact CG2-CE2 4.09Å; I190-Y192 VanDerWaalsContact CG2-CZ 3.49Å; I190-H439 HydrophobicContact CD1-CB 4.29Å; I190-H439 WeakPolarHBondContact CD1-ND1 3.31Å; I190-H439 PolarHBondContact N-O 3.37Å; I190-H439 VanDerWaalsContact N-O 3.13Å; I190-K441 HydrophobicContact CD1-CB 3.94Å; I190-K441 HydrophobicContact CG1-CB 3.87Å
191	N	72.8	Confident	70.8	Confident	89 Å²	89	33.3 Å²	33.3	48%	0.476	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-77.7	138.2	175.9	-165.6	62.2	0	0	0	111.2	Y225	N191-Y225 WeakPolarHBondContact OD1-CE2 3.03Å
192	Y	67.7	Low	71.3	Confident	38 Å²	38	33.9 Å²	33.9	15%	0.149	18%	0.182	C	C	.	.			trans	-140.3	148.3	176.2	-63	-60.3	0	0	0	112.2	I190 Y225 L227 H439 H569	I190-Y192 HydrophobicContact CB-CE2 4.29Å; I190-Y192 HydrophobicContact CG2-CD1 4.28Å; I190-Y192 HydrophobicContact CG2-CE1 3.61Å; I190-Y192 HydrophobicContact CG2-CE2 4.09Å; I190-Y192 VanDerWaalsContact CG2-CZ 3.49Å; Y192-Y225 HydrophobicContact CD2-CG 4.42Å; Y192-Y225 WeakPolarHBondContact O-CD1 3.46Å; Y192-Y225 WeakPolarHBondContact O-CE1 3.46Å; Y192-Y225 VanDerWaalsContact O-CZ 3.25Å; Y192-L227 HydrophobicContact CE2-CD2 4.06Å; Y192-H439 HydrophobicContact CE2-CB 4.1Å; Y192-H439 WeakPolarHBondContact OH-CB 3.47Å; Y192-H439 VanDerWaalsContact OH-CG 3.28Å; Y192-H439 PolarHBondContact OH-ND1 2.82Å; Y192-H569 HydrophobicContact CE1-CB 3.7Å; Y192-H569 HydrophobicContact CE2-CB 4.27Å; Y192-H569 VanDerWaalsContact CZ-CB 3.49Å; Y192-H569 VanDerWaalsContact OH-CB 3.23Å; Y192-H569 WeakPolarHBondContact OH-CB 3.34Å
193	D	64.3	Low	71.8	Confident	103 Å²	103	36.3 Å²	36.3	55%	0.551	20%	0.2	S	C	*	.	S	Bend	trans	-91.4	123.4	-179.7	-51.2	-53.6	0	0	0	111.9	S572 I574	D193-S572 WeakPolarHBondContact O-CB 3.19Å; D193-S572 PolarHBondContact O-OG 2.86Å; D193-S572 VanDerWaalsContact O-OG 3.08Å; D193-I574 HydrophobicContact CB-CD1 4.34Å
194	G	57.8	Low	72.2	Confident	8 Å²	8	41 Å²	41	8%	0.082	23%	0.231	C	C	.	.	S	Bend	trans	94.2	-4	151.1	0	0	0	0	0	120.6	D197 S573 I574	G194-D197 WeakPolarHBondContact CA-OD2 3.21Å; G194-S573 PolarHBondContact O-OG 2.89Å; G194-I574 VanDerWaalsContact CA-CD1 3.46Å
195	V	64.3	Low	72.3	Confident	12 Å²	12	44 Å²	44	7%	0.073	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-38.5	-174.8	-173.3	0	0	0	0	112.8	D197 P427 F429	V195-D197 VanDerWaalsContact C-N 3.34Å; V195-D197 PolarHBondContact O-N 2.79Å; V195-P427 HydrophobicContact CG1-CB 4.12Å; V195-P427 HydrophobicContact CG1-CG 4.21Å; V195-F429 HydrophobicContact CG1-CZ 4.07Å
196	N	72.4	Confident	72.4	Confident	14 Å²	14	46 Å²	46	8%	0.075	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-35.4	-176.4	-71.2	-8.6	0	0	0	112.4	V198 I199 L200 L215 R224	N196-V198 VanDerWaalsContact C-N 3.26Å; N196-V198 PolarHBondContact O-N 3.41Å; N196-I199 PolarHBondContact O-N 2.93Å; N196-L200 HydrophobicContact CB-CD1 4.02Å; N196-L200 HydrophobicContact CB-CG 4.41Å; N196-L200 WeakPolarHBondContact O-CG 3.28Å; N196-L200 PolarHBondContact O-N 3.44Å; N196-L215 HydrophobicContact CB-CD2 4.23Å; N196-R224 PolarHBondContact ND2-O 2.84Å
197	D	70.4	Confident	72.3	Confident	78 Å²	78	49.6 Å²	49.6	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-64.2	-32.1	-167.4	-48.9	-40.5	0	0	0	112.4	G194 V195 I199 L200 N201	G194-D197 WeakPolarHBondContact CA-OD2 3.21Å; V195-D197 VanDerWaalsContact C-N 3.34Å; V195-D197 PolarHBondContact O-N 2.79Å; D197-I199 PolarHBondContact O-N 2.99Å; D197-L200 PolarHBondContact O-N 2.89Å; D197-N201 VanDerWaalsContact O-CB 3.24Å; D197-N201 WeakPolarHBondContact O-CB 3.49Å; D197-N201 PolarHBondContact O-N 2.86Å
198	V	71.2	Confident	72	Confident	29 Å²	29	50.5 Å²	50.5	18%	0.176	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-29.4	174.7	-174.4	0	0	0	0	112	N196 N301	N196-V198 VanDerWaalsContact C-N 3.26Å; N196-V198 PolarHBondContact O-N 3.41Å; V198-N301 HydrophobicContact CG1-CB 4.11Å; V198-N301 HydrophobicContact CG2-CB 4.13Å
199	I	74.5	Confident	71.8	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-95.2	-37.1	177.9	-72.3	172.2	0	0	0	111.6	N196 D197 N201 A202 A208 L211 K212 L215 F429	N196-I199 PolarHBondContact O-N 2.93Å; D197-I199 PolarHBondContact O-N 2.99Å; I199-N201 VanDerWaalsContact C-N 3.35Å; I199-A202 VanDerWaalsContact O-CB 3.31Å; I199-A202 WeakPolarHBondContact O-CB 3.4Å; I199-A202 PolarHBondContact O-N 3.08Å; I199-A208 HydrophobicContact CG1-CB 4.15Å; I199-L211 HydrophobicContact CD1-CB 4.13Å; I199-L211 HydrophobicContact CD1-CD1 3.91Å; I199-L211 HydrophobicContact CG2-CB 4.03Å; I199-K212 HydrophobicContact CG2-CB 4.18Å; I199-L215 HydrophobicContact CB-CD2 3.93Å; I199-L215 HydrophobicContact CG2-CB 4.28Å; I199-L215 HydrophobicContact CG2-CD2 3.61Å; I199-F429 HydrophobicContact CD1-CD2 3.54Å; I199-F429 HydrophobicContact CD1-CE2 3.39Å; I199-F429 HydrophobicContact CD1-CZ 4.45Å
200	L	77	Confident	71.6	Confident	27 Å²	27	58.3 Å²	58.3	14%	0.141	33%	0.328	C	S	.	.	H	α-helix	trans	-67	-36.6	177.4	-65.6	177.2	0	0	0	111.7	N196 D197 K212 L215 L216	N196-L200 HydrophobicContact CB-CD1 4.02Å; N196-L200 HydrophobicContact CB-CG 4.41Å; N196-L200 WeakPolarHBondContact O-CG 3.28Å; N196-L200 PolarHBondContact O-N 3.44Å; D197-L200 PolarHBondContact O-N 2.89Å; L200-K212 HydrophobicContact CD2-CG 4.3Å; L200-K212 VanDerWaalsContact O-CE 3.27Å; L200-K212 WeakPolarHBondContact O-CE 3.23Å; L200-K212 PolarHBondContact O-NZ 3.17Å; L200-L215 HydrophobicContact CD2-CD2 4.21Å; L200-L215 HydrophobicContact CG-CD2 4.31Å; L200-L216 HydrophobicContact CD2-CD2 3.9Å; L200-L216 HydrophobicContact CD2-CG 4.18Å
201	N	77.1	Confident	71.7	Confident	136 Å²	136	56.8 Å²	56.8	73%	0.727	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	7.2	179	-59.1	-21.6	0	0	0	113.3	D197 I199	D197-N201 VanDerWaalsContact O-CB 3.24Å; D197-N201 WeakPolarHBondContact O-CB 3.49Å; D197-N201 PolarHBondContact O-N 2.86Å; I199-N201 VanDerWaalsContact C-N 3.35Å
202	A	73.9	Confident	72.1	Confident	16 Å²	16	55.8 Å²	55.8	13%	0.132	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-63.9	135.7	-179.4	0	0	0	0	0	112.4	I199 A208 F209	I199-A202 VanDerWaalsContact O-CB 3.31Å; I199-A202 WeakPolarHBondContact O-CB 3.4Å; I199-A202 PolarHBondContact O-N 3.08Å; A202-A208 HydrophobicContact CB-CB 3.52Å; A202-F209 HydrophobicContact CB-CB 4.2Å; A202-F209 WeakPolarHBondContact O-CD2 3.28Å
203	S	74.9	Confident	72.8	Confident	73 Å²	73	60.8 Å²	60.8	51%	0.51	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-74.7	145.2	-179.8	53	0	0	0	0	112.5	G205 T206 F209	S203-G205 PolarHBondContact O-N 3.31Å; S203-T206 WeakPolarHBondContact O-CB 3.24Å; S203-T206 WeakPolarHBondContact O-CG2 3.49Å; S203-T206 PolarHBondContact O-N 3.09Å; S203-T206 PolarHBondContact O-OG1 3.15Å; S203-T206 VanDerWaalsContact OG-CG2 3.31Å; S203-T206 WeakPolarHBondContact OG-CG2 3.34Å; S203-F209 WeakPolarHBondContact O-CB 3.33Å
204	P	72.5	Confident	73.6	Confident	108 Å²	108	57.9 Å²	57.9	70%	0.701	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	132.9	178.5	-27.2	35.1	0	0	0	112.9	F209	P204-F209 HydrophobicContact CB-CD2 4.48Å; P204-F209 HydrophobicContact CB-CE1 4.36Å; P204-F209 HydrophobicContact CB-CE2 4.25Å; P204-F209 HydrophobicContact CB-CZ 4.19Å; P204-F209 HydrophobicContact CG-CD2 4.3Å; P204-F209 HydrophobicContact CG-CE2 3.9Å; P204-F209 HydrophobicContact CG-CZ 4.19Å
205	G	65.7	Low	74.9	Confident	74 Å²	74	57.6 Å²	57.6	76%	0.763	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.2	-18	-177.3	0	0	0	0	0	114.8	S203	S203-G205 PolarHBondContact O-N 3.31Å
206	T	69.3	Low	75.7	Confident	51 Å²	51	58.2 Å²	58.2	31%	0.313	32%	0.322	S	S	.	.	S	Bend	trans	-70.4	158.9	172.3	61.7	0	0	0	0	112.4	S203 A208 F209	S203-T206 WeakPolarHBondContact O-CB 3.24Å; S203-T206 WeakPolarHBondContact O-CG2 3.49Å; S203-T206 PolarHBondContact O-N 3.09Å; S203-T206 PolarHBondContact O-OG1 3.15Å; S203-T206 VanDerWaalsContact OG-CG2 3.31Å; S203-T206 WeakPolarHBondContact OG-CG2 3.34Å; T206-A208 VanDerWaalsContact C-N 3.33Å; T206-F209 PolarHBondContact O-N 3.42Å; T206-F209 WeakPolarHBondContact OG1-CB 3.36Å; T206-F209 PolarHBondContact OG1-N 3.14Å; T206-F209 VanDerWaalsContact OG1-N 3.16Å
207	Y	69.7	Low	76.1	Confident	94 Å²	94	62 Å²	62	37%	0.369	34%	0.339	S	S	.	.	H	α-helix	trans	-59.6	-44	171.3	176	-111.1	0	0	0	111.7	F209 R210 L211 H432	Y207-F209 VanDerWaalsContact C-N 3.31Å; Y207-F209 PolarHBondContact O-N 3.04Å; Y207-R210 WeakPolarHBondContact O-CB 3.48Å; Y207-R210 PolarHBondContact O-N 3.05Å; Y207-L211 HydrophobicContact CD1-CD1 4.3Å; Y207-L211 HydrophobicContact CE1-CD1 3.69Å; Y207-L211 HydrophobicContact CE1-CG 4.25Å; Y207-L211 PolarHBondContact O-N 2.64Å; Y207-H432 AromaticContact CE2-NE2 3.34Å; Y207-H432 VanDerWaalsContact CE2-NE2 3.34Å; Y207-H432 WeakPolarHBondContact CE2-NE2 3.31Å; Y207-H432 AromaticContact CZ-NE2 3.62Å; Y207-H432 PolarHBondContact OH-CD2 3.35Å; Y207-H432 PolarHBondContact OH-NE2 2.97Å; Y207-H432 VanDerWaalsContact OH-NE2 3.09Å
208	A	73.6	Confident	76.7	Confident	20 Å²	20	58.5 Å²	58.5	17%	0.165	32%	0.321	C	S	.	.	H	α-helix	trans	-57.9	-39.1	177.3	0	0	0	0	0	112.7	I199 A202 T206 R210 L211 K212	I199-A208 HydrophobicContact CG1-CB 4.15Å; A202-A208 HydrophobicContact CB-CB 3.52Å; T206-A208 VanDerWaalsContact C-N 3.33Å; A208-R210 VanDerWaalsContact C-N 3.26Å; A208-R210 PolarHBondContact O-N 3.26Å; A208-L211 WeakPolarHBondContact O-CA 3.33Å; A208-L211 WeakPolarHBondContact O-CB 3.49Å; A208-L211 PolarHBondContact O-N 2.99Å; A208-K212 PolarHBondContact O-N 2.85Å
209	F	78.7	Confident	77.2	Confident	86 Å²	86	57.7 Å²	57.7	38%	0.377	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-31.6	175.1	-177.9	-94.5	0	0	0	113.2	A202 S203 P204 T206 Y207 L211 K212	A202-F209 HydrophobicContact CB-CB 4.2Å; A202-F209 WeakPolarHBondContact O-CD2 3.28Å; S203-F209 WeakPolarHBondContact O-CB 3.33Å; P204-F209 HydrophobicContact CB-CD2 4.48Å; P204-F209 HydrophobicContact CB-CE1 4.36Å; P204-F209 HydrophobicContact CB-CE2 4.25Å; P204-F209 HydrophobicContact CB-CZ 4.19Å; P204-F209 HydrophobicContact CG-CD2 4.3Å; P204-F209 HydrophobicContact CG-CE2 3.9Å; P204-F209 HydrophobicContact CG-CZ 4.19Å; T206-F209 PolarHBondContact O-N 3.42Å; T206-F209 WeakPolarHBondContact OG1-CB 3.36Å; T206-F209 PolarHBondContact OG1-N 3.14Å; T206-F209 VanDerWaalsContact OG1-N 3.16Å; Y207-F209 VanDerWaalsContact C-N 3.31Å; Y207-F209 PolarHBondContact O-N 3.04Å; F209-L211 VanDerWaalsContact C-N 3.28Å; F209-L211 PolarHBondContact O-N 3.46Å; F209-K212 WeakPolarHBondContact O-CB 3.36Å; F209-K212 PolarHBondContact O-N 2.87Å
210	R	78.1	Confident	77.5	Confident	132 Å²	132	61.8 Å²	61.8	50%	0.498	34%	0.339	S	S	.	.	H	α-helix	trans	-67.4	-28.7	172.9	-62.5	-176.4	173.5	-171.1	-2.6	112.5	Y207 A208 P214	Y207-R210 WeakPolarHBondContact O-CB 3.48Å; Y207-R210 PolarHBondContact O-N 3.05Å; A208-R210 VanDerWaalsContact C-N 3.26Å; A208-R210 PolarHBondContact O-N 3.26Å; R210-P214 WeakPolarHBondContact O-CD 3.36Å
211	L	79.4	Confident	77.6	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-79.4	-19.6	176.5	-59.6	178.6	0	0	0	113.2	I199 Y207 A208 F209 Q213 P214 L215 F429 F431	I199-L211 HydrophobicContact CD1-CB 4.13Å; I199-L211 HydrophobicContact CD1-CD1 3.91Å; I199-L211 HydrophobicContact CG2-CB 4.03Å; Y207-L211 HydrophobicContact CD1-CD1 4.3Å; Y207-L211 HydrophobicContact CE1-CD1 3.69Å; Y207-L211 HydrophobicContact CE1-CG 4.25Å; Y207-L211 PolarHBondContact O-N 2.64Å; A208-L211 WeakPolarHBondContact O-CA 3.33Å; A208-L211 WeakPolarHBondContact O-CB 3.49Å; A208-L211 PolarHBondContact O-N 2.99Å; F209-L211 VanDerWaalsContact C-N 3.28Å; F209-L211 PolarHBondContact O-N 3.46Å; L211-Q213 VanDerWaalsContact C-N 3.34Å; L211-Q213 PolarHBondContact O-N 2.77Å; L211-P214 WeakPolarHBondContact O-CD 3.15Å; L211-L215 VanDerWaalsContact O-CB 3.23Å; L211-L215 WeakPolarHBondContact O-CB 3.26Å; L211-L215 PolarHBondContact O-N 3.3Å; L211-F429 HydrophobicContact CD1-CB 4.3Å; L211-F429 HydrophobicContact CD1-CD2 4.18Å; L211-F431 HydrophobicContact CB-CD2 4.43Å; L211-F431 HydrophobicContact CD2-CD2 3.97Å
212	K	82.4	Confident	77.8	Confident	68 Å²	68	60 Å²	60	30%	0.296	33%	0.325	S	S	.	.	H	α-helix	trans	-55.2	-42.7	-177	-174.6	168	178.8	171.1	0	113.3	I199 L200 A208 F209 L216	I199-K212 HydrophobicContact CG2-CB 4.18Å; L200-K212 HydrophobicContact CD2-CG 4.3Å; L200-K212 VanDerWaalsContact O-CE 3.27Å; L200-K212 WeakPolarHBondContact O-CE 3.23Å; L200-K212 PolarHBondContact O-NZ 3.17Å; A208-K212 PolarHBondContact O-N 2.85Å; F209-K212 WeakPolarHBondContact O-CB 3.36Å; F209-K212 PolarHBondContact O-N 2.87Å; K212-L216 HydrophobicContact CG-CD1 4.14Å; K212-L216 WeakPolarHBondContact O-CB 3.32Å; K212-L216 WeakPolarHBondContact O-CD1 3.5Å; K212-L216 WeakPolarHBondContact O-CG 3.4Å; K212-L216 PolarHBondContact O-N 2.77Å
213	Q	80.9	Confident	78.2	Confident	144 Å²	144	59.3 Å²	59.3	67%	0.673	32%	0.319	S	S	*	.	H	α-helix	trans	-70.9	-50.4	179.4	-73.6	-69.5	-23.9	0	0	113.2	L211 L215 L216 Q217	L211-Q213 VanDerWaalsContact C-N 3.34Å; L211-Q213 PolarHBondContact O-N 2.77Å; Q213-L215 VanDerWaalsContact C-N 3.34Å; Q213-L215 PolarHBondContact O-N 2.79Å; Q213-L216 PolarHBondContact O-N 2.91Å; Q213-Q217 PolarHBondContact O-N 3.17Å
214	P	82.1	Confident	78.5	Confident	41 Å²	41	57.2 Å²	57.2	27%	0.266	30%	0.3	S	S	.	.	H	α-helix	trans	-57.4	-40.8	170.9	-27.5	34.4	0	0	0	114.2	R210 L211 L216 Q217 I218 F431	R210-P214 WeakPolarHBondContact O-CD 3.36Å; L211-P214 WeakPolarHBondContact O-CD 3.15Å; P214-L216 PolarHBondContact O-N 3Å; P214-Q217 PolarHBondContact O-N 3.27Å; P214-I218 WeakPolarHBondContact O-CD1 3.44Å; P214-I218 WeakPolarHBondContact O-CG1 3.36Å; P214-I218 PolarHBondContact O-N 3.48Å; P214-F431 HydrophobicContact CB-CB 3.82Å; P214-F431 HydrophobicContact CB-CD2 3.7Å; P214-F431 HydrophobicContact CB-CG 3.95Å; P214-F431 HydrophobicContact CG-CB 4.48Å
215	L	84.2	Confident	78.9	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-58.7	-48.8	177.1	-173	76.3	0	0	0	110.6	N196 I199 L200 L211 Q213 Q217 I218 A219 P226 F431	N196-L215 HydrophobicContact CB-CD2 4.23Å; I199-L215 HydrophobicContact CB-CD2 3.93Å; I199-L215 HydrophobicContact CG2-CB 4.28Å; I199-L215 HydrophobicContact CG2-CD2 3.61Å; L200-L215 HydrophobicContact CD2-CD2 4.21Å; L200-L215 HydrophobicContact CG-CD2 4.31Å; L211-L215 VanDerWaalsContact O-CB 3.23Å; L211-L215 WeakPolarHBondContact O-CB 3.26Å; L211-L215 PolarHBondContact O-N 3.3Å; Q213-L215 VanDerWaalsContact C-N 3.34Å; Q213-L215 PolarHBondContact O-N 2.79Å; L215-Q217 VanDerWaalsContact C-N 3.35Å; L215-Q217 PolarHBondContact O-N 3.38Å; L215-I218 PolarHBondContact O-N 2.83Å; L215-A219 VanDerWaalsContact O-CB 3.24Å; L215-A219 WeakPolarHBondContact O-CB 3.24Å; L215-A219 PolarHBondContact O-N 3.48Å; L215-P226 HydrophobicContact CD1-CB 4.37Å; L215-P226 HydrophobicContact CD1-CG 3.89Å; L215-F431 HydrophobicContact CB-CE2 4.03Å; L215-F431 HydrophobicContact CD1-CE2 3.9Å; L215-F431 HydrophobicContact CD1-CZ 3.85Å
216	L	82.2	Confident	79.7	Confident	25 Å²	25	51 Å²	51	13%	0.131	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-38.6	177.1	-73.4	169.7	0	0	0	112.7	L200 K212 Q213 P214 I218 N220 Y629	L200-L216 HydrophobicContact CD2-CD2 3.9Å; L200-L216 HydrophobicContact CD2-CG 4.18Å; K212-L216 HydrophobicContact CG-CD1 4.14Å; K212-L216 WeakPolarHBondContact O-CB 3.32Å; K212-L216 WeakPolarHBondContact O-CD1 3.5Å; K212-L216 WeakPolarHBondContact O-CG 3.4Å; K212-L216 PolarHBondContact O-N 2.77Å; Q213-L216 PolarHBondContact O-N 2.91Å; P214-L216 PolarHBondContact O-N 3Å; L216-I218 PolarHBondContact O-N 3.45Å; L216-N220 WeakPolarHBondContact O-CB 3.11Å; L216-N220 PolarHBondContact O-N 3.3Å; L216-N220 VanDerWaalsContact O-N 3.1Å; L216-N220 PolarHBondContact O-ND2 2.83Å; L216-Y629 HydrophobicContact CD2-CD1 4.46Å; L216-Y629 HydrophobicContact CD2-CE1 3.45Å; L216-Y629 VanDerWaalsContact CD2-CE1 3.45Å; L216-Y629 VanDerWaalsContact CD2-OH 3.27Å; L216-Y629 WeakPolarHBondContact CD2-OH 3.43Å
217	Q	81.1	Confident	80.3	Confident	94 Å²	94	48.9 Å²	48.9	44%	0.439	23%	0.227	S	C	.	.	H	α-helix	trans	-61.9	-43.7	175.2	-176.7	176.7	1.2	0	0	111.7	Q213 P214 L215 Q221	Q213-Q217 PolarHBondContact O-N 3.17Å; P214-Q217 PolarHBondContact O-N 3.27Å; L215-Q217 VanDerWaalsContact C-N 3.35Å; L215-Q217 PolarHBondContact O-N 3.38Å; Q217-Q221 WeakPolarHBondContact O-CB 3.05Å; Q217-Q221 WeakPolarHBondContact O-CG 3.42Å; Q217-Q221 PolarHBondContact O-N 2.8Å
218	I	82.8	Confident	80.7	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-74.9	-39.9	-178	-64.8	160.3	0	0	0	110.9	P214 L215 L216 N220 Q221 F222 C223 P226 F431 F436	P214-I218 WeakPolarHBondContact O-CD1 3.44Å; P214-I218 WeakPolarHBondContact O-CG1 3.36Å; P214-I218 PolarHBondContact O-N 3.48Å; L215-I218 PolarHBondContact O-N 2.83Å; L216-I218 PolarHBondContact O-N 3.45Å; I218-N220 VanDerWaalsContact C-N 3.26Å; I218-N220 PolarHBondContact O-N 2.86Å; I218-Q221 PolarHBondContact O-N 3.07Å; I218-Q221 VanDerWaalsContact O-N 3.11Å; I218-F222 HydrophobicContact CG2-CB 4.26Å; I218-F222 HydrophobicContact CG2-CD2 4.31Å; I218-F222 PolarHBondContact O-N 3.31Å; I218-C223 PolarHBondContact O-N 3.4Å; I218-P226 HydrophobicContact CB-CG 4.44Å; I218-P226 HydrophobicContact CG2-CB 4.44Å; I218-P226 HydrophobicContact CG2-CG 3.79Å; I218-F431 HydrophobicContact CD1-CD1 3.4Å; I218-F431 VanDerWaalsContact CD1-CD1 3.4Å; I218-F431 HydrophobicContact CD1-CE1 3.34Å; I218-F431 HydrophobicContact CD1-CG 4.08Å; I218-F431 HydrophobicContact CD1-CZ 3.95Å; I218-F436 HydrophobicContact CD1-CB 3.79Å; I218-F436 HydrophobicContact CD1-CD1 4.17Å; I218-F436 HydrophobicContact CD1-CG 4.13Å; I218-F436 HydrophobicContact CG1-CD1 4.24Å; I218-F436 HydrophobicContact CG1-CG 4.39Å; I218-F436 HydrophobicContact CG2-CB 4.27Å; I218-F436 HydrophobicContact CG2-CD1 4.45Å; I218-F436 HydrophobicContact CG2-CD2 3.85Å; I218-F436 HydrophobicContact CG2-CE2 4.28Å; I218-F436 HydrophobicContact CG2-CG 3.95Å
219	A	81.8	Confident	80.6	Confident	11 Å²	11	45.4 Å²	45.4	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-57.3	-38.8	174.8	0	0	0	0	0	112.6	L215 C223 H634	L215-A219 VanDerWaalsContact O-CB 3.24Å; L215-A219 WeakPolarHBondContact O-CB 3.24Å; L215-A219 PolarHBondContact O-N 3.48Å; A219-C223 WeakPolarHBondContact CA-O 3.31Å; A219-H634 PolarHBondContact O-NE2 3.41Å
220	N	80.1	Confident	80.4	Confident	88 Å²	88	45.3 Å²	45.3	47%	0.471	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.1	179.5	-69.3	-21.9	0	0	0	114.2	L216 I218	L216-N220 WeakPolarHBondContact O-CB 3.11Å; L216-N220 PolarHBondContact O-N 3.3Å; L216-N220 VanDerWaalsContact O-N 3.1Å; L216-N220 PolarHBondContact O-ND2 2.83Å; I218-N220 VanDerWaalsContact C-N 3.26Å; I218-N220 PolarHBondContact O-N 2.86Å
221	Q	78.6	Confident	80.2	Confident	99 Å²	99	39.4 Å²	39.4	46%	0.463	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-27.4	-171.7	-67.6	-174	-15.5	0	0	115.6	Q217 I218	Q217-Q221 WeakPolarHBondContact O-CB 3.05Å; Q217-Q221 WeakPolarHBondContact O-CG 3.42Å; Q217-Q221 PolarHBondContact O-N 2.8Å; I218-Q221 PolarHBondContact O-N 3.07Å; I218-Q221 VanDerWaalsContact O-N 3.11Å
222	F	81.8	Confident	80.1	Confident	26 Å²	26	41.8 Å²	41.8	11%	0.114	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.9	-38.5	-165.8	-59.2	-64.6	0	0	0	116	I218 F436 Y530 F532 F636	I218-F222 HydrophobicContact CG2-CB 4.26Å; I218-F222 HydrophobicContact CG2-CD2 4.31Å; I218-F222 PolarHBondContact O-N 3.31Å; F222-F436 HydrophobicContact CB-CE2 3.57Å; F222-F436 HydrophobicContact CB-CZ 3.66Å; F222-F436 AromaticContact CD1-CZ 3.82Å; F222-F436 HydrophobicContact CD1-CZ 3.82Å; F222-F436 AromaticContact CD2-CE1 3.67Å; F222-F436 HydrophobicContact CD2-CE1 3.67Å; F222-F436 HydrophobicContact CD2-CE2 4.07Å; F222-F436 AromaticContact CD2-CZ 3.34Å; F222-F436 HydrophobicContact CD2-CZ 3.34Å; F222-F436 HydrophobicContact CE1-CZ 4.31Å; F222-F436 AromaticContact CE2-CE1 3.89Å; F222-F436 HydrophobicContact CE2-CE1 3.89Å; F222-F436 AromaticContact CE2-CZ 3.89Å; F222-F436 HydrophobicContact CE2-CZ 3.89Å; F222-F436 HydrophobicContact CG-CE1 4.13Å; F222-F436 AromaticContact CG-CE2 3.81Å; F222-F436 HydrophobicContact CG-CE2 3.81Å; F222-F436 AromaticContact CG-CZ 3.31Å; F222-F436 HydrophobicContact CG-CZ 3.31Å; F222-F436 HydrophobicContact CZ-CZ 4.34Å; F222-Y530 HydrophobicContact CE2-CD2 4.01Å; F222-Y530 AromaticContact CE2-CE2 3.85Å; F222-Y530 HydrophobicContact CE2-CE2 3.85Å; F222-Y530 AromaticContact CZ-CD2 3.78Å; F222-Y530 HydrophobicContact CZ-CD2 3.78Å; F222-Y530 HydrophobicContact CZ-CE2 4.07Å; F222-F532 HydrophobicContact CD1-CE1 4.29Å; F222-F532 HydrophobicContact CD1-CZ 4.42Å; F222-F532 AromaticContact CE1-CE1 3.97Å; F222-F532 HydrophobicContact CE1-CE1 3.97Å; F222-F532 AromaticContact CE1-CZ 3.74Å; F222-F532 HydrophobicContact CE1-CZ 3.74Å; F222-F532 HydrophobicContact CZ-CZ 4.28Å; F222-F636 WeakPolarHBondContact O-CE2 3.15Å; F222-F636 VanDerWaalsContact O-CZ 3.24Å; F222-F636 WeakPolarHBondContact O-CZ 3.39Å
223	C	83.5	Confident	79.9	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.014	19%	0.188	C	C	.	.			trans	-169.6	144.9	170.5	56.7	0	0	0	0	110.9	D189 I218 A219 Y225 C438	D189-C223 HydrophobicContact CB-CB 3.95Å; I218-C223 PolarHBondContact O-N 3.4Å; A219-C223 WeakPolarHBondContact CA-O 3.31Å; C223-Y225 PolarHBondContact O-N 3.35Å; C223-C438 HydrophobicContact CB-CB 3.61Å; C223-C438 WeakPolarHBondContact CB-SG 3.4Å; C223-C438 VanDerWaalsContact SG-CA 3.6Å; C223-C438 WeakPolarHBondContact SG-CB 3.32Å; C223-C438 CovalentContact SG-SG 2.03Å; C223-C438 PolarHBondContact SG-SG 3.26Å
224	R	80.7	Confident	79.9	Confident	30 Å²	30	32.8 Å²	32.8	11%	0.113	16%	0.164	C	C	.	.	S	Bend	trans	-57.8	-34.3	179.3	-72.5	169.3	-74.3	160.9	-0.3	113.1	D189 N196 I632 L633	D189-R224 PolarHBondContact O-NH2 2.76Å; D189-R224 IonicContact OD1-CZ 3.59Å; D189-R224 IonicContact OD1-NE 2.72Å; D189-R224 PolarHBondContact OD1-NE 2.84Å; D189-R224 VanDerWaalsContact OD1-NE 3.17Å; D189-R224 IonicContact OD1-NH2 3.53Å; D189-R224 PolarHBondContact OD1-NH2 3.3Å; D189-R224 WeakPolarHBondContact OD2-CB 3.28Å; D189-R224 WeakPolarHBondContact OD2-CG 3.43Å; D189-R224 IonicContact OD2-CZ 3.76Å; D189-R224 PolarHBondContact OD2-N 3.4Å; D189-R224 IonicContact OD2-NE 3.63Å; D189-R224 PolarHBondContact OD2-NE 3.2Å; D189-R224 IonicContact OD2-NH2 2.66Å; N196-R224 PolarHBondContact ND2-O 2.84Å; R224-I632 WeakPolarHBondContact CD-O 3.46Å; R224-I632 WeakPolarHBondContact CG-O 2.99Å; R224-I632 PolarHBondContact NE-O 3.34Å; R224-L633 VanDerWaalsContact NH2-CD1 3.33Å
225	Y	80.7	Confident	80	Confident	47 Å²	47	30.9 Å²	30.9	18%	0.184	15%	0.152	C	C	.	.	S	Bend	trans	-128.9	92.1	-175.3	-58.6	-79	0	0	0	110.8	N191 Y192 C223	N191-Y225 WeakPolarHBondContact OD1-CE2 3.03Å; Y192-Y225 HydrophobicContact CD2-CG 4.42Å; Y192-Y225 WeakPolarHBondContact O-CD1 3.46Å; Y192-Y225 WeakPolarHBondContact O-CE1 3.46Å; Y192-Y225 VanDerWaalsContact O-CZ 3.25Å; C223-Y225 PolarHBondContact O-N 3.35Å
226	P	83.3	Confident	80.1	Confident	3 Å²	3	35.5 Å²	35.5	2%	0.019	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	141.5	170.1	-23.9	37.4	0	0	0	111	L215 I218 F429 F431 M437	L215-P226 HydrophobicContact CD1-CB 4.37Å; L215-P226 HydrophobicContact CD1-CG 3.89Å; I218-P226 HydrophobicContact CB-CG 4.44Å; I218-P226 HydrophobicContact CG2-CB 4.44Å; I218-P226 HydrophobicContact CG2-CG 3.79Å; P226-F429 HydrophobicContact CB-CD1 4.44Å; P226-F429 HydrophobicContact CB-CE1 3.94Å; P226-F429 WeakPolarHBondContact O-CE1 3.04Å; P226-F431 HydrophobicContact CB-CE1 4.45Å; P226-F431 HydrophobicContact CB-CZ 4.16Å; P226-M437 CarbonylContact C-O 3.55Å; P226-M437 WeakPolarHBondContact CA-O 3.42Å
227	L	81.2	Confident	80.1	Confident	8 Å²	8	34.7 Å²	34.7	4%	0.042	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.9	173.8	-59.3	170.4	0	0	0	109.7	Y192 M437 H439 I518 P568 H569	Y192-L227 HydrophobicContact CE2-CD2 4.06Å; L227-M437 HydrophobicContact CB-CB 3.93Å; L227-M437 HydrophobicContact CD1-CB 4.36Å; L227-M437 PolarHBondContact N-O 3.25Å; L227-H439 HydrophobicContact CD1-CB 4.15Å; L227-I518 HydrophobicContact CD1-CG2 4.29Å; L227-P568 HydrophobicContact CB-CG 4.49Å; L227-P568 HydrophobicContact CD1-CG 4.1Å; L227-H569 HydrophobicContact CD2-CB 3.97Å
228	P	77.1	Confident	80.2	Confident	3 Å²	3	32 Å²	32	2%	0.019	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-69.9	151.5	170.9	28.4	-32.4	0	0	0	111.1	Y231 P427 E428 F429	P228-Y231 HydrophobicContact CG-CD1 4.35Å; P228-Y231 HydrophobicContact CG-CE1 3.6Å; P228-Y231 HydrophobicContact CG-CE2 3.98Å; P228-Y231 VanDerWaalsContact CG-OH 3.28Å; P228-Y231 WeakPolarHBondContact CG-OH 3.23Å; P228-P427 HydrophobicContact CB-CB 3.86Å; P228-P427 HydrophobicContact CG-CB 3.96Å; P228-E428 CarbonylContact C-O 3.45Å; P228-E428 WeakPolarHBondContact CA-O 3.34Å; P228-E428 WeakPolarHBondContact CB-O 3.5Å; P228-F429 HydrophobicContact CB-CD1 4.27Å; P228-F429 HydrophobicContact CB-CD2 4.4Å; P228-F429 HydrophobicContact CB-CE1 3.97Å; P228-F429 HydrophobicContact CB-CE2 4.12Å; P228-F429 HydrophobicContact CB-CG 4.49Å; P228-F429 HydrophobicContact CB-CZ 3.91Å; P228-F429 HydrophobicContact CG-CZ 4.33Å
229	S	72.8	Confident	80.1	Confident	38 Å²	38	36.7 Å²	36.7	27%	0.266	17%	0.173	S	C	.	.	S	Bend	trans	-78.2	-29.6	180	56.7	0	0	0	0	112.3	E428 Q564	S229-E428 PolarHBondContact N-O 2.86Å; S229-E428 PolarHBondContact OG-O 3.41Å; S229-Q564 PolarHBondContact O-NE2 3.41Å
230	R	73.3	Confident	79.8	Confident	84 Å²	84	45.8 Å²	45.8	32%	0.317	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	160.2	172.6	60	-170.9	-178.8	-178.3	-4	110.4	E428	R230-E428 HydrophobicContact CG-CB 4.02Å; R230-E428 IonicContact CZ-OE1 2.63Å; R230-E428 IonicContact CZ-OE2 3.11Å; R230-E428 VanDerWaalsContact CZ-OE2 3.28Å; R230-E428 VanDerWaalsContact NE-CD 3.29Å; R230-E428 IonicContact NE-OE1 2.79Å; R230-E428 PolarHBondContact NE-OE1 3.33Å; R230-E428 IonicContact NE-OE2 2.68Å; R230-E428 PolarHBondContact NE-OE2 3.15Å; R230-E428 VanDerWaalsContact NH2-CD 3.32Å; R230-E428 IonicContact NH2-OE1 2.97Å; R230-E428 PolarHBondContact NH2-OE1 3.48Å; R230-E428 IonicContact NH2-OE2 2.68Å; R230-E428 PolarHBondContact NH2-OE2 3.47Å; R230-E428 VanDerWaalsContact NH2-OE2 3.09Å; R230-E428 PolarHBondContact O-N 3.08Å
231	Y	75	Confident	79.7	Confident	7 Å²	7	42 Å²	42	3%	0.027	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.6	170.6	-68.9	-78.2	0	0	0	108.9	P228 I425 P427 T562 I563 P568 F571	P228-Y231 HydrophobicContact CG-CD1 4.35Å; P228-Y231 HydrophobicContact CG-CE1 3.6Å; P228-Y231 HydrophobicContact CG-CE2 3.98Å; P228-Y231 VanDerWaalsContact CG-OH 3.28Å; P228-Y231 WeakPolarHBondContact CG-OH 3.23Å; Y231-I425 HydrophobicContact CD1-CG2 3.72Å; Y231-I425 HydrophobicContact CE1-CG2 4.5Å; Y231-I425 HydrophobicContact CG-CG2 4.36Å; Y231-P427 HydrophobicContact CD1-CB 4.11Å; Y231-P427 HydrophobicContact CE1-CB 3.89Å; Y231-T562 CarbonylContact O-C 3.58Å; Y231-T562 WeakPolarHBondContact O-CA 3.39Å; Y231-I563 PolarHBondContact N-O 3.48Å; Y231-I563 PolarHBondContact O-N 2.81Å; Y231-P568 PolarHBondContact OH-O 2.77Å; Y231-F571 HydrophobicContact CE2-CB 4.15Å; Y231-F571 PolarHBondContact OH-O 2.86Å
232	L	75.7	Confident	79.9	Confident	52 Å²	52	39.1 Å²	39.1	27%	0.272	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	121.4	167.3	175.3	67.8	0	0	0	108	T426 F560 T562	L232-T426 PolarHBondContact N-O 2.78Å; L232-T426 PolarHBondContact O-N 2.81Å; L232-F560 HydrophobicContact CD1-CB 4.45Å; L232-T562 HydrophobicContact CD1-CG2 3.89Å
233	L	80.2	Confident	79.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.7	169.4	-54.1	-173.5	0	0	0	108.7	L311 F316 S424 I425 F560 T561 I563 W576	L233-L311 HydrophobicContact CD1-CD1 4.02Å; L233-F316 HydrophobicContact CB-CZ 3.99Å; L233-S424 WeakPolarHBondContact CA-O 3.45Å; L233-I425 HydrophobicContact CD2-CB 4.23Å; L233-I425 HydrophobicContact CD2-CG1 3.87Å; L233-I425 HydrophobicContact CD2-CG2 4.04Å; L233-F560 WeakPolarHBondContact O-CA 3.2Å; L233-T561 HydrophobicContact CB-CG2 3.89Å; L233-T561 HydrophobicContact CD1-CG2 4.31Å; L233-T561 HydrophobicContact CG-CG2 4.43Å; L233-T561 PolarHBondContact N-O 2.89Å; L233-T561 PolarHBondContact O-N 3.32Å; L233-I563 HydrophobicContact CD1-CD1 3.46Å; L233-I563 VanDerWaalsContact CD1-CD1 3.46Å; L233-I563 HydrophobicContact CD1-CG1 3.77Å; L233-I563 HydrophobicContact CG-CD1 4.36Å; L233-I563 HydrophobicContact CG-CG1 4.15Å; L233-W576 HydrophobicContact CD1-CH2 3.93Å; L233-W576 HydrophobicContact CD1-CZ3 3.67Å; L233-W576 HydrophobicContact CD2-CE3 4.26Å; L233-W576 HydrophobicContact CD2-CH2 3.96Å; L233-W576 HydrophobicContact CD2-CZ3 3.52Å; L233-W576 HydrophobicContact CG-CH2 4.47Å; L233-W576 HydrophobicContact CG-CZ3 4.24Å
234	S	80.9	Confident	80	Confident	23 Å²	23	41 Å²	41	16%	0.161	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	114.3	167.1	60.5	0	0	0	0	109.2	S424 A559 F560	S234-S424 PolarHBondContact N-O 3.41Å; S234-S424 PolarHBondContact O-N 3.26Å; S234-S424 WeakPolarHBondContact OG-CB 3.27Å; S234-A559 WeakPolarHBondContact CA-O 3.42Å; S234-F560 VanDerWaalsContact CB-CE1 3.42Å
235	L	84	Confident	80	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	130.9	162.7	172.4	147.8	0	0	0	108.4	A237 I312 F316 E318 F421 Q422 S558 A559	L235-A237 HydrophobicContact CD2-CB 4.47Å; L235-I312 HydrophobicContact CD1-CG2 4.25Å; L235-F316 HydrophobicContact CB-CD1 3.86Å; L235-F316 HydrophobicContact CB-CD2 3.76Å; L235-F316 HydrophobicContact CB-CE1 3.66Å; L235-F316 HydrophobicContact CB-CE2 3.59Å; L235-F316 HydrophobicContact CB-CG 3.9Å; L235-F316 HydrophobicContact CB-CZ 3.52Å; L235-F316 HydrophobicContact CD1-CB 3.96Å; L235-F316 HydrophobicContact CD1-CD1 4.49Å; L235-F316 HydrophobicContact CD1-CD2 3.5Å; L235-F316 HydrophobicContact CD1-CE2 4.09Å; L235-F316 HydrophobicContact CD1-CG 3.74Å; L235-F316 HydrophobicContact CG-CD2 4.27Å; L235-F316 HydrophobicContact CG-CE2 4.5Å; L235-F316 HydrophobicContact CG-CG 4.36Å; L235-E318 HydrophobicContact CD2-CG 4.43Å; L235-F421 HydrophobicContact CD1-CB 4.03Å; L235-F421 HydrophobicContact CD1-CD1 3.73Å; L235-F421 HydrophobicContact CD1-CE1 4.4Å; L235-F421 HydrophobicContact CD1-CG 4Å; L235-F421 HydrophobicContact CD2-CD1 3.74Å; L235-F421 HydrophobicContact CD2-CE1 4.13Å; L235-F421 HydrophobicContact CG-CB 4.32Å; L235-F421 HydrophobicContact CG-CD1 3.87Å; L235-F421 HydrophobicContact CG-CG 4.44Å; L235-Q422 CarbonylContact C-O 3.58Å; L235-Q422 VanDerWaalsContact CA-O 3.3Å; L235-Q422 WeakPolarHBondContact CA-O 3.2Å; L235-S558 CarbonylContact O-C 3.52Å; L235-S558 VanDerWaalsContact O-CA 3.26Å; L235-S558 WeakPolarHBondContact O-CA 3.48Å; L235-A559 HydrophobicContact CD2-CB 4.28Å; L235-A559 PolarHBondContact N-O 3.33Å; L235-A559 PolarHBondContact O-N 3.48Å
236	K	84.9	Confident	80	Confident	98 Å²	98	40.4 Å²	40.4	43%	0.426	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	118.5	171.7	174.7	-178	172.9	-172	0	108.8	F238 Q422 D557	K236-F238 HydrophobicContact CD-CE2 3.84Å; K236-F238 HydrophobicContact CD-CZ 3.92Å; K236-F238 VanDerWaalsContact CE-CZ 3.42Å; K236-F238 HydrophobicContact CG-CD2 4.4Å; K236-F238 HydrophobicContact CG-CE2 3.95Å; K236-F238 HydrophobicContact CG-CZ 4.43Å; K236-Q422 HydrophobicContact CB-CB 4.3Å; K236-Q422 PolarHBondContact N-O 2.9Å; K236-Q422 PolarHBondContact O-N 2.83Å; K236-D557 WeakPolarHBondContact CA-O 3.46Å
237	A	83.2	Confident	79.8	Confident	8 Å²	8	44 Å²	44	7%	0.066	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	115	-177.1	0	0	0	0	0	110.5	L235 R239 F421 D557	L235-A237 HydrophobicContact CD2-CB 4.47Å; A237-R239 HydrophobicContact CB-CG 4.11Å; A237-R239 PolarHBondContact O-N 3.45Å; A237-F421 HydrophobicContact CB-CD1 3.81Å; A237-F421 HydrophobicContact CB-CE1 3.62Å; A237-D557 PolarHBondContact N-O 2.79Å
238	F	83.1	Confident	79.5	Confident	38 Å²	38	48.9 Å²	48.9	17%	0.167	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	89.1	164.7	-60.8	-104.8	0	0	0	108.3	K236 R241 L296 Y304 T420 Q422	K236-F238 HydrophobicContact CD-CE2 3.84Å; K236-F238 HydrophobicContact CD-CZ 3.92Å; K236-F238 VanDerWaalsContact CE-CZ 3.42Å; K236-F238 HydrophobicContact CG-CD2 4.4Å; K236-F238 HydrophobicContact CG-CE2 3.95Å; K236-F238 HydrophobicContact CG-CZ 4.43Å; F238-R241 HydrophobicContact CB-CG 4.15Å; F238-L296 HydrophobicContact CD1-CD2 3.91Å; F238-L296 HydrophobicContact CD2-CD2 4.18Å; F238-L296 HydrophobicContact CE1-CD2 3.56Å; F238-L296 HydrophobicContact CE2-CD2 3.88Å; F238-L296 HydrophobicContact CG-CD2 4.19Å; F238-L296 HydrophobicContact CZ-CD2 3.53Å; F238-Y304 HydrophobicContact CE2-CE1 4.39Å; F238-T420 WeakPolarHBondContact CB-O 3.42Å; F238-T420 PolarHBondContact N-O 3.47Å; F238-T420 PolarHBondContact O-N 3.04Å; F238-Q422 HydrophobicContact CD2-CB 4.31Å; F238-Q422 HydrophobicContact CE2-CB 3.73Å
239	R	79.4	Confident	79.3	Confident	104 Å²	104	50.2 Å²	50.2	39%	0.392	22%	0.217	S	C	.	.			trans	-72.4	147.8	-175.8	-63.9	179.2	172.3	136	-3.4	111.5	A237 E318 N419 T556 D557	A237-R239 HydrophobicContact CB-CG 4.11Å; A237-R239 PolarHBondContact O-N 3.45Å; R239-E318 IonicContact NH2-OE1 3.01Å; R239-E318 PolarHBondContact NH2-OE1 3.36Å; R239-N419 WeakPolarHBondContact CA-OD1 3.49Å; R239-T556 PolarHBondContact NH1-O 2.8Å; R239-T556 PolarHBondContact NH2-O 2.83Å; R239-D557 IonicContact CZ-OD1 3.99Å; R239-D557 IonicContact NH1-OD1 3.37Å; R239-D557 PolarHBondContact NH1-OD1 2.86Å
240	R	75.6	Confident	79.1	Confident	202 Å²	202	49.7 Å²	49.7	76%	0.762	21%	0.213	S	C	*	.	S	Bend	trans	49.2	57.4	177.2	-64.1	-176.8	177.2	165.9	-2.1	115.5	D417	R240-D417 WeakPolarHBondContact CA-OD1 3.39Å
241	R	79.2	Confident	78.7	Confident	9 Å²	9	55 Å²	55	3%	0.034	23%	0.234	C	C	.	.			trans	-93.9	107.7	173.1	-72.2	-172.8	74.5	-114.5	11.6	111.7	F238 T243 R282 L284 N285 A293 A294 D417 G418 T420	F238-R241 HydrophobicContact CB-CG 4.15Å; R241-T243 PolarHBondContact O-N 3.23Å; R241-T243 PolarHBondContact O-OG1 3.32Å; R241-R282 PolarHBondContact O-NH1 2.9Å; R241-R282 VanDerWaalsContact O-NH1 3.15Å; R241-L284 VanDerWaalsContact CZ-O 3.23Å; R241-L284 PolarHBondContact NH1-O 3.36Å; R241-L284 PolarHBondContact NH2-O 3.26Å; R241-N285 PolarHBondContact NH2-OD1 3.03Å; R241-A293 HydrophobicContact CG-CB 4.16Å; R241-A294 PolarHBondContact NH2-O 3.36Å; R241-D417 PolarHBondContact N-OD1 2.84Å; R241-G418 PolarHBondContact N-O 3.3Å; R241-T420 PolarHBondContact NH1-OG1 2.83Å
242	Q	82.3	Confident	78.1	Confident	38 Å²	38	59.7 Å²	59.7	18%	0.178	26%	0.256	C	S	.	.			trans	-73.1	106.8	173.3	-64.5	-176.4	-13.1	0	0	111	C288 V325 M416 D417	Q242-C288 VanDerWaalsContact C-SG 3.51Å; Q242-C288 WeakPolarHBondContact CB-O 3.42Å; Q242-C288 PolarHBondContact O-N 2.73Å; Q242-C288 VanDerWaalsContact O-N 3.09Å; Q242-V325 HydrophobicContact CG-CG2 4.37Å; Q242-M416 WeakPolarHBondContact CA-O 3.18Å; Q242-D417 HydrophobicContact CG-CB 4.08Å
243	T	82.9	Confident	76.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	157.5	-178.3	39.4	0	0	0	0	111	R241 G245 R282 S283 D286 Q287 C288 M416	R241-T243 PolarHBondContact O-N 3.23Å; R241-T243 PolarHBondContact O-OG1 3.32Å; T243-G245 PolarHBondContact O-N 3.38Å; T243-R282 VanDerWaalsContact OG1-CD 3.25Å; T243-R282 WeakPolarHBondContact OG1-CD 3.47Å; T243-R282 WeakPolarHBondContact OG1-CG 3.23Å; T243-S283 WeakPolarHBondContact CB-O 3.19Å; T243-S283 PolarHBondContact OG1-O 3.02Å; T243-D286 CarbonylContact C-O 3.58Å; T243-D286 VanDerWaalsContact CA-O 3.22Å; T243-D286 WeakPolarHBondContact CA-O 3.36Å; T243-D286 WeakPolarHBondContact CB-O 3.11Å; T243-Q287 HydrophobicContact CG2-CG 4.44Å; T243-C288 PolarHBondContact N-SG 2.87Å; T243-C288 VanDerWaalsContact N-SG 3.37Å; T243-C288 PolarHBondContact O-SG 2.85Å; T243-M416 PolarHBondContact N-O 3.47Å; T243-M416 PolarHBondContact O-N 2.9Å
244	Y	83.7	Confident	75.5	Confident	66 Å²	66	67.5 Å²	67.5	26%	0.259	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	128.3	-178.6	-69.7	-74.1	0	0	0	111.7	S283 D286 Q287 C288 L410 K413 V414	Y244-S283 WeakPolarHBondContact O-CB 3.4Å; Y244-S283 PolarHBondContact O-N 3.38Å; Y244-S283 PolarHBondContact O-OG 2.78Å; Y244-D286 HydrophobicContact CD2-CB 3.87Å; Y244-D286 WeakPolarHBondContact CD2-O 3.49Å; Y244-D286 PolarHBondContact N-O 2.79Å; Y244-Q287 WeakPolarHBondContact CE2-O 3.31Å; Y244-C288 HydrophobicContact CD1-CB 4.13Å; Y244-C288 HydrophobicContact CD2-CB 4.28Å; Y244-C288 HydrophobicContact CE1-CB 3.8Å; Y244-C288 HydrophobicContact CE2-CB 3.97Å; Y244-C288 HydrophobicContact CG-CB 4.36Å; Y244-L410 HydrophobicContact CE1-CD2 4Å; Y244-K413 HydrophobicContact CD1-CB 3.92Å; Y244-K413 HydrophobicContact CD1-CD 4.35Å; Y244-K413 HydrophobicContact CG-CD 4.35Å; Y244-V414 CarbonylContact C-O 3.5Å; Y244-V414 WeakPolarHBondContact CA-O 3.22Å
245	G	81.5	Confident	74.1	Confident	0 Å²	0	68 Å²	68	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.5	163.6	0	0	0	0	0	111	T243 E281 K413 V414	T243-G245 PolarHBondContact O-N 3.38Å; G245-E281 WeakPolarHBondContact CA-O 3.45Å; G245-K413 WeakPolarHBondContact O-CA 3.28Å; G245-V414 PolarHBondContact N-O 2.85Å; G245-V414 PolarHBondContact O-N 3.43Å
246	Y	81.7	Confident	72.2	Confident	65 Å²	65	71.1 Å²	71.1	26%	0.255	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	132.4	178.2	-73.5	-94.8	0	0	0	110.9	R248 Y280 E281 D286 K413	Y246-R248 PolarHBondContact O-N 3.4Å; Y246-Y280 WeakPolarHBondContact O-CA 2.98Å; Y246-E281 PolarHBondContact N-O 3.16Å; Y246-E281 PolarHBondContact O-N 3.34Å; Y246-D286 VanDerWaalsContact CE2-OD2 3.29Å; Y246-D286 WeakPolarHBondContact CE2-OD2 3.12Å; Y246-D286 VanDerWaalsContact CZ-OD2 3.31Å; Y246-D286 PolarHBondContact OH-OD2 2.78Å; Y246-K413 HydrophobicContact CD1-CD 4.41Å; Y246-K413 HydrophobicContact CD1-CG 4.21Å; Y246-K413 HydrophobicContact CE1-CD 3.77Å; Y246-K413 HydrophobicContact CE1-CG 4.05Å; Y246-K413 PolarHBondContact OH-NZ 3.05Å
247	K	78.7	Confident	70.3	Confident	80 Å²	80	70.9 Å²	70.9	35%	0.348	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	124.7	178.5	-161.5	176.9	-178.2	179.6	0	111.4	Y278 Y280 D412	K247-Y278 HydrophobicContact CD-CD1 4.38Å; K247-Y278 HydrophobicContact CG-CD1 4.02Å; K247-Y278 HydrophobicContact CG-CG 4.3Å; K247-Y280 HydrophobicContact CB-CD1 4.21Å; K247-Y280 HydrophobicContact CB-CE1 3.83Å; K247-Y280 HydrophobicContact CG-CE1 4.03Å; K247-D412 PolarHBondContact N-O 2.77Å; K247-D412 VanDerWaalsContact N-O 3.14Å
248	R	74.9	Confident	68.8	Low	110 Å²	110	71.9 Å²	71.9	42%	0.415	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	156.5	175.8	-63.3	-59	-163.8	-176.9	4.5	110.1	Y246 Y278 F279 E281	Y246-R248 PolarHBondContact O-N 3.4Å; R248-Y278 CarbonylContact O-C 3.56Å; R248-Y278 WeakPolarHBondContact O-CA 3.12Å; R248-Y278 VanDerWaalsContact O-CB 3.31Å; R248-Y278 WeakPolarHBondContact O-CB 3.46Å; R248-Y278 WeakPolarHBondContact O-CD1 3.4Å; R248-F279 HydrophobicContact CB-CD1 3.94Å; R248-F279 HydrophobicContact CB-CD2 4.08Å; R248-F279 HydrophobicContact CB-CE1 3.52Å; R248-F279 HydrophobicContact CB-CE2 3.66Å; R248-F279 HydrophobicContact CB-CG 4.21Å; R248-F279 HydrophobicContact CB-CZ 3.37Å; R248-F279 HydrophobicContact CG-CD2 4.48Å; R248-F279 HydrophobicContact CG-CE1 4.46Å; R248-F279 HydrophobicContact CG-CE2 3.83Å; R248-F279 HydrophobicContact CG-CZ 3.83Å; R248-F279 PolarHBondContact N-O 3.18Å; R248-F279 PolarHBondContact O-N 2.85Å; R248-E281 HydrophobicContact CG-CB 3.78Å; R248-E281 IonicContact CZ-OE2 3.57Å; R248-E281 IonicContact NE-OE2 2.85Å; R248-E281 PolarHBondContact NE-OE2 2.77Å; R248-E281 IonicContact NH2-OE2 3.41Å; R248-E281 PolarHBondContact NH2-OE2 3.49Å
249	S	72.3	Confident	67.5	Low	30 Å²	30	74.5 Å²	74.5	21%	0.21	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132	179.4	-169.9	0	0	0	0	112	R251 T277	S249-R251 PolarHBondContact O-N 3.48Å; S249-T277 WeakPolarHBondContact CA-O 3.47Å; S249-T277 PolarHBondContact OG-O 3.15Å
250	C	67.9	Low	66.3	Low	27 Å²	27	71.6 Å²	71.6	18%	0.182	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	28.9	-179.3	-70	0	0	0	0	114.8	C261 T277	C250-C261 VanDerWaalsContact CA-SG 3.54Å; C250-C261 HydrophobicContact CB-CB 3.73Å; C250-C261 WeakPolarHBondContact CB-SG 3.44Å; C250-C261 WeakPolarHBondContact SG-CB 3.47Å; C250-C261 CovalentContact SG-SG 2.04Å; C250-C261 PolarHBondContact SG-SG 2.77Å; C250-T277 PolarHBondContact N-O 3.19Å
251	R	66.5	Low	65.4	Low	196 Å²	196	63.7 Å²	63.7	74%	0.74	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-10.8	-176.7	-70	-175.5	174.6	-174.6	0	114.5	S249	S249-R251 PolarHBondContact O-N 3.48Å
252	E	60.9	Low	64.2	Low	105 Å²	105	69.8 Å²	69.8	49%	0.491	35%	0.354	S	S	.	.	S	Bend	trans	-85.3	134.6	178.1	-71.6	-175.2	-176.5	0	0	111.9	T254 Q255 T256	E252-T254 PolarHBondContact O-N 2.73Å; E252-Q255 HydrophobicContact CB-CB 4.3Å; E252-Q255 HydrophobicContact CB-CG 3.98Å; E252-Q255 VanDerWaalsContact CD-NE2 3.31Å; E252-Q255 WeakPolarHBondContact O-CA 3.25Å; E252-Q255 PolarHBondContact O-N 3.32Å; E252-Q255 PolarHBondContact OE2-NE2 2.75Å; E252-T256 PolarHBondContact O-N 3.44Å; E252-T256 VanDerWaalsContact O-N 3.07Å
253	P	49.9	Very low	62.7	Low	113 Å²	113	70.3 Å²	70.3	73%	0.734	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-18.2	-176.7	28.1	-35.6	0	0	0	113.7	Q255 T256	P253-Q255 VanDerWaalsContact C-N 3.35Å; P253-T256 WeakPolarHBondContact CA-OG1 3.21Å; P253-T256 PolarHBondContact O-OG1 3.04Å; P253-T256 VanDerWaalsContact O-OG1 3.05Å
254	T	51.2	Low	60.9	Low	104 Å²	104	76.6 Å²	76.6	64%	0.638	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-21.2	170	42	0	0	0	0	113.1	E252	E252-T254 PolarHBondContact O-N 2.73Å
255	Q	52	Low	59.1	Low	34 Å²	34	81.4 Å²	81.4	16%	0.159	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-23.6	-178.1	-58.5	-174	37.8	0	0	112.2	E252 P253 S257 T258	E252-Q255 HydrophobicContact CB-CB 4.3Å; E252-Q255 HydrophobicContact CB-CG 3.98Å; E252-Q255 VanDerWaalsContact CD-NE2 3.31Å; E252-Q255 WeakPolarHBondContact O-CA 3.25Å; E252-Q255 PolarHBondContact O-N 3.32Å; E252-Q255 PolarHBondContact OE2-NE2 2.75Å; P253-Q255 VanDerWaalsContact C-N 3.35Å; Q255-S257 PolarHBondContact O-N 3.27Å; Q255-T258 WeakPolarHBondContact O-CB 3.37Å; Q255-T258 PolarHBondContact O-N 2.83Å; Q255-T258 PolarHBondContact O-OG1 3.47Å
256	T	44.4	Very low	57.2	Low	67 Å²	67	85.4 Å²	85.4	41%	0.411	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-11.5	178.4	45.3	0	0	0	0	115.2	E252 P253 Q262	E252-T256 PolarHBondContact O-N 3.44Å; E252-T256 VanDerWaalsContact O-N 3.07Å; P253-T256 WeakPolarHBondContact CA-OG1 3.21Å; P253-T256 PolarHBondContact O-OG1 3.04Å; P253-T256 VanDerWaalsContact O-OG1 3.05Å; T256-Q262 PolarHBondContact O-NE2 3.18Å
257	S	44.9	Very low	55.6	Low	93 Å²	93	87.5 Å²	87.5	65%	0.65	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-2.5	171.2	57.6	0	0	0	0	114.1	Q255	Q255-S257 PolarHBondContact O-N 3.27Å
258	T	51.7	Low	53.5	Low	28 Å²	28	90 Å²	90	17%	0.172	47%	0.469	C	S	.	.	S	Bend	trans	-82.9	139.5	175.1	66.5	0	0	0	0	110.3	Q255 L260 C261	Q255-T258 WeakPolarHBondContact O-CB 3.37Å; Q255-T258 PolarHBondContact O-N 2.83Å; Q255-T258 PolarHBondContact O-OG1 3.47Å; T258-L260 PolarHBondContact O-N 3.32Å; T258-C261 PolarHBondContact O-N 3.24Å
259	I	55	Low	52	Low	93 Å²	93	90.8 Å²	90.8	48%	0.477	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-58.2	-33.8	-175.8	-60.9	173.8	0	0	0	111.1	C261 Q262 T263	I259-C261 PolarHBondContact O-N 3.17Å; I259-Q262 PolarHBondContact O-N 3.18Å; I259-T263 HydrophobicContact CG2-CG2 3.66Å; I259-T263 PolarHBondContact O-N 2.88Å; I259-T263 PolarHBondContact O-OG1 3.12Å
260	L	55.1	Low	50.3	Low	44 Å²	44	98.5 Å²	98.5	23%	0.23	51%	0.505	C	S	.	.	G	3₁₀ helix	trans	-62.5	-8	177.3	-85.5	71	0	0	0	115.5	T258 H266 F279 R307	T258-L260 PolarHBondContact O-N 3.32Å; L260-H266 PolarHBondContact O-CE1 3.05Å; L260-H266 PolarHBondContact O-NE2 2.78Å; L260-F279 HydrophobicContact CD2-CD2 4.04Å; L260-R307 HydrophobicContact CD1-CB 4.49Å; L260-R307 HydrophobicContact CD1-CG 4.34Å; L260-R307 HydrophobicContact CD2-CG 4.21Å
261	C	57.4	Low	48.7	Very low	36 Å²	36	99.2 Å²	99.2	24%	0.243	52%	0.517	C	S	.	.	G	3₁₀ helix	trans	-114.4	10.2	171.3	-68.2	0	0	0	0	112.6	C250 T258 I259	C250-C261 VanDerWaalsContact CA-SG 3.54Å; C250-C261 HydrophobicContact CB-CB 3.73Å; C250-C261 WeakPolarHBondContact CB-SG 3.44Å; C250-C261 WeakPolarHBondContact SG-CB 3.47Å; C250-C261 CovalentContact SG-SG 2.04Å; C250-C261 PolarHBondContact SG-SG 2.77Å; T258-C261 PolarHBondContact O-N 3.24Å; I259-C261 PolarHBondContact O-N 3.17Å
262	Q	53.7	Low	47.7	Very low	136 Å²	136	95.6 Å²	95.6	64%	0.636	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128	-25.5	-176.2	-63.3	-168.8	4	0	0	114.3	T256 I259	T256-Q262 PolarHBondContact O-NE2 3.18Å; I259-Q262 PolarHBondContact O-N 3.18Å
263	T	50.3	Low	47.2	Very low	50 Å²	50	99.4 Å²	99.4	31%	0.307	53%	0.53	S	S	.	.			trans	-87.8	129.9	175.7	48.6	0	0	0	0	111.9	I259 E265	I259-T263 HydrophobicContact CG2-CG2 3.66Å; I259-T263 PolarHBondContact O-N 2.88Å; I259-T263 PolarHBondContact O-OG1 3.12Å; T263-E265 PolarHBondContact O-N 3.32Å; T263-E265 VanDerWaalsContact O-N 3.13Å
264	D	45.6	Very low	47.3	Very low	131 Å²	131	102.2 Å²	102.2	70%	0.701	53%	0.531	S	S	*	.	S	Bend	trans	-71.5	5.2	170	-91.6	-47.8	0	0	0	113.1	H266 K276	D264-H266 PolarHBondContact O-N 3.41Å; D264-K276 IonicContact OD1-NZ 2.77Å; D264-K276 PolarHBondContact OD1-NZ 3.38Å
265	E	44.5	Very low	47.3	Very low	168 Å²	168	102.1 Å²	102.1	79%	0.785	52%	0.523	S	S	*	.			trans	-84.1	19.9	-177.1	-58.9	-177.9	141.8	0	0	113.7	T263	T263-E265 PolarHBondContact O-N 3.32Å; T263-E265 VanDerWaalsContact O-N 3.13Å
266	H	43.5	Very low	47.4	Very low	84 Å²	84	106.9 Å²	106.9	39%	0.389	54%	0.543	S	S	.	.			trans	-56.6	142.9	165.9	-69.8	-56.4	0	0	0	110.2	L260 D264	L260-H266 PolarHBondContact O-CE1 3.05Å; L260-H266 PolarHBondContact O-NE2 2.78Å; D264-H266 PolarHBondContact O-N 3.41Å
267	L	46.6	Very low	48.3	Very low	109 Å²	109	105.9 Å²	105.9	57%	0.571	54%	0.537	S	S	*	.			trans	-45	151.3	-176	-68.6	79.5	0	0	0	112.4	Y269	L267-Y269 HydrophobicContact CB-CD2 3.93Å; L267-Y269 HydrophobicContact CB-CE2 3.98Å; L267-Y269 PolarHBondContact O-N 3.2Å
268	N	35.4	Very low	49.3	Very low	133 Å²	133	106.5 Å²	106.5	71%	0.711	53%	0.526	S	S	*	.			trans	-57.8	62.3	177.9	-92.1	-38.5	0	0	0	114.7	H270	N268-H270 PolarHBondContact O-N 2.83Å
269	Y	42.4	Very low	50.2	Low	126 Å²	126	105.7 Å²	105.7	49%	0.494	52%	0.52	S	S	.	.			trans	-81.8	91.3	171.3	-85.3	-80.8	0	0	0	109	L267 G271 I324	L267-Y269 HydrophobicContact CB-CD2 3.93Å; L267-Y269 HydrophobicContact CB-CE2 3.98Å; L267-Y269 PolarHBondContact O-N 3.2Å; Y269-G271 PolarHBondContact O-N 2.73Å; Y269-I324 WeakPolarHBondContact OH-CD1 3.15Å
270	H	37.3	Very low	51.1	Low	192 Å²	192	105.1 Å²	105.1	89%	0.889	51%	0.513	S	S	*	.			trans	-65.4	79.3	165.9	-89.9	-75.2	0	0	0	110.7	N268	N268-H270 PolarHBondContact O-N 2.83Å
271	G	35.2	Very low	52.1	Low	42 Å²	42	105.6 Å²	105.6	43%	0.433	51%	0.514	S	S	.	.	S	Bend	trans	163.3	129.9	171	0	0	0	0	0	115.5	Y269 Q275	Y269-G271 PolarHBondContact O-N 2.73Å; G271-Q275 PolarHBondContact O-NE2 3.03Å
272	D	44.6	Very low	53.3	Low	120 Å²	120	104.2 Å²	104.2	64%	0.642	50%	0.503	S	S	*	.			trans	59.4	109	169.7	-73.8	-13.3	0	0	0	119.2	K274 Q275	D272-K274 PolarHBondContact O-N 2.92Å; D272-Q275 HydrophobicContact CB-CG 4.4Å; D272-Q275 PolarHBondContact O-N 2.65Å
273	E	51.1	Low	54.6	Low	185 Å²	185	98.6 Å²	98.6	86%	0.864	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-52.1	-25.9	168	-61.4	-176.3	126.6	0	0	113.8	Q275 K276	E273-Q275 PolarHBondContact O-N 3.48Å; E273-Q275 VanDerWaalsContact O-N 3.12Å; E273-K276 PolarHBondContact O-N 2.92Å; E273-K276 VanDerWaalsContact O-N 3.14Å
274	K	50.5	Low	56.1	Low	171 Å²	171	99.2 Å²	99.2	74%	0.743	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-60.6	-17.9	177.1	-67.9	177.3	-178.4	169	0	113.3	D272 K276 T277	D272-K274 PolarHBondContact O-N 2.92Å; K274-K276 VanDerWaalsContact C-N 3.35Å; K274-T277 PolarHBondContact O-OG1 3.37Å
275	Q	52.1	Low	57.9	Low	102 Å²	102	95.8 Å²	95.8	48%	0.477	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-74.9	-22.4	177.5	-58.4	-162.7	37.6	0	0	113	G271 D272 E273 T277 Y278	G271-Q275 PolarHBondContact O-NE2 3.03Å; D272-Q275 HydrophobicContact CB-CG 4.4Å; D272-Q275 PolarHBondContact O-N 2.65Å; E273-Q275 PolarHBondContact O-N 3.48Å; E273-Q275 VanDerWaalsContact O-N 3.12Å; Q275-T277 PolarHBondContact O-N 3.34Å; Q275-Y278 PolarHBondContact O-N 2.64Å; Q275-Y278 VanDerWaalsContact O-N 3.14Å
276	K	54.2	Low	59.6	Low	134 Å²	134	91.1 Å²	91.1	58%	0.583	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-62.6	-1.3	178.3	-69.7	-158	176.6	-166.2	0	115.5	D264 E273 K274	D264-K276 IonicContact OD1-NZ 2.77Å; D264-K276 PolarHBondContact OD1-NZ 3.38Å; E273-K276 PolarHBondContact O-N 2.92Å; E273-K276 VanDerWaalsContact O-N 3.14Å; K274-K276 VanDerWaalsContact C-N 3.35Å
277	T	62.8	Low	61.1	Low	47 Å²	47	89.1 Å²	89.1	29%	0.288	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-95.2	-2	175.5	56.1	0	0	0	0	114.6	S249 C250 K274 Q275	S249-T277 WeakPolarHBondContact CA-O 3.47Å; S249-T277 PolarHBondContact OG-O 3.15Å; C250-T277 PolarHBondContact N-O 3.19Å; K274-T277 PolarHBondContact O-OG1 3.37Å; Q275-T277 PolarHBondContact O-N 3.34Å
278	Y	65.6	Low	62.4	Low	106 Å²	106	84.3 Å²	84.3	42%	0.416	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	146.7	-177.6	-56.4	-85.4	0	0	0	112.9	K247 R248 Q275	K247-Y278 HydrophobicContact CD-CD1 4.38Å; K247-Y278 HydrophobicContact CG-CD1 4.02Å; K247-Y278 HydrophobicContact CG-CG 4.3Å; R248-Y278 CarbonylContact O-C 3.56Å; R248-Y278 WeakPolarHBondContact O-CA 3.12Å; R248-Y278 VanDerWaalsContact O-CB 3.31Å; R248-Y278 WeakPolarHBondContact O-CB 3.46Å; R248-Y278 WeakPolarHBondContact O-CD1 3.4Å; Q275-Y278 PolarHBondContact O-N 2.64Å; Q275-Y278 VanDerWaalsContact O-N 3.14Å
279	F	71.3	Confident	63.9	Low	11 Å²	11	80.6 Å²	80.6	5%	0.048	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	162.7	165.7	68.2	-86.1	0	0	0	109.7	R248 L260 E281	R248-F279 HydrophobicContact CB-CD1 3.94Å; R248-F279 HydrophobicContact CB-CD2 4.08Å; R248-F279 HydrophobicContact CB-CE1 3.52Å; R248-F279 HydrophobicContact CB-CE2 3.66Å; R248-F279 HydrophobicContact CB-CG 4.21Å; R248-F279 HydrophobicContact CB-CZ 3.37Å; R248-F279 HydrophobicContact CG-CD2 4.48Å; R248-F279 HydrophobicContact CG-CE1 4.46Å; R248-F279 HydrophobicContact CG-CE2 3.83Å; R248-F279 HydrophobicContact CG-CZ 3.83Å; R248-F279 PolarHBondContact N-O 3.18Å; R248-F279 PolarHBondContact O-N 2.85Å; L260-F279 HydrophobicContact CD2-CD2 4.04Å; F279-E281 HydrophobicContact CE2-CB 4.26Å
280	Y	73.6	Confident	64.7	Low	80 Å²	80	81.3 Å²	81.3	31%	0.314	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	133.6	173.4	-71.5	-78.4	0	0	0	110.8	Y246 K247 I324 V414	Y246-Y280 WeakPolarHBondContact O-CA 2.98Å; K247-Y280 HydrophobicContact CB-CD1 4.21Å; K247-Y280 HydrophobicContact CB-CE1 3.83Å; K247-Y280 HydrophobicContact CG-CE1 4.03Å; Y280-I324 HydrophobicContact CD2-CD1 4.48Å; Y280-I324 HydrophobicContact CE2-CD1 4.47Å; Y280-V414 HydrophobicContact CD1-CG2 3.51Å; Y280-V414 HydrophobicContact CD2-CG2 4.49Å; Y280-V414 HydrophobicContact CE1-CG2 3.56Å; Y280-V414 HydrophobicContact CG-CG2 4.01Å
281	E	76.5	Confident	65.7	Low	55 Å²	55	77.9 Å²	77.9	26%	0.257	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	102.6	176.7	177.2	161.8	-96.1	0	0	109.5	G245 Y246 R248 F279 S283 R307	G245-E281 WeakPolarHBondContact CA-O 3.45Å; Y246-E281 PolarHBondContact N-O 3.16Å; Y246-E281 PolarHBondContact O-N 3.34Å; R248-E281 HydrophobicContact CG-CB 3.78Å; R248-E281 IonicContact CZ-OE2 3.57Å; R248-E281 IonicContact NE-OE2 2.85Å; R248-E281 PolarHBondContact NE-OE2 2.77Å; R248-E281 IonicContact NH2-OE2 3.41Å; R248-E281 PolarHBondContact NH2-OE2 3.49Å; F279-E281 HydrophobicContact CE2-CB 4.26Å; E281-S283 PolarHBondContact O-N 2.87Å; E281-R307 IonicContact OE1-CZ 2.6Å; E281-R307 IonicContact OE1-NH1 3.66Å; E281-R307 IonicContact OE1-NH2 2.63Å; E281-R307 PolarHBondContact OE1-NH2 2.83Å
282	R	81.6	Confident	66.9	Low	7 Å²	7	80.6 Å²	80.6	3%	0.026	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	121.6	177.4	-171.4	169.4	57.7	123.4	-3.8	111.3	R241 T243 E322 M416 G418 N419	R241-R282 PolarHBondContact O-NH1 2.9Å; R241-R282 VanDerWaalsContact O-NH1 3.15Å; T243-R282 VanDerWaalsContact OG1-CD 3.25Å; T243-R282 WeakPolarHBondContact OG1-CD 3.47Å; T243-R282 WeakPolarHBondContact OG1-CG 3.23Å; R282-E322 IonicContact CZ-OE1 3.64Å; R282-E322 IonicContact NE-OE1 2.71Å; R282-E322 PolarHBondContact NE-OE1 2.87Å; R282-E322 IonicContact NH2-OE1 4Å; R282-E322 PolarHBondContact NH2-OE1 3.37Å; R282-M416 HydrophobicContact CB-SD 4.34Å; R282-M416 HydrophobicContact CG-CB 4.23Å; R282-G418 VanDerWaalsContact NH1-C 3.31Å; R282-G418 PolarHBondContact NH1-O 3.18Å; R282-N419 PolarHBondContact NH2-O 2.98Å
283	S	82.9	Confident	67.7	Low	18 Å²	18	76.1 Å²	76.1	13%	0.126	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	151.9	178	59.5	0	0	0	0	112.8	T243 Y244 E281 D286	T243-S283 WeakPolarHBondContact CB-O 3.19Å; T243-S283 PolarHBondContact OG1-O 3.02Å; Y244-S283 WeakPolarHBondContact O-CB 3.4Å; Y244-S283 PolarHBondContact O-N 3.38Å; Y244-S283 PolarHBondContact O-OG 2.78Å; E281-S283 PolarHBondContact O-N 2.87Å; S283-D286 WeakPolarHBondContact OG-CB 3.36Å
284	L	80.8	Confident	68.5	Low	62 Å²	62	70.3 Å²	70.3	33%	0.325	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-32.6	-179.3	-68.3	175.5	0	0	0	113.4	R241 Y304 T306 T420	R241-L284 VanDerWaalsContact CZ-O 3.23Å; R241-L284 PolarHBondContact NH1-O 3.36Å; R241-L284 PolarHBondContact NH2-O 3.26Å; L284-Y304 HydrophobicContact CD1-CD2 4.24Å; L284-Y304 HydrophobicContact CD1-CG 4.4Å; L284-Y304 HydrophobicContact CD2-CG 4.36Å; L284-T306 HydrophobicContact CD2-CG2 3.79Å; L284-T420 HydrophobicContact CD2-CG2 3.9Å
285	N	83.2	Confident	69.7	Low	60 Å²	60	68.2 Å²	68.2	32%	0.321	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	-5	-169.6	-81	-30.1	0	0	0	115.5	R241 Q287 L296	R241-N285 PolarHBondContact NH2-OD1 3.03Å; N285-Q287 PolarHBondContact O-N 3.44Å; N285-Q287 VanDerWaalsContact O-N 3.16Å; N285-L296 PolarHBondContact ND2-O 3.19Å; N285-L296 PolarHBondContact OD1-N 3.46Å
286	D	80.8	Confident	71	Confident	70 Å²	70	63.8 Å²	63.8	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	96.2	176.1	-53.9	-16.3	0	0	0	109.2	T243 Y244 Y246 S283	T243-D286 CarbonylContact C-O 3.58Å; T243-D286 VanDerWaalsContact CA-O 3.22Å; T243-D286 WeakPolarHBondContact CA-O 3.36Å; T243-D286 WeakPolarHBondContact CB-O 3.11Å; Y244-D286 HydrophobicContact CD2-CB 3.87Å; Y244-D286 WeakPolarHBondContact CD2-O 3.49Å; Y244-D286 PolarHBondContact N-O 2.79Å; Y246-D286 VanDerWaalsContact CE2-OD2 3.29Å; Y246-D286 WeakPolarHBondContact CE2-OD2 3.12Å; Y246-D286 VanDerWaalsContact CZ-OD2 3.31Å; Y246-D286 PolarHBondContact OH-OD2 2.78Å; S283-D286 WeakPolarHBondContact OG-CB 3.36Å
287	Q	74.4	Confident	72.1	Confident	41 Å²	41	61.2 Å²	61.2	19%	0.192	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	146.2	-169.7	-58	179.3	17.6	0	0	113.1	T243 Y244 N285 A293	T243-Q287 HydrophobicContact CG2-CG 4.44Å; Y244-Q287 WeakPolarHBondContact CE2-O 3.31Å; N285-Q287 PolarHBondContact O-N 3.44Å; N285-Q287 VanDerWaalsContact O-N 3.16Å; Q287-A293 PolarHBondContact NE2-O 2.88Å; Q287-A293 PolarHBondContact OE1-O 2.85Å
288	C	74	Confident	72.5	Confident	8 Å²	8	65.6 Å²	65.6	5%	0.054	36%	0.355	C	S	.	.			trans	-130.2	162.4	173.4	63.7	0	0	0	0	110.9	Q242 T243 Y244 C415	Q242-C288 VanDerWaalsContact C-SG 3.51Å; Q242-C288 WeakPolarHBondContact CB-O 3.42Å; Q242-C288 PolarHBondContact O-N 2.73Å; Q242-C288 VanDerWaalsContact O-N 3.09Å; T243-C288 PolarHBondContact N-SG 2.87Å; T243-C288 VanDerWaalsContact N-SG 3.37Å; T243-C288 PolarHBondContact O-SG 2.85Å; Y244-C288 HydrophobicContact CD1-CB 4.13Å; Y244-C288 HydrophobicContact CD2-CB 4.28Å; Y244-C288 HydrophobicContact CE1-CB 3.8Å; Y244-C288 HydrophobicContact CE2-CB 3.97Å; Y244-C288 HydrophobicContact CG-CB 4.36Å; C288-C415 HydrophobicContact CB-CB 3.79Å; C288-C415 WeakPolarHBondContact CB-SG 3.15Å; C288-C415 WeakPolarHBondContact SG-CA 3.22Å; C288-C415 WeakPolarHBondContact SG-CB 3.31Å; C288-C415 CovalentContact SG-SG 2.04Å; C288-C415 PolarHBondContact SG-SG 2.75Å
289	G	66.3	Low	72.8	Confident	56 Å²	56	63.8 Å²	63.8	58%	0.577	35%	0.35	S	S	*	.	S	Bend	trans	81.4	-168.8	-176.5	0	0	0	0	0	114.2
290	R	60.4	Low	72.7	Confident	140 Å²	140	67.8 Å²	67.8	53%	0.528	38%	0.377	S	S	.	.	S	Bend	trans	-93.3	-20.4	179	-74.8	-175.5	175.7	161.4	-0.2	113.5	L292 S331 M399	R290-L292 PolarHBondContact O-N 2.79Å; R290-L292 VanDerWaalsContact O-N 3.09Å; R290-S331 PolarHBondContact NH1-OG 2.98Å; R290-M399 PolarHBondContact NH2-O 3.07Å
291	N	57.3	Low	72.7	Confident	121 Å²	121	65.6 Å²	65.6	65%	0.647	37%	0.371	S	S	*	.	S	Bend	trans	-83.8	83.4	178.8	-71.8	-5.8	0	0	0	109.4	A293	N291-A293 PolarHBondContact O-N 2.76Å
292	L	60.4	Low	72.9	Confident	98 Å²	98	63 Å²	63	51%	0.513	36%	0.36	S	S	.	.			trans	-59	109	173.1	-67.2	175	0	0	0	109.4	R290	R290-L292 PolarHBondContact O-N 2.79Å; R290-L292 VanDerWaalsContact O-N 3.09Å
293	A	62.6	Low	73	Confident	26 Å²	26	63.2 Å²	63.2	22%	0.215	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-71.8	164.8	177.3	0	0	0	0	0	110.8	R241 Q287 N291 I295	R241-A293 HydrophobicContact CG-CB 4.16Å; Q287-A293 PolarHBondContact NE2-O 2.88Å; Q287-A293 PolarHBondContact OE1-O 2.85Å; N291-A293 PolarHBondContact O-N 2.76Å; A293-I295 PolarHBondContact O-N 3.44Å
294	A	67.7	Low	73.2	Confident	63 Å²	63	64 Å²	64	52%	0.521	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-60.8	136.9	164.1	0	0	0	0	0	110	R241 L296	R241-A294 PolarHBondContact NH2-O 3.36Å; A294-L296 PolarHBondContact O-N 2.78Å
295	I	75	Confident	73.4	Confident	127 Å²	127	61 Å²	61	65%	0.651	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-66.1	129.1	163	-60.4	175.6	0	0	0	106.9	A293	A293-I295 PolarHBondContact O-N 3.44Å
296	L	80.5	Confident	73.3	Confident	10 Å²	10	59.1 Å²	59.1	5%	0.052	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-86.6	125.1	177.8	-63	177.1	0	0	0	109.4	F238 N285 A294 Y304 T420	F238-L296 HydrophobicContact CD1-CD2 3.91Å; F238-L296 HydrophobicContact CD2-CD2 4.18Å; F238-L296 HydrophobicContact CE1-CD2 3.56Å; F238-L296 HydrophobicContact CE2-CD2 3.88Å; F238-L296 HydrophobicContact CG-CD2 4.19Å; F238-L296 HydrophobicContact CZ-CD2 3.53Å; N285-L296 PolarHBondContact ND2-O 3.19Å; N285-L296 PolarHBondContact OD1-N 3.46Å; A294-L296 PolarHBondContact O-N 2.78Å; L296-Y304 HydrophobicContact CB-CE1 3.95Å; L296-Y304 HydrophobicContact CB-CE2 4.05Å; L296-Y304 HydrophobicContact CD1-CD1 3.76Å; L296-Y304 HydrophobicContact CD1-CE1 3.81Å; L296-Y304 HydrophobicContact CD1-CG 4.28Å; L296-Y304 HydrophobicContact CD2-CE1 3.89Å; L296-Y304 HydrophobicContact CG-CE1 4.08Å; L296-T420 HydrophobicContact CD1-CG2 3.8Å
297	S	76.9	Confident	73.1	Confident	80 Å²	80	58.4 Å²	58.4	56%	0.559	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-81.8	141.4	-176.3	-61.5	0	0	0	0	112.2	E299 Y304	S297-E299 VanDerWaalsContact C-N 3.31Å; S297-E299 PolarHBondContact O-N 3.33Å; S297-Y304 WeakPolarHBondContact O-CE2 3.29Å; S297-Y304 PolarHBondContact O-OH 2.78Å
298	D	70.6	Confident	73	Confident	139 Å²	139	60 Å²	60	74%	0.743	34%	0.338	S	S	*	.			trans	-81.7	72.4	-178.2	-144.8	-28	0	0	0	111.9	K577	D298-K577 IonicContact OD1-NZ 3.4Å; D298-K577 PolarHBondContact OD1-NZ 3.32Å
299	E	72.4	Confident	73	Confident	67 Å²	67	60 Å²	60	31%	0.313	34%	0.337	S	S	.	.			trans	-68.8	141.6	179.9	-61.9	171.5	178	0	0	111.6	S297 N301 S302 Q422 K577	S297-E299 VanDerWaalsContact C-N 3.31Å; S297-E299 PolarHBondContact O-N 3.33Å; E299-N301 VanDerWaalsContact C-N 3.25Å; E299-N301 PolarHBondContact O-N 2.74Å; E299-S302 WeakPolarHBondContact CB-OG 3.36Å; E299-S302 VanDerWaalsContact OE2-CB 3.31Å; E299-S302 WeakPolarHBondContact OE2-CB 3.38Å; E299-S302 PolarHBondContact OE2-OG 3.14Å; E299-Q422 VanDerWaalsContact CD-NE2 3.28Å; E299-Q422 PolarHBondContact OE1-NE2 2.76Å; E299-Q422 PolarHBondContact OE2-NE2 3.25Å; E299-K577 PolarHBondContact O-NZ 2.79Å
300	P	68.4	Low	73.2	Confident	95 Å²	95	59.5 Å²	59.5	62%	0.617	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-20.1	-177.5	29.6	-36.1	0	0	0	113.7
301	N	73.9	Confident	73.9	Confident	35 Å²	35	52.8 Å²	52.8	19%	0.187	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	9.8	-175.7	68.7	-60.8	0	0	0	113.6	V198 E299 I425	V198-N301 HydrophobicContact CG1-CB 4.11Å; V198-N301 HydrophobicContact CG2-CB 4.13Å; E299-N301 VanDerWaalsContact C-N 3.25Å; E299-N301 PolarHBondContact O-N 2.74Å; N301-I425 PolarHBondContact ND2-O 2.8Å; N301-I425 PolarHBondContact O-N 3.25Å
302	S	80.1	Confident	74.9	Confident	1 Å²	1	47 Å²	47	1%	0.007	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	161.7	171.2	77.4	0	0	0	0	112.8	E299 Q422 I423 S424	E299-S302 WeakPolarHBondContact CB-OG 3.36Å; E299-S302 VanDerWaalsContact OE2-CB 3.31Å; E299-S302 WeakPolarHBondContact OE2-CB 3.38Å; E299-S302 PolarHBondContact OE2-OG 3.14Å; S302-Q422 PolarHBondContact OG-NE2 2.77Å; S302-I423 VanDerWaalsContact CA-O 3.27Å; S302-I423 WeakPolarHBondContact CA-O 3.27Å; S302-I423 WeakPolarHBondContact CB-O 3.3Å; S302-S424 WeakPolarHBondContact CB-OG 3.38Å
303	F	85.6	Confident	75.6	Confident	11 Å²	11	43.9 Å²	43.9	5%	0.048	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	162.9	175.9	60.6	-81.7	0	0	0	109.3	L311 I423 I425 W576 G580	F303-L311 HydrophobicContact CE2-CD2 3.93Å; F303-L311 HydrophobicContact CZ-CD2 3.66Å; F303-I423 WeakPolarHBondContact CD1-O 3.27Å; F303-I423 HydrophobicContact CE1-CB 4.05Å; F303-I423 HydrophobicContact CE1-CG2 4Å; F303-I423 HydrophobicContact CE2-CB 4.1Å; F303-I423 HydrophobicContact CE2-CD1 4.2Å; F303-I423 HydrophobicContact CZ-CB 3.85Å; F303-I423 HydrophobicContact CZ-CD1 4.37Å; F303-I423 HydrophobicContact CZ-CG2 3.85Å; F303-I423 PolarHBondContact N-O 2.77Å; F303-I423 VanDerWaalsContact N-O 3.1Å; F303-I423 PolarHBondContact O-N 3Å; F303-I425 HydrophobicContact CD1-CD1 4.46Å; F303-I425 HydrophobicContact CE1-CD1 4.03Å; F303-I425 HydrophobicContact CE1-CG1 4.28Å; F303-W576 HydrophobicContact CE1-CE3 4.33Å; F303-G580 VanDerWaalsContact CE2-C 3.46Å; F303-G580 VanDerWaalsContact CE2-O 3.24Å; F303-G580 WeakPolarHBondContact CE2-O 3.41Å
304	Y	86.2	Confident	75.8	Confident	33 Å²	33	47.3 Å²	47.3	13%	0.129	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136	-172.5	-62.5	-81.2	0	0	0	111.4	F238 L284 L296 S297 T420 F421 Q422	F238-Y304 HydrophobicContact CE2-CE1 4.39Å; L284-Y304 HydrophobicContact CD1-CD2 4.24Å; L284-Y304 HydrophobicContact CD1-CG 4.4Å; L284-Y304 HydrophobicContact CD2-CG 4.36Å; L296-Y304 HydrophobicContact CB-CE1 3.95Å; L296-Y304 HydrophobicContact CB-CE2 4.05Å; L296-Y304 HydrophobicContact CD1-CD1 3.76Å; L296-Y304 HydrophobicContact CD1-CE1 3.81Å; L296-Y304 HydrophobicContact CD1-CG 4.28Å; L296-Y304 HydrophobicContact CD2-CE1 3.89Å; L296-Y304 HydrophobicContact CG-CE1 4.08Å; S297-Y304 WeakPolarHBondContact O-CE2 3.29Å; S297-Y304 PolarHBondContact O-OH 2.78Å; Y304-T420 HydrophobicContact CD1-CG2 4.35Å; Y304-F421 CarbonylContact C-O 3.57Å; Y304-F421 WeakPolarHBondContact CA-O 3.42Å; Y304-Q422 HydrophobicContact CD1-CB 3.62Å; Y304-Q422 HydrophobicContact CD1-CG 3.9Å; Y304-Q422 HydrophobicContact CE1-CB 3.43Å; Y304-Q422 VanDerWaalsContact CE1-CB 3.43Å; Y304-Q422 HydrophobicContact CE1-CG 3.38Å; Y304-Q422 PolarHBondContact OH-NE2 3.15Å
305	C	85.7	Confident	76	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	131.3	179.7	-56.7	0	0	0	0	111.8	I312 F421 C581	C305-I312 HydrophobicContact CB-CD1 3.59Å; C305-I312 HydrophobicContact CB-CG1 4.48Å; C305-F421 PolarHBondContact N-O 3.33Å; C305-F421 PolarHBondContact O-N 3.09Å; C305-C581 WeakPolarHBondContact CA-SG 3.31Å; C305-C581 HydrophobicContact CB-CB 3.99Å; C305-C581 WeakPolarHBondContact CB-SG 3.45Å; C305-C581 WeakPolarHBondContact SG-CB 3.39Å; C305-C581 CovalentContact SG-SG 2.03Å; C305-C581 PolarHBondContact SG-SG 3.2Å
306	T	80.7	Confident	75.9	Confident	20 Å²	20	38.9 Å²	38.9	12%	0.123	21%	0.21	C	C	.	.			trans	-124.9	22.4	176.3	49.1	0	0	0	0	111.3	L284 T420	L284-T306 HydrophobicContact CD2-CG2 3.79Å; T306-T420 HydrophobicContact CG2-CG2 3.94Å
307	R	75.9	Confident	75.5	Confident	56 Å²	56	40.5 Å²	40.5	21%	0.211	23%	0.23	C	C	.	.	S	Bend	trans	-145.8	145.4	179.2	-63.8	177.3	-179	155.4	8.1	109.5	L260 E281 T309 I312 V320	L260-R307 HydrophobicContact CD1-CB 4.49Å; L260-R307 HydrophobicContact CD1-CG 4.34Å; L260-R307 HydrophobicContact CD2-CG 4.21Å; E281-R307 IonicContact OE1-CZ 2.6Å; E281-R307 IonicContact OE1-NH1 3.66Å; E281-R307 IonicContact OE1-NH2 2.63Å; E281-R307 PolarHBondContact OE1-NH2 2.83Å; R307-T309 PolarHBondContact O-N 3.07Å; R307-I312 WeakPolarHBondContact O-CD1 3.22Å; R307-V320 VanDerWaalsContact C-CG2 3.43Å
308	D	72.7	Confident	75.4	Confident	73 Å²	73	38.2 Å²	38.2	39%	0.39	21%	0.21	S	C	.	.			trans	-59.8	132.5	169.9	-74.2	-51.3	0	0	0	110.4	N313 Y319 V320	D308-N313 WeakPolarHBondContact CA-OD1 3.35Å; D308-N313 WeakPolarHBondContact CB-OD1 3.26Å; D308-N313 VanDerWaalsContact CG-ND2 3.32Å; D308-N313 PolarHBondContact OD1-ND2 3.21Å; D308-N313 PolarHBondContact OD1-OD1 3.42Å; D308-Y319 WeakPolarHBondContact OD1-CA 3.19Å; D308-V320 PolarHBondContact OD1-N 3.23Å
309	T	73.6	Confident	75.6	Confident	8 Å²	8	38 Å²	38	5%	0.049	20%	0.2	C	C	.	.			trans	-149.9	156.7	177.4	62.4	0	0	0	0	109.3	R307 L311 I312 N313 C581	R307-T309 PolarHBondContact O-N 3.07Å; T309-L311 PolarHBondContact O-N 3.48Å; T309-I312 PolarHBondContact O-N 2.55Å; T309-N313 PolarHBondContact N-OD1 2.9Å; T309-N313 PolarHBondContact O-N 3.32Å; T309-N313 PolarHBondContact O-OD1 3.34Å; T309-C581 WeakPolarHBondContact CB-O 3.33Å; T309-C581 HydrophobicContact CG2-CB 3.73Å; T309-C581 PolarHBondContact OG1-O 3.5Å
310	P	71.4	Confident	75.7	Confident	46 Å²	46	35.2 Å²	35.2	30%	0.299	19%	0.187	S	C	.	.	H	α-helix	trans	-51.2	-31	179.2	-31.2	38	0	0	0	114.5	I312 E314 I315 F586	P310-I312 PolarHBondContact O-N 3.19Å; P310-E314 WeakPolarHBondContact CB-OE1 3.28Å; P310-E314 WeakPolarHBondContact O-CA 3.46Å; P310-E314 WeakPolarHBondContact O-CB 3.35Å; P310-E314 PolarHBondContact O-N 2.95Å; P310-I315 PolarHBondContact O-N 3.31Å; P310-F586 HydrophobicContact CB-CD2 4.29Å; P310-F586 HydrophobicContact CB-CE2 3.97Å
311	L	75	Confident	75.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.1	-31.8	175.4	167.3	59.7	0	0	0	113.5	L233 F303 T309 I315 F316 I423 I585	L233-L311 HydrophobicContact CD1-CD1 4.02Å; F303-L311 HydrophobicContact CE2-CD2 3.93Å; F303-L311 HydrophobicContact CZ-CD2 3.66Å; T309-L311 PolarHBondContact O-N 3.48Å; L311-I315 HydrophobicContact CD1-CD1 4.28Å; L311-I315 WeakPolarHBondContact O-CB 3.25Å; L311-F316 HydrophobicContact CD1-CD2 4.46Å; L311-F316 HydrophobicContact CD1-CE2 4Å; L311-F316 WeakPolarHBondContact O-CD2 3.34Å; L311-I423 HydrophobicContact CD1-CD1 4.24Å; L311-I423 HydrophobicContact CD2-CD1 3.5Å; L311-I423 HydrophobicContact CD2-CG2 4.42Å; L311-I423 HydrophobicContact CG-CD1 3.63Å; L311-I585 HydrophobicContact CB-CD1 4.22Å; L311-I585 HydrophobicContact CD1-CD1 3.63Å; L311-I585 HydrophobicContact CD2-CD1 4.46Å; L311-I585 HydrophobicContact CG-CD1 4.3Å
312	I	77.1	Confident	75.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-88.5	-52.7	177	-48.2	174.8	0	0	0	109.2	L235 C305 R307 T309 P310 F316 G317 E318 V320 F421 I423	L235-I312 HydrophobicContact CD1-CG2 4.25Å; C305-I312 HydrophobicContact CB-CD1 3.59Å; C305-I312 HydrophobicContact CB-CG1 4.48Å; R307-I312 WeakPolarHBondContact O-CD1 3.22Å; T309-I312 PolarHBondContact O-N 2.55Å; P310-I312 PolarHBondContact O-N 3.19Å; I312-F316 CarbonylContact O-C 3.56Å; I312-F316 WeakPolarHBondContact O-CA 3.46Å; I312-F316 WeakPolarHBondContact O-CB 3.17Å; I312-F316 PolarHBondContact O-N 3.24Å; I312-F316 VanDerWaalsContact O-N 3.13Å; I312-G317 PolarHBondContact O-N 2.94Å; I312-E318 HydrophobicContact CG2-CB 3.8Å; I312-E318 WeakPolarHBondContact CG2-O 3.22Å; I312-E318 PolarHBondContact O-N 3.46Å; I312-V320 HydrophobicContact CD1-CG2 3.91Å; I312-F421 HydrophobicContact CD1-CD2 4.01Å; I312-F421 HydrophobicContact CG2-CD2 3.89Å; I312-F421 HydrophobicContact CG2-CE2 3.93Å; I312-F421 HydrophobicContact CG2-CG 4.39Å; I312-F421 HydrophobicContact CG2-CZ 4.46Å; I312-I423 HydrophobicContact CG1-CD1 4.43Å
313	N	75.6	Confident	75.4	Confident	31 Å²	31	43 Å²	43	17%	0.166	22%	0.218	C	C	.	.	H	α-helix	trans	-76.1	-45.9	-167.8	-56.4	65.4	0	0	0	112.5	D308 T309 G317 E318 Y319	D308-N313 WeakPolarHBondContact CA-OD1 3.35Å; D308-N313 WeakPolarHBondContact CB-OD1 3.26Å; D308-N313 VanDerWaalsContact CG-ND2 3.32Å; D308-N313 PolarHBondContact OD1-ND2 3.21Å; D308-N313 PolarHBondContact OD1-OD1 3.42Å; T309-N313 PolarHBondContact N-OD1 2.9Å; T309-N313 PolarHBondContact O-N 3.32Å; T309-N313 PolarHBondContact O-OD1 3.34Å; N313-G317 WeakPolarHBondContact O-CA 3.25Å; N313-G317 PolarHBondContact O-N 3.18Å; N313-E318 WeakPolarHBondContact CA-O 3.25Å; N313-Y319 HydrophobicContact CB-CE1 4.34Å; N313-Y319 WeakPolarHBondContact ND2-CD1 3.15Å; N313-Y319 VanDerWaalsContact ND2-CE1 3.3Å; N313-Y319 WeakPolarHBondContact ND2-CE1 3.14Å
314	E	67.7	Low	74.8	Confident	98 Å²	98	44.8 Å²	44.8	46%	0.458	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-26.1	-176.8	-60.4	-177	-119.3	0	0	113.7	P310 F586	P310-E314 WeakPolarHBondContact CB-OE1 3.28Å; P310-E314 WeakPolarHBondContact O-CA 3.46Å; P310-E314 WeakPolarHBondContact O-CB 3.35Å; P310-E314 PolarHBondContact O-N 2.95Å; E314-F586 HydrophobicContact CB-CE2 3.73Å; E314-F586 HydrophobicContact CB-CZ 3.49Å; E314-F586 VanDerWaalsContact CB-CZ 3.49Å; E314-F586 HydrophobicContact CG-CE2 4.33Å; E314-F586 HydrophobicContact CG-CZ 4.42Å
315	I	70.7	Confident	73.9	Confident	6 Å²	6	45.4 Å²	45.4	3%	0.031	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-41.7	-176.5	-58.6	-177.9	0	0	0	112.5	P310 L311 V550 T561 I563 I585 F586	P310-I315 PolarHBondContact O-N 3.31Å; L311-I315 HydrophobicContact CD1-CD1 4.28Å; L311-I315 WeakPolarHBondContact O-CB 3.25Å; I315-V550 HydrophobicContact CG2-CG2 4.41Å; I315-T561 HydrophobicContact CG2-CG2 3.88Å; I315-I563 HydrophobicContact CD1-CD1 3.96Å; I315-I563 HydrophobicContact CG2-CD1 4.3Å; I315-I585 HydrophobicContact CD1-CB 3.94Å; I315-I585 HydrophobicContact CD1-CD1 3.57Å; I315-I585 HydrophobicContact CD1-CG1 4.34Å; I315-I585 HydrophobicContact CD1-CG2 3.71Å; I315-F586 HydrophobicContact CD1-CE2 4.2Å; I315-F586 HydrophobicContact CD1-CZ 4.08Å; I315-F586 HydrophobicContact CG1-CE1 4.4Å; I315-F586 HydrophobicContact CG1-CE2 3.97Å; I315-F586 HydrophobicContact CG1-CZ 3.53Å
316	F	74.3	Confident	72.5	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.035	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-22.7	178.9	-71	-68.7	0	0	0	113.6	L233 L235 L311 I312 E318 A559 T561	L233-F316 HydrophobicContact CB-CZ 3.99Å; L235-F316 HydrophobicContact CB-CD1 3.86Å; L235-F316 HydrophobicContact CB-CD2 3.76Å; L235-F316 HydrophobicContact CB-CE1 3.66Å; L235-F316 HydrophobicContact CB-CE2 3.59Å; L235-F316 HydrophobicContact CB-CG 3.9Å; L235-F316 HydrophobicContact CB-CZ 3.52Å; L235-F316 HydrophobicContact CD1-CB 3.96Å; L235-F316 HydrophobicContact CD1-CD1 4.49Å; L235-F316 HydrophobicContact CD1-CD2 3.5Å; L235-F316 HydrophobicContact CD1-CE2 4.09Å; L235-F316 HydrophobicContact CD1-CG 3.74Å; L235-F316 HydrophobicContact CG-CD2 4.27Å; L235-F316 HydrophobicContact CG-CE2 4.5Å; L235-F316 HydrophobicContact CG-CG 4.36Å; L311-F316 HydrophobicContact CD1-CD2 4.46Å; L311-F316 HydrophobicContact CD1-CE2 4Å; L311-F316 WeakPolarHBondContact O-CD2 3.34Å; I312-F316 CarbonylContact O-C 3.56Å; I312-F316 WeakPolarHBondContact O-CA 3.46Å; I312-F316 WeakPolarHBondContact O-CB 3.17Å; I312-F316 PolarHBondContact O-N 3.24Å; I312-F316 VanDerWaalsContact O-N 3.13Å; F316-E318 VanDerWaalsContact C-N 3.27Å; F316-A559 HydrophobicContact CD1-CB 3.65Å; F316-A559 HydrophobicContact CE1-CB 4.09Å; F316-T561 HydrophobicContact CD1-CG2 4.42Å; F316-T561 HydrophobicContact CE1-CG2 3.59Å; F316-T561 HydrophobicContact CE2-CG2 4.46Å; F316-T561 HydrophobicContact CZ-CG2 3.62Å
317	G	70.9	Confident	71.1	Confident	44 Å²	44	55.6 Å²	55.6	45%	0.454	29%	0.292	S	S	.	.			trans	76.5	12.9	-176.7	0	0	0	0	0	114	I312 N313	I312-G317 PolarHBondContact O-N 2.94Å; N313-G317 WeakPolarHBondContact O-CA 3.25Å; N313-G317 PolarHBondContact O-N 3.18Å
318	E	75.2	Confident	69.7	Low	31 Å²	31	58.4 Å²	58.4	15%	0.145	31%	0.307	C	S	.	.			trans	-93.9	159.4	177.2	-80	-85.1	-167.4	0	0	110.3	L235 R239 I312 N313 F316 F421	L235-E318 HydrophobicContact CD2-CG 4.43Å; R239-E318 IonicContact NH2-OE1 3.01Å; R239-E318 PolarHBondContact NH2-OE1 3.36Å; I312-E318 HydrophobicContact CG2-CB 3.8Å; I312-E318 WeakPolarHBondContact CG2-O 3.22Å; I312-E318 PolarHBondContact O-N 3.46Å; N313-E318 WeakPolarHBondContact CA-O 3.25Å; F316-E318 VanDerWaalsContact C-N 3.27Å; E318-F421 HydrophobicContact CB-CE1 3.93Å; E318-F421 HydrophobicContact CB-CE2 4.42Å; E318-F421 HydrophobicContact CB-CZ 3.72Å; E318-F421 HydrophobicContact CG-CE1 4.02Å; E318-F421 HydrophobicContact CG-CZ 4.22Å
319	Y	75.6	Confident	68.4	Low	135 Å²	135	59.4 Å²	59.4	53%	0.529	32%	0.315	S	S	.	.			trans	-135.9	143.7	-178.3	-67.8	-99.9	0	0	0	111.4	D308 N313 N321 N419	D308-Y319 WeakPolarHBondContact OD1-CA 3.19Å; N313-Y319 HydrophobicContact CB-CE1 4.34Å; N313-Y319 WeakPolarHBondContact ND2-CD1 3.15Å; N313-Y319 VanDerWaalsContact ND2-CE1 3.3Å; N313-Y319 WeakPolarHBondContact ND2-CE1 3.14Å; Y319-N321 PolarHBondContact O-N 3.34Å; Y319-N419 PolarHBondContact O-ND2 3.1Å
320	V	73.4	Confident	67.5	Low	9 Å²	9	60.4 Å²	60.4	6%	0.055	32%	0.323	C	S	.	.			trans	-89.6	74.9	179.9	-167.3	0	0	0	0	110.6	R307 D308 I312 E322 F421	R307-V320 VanDerWaalsContact C-CG2 3.43Å; D308-V320 PolarHBondContact OD1-N 3.23Å; I312-V320 HydrophobicContact CD1-CG2 3.91Å; V320-E322 HydrophobicContact CG1-CG 3.73Å; V320-E322 PolarHBondContact O-N 3.46Å; V320-F421 HydrophobicContact CG2-CD2 3.84Å; V320-F421 HydrophobicContact CG2-CE2 3.74Å
321	N	70.1	Confident	67.1	Low	117 Å²	117	60 Å²	60	63%	0.626	32%	0.321	S	S	*	.			trans	-63.7	106.1	166.8	-72.7	-22.6	0	0	0	109.9	Y319 G418	Y319-N321 PolarHBondContact O-N 3.34Å; N321-G418 VanDerWaalsContact O-CA 3.22Å; N321-G418 WeakPolarHBondContact O-CA 3.43Å
322	E	73.5	Confident	66.8	Low	42 Å²	42	60.2 Å²	60.2	20%	0.196	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	139.1	169.6	-54	-151.7	140	0	0	110.8	R282 V320 M416 D417	R282-E322 IonicContact CZ-OE1 3.64Å; R282-E322 IonicContact NE-OE1 2.71Å; R282-E322 PolarHBondContact NE-OE1 2.87Å; R282-E322 IonicContact NH2-OE1 4Å; R282-E322 PolarHBondContact NH2-OE1 3.37Å; V320-E322 HydrophobicContact CG1-CG 3.73Å; V320-E322 PolarHBondContact O-N 3.46Å; E322-M416 HydrophobicContact CB-CE 4.12Å; E322-M416 WeakPolarHBondContact OE2-CE 3.44Å; E322-D417 CarbonylContact C-O 3.6Å; E322-D417 WeakPolarHBondContact CA-O 3.16Å
323	Q	73.4	Confident	66.5	Low	135 Å²	135	62 Å²	62	63%	0.631	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	132	175.8	-65.1	-175.4	-12.2	0	0	109.1	V325 M416 D417	Q323-V325 PolarHBondContact O-N 3.06Å; Q323-M416 WeakPolarHBondContact O-CA 3.29Å; Q323-D417 PolarHBondContact N-O 3.04Å; Q323-D417 PolarHBondContact O-N 2.94Å
324	I	72.2	Confident	66.3	Low	49 Å²	49	63 Å²	63	25%	0.251	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	117.8	169.2	-58.7	-168.9	0	0	0	107.7	Y269 Y280 Q326 V414 M416	Y269-I324 WeakPolarHBondContact OH-CD1 3.15Å; Y280-I324 HydrophobicContact CD2-CD1 4.48Å; Y280-I324 HydrophobicContact CE2-CD1 4.47Å; I324-Q326 PolarHBondContact O-N 2.87Å; I324-V414 HydrophobicContact CD1-CG2 4.31Å; I324-V414 HydrophobicContact CG2-CB 4.14Å; I324-V414 HydrophobicContact CG2-CG1 4.34Å; I324-M416 HydrophobicContact CG1-CG 4.26Å
325	V	66.5	Low	66.8	Low	45 Å²	45	62 Å²	62	27%	0.273	33%	0.332	S	S	.	.			trans	-72.5	88.6	169.5	-176.7	0	0	0	0	107.1	Q242 Q323 S327 C415 D417	Q242-V325 HydrophobicContact CG-CG2 4.37Å; Q323-V325 PolarHBondContact O-N 3.06Å; V325-S327 PolarHBondContact O-N 3.24Å; V325-S327 VanDerWaalsContact O-N 3.13Å; V325-C415 HydrophobicContact CB-CB 4.2Å; V325-C415 PolarHBondContact N-O 3.22Å; V325-D417 HydrophobicContact CG2-CB 3.48Å; V325-D417 VanDerWaalsContact CG2-CB 3.48Å
326	Q	56.9	Low	67.3	Low	137 Å²	137	64.7 Å²	64.7	64%	0.64	35%	0.345	S	S	*	.			trans	-53.1	119.1	160.6	-73.8	-173.3	-1.3	0	0	108	I324 H328	I324-Q326 PolarHBondContact O-N 2.87Å; Q326-H328 HydrophobicContact CB-CB 4.19Å; Q326-H328 PolarHBondContact O-N 3.16Å; Q326-H328 PolarHBondContact OE1-CD2 2.96Å
327	S	50.9	Low	67.6	Low	98 Å²	98	70.1 Å²	70.1	69%	0.685	37%	0.368	S	S	*	.			trans	-74.7	57.7	178.2	43.8	0	0	0	0	110.5	V325	V325-S327 PolarHBondContact O-N 3.24Å; V325-S327 VanDerWaalsContact O-N 3.13Å
328	H	47.4	Very low	68	Low	115 Å²	115	71.2 Å²	71.2	53%	0.532	36%	0.363	S	S	.	.			trans	-123.9	7.1	-163.1	-68.3	-6	0	0	0	115	Q326 K337	Q326-H328 HydrophobicContact CB-CB 4.19Å; Q326-H328 PolarHBondContact O-N 3.16Å; Q326-H328 PolarHBondContact OE1-CD2 2.96Å; H328-K337 PolarHBondContact O-NZ 2.69Å
329	T	46.3	Very low	68.4	Low	93 Å²	93	69.8 Å²	69.8	57%	0.571	36%	0.357	S	S	*	.			trans	-147.5	89.7	136.7	46.9	0	0	0	0	110.3	D333 T334	T329-D333 VanDerWaalsContact CA-OD2 3.31Å; T329-D333 WeakPolarHBondContact CA-OD2 2.85Å; T329-T334 WeakPolarHBondContact CB-OG1 3.45Å; T329-T334 WeakPolarHBondContact CG2-OG1 3.47Å
330	S	54.4	Low	68.7	Low	29 Å²	29	65.8 Å²	65.8	20%	0.203	35%	0.349	C	S	.	.			trans	-59	155.1	147.4	96.3	0	0	0	0	108.3	C332 D333 T334	S330-C332 PolarHBondContact O-N 2.99Å; S330-C332 VanDerWaalsContact OG-CB 3.3Å; S330-C332 WeakPolarHBondContact OG-CB 3.41Å; S330-C332 PolarHBondContact OG-N 2.8Å; S330-D333 VanDerWaalsContact CB-OD1 3.3Å; S330-D333 WeakPolarHBondContact CB-OD1 3.38Å; S330-D333 VanDerWaalsContact N-CG 3.32Å; S330-D333 PolarHBondContact N-OD2 3.38Å; S330-D333 PolarHBondContact O-N 3.24Å; S330-D333 VanDerWaalsContact OG-CG 3.31Å; S330-D333 PolarHBondContact OG-N 3.47Å; S330-D333 PolarHBondContact OG-OD1 3.36Å; S330-T334 PolarHBondContact O-N 2.78Å
331	S	62.4	Low	69	Low	37 Å²	37	72.3 Å²	72.3	26%	0.259	38%	0.376	S	S	.	.	H	α-helix	trans	-54.8	-33	176.6	65.8	0	0	0	0	111.2	R290 T334 Y335	R290-S331 PolarHBondContact NH1-OG 2.98Å; S331-T334 PolarHBondContact O-N 3.3Å; S331-Y335 WeakPolarHBondContact O-CB 3.42Å; S331-Y335 WeakPolarHBondContact O-CD2 3.37Å; S331-Y335 PolarHBondContact O-N 2.8Å
332	C	69.5	Low	69.5	Low	6 Å²	6	68.4 Å²	68.4	4%	0.041	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-31	177.1	-48.8	0	0	0	0	113.1	S330 E336 C400	S330-C332 PolarHBondContact O-N 2.99Å; S330-C332 VanDerWaalsContact OG-CB 3.3Å; S330-C332 WeakPolarHBondContact OG-CB 3.41Å; S330-C332 PolarHBondContact OG-N 2.8Å; C332-E336 WeakPolarHBondContact O-CA 3.47Å; C332-E336 WeakPolarHBondContact O-CB 3.38Å; C332-E336 PolarHBondContact O-N 3.03Å; C332-C400 VanDerWaalsContact CA-SG 3.54Å; C332-C400 HydrophobicContact CB-CB 3.57Å; C332-C400 WeakPolarHBondContact CB-SG 3.24Å; C332-C400 WeakPolarHBondContact SG-CA 3.31Å; C332-C400 WeakPolarHBondContact SG-CB 3.18Å; C332-C400 CovalentContact SG-SG 2.03Å; C332-C400 PolarHBondContact SG-SG 2.84Å
333	D	69.5	Low	69.7	Low	38 Å²	38	69 Å²	69	20%	0.203	36%	0.36	C	S	.	.	H	α-helix	trans	-76.9	-34.3	177	-35.3	-13.7	0	0	0	110	T329 S330 E336 K337	T329-D333 VanDerWaalsContact CA-OD2 3.31Å; T329-D333 WeakPolarHBondContact CA-OD2 2.85Å; S330-D333 VanDerWaalsContact CB-OD1 3.3Å; S330-D333 WeakPolarHBondContact CB-OD1 3.38Å; S330-D333 VanDerWaalsContact N-CG 3.32Å; S330-D333 PolarHBondContact N-OD2 3.38Å; S330-D333 PolarHBondContact O-N 3.24Å; S330-D333 VanDerWaalsContact OG-CG 3.31Å; S330-D333 PolarHBondContact OG-N 3.47Å; S330-D333 PolarHBondContact OG-OD1 3.36Å; D333-E336 PolarHBondContact O-N 3.31Å; D333-K337 VanDerWaalsContact O-CB 3.3Å; D333-K337 WeakPolarHBondContact O-CB 3.4Å; D333-K337 VanDerWaalsContact O-CG 3.22Å; D333-K337 WeakPolarHBondContact O-CG 3.46Å; D333-K337 PolarHBondContact O-N 3.16Å
334	T	72.1	Confident	69.9	Low	52 Å²	52	66.9 Å²	66.9	32%	0.319	35%	0.353	S	S	.	.	H	α-helix	trans	-68	-44.7	171.7	-52.9	0	0	0	0	110.2	T329 S330 S331 E336 K337 L338	T329-T334 WeakPolarHBondContact CB-OG1 3.45Å; T329-T334 WeakPolarHBondContact CG2-OG1 3.47Å; S330-T334 PolarHBondContact O-N 2.78Å; S331-T334 PolarHBondContact O-N 3.3Å; T334-E336 VanDerWaalsContact C-N 3.35Å; T334-K337 PolarHBondContact O-N 3.14Å; T334-L338 HydrophobicContact CG2-CD1 4Å; T334-L338 WeakPolarHBondContact O-CB 3.28Å; T334-L338 VanDerWaalsContact O-CG 3.28Å; T334-L338 WeakPolarHBondContact O-CG 3.33Å; T334-L338 PolarHBondContact O-N 2.8Å
335	Y	78	Confident	69.6	Low	77 Å²	77	70.6 Å²	70.6	30%	0.302	36%	0.364	S	S	.	.	H	α-helix	trans	-64.9	-36.3	173.2	-58.3	-38.1	0	0	0	111.9	S331 C339 V391	S331-Y335 WeakPolarHBondContact O-CB 3.42Å; S331-Y335 WeakPolarHBondContact O-CD2 3.37Å; S331-Y335 PolarHBondContact O-N 2.8Å; Y335-C339 WeakPolarHBondContact O-CA 3.39Å; Y335-C339 WeakPolarHBondContact O-CB 3.3Å; Y335-C339 PolarHBondContact O-N 2.82Å; Y335-V391 HydrophobicContact CD1-CG1 4.22Å
336	E	80.1	Confident	69.3	Low	62 Å²	62	72.3 Å²	72.3	29%	0.29	37%	0.37	S	S	.	.	H	α-helix	trans	-65.1	-49.3	173.9	-174.3	170.7	-126.6	0	0	110.6	C332 D333 T334 L338 C339 S340 Y395 K404	C332-E336 WeakPolarHBondContact O-CA 3.47Å; C332-E336 WeakPolarHBondContact O-CB 3.38Å; C332-E336 PolarHBondContact O-N 3.03Å; D333-E336 PolarHBondContact O-N 3.31Å; T334-E336 VanDerWaalsContact C-N 3.35Å; E336-L338 PolarHBondContact O-N 3.29Å; E336-C339 PolarHBondContact O-N 3.08Å; E336-S340 WeakPolarHBondContact O-CB 3.34Å; E336-S340 PolarHBondContact O-N 2.77Å; E336-S340 PolarHBondContact O-OG 2.78Å; E336-Y395 HydrophobicContact CB-CD2 3.69Å; E336-Y395 HydrophobicContact CB-CE2 3.56Å; E336-Y395 HydrophobicContact CB-CG 4.48Å; E336-Y395 HydrophobicContact CG-CD2 4.29Å; E336-Y395 HydrophobicContact CG-CE2 3.69Å; E336-Y395 PolarHBondContact OE1-OH 3.36Å; E336-Y395 VanDerWaalsContact OE1-OH 3.07Å; E336-K404 IonicContact OE1-NZ 3.87Å; E336-K404 PolarHBondContact OE1-NZ 3.43Å
337	K	80.4	Confident	69.7	Low	121 Å²	121	70.6 Å²	70.6	53%	0.526	37%	0.369	S	S	.	.	H	α-helix	trans	-60.7	-41.3	176.3	-75.4	166.9	-177.4	169.3	0	112.1	H328 D333 T334 K341	H328-K337 PolarHBondContact O-NZ 2.69Å; D333-K337 VanDerWaalsContact O-CB 3.3Å; D333-K337 WeakPolarHBondContact O-CB 3.4Å; D333-K337 VanDerWaalsContact O-CG 3.22Å; D333-K337 WeakPolarHBondContact O-CG 3.46Å; D333-K337 PolarHBondContact O-N 3.16Å; T334-K337 PolarHBondContact O-N 3.14Å; K337-K341 VanDerWaalsContact O-CB 3.29Å; K337-K341 WeakPolarHBondContact O-CB 3.26Å; K337-K341 VanDerWaalsContact O-CG 3.27Å; K337-K341 WeakPolarHBondContact O-CG 3.35Å; K337-K341 PolarHBondContact O-N 2.79Å
338	L	80.2	Confident	70	Confident	67 Å²	67	73 Å²	73	35%	0.351	37%	0.369	S	S	.	.	H	α-helix	trans	-75.7	-39.6	178.8	-70.8	171.7	0	0	0	112.6	T334 E336 K341 C342 V391	T334-L338 HydrophobicContact CG2-CD1 4Å; T334-L338 WeakPolarHBondContact O-CB 3.28Å; T334-L338 VanDerWaalsContact O-CG 3.28Å; T334-L338 WeakPolarHBondContact O-CG 3.33Å; T334-L338 PolarHBondContact O-N 2.8Å; E336-L338 PolarHBondContact O-N 3.29Å; L338-K341 PolarHBondContact O-N 2.73Å; L338-C342 PolarHBondContact O-N 3.19Å; L338-V391 HydrophobicContact CB-CG1 3.45Å; L338-V391 VanDerWaalsContact CB-CG1 3.45Å; L338-V391 HydrophobicContact CD1-CG1 4.33Å
339	C	83.5	Confident	70.2	Confident	2 Å²	2	72 Å²	72	1%	0.014	37%	0.368	C	S	.	.	H	α-helix	trans	-66.8	-43	175.6	-172.4	0	0	0	0	110.9	Y335 E336 C342 F343 V391 C392	Y335-C339 WeakPolarHBondContact O-CA 3.39Å; Y335-C339 WeakPolarHBondContact O-CB 3.3Å; Y335-C339 PolarHBondContact O-N 2.82Å; E336-C339 PolarHBondContact O-N 3.08Å; C339-C342 WeakPolarHBondContact O-CA 3.15Å; C339-C342 VanDerWaalsContact O-CB 3.31Å; C339-C342 WeakPolarHBondContact O-CB 3.47Å; C339-C342 PolarHBondContact O-N 3.45Å; C339-C342 VanDerWaalsContact O-N 3.11Å; C339-F343 WeakPolarHBondContact O-CD2 3.28Å; C339-F343 PolarHBondContact O-N 3.34Å; C339-F343 WeakPolarHBondContact SG-CE2 3.21Å; C339-V391 HydrophobicContact CB-CG1 4.37Å; C339-C392 WeakPolarHBondContact CA-SG 3.23Å; C339-C392 HydrophobicContact CB-CB 4.08Å; C339-C392 WeakPolarHBondContact CB-SG 3.29Å; C339-C392 VanDerWaalsContact SG-CA 3.57Å; C339-C392 WeakPolarHBondContact SG-CB 3.2Å; C339-C392 CovalentContact SG-SG 2.03Å; C339-C392 PolarHBondContact SG-SG 3.01Å
340	S	81.9	Confident	70.3	Confident	51 Å²	51	72.1 Å²	72.1	36%	0.357	37%	0.372	S	S	.	.	H	α-helix	trans	-63.8	-40.3	171.6	-55.9	0	0	0	0	111.9	E336 C342 F343 N344	E336-S340 WeakPolarHBondContact O-CB 3.34Å; E336-S340 PolarHBondContact O-N 2.77Å; E336-S340 PolarHBondContact O-OG 2.78Å; S340-C342 VanDerWaalsContact C-N 3.28Å; S340-C342 PolarHBondContact O-N 2.78Å; S340-F343 PolarHBondContact O-N 3.35Å; S340-N344 WeakPolarHBondContact O-CB 3.31Å; S340-N344 PolarHBondContact O-N 3.42Å; S340-N344 PolarHBondContact O-OD1 2.85Å
341	K	80.5	Confident	69.8	Low	145 Å²	145	79.4 Å²	79.4	63%	0.63	40%	0.4	S	S	*	.	H	α-helix	trans	-59.8	-38	170.1	-85.6	-179.6	174.3	-172.5	0	112.1	K337 L338 N344 R345	K337-K341 VanDerWaalsContact O-CB 3.29Å; K337-K341 WeakPolarHBondContact O-CB 3.26Å; K337-K341 VanDerWaalsContact O-CG 3.27Å; K337-K341 WeakPolarHBondContact O-CG 3.35Å; K337-K341 PolarHBondContact O-N 2.79Å; L338-K341 PolarHBondContact O-N 2.73Å; K341-N344 PolarHBondContact O-N 3.29Å; K341-R345 WeakPolarHBondContact O-CB 3.27Å; K341-R345 PolarHBondContact O-N 3.3Å
342	C	79.7	Confident	68.6	Low	36 Å²	36	83.2 Å²	83.2	24%	0.243	43%	0.426	C	S	.	.	H	α-helix	trans	-64.9	-48.6	175.6	-163	0	0	0	0	111.3	L338 C339 S340 N344 R345 M346 C386	L338-C342 PolarHBondContact O-N 3.19Å; C339-C342 WeakPolarHBondContact O-CA 3.15Å; C339-C342 VanDerWaalsContact O-CB 3.31Å; C339-C342 WeakPolarHBondContact O-CB 3.47Å; C339-C342 PolarHBondContact O-N 3.45Å; C339-C342 VanDerWaalsContact O-N 3.11Å; S340-C342 VanDerWaalsContact C-N 3.28Å; S340-C342 PolarHBondContact O-N 2.78Å; C342-N344 PolarHBondContact O-N 2.77Å; C342-R345 PolarHBondContact O-N 3.24Å; C342-M346 WeakPolarHBondContact O-CB 3.46Å; C342-M346 WeakPolarHBondContact O-CG 3.41Å; C342-M346 PolarHBondContact O-N 3.29Å; C342-C386 HydrophobicContact CB-CB 3.81Å; C342-C386 WeakPolarHBondContact CB-SG 3.05Å; C342-C386 PolarHBondContact O-SG 2.79Å; C342-C386 VanDerWaalsContact O-SG 3.36Å; C342-C386 WeakPolarHBondContact SG-CA 3.17Å; C342-C386 WeakPolarHBondContact SG-CB 2.98Å; C342-C386 CovalentContact SG-SG 2.04Å; C342-C386 PolarHBondContact SG-SG 3.46Å
343	F	78.8	Confident	67.2	Low	53 Å²	53	90.3 Å²	90.3	23%	0.232	46%	0.463	C	S	.	.	H	α-helix	trans	-59.6	-43.2	174.3	-71.7	-58.9	0	0	0	112.4	C339 S340 M346 T347 I384 C386 Y387	C339-F343 WeakPolarHBondContact O-CD2 3.28Å; C339-F343 PolarHBondContact O-N 3.34Å; C339-F343 WeakPolarHBondContact SG-CE2 3.21Å; S340-F343 PolarHBondContact O-N 3.35Å; F343-M346 WeakPolarHBondContact O-CB 3.33Å; F343-M346 PolarHBondContact O-N 3.48Å; F343-T347 PolarHBondContact O-N 2.79Å; F343-T347 PolarHBondContact O-OG1 3.36Å; F343-I384 HydrophobicContact CE1-CG2 3.9Å; F343-C386 HydrophobicContact CD1-CB 4.36Å; F343-C386 HydrophobicContact CE1-CB 4.22Å; F343-Y387 AromaticContact CE1-CD2 3.95Å; F343-Y387 HydrophobicContact CE1-CD2 3.95Å; F343-Y387 HydrophobicContact CE1-CE2 4.06Å; F343-Y387 AromaticContact CZ-CD2 3.71Å; F343-Y387 HydrophobicContact CZ-CD2 3.71Å; F343-Y387 AromaticContact CZ-CE2 3.63Å; F343-Y387 HydrophobicContact CZ-CE2 3.63Å; F343-Y387 HydrophobicContact CZ-CG 4.38Å
344	N	76	Confident	65.5	Low	92 Å²	92	93.8 Å²	93.8	49%	0.492	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-46	178.2	-69.6	8.5	0	0	0	111.6	S340 K341 C342 M346 T347 E348	S340-N344 WeakPolarHBondContact O-CB 3.31Å; S340-N344 PolarHBondContact O-N 3.42Å; S340-N344 PolarHBondContact O-OD1 2.85Å; K341-N344 PolarHBondContact O-N 3.29Å; C342-N344 PolarHBondContact O-N 2.77Å; N344-M346 PolarHBondContact O-N 3.24Å; N344-T347 WeakPolarHBondContact CA-OG1 3.46Å; N344-T347 PolarHBondContact O-N 3.22Å; N344-T347 PolarHBondContact O-OG1 3.46Å; N344-E348 WeakPolarHBondContact O-CB 3.45Å; N344-E348 WeakPolarHBondContact O-CG 3.36Å; N344-E348 PolarHBondContact O-N 3.01Å
345	R	66	Low	63.9	Low	127 Å²	127	100.4 Å²	100.4	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-61.9	-29.4	173.8	-111.8	-177.5	-179.9	174.8	2.1	112.1	K341 C342 N349	K341-R345 WeakPolarHBondContact O-CB 3.27Å; K341-R345 PolarHBondContact O-N 3.3Å; C342-R345 PolarHBondContact O-N 3.24Å; R345-N349 VanDerWaalsContact O-CB 3.23Å; R345-N349 WeakPolarHBondContact O-CB 3.3Å; R345-N349 PolarHBondContact O-N 2.98Å; R345-N349 PolarHBondContact O-ND2 2.67Å
346	M	61.9	Low	61.8	Low	80 Å²	80	107.6 Å²	107.6	39%	0.394	54%	0.543	S	S	.	.	H	α-helix	trans	-73.1	-40.8	173.3	-77.8	-82.7	-83.3	0	0	112.5	C342 F343 N344 N349 S350 I384 C386	C342-M346 WeakPolarHBondContact O-CB 3.46Å; C342-M346 WeakPolarHBondContact O-CG 3.41Å; C342-M346 PolarHBondContact O-N 3.29Å; F343-M346 WeakPolarHBondContact O-CB 3.33Å; F343-M346 PolarHBondContact O-N 3.48Å; N344-M346 PolarHBondContact O-N 3.24Å; M346-N349 CarbonylContact O-C 3.57Å; M346-N349 PolarHBondContact O-N 3.21Å; M346-S350 PolarHBondContact O-N 2.9Å; M346-I384 HydrophobicContact CE-CG2 4.49Å; M346-C386 VanDerWaalsContact CG-SG 3.55Å
347	T	63.4	Low	59.6	Low	101 Å²	101	110.8 Å²	110.8	62%	0.62	56%	0.56	S	S	*	*	H	α-helix	trans	-70.7	-32.9	175.3	46.6	0	0	0	0	112.8	F343 N344 S350	F343-T347 PolarHBondContact O-N 2.79Å; F343-T347 PolarHBondContact O-OG1 3.36Å; N344-T347 WeakPolarHBondContact CA-OG1 3.46Å; N344-T347 PolarHBondContact O-N 3.22Å; N344-T347 PolarHBondContact O-OG1 3.46Å; T347-S350 WeakPolarHBondContact O-CB 3.39Å; T347-S350 PolarHBondContact O-OG 3.16Å
348	E	58.3	Low	57.7	Low	149 Å²	149	111.1 Å²	111.1	70%	0.696	57%	0.567	S	S	*	*	H	α-helix	trans	-71.2	-40.3	172.8	-71.7	171.3	170.9	0	0	111.8	N344 S350	N344-E348 WeakPolarHBondContact O-CB 3.45Å; N344-E348 WeakPolarHBondContact O-CG 3.36Å; N344-E348 PolarHBondContact O-N 3.01Å; E348-S350 VanDerWaalsContact C-N 3.27Å; E348-S350 PolarHBondContact O-N 2.9Å
349	N	52.4	Low	55.6	Low	95 Å²	95	114.7 Å²	114.7	51%	0.508	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.1	32.9	176.8	-66.3	-64.4	0	0	0	113.4	R345 M346 K351	R345-N349 VanDerWaalsContact O-CB 3.23Å; R345-N349 WeakPolarHBondContact O-CB 3.3Å; R345-N349 PolarHBondContact O-N 2.98Å; R345-N349 PolarHBondContact O-ND2 2.67Å; M346-N349 CarbonylContact O-C 3.57Å; M346-N349 PolarHBondContact O-N 3.21Å; N349-K351 PolarHBondContact O-N 3.45Å
350	S	47.8	Very low	53.6	Low	94 Å²	94	120.7 Å²	120.7	66%	0.657	62%	0.616	S	S	*	*			trans	-69.4	22	179.3	72.5	0	0	0	0	114.8	M346 T347 E348	M346-S350 PolarHBondContact O-N 2.9Å; T347-S350 WeakPolarHBondContact O-CB 3.39Å; T347-S350 PolarHBondContact O-OG 3.16Å; E348-S350 VanDerWaalsContact C-N 3.27Å; E348-S350 PolarHBondContact O-N 2.9Å
351	K	43.5	Very low	51.7	Low	182 Å²	182	126 Å²	126	79%	0.791	64%	0.635	S	S	*	*	S	Bend	trans	-117.7	95.2	169.3	-71	179.9	-179.9	174.5	0	108.3	N349 N353	N349-K351 PolarHBondContact O-N 3.45Å; K351-N353 PolarHBondContact O-N 3.34Å
352	C	37.7	Very low	49.8	Very low	117 Å²	117	126.3 Å²	126.3	79%	0.791	64%	0.636	S	S	*	*			trans	-67.7	71.7	-179.3	-59.8	0	0	0	0	112.8
353	N	39	Very low	48	Very low	155 Å²	155	128.9 Å²	128.9	83%	0.829	66%	0.655	S	S	*	*			trans	-111.6	127	174.8	-101	-18.7	0	0	0	111	K351 K355	K351-N353 PolarHBondContact O-N 3.34Å; N353-K355 PolarHBondContact O-N 2.85Å
354	S	35.4	Very low	46.1	Very low	112 Å²	112	135.9 Å²	135.9	78%	0.783	69%	0.688	S	S	*	*			trans	-79.3	115.6	-171	53.4	0	0	0	0	113.3
355	K	37	Very low	44.6	Very low	191 Å²	191	138.3 Å²	138.3	83%	0.83	70%	0.7	S	S	*	*			trans	-168.6	111.6	144.7	-106.5	156.3	-174.1	178.8	0	111.3	N353	N353-K355 PolarHBondContact O-N 2.85Å
356	Y	35.2	Very low	42.8	Very low	227 Å²	227	135.9 Å²	135.9	89%	0.89	72%	0.715	S	S	*	*			trans	25.9	99.1	158.2	-62	-88	0	0	0	118.1
357	M	34	Very low	41.8	Very low	130 Å²	130	136.7 Å²	136.7	64%	0.64	72%	0.724	S	S	*	*			trans	-73.2	129.5	151.6	-90.5	-162.3	155.9	0	0	109.6
358	N	39	Very low	40.3	Very low	127 Å²	127	139.5 Å²	139.5	68%	0.679	74%	0.735	S	S	*	*			trans	-81.4	116.7	173.5	-172.8	-1.2	0	0	0	109	N360	N358-N360 VanDerWaalsContact C-N 3.31Å; N358-N360 PolarHBondContact O-N 3.48Å; N358-N360 PolarHBondContact OD1-OD1 3.16Å
359	M	36.9	Very low	39.3	Very low	143 Å²	143	140.3 Å²	140.3	70%	0.704	74%	0.739	S	S	*	*			trans	-83.9	2.8	-170.9	-79.5	-66.2	-146.6	0	0	114.8	E361 F362	M359-E361 PolarHBondContact O-N 3.11Å; M359-F362 PolarHBondContact O-N 3.37Å
360	N	40.9	Very low	38.7	Very low	127 Å²	127	143.6 Å²	143.6	68%	0.679	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	11	-171.1	-65	8.1	0	0	0	115.8	N358	N358-N360 VanDerWaalsContact C-N 3.31Å; N358-N360 PolarHBondContact O-N 3.48Å; N358-N360 PolarHBondContact OD1-OD1 3.16Å
361	E	41.8	Very low	38.1	Very low	163 Å²	163	148.5 Å²	148.5	76%	0.762	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	4.4	179.3	-154.5	173.3	-134	0	0	112.8	M359	M359-E361 PolarHBondContact O-N 3.11Å
362	F	41.8	Very low	37.8	Very low	151 Å²	151	143.6 Å²	143.6	66%	0.662	77%	0.77	S	S	*	*	S	Bend	trans	-116.5	4.7	178.7	-88.9	-82.5	0	0	0	114.6	M359 E364	M359-F362 PolarHBondContact O-N 3.37Å; F362-E364 PolarHBondContact O-N 3.23Å
363	S	41.3	Very low	37.7	Very low	90 Å²	90	144.8 Å²	144.8	63%	0.629	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	9.4	-166.5	49.2	0	0	0	0	116.6	I365	S363-I365 PolarHBondContact O-N 3.22Å
364	E	39.1	Very low	37.7	Very low	200 Å²	200	146.8 Å²	146.8	94%	0.935	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-0.1	176.8	-69.2	-163.8	136.2	0	0	114.5	F362	F362-E364 PolarHBondContact O-N 3.23Å
365	I	43.8	Very low	37.8	Very low	143 Å²	143	148.3 Å²	148.3	73%	0.733	76%	0.759	S	S	*	*	S	Bend	trans	-101.3	95.9	171.3	-56	179.3	0	0	0	108.6	S363 V367	S363-I365 PolarHBondContact O-N 3.22Å; I365-V367 HydrophobicContact CG2-CG2 4.4Å; I365-V367 PolarHBondContact O-N 3.44Å
366	G	29.8	Very low	37.7	Very low	77 Å²	77	146.3 Å²	146.3	79%	0.794	76%	0.762	S	S	*	*			trans	-67.7	94.9	-177	0	0	0	0	0	113.5
367	V	38.9	Very low	37.8	Very low	97 Å²	97	141.2 Å²	141.2	59%	0.588	76%	0.755	S	S	*	*			trans	-127.3	110.4	166.9	179.1	0	0	0	0	108.1	I365 H369	I365-V367 HydrophobicContact CG2-CG2 4.4Å; I365-V367 PolarHBondContact O-N 3.44Å; V367-H369 PolarHBondContact O-N 3.26Å
368	N	32.8	Very low	38	Very low	160 Å²	160	142.3 Å²	142.3	86%	0.856	76%	0.763	S	S	*	*			trans	-72	108.8	173.9	-72.3	-1.9	0	0	0	109.6
369	H	38.1	Very low	37.9	Very low	166 Å²	166	142.2 Å²	142.2	77%	0.769	77%	0.767	S	S	*	*			trans	-111.2	106.1	160.9	-86.8	-51.7	0	0	0	108.6	V367	V367-H369 PolarHBondContact O-N 3.26Å
370	D	38.3	Very low	37.8	Very low	163 Å²	163	144.2 Å²	144.2	87%	0.872	78%	0.775	S	S	*	*			trans	-66.6	134.5	166.1	-71.3	-53.3	0	0	0	109.7
371	E	36.3	Very low	37.4	Very low	197 Å²	197	143.8 Å²	143.8	92%	0.921	78%	0.781	S	S	*	*			trans	-79	141.2	-174.3	-62.4	-172.3	126.1	0	0	112.6
372	G	36.3	Very low	37.1	Very low	79 Å²	79	141.8 Å²	141.8	81%	0.814	78%	0.783	S	S	*	*			trans	-137.3	31	-170.8	0	0	0	0	0	115.3
373	E	36.7	Very low	37.3	Very low	142 Å²	142	137.1 Å²	137.1	66%	0.664	78%	0.777	S	S	*	*			trans	11.5	112.4	159.5	-146	-164.3	-124.5	0	0	119
374	R	38.8	Very low	37.7	Very low	198 Å²	198	137.3 Å²	137.3	75%	0.747	77%	0.771	S	S	*	*				167.4	134.2	116.4	-89	157.2	-160.9	-171.2	6.2	116.9
375	N	37.3	Very low	38.6	Very low	144 Å²	144	131.4 Å²	131.4	77%	0.77	75%	0.751	S	S	*	*			trans	44.5	104.9	137.6	-53.2	-4.3	0	0	0	121
376	V	35.7	Very low	39.8	Very low	149 Å²	149	124.6 Å²	124.6	90%	0.903	72%	0.716	S	S	*	*				-138.5	133.7	115.6	-179.8	0	0	0	0	108.4
377	T	36.4	Very low	41.6	Very low	120 Å²	120	125.9 Å²	125.9	74%	0.736	70%	0.698	S	S	*	*			trans	-94.1	135	169.6	47.9	0	0	0	0	110.1
378	D	38	Very low	43	Very low	152 Å²	152	127.5 Å²	127.5	81%	0.813	70%	0.703	S	S	*	*				-167.7	156.8	127.5	-115.9	-32.5	0	0	0	117
379	V	38.3	Very low	45	Very low	125 Å²	125	121.6 Å²	121.6	76%	0.758	67%	0.673	S	S	*	*			trans	42.1	123.1	159.6	-174.1	0	0	0	0	120.7	C381	V379-C381 PolarHBondContact O-N 3.03Å
380	Q	33.7	Very low	46.7	Very low	185 Å²	185	118.5 Å²	118.5	86%	0.864	67%	0.668	S	S	*	*			trans	-45.8	119.4	168.8	-63.8	165.1	-26.6	0	0	115.2
381	C	32.7	Very low	48.5	Very low	119 Å²	119	112.5 Å²	112.5	80%	0.804	64%	0.637	S	S	*	*			trans	-123.1	154.8	132.9	-84.1	0	0	0	0	108	V379 G383	V379-C381 PolarHBondContact O-N 3.03Å; C381-G383 PolarHBondContact O-N 3.01Å
382	C	36.1	Very low	50.7	Low	120 Å²	120	103.1 Å²	103.1	81%	0.811	59%	0.593	S	S	*	*			trans	-72.6	68.7	161.5	-71.7	0	0	0	0	108.8	I384	C382-I384 PolarHBondContact O-N 3.34Å
383	G	44.4	Very low	52.7	Low	53 Å²	53	104 Å²	104	55%	0.546	58%	0.579	S	S	.	*			trans	-57.3	126	-178.2	0	0	0	0	0	110.1	C381 S385	C381-G383 PolarHBondContact O-N 3.01Å; G383-S385 PolarHBondContact O-N 3.37Å
384	I	51.1	Low	54.7	Low	95 Å²	95	99 Å²	99	49%	0.487	56%	0.559	S	S	.	*			trans	-74.4	76.9	179.4	-53	174.9	0	0	0	107.7	F343 M346 C382 C386 Y387	F343-I384 HydrophobicContact CE1-CG2 3.9Å; M346-I384 HydrophobicContact CE-CG2 4.49Å; C382-I384 PolarHBondContact O-N 3.34Å; I384-C386 HydrophobicContact CG2-CB 4.37Å; I384-C386 PolarHBondContact O-N 3.33Å; I384-C386 VanDerWaalsContact O-N 3.07Å; I384-Y387 HydrophobicContact CG2-CD2 4.11Å; I384-Y387 WeakPolarHBondContact O-CB 3.37Å; I384-Y387 PolarHBondContact O-N 3.32Å
385	S	57.4	Low	56.6	Low	75 Å²	75	91.3 Å²	91.3	52%	0.524	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-54.4	-31.9	-173.5	57.2	0	0	0	0	112.4	G383 Y387 N388 T389	G383-S385 PolarHBondContact O-N 3.37Å; S385-Y387 VanDerWaalsContact C-N 3.3Å; S385-Y387 PolarHBondContact O-N 3.29Å; S385-N388 CarbonylContact O-C 3.57Å; S385-N388 PolarHBondContact O-N 2.99Å; S385-N388 VanDerWaalsContact O-N 3.1Å; S385-T389 PolarHBondContact O-N 2.92Å; S385-T389 VanDerWaalsContact O-N 3.14Å
386	C	68.7	Low	58.5	Low	0 Å²	0	89 Å²	89	0%	0	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-47.6	-48.1	169.9	-66.6	0	0	0	0	112.8	C342 F343 M346 I384 N388 T389 C392	C342-C386 HydrophobicContact CB-CB 3.81Å; C342-C386 WeakPolarHBondContact CB-SG 3.05Å; C342-C386 PolarHBondContact O-SG 2.79Å; C342-C386 VanDerWaalsContact O-SG 3.36Å; C342-C386 WeakPolarHBondContact SG-CA 3.17Å; C342-C386 WeakPolarHBondContact SG-CB 2.98Å; C342-C386 CovalentContact SG-SG 2.04Å; C342-C386 PolarHBondContact SG-SG 3.46Å; F343-C386 HydrophobicContact CD1-CB 4.36Å; F343-C386 HydrophobicContact CE1-CB 4.22Å; M346-C386 VanDerWaalsContact CG-SG 3.55Å; I384-C386 HydrophobicContact CG2-CB 4.37Å; I384-C386 PolarHBondContact O-N 3.33Å; I384-C386 VanDerWaalsContact O-N 3.07Å; C386-N388 VanDerWaalsContact C-N 3.26Å; C386-N388 PolarHBondContact O-N 3.44Å; C386-T389 WeakPolarHBondContact O-CB 3.5Å; C386-T389 PolarHBondContact O-N 2.94Å; C386-T389 PolarHBondContact O-OG1 3.27Å; C386-C392 WeakPolarHBondContact O-CB 3.34Å; C386-C392 PolarHBondContact O-SG 3.02Å
387	Y	67.5	Low	60.4	Low	104 Å²	104	83.8 Å²	83.8	41%	0.408	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-60.5	-34.8	-178.2	-111.1	-69.6	0	0	0	113	F343 I384 S385 L393 Y396	F343-Y387 AromaticContact CE1-CD2 3.95Å; F343-Y387 HydrophobicContact CE1-CD2 3.95Å; F343-Y387 HydrophobicContact CE1-CE2 4.06Å; F343-Y387 AromaticContact CZ-CD2 3.71Å; F343-Y387 HydrophobicContact CZ-CD2 3.71Å; F343-Y387 AromaticContact CZ-CE2 3.63Å; F343-Y387 HydrophobicContact CZ-CE2 3.63Å; F343-Y387 HydrophobicContact CZ-CG 4.38Å; I384-Y387 HydrophobicContact CG2-CD2 4.11Å; I384-Y387 WeakPolarHBondContact O-CB 3.37Å; I384-Y387 PolarHBondContact O-N 3.32Å; S385-Y387 VanDerWaalsContact C-N 3.3Å; S385-Y387 PolarHBondContact O-N 3.29Å; Y387-L393 WeakPolarHBondContact O-CD2 3.4Å; Y387-Y396 HydrophobicContact CD1-CD2 4.05Å; Y387-Y396 AromaticContact CD1-CE2 3.99Å; Y387-Y396 HydrophobicContact CD1-CE2 3.99Å; Y387-Y396 AromaticContact CE1-CD2 3.51Å; Y387-Y396 HydrophobicContact CE1-CD2 3.51Å; Y387-Y396 AromaticContact CE1-CE2 3.26Å; Y387-Y396 HydrophobicContact CE1-CE2 3.26Å; Y387-Y396 HydrophobicContact CE1-CG 4.28Å; Y387-Y396 AromaticContact CE1-CZ 3.85Å; Y387-Y396 AromaticContact CZ-CE2 3.67Å; Y387-Y396 AromaticContact CZ-CZ 3.87Å; Y387-Y396 PolarHBondContact OH-OH 3.5Å
388	N	69.1	Low	62	Low	131 Å²	131	82.5 Å²	82.5	70%	0.701	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-88	0.8	177.2	-74.5	6.7	0	0	0	113.6	S385 C386	S385-N388 CarbonylContact O-C 3.57Å; S385-N388 PolarHBondContact O-N 2.99Å; S385-N388 VanDerWaalsContact O-N 3.1Å; C386-N388 VanDerWaalsContact C-N 3.26Å; C386-N388 PolarHBondContact O-N 3.44Å
389	T	74.1	Confident	63.2	Low	37 Å²	37	81.7 Å²	81.7	23%	0.227	47%	0.47	C	S	.	.	S	Bend	trans	-64.7	142.2	170.4	62.1	0	0	0	0	109.7	S385 C386 V391 C392 L393	S385-T389 PolarHBondContact O-N 2.92Å; S385-T389 VanDerWaalsContact O-N 3.14Å; C386-T389 WeakPolarHBondContact O-CB 3.5Å; C386-T389 PolarHBondContact O-N 2.94Å; C386-T389 PolarHBondContact O-OG1 3.27Å; T389-V391 PolarHBondContact O-N 2.98Å; T389-C392 PolarHBondContact O-N 3.42Å; T389-C392 VanDerWaalsContact O-N 3.09Å; T389-C392 PolarHBondContact OG1-N 3.28Å; T389-C392 VanDerWaalsContact OG1-N 3.12Å; T389-L393 WeakPolarHBondContact O-CG 3.26Å; T389-L393 PolarHBondContact O-N 2.84Å
390	P	74.5	Confident	64.7	Low	101 Å²	101	76 Å²	76	66%	0.656	44%	0.436	S	S	*	.	H	α-helix	trans	-58.1	-25.4	175.8	23.5	-33.6	0	0	0	112.2	S394	P390-S394 VanDerWaalsContact O-CB 3.23Å; P390-S394 WeakPolarHBondContact O-CB 3.16Å; P390-S394 PolarHBondContact O-N 2.97Å; P390-S394 PolarHBondContact O-OG 2.97Å
391	V	76.2	Confident	66	Low	37 Å²	37	73.6 Å²	73.6	22%	0.224	43%	0.425	C	S	.	.	H	α-helix	trans	-62	-59.6	170.9	176	0	0	0	0	111.8	Y335 L338 C339 T389 L393 S394 Y395	Y335-V391 HydrophobicContact CD1-CG1 4.22Å; L338-V391 HydrophobicContact CB-CG1 3.45Å; L338-V391 VanDerWaalsContact CB-CG1 3.45Å; L338-V391 HydrophobicContact CD1-CG1 4.33Å; C339-V391 HydrophobicContact CB-CG1 4.37Å; T389-V391 PolarHBondContact O-N 2.98Å; V391-L393 PolarHBondContact O-N 2.94Å; V391-S394 PolarHBondContact O-N 2.62Å; V391-Y395 PolarHBondContact O-N 3.23Å
392	C	81.5	Confident	67	Low	0 Å²	0	71.1 Å²	71.1	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-66.8	-37.6	-179.6	-72.2	0	0	0	0	112.1	C339 C386 T389 S394 Y395 Y396	C339-C392 WeakPolarHBondContact CA-SG 3.23Å; C339-C392 HydrophobicContact CB-CB 4.08Å; C339-C392 WeakPolarHBondContact CB-SG 3.29Å; C339-C392 VanDerWaalsContact SG-CA 3.57Å; C339-C392 WeakPolarHBondContact SG-CB 3.2Å; C339-C392 CovalentContact SG-SG 2.03Å; C339-C392 PolarHBondContact SG-SG 3.01Å; C386-C392 WeakPolarHBondContact O-CB 3.34Å; C386-C392 PolarHBondContact O-SG 3.02Å; T389-C392 PolarHBondContact O-N 3.42Å; T389-C392 VanDerWaalsContact O-N 3.09Å; T389-C392 PolarHBondContact OG1-N 3.28Å; T389-C392 VanDerWaalsContact OG1-N 3.12Å; C392-S394 VanDerWaalsContact C-N 3.26Å; C392-S394 PolarHBondContact O-N 3.45Å; C392-Y395 PolarHBondContact O-N 3.47Å; C392-Y396 HydrophobicContact CB-CD2 4.48Å; C392-Y396 VanDerWaalsContact O-CD2 3.27Å; C392-Y396 WeakPolarHBondContact O-CD2 3.45Å; C392-Y396 PolarHBondContact O-N 2.93Å
393	L	79.4	Confident	67.7	Low	98 Å²	98	68.9 Å²	68.9	51%	0.513	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-39.6	173.6	-68.5	172.9	0	0	0	111.4	Y387 T389 V391 S397	Y387-L393 WeakPolarHBondContact O-CD2 3.4Å; T389-L393 WeakPolarHBondContact O-CG 3.26Å; T389-L393 PolarHBondContact O-N 2.84Å; V391-L393 PolarHBondContact O-N 2.94Å; L393-S397 PolarHBondContact O-N 2.84Å; L393-S397 VanDerWaalsContact O-N 3.12Å
394	S	78.1	Confident	68	Low	35 Å²	35	72 Å²	72	25%	0.245	39%	0.388	C	S	.	.	H	α-helix	trans	-68.7	-40.2	174.3	-60	0	0	0	0	112.5	P390 V391 C392 S397 C400	P390-S394 VanDerWaalsContact O-CB 3.23Å; P390-S394 WeakPolarHBondContact O-CB 3.16Å; P390-S394 PolarHBondContact O-N 2.97Å; P390-S394 PolarHBondContact O-OG 2.97Å; V391-S394 PolarHBondContact O-N 2.62Å; C392-S394 VanDerWaalsContact C-N 3.26Å; C392-S394 PolarHBondContact O-N 3.45Å; S394-S397 WeakPolarHBondContact O-CB 3.32Å; S394-S397 PolarHBondContact O-N 2.83Å; S394-S397 PolarHBondContact O-OG 2.84Å; S394-C400 PolarHBondContact O-SG 3.48Å
395	Y	79.6	Confident	67.9	Low	38 Å²	38	72.9 Å²	72.9	15%	0.149	40%	0.397	C	S	.	.	H	α-helix	trans	-62.3	-40.8	175.1	171.4	-116.2	0	0	0	113	E336 V391 C392 S397 C400 K404	E336-Y395 HydrophobicContact CB-CD2 3.69Å; E336-Y395 HydrophobicContact CB-CE2 3.56Å; E336-Y395 HydrophobicContact CB-CG 4.48Å; E336-Y395 HydrophobicContact CG-CD2 4.29Å; E336-Y395 HydrophobicContact CG-CE2 3.69Å; E336-Y395 PolarHBondContact OE1-OH 3.36Å; E336-Y395 VanDerWaalsContact OE1-OH 3.07Å; V391-Y395 PolarHBondContact O-N 3.23Å; C392-Y395 PolarHBondContact O-N 3.47Å; Y395-S397 VanDerWaalsContact C-N 3.31Å; Y395-C400 WeakPolarHBondContact O-CB 3.29Å; Y395-K404 PolarHBondContact OH-NZ 3.38Å
396	Y	77.1	Confident	67.3	Low	96 Å²	96	77.5 Å²	77.5	38%	0.376	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	0.7	178.1	-72	-66.2	0	0	0	114.1	Y387 C392	Y387-Y396 HydrophobicContact CD1-CD2 4.05Å; Y387-Y396 AromaticContact CD1-CE2 3.99Å; Y387-Y396 HydrophobicContact CD1-CE2 3.99Å; Y387-Y396 AromaticContact CE1-CD2 3.51Å; Y387-Y396 HydrophobicContact CE1-CD2 3.51Å; Y387-Y396 AromaticContact CE1-CE2 3.26Å; Y387-Y396 HydrophobicContact CE1-CE2 3.26Å; Y387-Y396 HydrophobicContact CE1-CG 4.28Å; Y387-Y396 AromaticContact CE1-CZ 3.85Å; Y387-Y396 AromaticContact CZ-CE2 3.67Å; Y387-Y396 AromaticContact CZ-CZ 3.87Å; Y387-Y396 PolarHBondContact OH-OH 3.5Å; C392-Y396 HydrophobicContact CB-CD2 4.48Å; C392-Y396 VanDerWaalsContact O-CD2 3.27Å; C392-Y396 WeakPolarHBondContact O-CD2 3.45Å; C392-Y396 PolarHBondContact O-N 2.93Å
397	S	74.8	Confident	66.1	Low	38 Å²	38	82.9 Å²	82.9	27%	0.266	44%	0.441	S	S	.	.	S	Bend	trans	-70.4	160	177.1	75.5	0	0	0	0	113.3	L393 S394 Y395 M399 C400 Q401	L393-S397 PolarHBondContact O-N 2.84Å; L393-S397 VanDerWaalsContact O-N 3.12Å; S394-S397 WeakPolarHBondContact O-CB 3.32Å; S394-S397 PolarHBondContact O-N 2.83Å; S394-S397 PolarHBondContact O-OG 2.84Å; Y395-S397 VanDerWaalsContact C-N 3.31Å; S397-M399 PolarHBondContact O-N 2.77Å; S397-C400 PolarHBondContact O-N 2.81Å; S397-Q401 PolarHBondContact O-N 3.06Å; S397-Q401 VanDerWaalsContact O-N 3.11Å
398	S	69.4	Low	64.8	Low	93 Å²	93	85 Å²	85	65%	0.65	46%	0.458	S	S	*	.	H	α-helix	trans	-57.7	-29.9	174.1	53	0	0	0	0	113.3	C400	S398-C400 PolarHBondContact O-N 3.32Å; S398-C400 VanDerWaalsContact O-N 3.14Å
399	M	63.4	Low	63.6	Low	135 Å²	135	84.6 Å²	84.6	67%	0.665	46%	0.46	S	S	*	.	H	α-helix	trans	-63.5	-13.5	173.2	-78	-157.5	171.6	0	0	114.3	R290 S397	R290-M399 PolarHBondContact NH2-O 3.07Å; S397-M399 PolarHBondContact O-N 2.77Å
400	C	69.5	Low	62.5	Low	6 Å²	6	86.7 Å²	86.7	4%	0.041	47%	0.469	C	S	.	.	H	α-helix	trans	-117.4	-26.5	-178.9	-70.2	0	0	0	0	113.8	C332 S394 Y395 S397 S398 S402	C332-C400 VanDerWaalsContact CA-SG 3.54Å; C332-C400 HydrophobicContact CB-CB 3.57Å; C332-C400 WeakPolarHBondContact CB-SG 3.24Å; C332-C400 WeakPolarHBondContact SG-CA 3.31Å; C332-C400 WeakPolarHBondContact SG-CB 3.18Å; C332-C400 CovalentContact SG-SG 2.03Å; C332-C400 PolarHBondContact SG-SG 2.84Å; S394-C400 PolarHBondContact O-SG 3.48Å; Y395-C400 WeakPolarHBondContact O-CB 3.29Å; S397-C400 PolarHBondContact O-N 2.81Å; S398-C400 PolarHBondContact O-N 3.32Å; S398-C400 VanDerWaalsContact O-N 3.14Å; C400-S402 VanDerWaalsContact C-N 3.3Å; C400-S402 PolarHBondContact O-N 2.82Å
401	Q	60.9	Low	61.6	Low	135 Å²	135	91 Å²	91	63%	0.631	48%	0.481	S	S	*	.	H	α-helix	trans	-61.1	-36.5	170.1	-77.4	-176.7	-30.4	0	0	112.9	S397 N403 K404	S397-Q401 PolarHBondContact O-N 3.06Å; S397-Q401 VanDerWaalsContact O-N 3.11Å; Q401-N403 PolarHBondContact O-N 3.25Å; Q401-K404 PolarHBondContact O-N 2.81Å
402	S	54.8	Low	61.1	Low	67 Å²	67	94.1 Å²	94.1	47%	0.469	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.1	-176.1	59.1	0	0	0	0	115.3	C400 T405	C400-S402 VanDerWaalsContact C-N 3.3Å; C400-S402 PolarHBondContact O-N 2.82Å; S402-T405 PolarHBondContact O-OG1 2.9Å
403	N	50.7	Low	60.7	Low	73 Å²	73	97.9 Å²	97.9	39%	0.39	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-27.1	176.8	-85.2	-4.1	0	0	0	113.2	Q401 T405	Q401-N403 PolarHBondContact O-N 3.25Å; N403-T405 VanDerWaalsContact C-N 3.26Å; N403-T405 PolarHBondContact O-N 3.17Å
404	K	49.5	Very low	60.5	Low	119 Å²	119	95 Å²	95	52%	0.517	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	1.5	-171.5	-67.1	-166	172	-173.6	0	114.7	E336 Y395 Q401	E336-K404 IonicContact OE1-NZ 3.87Å; E336-K404 PolarHBondContact OE1-NZ 3.43Å; Y395-K404 PolarHBondContact OH-NZ 3.38Å; Q401-K404 PolarHBondContact O-N 2.81Å
405	T	48.8	Very low	60.6	Low	113 Å²	113	94.5 Å²	94.5	69%	0.693	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	-0.6	-177	52	0	0	0	0	115.4	S402 N403	S402-T405 PolarHBondContact O-OG1 2.9Å; N403-T405 VanDerWaalsContact C-N 3.26Å; N403-T405 PolarHBondContact O-N 3.17Å
406	K	45.2	Very low	60.6	Low	171 Å²	171	93.3 Å²	93.3	74%	0.743	49%	0.491	S	S	*	.	S	Bend	trans	-103.7	6.7	-176.6	-77.7	-176.4	173.8	176.6	0	115.6	I408	K406-I408 PolarHBondContact O-N 2.98Å
407	T	43.6	Very low	60.7	Low	113 Å²	113	90 Å²	90	69%	0.693	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	8.3	-164.3	39.2	0	0	0	0	116.7
408	I	41.6	Very low	61	Low	150 Å²	150	88.3 Å²	88.3	77%	0.769	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	-6.9	-160.4	-64.1	178.3	0	0	0	115	K406	K406-I408 PolarHBondContact O-N 2.98Å
409	T	42.9	Very low	61.7	Low	122 Å²	122	85 Å²	85	75%	0.748	44%	0.444	S	S	*	.	S	Bend	trans	-141.6	36	-169.7	61.1	0	0	0	0	116.1
410	L	51	Low	62.7	Low	80 Å²	80	78.6 Å²	78.6	42%	0.419	41%	0.412	S	S	.	.			trans	-127.8	17.4	-167	-125.2	84.3	0	0	0	118.1	Y244 D412 K413	Y244-L410 HydrophobicContact CE1-CD2 4Å; L410-D412 VanDerWaalsContact C-N 3.26Å; L410-D412 PolarHBondContact O-N 3.11Å; L410-K413 HydrophobicContact CD2-CB 4.3Å; L410-K413 HydrophobicContact CG-CB 4.2Å; L410-K413 PolarHBondContact O-N 3.12Å
411	E	55.3	Low	63.5	Low	192 Å²	192	78.3 Å²	78.3	90%	0.897	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.6	-170.4	-62.3	-166.6	142.8	0	0	116.3
412	D	66.8	Low	64.7	Low	102 Å²	102	72.2 Å²	72.2	55%	0.545	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	2	179.1	-76	-44.6	0	0	0	115.1	K247 L410	K247-D412 PolarHBondContact N-O 2.77Å; K247-D412 VanDerWaalsContact N-O 3.14Å; L410-D412 VanDerWaalsContact C-N 3.26Å; L410-D412 PolarHBondContact O-N 3.11Å
413	K	71.9	Confident	66.1	Low	80 Å²	80	69 Å²	69	35%	0.348	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.8	-179.3	-48.2	-166.9	-168	-160.9	0	112.9	Y244 G245 Y246 L410	Y244-K413 HydrophobicContact CD1-CB 3.92Å; Y244-K413 HydrophobicContact CD1-CD 4.35Å; Y244-K413 HydrophobicContact CG-CD 4.35Å; G245-K413 WeakPolarHBondContact O-CA 3.28Å; Y246-K413 HydrophobicContact CD1-CD 4.41Å; Y246-K413 HydrophobicContact CD1-CG 4.21Å; Y246-K413 HydrophobicContact CE1-CD 3.77Å; Y246-K413 HydrophobicContact CE1-CG 4.05Å; Y246-K413 PolarHBondContact OH-NZ 3.05Å; L410-K413 HydrophobicContact CD2-CB 4.3Å; L410-K413 HydrophobicContact CG-CB 4.2Å; L410-K413 PolarHBondContact O-N 3.12Å
414	V	76.4	Confident	67.6	Low	38 Å²	38	66.2 Å²	66.2	23%	0.23	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	152.3	168.1	-80.9	0	0	0	0	110.8	Y244 G245 Y280 I324 M416	Y244-V414 CarbonylContact C-O 3.5Å; Y244-V414 WeakPolarHBondContact CA-O 3.22Å; G245-V414 PolarHBondContact N-O 2.85Å; G245-V414 PolarHBondContact O-N 3.43Å; Y280-V414 HydrophobicContact CD1-CG2 3.51Å; Y280-V414 HydrophobicContact CD2-CG2 4.49Å; Y280-V414 HydrophobicContact CE1-CG2 3.56Å; Y280-V414 HydrophobicContact CG-CG2 4.01Å; I324-V414 HydrophobicContact CD1-CG2 4.31Å; I324-V414 HydrophobicContact CG2-CB 4.14Å; I324-V414 HydrophobicContact CG2-CG1 4.34Å; V414-M416 HydrophobicContact CG2-CG 4.14Å; V414-M416 HydrophobicContact CG2-SD 4.3Å
415	C	80.1	Confident	69	Low	24 Å²	24	60.7 Å²	60.7	16%	0.162	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	127.1	169.4	-172.6	0	0	0	0	109	C288 V325	C288-C415 HydrophobicContact CB-CB 3.79Å; C288-C415 WeakPolarHBondContact CB-SG 3.15Å; C288-C415 WeakPolarHBondContact SG-CA 3.22Å; C288-C415 WeakPolarHBondContact SG-CB 3.31Å; C288-C415 CovalentContact SG-SG 2.04Å; C288-C415 PolarHBondContact SG-SG 2.75Å; V325-C415 HydrophobicContact CB-CB 4.2Å; V325-C415 PolarHBondContact N-O 3.22Å
416	M	78.7	Confident	70.3	Confident	13 Å²	13	57.5 Å²	57.5	6%	0.064	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128.9	-179.3	-67.1	-179.5	71.7	0	0	109.8	Q242 T243 R282 E322 Q323 I324 V414	Q242-M416 WeakPolarHBondContact CA-O 3.18Å; T243-M416 PolarHBondContact N-O 3.47Å; T243-M416 PolarHBondContact O-N 2.9Å; R282-M416 HydrophobicContact CB-SD 4.34Å; R282-M416 HydrophobicContact CG-CB 4.23Å; E322-M416 HydrophobicContact CB-CE 4.12Å; E322-M416 WeakPolarHBondContact OE2-CE 3.44Å; Q323-M416 WeakPolarHBondContact O-CA 3.29Å; I324-M416 HydrophobicContact CG1-CG 4.26Å; V414-M416 HydrophobicContact CG2-CG 4.14Å; V414-M416 HydrophobicContact CG2-SD 4.3Å
417	D	80.4	Confident	71.8	Confident	26 Å²	26	49.7 Å²	49.7	14%	0.139	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	147.6	169.4	-168.4	23.6	0	0	0	109.6	R240 R241 Q242 E322 Q323 V325	R240-D417 WeakPolarHBondContact CA-OD1 3.39Å; R241-D417 PolarHBondContact N-OD1 2.84Å; Q242-D417 HydrophobicContact CG-CB 4.08Å; E322-D417 CarbonylContact C-O 3.6Å; E322-D417 WeakPolarHBondContact CA-O 3.16Å; Q323-D417 PolarHBondContact N-O 3.04Å; Q323-D417 PolarHBondContact O-N 2.94Å; V325-D417 HydrophobicContact CG2-CB 3.48Å; V325-D417 VanDerWaalsContact CG2-CB 3.48Å
418	G	79.4	Confident	73.4	Confident	3 Å²	3	46.2 Å²	46.2	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166	171.5	178.5	0	0	0	0	0	113.3	R241 R282 N321	R241-G418 PolarHBondContact N-O 3.3Å; R282-G418 VanDerWaalsContact NH1-C 3.31Å; R282-G418 PolarHBondContact NH1-O 3.18Å; N321-G418 VanDerWaalsContact O-CA 3.22Å; N321-G418 WeakPolarHBondContact O-CA 3.43Å
419	N	84.2	Confident	75.2	Confident	23 Å²	23	39.2 Å²	39.2	12%	0.123	21%	0.209	C	C	.	.			trans	-75.2	132.7	-179.8	-61	-26.1	0	0	0	110.6	R239 R282 Y319 F421	R239-N419 WeakPolarHBondContact CA-OD1 3.49Å; R282-N419 PolarHBondContact NH2-O 2.98Å; Y319-N419 PolarHBondContact O-ND2 3.1Å; N419-F421 HydrophobicContact CB-CD2 4.42Å; N419-F421 HydrophobicContact CB-CE1 4.41Å; N419-F421 HydrophobicContact CB-CE2 3.79Å; N419-F421 HydrophobicContact CB-CZ 3.78Å
420	T	84.4	Confident	76.7	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.7	165.2	-50.4	0	0	0	0	108.1	F238 R241 L284 L296 Y304 T306	F238-T420 WeakPolarHBondContact CB-O 3.42Å; F238-T420 PolarHBondContact N-O 3.47Å; F238-T420 PolarHBondContact O-N 3.04Å; R241-T420 PolarHBondContact NH1-OG1 2.83Å; L284-T420 HydrophobicContact CD2-CG2 3.9Å; L296-T420 HydrophobicContact CD1-CG2 3.8Å; Y304-T420 HydrophobicContact CD1-CG2 4.35Å; T306-T420 HydrophobicContact CG2-CG2 3.94Å
421	F	86.1	Confident	78	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	117.8	-179.9	-65.1	-71.1	0	0	0	110.4	L235 A237 Y304 C305 I312 E318 V320 N419	L235-F421 HydrophobicContact CD1-CB 4.03Å; L235-F421 HydrophobicContact CD1-CD1 3.73Å; L235-F421 HydrophobicContact CD1-CE1 4.4Å; L235-F421 HydrophobicContact CD1-CG 4Å; L235-F421 HydrophobicContact CD2-CD1 3.74Å; L235-F421 HydrophobicContact CD2-CE1 4.13Å; L235-F421 HydrophobicContact CG-CB 4.32Å; L235-F421 HydrophobicContact CG-CD1 3.87Å; L235-F421 HydrophobicContact CG-CG 4.44Å; A237-F421 HydrophobicContact CB-CD1 3.81Å; A237-F421 HydrophobicContact CB-CE1 3.62Å; Y304-F421 CarbonylContact C-O 3.57Å; Y304-F421 WeakPolarHBondContact CA-O 3.42Å; C305-F421 PolarHBondContact N-O 3.33Å; C305-F421 PolarHBondContact O-N 3.09Å; I312-F421 HydrophobicContact CD1-CD2 4.01Å; I312-F421 HydrophobicContact CG2-CD2 3.89Å; I312-F421 HydrophobicContact CG2-CE2 3.93Å; I312-F421 HydrophobicContact CG2-CG 4.39Å; I312-F421 HydrophobicContact CG2-CZ 4.46Å; E318-F421 HydrophobicContact CB-CE1 3.93Å; E318-F421 HydrophobicContact CB-CE2 4.42Å; E318-F421 HydrophobicContact CB-CZ 3.72Å; E318-F421 HydrophobicContact CG-CE1 4.02Å; E318-F421 HydrophobicContact CG-CZ 4.22Å; V320-F421 HydrophobicContact CG2-CD2 3.84Å; V320-F421 HydrophobicContact CG2-CE2 3.74Å; N419-F421 HydrophobicContact CB-CD2 4.42Å; N419-F421 HydrophobicContact CB-CE1 4.41Å; N419-F421 HydrophobicContact CB-CE2 3.79Å; N419-F421 HydrophobicContact CB-CZ 3.78Å
422	Q	87.4	Confident	78.8	Confident	7 Å²	7	27.3 Å²	27.3	3%	0.033	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.5	168.9	-177.6	178.1	14.9	0	0	108.9	L235 K236 F238 E299 S302 Y304	L235-Q422 CarbonylContact C-O 3.58Å; L235-Q422 VanDerWaalsContact CA-O 3.3Å; L235-Q422 WeakPolarHBondContact CA-O 3.2Å; K236-Q422 HydrophobicContact CB-CB 4.3Å; K236-Q422 PolarHBondContact N-O 2.9Å; K236-Q422 PolarHBondContact O-N 2.83Å; F238-Q422 HydrophobicContact CD2-CB 4.31Å; F238-Q422 HydrophobicContact CE2-CB 3.73Å; E299-Q422 VanDerWaalsContact CD-NE2 3.28Å; E299-Q422 PolarHBondContact OE1-NE2 2.76Å; E299-Q422 PolarHBondContact OE2-NE2 3.25Å; S302-Q422 PolarHBondContact OG-NE2 2.77Å; Y304-Q422 HydrophobicContact CD1-CB 3.62Å; Y304-Q422 HydrophobicContact CD1-CG 3.9Å; Y304-Q422 HydrophobicContact CE1-CB 3.43Å; Y304-Q422 VanDerWaalsContact CE1-CB 3.43Å; Y304-Q422 HydrophobicContact CE1-CG 3.38Å; Y304-Q422 PolarHBondContact OH-NE2 3.15Å
423	I	84.7	Confident	78.8	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	105.4	177.5	-54	-176	0	0	0	108	S302 F303 L311 I312	S302-I423 VanDerWaalsContact CA-O 3.27Å; S302-I423 WeakPolarHBondContact CA-O 3.27Å; S302-I423 WeakPolarHBondContact CB-O 3.3Å; F303-I423 WeakPolarHBondContact CD1-O 3.27Å; F303-I423 HydrophobicContact CE1-CB 4.05Å; F303-I423 HydrophobicContact CE1-CG2 4Å; F303-I423 HydrophobicContact CE2-CB 4.1Å; F303-I423 HydrophobicContact CE2-CD1 4.2Å; F303-I423 HydrophobicContact CZ-CB 3.85Å; F303-I423 HydrophobicContact CZ-CD1 4.37Å; F303-I423 HydrophobicContact CZ-CG2 3.85Å; F303-I423 PolarHBondContact N-O 2.77Å; F303-I423 VanDerWaalsContact N-O 3.1Å; F303-I423 PolarHBondContact O-N 3Å; L311-I423 HydrophobicContact CD1-CD1 4.24Å; L311-I423 HydrophobicContact CD2-CD1 3.5Å; L311-I423 HydrophobicContact CD2-CG2 4.42Å; L311-I423 HydrophobicContact CG-CD1 3.63Å; I312-I423 HydrophobicContact CG1-CD1 4.43Å
424	S	81.5	Confident	78.9	Confident	15 Å²	15	19.8 Å²	19.8	11%	0.105	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	132.3	178.6	-44.7	0	0	0	0	110.6	L233 S234 S302	L233-S424 WeakPolarHBondContact CA-O 3.45Å; S234-S424 PolarHBondContact N-O 3.41Å; S234-S424 PolarHBondContact O-N 3.26Å; S234-S424 WeakPolarHBondContact OG-CB 3.27Å; S302-S424 WeakPolarHBondContact CB-OG 3.38Å
425	I	77.6	Confident	79.2	Confident	3 Å²	3	19 Å²	19	2%	0.015	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.2	-179.5	-49.6	157.4	0	0	0	108.1	Y231 L233 N301 F303 W576	Y231-I425 HydrophobicContact CD1-CG2 3.72Å; Y231-I425 HydrophobicContact CE1-CG2 4.5Å; Y231-I425 HydrophobicContact CG-CG2 4.36Å; L233-I425 HydrophobicContact CD2-CB 4.23Å; L233-I425 HydrophobicContact CD2-CG1 3.87Å; L233-I425 HydrophobicContact CD2-CG2 4.04Å; N301-I425 PolarHBondContact ND2-O 2.8Å; N301-I425 PolarHBondContact O-N 3.25Å; F303-I425 HydrophobicContact CD1-CD1 4.46Å; F303-I425 HydrophobicContact CE1-CD1 4.03Å; F303-I425 HydrophobicContact CE1-CG1 4.28Å; I425-W576 HydrophobicContact CD1-CB 3.28Å; I425-W576 HydrophobicContact CD1-CD2 3.7Å; I425-W576 HydrophobicContact CD1-CE3 3.57Å; I425-W576 HydrophobicContact CD1-CG 3.63Å; I425-W576 HydrophobicContact CG1-CD2 4.37Å; I425-W576 HydrophobicContact CG1-CE3 3.85Å; I425-W576 HydrophobicContact CG1-CZ3 4.46Å
426	T	76.8	Confident	79.5	Confident	46 Å²	46	18.1 Å²	18.1	28%	0.282	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.6	171	-55.7	0	0	0	0	109.2	L232 E428	L232-T426 PolarHBondContact N-O 2.78Å; L232-T426 PolarHBondContact O-N 2.81Å; T426-E428 PolarHBondContact O-N 2.82Å
427	P	77.4	Confident	79.8	Confident	7 Å²	7	18.7 Å²	18.7	5%	0.045	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	123.7	173.1	29.7	-33.2	0	0	0	109.8	V195 P228 Y231 F429	V195-P427 HydrophobicContact CG1-CB 4.12Å; V195-P427 HydrophobicContact CG1-CG 4.21Å; P228-P427 HydrophobicContact CB-CB 3.86Å; P228-P427 HydrophobicContact CG-CB 3.96Å; Y231-P427 HydrophobicContact CD1-CB 4.11Å; Y231-P427 HydrophobicContact CE1-CB 3.89Å; P427-F429 HydrophobicContact CB-CD2 4.48Å; P427-F429 HydrophobicContact CB-CE2 3.75Å; P427-F429 HydrophobicContact CB-CZ 4.36Å; P427-F429 HydrophobicContact CG-CE2 4.05Å
428	E	75.8	Confident	80.1	Confident	40 Å²	40	17.4 Å²	17.4	19%	0.187	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	132.9	178.6	-162.2	-178.7	151.6	0	0	110.8	P228 S229 R230 T426	P228-E428 CarbonylContact C-O 3.45Å; P228-E428 WeakPolarHBondContact CA-O 3.34Å; P228-E428 WeakPolarHBondContact CB-O 3.5Å; S229-E428 PolarHBondContact N-O 2.86Å; S229-E428 PolarHBondContact OG-O 3.41Å; R230-E428 HydrophobicContact CG-CB 4.02Å; R230-E428 IonicContact CZ-OE1 2.63Å; R230-E428 IonicContact CZ-OE2 3.11Å; R230-E428 VanDerWaalsContact CZ-OE2 3.28Å; R230-E428 VanDerWaalsContact NE-CD 3.29Å; R230-E428 IonicContact NE-OE1 2.79Å; R230-E428 PolarHBondContact NE-OE1 3.33Å; R230-E428 IonicContact NE-OE2 2.68Å; R230-E428 PolarHBondContact NE-OE2 3.15Å; R230-E428 VanDerWaalsContact NH2-CD 3.32Å; R230-E428 IonicContact NH2-OE1 2.97Å; R230-E428 PolarHBondContact NH2-OE1 3.48Å; R230-E428 IonicContact NH2-OE2 2.68Å; R230-E428 PolarHBondContact NH2-OE2 3.47Å; R230-E428 VanDerWaalsContact NH2-OE2 3.09Å; R230-E428 PolarHBondContact O-N 3.08Å; T426-E428 PolarHBondContact O-N 2.82Å
429	F	79.7	Confident	80.3	Confident	3 Å²	3	17.5 Å²	17.5	1%	0.013	9%	0.094	C	C	.	.			trans	-123.1	123.5	-176.9	-68.5	-89.6	0	0	0	110.4	V195 I199 L211 P226 P228 P427 F431	V195-F429 HydrophobicContact CG1-CZ 4.07Å; I199-F429 HydrophobicContact CD1-CD2 3.54Å; I199-F429 HydrophobicContact CD1-CE2 3.39Å; I199-F429 HydrophobicContact CD1-CZ 4.45Å; L211-F429 HydrophobicContact CD1-CB 4.3Å; L211-F429 HydrophobicContact CD1-CD2 4.18Å; P226-F429 HydrophobicContact CB-CD1 4.44Å; P226-F429 HydrophobicContact CB-CE1 3.94Å; P226-F429 WeakPolarHBondContact O-CE1 3.04Å; P228-F429 HydrophobicContact CB-CD1 4.27Å; P228-F429 HydrophobicContact CB-CD2 4.4Å; P228-F429 HydrophobicContact CB-CE1 3.97Å; P228-F429 HydrophobicContact CB-CE2 4.12Å; P228-F429 HydrophobicContact CB-CG 4.49Å; P228-F429 HydrophobicContact CB-CZ 3.91Å; P228-F429 HydrophobicContact CG-CZ 4.33Å; P427-F429 HydrophobicContact CB-CD2 4.48Å; P427-F429 HydrophobicContact CB-CE2 3.75Å; P427-F429 HydrophobicContact CB-CZ 4.36Å; P427-F429 HydrophobicContact CG-CE2 4.05Å; F429-F431 HydrophobicContact CB-CD1 4Å; F429-F431 HydrophobicContact CB-CD2 3.62Å; F429-F431 HydrophobicContact CB-CE1 3.88Å; F429-F431 HydrophobicContact CB-CE2 3.49Å; F429-F431 VanDerWaalsContact CB-CE2 3.49Å; F429-F431 HydrophobicContact CB-CG 3.88Å; F429-F431 HydrophobicContact CB-CZ 3.63Å; F429-F431 AromaticContact CD1-CE1 3.72Å; F429-F431 HydrophobicContact CD1-CE1 3.72Å; F429-F431 AromaticContact CD1-CE2 3.9Å; F429-F431 HydrophobicContact CD1-CE2 3.9Å; F429-F431 AromaticContact CD1-CZ 3.29Å; F429-F431 HydrophobicContact CD1-CZ 3.29Å; F429-F431 HydrophobicContact CD2-CE2 4.36Å; F429-F431 HydrophobicContact CE1-CZ 4.02Å; F429-F431 HydrophobicContact CG-CD2 4.32Å; F429-F431 HydrophobicContact CG-CE1 4.15Å; F429-F431 AromaticContact CG-CE2 3.68Å; F429-F431 HydrophobicContact CG-CE2 3.68Å; F429-F431 AromaticContact CG-CZ 3.58Å; F429-F431 HydrophobicContact CG-CZ 3.58Å; F429-F431 PolarHBondContact O-N 2.89Å
430	D	74.3	Confident	80.3	Confident	34 Å²	34	16.4 Å²	16.4	18%	0.182	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-79.7	33.9	-178.2	-173.5	44.8	0	0	0	113.4	H432 N433 G434 T435	D430-H432 PolarHBondContact O-N 2.82Å; D430-H432 VanDerWaalsContact O-N 3.12Å; D430-N433 VanDerWaalsContact CG-ND2 3.35Å; D430-N433 PolarHBondContact O-N 3.02Å; D430-N433 WeakPolarHBondContact OD1-CB 3.25Å; D430-N433 PolarHBondContact OD1-ND2 2.76Å; D430-N433 VanDerWaalsContact OD2-CB 3.26Å; D430-N433 WeakPolarHBondContact OD2-CB 3.46Å; D430-N433 PolarHBondContact OD2-ND2 2.82Å; D430-N433 VanDerWaalsContact OD2-ND2 3.13Å; D430-G434 PolarHBondContact O-N 2.79Å; D430-T435 CarbonylContact C-O 3.56Å; D430-T435 WeakPolarHBondContact CB-OG1 3.44Å; D430-T435 VanDerWaalsContact CG-OG1 3.25Å; D430-T435 PolarHBondContact O-N 2.8Å; D430-T435 VanDerWaalsContact O-N 3.13Å; D430-T435 PolarHBondContact O-OG1 3.42Å; D430-T435 PolarHBondContact OD2-OG1 2.87Å
431	F	79.7	Confident	80.3	Confident	19 Å²	19	21.4 Å²	21.4	8%	0.083	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-59	-23.6	175.6	-59.1	-27.5	0	0	0	112.4	L211 P214 L215 I218 P226 F429 G434 T435 F436	L211-F431 HydrophobicContact CB-CD2 4.43Å; L211-F431 HydrophobicContact CD2-CD2 3.97Å; P214-F431 HydrophobicContact CB-CB 3.82Å; P214-F431 HydrophobicContact CB-CD2 3.7Å; P214-F431 HydrophobicContact CB-CG 3.95Å; P214-F431 HydrophobicContact CG-CB 4.48Å; L215-F431 HydrophobicContact CB-CE2 4.03Å; L215-F431 HydrophobicContact CD1-CE2 3.9Å; L215-F431 HydrophobicContact CD1-CZ 3.85Å; I218-F431 HydrophobicContact CD1-CD1 3.4Å; I218-F431 VanDerWaalsContact CD1-CD1 3.4Å; I218-F431 HydrophobicContact CD1-CE1 3.34Å; I218-F431 HydrophobicContact CD1-CG 4.08Å; I218-F431 HydrophobicContact CD1-CZ 3.95Å; P226-F431 HydrophobicContact CB-CE1 4.45Å; P226-F431 HydrophobicContact CB-CZ 4.16Å; F429-F431 HydrophobicContact CB-CD1 4Å; F429-F431 HydrophobicContact CB-CD2 3.62Å; F429-F431 HydrophobicContact CB-CE1 3.88Å; F429-F431 HydrophobicContact CB-CE2 3.49Å; F429-F431 VanDerWaalsContact CB-CE2 3.49Å; F429-F431 HydrophobicContact CB-CG 3.88Å; F429-F431 HydrophobicContact CB-CZ 3.63Å; F429-F431 AromaticContact CD1-CE1 3.72Å; F429-F431 HydrophobicContact CD1-CE1 3.72Å; F429-F431 AromaticContact CD1-CE2 3.9Å; F429-F431 HydrophobicContact CD1-CE2 3.9Å; F429-F431 AromaticContact CD1-CZ 3.29Å; F429-F431 HydrophobicContact CD1-CZ 3.29Å; F429-F431 HydrophobicContact CD2-CE2 4.36Å; F429-F431 HydrophobicContact CE1-CZ 4.02Å; F429-F431 HydrophobicContact CG-CD2 4.32Å; F429-F431 HydrophobicContact CG-CE1 4.15Å; F429-F431 AromaticContact CG-CE2 3.68Å; F429-F431 HydrophobicContact CG-CE2 3.68Å; F429-F431 AromaticContact CG-CZ 3.58Å; F429-F431 HydrophobicContact CG-CZ 3.58Å; F429-F431 PolarHBondContact O-N 2.89Å; F431-G434 WeakPolarHBondContact O-CA 3.47Å; F431-G434 PolarHBondContact O-N 3.47Å; F431-T435 WeakPolarHBondContact CD1-O 3.42Å; F431-F436 HydrophobicContact CD1-CB 4.18Å; F431-F436 HydrophobicContact CE1-CB 3.92Å
432	H	71.1	Confident	79.9	Confident	91 Å²	91	24.4 Å²	24.4	42%	0.421	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-66	-41.4	176.7	-61.8	-66.4	0	0	0	113.1	Y207 D430 G434	Y207-H432 AromaticContact CE2-NE2 3.34Å; Y207-H432 VanDerWaalsContact CE2-NE2 3.34Å; Y207-H432 WeakPolarHBondContact CE2-NE2 3.31Å; Y207-H432 AromaticContact CZ-NE2 3.62Å; Y207-H432 PolarHBondContact OH-CD2 3.35Å; Y207-H432 PolarHBondContact OH-NE2 2.97Å; Y207-H432 VanDerWaalsContact OH-NE2 3.09Å; D430-H432 PolarHBondContact O-N 2.82Å; D430-H432 VanDerWaalsContact O-N 3.12Å; H432-G434 PolarHBondContact O-N 3.32Å
433	N	67.9	Low	79.1	Confident	13 Å²	13	24.6 Å²	24.6	7%	0.07	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-73.6	-4.6	169.5	-83.5	-33	0	0	0	112.8	D430 T435 F1615	D430-N433 VanDerWaalsContact CG-ND2 3.35Å; D430-N433 PolarHBondContact O-N 3.02Å; D430-N433 WeakPolarHBondContact OD1-CB 3.25Å; D430-N433 PolarHBondContact OD1-ND2 2.76Å; D430-N433 VanDerWaalsContact OD2-CB 3.26Å; D430-N433 WeakPolarHBondContact OD2-CB 3.46Å; D430-N433 PolarHBondContact OD2-ND2 2.82Å; D430-N433 VanDerWaalsContact OD2-ND2 3.13Å; N433-T435 HydrophobicContact CB-CG2 4.17Å; N433-F1615 WeakPolarHBondContact OD1-CD1 3.45Å; N433-F1615 WeakPolarHBondContact OD1-CE1 3.35Å
434	G	73.8	Confident	77.9	Confident	11 Å²	11	32.8 Å²	32.8	11%	0.113	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	28.8	-172.7	0	0	0	0	0	112.9	D430 F431 H432 R522 K523	D430-G434 PolarHBondContact O-N 2.79Å; F431-G434 WeakPolarHBondContact O-CA 3.47Å; F431-G434 PolarHBondContact O-N 3.47Å; H432-G434 PolarHBondContact O-N 3.32Å; G434-R522 CarbonylContact O-C 3.48Å; G434-R522 WeakPolarHBondContact O-CA 3.19Å; G434-K523 WeakPolarHBondContact O-CB 3.43Å; G434-K523 PolarHBondContact O-N 2.72Å
435	T	82.2	Confident	76.6	Confident	22 Å²	22	39.4 Å²	39.4	14%	0.135	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	149	173.5	73	0	0	0	0	110.9	D430 F431 N433 G521 R522	D430-T435 CarbonylContact C-O 3.56Å; D430-T435 WeakPolarHBondContact CB-OG1 3.44Å; D430-T435 VanDerWaalsContact CG-OG1 3.25Å; D430-T435 PolarHBondContact O-N 2.8Å; D430-T435 VanDerWaalsContact O-N 3.13Å; D430-T435 PolarHBondContact O-OG1 3.42Å; D430-T435 PolarHBondContact OD2-OG1 2.87Å; F431-T435 WeakPolarHBondContact CD1-O 3.42Å; N433-T435 HydrophobicContact CB-CG2 4.17Å; T435-G521 CarbonylContact C-O 3.41Å; T435-G521 VanDerWaalsContact CA-O 3.22Å; T435-G521 WeakPolarHBondContact CA-O 3.17Å; T435-R522 HydrophobicContact CG2-CB 4.35Å; T435-R522 HydrophobicContact CG2-CG 4.1Å
436	F	86.8	Confident	75.5	Confident	5 Å²	5	42 Å²	42	2%	0.022	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	155.6	171.2	71.3	-97.4	0	0	0	111.1	I218 F222 F431 L520 G521 Y530 F532	I218-F436 HydrophobicContact CD1-CB 3.79Å; I218-F436 HydrophobicContact CD1-CD1 4.17Å; I218-F436 HydrophobicContact CD1-CG 4.13Å; I218-F436 HydrophobicContact CG1-CD1 4.24Å; I218-F436 HydrophobicContact CG1-CG 4.39Å; I218-F436 HydrophobicContact CG2-CB 4.27Å; I218-F436 HydrophobicContact CG2-CD1 4.45Å; I218-F436 HydrophobicContact CG2-CD2 3.85Å; I218-F436 HydrophobicContact CG2-CE2 4.28Å; I218-F436 HydrophobicContact CG2-CG 3.95Å; F222-F436 HydrophobicContact CB-CE2 3.57Å; F222-F436 HydrophobicContact CB-CZ 3.66Å; F222-F436 AromaticContact CD1-CZ 3.82Å; F222-F436 HydrophobicContact CD1-CZ 3.82Å; F222-F436 AromaticContact CD2-CE1 3.67Å; F222-F436 HydrophobicContact CD2-CE1 3.67Å; F222-F436 HydrophobicContact CD2-CE2 4.07Å; F222-F436 AromaticContact CD2-CZ 3.34Å; F222-F436 HydrophobicContact CD2-CZ 3.34Å; F222-F436 HydrophobicContact CE1-CZ 4.31Å; F222-F436 AromaticContact CE2-CE1 3.89Å; F222-F436 HydrophobicContact CE2-CE1 3.89Å; F222-F436 AromaticContact CE2-CZ 3.89Å; F222-F436 HydrophobicContact CE2-CZ 3.89Å; F222-F436 HydrophobicContact CG-CE1 4.13Å; F222-F436 AromaticContact CG-CE2 3.81Å; F222-F436 HydrophobicContact CG-CE2 3.81Å; F222-F436 AromaticContact CG-CZ 3.31Å; F222-F436 HydrophobicContact CG-CZ 3.31Å; F222-F436 HydrophobicContact CZ-CZ 4.34Å; F431-F436 HydrophobicContact CD1-CB 4.18Å; F431-F436 HydrophobicContact CE1-CB 3.92Å; F436-L520 CarbonylContact O-C 3.54Å; F436-L520 WeakPolarHBondContact O-CA 3.19Å; F436-G521 PolarHBondContact N-O 2.67Å; F436-G521 PolarHBondContact O-N 3.39Å; F436-Y530 HydrophobicContact CD1-CD1 4.19Å; F436-Y530 AromaticContact CD1-CE1 3.93Å; F436-Y530 HydrophobicContact CD1-CE1 3.93Å; F436-Y530 AromaticContact CE1-CD1 3.72Å; F436-Y530 HydrophobicContact CE1-CD1 3.72Å; F436-Y530 AromaticContact CE1-CE1 3.77Å; F436-Y530 HydrophobicContact CE1-CE1 3.77Å; F436-Y530 HydrophobicContact CE1-CG 4.14Å; F436-F532 HydrophobicContact CE1-CE1 4.46Å; F436-F532 AromaticContact CZ-CE1 3.95Å; F436-F532 HydrophobicContact CZ-CE1 3.95Å
437	M	84.7	Confident	74.7	Confident	24 Å²	24	41.4 Å²	41.4	12%	0.118	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.8	179.8	-69.2	169.6	69.7	0	0	110.7	P226 L227 I518 L519 L520	P226-M437 CarbonylContact C-O 3.55Å; P226-M437 WeakPolarHBondContact CA-O 3.42Å; L227-M437 HydrophobicContact CB-CB 3.93Å; L227-M437 HydrophobicContact CD1-CB 4.36Å; L227-M437 PolarHBondContact N-O 3.25Å; M437-I518 HydrophobicContact CB-CG2 4.43Å; M437-I518 HydrophobicContact CE-CG2 3.67Å; M437-L519 CarbonylContact C-O 3.58Å; M437-L519 VanDerWaalsContact CA-O 3.3Å; M437-L519 WeakPolarHBondContact CA-O 3.26Å; M437-L520 HydrophobicContact CG-CD1 3.61Å; M437-L520 HydrophobicContact SD-CD1 4.4Å
438	C	85.5	Confident	74	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	140.1	176.3	-68.7	0	0	0	0	109.9	C223 L440 I518 L519	C223-C438 HydrophobicContact CB-CB 3.61Å; C223-C438 WeakPolarHBondContact CB-SG 3.4Å; C223-C438 VanDerWaalsContact SG-CA 3.6Å; C223-C438 WeakPolarHBondContact SG-CB 3.32Å; C223-C438 CovalentContact SG-SG 2.03Å; C223-C438 PolarHBondContact SG-SG 3.26Å; C438-L440 HydrophobicContact CB-CD2 4.32Å; C438-I518 WeakPolarHBondContact O-CA 3.49Å; C438-L519 HydrophobicContact CB-CB 4.35Å; C438-L519 PolarHBondContact N-O 3.5Å; C438-L519 PolarHBondContact O-N 3.47Å
439	H	84.4	Confident	73.5	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.023	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.5	169.4	-155.5	-148.6	0	0	0	110.3	I190 Y192 L227 E516 V517 H569	I190-H439 HydrophobicContact CD1-CB 4.29Å; I190-H439 WeakPolarHBondContact CD1-ND1 3.31Å; I190-H439 PolarHBondContact N-O 3.37Å; I190-H439 VanDerWaalsContact N-O 3.13Å; Y192-H439 HydrophobicContact CE2-CB 4.1Å; Y192-H439 WeakPolarHBondContact OH-CB 3.47Å; Y192-H439 VanDerWaalsContact OH-CG 3.28Å; Y192-H439 PolarHBondContact OH-ND1 2.82Å; L227-H439 HydrophobicContact CD1-CB 4.15Å; H439-E516 IonicContact CE1-OE2 3.64Å; H439-V517 PolarHBondContact CD2-O 2.8Å; H439-H569 AromaticContact CE1-CE1 3.99Å; H439-H569 AromaticContact CE1-ND1 3.93Å; H439-H569 AromaticContact ND1-ND1 3.93Å
440	L	84.6	Confident	73	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.5	179.9	-46.7	176.2	0	0	0	110.8	Y187 E188 D189 C438 E516 V517 L519 F636	Y187-L440 HydrophobicContact CD1-CB 4.3Å; E188-L440 CarbonylContact O-C 3.58Å; E188-L440 VanDerWaalsContact O-CA 3.27Å; E188-L440 WeakPolarHBondContact O-CA 3.43Å; D189-L440 HydrophobicContact CB-CD2 3.88Å; C438-L440 HydrophobicContact CB-CD2 4.32Å; L440-E516 WeakPolarHBondContact O-CA 3.5Å; L440-V517 HydrophobicContact CB-CG2 3.92Å; L440-V517 PolarHBondContact N-O 3.16Å; L440-V517 PolarHBondContact O-N 2.74Å; L440-L519 HydrophobicContact CD1-CB 4.02Å; L440-L519 HydrophobicContact CD1-CD2 3.99Å; L440-L519 HydrophobicContact CG-CB 4.37Å; L440-F636 HydrophobicContact CD1-CD2 4.02Å; L440-F636 HydrophobicContact CD2-CD2 4.21Å; L440-F636 HydrophobicContact CD2-CE2 4.32Å
441	K	83.7	Confident	72.8	Confident	104 Å²	104	42.3 Å²	42.3	45%	0.452	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	140.4	174.4	-163.3	174.8	-177	177	0	110	Y187 E188 I190 T443 E516	Y187-K441 CarbonylContact C-O 3.6Å; Y187-K441 WeakPolarHBondContact CA-O 3.12Å; E188-K441 PolarHBondContact N-O 2.86Å; E188-K441 PolarHBondContact O-N 2.7Å; I190-K441 HydrophobicContact CD1-CB 3.94Å; I190-K441 HydrophobicContact CG1-CB 3.87Å; K441-T443 PolarHBondContact O-N 3.5Å; K441-E516 HydrophobicContact CG-CG 4.3Å
442	Q	77.8	Confident	72.5	Confident	63 Å²	63	44.8 Å²	44.8	29%	0.294	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	125.2	169.1	-169.3	-173	-6.2	0	0	108.9	Y187 K515	Y187-Q442 HydrophobicContact CD1-CB 4.09Å; Y187-Q442 HydrophobicContact CE1-CB 3.82Å; Y187-Q442 HydrophobicContact CE1-CG 4.4Å; Q442-K515 WeakPolarHBondContact CB-O 3.39Å; Q442-K515 PolarHBondContact N-O 3.43Å
443	T	71.3	Confident	72.3	Confident	11 Å²	11	41.7 Å²	41.7	7%	0.067	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-71.3	154.5	174.7	65.6	0	0	0	0	111	I186 E188 K441 Y445	I186-T443 HydrophobicContact CG2-CG2 4.09Å; I186-T443 WeakPolarHBondContact O-CB 3.25Å; I186-T443 WeakPolarHBondContact O-CG2 3.37Å; I186-T443 PolarHBondContact O-N 3.37Å; I186-T443 PolarHBondContact O-OG1 3.27Å; E188-T443 HydrophobicContact CB-CG2 3.81Å; E188-T443 HydrophobicContact CG-CG2 3.74Å; K441-T443 PolarHBondContact O-N 3.5Å; T443-Y445 PolarHBondContact O-N 2.92Å; T443-Y445 VanDerWaalsContact O-N 3.12Å
444	N	59.4	Low	72.2	Confident	172 Å²	172	42 Å²	42	92%	0.92	20%	0.204	S	C	*	.	S	Bend	trans	-68.6	-3.5	174.1	-73	-5.7	0	0	0	113.6	S446	N444-S446 PolarHBondContact O-N 3.24Å
445	Y	54.6	Low	71.6	Confident	154 Å²	154	43.5 Å²	43.5	60%	0.604	21%	0.208	S	C	*	.			trans	-73	97.1	172.8	-89.5	-89.9	0	0	0	110.1	T443	T443-Y445 PolarHBondContact O-N 2.92Å; T443-Y445 VanDerWaalsContact O-N 3.12Å
446	S	53.5	Low	70.8	Confident	57 Å²	57	44 Å²	44	40%	0.399	21%	0.211	S	C	.	.			trans	-54.7	151.4	168.4	34.7	0	0	0	0	111.9	N444 G448 N483	N444-S446 PolarHBondContact O-N 3.24Å; S446-G448 PolarHBondContact O-N 2.81Å; S446-N483 PolarHBondContact OG-OD1 2.81Å
447	R	60.7	Low	69.5	Low	34 Å²	34	45.4 Å²	45.4	13%	0.128	22%	0.218	C	C	.	.	S	Bend	trans	-51	139.1	166.4	-63.7	176.1	176.9	169.6	-5.2	108.4	N182 L183 N483 F484 E505 S509	N182-R447 CarbonylContact O-C 3.56Å; N182-R447 WeakPolarHBondContact O-CA 3.5Å; N182-R447 WeakPolarHBondContact O-CB 3.28Å; L183-R447 WeakPolarHBondContact O-CD 3.14Å; L183-R447 PolarHBondContact O-NE 3.4Å; R447-N483 CarbonylContact O-C 3.51Å; R447-N483 VanDerWaalsContact O-CA 3.31Å; R447-N483 WeakPolarHBondContact O-CA 3.24Å; R447-F484 HydrophobicContact CB-CB 4.02Å; R447-F484 HydrophobicContact CB-CD2 3.98Å; R447-F484 PolarHBondContact O-N 2.78Å; R447-E505 IonicContact CZ-OE1 3.51Å; R447-E505 IonicContact CZ-OE2 3.88Å; R447-E505 IonicContact NH1-OE1 2.75Å; R447-E505 PolarHBondContact NH1-OE1 3.33Å; R447-E505 IonicContact NH1-OE2 3.76Å; R447-E505 PolarHBondContact NH1-OE2 2.96Å; R447-S509 PolarHBondContact NH2-OG 2.84Å
448	G	63	Low	68.2	Low	5 Å²	5	45.6 Å²	45.6	5%	0.052	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177	-175.3	-177.7	0	0	0	0	0	115.3	L181 N182 S446 H482 F484	L181-G448 CarbonylContact C-O 3.56Å; N182-G448 PolarHBondContact N-O 2.89Å; N182-G448 PolarHBondContact O-N 3.45Å; S446-G448 PolarHBondContact O-N 2.81Å; G448-H482 CarbonylContact C-O 3.54Å; G448-H482 WeakPolarHBondContact CA-O 3.21Å; G448-F484 VanDerWaalsContact N-CD2 3.35Å
449	F	65.6	Low	67	Low	9 Å²	9	49 Å²	49	4%	0.039	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	154.5	174.9	64.2	-82.8	0	0	0	111.4	L178 L181 L451 H482 F484 Y490 I501	L178-F449 HydrophobicContact CD1-CB 4.26Å; L178-F449 HydrophobicContact CD1-CD2 3.52Å; L178-F449 HydrophobicContact CD1-CE2 4.15Å; L178-F449 HydrophobicContact CD1-CG 4.12Å; L178-F449 HydrophobicContact CG-CD2 4.47Å; L181-F449 HydrophobicContact CD1-CB 3.8Å; F449-L451 HydrophobicContact CD2-CB 4.12Å; F449-L451 HydrophobicContact CE2-CB 4.02Å; F449-H482 HydrophobicContact CD1-CB 3.95Å; F449-H482 HydrophobicContact CD2-CB 4.39Å; F449-H482 HydrophobicContact CE1-CB 3.48Å; F449-H482 VanDerWaalsContact CE1-CB 3.48Å; F449-H482 HydrophobicContact CE2-CB 3.96Å; F449-H482 AromaticContact CE2-CD2 3.45Å; F449-H482 VanDerWaalsContact CE2-CD2 3.45Å; F449-H482 WeakPolarHBondContact CE2-CD2 3.39Å; F449-H482 AromaticContact CE2-CG 3.95Å; F449-H482 HydrophobicContact CG-CB 4.4Å; F449-H482 HydrophobicContact CZ-CB 3.48Å; F449-H482 VanDerWaalsContact CZ-CB 3.48Å; F449-H482 AromaticContact CZ-CD2 3.64Å; F449-H482 AromaticContact CZ-CG 3.68Å; F449-H482 PolarHBondContact N-O 2.82Å; F449-H482 PolarHBondContact O-N 2.85Å; F449-F484 HydrophobicContact CD1-CD1 4.39Å; F449-F484 AromaticContact CD1-CE1 3.64Å; F449-F484 HydrophobicContact CD1-CE1 3.64Å; F449-F484 AromaticContact CD1-CE2 3.94Å; F449-F484 HydrophobicContact CD1-CE2 3.94Å; F449-F484 AromaticContact CD1-CZ 3.38Å; F449-F484 HydrophobicContact CD1-CZ 3.38Å; F449-F484 HydrophobicContact CE1-CD1 4.35Å; F449-F484 AromaticContact CE1-CE1 3.71Å; F449-F484 HydrophobicContact CE1-CE1 3.71Å; F449-F484 AromaticContact CE1-CZ 3.95Å; F449-F484 HydrophobicContact CE1-CZ 3.95Å; F449-F484 HydrophobicContact CG-CZ 4.32Å; F449-Y490 HydrophobicContact CE1-CG 4.26Å; F449-I501 HydrophobicContact CD1-CD1 4.49Å; F449-I501 HydrophobicContact CD2-CD1 4.14Å; F449-I501 HydrophobicContact CE1-CD1 4.04Å; F449-I501 HydrophobicContact CE2-CD1 3.65Å; F449-I501 HydrophobicContact CZ-CD1 3.6Å
450	R	68.9	Low	65.3	Low	81 Å²	81	51.6 Å²	51.6	31%	0.306	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	109.1	174.6	177.2	-177.8	-176.4	147.4	11.8	108.8	S179 E180 E479	S179-R450 PolarHBondContact N-O 2.81Å; S179-R450 PolarHBondContact O-N 3.3Å; S179-R450 WeakPolarHBondContact OG-CB 3.49Å; S179-R450 WeakPolarHBondContact OG-CG 3.31Å; S179-R450 PolarHBondContact OG-O 3.49Å; E180-R450 HydrophobicContact CB-CB 4.02Å; E180-R450 HydrophobicContact CG-CB 4.33Å; E180-R450 WeakPolarHBondContact OE1-CD 3.45Å; E180-R450 IonicContact OE1-CZ 3.13Å; E180-R450 IonicContact OE1-NE 3.66Å; E180-R450 IonicContact OE1-NH1 2.69Å; E180-R450 PolarHBondContact OE1-NH1 3.4Å; R450-E479 HydrophobicContact CG-CG 4.28Å; R450-E479 IonicContact CZ-OE1 2.71Å; R450-E479 IonicContact CZ-OE2 3.53Å; R450-E479 IonicContact NE-OE1 3.44Å; R450-E479 PolarHBondContact NE-OE1 2.86Å; R450-E479 IonicContact NE-OE2 3.14Å; R450-E479 VanDerWaalsContact NH2-CD 3.29Å; R450-E479 IonicContact NH2-OE1 2.75Å; R450-E479 PolarHBondContact NH2-OE1 2.81Å; R450-E479 IonicContact NH2-OE2 2.75Å; R450-E479 PolarHBondContact NH2-OE2 2.56Å
451	L	69.9	Low	63.9	Low	9 Å²	9	55.4 Å²	55.4	5%	0.047	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	127.9	-180	-176.1	75.4	0	0	0	109.7	V176 L178 F449 E479 S480 L492	V176-L451 HydrophobicContact CG1-CD1 3.61Å; L178-L451 HydrophobicContact CD1-CD1 4.08Å; F449-L451 HydrophobicContact CD2-CB 4.12Å; F449-L451 HydrophobicContact CE2-CB 4.02Å; L451-E479 CarbonylContact O-C 3.47Å; L451-E479 WeakPolarHBondContact O-CA 3.47Å; L451-S480 PolarHBondContact N-O 2.66Å; L451-S480 PolarHBondContact O-N 2.89Å; L451-L492 HydrophobicContact CD2-CD1 4.4Å; L451-L492 HydrophobicContact CD2-CD2 3.52Å
452	K	73	Confident	62.5	Low	71 Å²	71	56.9 Å²	56.9	31%	0.309	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	109.7	175.4	176.3	179.7	159.6	-148.6	0	109.5	E177 V478 E479	E177-K452 HydrophobicContact CB-CB 4.2Å; E177-K452 PolarHBondContact N-O 2.87Å; E177-K452 PolarHBondContact O-N 3.37Å; E177-K452 WeakPolarHBondContact OE2-CE 3.25Å; E177-K452 IonicContact OE2-NZ 3.31Å; E177-K452 PolarHBondContact OE2-NZ 3.46Å; K452-V478 CarbonylContact C-O 3.55Å; K452-V478 WeakPolarHBondContact CA-O 3.05Å; K452-E479 HydrophobicContact CB-CB 4.42Å; K452-E479 HydrophobicContact CB-CG 4.23Å; K452-E479 HydrophobicContact CG-CB 4.43Å
453	F	67.3	Low	61.3	Low	26 Å²	26	62 Å²	62	11%	0.114	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.5	-178.5	172.6	-94.1	0	0	0	108.7	V174 V176 I455 S477 V478 I494 L497	V174-F453 HydrophobicContact CG1-CD2 4.26Å; V174-F453 HydrophobicContact CG1-CE2 3.51Å; V174-F453 HydrophobicContact CG1-CZ 4.03Å; V176-F453 HydrophobicContact CG2-CD2 3.93Å; V176-F453 HydrophobicContact CG2-CE2 4.44Å; F453-I455 HydrophobicContact CD1-CG1 4.39Å; F453-I455 HydrophobicContact CE1-CD1 3.68Å; F453-I455 HydrophobicContact CE1-CG1 3.44Å; F453-I455 VanDerWaalsContact CE1-CG1 3.44Å; F453-I455 HydrophobicContact CZ-CD1 3.79Å; F453-I455 HydrophobicContact CZ-CG1 3.56Å; F453-S477 CarbonylContact O-C 3.55Å; F453-S477 VanDerWaalsContact O-CA 3.32Å; F453-S477 WeakPolarHBondContact O-CA 3.37Å; F453-V478 PolarHBondContact N-O 2.95Å; F453-V478 PolarHBondContact O-N 2.81Å; F453-I494 HydrophobicContact CD1-CD1 4.43Å; F453-I494 HydrophobicContact CD2-CD1 3.71Å; F453-I494 HydrophobicContact CE1-CD1 4.47Å; F453-I494 HydrophobicContact CE2-CD1 3.79Å; F453-I494 HydrophobicContact CG-CD1 4.06Å; F453-I494 HydrophobicContact CZ-CD1 4.18Å; F453-I494 HydrophobicContact CZ-CG2 4.34Å; F453-L497 HydrophobicContact CE2-CD2 4.32Å
454	S	64.8	Low	60	Low	19 Å²	19	69.7 Å²	69.7	13%	0.133	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	119.9	174	68.2	0	0	0	0	112.5	N175 I476	N175-S454 PolarHBondContact N-O 3.27Å; N175-S454 PolarHBondContact O-N 2.84Å; S454-I476 CarbonylContact C-O 3.57Å; S454-I476 VanDerWaalsContact CA-O 3.26Å; S454-I476 WeakPolarHBondContact CA-O 3.27Å
455	I	62.7	Low	59.4	Low	42 Å²	42	65.3 Å²	65.3	22%	0.215	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120	168.2	-51.2	176.7	0	0	0	107.7	I172 H173 F453 L457 I475 I476	I172-I455 HydrophobicContact CG2-CG2 3.71Å; H173-I455 CarbonylContact O-C 3.5Å; H173-I455 WeakPolarHBondContact O-CA 3.24Å; F453-I455 HydrophobicContact CD1-CG1 4.39Å; F453-I455 HydrophobicContact CE1-CD1 3.68Å; F453-I455 HydrophobicContact CE1-CG1 3.44Å; F453-I455 VanDerWaalsContact CE1-CG1 3.44Å; F453-I455 HydrophobicContact CZ-CD1 3.79Å; F453-I455 HydrophobicContact CZ-CG1 3.56Å; I455-L457 HydrophobicContact CG2-CD2 3.68Å; I455-L457 HydrophobicContact CG2-CG 4.03Å; I455-I475 CarbonylContact O-C 3.56Å; I455-I475 VanDerWaalsContact O-CA 3.27Å; I455-I475 WeakPolarHBondContact O-CA 3.15Å; I455-I476 PolarHBondContact N-O 3.4Å; I455-I476 PolarHBondContact O-N 2.76Å
456	D	64.2	Low	58.9	Low	34 Å²	34	63.3 Å²	63.3	18%	0.182	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	120	167.1	179.6	6.4	0	0	0	109.3	H173 S458 I475	H173-D456 HydrophobicContact CB-CB 4.09Å; H173-D456 PolarHBondContact N-O 2.65Å; H173-D456 PolarHBondContact O-N 3.41Å; D456-S458 WeakPolarHBondContact OD1-CB 3.27Å; D456-S458 PolarHBondContact OD1-N 2.84Å; D456-S458 PolarHBondContact OD1-OG 3.42Å; D456-I475 HydrophobicContact CB-CG1 4.01Å
457	L	59.7	Low	58.3	Low	33 Å²	33	66.2 Å²	66.2	17%	0.173	33%	0.326	C	S	.	.			trans	-99.3	5.5	-178.4	-61.1	172.8	0	0	0	113	I172 I455 E459 L460 F461 T474 I476	I172-L457 HydrophobicContact CG1-CD2 4.3Å; I172-L457 HydrophobicContact CG2-CD2 4.28Å; I455-L457 HydrophobicContact CG2-CD2 3.68Å; I455-L457 HydrophobicContact CG2-CG 4.03Å; L457-E459 PolarHBondContact O-N 2.83Å; L457-L460 VanDerWaalsContact O-CB 3.31Å; L457-L460 WeakPolarHBondContact O-CB 3.47Å; L457-L460 PolarHBondContact O-N 3.37Å; L457-F461 HydrophobicContact CB-CD2 3.92Å; L457-F461 HydrophobicContact CB-CE2 3.81Å; L457-F461 HydrophobicContact CD1-CE2 4.21Å; L457-F461 WeakPolarHBondContact O-CD2 3.38Å; L457-F461 PolarHBondContact O-N 3.3Å; L457-T474 PolarHBondContact N-O 2.99Å; L457-I476 HydrophobicContact CD1-CD1 4.36Å
458	S	58.3	Low	57.4	Low	28 Å²	28	71.6 Å²	71.6	20%	0.196	36%	0.357	C	S	.	.	H	α-helix	trans	-52.8	-46.8	-167.9	-64	0	0	0	0	114.7	D456 L460 F461 K462 T474	D456-S458 WeakPolarHBondContact OD1-CB 3.27Å; D456-S458 PolarHBondContact OD1-N 2.84Å; D456-S458 PolarHBondContact OD1-OG 3.42Å; S458-L460 VanDerWaalsContact C-N 3.29Å; S458-L460 PolarHBondContact O-N 3.14Å; S458-F461 PolarHBondContact O-N 3.47Å; S458-K462 WeakPolarHBondContact O-CG 3.41Å; S458-K462 PolarHBondContact O-N 3.25Å; S458-T474 PolarHBondContact OG-OG1 3.5Å
459	E	58.5	Low	56	Low	73 Å²	73	82.2 Å²	82.2	34%	0.341	40%	0.398	S	S	.	.	H	α-helix	trans	-65.8	-33.1	-179.8	-60.6	-51.9	131.4	0	0	112.6	L457 F461 K462 Q463	L457-E459 PolarHBondContact O-N 2.83Å; E459-F461 VanDerWaalsContact C-N 3.3Å; E459-F461 PolarHBondContact O-N 3.09Å; E459-K462 PolarHBondContact O-N 3.09Å; E459-K462 IonicContact OE1-NZ 3.4Å; E459-K462 PolarHBondContact OE1-NZ 2.88Å; E459-K462 WeakPolarHBondContact OE2-CD 3.42Å; E459-K462 IonicContact OE2-NZ 3.5Å; E459-Q463 PolarHBondContact O-N 3.04Å
460	L	50.4	Low	54.7	Low	58 Å²	58	87.2 Å²	87.2	30%	0.304	43%	0.428	S	S	.	.	H	α-helix	trans	-68	-29.8	177	-131.5	168.6	0	0	0	112.4	S170 I172 L457 S458	S170-L460 WeakPolarHBondContact O-CD1 3.39Å; S170-L460 WeakPolarHBondContact O-CG 3.23Å; I172-L460 HydrophobicContact CD1-CD1 4.15Å; I172-L460 HydrophobicContact CG1-CD1 3.54Å; L457-L460 VanDerWaalsContact O-CB 3.31Å; L457-L460 WeakPolarHBondContact O-CB 3.47Å; L457-L460 PolarHBondContact O-N 3.37Å; S458-L460 VanDerWaalsContact C-N 3.29Å; S458-L460 PolarHBondContact O-N 3.14Å
461	F	54.9	Low	53.3	Low	80 Å²	80	91 Å²	91	35%	0.351	46%	0.455	S	S	.	.	H	α-helix	trans	-81.2	-40.4	170.8	-76.1	-80.4	0	0	0	112	L457 S458 E459 Q463 K464 I465 T474	L457-F461 HydrophobicContact CB-CD2 3.92Å; L457-F461 HydrophobicContact CB-CE2 3.81Å; L457-F461 HydrophobicContact CD1-CE2 4.21Å; L457-F461 WeakPolarHBondContact O-CD2 3.38Å; L457-F461 PolarHBondContact O-N 3.3Å; S458-F461 PolarHBondContact O-N 3.47Å; E459-F461 VanDerWaalsContact C-N 3.3Å; E459-F461 PolarHBondContact O-N 3.09Å; F461-Q463 VanDerWaalsContact C-N 3.31Å; F461-Q463 PolarHBondContact O-N 2.94Å; F461-K464 PolarHBondContact O-N 2.98Å; F461-I465 HydrophobicContact CD1-CD1 3.81Å; F461-I465 PolarHBondContact O-N 2.93Å; F461-T474 HydrophobicContact CB-CG2 4.4Å; F461-T474 HydrophobicContact CD2-CG2 3.43Å; F461-T474 VanDerWaalsContact CD2-CG2 3.43Å; F461-T474 HydrophobicContact CE2-CG2 3.92Å; F461-T474 HydrophobicContact CG-CG2 4.08Å
462	K	53.6	Low	52	Low	135 Å²	135	94.1 Å²	94.1	59%	0.587	48%	0.477	S	S	*	.	H	α-helix	trans	-57.9	-38.9	175.3	-73.5	172.8	-177.1	174.9	0	113.2	S458 E459 K464	S458-K462 WeakPolarHBondContact O-CG 3.41Å; S458-K462 PolarHBondContact O-N 3.25Å; E459-K462 PolarHBondContact O-N 3.09Å; E459-K462 IonicContact OE1-NZ 3.4Å; E459-K462 PolarHBondContact OE1-NZ 2.88Å; E459-K462 WeakPolarHBondContact OE2-CD 3.42Å; E459-K462 IonicContact OE2-NZ 3.5Å; K462-K464 PolarHBondContact O-N 3.49Å
463	Q	51.7	Low	50.6	Low	172 Å²	172	102 Å²	102	80%	0.804	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-8.7	176.8	-76.1	-168.6	-18.2	0	0	114.4	E459 F461	E459-Q463 PolarHBondContact O-N 3.04Å; F461-Q463 VanDerWaalsContact C-N 3.31Å; F461-Q463 PolarHBondContact O-N 2.94Å
464	K	45.3	Very low	49.9	Very low	172 Å²	172	102.2 Å²	102.2	75%	0.748	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	-8.6	-170.5	-136.6	176.1	-172.9	179.7	0	115.3	F461 K462	F461-K464 PolarHBondContact O-N 2.98Å; K462-K464 PolarHBondContact O-N 3.49Å
465	I	46.4	Very low	49.3	Very low	80 Å²	80	105.4 Å²	105.4	41%	0.41	52%	0.523	S	S	.	.			trans	-125	81.9	175.5	-54.1	-175.4	0	0	0	107.9	F461 D467 N468	F461-I465 HydrophobicContact CD1-CD1 3.81Å; F461-I465 PolarHBondContact O-N 2.93Å; I465-D467 VanDerWaalsContact CG2-O 3.27Å; I465-D467 WeakPolarHBondContact CG2-O 3.35Å; I465-N468 WeakPolarHBondContact CG2-O 3.29Å
466	S	44.4	Very low	49	Very low	111 Å²	111	108.1 Å²	108.1	78%	0.776	54%	0.537	S	S	*	.	S	Bend	trans	-70.6	-21.5	164.3	46.6	0	0	0	0	112.1
467	D	40.7	Very low	48.7	Very low	118 Å²	118	110.3 Å²	110.3	63%	0.631	56%	0.555	S	S	*	*	S	Bend	trans	-133	127	-167.5	-62.7	-88.2	0	0	0	111.9	I465	I465-D467 VanDerWaalsContact CG2-O 3.27Å; I465-D467 WeakPolarHBondContact CG2-O 3.35Å
468	N	42.7	Very low	48.7	Very low	147 Å²	147	111.4 Å²	111.4	79%	0.786	56%	0.563	S	S	*	*	S	Bend	trans	75	134.1	175	-61.5	-47.8	0	0	0	119	I465 V470	I465-N468 WeakPolarHBondContact CG2-O 3.29Å; N468-V470 PolarHBondContact O-N 3.02Å
469	Y	32.4	Very low	49.1	Very low	229 Å²	229	114 Å²	114	90%	0.898	57%	0.572	S	S	*	*			trans	-70.5	120.9	-176.2	-86	-122.2	0	0	0	112.8
470	V	39.5	Very low	49.2	Very low	113 Å²	113	111.3 Å²	111.3	69%	0.685	56%	0.561	S	S	*	*			trans	-133.3	99.6	150.4	-172.9	0	0	0	0	108.6	N468 S472	N468-V470 PolarHBondContact O-N 3.02Å; V470-S472 PolarHBondContact O-N 2.98Å
471	N	38.3	Very low	49.8	Very low	162 Å²	162	114.5 Å²	114.5	87%	0.866	57%	0.574	S	S	*	*			trans	-82.7	38.3	-177.5	-156.4	10.7	0	0	0	112.2
472	S	42.6	Very low	50.1	Low	73 Å²	73	112.3 Å²	112.3	51%	0.51	57%	0.565	S	S	.	*			trans	-73.5	129.2	178.9	54.1	0	0	0	0	109.9	V470 T474	V470-S472 PolarHBondContact O-N 2.98Å; S472-T474 PolarHBondContact O-N 2.88Å
473	R	43.2	Very low	50.4	Low	237 Å²	237	110 Å²	110	89%	0.894	56%	0.559	S	S	*	*			trans	-55.1	103.8	179.7	-71.5	178.6	176.3	163.7	-0.5	111.1	I475	R473-I475 PolarHBondContact O-N 3.08Å; R473-I475 VanDerWaalsContact O-N 3.08Å
474	T	52.7	Low	50.8	Low	30 Å²	30	102.9 Å²	102.9	18%	0.184	53%	0.526	C	S	.	.			trans	-68.3	3.5	174.9	41	0	0	0	0	114.1	L457 S458 F461 S472	L457-T474 PolarHBondContact N-O 2.99Å; S458-T474 PolarHBondContact OG-OG1 3.5Å; F461-T474 HydrophobicContact CB-CG2 4.4Å; F461-T474 HydrophobicContact CD2-CG2 3.43Å; F461-T474 VanDerWaalsContact CD2-CG2 3.43Å; F461-T474 HydrophobicContact CE2-CG2 3.92Å; F461-T474 HydrophobicContact CG-CG2 4.08Å; S472-T474 PolarHBondContact O-N 2.88Å
475	I	53.4	Low	51.1	Low	87 Å²	87	95.7 Å²	95.7	45%	0.446	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	101.3	-175.6	-52.6	178.8	0	0	0	109.3	I455 D456 R473 S477	I455-I475 CarbonylContact O-C 3.56Å; I455-I475 VanDerWaalsContact O-CA 3.27Å; I455-I475 WeakPolarHBondContact O-CA 3.15Å; D456-I475 HydrophobicContact CB-CG1 4.01Å; R473-I475 PolarHBondContact O-N 3.08Å; R473-I475 VanDerWaalsContact O-N 3.08Å; I475-S477 PolarHBondContact O-N 2.95Å
476	I	56.4	Low	51.1	Low	99 Å²	99	94.6 Å²	94.6	51%	0.508	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	106.1	173.7	-59.2	172.9	0	0	0	107.9	S454 I455 L457	S454-I476 CarbonylContact C-O 3.57Å; S454-I476 VanDerWaalsContact CA-O 3.26Å; S454-I476 WeakPolarHBondContact CA-O 3.27Å; I455-I476 PolarHBondContact N-O 3.4Å; I455-I476 PolarHBondContact O-N 2.76Å; L457-I476 HydrophobicContact CD1-CD1 4.36Å
477	S	58.6	Low	51.1	Low	79 Å²	79	98.6 Å²	98.6	55%	0.552	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.8	178.5	63	0	0	0	0	113.1	F453 I475	F453-S477 CarbonylContact O-C 3.55Å; F453-S477 VanDerWaalsContact O-CA 3.32Å; F453-S477 WeakPolarHBondContact O-CA 3.37Å; I475-S477 PolarHBondContact O-N 2.95Å
478	V	58.6	Low	51.5	Low	56 Å²	56	98.3 Å²	98.3	34%	0.339	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.4	171	-178.9	0	0	0	0	108.5	K452 F453	K452-V478 CarbonylContact C-O 3.55Å; K452-V478 WeakPolarHBondContact CA-O 3.05Å; F453-V478 PolarHBondContact N-O 2.95Å; F453-V478 PolarHBondContact O-N 2.81Å
479	E	66.2	Low	51.8	Low	84 Å²	84	97 Å²	97	39%	0.393	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	131.3	178.2	-177.8	167.2	-116.9	0	0	110	R450 L451 K452	R450-E479 HydrophobicContact CG-CG 4.28Å; R450-E479 IonicContact CZ-OE1 2.71Å; R450-E479 IonicContact CZ-OE2 3.53Å; R450-E479 IonicContact NE-OE1 3.44Å; R450-E479 PolarHBondContact NE-OE1 2.86Å; R450-E479 IonicContact NE-OE2 3.14Å; R450-E479 VanDerWaalsContact NH2-CD 3.29Å; R450-E479 IonicContact NH2-OE1 2.75Å; R450-E479 PolarHBondContact NH2-OE1 2.81Å; R450-E479 IonicContact NH2-OE2 2.75Å; R450-E479 PolarHBondContact NH2-OE2 2.56Å; L451-E479 CarbonylContact O-C 3.47Å; L451-E479 WeakPolarHBondContact O-CA 3.47Å; K452-E479 HydrophobicContact CB-CB 4.42Å; K452-E479 HydrophobicContact CB-CG 4.23Å; K452-E479 HydrophobicContact CG-CB 4.43Å
480	S	60.6	Low	52.8	Low	16 Å²	16	87.9 Å²	87.9	11%	0.112	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	136.8	-177.5	59.8	0	0	0	0	111.6	L451 H482	L451-S480 PolarHBondContact N-O 2.66Å; L451-S480 PolarHBondContact O-N 2.89Å; S480-H482 WeakPolarHBondContact CB-NE2 3.5Å; S480-H482 PolarHBondContact OG-NE2 2.8Å
481	Q	63.5	Low	53.4	Low	124 Å²	124	87.4 Å²	87.4	58%	0.579	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.7	175	-173	175.5	-7.1	0	0	109.7
482	H	62.4	Low	54	Low	35 Å²	35	82.2 Å²	82.2	16%	0.162	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.8	-177.3	-63	-79.4	0	0	0	110.3	G448 F449 S480	G448-H482 CarbonylContact C-O 3.54Å; G448-H482 WeakPolarHBondContact CA-O 3.21Å; F449-H482 HydrophobicContact CD1-CB 3.95Å; F449-H482 HydrophobicContact CD2-CB 4.39Å; F449-H482 HydrophobicContact CE1-CB 3.48Å; F449-H482 VanDerWaalsContact CE1-CB 3.48Å; F449-H482 HydrophobicContact CE2-CB 3.96Å; F449-H482 AromaticContact CE2-CD2 3.45Å; F449-H482 VanDerWaalsContact CE2-CD2 3.45Å; F449-H482 WeakPolarHBondContact CE2-CD2 3.39Å; F449-H482 AromaticContact CE2-CG 3.95Å; F449-H482 HydrophobicContact CG-CB 4.4Å; F449-H482 HydrophobicContact CZ-CB 3.48Å; F449-H482 VanDerWaalsContact CZ-CB 3.48Å; F449-H482 AromaticContact CZ-CD2 3.64Å; F449-H482 AromaticContact CZ-CG 3.68Å; F449-H482 PolarHBondContact N-O 2.82Å; F449-H482 PolarHBondContact O-N 2.85Å; S480-H482 WeakPolarHBondContact CB-NE2 3.5Å; S480-H482 PolarHBondContact OG-NE2 2.8Å
483	N	59.3	Low	54	Low	85 Å²	85	83.2 Å²	83.2	46%	0.455	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	137.7	170.2	-67.8	-50.7	0	0	0	109.4	S446 R447 G485 Y490	S446-N483 PolarHBondContact OG-OD1 2.81Å; R447-N483 CarbonylContact O-C 3.51Å; R447-N483 VanDerWaalsContact O-CA 3.31Å; R447-N483 WeakPolarHBondContact O-CA 3.24Å; N483-G485 PolarHBondContact O-N 2.81Å; N483-Y490 PolarHBondContact O-OH 2.81Å
484	F	59.1	Low	54.2	Low	23 Å²	23	74.5 Å²	74.5	10%	0.101	38%	0.38	C	S	.	.			trans	-76.4	104.4	175.4	-68.2	-67.3	0	0	0	110.5	L181 L183 R447 G448 F449 Y490 I501 V503	L181-F484 HydrophobicContact CD1-CE2 3.88Å; L181-F484 HydrophobicContact CD1-CZ 3.82Å; L183-F484 HydrophobicContact CD2-CE2 3.83Å; L183-F484 HydrophobicContact CD2-CZ 4.08Å; R447-F484 HydrophobicContact CB-CB 4.02Å; R447-F484 HydrophobicContact CB-CD2 3.98Å; R447-F484 PolarHBondContact O-N 2.78Å; G448-F484 VanDerWaalsContact N-CD2 3.35Å; F449-F484 HydrophobicContact CD1-CD1 4.39Å; F449-F484 AromaticContact CD1-CE1 3.64Å; F449-F484 HydrophobicContact CD1-CE1 3.64Å; F449-F484 AromaticContact CD1-CE2 3.94Å; F449-F484 HydrophobicContact CD1-CE2 3.94Å; F449-F484 AromaticContact CD1-CZ 3.38Å; F449-F484 HydrophobicContact CD1-CZ 3.38Å; F449-F484 HydrophobicContact CE1-CD1 4.35Å; F449-F484 AromaticContact CE1-CE1 3.71Å; F449-F484 HydrophobicContact CE1-CE1 3.71Å; F449-F484 AromaticContact CE1-CZ 3.95Å; F449-F484 HydrophobicContact CE1-CZ 3.95Å; F449-F484 HydrophobicContact CG-CZ 4.32Å; F484-Y490 HydrophobicContact CB-CE2 4.4Å; F484-Y490 AromaticContact CD1-CD2 3.61Å; F484-Y490 HydrophobicContact CD1-CD2 3.61Å; F484-Y490 AromaticContact CD1-CE2 3.6Å; F484-Y490 HydrophobicContact CD1-CE2 3.6Å; F484-Y490 AromaticContact CE1-CD2 3.98Å; F484-Y490 HydrophobicContact CE1-CD2 3.98Å; F484-Y490 HydrophobicContact CE1-CE2 4.41Å; F484-Y490 HydrophobicContact CG-CE2 4.44Å; F484-I501 HydrophobicContact CE1-CG2 4.19Å; F484-I501 HydrophobicContact CZ-CG2 4.47Å; F484-V503 HydrophobicContact CD1-CG2 3.94Å; F484-V503 HydrophobicContact CE1-CG2 3.44Å; F484-V503 VanDerWaalsContact CE1-CG2 3.44Å; F484-V503 HydrophobicContact CZ-CG2 3.86Å
485	G	52.2	Low	53.7	Low	22 Å²	22	79.5 Å²	79.5	23%	0.227	41%	0.406	C	S	.	.			trans	-65.9	165.3	170.7	0	0	0	0	0	113.1	N483 Y487 E488 Y490	N483-G485 PolarHBondContact O-N 2.81Å; G485-Y487 VanDerWaalsContact C-N 3.26Å; G485-Y487 PolarHBondContact O-N 2.83Å; G485-E488 WeakPolarHBondContact CA-OE1 3.25Å; G485-Y490 PolarHBondContact N-OH 2.87Å
486	A	46.9	Very low	53.1	Low	57 Å²	57	77.8 Å²	77.8	47%	0.471	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.7	-160.5	0	0	0	0	0	115.3	R512	A486-R512 VanDerWaalsContact O-CZ 3.26Å; A486-R512 PolarHBondContact O-NH1 3.28Å; A486-R512 PolarHBondContact O-NH2 2.91Å
487	Y	43.7	Very low	52.5	Low	194 Å²	194	74.1 Å²	74.1	76%	0.761	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.2	26.8	-178.2	-74.4	-78.1	0	0	0	112.7	G485	G485-Y487 VanDerWaalsContact C-N 3.26Å; G485-Y487 PolarHBondContact O-N 2.83Å
488	E	48.6	Very low	52.1	Low	113 Å²	113	70.7 Å²	70.7	53%	0.528	36%	0.361	S	S	.	.			trans	-97.4	120.6	-164.2	-79.4	159.7	-121	0	0	114.4	G485 Y490	G485-E488 WeakPolarHBondContact CA-OE1 3.25Å; E488-Y490 HydrophobicContact CB-CD2 4.33Å; E488-Y490 HydrophobicContact CB-CE1 4.49Å; E488-Y490 HydrophobicContact CB-CE2 3.56Å; E488-Y490 WeakPolarHBondContact CB-OH 3.1Å; E488-Y490 VanDerWaalsContact O-CD2 3.32Å; E488-Y490 WeakPolarHBondContact O-CD2 3.36Å; E488-Y490 WeakPolarHBondContact O-CE2 3.44Å; E488-Y490 PolarHBondContact O-N 2.87Å; E488-Y490 PolarHBondContact OE2-OH 2.77Å
489	K	50.6	Low	51.9	Low	118 Å²	118	68.3 Å²	68.3	51%	0.513	35%	0.347	S	S	.	.			trans	-82.8	96.8	170.3	-166.4	-162.1	-158.6	-160.3	0	108.6	K491 E500 L502	K489-K491 PolarHBondContact O-N 3.07Å; K489-E500 WeakPolarHBondContact CE-OE1 3.4Å; K489-E500 IonicContact NZ-OE1 2.71Å; K489-E500 PolarHBondContact NZ-OE1 2.84Å; K489-L502 HydrophobicContact CD-CD2 4.43Å; K489-L502 HydrophobicContact CG-CD2 4.19Å; K489-L502 HydrophobicContact CG-CG 4.37Å
490	Y	52.7	Low	51.4	Low	39 Å²	39	65.3 Å²	65.3	15%	0.153	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	100.5	-176.4	-73.8	-82.6	0	0	0	111.3	F449 N483 F484 G485 E488 I501	F449-Y490 HydrophobicContact CE1-CG 4.26Å; N483-Y490 PolarHBondContact O-OH 2.81Å; F484-Y490 HydrophobicContact CB-CE2 4.4Å; F484-Y490 AromaticContact CD1-CD2 3.61Å; F484-Y490 HydrophobicContact CD1-CD2 3.61Å; F484-Y490 AromaticContact CD1-CE2 3.6Å; F484-Y490 HydrophobicContact CD1-CE2 3.6Å; F484-Y490 AromaticContact CE1-CD2 3.98Å; F484-Y490 HydrophobicContact CE1-CD2 3.98Å; F484-Y490 HydrophobicContact CE1-CE2 4.41Å; F484-Y490 HydrophobicContact CG-CE2 4.44Å; G485-Y490 PolarHBondContact N-OH 2.87Å; E488-Y490 HydrophobicContact CB-CD2 4.33Å; E488-Y490 HydrophobicContact CB-CE1 4.49Å; E488-Y490 HydrophobicContact CB-CE2 3.56Å; E488-Y490 WeakPolarHBondContact CB-OH 3.1Å; E488-Y490 VanDerWaalsContact O-CD2 3.32Å; E488-Y490 WeakPolarHBondContact O-CD2 3.36Å; E488-Y490 WeakPolarHBondContact O-CE2 3.44Å; E488-Y490 PolarHBondContact O-N 2.87Å; E488-Y490 PolarHBondContact OE2-OH 2.77Å; Y490-I501 PolarHBondContact N-O 2.86Å; Y490-I501 PolarHBondContact O-N 3.03Å
491	K	52.1	Low	51.3	Low	103 Å²	103	64.8 Å²	64.8	45%	0.448	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	88.7	173.2	-172.7	-178.8	-177.1	179.3	0	109.2	K489 N493 N498 V499 E500 H656	K489-K491 PolarHBondContact O-N 3.07Å; K491-N493 PolarHBondContact O-N 3.13Å; K491-N498 WeakPolarHBondContact CE-OD1 3.45Å; K491-N498 WeakPolarHBondContact CG-OD1 3.49Å; K491-V499 WeakPolarHBondContact CA-O 3.32Å; K491-E500 HydrophobicContact CG-CG 4.27Å; K491-H656 PolarHBondContact NZ-NE2 3.47Å
492	L	50.5	Low	50.9	Low	53 Å²	53	61.3 Å²	61.3	28%	0.277	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	100	173.9	-169.3	109.5	0	0	0	108.8	L451 I494 V499	L451-L492 HydrophobicContact CD2-CD1 4.4Å; L451-L492 HydrophobicContact CD2-CD2 3.52Å; L492-I494 HydrophobicContact CD2-CD1 3.7Å; L492-I494 HydrophobicContact CD2-CG1 3.78Å; L492-I494 PolarHBondContact O-N 2.69Å; L492-V499 HydrophobicContact CB-CB 4.24Å; L492-V499 HydrophobicContact CD2-CG2 4.42Å; L492-V499 PolarHBondContact N-O 3.31Å; L492-V499 PolarHBondContact O-N 2.72Å
493	N	44	Very low	50.6	Low	94 Å²	94	61.1 Å²	61.1	50%	0.503	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	80.1	-175.4	-169.1	42.3	0	0	0	110.8	K491	K491-N493 PolarHBondContact O-N 3.13Å
494	I	47	Very low	50.3	Low	54 Å²	54	61.2 Å²	61.2	28%	0.277	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	138.2	166.1	-62.8	172.1	0	0	0	107.2	F453 L492 A496 L497	F453-I494 HydrophobicContact CD1-CD1 4.43Å; F453-I494 HydrophobicContact CD2-CD1 3.71Å; F453-I494 HydrophobicContact CE1-CD1 4.47Å; F453-I494 HydrophobicContact CE2-CD1 3.79Å; F453-I494 HydrophobicContact CG-CD1 4.06Å; F453-I494 HydrophobicContact CZ-CD1 4.18Å; F453-I494 HydrophobicContact CZ-CG2 4.34Å; L492-I494 HydrophobicContact CD2-CD1 3.7Å; L492-I494 HydrophobicContact CD2-CG1 3.78Å; L492-I494 PolarHBondContact O-N 2.69Å; I494-A496 PolarHBondContact O-N 3.37Å; I494-L497 HydrophobicContact CB-CB 4.48Å; I494-L497 PolarHBondContact N-O 3.07Å; I494-L497 CarbonylContact O-C 3.6Å; I494-L497 PolarHBondContact O-N 2.7Å
495	N	42.2	Very low	50	Low	135 Å²	135	63 Å²	63	72%	0.722	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-2.5	-165.8	-72	-19.3	0	0	0	117.7	V658	N495-V658 WeakPolarHBondContact O-CG2 3.32Å
496	A	40.5	Very low	49.7	Very low	50 Å²	50	64.1 Å²	64.1	41%	0.413	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.7	18.1	169.6	0	0	0	0	0	113.7	R168 I494	R168-A496 PolarHBondContact NH2-O 3.36Å; I494-A496 PolarHBondContact O-N 3.37Å
497	L	43.5	Very low	49.6	Very low	22 Å²	22	69 Å²	69	12%	0.115	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	99.9	-177	-166	93	0	0	0	109.9	V176 F453 I494 V499 L652	V176-L497 HydrophobicContact CG2-CD2 4Å; F453-L497 HydrophobicContact CE2-CD2 4.32Å; I494-L497 HydrophobicContact CB-CB 4.48Å; I494-L497 PolarHBondContact N-O 3.07Å; I494-L497 CarbonylContact O-C 3.6Å; I494-L497 PolarHBondContact O-N 2.7Å; L497-V499 HydrophobicContact CD2-CG2 3.98Å; L497-V499 PolarHBondContact O-N 3.01Å; L497-L652 HydrophobicContact CD2-CD2 4.3Å
498	N	49.9	Very low	49.9	Very low	7 Å²	7	67.8 Å²	67.8	4%	0.037	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	107.1	-180	176.7	57.3	0	0	0	110.7	K491 S653	K491-N498 WeakPolarHBondContact CE-OD1 3.45Å; K491-N498 WeakPolarHBondContact CG-OD1 3.49Å; N498-S653 WeakPolarHBondContact CB-O 3.37Å; N498-S653 PolarHBondContact N-O 3.12Å; N498-S653 PolarHBondContact ND2-OG 3.32Å; N498-S653 PolarHBondContact O-N 3.17Å; N498-S653 PolarHBondContact O-OG 3.38Å
499	V	54.4	Low	50.1	Low	6 Å²	6	63.5 Å²	63.5	4%	0.036	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	100.6	177.4	-169.4	0	0	0	0	108.7	K491 L492 L497 I501 I650 L652	K491-V499 WeakPolarHBondContact CA-O 3.32Å; L492-V499 HydrophobicContact CB-CB 4.24Å; L492-V499 HydrophobicContact CD2-CG2 4.42Å; L492-V499 PolarHBondContact N-O 3.31Å; L492-V499 PolarHBondContact O-N 2.72Å; L497-V499 HydrophobicContact CD2-CG2 3.98Å; L497-V499 PolarHBondContact O-N 3.01Å; V499-I501 HydrophobicContact CG1-CG1 4.02Å; V499-I650 HydrophobicContact CG1-CG2 4.33Å; V499-L652 HydrophobicContact CB-CD2 4.21Å; V499-L652 HydrophobicContact CG1-CD2 3.94Å; V499-L652 HydrophobicContact CG2-CD2 3.69Å
500	E	56.8	Low	50.4	Low	22 Å²	22	61 Å²	61	10%	0.103	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	112.1	164.9	-75	-169.3	119	0	0	109.1	K489 K491 K651	K489-E500 WeakPolarHBondContact CE-OE1 3.4Å; K489-E500 IonicContact NZ-OE1 2.71Å; K489-E500 PolarHBondContact NZ-OE1 2.84Å; K491-E500 HydrophobicContact CG-CG 4.27Å; E500-K651 HydrophobicContact CB-CB 4.3Å; E500-K651 PolarHBondContact N-O 3.4Å; E500-K651 VanDerWaalsContact N-O 3.16Å; E500-K651 PolarHBondContact O-N 2.9Å; E500-K651 IonicContact OE2-NZ 3.59Å
501	I	57.6	Low	50.7	Low	4 Å²	4	59.6 Å²	59.6	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	91.7	164.1	-53.6	-173.8	0	0	0	107.1	L178 F449 F484 Y490 V499 V503 I650	L178-I501 HydrophobicContact CD1-CD1 3.87Å; F449-I501 HydrophobicContact CD1-CD1 4.49Å; F449-I501 HydrophobicContact CD2-CD1 4.14Å; F449-I501 HydrophobicContact CE1-CD1 4.04Å; F449-I501 HydrophobicContact CE2-CD1 3.65Å; F449-I501 HydrophobicContact CZ-CD1 3.6Å; F484-I501 HydrophobicContact CE1-CG2 4.19Å; F484-I501 HydrophobicContact CZ-CG2 4.47Å; Y490-I501 PolarHBondContact N-O 2.86Å; Y490-I501 PolarHBondContact O-N 3.03Å; V499-I501 HydrophobicContact CG1-CG1 4.02Å; I501-V503 HydrophobicContact CG2-CG2 4.02Å; I501-V503 PolarHBondContact O-N 3.11Å; I501-I650 HydrophobicContact CB-CG1 4.49Å; I501-I650 HydrophobicContact CD1-CD1 4.01Å; I501-I650 HydrophobicContact CD1-CG1 4.42Å; I501-I650 HydrophobicContact CG1-CD1 4.15Å; I501-I650 HydrophobicContact CG1-CG1 4.04Å; I501-I650 HydrophobicContact CG2-CG1 4.15Å
502	L	55.5	Low	50.8	Low	52 Å²	52	59.3 Å²	59.3	27%	0.272	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	100.1	170.2	-94.3	152.1	0	0	0	108.3	K489 D504 N649	K489-L502 HydrophobicContact CD-CD2 4.43Å; K489-L502 HydrophobicContact CG-CD2 4.19Å; K489-L502 HydrophobicContact CG-CG 4.37Å; L502-D504 PolarHBondContact O-N 2.94Å; L502-N649 HydrophobicContact CB-CB 3.98Å; L502-N649 PolarHBondContact N-O 3.46Å; L502-N649 PolarHBondContact O-N 3.15Å
503	V	56.5	Low	51.4	Low	31 Å²	31	60.6 Å²	60.6	19%	0.188	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	101.8	165.1	-173.9	0	0	0	0	108	L183 F484 I501 E505	L183-V503 HydrophobicContact CD2-CG1 4.42Å; L183-V503 HydrophobicContact CD2-CG2 4.4Å; F484-V503 HydrophobicContact CD1-CG2 3.94Å; F484-V503 HydrophobicContact CE1-CG2 3.44Å; F484-V503 VanDerWaalsContact CE1-CG2 3.44Å; F484-V503 HydrophobicContact CZ-CG2 3.86Å; I501-V503 HydrophobicContact CG2-CG2 4.02Å; I501-V503 PolarHBondContact O-N 3.11Å; V503-E505 HydrophobicContact CG1-CG 3.89Å; V503-E505 PolarHBondContact O-N 3.44Å
504	D	52.9	Low	52.6	Low	86 Å²	86	56.6 Å²	56.6	46%	0.46	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	82.2	169.5	-72.8	-39.3	0	0	0	108.9	L502 P506 R647 N649	L502-D504 PolarHBondContact O-N 2.94Å; D504-P506 WeakPolarHBondContact O-CD 3.41Å; D504-R647 HydrophobicContact CB-CB 4.37Å; D504-R647 PolarHBondContact N-O 3.06Å; D504-N649 PolarHBondContact OD2-ND2 2.8Å; D504-N649 VanDerWaalsContact OD2-ND2 3.12Å
505	E	51.2	Low	54	Low	60 Å²	60	62.3 Å²	62.3	28%	0.28	32%	0.324	S	S	.	.			trans	-71.6	119	169.9	-81.4	-151.6	-142.4	0	0	110.3	R447 V503 N507 R512	R447-E505 IonicContact CZ-OE1 3.51Å; R447-E505 IonicContact CZ-OE2 3.88Å; R447-E505 IonicContact NH1-OE1 2.75Å; R447-E505 PolarHBondContact NH1-OE1 3.33Å; R447-E505 IonicContact NH1-OE2 3.76Å; R447-E505 PolarHBondContact NH1-OE2 2.96Å; V503-E505 HydrophobicContact CG1-CG 3.89Å; V503-E505 PolarHBondContact O-N 3.44Å; E505-N507 PolarHBondContact O-N 2.75Å; E505-R512 IonicContact OE1-CZ 2.65Å; E505-R512 IonicContact OE1-NE 2.65Å; E505-R512 IonicContact OE1-NH2 3.66Å; E505-R512 PolarHBondContact OE1-NH2 2.9Å; E505-R512 IonicContact OE2-CZ 2.76Å; E505-R512 IonicContact OE2-NE 3.51Å; E505-R512 PolarHBondContact OE2-NE 3.22Å; E505-R512 IonicContact OE2-NH2 2.93Å; E505-R512 PolarHBondContact OE2-NH2 3.49Å; E505-R512 VanDerWaalsContact OE2-NH2 3.13Å
506	P	47	Very low	55.7	Low	46 Å²	46	59.6 Å²	59.6	30%	0.299	31%	0.307	S	S	.	.			trans	-63.7	132.5	173.9	25.7	-31.8	0	0	0	110.1	D504 K508 A643	D504-P506 WeakPolarHBondContact O-CD 3.41Å; P506-K508 PolarHBondContact O-N 2.76Å; P506-K508 VanDerWaalsContact O-N 3.11Å; P506-A643 HydrophobicContact CG-CB 3.93Å
507	N	44.7	Very low	57.6	Low	160 Å²	160	57.2 Å²	57.2	86%	0.856	29%	0.287	S	S	*	.	S	Bend	trans	-39.7	112.2	-171.7	-102.6	-53.4	0	0	0	114.1	E505	E505-N507 PolarHBondContact O-N 2.75Å
508	K	49.8	Very low	59.4	Low	168 Å²	168	56.3 Å²	56.3	73%	0.73	28%	0.282	S	S	*	.			trans	56.2	70.6	175.7	-59.2	-176	178.8	-176.7	0	114.5	P506 I510	P506-K508 PolarHBondContact O-N 2.76Å; P506-K508 VanDerWaalsContact O-N 3.11Å; K508-I510 PolarHBondContact O-N 3.44Å
509	S	52.4	Low	61.1	Low	23 Å²	23	56 Å²	56	16%	0.161	28%	0.28	C	S	.	.			trans	-57.3	106.4	163.5	71.4	0	0	0	0	110.1	R447 F511 R512	R447-S509 PolarHBondContact NH2-OG 2.84Å; S509-F511 PolarHBondContact O-N 3.22Å; S509-F511 VanDerWaalsContact O-N 3.12Å; S509-R512 WeakPolarHBondContact O-CB 3.3Å; S509-R512 PolarHBondContact O-N 2.95Å
510	I	57.4	Low	62.6	Low	67 Å²	67	57 Å²	57	34%	0.344	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-59.6	-32.7	-166.5	-60.3	171.9	0	0	0	111.7	K508 R512 S513 F514 Y603	K508-I510 PolarHBondContact O-N 3.44Å; I510-R512 PolarHBondContact O-N 3.33Å; I510-S513 PolarHBondContact O-N 3.35Å; I510-S513 PolarHBondContact O-OG 3.2Å; I510-F514 HydrophobicContact CG2-CE1 4.18Å; I510-F514 HydrophobicContact CG2-CE2 4.14Å; I510-F514 HydrophobicContact CG2-CZ 3.56Å; I510-Y603 HydrophobicContact CD1-CD1 4.08Å; I510-Y603 HydrophobicContact CD1-CE1 3.37Å; I510-Y603 HydrophobicContact CG2-CE1 4.5Å; I510-Y603 HydrophobicContact CG2-CE2 4.37Å
511	F	58.6	Low	64	Low	9 Å²	9	56 Å²	56	4%	0.039	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-51.7	-20.2	173	-53.8	-89.9	0	0	0	115.5	Y187 S509 S513 F514 V534 Y603 V605 D640	Y187-F511 PolarHBondContact OH-O 3.31Å; S509-F511 PolarHBondContact O-N 3.22Å; S509-F511 VanDerWaalsContact O-N 3.12Å; F511-S513 PolarHBondContact O-N 2.88Å; F511-S513 VanDerWaalsContact O-N 3.11Å; F511-F514 HydrophobicContact CD1-CD2 4.34Å; F511-F514 PolarHBondContact O-N 2.95Å; F511-V534 HydrophobicContact CD1-CG1 4.23Å; F511-V534 HydrophobicContact CE1-CB 3.89Å; F511-V534 HydrophobicContact CE1-CG1 3.78Å; F511-V534 HydrophobicContact CE1-CG2 4.26Å; F511-Y603 HydrophobicContact CZ-CG 4.35Å; F511-V605 HydrophobicContact CE1-CG1 3.58Å; F511-V605 HydrophobicContact CZ-CG1 3.51Å; F511-D640 HydrophobicContact CD2-CB 4.48Å; F511-D640 HydrophobicContact CE2-CB 3.72Å; F511-D640 HydrophobicContact CZ-CB 4.39Å
512	R	55.5	Low	65.4	Low	97 Å²	97	59.3 Å²	59.3	37%	0.366	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-60.6	-14.5	171.3	-85.1	179	171.3	-160.4	0.3	113.5	A486 E505 S509 I510	A486-R512 VanDerWaalsContact O-CZ 3.26Å; A486-R512 PolarHBondContact O-NH1 3.28Å; A486-R512 PolarHBondContact O-NH2 2.91Å; E505-R512 IonicContact OE1-CZ 2.65Å; E505-R512 IonicContact OE1-NE 2.65Å; E505-R512 IonicContact OE1-NH2 3.66Å; E505-R512 PolarHBondContact OE1-NH2 2.9Å; E505-R512 IonicContact OE2-CZ 2.76Å; E505-R512 IonicContact OE2-NE 3.51Å; E505-R512 PolarHBondContact OE2-NE 3.22Å; E505-R512 IonicContact OE2-NH2 2.93Å; E505-R512 PolarHBondContact OE2-NH2 3.49Å; E505-R512 VanDerWaalsContact OE2-NH2 3.13Å; S509-R512 WeakPolarHBondContact O-CB 3.3Å; S509-R512 PolarHBondContact O-N 2.95Å; I510-R512 PolarHBondContact O-N 3.33Å
513	S	61.3	Low	66.7	Low	80 Å²	80	60.7 Å²	60.7	56%	0.559	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-104	-1	-177.7	66.7	0	0	0	0	114.9	I510 F511	I510-S513 PolarHBondContact O-N 3.35Å; I510-S513 PolarHBondContact O-OG 3.2Å; F511-S513 PolarHBondContact O-N 2.88Å; F511-S513 VanDerWaalsContact O-N 3.11Å
514	F	69.5	Low	67.8	Low	10 Å²	10	61.3 Å²	61.3	4%	0.044	30%	0.301	C	S	.	.			trans	-108.8	96.8	-171.4	-56.6	-20.6	0	0	0	111.5	Y187 I510 F511 E516 V517 K536 Y603	Y187-F514 PolarHBondContact OH-O 2.79Å; I510-F514 HydrophobicContact CG2-CE1 4.18Å; I510-F514 HydrophobicContact CG2-CE2 4.14Å; I510-F514 HydrophobicContact CG2-CZ 3.56Å; F511-F514 HydrophobicContact CD1-CD2 4.34Å; F511-F514 PolarHBondContact O-N 2.95Å; F514-E516 PolarHBondContact O-N 2.84Å; F514-V517 HydrophobicContact CB-CG1 3.55Å; F514-V517 HydrophobicContact CD2-CG1 3.86Å; F514-V517 HydrophobicContact CG-CG1 4.12Å; F514-K536 HydrophobicContact CD1-CB 4.02Å; F514-K536 HydrophobicContact CD1-CD 3.96Å; F514-K536 HydrophobicContact CD1-CG 3.7Å; F514-K536 HydrophobicContact CE1-CB 3.78Å; F514-K536 HydrophobicContact CE1-CD 3.76Å; F514-K536 HydrophobicContact CE1-CG 3.8Å; F514-K536 HydrophobicContact CE2-CB 4.37Å; F514-K536 HydrophobicContact CG-CB 4.43Å; F514-K536 HydrophobicContact CG-CG 4.35Å; F514-K536 HydrophobicContact CZ-CB 3.96Å; F514-K536 HydrophobicContact CZ-CG 4.48Å; F514-Y603 HydrophobicContact CE2-CD2 4.18Å; F514-Y603 HydrophobicContact CE2-CE2 4.15Å; F514-Y603 HydrophobicContact CZ-CD2 4.46Å; F514-Y603 AromaticContact CZ-CE2 3.97Å; F514-Y603 HydrophobicContact CZ-CE2 3.97Å
515	K	76.8	Confident	68.7	Low	173 Å²	173	64.7 Å²	64.7	75%	0.752	31%	0.312	S	S	*	.	S	Bend	trans	-63.9	-28.6	172	-68.1	-171.9	176.6	-174.2	0	112.9	Q442	Q442-K515 WeakPolarHBondContact CB-O 3.39Å; Q442-K515 PolarHBondContact N-O 3.43Å
516	E	78	Confident	69.7	Low	79 Å²	79	69.5 Å²	69.5	37%	0.369	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143.7	-178.4	-72.6	171.9	-165.3	0	0	108.2	H439 L440 K441 F514 P537	H439-E516 IonicContact CE1-OE2 3.64Å; L440-E516 WeakPolarHBondContact O-CA 3.5Å; K441-E516 HydrophobicContact CG-CG 4.3Å; F514-E516 PolarHBondContact O-N 2.84Å; E516-P537 HydrophobicContact CB-CG 4.15Å; E516-P537 WeakPolarHBondContact O-CD 3.45Å
517	V	79.9	Confident	70.6	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	142.3	-177.6	-67.8	0	0	0	0	111.7	Y187 H439 L440 F514 V534 L638	Y187-V517 HydrophobicContact CD1-CG2 3.56Å; Y187-V517 HydrophobicContact CE1-CB 4.3Å; Y187-V517 HydrophobicContact CE1-CG1 3.84Å; Y187-V517 HydrophobicContact CE1-CG2 3.51Å; Y187-V517 HydrophobicContact CG-CG2 4.37Å; H439-V517 PolarHBondContact CD2-O 2.8Å; L440-V517 HydrophobicContact CB-CG2 3.92Å; L440-V517 PolarHBondContact N-O 3.16Å; L440-V517 PolarHBondContact O-N 2.74Å; F514-V517 HydrophobicContact CB-CG1 3.55Å; F514-V517 HydrophobicContact CD2-CG1 3.86Å; F514-V517 HydrophobicContact CG-CG1 4.12Å; V517-V534 HydrophobicContact CB-CG1 3.83Å; V517-V534 HydrophobicContact CG1-CG1 3.73Å; V517-L638 HydrophobicContact CG2-CD1 4.26Å
518	I	81.9	Confident	71.8	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.01	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	119	166.8	-61.9	174.7	0	0	0	107.8	L227 M437 C438 H535 F598	L227-I518 HydrophobicContact CD1-CG2 4.29Å; M437-I518 HydrophobicContact CB-CG2 4.43Å; M437-I518 HydrophobicContact CE-CG2 3.67Å; C438-I518 WeakPolarHBondContact O-CA 3.49Å; I518-H535 HydrophobicContact CB-CB 4.46Å; I518-H535 PolarHBondContact N-O 3.19Å; I518-H535 PolarHBondContact O-N 2.87Å; I518-F598 HydrophobicContact CD1-CZ 4.29Å
519	L	85.7	Confident	73.1	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.8	175.9	-179.1	75.4	0	0	0	109.4	M437 C438 L440 F532 V534 V605 I607 L638	M437-L519 CarbonylContact C-O 3.58Å; M437-L519 VanDerWaalsContact CA-O 3.3Å; M437-L519 WeakPolarHBondContact CA-O 3.26Å; C438-L519 HydrophobicContact CB-CB 4.35Å; C438-L519 PolarHBondContact N-O 3.5Å; C438-L519 PolarHBondContact O-N 3.47Å; L440-L519 HydrophobicContact CD1-CB 4.02Å; L440-L519 HydrophobicContact CD1-CD2 3.99Å; L440-L519 HydrophobicContact CG-CB 4.37Å; L519-F532 HydrophobicContact CD1-CB 4.19Å; L519-V534 HydrophobicContact CD1-CG2 3.76Å; L519-V605 HydrophobicContact CD1-CG2 4.11Å; L519-I607 HydrophobicContact CD1-CD1 3.88Å; L519-I607 HydrophobicContact CD1-CG1 4.46Å; L519-I607 HydrophobicContact CD2-CD1 3.47Å; L519-I607 VanDerWaalsContact CD2-CD1 3.47Å; L519-I607 HydrophobicContact CG-CD1 4.2Å; L519-L638 HydrophobicContact CD1-CD2 4.45Å
520	L	86.6	Confident	74.5	Confident	28 Å²	28	67.7 Å²	67.7	15%	0.147	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	117	172.5	177.3	72.5	0	0	0	109.1	F436 M437 F532 V533 L599	F436-L520 CarbonylContact O-C 3.54Å; F436-L520 WeakPolarHBondContact O-CA 3.19Å; M437-L520 HydrophobicContact CG-CD1 3.61Å; M437-L520 HydrophobicContact SD-CD1 4.4Å; L520-F532 CarbonylContact O-C 3.59Å; L520-F532 WeakPolarHBondContact O-CA 3.39Å; L520-V533 HydrophobicContact CB-CB 4.41Å; L520-V533 PolarHBondContact N-O 3.23Å; L520-V533 PolarHBondContact O-N 2.8Å; L520-L599 HydrophobicContact CD2-CD2 4.23Å
521	G	86.4	Confident	75.8	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	134.3	168.4	0	0	0	0	0	110.8	T435 F436	T435-G521 CarbonylContact C-O 3.41Å; T435-G521 VanDerWaalsContact CA-O 3.22Å; T435-G521 WeakPolarHBondContact CA-O 3.17Å; F436-G521 PolarHBondContact N-O 2.67Å; F436-G521 PolarHBondContact O-N 3.39Å
522	R	85.8	Confident	77.1	Confident	74 Å²	74	68.9 Å²	68.9	28%	0.279	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	122.3	177.5	177.7	172.7	-179.1	-160.4	-1.9	111.4	G434 T435 V524 Y530 E531	G434-R522 CarbonylContact O-C 3.48Å; G434-R522 WeakPolarHBondContact O-CA 3.19Å; T435-R522 HydrophobicContact CG2-CB 4.35Å; T435-R522 HydrophobicContact CG2-CG 4.1Å; R522-V524 PolarHBondContact O-N 2.94Å; R522-Y530 WeakPolarHBondContact O-CA 3.4Å; R522-E531 PolarHBondContact N-O 3.5Å; R522-E531 PolarHBondContact O-N 2.77Å
523	K	82.6	Confident	78.6	Confident	81 Å²	81	65.8 Å²	65.8	35%	0.352	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	112.2	-177.7	-165.4	173.8	-179.6	-179.8	0	111.7	G434 K525 N528 Y530	G434-K523 WeakPolarHBondContact O-CB 3.43Å; G434-K523 PolarHBondContact O-N 2.72Å; K523-K525 PolarHBondContact O-N 2.86Å; K523-N528 WeakPolarHBondContact CE-OD1 3.17Å; K523-N528 PolarHBondContact NZ-OD1 3.37Å; K523-Y530 HydrophobicContact CB-CD1 3.93Å; K523-Y530 HydrophobicContact CB-CE1 3.73Å; K523-Y530 HydrophobicContact CG-CE1 4.28Å
524	V	79.1	Confident	79.6	Confident	45 Å²	45	62 Å²	62	27%	0.273	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	98.6	177.5	-177.7	0	0	0	0	109.2	R522 K526 Y527 N528 A529 E531	R522-V524 PolarHBondContact O-N 2.94Å; V524-K526 HydrophobicContact CG1-CB 4.28Å; V524-K526 PolarHBondContact O-N 3.45Å; V524-Y527 HydrophobicContact CG1-CD2 4.01Å; V524-Y527 PolarHBondContact O-N 3.25Å; V524-N528 PolarHBondContact O-N 3.21Å; V524-N528 VanDerWaalsContact O-N 3.12Å; V524-A529 PolarHBondContact N-O 3.44Å; V524-E531 HydrophobicContact CG2-CB 3.57Å
525	K	72.1	Confident	79.9	Confident	157 Å²	157	61.7 Å²	61.7	68%	0.683	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44	-37.4	-177.1	-66	-173.4	179.2	-176.8	0	114	K523 Y527	K523-K525 PolarHBondContact O-N 2.86Å; K525-Y527 VanDerWaalsContact C-N 3.3Å; K525-Y527 PolarHBondContact O-N 2.74Å
526	K	71.8	Confident	79.7	Confident	161 Å²	161	58.7 Å²	58.7	70%	0.7	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-26.1	-179.2	-171.7	-179.6	176.6	-156.9	0	115.3	V524	V524-K526 HydrophobicContact CG1-CB 4.28Å; V524-K526 PolarHBondContact O-N 3.45Å
527	Y	67	Low	79.3	Confident	159 Å²	159	56 Å²	56	62%	0.624	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.6	-1.8	-174.4	-61.7	-70.7	0	0	0	113.5	V524 K525 A529	V524-Y527 HydrophobicContact CG1-CD2 4.01Å; V524-Y527 PolarHBondContact O-N 3.25Å; K525-Y527 VanDerWaalsContact C-N 3.3Å; K525-Y527 PolarHBondContact O-N 2.74Å; Y527-A529 PolarHBondContact O-N 2.94Å
528	N	70.7	Confident	78.4	Confident	102 Å²	102	57.8 Å²	57.8	55%	0.545	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	10.2	-172.3	-114.1	-19.7	0	0	0	115.6	K523 V524	K523-N528 WeakPolarHBondContact CE-OD1 3.17Å; K523-N528 PolarHBondContact NZ-OD1 3.37Å; V524-N528 PolarHBondContact O-N 3.21Å; V524-N528 VanDerWaalsContact O-N 3.12Å
529	A	75.8	Confident	77	Confident	53 Å²	53	59.9 Å²	59.9	44%	0.438	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	159.6	176.8	0	0	0	0	0	111.6	V524 Y527	V524-A529 PolarHBondContact N-O 3.44Å; Y527-A529 PolarHBondContact O-N 2.94Å
530	Y	82.3	Confident	75.2	Confident	45 Å²	45	64.5 Å²	64.5	18%	0.176	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	136	171.2	-66	-85	0	0	0	110.7	F222 F436 R522 K523 F532	F222-Y530 HydrophobicContact CE2-CD2 4.01Å; F222-Y530 AromaticContact CE2-CE2 3.85Å; F222-Y530 HydrophobicContact CE2-CE2 3.85Å; F222-Y530 AromaticContact CZ-CD2 3.78Å; F222-Y530 HydrophobicContact CZ-CD2 3.78Å; F222-Y530 HydrophobicContact CZ-CE2 4.07Å; F436-Y530 HydrophobicContact CD1-CD1 4.19Å; F436-Y530 AromaticContact CD1-CE1 3.93Å; F436-Y530 HydrophobicContact CD1-CE1 3.93Å; F436-Y530 AromaticContact CE1-CD1 3.72Å; F436-Y530 HydrophobicContact CE1-CD1 3.72Å; F436-Y530 AromaticContact CE1-CE1 3.77Å; F436-Y530 HydrophobicContact CE1-CE1 3.77Å; F436-Y530 HydrophobicContact CE1-CG 4.14Å; R522-Y530 WeakPolarHBondContact O-CA 3.4Å; K523-Y530 HydrophobicContact CB-CD1 3.93Å; K523-Y530 HydrophobicContact CB-CE1 3.73Å; K523-Y530 HydrophobicContact CG-CE1 4.28Å; Y530-F532 VanDerWaalsContact CB-CZ 3.49Å; Y530-F532 HydrophobicContact CG-CE1 4.41Å; Y530-F532 HydrophobicContact CG-CZ 4.45Å
531	E	83.9	Confident	73.3	Confident	76 Å²	76	69.1 Å²	69.1	36%	0.355	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	135.6	162.7	175.1	160.8	-124.9	0	0	108.2	R522 V524 K641	R522-E531 PolarHBondContact N-O 3.5Å; R522-E531 PolarHBondContact O-N 2.77Å; V524-E531 HydrophobicContact CG2-CB 3.57Å; E531-K641 IonicContact OE1-NZ 2.67Å; E531-K641 PolarHBondContact OE1-NZ 3.28Å
532	F	87.4	Confident	71.1	Confident	25 Å²	25	75.2 Å²	75.2	11%	0.11	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	143.9	-171.2	-54.6	-77.6	0	0	0	111.9	F222 F436 L519 L520 Y530 P604 V605 I607	F222-F532 HydrophobicContact CD1-CE1 4.29Å; F222-F532 HydrophobicContact CD1-CZ 4.42Å; F222-F532 AromaticContact CE1-CE1 3.97Å; F222-F532 HydrophobicContact CE1-CE1 3.97Å; F222-F532 AromaticContact CE1-CZ 3.74Å; F222-F532 HydrophobicContact CE1-CZ 3.74Å; F222-F532 HydrophobicContact CZ-CZ 4.28Å; F436-F532 HydrophobicContact CE1-CE1 4.46Å; F436-F532 AromaticContact CZ-CE1 3.95Å; F436-F532 HydrophobicContact CZ-CE1 3.95Å; L519-F532 HydrophobicContact CD1-CB 4.19Å; L520-F532 CarbonylContact O-C 3.59Å; L520-F532 WeakPolarHBondContact O-CA 3.39Å; Y530-F532 VanDerWaalsContact CB-CZ 3.49Å; Y530-F532 HydrophobicContact CG-CE1 4.41Å; Y530-F532 HydrophobicContact CG-CZ 4.45Å; F532-P604 WeakPolarHBondContact O-CA 3.24Å; F532-V605 HydrophobicContact CB-CG2 3.78Å; F532-V605 PolarHBondContact O-N 3.13Å; F532-I607 HydrophobicContact CB-CD1 3.94Å; F532-I607 HydrophobicContact CB-CG1 4.06Å; F532-I607 HydrophobicContact CD1-CD1 3.39Å; F532-I607 HydrophobicContact CD1-CG1 4.29Å; F532-I607 HydrophobicContact CD2-CB 4.2Å; F532-I607 HydrophobicContact CD2-CD1 3.6Å; F532-I607 HydrophobicContact CD2-CG1 3.62Å; F532-I607 HydrophobicContact CE1-CD1 3.65Å; F532-I607 HydrophobicContact CE2-CB 4.23Å; F532-I607 HydrophobicContact CE2-CD1 3.84Å; F532-I607 HydrophobicContact CE2-CG1 4.06Å; F532-I607 HydrophobicContact CG-CD1 3.35Å; F532-I607 HydrophobicContact CG-CG1 3.74Å; F532-I607 HydrophobicContact CZ-CD1 3.85Å
533	V	85.4	Confident	68.9	Low	32 Å²	32	73.5 Å²	73.5	19%	0.194	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	139.6	-178.8	-173.2	0	0	0	0	109.1	L520 H535 Y603	L520-V533 HydrophobicContact CB-CB 4.41Å; L520-V533 PolarHBondContact N-O 3.23Å; L520-V533 PolarHBondContact O-N 2.8Å; V533-H535 WeakPolarHBondContact CG1-NE2 3.48Å; V533-Y603 CarbonylContact C-O 3.54Å; V533-Y603 WeakPolarHBondContact CA-O 3.39Å
534	V	82.7	Confident	66.7	Low	0 Å²	0	78.1 Å²	78.1	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.2	-176.1	167.9	0	0	0	0	110.8	F511 V517 L519 G602 Y603 V605 L638	F511-V534 HydrophobicContact CD1-CG1 4.23Å; F511-V534 HydrophobicContact CE1-CB 3.89Å; F511-V534 HydrophobicContact CE1-CG1 3.78Å; F511-V534 HydrophobicContact CE1-CG2 4.26Å; V517-V534 HydrophobicContact CB-CG1 3.83Å; V517-V534 HydrophobicContact CG1-CG1 3.73Å; L519-V534 HydrophobicContact CD1-CG2 3.76Å; V534-G602 WeakPolarHBondContact O-CA 3.32Å; V534-Y603 PolarHBondContact N-O 2.86Å; V534-Y603 PolarHBondContact O-N 3.3Å; V534-V605 HydrophobicContact CB-CG1 4.18Å; V534-V605 HydrophobicContact CG2-CB 4.3Å; V534-V605 HydrophobicContact CG2-CG1 3.71Å; V534-V605 HydrophobicContact CG2-CG2 3.58Å; V534-L638 HydrophobicContact CG2-CD1 4.09Å
535	H	76.6	Confident	64.6	Low	4 Å²	4	81 Å²	81	2%	0.019	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.3	177.4	-52.1	-102.8	0	0	0	109.6	I518 V533 F598 L599 G602	I518-H535 HydrophobicContact CB-CB 4.46Å; I518-H535 PolarHBondContact N-O 3.19Å; I518-H535 PolarHBondContact O-N 2.87Å; V533-H535 WeakPolarHBondContact CG1-NE2 3.48Å; H535-F598 HydrophobicContact CB-CE1 3.78Å; H535-F598 HydrophobicContact CB-CE2 4.24Å; H535-F598 HydrophobicContact CB-CZ 3.53Å; H535-F598 AromaticContact CG-CE1 3.98Å; H535-F598 PolarHBondContact ND1-O 3.33Å; H535-L599 PolarHBondContact CE1-O 3.21Å; H535-G602 VanDerWaalsContact CE1-CA 3.42Å; H535-G602 WeakPolarHBondContact CE1-CA 3.4Å; H535-G602 WeakPolarHBondContact ND1-CA 3.12Å
536	K	73.2	Confident	62.9	Low	110 Å²	110	78.7 Å²	78.7	48%	0.478	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-77.8	129.5	169.2	-173.8	-159.3	177.6	-168.8	0	108.5	F514 F598	F514-K536 HydrophobicContact CD1-CB 4.02Å; F514-K536 HydrophobicContact CD1-CD 3.96Å; F514-K536 HydrophobicContact CD1-CG 3.7Å; F514-K536 HydrophobicContact CE1-CB 3.78Å; F514-K536 HydrophobicContact CE1-CD 3.76Å; F514-K536 HydrophobicContact CE1-CG 3.8Å; F514-K536 HydrophobicContact CE2-CB 4.37Å; F514-K536 HydrophobicContact CG-CB 4.43Å; F514-K536 HydrophobicContact CG-CG 4.35Å; F514-K536 HydrophobicContact CZ-CB 3.96Å; F514-K536 HydrophobicContact CZ-CG 4.48Å; K536-F598 WeakPolarHBondContact O-CE2 3.38Å
537	P	67.6	Low	61.1	Low	21 Å²	21	78.9 Å²	78.9	14%	0.136	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-61	143.3	173.3	25.5	-33.1	0	0	0	111.2	E516	E516-P537 HydrophobicContact CB-CG 4.15Å; E516-P537 WeakPolarHBondContact O-CD 3.45Å
538	P	61.3	Low	59.6	Low	39 Å²	39	73.1 Å²	73.1	25%	0.253	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-71.5	139.3	-177.7	28.7	-33.8	0	0	0	111.8	N566	P538-N566 HydrophobicContact CG-CB 4.08Å; P538-N566 WeakPolarHBondContact CG-O 3.36Å
539	S	53.9	Low	57.9	Low	46 Å²	46	74.1 Å²	74.1	32%	0.322	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-73.7	142.1	174.2	31	0	0	0	0	111.6	T541 E542	S539-T541 PolarHBondContact O-N 3.45Å; S539-E542 PolarHBondContact O-N 2.82Å
540	T	47.5	Very low	56.3	Low	96 Å²	96	73 Å²	73	59%	0.589	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-55.3	-25.3	-177.5	40.1	0	0	0	0	114.5	E542 K567	T540-E542 VanDerWaalsContact C-N 3.28Å; T540-E542 PolarHBondContact O-N 2.79Å; T540-K567 VanDerWaalsContact CG2-NZ 3.26Å
541	T	45.4	Very low	54.3	Low	125 Å²	125	79.4 Å²	79.4	77%	0.767	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-74.6	-6.7	-178.1	53.6	0	0	0	0	115.1	S539	S539-T541 PolarHBondContact O-N 3.45Å
542	E	40.7	Very low	52.4	Low	128 Å²	128	80.7 Å²	80.7	60%	0.598	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-107.1	14.9	-177.4	-62.4	-173.1	171.3	0	0	113.8	S539 T540 K590	S539-E542 PolarHBondContact O-N 2.82Å; T540-E542 VanDerWaalsContact C-N 3.28Å; T540-E542 PolarHBondContact O-N 2.79Å; E542-K590 PolarHBondContact O-NZ 2.79Å
543	I	41	Very low	50.3	Low	39 Å²	39	83.3 Å²	83.3	20%	0.2	45%	0.452	C	S	.	.			trans	-102.8	92.1	176.7	-48	179.8	0	0	0	108.9	N566 Q587	I543-N566 HydrophobicContact CD1-CB 4.43Å; I543-Q587 WeakPolarHBondContact CD1-O 3.36Å
544	K	35.9	Very low	48.3	Very low	178 Å²	178	87 Å²	87	77%	0.774	47%	0.471	S	S	*	.			trans	-77.6	135.1	156.6	-70.4	-168.5	174.7	-169.1	0	108.3	I546	K544-I546 PolarHBondContact O-N 3.3Å
545	S	34.8	Very low	46.7	Very low	106 Å²	106	92.6 Å²	92.6	74%	0.741	50%	0.496	S	S	*	.			trans	-59.2	124	170.2	48.9	0	0	0	0	110.2
546	I	35.3	Very low	45.7	Very low	107 Å²	107	98 Å²	98	55%	0.549	53%	0.529	S	S	.	.			trans	-131.9	113.8	173.2	-61.4	173.3	0	0	0	105.3	K544 S548	K544-I546 PolarHBondContact O-N 3.3Å; I546-S548 PolarHBondContact O-N 2.8Å
547	Q	35.7	Very low	45.3	Very low	165 Å²	165	96.2 Å²	96.2	77%	0.771	53%	0.526	S	S	*	.			trans	-60.6	111.9	171.2	-76.1	171.8	-46.6	0	0	108.6
548	S	34.8	Very low	45.5	Very low	39 Å²	39	97 Å²	97	27%	0.273	53%	0.531	S	S	.	.			trans	-85.5	121.8	173.1	53.8	0	0	0	0	108.9	I546 V550	I546-S548 PolarHBondContact O-N 2.8Å; S548-V550 PolarHBondContact O-N 2.78Å
549	S	33.9	Very low	45.9	Very low	123 Å²	123	95.5 Å²	95.5	86%	0.86	52%	0.522	S	S	*	.			trans	-56.1	111.5	166.6	53.2	0	0	0	0	109.4
550	V	42.9	Very low	46.8	Very low	29 Å²	29	97.1 Å²	97.1	18%	0.176	52%	0.524	C	S	.	.			trans	-73.7	138.3	174.5	175.2	0	0	0	0	108.3	I315 S548 H552 T561	I315-V550 HydrophobicContact CG2-CG2 4.41Å; S548-V550 PolarHBondContact O-N 2.78Å; V550-H552 PolarHBondContact O-CD2 2.75Å; V550-H552 PolarHBondContact O-N 3.2Å; V550-T561 WeakPolarHBondContact CG1-OG1 3.39Å
551	E	40.4	Very low	47.9	Very low	179 Å²	179	93.3 Å²	93.3	84%	0.836	50%	0.5	S	S	*	.			trans	-83.4	84.2	178.1	-160	165.5	-138.1	0	0	108.6	V553	E551-V553 PolarHBondContact O-N 2.85Å
552	H	44.3	Very low	49	Very low	104 Å²	104	90.7 Å²	90.7	48%	0.481	48%	0.484	S	S	.	.			trans	-69	98.3	-169.9	-62.9	-88.7	0	0	0	112.7	V550 L554	V550-H552 PolarHBondContact O-CD2 2.75Å; V550-H552 PolarHBondContact O-N 3.2Å; H552-L554 PolarHBondContact O-N 3.46Å
553	V	43.7	Very low	50.2	Low	79 Å²	79	85.1 Å²	85.1	48%	0.479	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	88.9	166.8	-174.3	0	0	0	0	109.4	E551 H555	E551-V553 PolarHBondContact O-N 2.85Å; V553-H555 PolarHBondContact O-N 2.74Å
554	L	43	Very low	51.3	Low	111 Å²	111	85.3 Å²	85.3	58%	0.581	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	96.2	175.4	-85.5	155.7	0	0	0	110.9	H552 A559	H552-L554 PolarHBondContact O-N 3.46Å; L554-A559 HydrophobicContact CD2-CB 4.43Å
555	H	48.8	Very low	52.5	Low	117 Å²	117	77.4 Å²	77.4	54%	0.542	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	146.9	153.3	-71.8	-59.6	0	0	0	108.8	V553 D557 S558	V553-H555 PolarHBondContact O-N 2.74Å; H555-D557 VanDerWaalsContact C-N 3.26Å; H555-D557 PolarHBondContact O-N 2.68Å; H555-S558 PolarHBondContact N-O 3.16Å; H555-S558 CarbonylContact O-C 3.57Å; H555-S558 PolarHBondContact O-N 2.78Å
556	T	56.5	Low	53.4	Low	116 Å²	116	74 Å²	74	71%	0.712	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-30.9	-149.7	55	0	0	0	0	116.4	R239	R239-T556 PolarHBondContact NH1-O 2.8Å; R239-T556 PolarHBondContact NH2-O 2.83Å
557	D	65	Low	54.5	Low	74 Å²	74	71.2 Å²	71.2	40%	0.396	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	11.2	178.1	-56.5	-85.8	0	0	0	112.5	K236 A237 R239 H555	K236-D557 WeakPolarHBondContact CA-O 3.46Å; A237-D557 PolarHBondContact N-O 2.79Å; R239-D557 IonicContact CZ-OD1 3.99Å; R239-D557 IonicContact NH1-OD1 3.37Å; R239-D557 PolarHBondContact NH1-OD1 2.86Å; H555-D557 VanDerWaalsContact C-N 3.26Å; H555-D557 PolarHBondContact O-N 2.68Å
558	S	70.7	Confident	55.6	Low	36 Å²	36	64 Å²	64	25%	0.252	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	113.2	-178.8	61.2	0	0	0	0	112.1	L235 H555	L235-S558 CarbonylContact O-C 3.52Å; L235-S558 VanDerWaalsContact O-CA 3.26Å; L235-S558 WeakPolarHBondContact O-CA 3.48Å; H555-S558 PolarHBondContact N-O 3.16Å; H555-S558 CarbonylContact O-C 3.57Å; H555-S558 PolarHBondContact O-N 2.78Å
559	A	70.5	Confident	56.8	Low	8 Å²	8	64.2 Å²	64.2	7%	0.066	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.5	175.4	0	0	0	0	0	110.4	S234 L235 F316 L554	S234-A559 WeakPolarHBondContact CA-O 3.42Å; L235-A559 HydrophobicContact CD2-CB 4.28Å; L235-A559 PolarHBondContact N-O 3.33Å; L235-A559 PolarHBondContact O-N 3.48Å; F316-A559 HydrophobicContact CD1-CB 3.65Å; F316-A559 HydrophobicContact CE1-CB 4.09Å; L554-A559 HydrophobicContact CD2-CB 4.43Å
560	F	73	Confident	57.9	Low	81 Å²	81	60.2 Å²	60.2	36%	0.355	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138	-179.1	-60.5	-90.9	0	0	0	110.3	L232 L233 S234	L232-F560 HydrophobicContact CD1-CB 4.45Å; L233-F560 WeakPolarHBondContact O-CA 3.2Å; S234-F560 VanDerWaalsContact CB-CE1 3.42Å
561	T	69.5	Low	58.6	Low	16 Å²	16	59.5 Å²	59.5	10%	0.098	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	147.9	173.2	-175.1	0	0	0	0	110.2	L233 I315 F316 V550 I563	L233-T561 HydrophobicContact CB-CG2 3.89Å; L233-T561 HydrophobicContact CD1-CG2 4.31Å; L233-T561 HydrophobicContact CG-CG2 4.43Å; L233-T561 PolarHBondContact N-O 2.89Å; L233-T561 PolarHBondContact O-N 3.32Å; I315-T561 HydrophobicContact CG2-CG2 3.88Å; F316-T561 HydrophobicContact CD1-CG2 4.42Å; F316-T561 HydrophobicContact CE1-CG2 3.59Å; F316-T561 HydrophobicContact CE2-CG2 4.46Å; F316-T561 HydrophobicContact CZ-CG2 3.62Å; V550-T561 WeakPolarHBondContact CG1-OG1 3.39Å; T561-I563 HydrophobicContact CG2-CG1 4.3Å
562	T	68.3	Low	59.8	Low	69 Å²	69	51.3 Å²	51.3	42%	0.423	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.5	175.2	60.5	0	0	0	0	110.7	Y231 L232	Y231-T562 CarbonylContact O-C 3.58Å; Y231-T562 WeakPolarHBondContact O-CA 3.39Å; L232-T562 HydrophobicContact CD1-CG2 3.89Å
563	I	66.9	Low	60.7	Low	11 Å²	11	46.8 Å²	46.8	6%	0.056	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.9	179.5	-59.1	-152	0	0	0	110.2	Y231 L233 I315 T561 I585 T589	Y231-I563 PolarHBondContact N-O 3.48Å; Y231-I563 PolarHBondContact O-N 2.81Å; L233-I563 HydrophobicContact CD1-CD1 3.46Å; L233-I563 VanDerWaalsContact CD1-CD1 3.46Å; L233-I563 HydrophobicContact CD1-CG1 3.77Å; L233-I563 HydrophobicContact CG-CD1 4.36Å; L233-I563 HydrophobicContact CG-CG1 4.15Å; I315-I563 HydrophobicContact CD1-CD1 3.96Å; I315-I563 HydrophobicContact CG2-CD1 4.3Å; T561-I563 HydrophobicContact CG2-CG1 4.3Å; I563-I585 HydrophobicContact CD1-CD1 4.1Å; I563-I585 HydrophobicContact CD1-CG2 3.82Å; I563-I585 HydrophobicContact CG2-CG2 4.3Å; I563-T589 HydrophobicContact CG2-CG2 3.64Å
564	Q	64.2	Low	61.9	Low	44 Å²	44	47 Å²	47	21%	0.206	26%	0.256	C	S	.	.			trans	-116.1	118.6	175.8	-168.9	162.7	66.5	0	0	109.5	S229 L595	S229-Q564 PolarHBondContact O-NE2 3.41Å; Q564-L595 HydrophobicContact CG-CD1 3.82Å
565	S	61.5	Low	63.1	Low	11 Å²	11	45 Å²	45	8%	0.077	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-97	140.5	-174	176.8	0	0	0	0	111.7	K567 F571	S565-K567 PolarHBondContact O-N 3.31Å; S565-K567 WeakPolarHBondContact OG-CA 3.32Å; S565-K567 PolarHBondContact OG-N 2.74Å; S565-K567 PolarHBondContact OG-O 2.72Å; S565-F571 VanDerWaalsContact OG-CD2 3.31Å; S565-F571 WeakPolarHBondContact OG-CD2 3.26Å; S565-F571 WeakPolarHBondContact OG-CE2 3.27Å
566	N	53.1	Low	64.2	Low	34 Å²	34	39.6 Å²	39.6	18%	0.182	22%	0.221	C	C	.	.	S	Bend	trans	-62.5	-16.5	166.2	-65.5	-68.3	0	0	0	112.6	P538 I543 N588	P538-N566 HydrophobicContact CG-CB 4.08Å; P538-N566 WeakPolarHBondContact CG-O 3.36Å; I543-N566 HydrophobicContact CD1-CB 4.43Å; N566-N588 PolarHBondContact N-O 3.02Å; N566-N588 PolarHBondContact ND2-O 2.8Å
567	K	58.7	Low	64.9	Low	50 Å²	50	37.4 Å²	37.4	22%	0.217	20%	0.201	C	C	.	.			trans	-133.7	80.1	174.8	-64.7	-178.5	-176.2	175.6	0	109.8	T540 S565 H569 A570	T540-K567 VanDerWaalsContact CG2-NZ 3.26Å; S565-K567 PolarHBondContact O-N 3.31Å; S565-K567 WeakPolarHBondContact OG-CA 3.32Å; S565-K567 PolarHBondContact OG-N 2.74Å; S565-K567 PolarHBondContact OG-O 2.72Å; K567-H569 PolarHBondContact O-N 3.03Å; K567-H569 VanDerWaalsContact O-N 3.08Å; K567-A570 HydrophobicContact CB-CB 3.75Å; K567-A570 HydrophobicContact CD-CB 4.18Å; K567-A570 PolarHBondContact O-N 2.82Å; K567-A570 VanDerWaalsContact O-N 3.08Å
568	P	57.2	Low	65.3	Low	14 Å²	14	42 Å²	42	9%	0.091	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-19	178.9	26.3	-35.6	0	0	0	113.1	L227 Y231	L227-P568 HydrophobicContact CB-CG 4.49Å; L227-P568 HydrophobicContact CD1-CG 4.1Å; Y231-P568 PolarHBondContact OH-O 2.77Å
569	H	60.1	Low	65.4	Low	42 Å²	42	46 Å²	46	19%	0.194	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-19	176.3	59.3	-110.1	0	0	0	115.4	Y192 L227 H439 K567 F571	Y192-H569 HydrophobicContact CE1-CB 3.7Å; Y192-H569 HydrophobicContact CE2-CB 4.27Å; Y192-H569 VanDerWaalsContact CZ-CB 3.49Å; Y192-H569 VanDerWaalsContact OH-CB 3.23Å; Y192-H569 WeakPolarHBondContact OH-CB 3.34Å; L227-H569 HydrophobicContact CD2-CB 3.97Å; H439-H569 AromaticContact CE1-CE1 3.99Å; H439-H569 AromaticContact CE1-ND1 3.93Å; H439-H569 AromaticContact ND1-ND1 3.93Å; K567-H569 PolarHBondContact O-N 3.03Å; K567-H569 VanDerWaalsContact O-N 3.08Å; H569-F571 PolarHBondContact O-N 2.99Å
570	A	56.8	Low	65.5	Low	40 Å²	40	46.3 Å²	46.3	33%	0.331	24%	0.237	S	C	.	.	S	Bend	trans	-74.6	-8.1	178	0	0	0	0	0	111.9	K567	K567-A570 HydrophobicContact CB-CB 3.75Å; K567-A570 HydrophobicContact CD-CB 4.18Å; K567-A570 PolarHBondContact O-N 2.82Å; K567-A570 VanDerWaalsContact O-N 3.08Å
571	F	59.5	Low	65.5	Low	14 Å²	14	43.4 Å²	43.4	6%	0.061	23%	0.227	C	C	.	.			trans	-129.6	118.2	-167.7	-69.9	-35.5	0	0	0	107.8	Y231 S565 H569 W576 L583 N588	Y231-F571 HydrophobicContact CE2-CB 4.15Å; Y231-F571 PolarHBondContact OH-O 2.86Å; S565-F571 VanDerWaalsContact OG-CD2 3.31Å; S565-F571 WeakPolarHBondContact OG-CD2 3.26Å; S565-F571 WeakPolarHBondContact OG-CE2 3.27Å; H569-F571 PolarHBondContact O-N 2.99Å; F571-W576 AromaticContact CD1-CD1 3.94Å; F571-W576 HydrophobicContact CD1-CZ2 4.39Å; F571-W576 AromaticContact CD1-NE1 3.13Å; F571-W576 HydrophobicContact CD2-CZ2 4.4Å; F571-W576 HydrophobicContact CG-CZ2 4.22Å; F571-W576 AromaticContact CG-NE1 3.24Å; F571-L583 HydrophobicContact CE1-CD2 4.05Å; F571-N588 HydrophobicContact CE2-CB 3.79Å; F571-N588 HydrophobicContact CZ-CB 3.87Å
572	S	63.8	Low	65.5	Low	6 Å²	6	47.9 Å²	47.9	4%	0.042	25%	0.25	C	C	.	.			trans	-129.5	163.1	165.9	69	0	0	0	0	108.3	D193 I574 N575 W576	D193-S572 WeakPolarHBondContact O-CB 3.19Å; D193-S572 PolarHBondContact O-OG 2.86Å; D193-S572 VanDerWaalsContact O-OG 3.08Å; S572-I574 PolarHBondContact O-N 3.05Å; S572-N575 PolarHBondContact O-N 3.01Å; S572-N575 VanDerWaalsContact O-N 3.15Å; S572-N575 PolarHBondContact OG-N 2.94Å; S572-N575 VanDerWaalsContact OG-N 3.09Å; S572-W576 PolarHBondContact O-N 3.18Å
573	S	64.1	Low	65.4	Low	10 Å²	10	44.7 Å²	44.7	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-47.2	-45.8	170.2	37.7	0	0	0	0	112	G194 K577	G194-S573 PolarHBondContact O-OG 2.89Å; S573-K577 WeakPolarHBondContact O-CB 3.49Å; S573-K577 PolarHBondContact O-N 3.02Å
574	I	68.3	Low	65.3	Low	83 Å²	83	47.2 Å²	47.2	43%	0.426	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-49.4	177.3	-62.9	-178.2	0	0	0	111.3	D193 G194 S572 W576 K577 H578	D193-I574 HydrophobicContact CB-CD1 4.34Å; G194-I574 VanDerWaalsContact CA-CD1 3.46Å; S572-I574 PolarHBondContact O-N 3.05Å; I574-W576 PolarHBondContact O-N 2.85Å; I574-K577 PolarHBondContact O-N 3.47Å; I574-H578 WeakPolarHBondContact O-CB 3.34Å; I574-H578 PolarHBondContact O-N 2.8Å
575	N	69.2	Low	65.2	Low	70 Å²	70	45.2 Å²	45.2	37%	0.374	24%	0.235	S	C	.	.	H	α-helix	trans	-62	-33.5	-179.7	-72.2	-1	0	0	0	112.5	S572 K579	S572-N575 PolarHBondContact O-N 3.01Å; S572-N575 VanDerWaalsContact O-N 3.15Å; S572-N575 PolarHBondContact OG-N 2.94Å; S572-N575 VanDerWaalsContact OG-N 3.09Å; N575-K579 PolarHBondContact O-N 3.04Å
576	W	71	Confident	64.8	Low	3 Å²	3	46.9 Å²	46.9	1%	0.011	24%	0.241	C	C	.	.	H	α-helix	trans	-74	-47.9	175.1	-76.5	46.5	0	0	0	111.3	L233 F303 I425 F571 S572 I574 H578 K579 G580 L583 I585	L233-W576 HydrophobicContact CD1-CH2 3.93Å; L233-W576 HydrophobicContact CD1-CZ3 3.67Å; L233-W576 HydrophobicContact CD2-CE3 4.26Å; L233-W576 HydrophobicContact CD2-CH2 3.96Å; L233-W576 HydrophobicContact CD2-CZ3 3.52Å; L233-W576 HydrophobicContact CG-CH2 4.47Å; L233-W576 HydrophobicContact CG-CZ3 4.24Å; F303-W576 HydrophobicContact CE1-CE3 4.33Å; I425-W576 HydrophobicContact CD1-CB 3.28Å; I425-W576 HydrophobicContact CD1-CD2 3.7Å; I425-W576 HydrophobicContact CD1-CE3 3.57Å; I425-W576 HydrophobicContact CD1-CG 3.63Å; I425-W576 HydrophobicContact CG1-CD2 4.37Å; I425-W576 HydrophobicContact CG1-CE3 3.85Å; I425-W576 HydrophobicContact CG1-CZ3 4.46Å; F571-W576 AromaticContact CD1-CD1 3.94Å; F571-W576 HydrophobicContact CD1-CZ2 4.39Å; F571-W576 AromaticContact CD1-NE1 3.13Å; F571-W576 HydrophobicContact CD2-CZ2 4.4Å; F571-W576 HydrophobicContact CG-CZ2 4.22Å; F571-W576 AromaticContact CG-NE1 3.24Å; S572-W576 PolarHBondContact O-N 3.18Å; I574-W576 PolarHBondContact O-N 2.85Å; W576-H578 PolarHBondContact O-N 3.35Å; W576-K579 CarbonylContact O-C 3.6Å; W576-K579 PolarHBondContact O-N 3.11Å; W576-K579 VanDerWaalsContact O-N 3.09Å; W576-G580 PolarHBondContact O-N 3.45Å; W576-L583 HydrophobicContact CB-CD1 3.73Å; W576-L583 HydrophobicContact CD2-CD1 3.44Å; W576-L583 VanDerWaalsContact CD2-CD1 3.44Å; W576-L583 HydrophobicContact CD2-CD2 4.43Å; W576-L583 HydrophobicContact CE3-CD1 3.79Å; W576-L583 HydrophobicContact CG-CD1 3.41Å; W576-L583 VanDerWaalsContact CG-CD1 3.41Å; W576-L583 HydrophobicContact CZ2-CD2 4.35Å; W576-I585 HydrophobicContact CH2-CD1 3.98Å; W576-I585 HydrophobicContact CH2-CG1 4.25Å; W576-I585 HydrophobicContact CZ3-CD1 4.15Å
577	K	72.6	Confident	64.7	Low	69 Å²	69	51.2 Å²	51.2	30%	0.3	26%	0.26	S	S	.	.	H	α-helix	trans	-59.9	-32.4	177	-173.7	163.9	-175.1	168.7	0	112.4	D298 E299 S573 I574	D298-K577 IonicContact OD1-NZ 3.4Å; D298-K577 PolarHBondContact OD1-NZ 3.32Å; E299-K577 PolarHBondContact O-NZ 2.79Å; S573-K577 WeakPolarHBondContact O-CB 3.49Å; S573-K577 PolarHBondContact O-N 3.02Å; I574-K577 PolarHBondContact O-N 3.47Å
578	H	72.6	Confident	64.3	Low	172 Å²	172	49.9 Å²	49.9	80%	0.796	26%	0.255	S	S	*	.	H	α-helix	trans	-74.2	-33.7	175.3	-172.4	35.9	0	0	0	113.7	I574 W576	I574-H578 WeakPolarHBondContact O-CB 3.34Å; I574-H578 PolarHBondContact O-N 2.8Å; W576-H578 PolarHBondContact O-N 3.35Å
579	K	72.4	Confident	64	Low	118 Å²	118	50.1 Å²	50.1	51%	0.513	26%	0.256	S	S	.	.	H	α-helix	trans	-78.8	-22.5	171.9	-78.1	-169.3	170.8	-159.7	0	113.8	N575 W576 C581 D582 L583	N575-K579 PolarHBondContact O-N 3.04Å; W576-K579 CarbonylContact O-C 3.6Å; W576-K579 PolarHBondContact O-N 3.11Å; W576-K579 VanDerWaalsContact O-N 3.09Å; K579-C581 PolarHBondContact O-N 3.03Å; K579-D582 PolarHBondContact O-N 3.26Å; K579-L583 HydrophobicContact CB-CB 4.41Å; K579-L583 HydrophobicContact CB-CD1 4.01Å; K579-L583 HydrophobicContact CB-CG 4.17Å; K579-L583 HydrophobicContact CD-CD1 4.32Å; K579-L583 HydrophobicContact CD-CG 3.95Å
580	G	73.2	Confident	63.3	Low	15 Å²	15	51.3 Å²	51.3	16%	0.155	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	56	-132.6	-175.9	0	0	0	0	0	112.2	F303 W576	F303-G580 VanDerWaalsContact CE2-C 3.46Å; F303-G580 VanDerWaalsContact CE2-O 3.24Å; F303-G580 WeakPolarHBondContact CE2-O 3.41Å; W576-G580 PolarHBondContact O-N 3.45Å
581	C	73.5	Confident	62.7	Low	20 Å²	20	52.5 Å²	52.5	14%	0.135	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.3	-173.7	-48.5	0	0	0	0	113.3	C305 T309 K579 L583	C305-C581 WeakPolarHBondContact CA-SG 3.31Å; C305-C581 HydrophobicContact CB-CB 3.99Å; C305-C581 WeakPolarHBondContact CB-SG 3.45Å; C305-C581 WeakPolarHBondContact SG-CB 3.39Å; C305-C581 CovalentContact SG-SG 2.03Å; C305-C581 PolarHBondContact SG-SG 3.2Å; T309-C581 WeakPolarHBondContact CB-O 3.33Å; T309-C581 HydrophobicContact CG2-CB 3.73Å; T309-C581 PolarHBondContact OG1-O 3.5Å; K579-C581 PolarHBondContact O-N 3.03Å; C581-L583 PolarHBondContact O-N 3.2Å
582	D	68	Low	62.2	Low	110 Å²	110	56.4 Å²	56.4	59%	0.588	29%	0.289	S	S	*	.			trans	-79	31.6	-178.2	-57.2	-34.6	0	0	0	112.4	K579 D584	K579-D582 PolarHBondContact O-N 3.26Å; D582-D584 PolarHBondContact O-N 3.44Å
583	L	67	Low	61.2	Low	3 Å²	3	63.1 Å²	63.1	2%	0.016	32%	0.317	C	S	.	.			trans	-91.8	97.3	-171.2	-153.4	156.7	0	0	0	110.6	F571 W576 K579 C581 I585	F571-L583 HydrophobicContact CE1-CD2 4.05Å; W576-L583 HydrophobicContact CB-CD1 3.73Å; W576-L583 HydrophobicContact CD2-CD1 3.44Å; W576-L583 VanDerWaalsContact CD2-CD1 3.44Å; W576-L583 HydrophobicContact CD2-CD2 4.43Å; W576-L583 HydrophobicContact CE3-CD1 3.79Å; W576-L583 HydrophobicContact CG-CD1 3.41Å; W576-L583 VanDerWaalsContact CG-CD1 3.41Å; W576-L583 HydrophobicContact CZ2-CD2 4.35Å; K579-L583 HydrophobicContact CB-CB 4.41Å; K579-L583 HydrophobicContact CB-CD1 4.01Å; K579-L583 HydrophobicContact CB-CG 4.17Å; K579-L583 HydrophobicContact CD-CD1 4.32Å; K579-L583 HydrophobicContact CD-CG 3.95Å; C581-L583 PolarHBondContact O-N 3.2Å; L583-I585 HydrophobicContact CD2-CD1 4.26Å; L583-I585 HydrophobicContact CD2-CG1 3.49Å; L583-I585 VanDerWaalsContact CD2-CG1 3.49Å; L583-I585 WeakPolarHBondContact O-CG1 3.03Å; L583-I585 PolarHBondContact O-N 3.02Å
584	D	64	Low	60.3	Low	64 Å²	64	64.1 Å²	64.1	34%	0.342	33%	0.327	S	S	.	.			trans	-63	102.8	169.3	-174.2	-25.9	0	0	0	110.5	D582 F586 Q587	D582-D584 PolarHBondContact O-N 3.44Å; D584-F586 PolarHBondContact OD1-N 2.79Å; D584-F586 VanDerWaalsContact OD1-N 3.1Å; D584-Q587 PolarHBondContact OD1-N 3.06Å; D584-Q587 WeakPolarHBondContact OD2-CG 3.45Å; D584-Q587 PolarHBondContact OD2-NE2 3.22Å
585	I	61.9	Low	59.4	Low	2 Å²	2	61.9 Å²	61.9	1%	0.01	32%	0.315	C	S	.	.			trans	-88.4	-33.2	177.9	-73.3	165.2	0	0	0	111	L311 I315 I563 W576 L583 Q587 N588 T589	L311-I585 HydrophobicContact CB-CD1 4.22Å; L311-I585 HydrophobicContact CD1-CD1 3.63Å; L311-I585 HydrophobicContact CD2-CD1 4.46Å; L311-I585 HydrophobicContact CG-CD1 4.3Å; I315-I585 HydrophobicContact CD1-CB 3.94Å; I315-I585 HydrophobicContact CD1-CD1 3.57Å; I315-I585 HydrophobicContact CD1-CG1 4.34Å; I315-I585 HydrophobicContact CD1-CG2 3.71Å; I563-I585 HydrophobicContact CD1-CD1 4.1Å; I563-I585 HydrophobicContact CD1-CG2 3.82Å; I563-I585 HydrophobicContact CG2-CG2 4.3Å; W576-I585 HydrophobicContact CH2-CD1 3.98Å; W576-I585 HydrophobicContact CH2-CG1 4.25Å; W576-I585 HydrophobicContact CZ3-CD1 4.15Å; L583-I585 HydrophobicContact CD2-CD1 4.26Å; L583-I585 HydrophobicContact CD2-CG1 3.49Å; L583-I585 VanDerWaalsContact CD2-CG1 3.49Å; L583-I585 WeakPolarHBondContact O-CG1 3.03Å; L583-I585 PolarHBondContact O-N 3.02Å; I585-Q587 VanDerWaalsContact C-N 3.26Å; I585-Q587 PolarHBondContact O-N 3.1Å; I585-N588 PolarHBondContact O-N 3.08Å; I585-T589 HydrophobicContact CG2-CG2 3.44Å; I585-T589 VanDerWaalsContact CG2-CG2 3.44Å; I585-T589 PolarHBondContact O-N 2.95Å; I585-T589 PolarHBondContact O-OG1 3.38Å
586	F	54.1	Low	58.6	Low	45 Å²	45	60.9 Å²	60.9	20%	0.197	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-24.4	-171.8	-68.3	-75.4	0	0	0	113.5	P310 E314 I315 D584 N588	P310-F586 HydrophobicContact CB-CD2 4.29Å; P310-F586 HydrophobicContact CB-CE2 3.97Å; E314-F586 HydrophobicContact CB-CE2 3.73Å; E314-F586 HydrophobicContact CB-CZ 3.49Å; E314-F586 VanDerWaalsContact CB-CZ 3.49Å; E314-F586 HydrophobicContact CG-CE2 4.33Å; E314-F586 HydrophobicContact CG-CZ 4.42Å; I315-F586 HydrophobicContact CD1-CE2 4.2Å; I315-F586 HydrophobicContact CD1-CZ 4.08Å; I315-F586 HydrophobicContact CG1-CE1 4.4Å; I315-F586 HydrophobicContact CG1-CE2 3.97Å; I315-F586 HydrophobicContact CG1-CZ 3.53Å; D584-F586 PolarHBondContact OD1-N 2.79Å; D584-F586 VanDerWaalsContact OD1-N 3.1Å; F586-N588 PolarHBondContact O-N 3.31Å
587	Q	51.5	Low	57.8	Low	126 Å²	126	65.5 Å²	65.5	59%	0.589	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.3	168.6	-76.6	-176.9	39.7	0	0	114.8	I543 D584 I585	I543-Q587 WeakPolarHBondContact CD1-O 3.36Å; D584-Q587 PolarHBondContact OD1-N 3.06Å; D584-Q587 WeakPolarHBondContact OD2-CG 3.45Å; D584-Q587 PolarHBondContact OD2-NE2 3.22Å; I585-Q587 VanDerWaalsContact C-N 3.26Å; I585-Q587 PolarHBondContact O-N 3.1Å
588	N	50	Low	57.2	Low	22 Å²	22	64.5 Å²	64.5	12%	0.118	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-3.9	-170.8	-67.7	-86.8	0	0	0	116.1	N566 F571 I585 F586	N566-N588 PolarHBondContact N-O 3.02Å; N566-N588 PolarHBondContact ND2-O 2.8Å; F571-N588 HydrophobicContact CE2-CB 3.79Å; F571-N588 HydrophobicContact CZ-CB 3.87Å; I585-N588 PolarHBondContact O-N 3.08Å; F586-N588 PolarHBondContact O-N 3.31Å
589	T	51.1	Low	56.6	Low	18 Å²	18	58.8 Å²	58.8	11%	0.11	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-85.9	150.4	175.4	45.1	0	0	0	0	113.2	I563 I585	I563-T589 HydrophobicContact CG2-CG2 3.64Å; I585-T589 HydrophobicContact CG2-CG2 3.44Å; I585-T589 VanDerWaalsContact CG2-CG2 3.44Å; I585-T589 PolarHBondContact O-N 2.95Å; I585-T589 PolarHBondContact O-OG1 3.38Å
590	K	45.8	Very low	56	Low	68 Å²	68	57.3 Å²	57.3	30%	0.296	31%	0.311	S	S	.	.			trans	-145.5	148.4	164.5	-83.7	-175.1	-177.1	176	0	109.9	E542 A594	E542-K590 PolarHBondContact O-NZ 2.79Å; K590-A594 HydrophobicContact CB-CB 3.83Å; K590-A594 HydrophobicContact CD-CB 3.96Å; K590-A594 HydrophobicContact CG-CB 4.45Å
591	V	42.8	Very low	55.7	Low	64 Å²	64	62 Å²	62	39%	0.388	33%	0.327	S	S	.	.			trans	-55.6	146.2	174.5	-179	0	0	0	0	111.1	K593 A594	V591-K593 PolarHBondContact O-N 3Å; V591-A594 WeakPolarHBondContact O-CB 3.25Å; V591-A594 PolarHBondContact O-N 3.48Å
592	T	48.7	Very low	55.5	Low	97 Å²	97	62 Å²	62	60%	0.595	33%	0.331	S	S	*	.	H	α-helix	trans	-47.3	-31.6	-177.8	47.8	0	0	0	0	116	A594 L595 S596	T592-A594 PolarHBondContact O-N 3.24Å; T592-A594 VanDerWaalsContact O-N 3.16Å; T592-L595 PolarHBondContact O-N 2.81Å; T592-S596 PolarHBondContact O-N 3.42Å; T592-S596 PolarHBondContact O-OG 2.88Å
593	K	44.2	Very low	55.8	Low	146 Å²	146	60.6 Å²	60.6	64%	0.635	32%	0.317	S	S	*	.	H	α-helix	trans	-56.6	-26	171.9	-81.1	-175.4	173.2	177.3	0	113	V591 S596 E597 D1852	V591-K593 PolarHBondContact O-N 3Å; K593-S596 WeakPolarHBondContact CA-OG 3.35Å; K593-S596 PolarHBondContact O-OG 3.35Å; K593-E597 PolarHBondContact O-N 2.96Å; K593-D1852 IonicContact NZ-OD2 3.41Å; K593-D1852 PolarHBondContact NZ-OD2 2.85Å
594	A	45.6	Very low	56.6	Low	32 Å²	32	61.9 Å²	61.9	26%	0.264	33%	0.326	S	S	.	.	H	α-helix	trans	-83.7	-37	179.8	0	0	0	0	0	113.9	K590 V591 T592 E597 F598	K590-A594 HydrophobicContact CB-CB 3.83Å; K590-A594 HydrophobicContact CD-CB 3.96Å; K590-A594 HydrophobicContact CG-CB 4.45Å; V591-A594 WeakPolarHBondContact O-CB 3.25Å; V591-A594 PolarHBondContact O-N 3.48Å; T592-A594 PolarHBondContact O-N 3.24Å; T592-A594 VanDerWaalsContact O-N 3.16Å; A594-E597 PolarHBondContact O-N 2.87Å; A594-F598 PolarHBondContact O-N 2.92Å
595	L	49.4	Very low	57.3	Low	35 Å²	35	58.8 Å²	58.8	18%	0.183	31%	0.31	C	S	.	.	H	α-helix	trans	-75.9	-37.9	177.3	-174.1	125.5	0	0	0	111.6	Q564 T592 E597 F598 L599	Q564-L595 HydrophobicContact CG-CD1 3.82Å; T592-L595 PolarHBondContact O-N 2.81Å; L595-E597 PolarHBondContact O-N 2.98Å; L595-F598 CarbonylContact O-C 3.6Å; L595-F598 WeakPolarHBondContact O-CA 3.35Å; L595-F598 WeakPolarHBondContact O-CB 3.32Å; L595-F598 PolarHBondContact O-N 2.91Å; L595-L599 HydrophobicContact CD2-CD1 3.54Å; L595-L599 HydrophobicContact CD2-CG 3.79Å; L595-L599 HydrophobicContact CG-CG 4.26Å; L595-L599 WeakPolarHBondContact O-CG 3.43Å; L595-L599 PolarHBondContact O-N 3.34Å
596	S	51.5	Low	58	Low	49 Å²	49	61.2 Å²	61.2	34%	0.343	32%	0.323	S	S	.	.	H	α-helix	trans	-58.1	-36.5	169.5	48.5	0	0	0	0	111.6	T592 K593 S600	T592-S596 PolarHBondContact O-N 3.42Å; T592-S596 PolarHBondContact O-OG 2.88Å; K593-S596 WeakPolarHBondContact CA-OG 3.35Å; K593-S596 PolarHBondContact O-OG 3.35Å; S596-S600 WeakPolarHBondContact O-CB 3.38Å; S596-S600 PolarHBondContact O-N 3Å
597	E	54.6	Low	59.1	Low	101 Å²	101	60.5 Å²	60.5	47%	0.472	32%	0.32	S	S	.	.	H	α-helix	trans	-67.9	-39.6	170.2	-149.2	-154.8	176.3	0	0	112.9	K593 A594 L595 S600 K601	K593-E597 PolarHBondContact O-N 2.96Å; A594-E597 PolarHBondContact O-N 2.87Å; L595-E597 PolarHBondContact O-N 2.98Å; E597-S600 PolarHBondContact O-N 3.02Å; E597-S600 PolarHBondContact O-OG 3.07Å; E597-K601 VanDerWaalsContact CD-CE 3.44Å; E597-K601 WeakPolarHBondContact O-CD 3.21Å; E597-K601 VanDerWaalsContact O-CG 3.31Å; E597-K601 WeakPolarHBondContact O-CG 3.37Å; E597-K601 PolarHBondContact O-N 3.34Å; E597-K601 WeakPolarHBondContact OE1-CE 3.46Å; E597-K601 IonicContact OE1-NZ 2.7Å; E597-K601 PolarHBondContact OE1-NZ 2.96Å; E597-K601 IonicContact OE2-NZ 3.84Å; E597-K601 PolarHBondContact OE2-NZ 3.09Å
598	F	59.4	Low	60	Low	47 Å²	47	58.5 Å²	58.5	21%	0.206	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-43.7	175.5	177.9	-96.4	0	0	0	112.8	I518 H535 K536 A594 L595 S600 K601	I518-F598 HydrophobicContact CD1-CZ 4.29Å; H535-F598 HydrophobicContact CB-CE1 3.78Å; H535-F598 HydrophobicContact CB-CE2 4.24Å; H535-F598 HydrophobicContact CB-CZ 3.53Å; H535-F598 AromaticContact CG-CE1 3.98Å; H535-F598 PolarHBondContact ND1-O 3.33Å; K536-F598 WeakPolarHBondContact O-CE2 3.38Å; A594-F598 PolarHBondContact O-N 2.92Å; L595-F598 CarbonylContact O-C 3.6Å; L595-F598 WeakPolarHBondContact O-CA 3.35Å; L595-F598 WeakPolarHBondContact O-CB 3.32Å; L595-F598 PolarHBondContact O-N 2.91Å; F598-S600 VanDerWaalsContact C-N 3.3Å; F598-S600 PolarHBondContact O-N 3.33Å; F598-K601 PolarHBondContact O-N 2.76Å
599	L	60.4	Low	60.9	Low	52 Å²	52	61.8 Å²	61.8	27%	0.272	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-31.8	173.9	-67.3	-175.8	0	0	0	111.7	L520 H535 L595 K601	L520-L599 HydrophobicContact CD2-CD2 4.23Å; H535-L599 PolarHBondContact CE1-O 3.21Å; L595-L599 HydrophobicContact CD2-CD1 3.54Å; L595-L599 HydrophobicContact CD2-CG 3.79Å; L595-L599 HydrophobicContact CG-CG 4.26Å; L595-L599 WeakPolarHBondContact O-CG 3.43Å; L595-L599 PolarHBondContact O-N 3.34Å; L599-K601 VanDerWaalsContact C-N 3.27Å; L599-K601 PolarHBondContact O-N 3.29Å
600	S	59.6	Low	61.4	Low	88 Å²	88	61.9 Å²	61.9	62%	0.615	33%	0.333	S	S	*	.	H	α-helix	trans	-69.5	-19.9	173.9	83.1	0	0	0	0	114.5	S596 E597 F598	S596-S600 WeakPolarHBondContact O-CB 3.38Å; S596-S600 PolarHBondContact O-N 3Å; E597-S600 PolarHBondContact O-N 3.02Å; E597-S600 PolarHBondContact O-OG 3.07Å; F598-S600 VanDerWaalsContact C-N 3.3Å; F598-S600 PolarHBondContact O-N 3.33Å
601	K	66	Low	61.8	Low	114 Å²	114	62.3 Å²	62.3	50%	0.496	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	9.8	-174.2	-74.2	168.1	-179.5	170.3	0	114.3	E597 F598 L599	E597-K601 VanDerWaalsContact CD-CE 3.44Å; E597-K601 WeakPolarHBondContact O-CD 3.21Å; E597-K601 VanDerWaalsContact O-CG 3.31Å; E597-K601 WeakPolarHBondContact O-CG 3.37Å; E597-K601 PolarHBondContact O-N 3.34Å; E597-K601 WeakPolarHBondContact OE1-CE 3.46Å; E597-K601 IonicContact OE1-NZ 2.7Å; E597-K601 PolarHBondContact OE1-NZ 2.96Å; E597-K601 IonicContact OE2-NZ 3.84Å; E597-K601 PolarHBondContact OE2-NZ 3.09Å; F598-K601 PolarHBondContact O-N 2.76Å; L599-K601 VanDerWaalsContact C-N 3.27Å; L599-K601 PolarHBondContact O-N 3.29Å
602	G	69.1	Low	61.9	Low	20 Å²	20	64.8 Å²	64.8	21%	0.206	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-75.8	151.8	-179.3	0	0	0	0	0	114.4	V534 H535	V534-G602 WeakPolarHBondContact O-CA 3.32Å; H535-G602 VanDerWaalsContact CE1-CA 3.42Å; H535-G602 WeakPolarHBondContact CE1-CA 3.4Å; H535-G602 WeakPolarHBondContact ND1-CA 3.12Å
603	Y	76.3	Confident	61.2	Low	79 Å²	79	65.4 Å²	65.4	31%	0.31	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.3	176.4	-59.5	-84	0	0	0	110.3	I510 F511 F514 V533 V534	I510-Y603 HydrophobicContact CD1-CD1 4.08Å; I510-Y603 HydrophobicContact CD1-CE1 3.37Å; I510-Y603 HydrophobicContact CG2-CE1 4.5Å; I510-Y603 HydrophobicContact CG2-CE2 4.37Å; F511-Y603 HydrophobicContact CZ-CG 4.35Å; F514-Y603 HydrophobicContact CE2-CD2 4.18Å; F514-Y603 HydrophobicContact CE2-CE2 4.15Å; F514-Y603 HydrophobicContact CZ-CD2 4.46Å; F514-Y603 AromaticContact CZ-CE2 3.97Å; F514-Y603 HydrophobicContact CZ-CE2 3.97Å; V533-Y603 CarbonylContact C-O 3.54Å; V533-Y603 WeakPolarHBondContact CA-O 3.39Å; V534-Y603 PolarHBondContact N-O 2.86Å; V534-Y603 PolarHBondContact O-N 3.3Å
604	P	82	Confident	60.5	Low	30 Å²	30	66.8 Å²	66.8	20%	0.195	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	133.5	179.6	28.9	-33.5	0	0	0	111	F532 K641 H642	F532-P604 WeakPolarHBondContact O-CA 3.24Å; P604-K641 HydrophobicContact CB-CB 4.14Å; P604-K641 HydrophobicContact CB-CD 4.28Å; P604-K641 HydrophobicContact CG-CB 4.39Å; P604-K641 WeakPolarHBondContact O-CB 3.46Å; P604-K641 PolarHBondContact O-N 3.29Å; P604-H642 WeakPolarHBondContact CG-NE2 3.22Å
605	V	78.5	Confident	59.7	Low	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.5	-177.6	-62	0	0	0	0	112.8	F511 L519 F532 V534 I607 N639	F511-V605 HydrophobicContact CE1-CG1 3.58Å; F511-V605 HydrophobicContact CZ-CG1 3.51Å; L519-V605 HydrophobicContact CD1-CG2 4.11Å; F532-V605 HydrophobicContact CB-CG2 3.78Å; F532-V605 PolarHBondContact O-N 3.13Å; V534-V605 HydrophobicContact CB-CG1 4.18Å; V534-V605 HydrophobicContact CG2-CB 4.3Å; V534-V605 HydrophobicContact CG2-CG1 3.71Å; V534-V605 HydrophobicContact CG2-CG2 3.58Å; V605-I607 HydrophobicContact CG2-CG1 4.46Å; V605-N639 CarbonylContact C-O 3.52Å; V605-N639 WeakPolarHBondContact CA-O 3.37Å; V605-N639 WeakPolarHBondContact CB-O 3.42Å
606	D	78.3	Confident	58.7	Low	53 Å²	53	75.2 Å²	75.2	28%	0.283	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	137.4	160.8	-59.1	-48.3	0	0	0	108.8	Y608 N639	D606-Y608 HydrophobicContact CB-CE2 4.24Å; D606-N639 PolarHBondContact N-O 2.88Å; D606-N639 PolarHBondContact O-N 3.4Å
607	I	75.5	Confident	57.6	Low	30 Å²	30	77.7 Å²	77.7	15%	0.154	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.5	-180	-58.7	-178	0	0	0	109.7	L519 F532 V605 F636 L638	L519-I607 HydrophobicContact CD1-CD1 3.88Å; L519-I607 HydrophobicContact CD1-CG1 4.46Å; L519-I607 HydrophobicContact CD2-CD1 3.47Å; L519-I607 VanDerWaalsContact CD2-CD1 3.47Å; L519-I607 HydrophobicContact CG-CD1 4.2Å; F532-I607 HydrophobicContact CB-CD1 3.94Å; F532-I607 HydrophobicContact CB-CG1 4.06Å; F532-I607 HydrophobicContact CD1-CD1 3.39Å; F532-I607 HydrophobicContact CD1-CG1 4.29Å; F532-I607 HydrophobicContact CD2-CB 4.2Å; F532-I607 HydrophobicContact CD2-CD1 3.6Å; F532-I607 HydrophobicContact CD2-CG1 3.62Å; F532-I607 HydrophobicContact CE1-CD1 3.65Å; F532-I607 HydrophobicContact CE2-CB 4.23Å; F532-I607 HydrophobicContact CE2-CD1 3.84Å; F532-I607 HydrophobicContact CE2-CG1 4.06Å; F532-I607 HydrophobicContact CG-CD1 3.35Å; F532-I607 HydrophobicContact CG-CG1 3.74Å; F532-I607 HydrophobicContact CZ-CD1 3.85Å; V605-I607 HydrophobicContact CG2-CG1 4.46Å; I607-F636 HydrophobicContact CG2-CB 4Å; I607-F636 HydrophobicContact CG2-CD1 3.37Å; I607-F636 HydrophobicContact CG2-CE1 4.16Å; I607-F636 HydrophobicContact CG2-CG 3.9Å; I607-L638 HydrophobicContact CG1-CD2 3.92Å
608	Y	72.4	Confident	56.2	Low	84 Å²	84	79.3 Å²	79.3	33%	0.329	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.1	166.5	-49.5	-83.1	0	0	0	110.1	D606 F636 R637 N639	D606-Y608 HydrophobicContact CB-CE2 4.24Å; Y608-F636 WeakPolarHBondContact O-CA 3.16Å; Y608-R637 PolarHBondContact N-O 2.88Å; Y608-R637 PolarHBondContact O-N 3Å; Y608-N639 HydrophobicContact CE2-CB 3.88Å
609	P	67.6	Low	54.8	Low	91 Å²	91	87.7 Å²	87.7	59%	0.591	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	137.8	173.9	26.7	-33.7	0	0	0	110.5	S611 R637	P609-S611 PolarHBondContact O-N 2.93Å; P609-R637 PolarHBondContact O-NH1 2.8Å
610	A	62	Low	53.2	Low	20 Å²	20	90.6 Å²	90.6	17%	0.165	50%	0.497	C	S	.	.			trans	-81.8	68	177.2	0	0	0	0	0	110.7	I186 N612 R635 R637	I186-A610 HydrophobicContact CG2-CB 4.03Å; A610-N612 PolarHBondContact O-N 2.95Å; A610-R635 HydrophobicContact CB-CB 3.79Å; A610-R635 WeakPolarHBondContact CB-O 3.46Å; A610-R635 PolarHBondContact N-O 3.05Å; A610-R637 HydrophobicContact CB-CG 4.44Å
611	S	54.8	Low	51.7	Low	76 Å²	76	94 Å²	94	53%	0.531	51%	0.505	S	S	.	.			trans	-63.4	103.1	-178.6	43.9	0	0	0	0	112.6	P609	P609-S611 PolarHBondContact O-N 2.93Å
612	N	44.1	Very low	49.9	Very low	116 Å²	116	93 Å²	93	62%	0.62	51%	0.513	S	S	*	.			trans	-157.2	19.3	157.7	-122.6	-0.8	0	0	0	115.4	A610 K614	A610-N612 PolarHBondContact O-N 2.95Å; N612-K614 PolarHBondContact O-N 3.3Å
613	V	34.5	Very low	47.9	Very low	110 Å²	110	93.8 Å²	93.8	67%	0.667	52%	0.521	S	S	*	.			trans	-87.7	96.7	170.4	-177.9	0	0	0	0	109.2	T615	V613-T615 VanDerWaalsContact C-N 3.29Å; V613-T615 HydrophobicContact CG1-CG2 3.8Å; V613-T615 PolarHBondContact O-N 3.3Å; V613-T615 VanDerWaalsContact O-N 3.09Å
614	K	29	Very low	45.7	Very low	175 Å²	175	95.5 Å²	95.5	76%	0.761	53%	0.53	S	S	*	.			trans	-77.7	77	166	-73.6	-175.4	179.3	176.2	0	110.2	N612 N616	N612-K614 PolarHBondContact O-N 3.3Å; K614-N616 PolarHBondContact O-N 3.26Å
615	T	29.5	Very low	43.4	Very low	107 Å²	107	100.6 Å²	100.6	66%	0.656	55%	0.551	S	S	*	*			trans	-71.5	69.1	166.2	26.6	0	0	0	0	110.4	V613 T617	V613-T615 VanDerWaalsContact C-N 3.29Å; V613-T615 HydrophobicContact CG1-CG2 3.8Å; V613-T615 PolarHBondContact O-N 3.3Å; V613-T615 VanDerWaalsContact O-N 3.09Å; T615-T617 PolarHBondContact O-N 3.24Å
616	N	27	Very low	41.3	Very low	137 Å²	137	106.5 Å²	106.5	73%	0.733	58%	0.583	S	S	*	*			trans	-72.3	48.1	174.8	-83.6	15.5	0	0	0	112.1	K614	K614-N616 PolarHBondContact O-N 3.26Å
617	T	28.4	Very low	39.5	Very low	102 Å²	102	110.1 Å²	110.1	63%	0.626	60%	0.602	S	S	*	*			trans	-145.7	75.9	175.8	48.8	0	0	0	0	111.1	T615 R619	T615-T617 PolarHBondContact O-N 3.24Å; T617-R619 PolarHBondContact O-N 2.94Å
618	P	26.7	Very low	37.9	Very low	134 Å²	134	112.2 Å²	112.2	87%	0.87	62%	0.616	S	S	*	*			trans	-69.7	83.2	162	30.9	-33.4	0	0	0	108.8
619	R	29.4	Very low	36.8	Very low	224 Å²	224	113.4 Å²	113.4	85%	0.845	62%	0.621	S	S	*	*			trans	-133.5	102	-177.9	-103.7	-174.7	173.1	175.8	-1.2	112.3	T617	T617-R619 PolarHBondContact O-N 2.94Å
620	S	25.9	Very low	35.9	Very low	112 Å²	112	111.9 Å²	111.9	78%	0.783	61%	0.613	S	S	*	*			trans	45.5	89.5	149.7	-166.4	0	0	0	0	117.4
621	M	28.5	Very low	35.5	Very low	159 Å²	159	117.6 Å²	117.6	78%	0.783	64%	0.64	S	S	*	*			trans	-111.5	82.5	151.4	-70.1	-137.5	70.3	0	0	109.5
622	S	28.4	Very low	35.9	Very low	94 Å²	94	117.5 Å²	117.5	66%	0.657	63%	0.633	S	S	*	*			trans	-116.7	68.7	170.6	-175	0	0	0	0	110.2	K2046	S622-K2046 PolarHBondContact O-NZ 3.37Å
623	G	26.4	Very low	36.9	Very low	37 Å²	37	115.7 Å²	115.7	38%	0.381	62%	0.623	S	S	.	*	S	Bend	trans	172.5	123.7	176.8	0	0	0	0	0	113.6
624	K	30.4	Very low	39	Very low	115 Å²	115	111.4 Å²	111.4	50%	0.5	60%	0.595	S	S	.	*			trans	64.7	115.8	171.2	-47.6	-145.1	159.3	-154.8	0	114.8	E2045	K624-E2045 WeakPolarHBondContact CB-OE1 3.39Å; K624-E2045 WeakPolarHBondContact CD-OE1 3.47Å; K624-E2045 VanDerWaalsContact CE-OE1 3.29Å; K624-E2045 WeakPolarHBondContact CE-OE1 3.33Å; K624-E2045 VanDerWaalsContact CE-OE2 3.23Å; K624-E2045 WeakPolarHBondContact CE-OE2 3.4Å; K624-E2045 WeakPolarHBondContact CG-OE1 3.13Å; K624-E2045 IonicContact NZ-OE1 3.68Å; K624-E2045 IonicContact NZ-OE2 2.8Å; K624-E2045 PolarHBondContact NZ-OE2 3.43Å
625	E	33.7	Very low	41.3	Very low	136 Å²	136	108.1 Å²	108.1	64%	0.636	58%	0.578	S	S	*	*	S	Bend	trans	-83.2	-14.6	-173	-55.4	-154.7	165.8	0	0	113.6	N627	E625-N627 VanDerWaalsContact C-N 3.35Å; E625-N627 PolarHBondContact O-N 3.37Å; E625-N627 VanDerWaalsContact O-N 3.07Å
626	D	34.7	Very low	43.6	Very low	125 Å²	125	103.5 Å²	103.5	67%	0.668	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-6	-161.2	-65.3	-24	0	0	0	118.3
627	N	40.7	Very low	45.8	Very low	128 Å²	128	97.8 Å²	97.8	68%	0.684	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.9	6.7	-167.2	-92.3	-80.2	0	0	0	117.3	E625 Y629 S630	E625-N627 VanDerWaalsContact C-N 3.35Å; E625-N627 PolarHBondContact O-N 3.37Å; E625-N627 VanDerWaalsContact O-N 3.07Å; N627-Y629 PolarHBondContact O-N 3.15Å; N627-S630 PolarHBondContact O-OG 2.97Å; N627-S630 VanDerWaalsContact O-OG 3.04Å
628	V	42.2	Very low	48	Very low	75 Å²	75	93.2 Å²	93.2	46%	0.455	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-67.6	-28.8	-167.4	-175.6	0	0	0	0	114.2	S630	V628-S630 VanDerWaalsContact C-N 3.29Å; V628-S630 PolarHBondContact O-N 3.03Å
629	Y	50	Low	50.1	Low	109 Å²	109	87.2 Å²	87.2	43%	0.427	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-69.6	-17.2	-170.8	-60	-73.2	0	0	0	115.9	L216 N627 N631	L216-Y629 HydrophobicContact CD2-CD1 4.46Å; L216-Y629 HydrophobicContact CD2-CE1 3.45Å; L216-Y629 VanDerWaalsContact CD2-CE1 3.45Å; L216-Y629 VanDerWaalsContact CD2-OH 3.27Å; L216-Y629 WeakPolarHBondContact CD2-OH 3.43Å; N627-Y629 PolarHBondContact O-N 3.15Å; Y629-N631 PolarHBondContact O-N 2.83Å
630	S	48.7	Very low	52	Low	59 Å²	59	77.9 Å²	77.9	41%	0.413	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-65.8	-30.6	-173.7	51.6	0	0	0	0	114.7	N627 V628	N627-S630 PolarHBondContact O-OG 2.97Å; N627-S630 VanDerWaalsContact O-OG 3.04Å; V628-S630 VanDerWaalsContact C-N 3.29Å; V628-S630 PolarHBondContact O-N 3.03Å
631	N	53.9	Low	54.1	Low	139 Å²	139	76.4 Å²	76.4	74%	0.743	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-98.8	-4.9	-161.7	-72.4	-54.9	0	0	0	116.2	Y629 L633	Y629-N631 PolarHBondContact O-N 2.83Å; N631-L633 PolarHBondContact O-N 2.88Å
632	I	61.9	Low	55.8	Low	75 Å²	75	76.3 Å²	76.3	39%	0.385	39%	0.393	S	S	.	.			trans	-90	83.1	-176.1	-52.2	-179	0	0	0	110.5	R224 H634	R224-I632 WeakPolarHBondContact CD-O 3.46Å; R224-I632 WeakPolarHBondContact CG-O 2.99Å; R224-I632 PolarHBondContact NE-O 3.34Å; I632-H634 PolarHBondContact O-CD2 2.97Å; I632-H634 PolarHBondContact O-N 3.43Å
633	L	66.3	Low	57.2	Low	77 Å²	77	73.1 Å²	73.1	40%	0.403	37%	0.373	S	S	.	.			trans	-70.2	113.2	172.3	-179.7	68.1	0	0	0	110.5	E188 R224 N631 R635	E188-L633 HydrophobicContact CB-CD1 4.37Å; R224-L633 VanDerWaalsContact NH2-CD1 3.33Å; N631-L633 PolarHBondContact O-N 2.88Å; L633-R635 HydrophobicContact CG-CG 4.37Å
634	H	76.7	Confident	58.4	Low	20 Å²	20	76.8 Å²	76.8	9%	0.093	38%	0.384	C	S	.	.			trans	-87.1	132.5	-179.4	-74.3	-76.8	0	0	0	111.2	E188 D189 A219 I632 F636	E188-H634 WeakPolarHBondContact CA-O 3.28Å; D189-H634 HydrophobicContact CB-CB 4.26Å; D189-H634 PolarHBondContact N-O 3.23Å; D189-H634 VanDerWaalsContact N-O 3.09Å; D189-H634 PolarHBondContact OD1-N 2.92Å; D189-H634 IonicContact OD2-CD2 2.77Å; A219-H634 PolarHBondContact O-NE2 3.41Å; I632-H634 PolarHBondContact O-CD2 2.97Å; I632-H634 PolarHBondContact O-N 3.43Å; H634-F636 HydrophobicContact CB-CE2 3.66Å; H634-F636 HydrophobicContact CB-CZ 3.77Å
635	R	78.1	Confident	59.4	Low	106 Å²	106	74.4 Å²	74.4	40%	0.4	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	130.9	-178.2	-68.5	-175.8	164.3	163.4	-2.9	112.4	I186 Y187 E188 A610 L633	I186-R635 HydrophobicContact CG2-CB 4.42Å; Y187-R635 CarbonylContact O-C 3.51Å; Y187-R635 WeakPolarHBondContact O-CA 3.43Å; E188-R635 HydrophobicContact CB-CG 3.92Å; E188-R635 IonicContact OE2-CZ 2.8Å; E188-R635 IonicContact OE2-NE 3.92Å; E188-R635 PolarHBondContact OE2-NE 3.41Å; E188-R635 IonicContact OE2-NH2 3.55Å; E188-R635 PolarHBondContact OE2-NH2 3.26Å; A610-R635 HydrophobicContact CB-CB 3.79Å; A610-R635 WeakPolarHBondContact CB-O 3.46Å; A610-R635 PolarHBondContact N-O 3.05Å; L633-R635 HydrophobicContact CG-CG 4.37Å
636	F	77	Confident	60.1	Low	11 Å²	11	68.7 Å²	68.7	5%	0.048	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	142.6	-170.9	-57.5	-67.8	0	0	0	112.7	I186 Y187 F222 L440 I607 Y608 H634 L638	I186-F636 WeakPolarHBondContact CA-O 3.4Å; Y187-F636 PolarHBondContact N-O 2.95Å; Y187-F636 PolarHBondContact O-N 2.71Å; F222-F636 WeakPolarHBondContact O-CE2 3.15Å; F222-F636 VanDerWaalsContact O-CZ 3.24Å; F222-F636 WeakPolarHBondContact O-CZ 3.39Å; L440-F636 HydrophobicContact CD1-CD2 4.02Å; L440-F636 HydrophobicContact CD2-CD2 4.21Å; L440-F636 HydrophobicContact CD2-CE2 4.32Å; I607-F636 HydrophobicContact CG2-CB 4Å; I607-F636 HydrophobicContact CG2-CD1 3.37Å; I607-F636 HydrophobicContact CG2-CE1 4.16Å; I607-F636 HydrophobicContact CG2-CG 3.9Å; Y608-F636 WeakPolarHBondContact O-CA 3.16Å; H634-F636 HydrophobicContact CB-CE2 3.66Å; H634-F636 HydrophobicContact CB-CZ 3.77Å; F636-L638 HydrophobicContact CB-CD2 4.27Å
637	R	74.9	Confident	60.7	Low	16 Å²	16	68.2 Å²	68.2	6%	0.06	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127	162	-66.6	176.9	-177.7	118.9	-10.8	107.7	T158 N182 Y184 I186 Y608 P609 A610	T158-R637 PolarHBondContact O-NH2 3.32Å; N182-R637 PolarHBondContact OD1-NE 2.89Å; N182-R637 PolarHBondContact OD1-NH2 3.37Å; Y184-R637 HydrophobicContact CD2-CB 4.27Å; Y184-R637 HydrophobicContact CG-CB 4.41Å; I186-R637 HydrophobicContact CG1-CG 4.06Å; Y608-R637 PolarHBondContact N-O 2.88Å; Y608-R637 PolarHBondContact O-N 3Å; P609-R637 PolarHBondContact O-NH1 2.8Å; A610-R637 HydrophobicContact CB-CG 4.44Å
638	L	73.3	Confident	61.1	Low	6 Å²	6	62.1 Å²	62.1	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.1	179.3	-55.9	-179.2	0	0	0	110.1	Y187 V517 L519 V534 I607 F636	Y187-L638 HydrophobicContact CD2-CB 4.45Å; Y187-L638 HydrophobicContact CD2-CD1 3.56Å; Y187-L638 HydrophobicContact CD2-CG 3.85Å; Y187-L638 HydrophobicContact CE2-CB 4.46Å; Y187-L638 HydrophobicContact CE2-CD1 3.73Å; Y187-L638 HydrophobicContact CE2-CG 4.23Å; Y187-L638 HydrophobicContact CG-CD1 4Å; V517-L638 HydrophobicContact CG2-CD1 4.26Å; L519-L638 HydrophobicContact CD1-CD2 4.45Å; V534-L638 HydrophobicContact CG2-CD1 4.09Å; I607-L638 HydrophobicContact CG1-CD2 3.92Å; F636-L638 HydrophobicContact CB-CD2 4.27Å
639	N	70.7	Confident	61.6	Low	8 Å²	8	61.3 Å²	61.3	4%	0.043	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.3	172.5	177.3	59	0	0	0	110.6	Y184 V605 D606 Y608	Y184-N639 HydrophobicContact CD1-CB 4.15Å; Y184-N639 HydrophobicContact CE1-CB 3.64Å; Y184-N639 WeakPolarHBondContact CE1-OD1 3.39Å; V605-N639 CarbonylContact C-O 3.52Å; V605-N639 WeakPolarHBondContact CA-O 3.37Å; V605-N639 WeakPolarHBondContact CB-O 3.42Å; D606-N639 PolarHBondContact N-O 2.88Å; D606-N639 PolarHBondContact O-N 3.4Å; Y608-N639 HydrophobicContact CE2-CB 3.88Å
640	D	69.4	Low	61.6	Low	29 Å²	29	56.2 Å²	56.2	16%	0.155	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	125.1	174.1	-176.7	-34.6	0	0	0	110.2	F511 H642 A643	F511-D640 HydrophobicContact CD2-CB 4.48Å; F511-D640 HydrophobicContact CE2-CB 3.72Å; F511-D640 HydrophobicContact CZ-CB 4.39Å; D640-H642 PolarHBondContact O-N 3.22Å; D640-H642 WeakPolarHBondContact OD1-CA 3.32Å; D640-H642 WeakPolarHBondContact OD1-CB 3.45Å; D640-H642 PolarHBondContact OD1-N 2.66Å; D640-A643 HydrophobicContact CB-CB 3.7Å; D640-A643 PolarHBondContact O-N 3.13Å; D640-A643 PolarHBondContact OD1-N 2.72Å
641	K	71	Confident	61.6	Low	81 Å²	81	57.5 Å²	57.5	35%	0.352	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.2	-176.4	-166.5	170.8	-172.2	170.8	0	113.7	E531 P604	E531-K641 IonicContact OE1-NZ 2.67Å; E531-K641 PolarHBondContact OE1-NZ 3.28Å; P604-K641 HydrophobicContact CB-CB 4.14Å; P604-K641 HydrophobicContact CB-CD 4.28Å; P604-K641 HydrophobicContact CG-CB 4.39Å; P604-K641 WeakPolarHBondContact O-CB 3.46Å; P604-K641 PolarHBondContact O-N 3.29Å
642	H	64.3	Low	61.3	Low	157 Å²	157	51.6 Å²	51.6	73%	0.727	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-12.5	174.6	-64	-32.5	0	0	0	113.1	P604 D640	P604-H642 WeakPolarHBondContact CG-NE2 3.22Å; D640-H642 PolarHBondContact O-N 3.22Å; D640-H642 WeakPolarHBondContact OD1-CA 3.32Å; D640-H642 WeakPolarHBondContact OD1-CB 3.45Å; D640-H642 PolarHBondContact OD1-N 2.66Å
643	A	56.8	Low	60.5	Low	27 Å²	27	48.3 Å²	48.3	22%	0.223	23%	0.23	C	C	.	.	S	Bend	trans	-72.9	143.4	167.2	0	0	0	0	0	110.6	P506 D640 L645	P506-A643 HydrophobicContact CG-CB 3.93Å; D640-A643 HydrophobicContact CB-CB 3.7Å; D640-A643 PolarHBondContact O-N 3.13Å; D640-A643 PolarHBondContact OD1-N 2.72Å; A643-L645 PolarHBondContact O-N 3.14Å
644	N	51.8	Low	59.5	Low	114 Å²	114	48.1 Å²	48.1	61%	0.61	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-61.5	134	154.6	-67.3	-61.7	0	0	0	107.2
645	L	51.4	Low	57.8	Low	65 Å²	65	50.6 Å²	50.6	34%	0.34	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-49	131.3	173.2	-75.4	76.5	0	0	0	108.7	A643 R647	A643-L645 PolarHBondContact O-N 3.14Å; L645-R647 WeakPolarHBondContact O-CG 3.31Å; L645-R647 PolarHBondContact O-N 3.37Å
646	P	49.1	Very low	56	Low	15 Å²	15	50.9 Å²	50.9	10%	0.097	27%	0.266	C	S	.	.			trans	-57.6	114.3	-178.3	23.3	-33.8	0	0	0	109.2	L183 Y184 A648	L183-P646 HydrophobicContact CB-CG 4.07Å; Y184-P646 HydrophobicContact CD1-CG 4.34Å; Y184-P646 HydrophobicContact CE1-CG 3.64Å; P646-A648 PolarHBondContact O-N 2.77Å
647	R	47.2	Very low	54.1	Low	116 Å²	116	51.4 Å²	51.4	44%	0.438	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	108	-173.5	-63.1	-175.9	179.1	170.4	2.2	108.6	L154 D504 L645 N649	L154-R647 HydrophobicContact CD1-CB 4.13Å; L154-R647 HydrophobicContact CD1-CG 4.25Å; D504-R647 HydrophobicContact CB-CB 4.37Å; D504-R647 PolarHBondContact N-O 3.06Å; L645-R647 WeakPolarHBondContact O-CG 3.31Å; L645-R647 PolarHBondContact O-N 3.37Å; R647-N649 PolarHBondContact O-N 2.63Å; R647-N649 VanDerWaalsContact O-N 3.17Å
648	A	49.1	Very low	52.5	Low	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	91.5	163.6	0	0	0	0	0	108.3	I155 L181 L183 P646 I650	I155-A648 HydrophobicContact CB-CB 4.31Å; I155-A648 HydrophobicContact CD1-CB 4.11Å; I155-A648 PolarHBondContact N-O 3.12Å; L181-A648 HydrophobicContact CD2-CB 4.48Å; L183-A648 HydrophobicContact CD1-CB 4.1Å; L183-A648 HydrophobicContact CD2-CB 4.08Å; P646-A648 PolarHBondContact O-N 2.77Å; A648-I650 PolarHBondContact O-N 3.38Å
649	N	51.4	Low	51.3	Low	58 Å²	58	57 Å²	57	31%	0.31	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	88.8	166.1	-76.1	-50.6	0	0	0	107.8	L502 D504 R647 K651	L502-N649 HydrophobicContact CB-CB 3.98Å; L502-N649 PolarHBondContact N-O 3.46Å; L502-N649 PolarHBondContact O-N 3.15Å; D504-N649 PolarHBondContact OD2-ND2 2.8Å; D504-N649 VanDerWaalsContact OD2-ND2 3.12Å; R647-N649 PolarHBondContact O-N 2.63Å; R647-N649 VanDerWaalsContact O-N 3.17Å; N649-K651 PolarHBondContact O-N 2.8Å
650	I	51.2	Low	50.1	Low	2 Å²	2	60.3 Å²	60.3	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	107.7	169.1	-60.8	-164.1	0	0	0	107.7	S152 I155 F164 L178 V499 I501 A648 L652	S152-I650 VanDerWaalsContact CA-O 3.31Å; S152-I650 WeakPolarHBondContact CA-O 3.34Å; I155-I650 HydrophobicContact CD1-CB 4.43Å; I155-I650 HydrophobicContact CD1-CD1 3.48Å; I155-I650 VanDerWaalsContact CD1-CD1 3.48Å; I155-I650 HydrophobicContact CD1-CG1 3.6Å; F164-I650 HydrophobicContact CE2-CG2 4.13Å; F164-I650 HydrophobicContact CZ-CB 4.26Å; F164-I650 HydrophobicContact CZ-CD1 4.45Å; F164-I650 HydrophobicContact CZ-CG2 3.83Å; L178-I650 HydrophobicContact CD1-CD1 3.72Å; L178-I650 HydrophobicContact CD2-CD1 3.67Å; L178-I650 HydrophobicContact CG-CD1 4.22Å; V499-I650 HydrophobicContact CG1-CG2 4.33Å; I501-I650 HydrophobicContact CB-CG1 4.49Å; I501-I650 HydrophobicContact CD1-CD1 4.01Å; I501-I650 HydrophobicContact CD1-CG1 4.42Å; I501-I650 HydrophobicContact CG1-CD1 4.15Å; I501-I650 HydrophobicContact CG1-CG1 4.04Å; I501-I650 HydrophobicContact CG2-CG1 4.15Å; A648-I650 PolarHBondContact O-N 3.38Å; I650-L652 HydrophobicContact CG2-CG 4.49Å
651	K	49	Very low	49.2	Very low	86 Å²	86	62 Å²	62	37%	0.374	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	92.3	177.1	-176	-169.7	176.3	-168.4	0	108.6	E500 N649 S653	E500-K651 HydrophobicContact CB-CB 4.3Å; E500-K651 PolarHBondContact N-O 3.4Å; E500-K651 VanDerWaalsContact N-O 3.16Å; E500-K651 PolarHBondContact O-N 2.9Å; E500-K651 IonicContact OE2-NZ 3.59Å; N649-K651 PolarHBondContact O-N 2.8Å; K651-S653 PolarHBondContact O-N 3.2Å
652	L	47.9	Very low	48.3	Very low	15 Å²	15	62.8 Å²	62.8	8%	0.079	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	115	161.5	-67.8	-176.5	0	0	0	108.4	Q151 F164 L497 V499 I650	Q151-L652 HydrophobicContact CB-CD1 4.26Å; F164-L652 HydrophobicContact CB-CD1 3.41Å; F164-L652 VanDerWaalsContact CB-CD1 3.41Å; F164-L652 HydrophobicContact CD1-CD1 3.64Å; F164-L652 HydrophobicContact CD2-CD1 3.92Å; F164-L652 HydrophobicContact CE1-CD1 4.31Å; F164-L652 HydrophobicContact CG-CD1 3.38Å; F164-L652 HydrophobicContact CG-CG 4.44Å; L497-L652 HydrophobicContact CD2-CD2 4.3Å; V499-L652 HydrophobicContact CB-CD2 4.21Å; V499-L652 HydrophobicContact CG1-CD2 3.94Å; V499-L652 HydrophobicContact CG2-CD2 3.69Å; I650-L652 HydrophobicContact CG2-CG 4.49Å
653	S	45.1	Very low	47.8	Very low	6 Å²	6	57.1 Å²	57.1	4%	0.042	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	98.6	-177.7	55.8	0	0	0	0	111	N498 K651 N655	N498-S653 WeakPolarHBondContact CB-O 3.37Å; N498-S653 PolarHBondContact N-O 3.12Å; N498-S653 PolarHBondContact ND2-OG 3.32Å; N498-S653 PolarHBondContact O-N 3.17Å; N498-S653 PolarHBondContact O-OG 3.38Å; K651-S653 PolarHBondContact O-N 3.2Å; S653-N655 PolarHBondContact O-N 2.81Å
654	G	43.5	Very low	48	Very low	73 Å²	73	57.6 Å²	57.6	75%	0.753	31%	0.312	S	S	*	.			trans	-73.5	47	162.3	0	0	0	0	0	111.5
655	N	41.7	Very low	48.1	Very low	72 Å²	72	58 Å²	58	39%	0.385	31%	0.314	S	S	.	.			trans	-129	21.8	-161.9	-151.3	-4.2	0	0	0	113.2	S653	S653-N655 PolarHBondContact O-N 2.81Å
656	H	40.5	Very low	48	Very low	112 Å²	112	59.5 Å²	59.5	52%	0.519	32%	0.322	S	S	.	.			trans	-115	117.4	158.5	-75.9	-59.9	0	0	0	107.4	K491 V658	K491-H656 PolarHBondContact NZ-NE2 3.47Å; H656-V658 PolarHBondContact O-N 3.02Å
657	S	36.8	Very low	48	Very low	22 Å²	22	68.1 Å²	68.1	15%	0.154	36%	0.361	C	S	.	.			trans	-60	108.6	150.8	26.1	0	0	0	0	107.3	L659 R660 Y724 D742	S657-L659 PolarHBondContact O-N 3.49Å; S657-R660 PolarHBondContact O-N 3.03Å; S657-Y724 PolarHBondContact OG-OH 3.18Å; S657-D742 WeakPolarHBondContact CB-OD2 3.48Å; S657-D742 PolarHBondContact OG-OD1 3.36Å; S657-D742 PolarHBondContact OG-OD2 3.25Å
658	V	42	Very low	47.9	Very low	63 Å²	63	69.8 Å²	69.8	38%	0.382	38%	0.379	S	S	.	.	H	α-helix	trans	-47.3	-34.7	169.8	-162.4	0	0	0	0	110.2	N495 H656 R660 S661 I662	N495-V658 WeakPolarHBondContact O-CG2 3.32Å; H656-V658 PolarHBondContact O-N 3.02Å; V658-R660 PolarHBondContact O-N 3.33Å; V658-S661 PolarHBondContact O-OG 3.18Å; V658-S661 VanDerWaalsContact O-OG 3.14Å; V658-I662 HydrophobicContact CG1-CD1 3.95Å; V658-I662 WeakPolarHBondContact O-CG1 3.48Å; V658-I662 PolarHBondContact O-N 2.88Å
659	L	46.8	Very low	47.6	Very low	75 Å²	75	73.8 Å²	73.8	39%	0.393	40%	0.396	S	S	.	.	H	α-helix	trans	-56	-41.8	174.3	-52.4	169.2	0	0	0	113.6	S657 S661 I662 F663 V744	S657-L659 PolarHBondContact O-N 3.49Å; L659-S661 PolarHBondContact O-N 2.9Å; L659-I662 PolarHBondContact O-N 2.89Å; L659-F663 HydrophobicContact CB-CD2 4.14Å; L659-F663 HydrophobicContact CB-CE2 4.28Å; L659-F663 HydrophobicContact CD2-CE2 4.13Å; L659-F663 WeakPolarHBondContact O-CD2 3.21Å; L659-F663 PolarHBondContact O-N 2.79Å; L659-V744 HydrophobicContact CB-CG2 3.81Å; L659-V744 HydrophobicContact CD1-CB 4.44Å; L659-V744 HydrophobicContact CD1-CG2 3.7Å; L659-V744 HydrophobicContact CG-CG2 4.24Å
660	R	46.9	Very low	47.1	Very low	79 Å²	79	75.2 Å²	75.2	30%	0.298	41%	0.409	S	S	.	.	H	α-helix	trans	-61.1	-45.9	-175.6	-173.7	177.4	-175.9	157.4	5.2	111.9	S657 V658 I662 F663 C664 Y724 E799	S657-R660 PolarHBondContact O-N 3.03Å; V658-R660 PolarHBondContact O-N 3.33Å; R660-I662 VanDerWaalsContact C-N 3.3Å; R660-I662 PolarHBondContact O-N 3.02Å; R660-F663 PolarHBondContact O-N 2.98Å; R660-C664 WeakPolarHBondContact O-CB 3.44Å; R660-C664 PolarHBondContact O-N 2.7Å; R660-Y724 HydrophobicContact CB-CD1 4.44Å; R660-Y724 HydrophobicContact CB-CD2 4.38Å; R660-Y724 HydrophobicContact CB-CE1 3.95Å; R660-Y724 HydrophobicContact CB-CE2 3.88Å; R660-Y724 VanDerWaalsContact CD-CE1 3.48Å; R660-Y724 HydrophobicContact CG-CD1 3.95Å; R660-Y724 HydrophobicContact CG-CE1 3.47Å; R660-Y724 VanDerWaalsContact CG-CE1 3.47Å; R660-Y724 HydrophobicContact CG-CE2 4.34Å; R660-E799 PolarHBondContact NH2-O 2.85Å
661	S	50.2	Low	46.5	Very low	64 Å²	64	79 Å²	79	45%	0.448	44%	0.44	S	S	.	.	H	α-helix	trans	-73.8	-19.7	176.4	46.7	0	0	0	0	113.4	V658 L659 N665	V658-S661 PolarHBondContact O-OG 3.18Å; V658-S661 VanDerWaalsContact O-OG 3.14Å; L659-S661 PolarHBondContact O-N 2.9Å; S661-N665 VanDerWaalsContact O-CB 3.23Å; S661-N665 WeakPolarHBondContact O-CB 3.33Å; S661-N665 VanDerWaalsContact O-CG 3.23Å
662	I	52.4	Low	45.8	Very low	97 Å²	97	81.8 Å²	81.8	50%	0.497	46%	0.459	S	S	.	.	H	α-helix	trans	-78.3	-37.8	173.1	-72.1	170.2	0	0	0	111.1	V658 L659 R660	V658-I662 HydrophobicContact CG1-CD1 3.95Å; V658-I662 WeakPolarHBondContact O-CG1 3.48Å; V658-I662 PolarHBondContact O-N 2.88Å; L659-I662 PolarHBondContact O-N 2.89Å; R660-I662 VanDerWaalsContact C-N 3.3Å; R660-I662 PolarHBondContact O-N 3.02Å
663	F	54.2	Low	45.3	Very low	39 Å²	39	86.1 Å²	86.1	17%	0.171	48%	0.478	C	S	.	.	H	α-helix	trans	-88.9	-45.2	-178.5	-71.6	-70.7	0	0	0	113.6	L659 R660 F669 V744 L746	L659-F663 HydrophobicContact CB-CD2 4.14Å; L659-F663 HydrophobicContact CB-CE2 4.28Å; L659-F663 HydrophobicContact CD2-CE2 4.13Å; L659-F663 WeakPolarHBondContact O-CD2 3.21Å; L659-F663 PolarHBondContact O-N 2.79Å; R660-F663 PolarHBondContact O-N 2.98Å; F663-F669 VanDerWaalsContact O-CD2 3.27Å; F663-F669 WeakPolarHBondContact O-CD2 3.36Å; F663-F669 WeakPolarHBondContact O-CE2 3.35Å; F663-V744 HydrophobicContact CD2-CG1 4.15Å; F663-V744 HydrophobicContact CD2-CG2 4.19Å; F663-V744 HydrophobicContact CE2-CG1 3.72Å; F663-V744 HydrophobicContact CE2-CG2 4.25Å; F663-V744 HydrophobicContact CZ-CG1 4.06Å; F663-L746 HydrophobicContact CE1-CD2 3.99Å; F663-L746 HydrophobicContact CE2-CD2 4.38Å; F663-L746 HydrophobicContact CZ-CD2 3.55Å
664	C	59.9	Low	44.7	Very low	36 Å²	36	94.1 Å²	94.1	24%	0.243	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-9.5	-174.8	-55.9	0	0	0	0	115.2	R660 C800	R660-C664 WeakPolarHBondContact O-CB 3.44Å; R660-C664 PolarHBondContact O-N 2.7Å; C664-C800 HydrophobicContact CB-CB 3.89Å; C664-C800 WeakPolarHBondContact CB-SG 3.19Å; C664-C800 WeakPolarHBondContact SG-CB 3.49Å; C664-C800 CovalentContact SG-SG 2.05Å; C664-C800 PolarHBondContact SG-SG 3.36Å
665	N	54.6	Low	44.3	Very low	123 Å²	123	94.5 Å²	94.5	66%	0.658	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-4.5	-178.9	-73	14.2	0	0	0	114.5	S661 E667	S661-N665 VanDerWaalsContact O-CB 3.23Å; S661-N665 WeakPolarHBondContact O-CB 3.33Å; S661-N665 VanDerWaalsContact O-CG 3.23Å; N665-E667 PolarHBondContact O-N 2.66Å
666	N	49.3	Very low	43.9	Very low	97 Å²	97	96.3 Å²	96.3	52%	0.519	50%	0.502	S	S	.	.			trans	-80.6	115.7	177.4	-93.3	-34.6	0	0	0	110.4	N668 F669	N666-N668 PolarHBondContact O-N 3.26Å; N666-F669 HydrophobicContact CB-CD2 4.21Å; N666-F669 PolarHBondContact O-N 2.99Å; N666-F669 VanDerWaalsContact O-N 3.08Å
667	E	49.4	Very low	43.5	Very low	196 Å²	196	93.9 Å²	93.9	92%	0.916	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-13.3	175.6	-60.4	-175.6	145.3	0	0	113.7	N665 F669	N665-E667 PolarHBondContact O-N 2.66Å; E667-F669 VanDerWaalsContact C-N 3.32Å; E667-F669 PolarHBondContact O-N 3.38Å
668	N	43.3	Very low	43.3	Very low	151 Å²	151	97.2 Å²	97.2	81%	0.807	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	3	176	-65.2	-41	0	0	0	114.8	N666	N666-N668 PolarHBondContact O-N 3.26Å
669	F	43.4	Very low	43	Very low	84 Å²	84	99.7 Å²	99.7	37%	0.368	53%	0.526	S	S	.	.	S	Bend	trans	-78.3	127.1	176.7	-104.6	-89	0	0	0	112.2	F663 N666 E667 A671 P722	F663-F669 VanDerWaalsContact O-CD2 3.27Å; F663-F669 WeakPolarHBondContact O-CD2 3.36Å; F663-F669 WeakPolarHBondContact O-CE2 3.35Å; N666-F669 HydrophobicContact CB-CD2 4.21Å; N666-F669 PolarHBondContact O-N 2.99Å; N666-F669 VanDerWaalsContact O-N 3.08Å; E667-F669 VanDerWaalsContact C-N 3.32Å; E667-F669 PolarHBondContact O-N 3.38Å; F669-A671 PolarHBondContact O-N 3.26Å; F669-P722 HydrophobicContact CZ-CG 4.48Å
670	P	40.3	Very low	42.5	Very low	88 Å²	88	104.5 Å²	104.5	57%	0.571	55%	0.546	S	S	*	.			trans	-77.7	111.3	-174.6	29.4	-34.4	0	0	0	112.5	N672	P670-N672 PolarHBondContact O-N 3.14Å
671	A	38.8	Very low	41.8	Very low	80 Å²	80	104.2 Å²	104.2	66%	0.661	57%	0.567	S	S	*	*			trans	-68.8	40	-173.5	0	0	0	0	0	116.7	F669	F669-A671 PolarHBondContact O-N 3.26Å
672	N	34.8	Very low	41	Very low	145 Å²	145	110.7 Å²	110.7	78%	0.775	59%	0.587	S	S	*	*			trans	-104.5	0.5	-172.2	-78.1	-33.6	0	0	0	115	P670 K674	P670-N672 PolarHBondContact O-N 3.14Å; N672-K674 PolarHBondContact O-N 3.47Å; N672-K674 VanDerWaalsContact O-N 3.16Å
673	F	37.5	Very low	40.2	Very low	107 Å²	107	111.2 Å²	111.2	47%	0.469	60%	0.6	S	S	.	*			trans	-81.7	91.1	176.3	-90	-99.4	0	0	0	111.8
674	K	33.2	Very low	39.1	Very low	174 Å²	174	117.2 Å²	117.2	76%	0.757	63%	0.633	S	S	*	*			trans	-102.8	103.5	172.6	-91	175.6	-178.7	159.6	0	112.3	N672	N672-K674 PolarHBondContact O-N 3.47Å; N672-K674 VanDerWaalsContact O-N 3.16Å
675	L	33.8	Very low	38.1	Very low	81 Å²	81	118.2 Å²	118.2	42%	0.424	65%	0.65	S	S	.	*			trans	-69.7	129.4	176.5	-137.7	156.4	0	0	0	110.9	A802 V804	L675-A802 HydrophobicContact CB-CB 4.49Å; L675-V804 HydrophobicContact CD1-CG2 3.49Å; L675-V804 VanDerWaalsContact CD1-CG2 3.49Å; L675-V804 HydrophobicContact CD2-CG2 3.74Å; L675-V804 HydrophobicContact CG-CG2 4.16Å
676	H	34.9	Very low	37.3	Very low	109 Å²	109	119.1 Å²	119.1	51%	0.505	65%	0.65	S	S	.	*			trans	-131.5	126.2	-176.8	-99.4	-87.7	0	0	0	109.6	R691	H676-R691 VanDerWaalsContact CB-NH1 3.3Å; H676-R691 WeakPolarHBondContact O-CB 3.14Å; H676-R691 WeakPolarHBondContact O-CD 3.46Å
677	T	31	Very low	36.7	Very low	62 Å²	62	119.2 Å²	119.2	38%	0.38	65%	0.646	S	S	.	*			trans	-94.8	132.9	176.4	47.7	0	0	0	0	111.7	I834	T677-I834 HydrophobicContact CG2-CG2 4.12Å
678	I	32.2	Very low	36.1	Very low	92 Å²	92	117.5 Å²	117.5	47%	0.472	63%	0.631	S	S	.	*			trans	-132.1	137.3	169.5	-58.8	176.5	0	0	0	106.9
679	T	36.5	Very low	35.9	Very low	115 Å²	115	112.2 Å²	112.2	71%	0.706	60%	0.602	S	S	*	*			trans	-118.8	103.9	-178.1	52.2	0	0	0	0	111.2	I834	T679-I834 HydrophobicContact CG2-CD1 4.26Å
680	E	36.7	Very low	35.5	Very low	176 Å²	176	112 Å²	112	82%	0.822	61%	0.608	S	S	*	*			trans	-94.2	126.8	169.6	-66.1	-174.5	161.5	0	0	110
681	G	31.1	Very low	35.2	Very low	72 Å²	72	114.2 Å²	114.2	74%	0.742	61%	0.605	S	S	*	*			trans	-114	109.9	-174.7	0	0	0	0	0	113.6
682	K	32.9	Very low	35.3	Very low	200 Å²	200	120.2 Å²	120.2	87%	0.87	62%	0.616	S	S	*	*			trans	-167.3	151.2	161.7	-103.3	147.3	-174.7	177.7	0	111.3
683	S	36.9	Very low	36.3	Very low	109 Å²	109	114.6 Å²	114.6	76%	0.762	59%	0.587	S	S	*	*	S	Bend	trans	72.4	167.3	177.6	81.4	0	0	0	0	117.4
684	L	30.6	Very low	37.1	Very low	164 Å²	164	111 Å²	111	86%	0.859	57%	0.572	S	S	*	*	S	Bend	trans	-82.8	144.7	-167.5	-86.9	63.8	0	0	0	112.8	Q686	L684-Q686 PolarHBondContact O-N 3.46Å
685	G	38.9	Very low	38.3	Very low	58 Å²	58	105.2 Å²	105.2	60%	0.598	55%	0.548	S	S	*	.	S	Bend	trans	73.5	-16	153.7	0	0	0	0	0	118.1
686	Q	36.9	Very low	39.6	Very low	141 Å²	141	102 Å²	102	66%	0.659	53%	0.532	S	S	*	.			trans	-111.5	109.3	177	-72.2	-175.6	-39.2	0	0	111.5	L684 R688	L684-Q686 PolarHBondContact O-N 3.46Å; Q686-R688 PolarHBondContact O-N 3.29Å
687	F	38.5	Very low	40.9	Very low	100 Å²	100	98.8 Å²	98.8	44%	0.439	52%	0.522	S	S	.	.			trans	-90.1	90.8	169.4	-69.5	-80.1	0	0	0	109.5	V832	F687-V832 HydrophobicContact CD1-CB 4.11Å; F687-V832 HydrophobicContact CD1-CG2 4.34Å; F687-V832 HydrophobicContact CD2-CG2 3.92Å; F687-V832 HydrophobicContact CE1-CB 3.9Å; F687-V832 HydrophobicContact CE1-CG2 4.03Å; F687-V832 HydrophobicContact CE2-CB 4.33Å; F687-V832 HydrophobicContact CE2-CG2 3.57Å; F687-V832 HydrophobicContact CG-CB 4.41Å; F687-V832 HydrophobicContact CG-CG2 4.29Å; F687-V832 HydrophobicContact CZ-CB 4.02Å; F687-V832 HydrophobicContact CZ-CG2 3.63Å
688	R	35.6	Very low	42.4	Very low	159 Å²	159	97.6 Å²	97.6	60%	0.6	52%	0.515	S	S	*	.			trans	-80.1	123.1	-178.5	-123.2	178.7	-178.6	171.6	2.4	111.6	Q686 T690 E695	Q686-R688 PolarHBondContact O-N 3.29Å; R688-T690 HydrophobicContact CB-CG2 4.2Å; R688-T690 HydrophobicContact CG-CG2 3.93Å; R688-E695 WeakPolarHBondContact CG-OE1 3.46Å; R688-E695 IonicContact CZ-OE1 3.56Å; R688-E695 IonicContact NE-OE1 3.09Å; R688-E695 PolarHBondContact NE-OE1 3.04Å; R688-E695 IonicContact NH2-OE1 2.94Å; R688-E695 PolarHBondContact NH2-OE1 2.78Å; R688-E695 IonicContact NH2-OE2 3.71Å
689	I	38.6	Very low	44.1	Very low	41 Å²	41	99.5 Å²	99.5	21%	0.21	52%	0.52	C	S	.	.			trans	-109.1	91.7	178.8	-52	172.3	0	0	0	107.5	A696 L806 I834	I689-A696 HydrophobicContact CD1-CB 4.38Å; I689-L806 HydrophobicContact CD1-CD1 3.41Å; I689-L806 VanDerWaalsContact CD1-CD1 3.41Å; I689-L806 HydrophobicContact CD1-CD2 3.39Å; I689-L806 HydrophobicContact CD1-CG 3.92Å; I689-I834 HydrophobicContact CG1-CD1 4.43Å
690	T	37	Very low	45.4	Very low	78 Å²	78	98.8 Å²	98.8	48%	0.479	51%	0.507	S	S	.	.			trans	-111.2	78.7	-163.8	41.3	0	0	0	0	113.4	R688	R688-T690 HydrophobicContact CB-CG2 4.2Å; R688-T690 HydrophobicContact CG-CG2 3.93Å
691	R	32.3	Very low	46.8	Very low	135 Å²	135	92.1 Å²	92.1	51%	0.509	48%	0.482	S	S	.	.	S	Bend	trans	-139.8	108.4	148.1	-107.7	-179.2	-174.3	-155.3	3.1	110.4	H676	H676-R691 VanDerWaalsContact CB-NH1 3.3Å; H676-R691 WeakPolarHBondContact O-CB 3.14Å; H676-R691 WeakPolarHBondContact O-CD 3.46Å
692	K	42.2	Very low	48.2	Very low	206 Å²	206	93.5 Å²	93.5	90%	0.896	48%	0.477	S	S	*	.	S	Bend	trans	14.2	117.7	172.7	-63.2	-176.6	179.1	-178.4	0	116.7
693	V	54.9	Low	49.4	Very low	27 Å²	27	86.1 Å²	86.1	16%	0.164	45%	0.447	C	S	.	.	S	Bend	trans	119.5	-32	165.2	178.4	0	0	0	0	113.8	G716 Y717 V718 I725	V693-G716 CarbonylContact O-C 3.48Å; V693-G716 WeakPolarHBondContact O-CA 3.34Å; V693-Y717 WeakPolarHBondContact CG2-O 3.43Å; V693-Y717 PolarHBondContact O-N 2.8Å; V693-V718 HydrophobicContact CG1-CG2 4.23Å; V693-I725 HydrophobicContact CG1-CD1 4.31Å
694	I	55.1	Low	50.6	Low	33 Å²	33	87.1 Å²	87.1	17%	0.169	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	137	-178.4	-43.9	178	0	0	0	112	V714 T715 I725 F727 F763 I797	I694-V714 HydrophobicContact CG2-CG1 3.71Å; I694-T715 CarbonylContact C-O 3.36Å; I694-T715 WeakPolarHBondContact CA-O 3.27Å; I694-T715 WeakPolarHBondContact CG2-O 2.95Å; I694-I725 HydrophobicContact CD1-CG2 4.19Å; I694-F727 HydrophobicContact CD1-CE1 4.03Å; I694-F727 HydrophobicContact CD1-CZ 3.91Å; I694-F727 HydrophobicContact CG2-CE1 4.24Å; I694-F763 HydrophobicContact CG1-CZ 4.28Å; I694-I797 HydrophobicContact CD1-CD1 4Å; I694-I797 HydrophobicContact CD1-CG2 3.76Å; I694-I797 HydrophobicContact CG2-CD1 4.25Å
695	E	58.2	Low	51.5	Low	52 Å²	52	85.9 Å²	85.9	24%	0.243	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.7	172.3	174.4	168.7	-142.1	0	0	108.9	R688 T715	R688-E695 WeakPolarHBondContact CG-OE1 3.46Å; R688-E695 IonicContact CZ-OE1 3.56Å; R688-E695 IonicContact NE-OE1 3.09Å; R688-E695 PolarHBondContact NE-OE1 3.04Å; R688-E695 IonicContact NH2-OE1 2.94Å; R688-E695 PolarHBondContact NH2-OE1 2.78Å; R688-E695 IonicContact NH2-OE2 3.71Å; E695-T715 PolarHBondContact N-O 3.33Å; E695-T715 PolarHBondContact O-N 2.96Å; E695-T715 VanDerWaalsContact O-O 3.06Å; E695-T715 PolarHBondContact O-OG1 3.01Å; E695-T715 VanDerWaalsContact O-OG1 3.05Å
696	A	60.1	Low	52.3	Low	12 Å²	12	85.8 Å²	85.8	10%	0.099	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	141.2	-179.9	0	0	0	0	0	111.3	I689 F713 V714	I689-A696 HydrophobicContact CD1-CB 4.38Å; A696-F713 CarbonylContact C-O 3.57Å; A696-F713 VanDerWaalsContact CA-O 3.27Å; A696-F713 WeakPolarHBondContact CA-O 3.17Å; A696-V714 HydrophobicContact CB-CG2 4.18Å
697	S	63.6	Low	53.2	Low	42 Å²	42	81.6 Å²	81.6	29%	0.294	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	157.3	178.5	68.5	0	0	0	0	112.4	I712 F713	S697-I712 WeakPolarHBondContact O-CA 3.08Å; S697-F713 PolarHBondContact N-O 2.92Å; S697-F713 PolarHBondContact O-N 2.72Å
698	V	61.4	Low	54.1	Low	38 Å²	38	80.3 Å²	80.3	23%	0.23	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.9	-173.2	-176.9	0	0	0	0	109.5	L710 H711 I712 I808	V698-L710 HydrophobicContact CG1-CD1 3.47Å; V698-L710 VanDerWaalsContact CG1-CD1 3.47Å; V698-L710 HydrophobicContact CG1-CG 4.19Å; V698-H711 CarbonylContact C-O 3.52Å; V698-H711 WeakPolarHBondContact CA-O 3.48Å; V698-I712 HydrophobicContact CG1-CG1 4.5Å; V698-I712 HydrophobicContact CG2-CG1 4.42Å; V698-I712 HydrophobicContact CG2-CG2 4.36Å; V698-I808 HydrophobicContact CG2-CD1 3.87Å
699	K	68.1	Low	55.4	Low	132 Å²	132	73.4 Å²	73.4	57%	0.574	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	126.2	-177.6	-173.2	-178.7	179.6	-175.3	0	110.6	H711 F713	K699-H711 PolarHBondContact N-O 3.04Å; K699-H711 PolarHBondContact O-N 3.06Å; K699-F713 HydrophobicContact CB-CE2 4.07Å
700	F	62.9	Low	56.8	Low	100 Å²	100	71.5 Å²	71.5	44%	0.439	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	137.5	167	-65.5	-101.3	0	0	0	109.1	I709 L710 I771 T810	F700-I709 WeakPolarHBondContact CA-O 3.46Å; F700-L710 HydrophobicContact CD1-CD1 3.87Å; F700-L710 HydrophobicContact CD2-CD1 3.93Å; F700-L710 HydrophobicContact CE1-CD1 3.67Å; F700-L710 HydrophobicContact CE2-CD1 3.72Å; F700-L710 HydrophobicContact CG-CD1 4Å; F700-L710 HydrophobicContact CZ-CD1 3.59Å; F700-I771 HydrophobicContact CD1-CD1 3.85Å; F700-I771 HydrophobicContact CE1-CD1 3.86Å; F700-T810 HydrophobicContact CE1-CG2 4.43Å; F700-T810 HydrophobicContact CZ-CG2 4.31Å
701	A	67.7	Low	58.4	Low	36 Å²	36	69.5 Å²	69.5	30%	0.298	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	144.7	176.4	0	0	0	0	0	110.2	I709	A701-I709 PolarHBondContact N-O 2.92Å; A701-I709 WeakPolarHBondContact O-CA 3.38Å; A701-I709 PolarHBondContact O-N 3.46Å
702	T	60.1	Low	60.2	Low	101 Å²	101	63.1 Å²	63.1	62%	0.62	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.4	169.6	48.6	0	0	0	0	110.1	Q707 E708	T702-Q707 CarbonylContact C-O 3.59Å; T702-Q707 VanDerWaalsContact CA-O 3.31Å; T702-Q707 WeakPolarHBondContact CA-O 3.42Å; T702-E708 HydrophobicContact CG2-CG 4.18Å
703	N	58.5	Low	61.7	Low	45 Å²	45	55.9 Å²	55.9	24%	0.241	32%	0.317	C	S	.	.			trans	-77.2	175.7	171.7	77.9	1.9	0	0	0	112	L705 G706 Q707 I709	N703-L705 PolarHBondContact O-N 3.23Å; N703-L705 VanDerWaalsContact O-N 3.17Å; N703-L705 WeakPolarHBondContact OD1-CA 3.42Å; N703-L705 WeakPolarHBondContact OD1-CB 3.45Å; N703-L705 PolarHBondContact OD1-N 2.86Å; N703-G706 PolarHBondContact O-N 2.99Å; N703-G706 PolarHBondContact OD1-N 3.35Å; N703-Q707 PolarHBondContact N-O 3.3Å; N703-Q707 PolarHBondContact ND2-OE1 3.15Å; N703-Q707 WeakPolarHBondContact OD1-CB 3.4Å; N703-Q707 PolarHBondContact OD1-N 3.18Å; N703-I709 HydrophobicContact CB-CD1 3.79Å; N703-I709 HydrophobicContact CB-CG1 4.43Å
704	S	60.5	Low	62.3	Low	130 Å²	130	54.6 Å²	54.6	91%	0.909	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.2	178.5	47	0	0	0	0	114.7
705	L	50.6	Low	62.9	Low	138 Å²	138	54.7 Å²	54.7	72%	0.723	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	4.6	175.2	-66.1	162.9	0	0	0	112.5	N703 Q707	N703-L705 PolarHBondContact O-N 3.23Å; N703-L705 VanDerWaalsContact O-N 3.17Å; N703-L705 WeakPolarHBondContact OD1-CA 3.42Å; N703-L705 WeakPolarHBondContact OD1-CB 3.45Å; N703-L705 PolarHBondContact OD1-N 2.86Å; L705-Q707 VanDerWaalsContact C-N 3.29Å; L705-Q707 HydrophobicContact CB-CG 4.22Å; L705-Q707 PolarHBondContact O-N 3.37Å
706	G	55.9	Low	63.1	Low	56 Å²	56	52.2 Å²	52.2	58%	0.577	30%	0.299	S	S	*	.	S	Bend	trans	75.6	12.4	-178.2	0	0	0	0	0	114.5	N703	N703-G706 PolarHBondContact O-N 2.99Å; N703-G706 PolarHBondContact OD1-N 3.35Å
707	Q	54.5	Low	63	Low	53 Å²	53	57.2 Å²	57.2	25%	0.248	32%	0.317	C	S	.	.			trans	-82.1	136.7	176.5	-52.9	171	-84.9	0	0	110.3	T702 N703 L705 D770 N772	T702-Q707 CarbonylContact C-O 3.59Å; T702-Q707 VanDerWaalsContact CA-O 3.31Å; T702-Q707 WeakPolarHBondContact CA-O 3.42Å; N703-Q707 PolarHBondContact N-O 3.3Å; N703-Q707 PolarHBondContact ND2-OE1 3.15Å; N703-Q707 WeakPolarHBondContact OD1-CB 3.4Å; N703-Q707 PolarHBondContact OD1-N 3.18Å; L705-Q707 VanDerWaalsContact C-N 3.29Å; L705-Q707 HydrophobicContact CB-CG 4.22Å; L705-Q707 PolarHBondContact O-N 3.37Å; Q707-D770 PolarHBondContact NE2-OD2 3.29Å; Q707-D770 VanDerWaalsContact NE2-OD2 3.16Å; Q707-N772 WeakPolarHBondContact CA-ND2 3.49Å; Q707-N772 WeakPolarHBondContact CB-ND2 3.19Å
708	E	58.8	Low	62.5	Low	73 Å²	73	55.6 Å²	55.6	34%	0.341	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.3	176.5	-63.6	-174.5	178.6	0	0	110.3	T702 I771 F813	T702-E708 HydrophobicContact CG2-CG 4.18Å; E708-I771 HydrophobicContact CB-CB 4.34Å; E708-I771 HydrophobicContact CB-CD1 4.08Å; E708-I771 WeakPolarHBondContact O-CB 3.38Å; E708-I771 WeakPolarHBondContact O-CG1 3.15Å; E708-I771 PolarHBondContact O-N 2.87Å; E708-F813 WeakPolarHBondContact OE2-CZ 3.48Å
709	I	62.9	Low	61.8	Low	13 Å²	13	57.7 Å²	57.7	7%	0.067	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.6	-178.5	-60.1	-169.8	0	0	0	109.4	F700 A701 N703 Q768 I769	F700-I709 WeakPolarHBondContact CA-O 3.46Å; A701-I709 PolarHBondContact N-O 2.92Å; A701-I709 WeakPolarHBondContact O-CA 3.38Å; A701-I709 PolarHBondContact O-N 3.46Å; N703-I709 HydrophobicContact CB-CD1 3.79Å; N703-I709 HydrophobicContact CB-CG1 4.43Å; I709-Q768 HydrophobicContact CG2-CG 3.47Å; I709-Q768 VanDerWaalsContact CG2-CG 3.47Å; I709-I769 WeakPolarHBondContact CA-O 3.18Å
710	L	67.2	Low	60.6	Low	2 Å²	2	54 Å²	54	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.8	169.4	-170.6	69.8	0	0	0	109.9	V698 F700 I712 I769 I771 F793	V698-L710 HydrophobicContact CG1-CD1 3.47Å; V698-L710 VanDerWaalsContact CG1-CD1 3.47Å; V698-L710 HydrophobicContact CG1-CG 4.19Å; F700-L710 HydrophobicContact CD1-CD1 3.87Å; F700-L710 HydrophobicContact CD2-CD1 3.93Å; F700-L710 HydrophobicContact CE1-CD1 3.67Å; F700-L710 HydrophobicContact CE2-CD1 3.72Å; F700-L710 HydrophobicContact CG-CD1 4Å; F700-L710 HydrophobicContact CZ-CD1 3.59Å; L710-I712 HydrophobicContact CD2-CD1 4.2Å; L710-I712 HydrophobicContact CD2-CG1 4.18Å; L710-I712 HydrophobicContact CG-CG1 4.28Å; L710-I769 HydrophobicContact CB-CB 4.41Å; L710-I769 PolarHBondContact N-O 3.48Å; L710-I769 PolarHBondContact O-N 3.39Å; L710-I771 HydrophobicContact CB-CD1 4.34Å; L710-I771 HydrophobicContact CB-CG1 4.36Å; L710-F793 HydrophobicContact CD2-CD2 3.71Å; L710-F793 HydrophobicContact CD2-CE2 3.44Å; L710-F793 VanDerWaalsContact CD2-CE2 3.44Å
711	H	71.7	Confident	59.9	Low	35 Å²	35	52.4 Å²	52.4	16%	0.162	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	129	166.8	-64.7	-97.5	0	0	0	109.9	V698 K699 F713 Y767 Q768	V698-H711 CarbonylContact C-O 3.52Å; V698-H711 WeakPolarHBondContact CA-O 3.48Å; K699-H711 PolarHBondContact N-O 3.04Å; K699-H711 PolarHBondContact O-N 3.06Å; H711-F713 HydrophobicContact CB-CD2 4.31Å; H711-F713 HydrophobicContact CB-CE2 3.55Å; H711-F713 HydrophobicContact CB-CZ 3.7Å; H711-Y767 CarbonylContact C-O 3.54Å; H711-Y767 WeakPolarHBondContact CA-O 3.02Å; H711-Q768 PolarHBondContact CE1-OE1 2.81Å; H711-Q768 VanDerWaalsContact CE1-OE1 3.3Å
712	I	70.4	Confident	59.1	Low	2 Å²	2	52.9 Å²	52.9	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	109.2	171.1	-52.7	172.8	0	0	0	107.1	S697 V698 L710 V714 L729 T766 Y767 I769 F793 I808	S697-I712 WeakPolarHBondContact O-CA 3.08Å; V698-I712 HydrophobicContact CG1-CG1 4.5Å; V698-I712 HydrophobicContact CG2-CG1 4.42Å; V698-I712 HydrophobicContact CG2-CG2 4.36Å; L710-I712 HydrophobicContact CD2-CD1 4.2Å; L710-I712 HydrophobicContact CD2-CG1 4.18Å; L710-I712 HydrophobicContact CG-CG1 4.28Å; I712-V714 HydrophobicContact CG2-CG2 4.36Å; I712-L729 HydrophobicContact CD1-CD1 3.97Å; I712-L729 HydrophobicContact CD1-CD2 4.4Å; I712-T766 WeakPolarHBondContact O-CA 3.49Å; I712-Y767 HydrophobicContact CB-CD2 4.18Å; I712-Y767 HydrophobicContact CG2-CD2 4.27Å; I712-Y767 PolarHBondContact N-O 3.49Å; I712-Y767 PolarHBondContact O-N 2.99Å; I712-I769 HydrophobicContact CD1-CD1 4.16Å; I712-F793 HydrophobicContact CD1-CD2 4.36Å; I712-I808 HydrophobicContact CD1-CD1 4.1Å
713	F	72.1	Confident	58.8	Low	54 Å²	54	49.2 Å²	49.2	24%	0.237	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	134.2	177	-55.5	-86.9	0	0	0	109.4	A696 S697 K699 H711 T766	A696-F713 CarbonylContact C-O 3.57Å; A696-F713 VanDerWaalsContact CA-O 3.27Å; A696-F713 WeakPolarHBondContact CA-O 3.17Å; S697-F713 PolarHBondContact N-O 2.92Å; S697-F713 PolarHBondContact O-N 2.72Å; K699-F713 HydrophobicContact CB-CE2 4.07Å; H711-F713 HydrophobicContact CB-CD2 4.31Å; H711-F713 HydrophobicContact CB-CE2 3.55Å; H711-F713 HydrophobicContact CB-CZ 3.7Å; F713-T766 HydrophobicContact CD1-CG2 3.58Å; F713-T766 WeakPolarHBondContact CD1-OG1 3.48Å; F713-T766 HydrophobicContact CE1-CG2 3.49Å; F713-T766 VanDerWaalsContact CE1-CG2 3.49Å; F713-T766 HydrophobicContact CG-CG2 4.48Å; F713-T766 HydrophobicContact CZ-CG2 4.34Å
714	V	68.8	Low	58.9	Low	0 Å²	0	47.7 Å²	47.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	98.3	174.2	-175.1	0	0	0	0	108.2	I694 A696 I712 F727 L765 Y767 L795	I694-V714 HydrophobicContact CG2-CG1 3.71Å; A696-V714 HydrophobicContact CB-CG2 4.18Å; I712-V714 HydrophobicContact CG2-CG2 4.36Å; V714-F727 HydrophobicContact CG1-CD1 4.08Å; V714-F727 HydrophobicContact CG1-CE1 3.58Å; V714-F727 HydrophobicContact CG1-CZ 4.26Å; V714-L765 HydrophobicContact CB-CB 4.3Å; V714-L765 PolarHBondContact N-O 3.5Å; V714-L765 PolarHBondContact O-N 3.48Å; V714-Y767 HydrophobicContact CG2-CE2 4.31Å; V714-L795 HydrophobicContact CG2-CD2 3.9Å
715	T	68.3	Low	59.1	Low	34 Å²	34	41.5 Å²	41.5	21%	0.209	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	151.3	175.3	40.9	0	0	0	0	110.6	I694 E695 F763 Q764	I694-T715 CarbonylContact C-O 3.36Å; I694-T715 WeakPolarHBondContact CA-O 3.27Å; I694-T715 WeakPolarHBondContact CG2-O 2.95Å; E695-T715 PolarHBondContact N-O 3.33Å; E695-T715 PolarHBondContact O-N 2.96Å; E695-T715 VanDerWaalsContact O-O 3.06Å; E695-T715 PolarHBondContact O-OG1 3.01Å; E695-T715 VanDerWaalsContact O-OG1 3.05Å; T715-F763 CarbonylContact C-O 3.52Å; T715-F763 WeakPolarHBondContact CA-O 3.37Å; T715-Q764 HydrophobicContact CG2-CB 4.02Å; T715-Q764 HydrophobicContact CG2-CG 3.79Å
716	G	62.4	Low	59.8	Low	0 Å²	0	35 Å²	35	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	171.5	173.8	0	0	0	0	0	114.2	V693 S762 F763	V693-G716 CarbonylContact O-C 3.48Å; V693-G716 WeakPolarHBondContact O-CA 3.34Å; G716-S762 CarbonylContact O-C 3.55Å; G716-S762 WeakPolarHBondContact O-CA 3.43Å; G716-S762 WeakPolarHBondContact O-CB 3.05Å; G716-F763 PolarHBondContact N-O 3.43Å; G716-F763 PolarHBondContact O-N 2.91Å
717	Y	57.2	Low	60.5	Low	118 Å²	118	32.3 Å²	32.3	46%	0.463	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	104.8	-167.4	-61.5	-79.4	0	0	0	110.1	V693 I760	V693-Y717 WeakPolarHBondContact CG2-O 3.43Å; V693-Y717 PolarHBondContact O-N 2.8Å; Y717-I760 HydrophobicContact CD1-CG2 3.9Å; Y717-I760 HydrophobicContact CG-CG2 4.3Å
718	V	51.9	Low	61.4	Low	8 Å²	8	31.5 Å²	31.5	5%	0.048	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.2	180	-177.7	0	0	0	0	110.7	V693 A723 I725 V745 E761 F763	V693-V718 HydrophobicContact CG1-CG2 4.23Å; V718-A723 HydrophobicContact CG1-CB 4.05Å; V718-I725 HydrophobicContact CG2-CD1 4.04Å; V718-V745 HydrophobicContact CB-CB 4.2Å; V718-V745 HydrophobicContact CB-CG1 4.04Å; V718-V745 HydrophobicContact CB-CG2 4Å; V718-V745 HydrophobicContact CG1-CB 3.94Å; V718-V745 HydrophobicContact CG1-CG1 3.86Å; V718-V745 HydrophobicContact CG1-CG2 4.25Å; V718-V745 HydrophobicContact CG2-CB 4.37Å; V718-V745 HydrophobicContact CG2-CG2 3.76Å; V718-E761 PolarHBondContact N-O 2.82Å; V718-E761 PolarHBondContact O-N 3Å; V718-F763 HydrophobicContact CG2-CD1 4.31Å; V718-F763 HydrophobicContact CG2-CE1 3.95Å
719	T	48	Very low	62.1	Low	82 Å²	82	28.2 Å²	28.2	50%	0.503	16%	0.162	S	C	.	.			trans	-125.2	96.2	-170.5	56.2	0	0	0	0	112.6	T721 I760	T719-T721 PolarHBondContact O-N 3.34Å; T719-I760 HydrophobicContact CG2-CG2 4.36Å
720	G	43.1	Very low	62.5	Low	54 Å²	54	28.8 Å²	28.8	56%	0.557	17%	0.165	S	C	*	.	S	Bend	trans	73.6	-33.1	159.2	0	0	0	0	0	118.1
721	T	47.2	Very low	62.5	Low	67 Å²	67	30 Å²	30	41%	0.411	17%	0.17	S	C	.	.	S	Bend	trans	-92.3	134.6	174.4	50.6	0	0	0	0	110.6	T719 A723	T719-T721 PolarHBondContact O-N 3.34Å; T721-A723 PolarHBondContact O-N 2.9Å
722	P	51.6	Low	62.2	Low	45 Å²	45	30.2 Å²	30.2	29%	0.292	17%	0.174	S	C	.	.			trans	-63	128.9	175	27.2	-33.6	0	0	0	109.9	F669 V745	F669-P722 HydrophobicContact CZ-CG 4.48Å; P722-V745 CarbonylContact C-O 3.58Å; P722-V745 WeakPolarHBondContact CA-O 3.35Å
723	A	54	Low	61.5	Low	25 Å²	25	34 Å²	34	21%	0.207	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.8	-170.7	0	0	0	0	0	110.9	V718 T721 V744 V745	V718-A723 HydrophobicContact CG1-CB 4.05Å; T721-A723 PolarHBondContact O-N 2.9Å; A723-V744 WeakPolarHBondContact O-CA 3.34Å; A723-V745 PolarHBondContact N-O 2.88Å; A723-V745 PolarHBondContact O-N 3.41Å
724	Y	59.7	Low	60.9	Low	12 Å²	12	37 Å²	37	5%	0.047	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.4	172.2	166.8	-95.3	0	0	0	109.1	S657 R660 N726 D742 V744	S657-Y724 PolarHBondContact OG-OH 3.18Å; R660-Y724 HydrophobicContact CB-CD1 4.44Å; R660-Y724 HydrophobicContact CB-CD2 4.38Å; R660-Y724 HydrophobicContact CB-CE1 3.95Å; R660-Y724 HydrophobicContact CB-CE2 3.88Å; R660-Y724 VanDerWaalsContact CD-CE1 3.48Å; R660-Y724 HydrophobicContact CG-CD1 3.95Å; R660-Y724 HydrophobicContact CG-CE1 3.47Å; R660-Y724 VanDerWaalsContact CG-CE1 3.47Å; R660-Y724 HydrophobicContact CG-CE2 4.34Å; Y724-N726 HydrophobicContact CE1-CB 4.17Å; Y724-D742 HydrophobicContact CE2-CB 4.06Å; Y724-D742 VanDerWaalsContact CE2-OD1 3.28Å; Y724-D742 WeakPolarHBondContact CE2-OD1 3.11Å; Y724-D742 VanDerWaalsContact CZ-OD1 3.27Å; Y724-D742 PolarHBondContact OH-OD1 3.45Å; Y724-V744 HydrophobicContact CD2-CG2 3.98Å
725	I	64.4	Low	60.5	Low	1 Å²	1	41.8 Å²	41.8	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	121.8	-179.6	-48.5	175.6	0	0	0	108.5	V693 I694 V718 F727 V743 F763 I797	V693-I725 HydrophobicContact CG1-CD1 4.31Å; I694-I725 HydrophobicContact CD1-CG2 4.19Å; V718-I725 HydrophobicContact CG2-CD1 4.04Å; I725-F727 HydrophobicContact CB-CE2 4.14Å; I725-F727 HydrophobicContact CG2-CD2 4.21Å; I725-F727 HydrophobicContact CG2-CE1 4.34Å; I725-F727 HydrophobicContact CG2-CE2 3.5Å; I725-F727 HydrophobicContact CG2-CZ 3.57Å; I725-V743 PolarHBondContact N-O 3.15Å; I725-V743 WeakPolarHBondContact O-CB 3.46Å; I725-V743 PolarHBondContact O-N 2.93Å; I725-F763 HydrophobicContact CD1-CE1 4.15Å; I725-F763 HydrophobicContact CD1-CZ 4.35Å; I725-I797 HydrophobicContact CG2-CG2 3.86Å
726	N	66	Low	59.8	Low	1 Å²	1	44.8 Å²	44.8	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.8	178.6	173.8	-95.8	0	0	0	110.6	Y724 K728 N740 H741 D742 I797 Q798	Y724-N726 HydrophobicContact CE1-CB 4.17Å; N726-K728 WeakPolarHBondContact OD1-CD 3.42Å; N726-K728 VanDerWaalsContact OD1-CE 3.24Å; N726-K728 WeakPolarHBondContact OD1-CE 3.2Å; N726-K728 WeakPolarHBondContact OD1-CG 3.4Å; N726-K728 PolarHBondContact OD1-NZ 2.89Å; N726-N740 PolarHBondContact ND2-OD1 2.91Å; N726-H741 WeakPolarHBondContact CA-O 3.48Å; N726-D742 PolarHBondContact ND2-OD1 3.47Å; N726-I797 CarbonylContact O-C 3.35Å; N726-I797 WeakPolarHBondContact O-CA 3.46Å; N726-Q798 HydrophobicContact CB-CB 4.16Å; N726-Q798 PolarHBondContact N-O 3.19Å; N726-Q798 PolarHBondContact O-N 2.73Å; N726-Q798 PolarHBondContact OD1-OE1 3.2Å
727	F	70.9	Confident	59.7	Low	0 Å²	0	48 Å²	48	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.3	175	-63.4	-87.2	0	0	0	110.6	I694 V714 I725 N740 H741 V743 F763 L765 I797	I694-F727 HydrophobicContact CD1-CE1 4.03Å; I694-F727 HydrophobicContact CD1-CZ 3.91Å; I694-F727 HydrophobicContact CG2-CE1 4.24Å; V714-F727 HydrophobicContact CG1-CD1 4.08Å; V714-F727 HydrophobicContact CG1-CE1 3.58Å; V714-F727 HydrophobicContact CG1-CZ 4.26Å; I725-F727 HydrophobicContact CB-CE2 4.14Å; I725-F727 HydrophobicContact CG2-CD2 4.21Å; I725-F727 HydrophobicContact CG2-CE1 4.34Å; I725-F727 HydrophobicContact CG2-CE2 3.5Å; I725-F727 HydrophobicContact CG2-CZ 3.57Å; F727-N740 CarbonylContact O-C 3.53Å; F727-N740 WeakPolarHBondContact O-CA 3.41Å; F727-H741 HydrophobicContact CB-CB 4.38Å; F727-H741 PolarHBondContact N-O 2.97Å; F727-H741 PolarHBondContact O-N 2.8Å; F727-V743 HydrophobicContact CD2-CG2 4.03Å; F727-V743 HydrophobicContact CE2-CG2 3.99Å; F727-F763 AromaticContact CE2-CE2 3.85Å; F727-F763 HydrophobicContact CE2-CE2 3.85Å; F727-F763 HydrophobicContact CE2-CZ 4.09Å; F727-F763 AromaticContact CZ-CE2 3.52Å; F727-F763 HydrophobicContact CZ-CE2 3.52Å; F727-F763 AromaticContact CZ-CZ 3.66Å; F727-F763 HydrophobicContact CZ-CZ 3.66Å; F727-L765 HydrophobicContact CB-CD1 4.46Å; F727-L765 HydrophobicContact CD2-CD1 3.64Å; F727-L765 HydrophobicContact CE2-CD1 3.98Å; F727-L765 HydrophobicContact CG-CD1 3.98Å; F727-I797 HydrophobicContact CD1-CD1 4.36Å; F727-I797 HydrophobicContact CD1-CG1 3.92Å; F727-I797 HydrophobicContact CD1-CG2 4.3Å; F727-I797 HydrophobicContact CE1-CD1 3.97Å; F727-I797 HydrophobicContact CE1-CG1 3.97Å; F727-I797 HydrophobicContact CE1-CG2 4Å
728	K	72.2	Confident	59.8	Low	35 Å²	35	46.1 Å²	46.1	15%	0.152	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	116	178.4	-77.8	168.2	175.1	124.4	0	111.2	N726 I730 S739 N740 L795 I796	N726-K728 WeakPolarHBondContact OD1-CD 3.42Å; N726-K728 VanDerWaalsContact OD1-CE 3.24Å; N726-K728 WeakPolarHBondContact OD1-CE 3.2Å; N726-K728 WeakPolarHBondContact OD1-CG 3.4Å; N726-K728 PolarHBondContact OD1-NZ 2.89Å; K728-I730 HydrophobicContact CB-CG1 4.44Å; K728-S739 WeakPolarHBondContact CA-O 3.17Å; K728-N740 VanDerWaalsContact CE-OD1 3.31Å; K728-N740 WeakPolarHBondContact CE-OD1 3.47Å; K728-N740 HydrophobicContact CG-CB 4.37Å; K728-N740 VanDerWaalsContact CG-OD1 3.28Å; K728-N740 WeakPolarHBondContact CG-OD1 3.49Å; K728-L795 CarbonylContact O-C 3.55Å; K728-L795 WeakPolarHBondContact O-CA 3.35Å; K728-I796 HydrophobicContact CB-CB 4.34Å; K728-I796 PolarHBondContact N-O 2.81Å; K728-I796 PolarHBondContact O-N 3.08Å
729	L	74.1	Confident	60.3	Low	4 Å²	4	46.7 Å²	46.7	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.8	167.3	-167.8	71.2	0	0	0	109	I712 I737 L738 S739 Y767 I769 F793 L795	I712-L729 HydrophobicContact CD1-CD1 3.97Å; I712-L729 HydrophobicContact CD1-CD2 4.4Å; L729-I737 CarbonylContact O-C 3.59Å; L729-I737 WeakPolarHBondContact O-CA 3.2Å; L729-L738 HydrophobicContact CB-CB 4.33Å; L729-L738 HydrophobicContact CD2-CB 4.2Å; L729-L738 HydrophobicContact CD2-CD1 4.11Å; L729-L738 HydrophobicContact CG-CB 4.35Å; L729-L738 HydrophobicContact CG-CD1 4.17Å; L729-L738 PolarHBondContact O-N 3.28Å; L729-S739 WeakPolarHBondContact CB-OG 3.19Å; L729-S739 PolarHBondContact N-O 3.3Å; L729-S739 PolarHBondContact O-N 3.43Å; L729-Y767 HydrophobicContact CD2-CG 4.5Å; L729-I769 HydrophobicContact CD2-CD1 3.88Å; L729-F793 HydrophobicContact CD1-CB 4.01Å; L729-F793 HydrophobicContact CD1-CG 4.46Å; L729-F793 HydrophobicContact CD2-CD1 4.38Å; L729-F793 HydrophobicContact CG-CD1 4.43Å; L729-L795 HydrophobicContact CD1-CB 4.21Å; L729-L795 HydrophobicContact CD1-CD1 4.26Å
730	I	71.1	Confident	61.1	Low	25 Å²	25	45 Å²	45	13%	0.128	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.6	-173	-53.4	-173.7	0	0	0	110.4	K728 P732 L736 I737 D794 I796	K728-I730 HydrophobicContact CB-CG1 4.44Å; I730-P732 WeakPolarHBondContact O-CD 3.46Å; I730-L736 CarbonylContact C-O 3.53Å; I730-L736 WeakPolarHBondContact CA-O 3.49Å; I730-I737 HydrophobicContact CD1-CG1 4.45Å; I730-I737 HydrophobicContact CG1-CG1 4.28Å; I730-D794 HydrophobicContact CB-CB 4.32Å; I730-D794 PolarHBondContact N-O 2.66Å; I730-D794 PolarHBondContact O-N 3.05Å; I730-I796 HydrophobicContact CD1-CD1 3.65Å; I730-I796 HydrophobicContact CD1-CG1 4.21Å
731	W	68.4	Low	62.1	Low	29 Å²	29	44.4 Å²	44.4	11%	0.11	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	111.8	168.1	-173.1	-103.1	0	0	0	110	A733 N734 S735 L736 L738 I774 I777 I792 F793	W731-A733 VanDerWaalsContact C-N 3.32Å; W731-A733 PolarHBondContact O-N 2.86Å; W731-N734 PolarHBondContact O-N 2.9Å; W731-S735 WeakPolarHBondContact O-CA 3.43Å; W731-S735 PolarHBondContact O-N 3.06Å; W731-L736 HydrophobicContact CB-CB 4.19Å; W731-L736 PolarHBondContact N-O 3.15Å; W731-L736 PolarHBondContact O-N 3.26Å; W731-L738 HydrophobicContact CB-CD1 3.98Å; W731-L738 HydrophobicContact CB-CD2 4.39Å; W731-L738 HydrophobicContact CB-CG 4.17Å; W731-L738 HydrophobicContact CE3-CD1 4.45Å; W731-I774 HydrophobicContact CH2-CD1 4.48Å; W731-I774 HydrophobicContact CH2-CG2 3.84Å; W731-I774 HydrophobicContact CZ3-CD1 4.32Å; W731-I777 HydrophobicContact CZ2-CD1 4.13Å; W731-I792 HydrophobicContact CH2-CG2 4.35Å; W731-I792 HydrophobicContact CZ3-CG2 3.92Å; W731-I792 WeakPolarHBondContact CZ3-O 3.48Å; W731-F793 AromaticContact CE3-CD1 3.92Å; W731-F793 HydrophobicContact CE3-CD1 3.92Å; W731-F793 AromaticContact CE3-CE1 3.5Å; W731-F793 HydrophobicContact CE3-CE1 3.5Å; W731-F793 VanDerWaalsContact CE3-CE1 3.5Å; W731-F793 HydrophobicContact CE3-CZ 4.18Å; W731-F793 HydrophobicContact CZ3-CD1 4.34Å; W731-F793 AromaticContact CZ3-CE1 3.66Å; W731-F793 HydrophobicContact CZ3-CE1 3.66Å; W731-F793 AromaticContact CZ3-CZ 3.84Å; W731-F793 HydrophobicContact CZ3-CZ 3.84Å
732	P	64.6	Low	62.5	Low	39 Å²	39	43.8 Å²	43.8	25%	0.253	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-23.1	-165.5	25.6	-32	0	0	0	113.8	I730 N734 L791 I792	I730-P732 WeakPolarHBondContact O-CD 3.46Å; P732-N734 PolarHBondContact O-N 3.4Å; P732-L791 HydrophobicContact CB-CD2 3.82Å; P732-L791 HydrophobicContact CG-CD2 3.41Å; P732-L791 VanDerWaalsContact CG-CD2 3.41Å; P732-I792 WeakPolarHBondContact CD-O 3.14Å
733	A	56.4	Low	62.8	Low	80 Å²	80	43 Å²	43	66%	0.661	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-26.9	-179.6	0	0	0	0	0	113.8	W731	W731-A733 VanDerWaalsContact C-N 3.32Å; W731-A733 PolarHBondContact O-N 2.86Å
734	N	58.3	Low	62.7	Low	119 Å²	119	43.6 Å²	43.6	64%	0.636	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122	-0.7	-176.6	-69.7	-0.5	0	0	0	113.2	W731 P732 L736	W731-N734 PolarHBondContact O-N 2.9Å; P732-N734 PolarHBondContact O-N 3.4Å; N734-L736 HydrophobicContact CB-CB 4.21Å; N734-L736 PolarHBondContact O-N 2.85Å; N734-L736 VanDerWaalsContact O-N 3.15Å
735	S	61.4	Low	62.4	Low	99 Å²	99	44 Å²	44	69%	0.692	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	24.1	-165.2	58.9	0	0	0	0	114.5	W731 I737	W731-S735 WeakPolarHBondContact O-CA 3.43Å; W731-S735 PolarHBondContact O-N 3.06Å; S735-I737 PolarHBondContact O-N 2.87Å
736	L	53.5	Low	61.5	Low	97 Å²	97	48.7 Å²	48.7	51%	0.508	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	120	-178.6	-176.6	81	0	0	0	109.3	I730 W731 N734 L738	I730-L736 CarbonylContact C-O 3.53Å; I730-L736 WeakPolarHBondContact CA-O 3.49Å; W731-L736 HydrophobicContact CB-CB 4.19Å; W731-L736 PolarHBondContact N-O 3.15Å; W731-L736 PolarHBondContact O-N 3.26Å; N734-L736 HydrophobicContact CB-CB 4.21Å; N734-L736 PolarHBondContact O-N 2.85Å; N734-L736 VanDerWaalsContact O-N 3.15Å; L736-L738 HydrophobicContact CD2-CD2 4.09Å; L736-L738 PolarHBondContact O-N 2.95Å
737	I	59.6	Low	60.5	Low	69 Å²	69	52.8 Å²	52.8	35%	0.354	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	120.1	170	-56.2	177.7	0	0	0	107.5	L729 I730 S735 S739 N740	L729-I737 CarbonylContact O-C 3.59Å; L729-I737 WeakPolarHBondContact O-CA 3.2Å; I730-I737 HydrophobicContact CD1-CG1 4.45Å; I730-I737 HydrophobicContact CG1-CG1 4.28Å; S735-I737 PolarHBondContact O-N 2.87Å; I737-S739 VanDerWaalsContact CG2-O 3.23Å; I737-S739 WeakPolarHBondContact CG2-O 3.4Å; I737-N740 HydrophobicContact CG2-CB 4.22Å
738	L	59.9	Low	59	Low	77 Å²	77	56.5 Å²	56.5	40%	0.403	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-29	-179.6	-67.4	163.4	0	0	0	112.1	L729 W731 L736 F793	L729-L738 HydrophobicContact CB-CB 4.33Å; L729-L738 HydrophobicContact CD2-CB 4.2Å; L729-L738 HydrophobicContact CD2-CD1 4.11Å; L729-L738 HydrophobicContact CG-CB 4.35Å; L729-L738 HydrophobicContact CG-CD1 4.17Å; L729-L738 PolarHBondContact O-N 3.28Å; W731-L738 HydrophobicContact CB-CD1 3.98Å; W731-L738 HydrophobicContact CB-CD2 4.39Å; W731-L738 HydrophobicContact CB-CG 4.17Å; W731-L738 HydrophobicContact CE3-CD1 4.45Å; L736-L738 HydrophobicContact CD2-CD2 4.09Å; L736-L738 PolarHBondContact O-N 2.95Å; L738-F793 HydrophobicContact CD1-CD1 3.4Å; L738-F793 HydrophobicContact CD1-CE1 3.41Å; L738-F793 VanDerWaalsContact CD1-CE1 3.41Å
739	S	61.7	Low	57.4	Low	20 Å²	20	61.3 Å²	61.3	14%	0.14	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	146.2	171.5	60.9	0	0	0	0	109.9	K728 L729 I737 Y767	K728-S739 WeakPolarHBondContact CA-O 3.17Å; L729-S739 WeakPolarHBondContact CB-OG 3.19Å; L729-S739 PolarHBondContact N-O 3.3Å; L729-S739 PolarHBondContact O-N 3.43Å; I737-S739 VanDerWaalsContact CG2-O 3.23Å; I737-S739 WeakPolarHBondContact CG2-O 3.4Å; S739-Y767 WeakPolarHBondContact OG-CE1 3.46Å
740	N	65.3	Low	55.4	Low	48 Å²	48	67.3 Å²	67.3	26%	0.257	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	124.2	172.3	-177.4	36.9	0	0	0	108	N726 F727 K728 I737	N726-N740 PolarHBondContact ND2-OD1 2.91Å; F727-N740 CarbonylContact O-C 3.53Å; F727-N740 WeakPolarHBondContact O-CA 3.41Å; K728-N740 VanDerWaalsContact CE-OD1 3.31Å; K728-N740 WeakPolarHBondContact CE-OD1 3.47Å; K728-N740 HydrophobicContact CG-CB 4.37Å; K728-N740 VanDerWaalsContact CG-OD1 3.28Å; K728-N740 WeakPolarHBondContact CG-OD1 3.49Å; I737-N740 HydrophobicContact CG2-CB 4.22Å
741	H	63.2	Low	53.5	Low	41 Å²	41	74.4 Å²	74.4	19%	0.19	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	114.6	-179.4	-63.7	-22.5	0	0	0	110.1	N726 F727 Y767	N726-H741 WeakPolarHBondContact CA-O 3.48Å; F727-H741 HydrophobicContact CB-CB 4.38Å; F727-H741 PolarHBondContact N-O 2.97Å; F727-H741 PolarHBondContact O-N 2.8Å; H741-Y767 AromaticContact CD2-CE1 3.72Å; H741-Y767 AromaticContact CD2-CZ 3.85Å; H741-Y767 PolarHBondContact CD2-OH 3.12Å; H741-Y767 VanDerWaalsContact CD2-OH 3.25Å; H741-Y767 AromaticContact NE2-CE1 3.43Å; H741-Y767 WeakPolarHBondContact NE2-CE1 3.41Å
742	D	56.3	Low	51.9	Low	53 Å²	53	79.2 Å²	79.2	28%	0.283	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	101.4	173.4	-77.3	-45.7	0	0	0	109.6	S657 Y724 N726	S657-D742 WeakPolarHBondContact CB-OD2 3.48Å; S657-D742 PolarHBondContact OG-OD1 3.36Å; S657-D742 PolarHBondContact OG-OD2 3.25Å; Y724-D742 HydrophobicContact CE2-CB 4.06Å; Y724-D742 VanDerWaalsContact CE2-OD1 3.28Å; Y724-D742 WeakPolarHBondContact CE2-OD1 3.11Å; Y724-D742 VanDerWaalsContact CZ-OD1 3.27Å; Y724-D742 PolarHBondContact OH-OD1 3.45Å; N726-D742 PolarHBondContact ND2-OD1 3.47Å
743	V	58	Low	50.4	Low	30 Å²	30	87.7 Å²	87.7	18%	0.182	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	115.8	177.1	-177.6	0	0	0	0	108.6	I725 F727 V745	I725-V743 PolarHBondContact N-O 3.15Å; I725-V743 WeakPolarHBondContact O-CB 3.46Å; I725-V743 PolarHBondContact O-N 2.93Å; F727-V743 HydrophobicContact CD2-CG2 4.03Å; F727-V743 HydrophobicContact CE2-CG2 3.99Å; V743-V745 HydrophobicContact CG1-CG2 4.17Å
744	V	51.4	Low	49	Very low	36 Å²	36	93.8 Å²	93.8	22%	0.218	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	117.6	163	177.6	0	0	0	0	108.2	L659 F663 A723 Y724 L746	L659-V744 HydrophobicContact CB-CG2 3.81Å; L659-V744 HydrophobicContact CD1-CB 4.44Å; L659-V744 HydrophobicContact CD1-CG2 3.7Å; L659-V744 HydrophobicContact CG-CG2 4.24Å; F663-V744 HydrophobicContact CD2-CG1 4.15Å; F663-V744 HydrophobicContact CD2-CG2 4.19Å; F663-V744 HydrophobicContact CE2-CG1 3.72Å; F663-V744 HydrophobicContact CE2-CG2 4.25Å; F663-V744 HydrophobicContact CZ-CG1 4.06Å; A723-V744 WeakPolarHBondContact O-CA 3.34Å; Y724-V744 HydrophobicContact CD2-CG2 3.98Å; V744-L746 HydrophobicContact CG1-CD2 3.53Å; V744-L746 HydrophobicContact CG1-CG 3.93Å
745	V	54.5	Low	47.8	Very low	21 Å²	21	98.9 Å²	98.9	13%	0.127	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125.2	164.1	-179.4	0	0	0	0	107.7	V718 P722 A723 V743	V718-V745 HydrophobicContact CB-CB 4.2Å; V718-V745 HydrophobicContact CB-CG1 4.04Å; V718-V745 HydrophobicContact CB-CG2 4Å; V718-V745 HydrophobicContact CG1-CB 3.94Å; V718-V745 HydrophobicContact CG1-CG1 3.86Å; V718-V745 HydrophobicContact CG1-CG2 4.25Å; V718-V745 HydrophobicContact CG2-CB 4.37Å; V718-V745 HydrophobicContact CG2-CG2 3.76Å; P722-V745 CarbonylContact C-O 3.58Å; P722-V745 WeakPolarHBondContact CA-O 3.35Å; A723-V745 PolarHBondContact N-O 2.88Å; A723-V745 PolarHBondContact O-N 3.41Å; V743-V745 HydrophobicContact CG1-CG2 4.17Å
746	L	45.1	Very low	46.4	Very low	100 Å²	100	100.6 Å²	100.6	52%	0.524	50%	0.504	S	S	.	.			trans	-105	138.9	174.6	-62.4	177.9	0	0	0	108.8	F663 V744 S748	F663-L746 HydrophobicContact CE1-CD2 3.99Å; F663-L746 HydrophobicContact CE2-CD2 4.38Å; F663-L746 HydrophobicContact CZ-CD2 3.55Å; V744-L746 HydrophobicContact CG1-CD2 3.53Å; V744-L746 HydrophobicContact CG1-CG 3.93Å; L746-S748 PolarHBondContact O-N 3.38Å; L746-S748 VanDerWaalsContact O-N 3.1Å
747	N	44.5	Very low	45.6	Very low	86 Å²	86	102.9 Å²	102.9	46%	0.46	52%	0.516	S	S	.	.			trans	-63.6	114.2	173.9	179.9	20.8	0	0	0	109.7	Q749	N747-Q749 PolarHBondContact O-N 3.31Å
748	S	39	Very low	44.6	Very low	78 Å²	78	108.8 Å²	108.8	55%	0.545	54%	0.539	S	S	.	.	S	Bend	trans	-75	22.2	-168.5	51.8	0	0	0	0	115.2	L746 E761	L746-S748 PolarHBondContact O-N 3.38Å; L746-S748 VanDerWaalsContact O-N 3.1Å; S748-E761 WeakPolarHBondContact CB-OE1 3.39Å; S748-E761 PolarHBondContact OG-OE1 3.47Å
749	Q	39.6	Very low	43.6	Very low	137 Å²	137	113.5 Å²	113.5	64%	0.64	56%	0.556	S	S	*	*			trans	-140	92.7	-178.2	-64.3	-166.4	-44.8	0	0	113.1	N747	N747-Q749 PolarHBondContact O-N 3.31Å
750	T	32.1	Very low	42.8	Very low	129 Å²	129	117 Å²	117	79%	0.791	57%	0.573	S	S	*	*			trans	-113.1	52.1	164.1	51.4	0	0	0	0	112
751	K	31.1	Very low	42.1	Very low	174 Å²	174	118.2 Å²	118.2	76%	0.757	58%	0.577	S	S	*	*	S	Bend	trans	-162.7	140.5	152.1	-97.3	138.6	-172.1	174.7	0	109.4
752	D	34.6	Very low	41.9	Very low	131 Å²	131	120.4 Å²	120.4	70%	0.701	60%	0.597	S	S	*	*	S	Bend	trans	63.2	101.1	162.3	-52.5	-38.5	0	0	0	121
753	Y	32.2	Very low	42.2	Very low	217 Å²	217	119.4 Å²	119.4	85%	0.851	59%	0.59	S	S	*	*			trans	60.5	119	141.1	-72.7	-86.5	0	0	0	122.5	R755	Y753-R755 PolarHBondContact O-N 3.48Å
754	F	28.5	Very low	42.7	Very low	207 Å²	207	124.2 Å²	124.2	91%	0.908	61%	0.61	S	S	*	*			trans	-29.1	107.6	161.9	-72.5	-99.9	0	0	0	116.5
755	R	32.4	Very low	43.6	Very low	226 Å²	226	124.2 Å²	124.2	85%	0.853	61%	0.609	S	S	*	*			trans	-138.1	120.6	143	-77.1	-167.4	172.4	-177.7	-1.8	110.1	Y753 N757	Y753-R755 PolarHBondContact O-N 3.48Å; R755-N757 VanDerWaalsContact C-N 3.26Å; R755-N757 PolarHBondContact O-N 3.32Å
756	P	32.8	Very low	44.4	Very low	136 Å²	136	126.1 Å²	126.1	88%	0.883	62%	0.621	S	S	*	*			trans	-81.2	63.1	-171.5	34.2	-37.4	0	0	0	112.9
757	N	37	Very low	45.6	Very low	144 Å²	144	122.1 Å²	122.1	77%	0.77	60%	0.599	S	S	*	*			trans	-114.3	101.7	178.1	-95.2	-19.6	0	0	0	112.3	R755 K759	R755-N757 VanDerWaalsContact C-N 3.26Å; R755-N757 PolarHBondContact O-N 3.32Å; N757-K759 PolarHBondContact O-N 2.78Å
758	K	37	Very low	46.9	Very low	194 Å²	194	124 Å²	124	84%	0.843	61%	0.605	S	S	*	*			trans	2.3	95.5	161.2	-61.8	173.6	-178.2	172.7	0	116.3
759	K	40.3	Very low	48.2	Very low	175 Å²	175	121.7 Å²	121.7	76%	0.761	59%	0.586	S	S	*	*			trans	-113.4	119.2	137	-74.5	-171.7	175.8	-176.7	0	107.5	N757	N757-K759 PolarHBondContact O-N 2.78Å
760	I	43.9	Very low	49.6	Very low	94 Å²	94	117.1 Å²	117.1	48%	0.482	57%	0.566	S	S	.	*			trans	-104.8	115.9	172.7	-58.6	174.5	0	0	0	104.5	Y717 T719 S762	Y717-I760 HydrophobicContact CD1-CG2 3.9Å; Y717-I760 HydrophobicContact CG-CG2 4.3Å; T719-I760 HydrophobicContact CG2-CG2 4.36Å; I760-S762 PolarHBondContact O-N 3.11Å
761	E	49.8	Very low	51	Low	74 Å²	74	113 Å²	113	35%	0.346	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	115.3	179.1	-69.9	-177	-174.4	0	0	108.4	V718 S748	V718-E761 PolarHBondContact N-O 2.82Å; V718-E761 PolarHBondContact O-N 3Å; S748-E761 WeakPolarHBondContact CB-OE1 3.39Å; S748-E761 PolarHBondContact OG-OE1 3.47Å
762	S	59.4	Low	52.1	Low	86 Å²	86	107.9 Å²	107.9	60%	0.601	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.3	-178.6	59.2	0	0	0	0	111.4	G716 I760	G716-S762 CarbonylContact O-C 3.55Å; G716-S762 WeakPolarHBondContact O-CA 3.43Å; G716-S762 WeakPolarHBondContact O-CB 3.05Å; I760-S762 PolarHBondContact O-N 3.11Å
763	F	64	Low	53.1	Low	33 Å²	33	104.9 Å²	104.9	15%	0.145	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	151.3	171.3	64.1	-94.7	0	0	0	110.9	I694 T715 G716 V718 I725 F727	I694-F763 HydrophobicContact CG1-CZ 4.28Å; T715-F763 CarbonylContact C-O 3.52Å; T715-F763 WeakPolarHBondContact CA-O 3.37Å; G716-F763 PolarHBondContact N-O 3.43Å; G716-F763 PolarHBondContact O-N 2.91Å; V718-F763 HydrophobicContact CG2-CD1 4.31Å; V718-F763 HydrophobicContact CG2-CE1 3.95Å; I725-F763 HydrophobicContact CD1-CE1 4.15Å; I725-F763 HydrophobicContact CD1-CZ 4.35Å; F727-F763 AromaticContact CE2-CE2 3.85Å; F727-F763 HydrophobicContact CE2-CE2 3.85Å; F727-F763 HydrophobicContact CE2-CZ 4.09Å; F727-F763 AromaticContact CZ-CE2 3.52Å; F727-F763 HydrophobicContact CZ-CE2 3.52Å; F727-F763 AromaticContact CZ-CZ 3.66Å; F727-F763 HydrophobicContact CZ-CZ 3.66Å
764	Q	68.4	Low	54.1	Low	130 Å²	130	95.5 Å²	95.5	61%	0.607	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	115.1	172.2	178.8	174.3	-17.2	0	0	109.6	T715	T715-Q764 HydrophobicContact CG2-CB 4.02Å; T715-Q764 HydrophobicContact CG2-CG 3.79Å
765	L	68.4	Low	54.8	Low	36 Å²	36	89.6 Å²	89.6	19%	0.188	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.9	168.5	-67.1	168.2	0	0	0	108.6	V714 F727	V714-L765 HydrophobicContact CB-CB 4.3Å; V714-L765 PolarHBondContact N-O 3.5Å; V714-L765 PolarHBondContact O-N 3.48Å; F727-L765 HydrophobicContact CB-CD1 4.46Å; F727-L765 HydrophobicContact CD2-CD1 3.64Å; F727-L765 HydrophobicContact CE2-CD1 3.98Å; F727-L765 HydrophobicContact CG-CD1 3.98Å
766	T	72	Confident	55.2	Low	61 Å²	61	87.4 Å²	87.4	37%	0.374	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	108.9	176.2	-56.2	0	0	0	0	108.9	I712 F713	I712-T766 WeakPolarHBondContact O-CA 3.49Å; F713-T766 HydrophobicContact CD1-CG2 3.58Å; F713-T766 WeakPolarHBondContact CD1-OG1 3.48Å; F713-T766 HydrophobicContact CE1-CG2 3.49Å; F713-T766 VanDerWaalsContact CE1-CG2 3.49Å; F713-T766 HydrophobicContact CG-CG2 4.48Å; F713-T766 HydrophobicContact CZ-CG2 4.34Å
767	Y	70.5	Confident	55.8	Low	17 Å²	17	83.8 Å²	83.8	7%	0.067	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.3	169.9	-51.8	-76.2	0	0	0	108.9	H711 I712 V714 L729 S739 H741 L795	H711-Y767 CarbonylContact C-O 3.54Å; H711-Y767 WeakPolarHBondContact CA-O 3.02Å; I712-Y767 HydrophobicContact CB-CD2 4.18Å; I712-Y767 HydrophobicContact CG2-CD2 4.27Å; I712-Y767 PolarHBondContact N-O 3.49Å; I712-Y767 PolarHBondContact O-N 2.99Å; V714-Y767 HydrophobicContact CG2-CE2 4.31Å; L729-Y767 HydrophobicContact CD2-CG 4.5Å; S739-Y767 WeakPolarHBondContact OG-CE1 3.46Å; H741-Y767 AromaticContact CD2-CE1 3.72Å; H741-Y767 AromaticContact CD2-CZ 3.85Å; H741-Y767 PolarHBondContact CD2-OH 3.12Å; H741-Y767 VanDerWaalsContact CD2-OH 3.25Å; H741-Y767 AromaticContact NE2-CE1 3.43Å; H741-Y767 WeakPolarHBondContact NE2-CE1 3.41Å; Y767-L795 HydrophobicContact CE2-CD1 4.48Å
768	Q	72.1	Confident	56	Low	126 Å²	126	81 Å²	81	59%	0.589	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.4	174.9	-177.2	175.2	-35.6	0	0	108.5	I709 H711	I709-Q768 HydrophobicContact CG2-CG 3.47Å; I709-Q768 VanDerWaalsContact CG2-CG 3.47Å; H711-Q768 PolarHBondContact CE1-OE1 2.81Å; H711-Q768 VanDerWaalsContact CE1-OE1 3.3Å
769	I	67	Low	55.9	Low	29 Å²	29	78.4 Å²	78.4	15%	0.149	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	114.1	-172.2	-46.9	176.4	0	0	0	108.6	I709 L710 I712 L729 I771 I774 F793	I709-I769 WeakPolarHBondContact CA-O 3.18Å; L710-I769 HydrophobicContact CB-CB 4.41Å; L710-I769 PolarHBondContact N-O 3.48Å; L710-I769 PolarHBondContact O-N 3.39Å; I712-I769 HydrophobicContact CD1-CD1 4.16Å; L729-I769 HydrophobicContact CD2-CD1 3.88Å; I769-I771 PolarHBondContact O-N 3.47Å; I769-I774 HydrophobicContact CG2-CD1 4.34Å; I769-F793 HydrophobicContact CD1-CD1 4.44Å; I769-F793 HydrophobicContact CD1-CD2 4.37Å; I769-F793 HydrophobicContact CD1-CE1 3.87Å; I769-F793 HydrophobicContact CD1-CE2 3.81Å; I769-F793 HydrophobicContact CD1-CZ 3.55Å; I769-F793 HydrophobicContact CG2-CZ 4.02Å
770	D	68	Low	55.9	Low	41 Å²	41	74.7 Å²	74.7	22%	0.219	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	116.6	173.5	176.6	16.8	0	0	0	109.8	Q707 N772 S773	Q707-D770 PolarHBondContact NE2-OD2 3.29Å; Q707-D770 VanDerWaalsContact NE2-OD2 3.16Å; D770-N772 PolarHBondContact O-N 2.79Å; D770-N772 WeakPolarHBondContact OD1-CB 3.43Å; D770-N772 PolarHBondContact OD1-N 2.84Å; D770-S773 WeakPolarHBondContact O-CB 3.33Å; D770-S773 PolarHBondContact O-N 3.47Å; D770-S773 PolarHBondContact O-OG 3.27Å
771	I	61	Low	55.9	Low	41 Å²	41	74.1 Å²	74.1	21%	0.21	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-24.1	179.7	-55.7	175.3	0	0	0	110.1	F700 E708 L710 I769 I774	F700-I771 HydrophobicContact CD1-CD1 3.85Å; F700-I771 HydrophobicContact CE1-CD1 3.86Å; E708-I771 HydrophobicContact CB-CB 4.34Å; E708-I771 HydrophobicContact CB-CD1 4.08Å; E708-I771 WeakPolarHBondContact O-CB 3.38Å; E708-I771 WeakPolarHBondContact O-CG1 3.15Å; E708-I771 PolarHBondContact O-N 2.87Å; L710-I771 HydrophobicContact CB-CD1 4.34Å; L710-I771 HydrophobicContact CB-CG1 4.36Å; I769-I771 PolarHBondContact O-N 3.47Å; I771-I774 VanDerWaalsContact O-CB 3.3Å; I771-I774 WeakPolarHBondContact O-CB 3.42Å; I771-I774 PolarHBondContact O-N 2.88Å
772	N	55.1	Low	55.4	Low	68 Å²	68	72.7 Å²	72.7	36%	0.364	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-25.7	174.4	-77.8	-33.7	0	0	0	113.6	Q707 D770 I774 N775	Q707-N772 WeakPolarHBondContact CA-ND2 3.49Å; Q707-N772 WeakPolarHBondContact CB-ND2 3.19Å; D770-N772 PolarHBondContact O-N 2.79Å; D770-N772 WeakPolarHBondContact OD1-CB 3.43Å; D770-N772 PolarHBondContact OD1-N 2.84Å; N772-I774 PolarHBondContact O-N 2.81Å; N772-N775 WeakPolarHBondContact CA-ND2 3.1Å; N772-N775 WeakPolarHBondContact O-CB 3.5Å; N772-N775 PolarHBondContact O-N 3.16Å; N772-N775 VanDerWaalsContact O-N 3.16Å; N772-N775 PolarHBondContact O-ND2 3.41Å; N772-N775 PolarHBondContact OD1-ND2 3.18Å
773	S	55.6	Low	54.3	Low	68 Å²	68	74.3 Å²	74.3	48%	0.476	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-64.5	-26.5	169.2	75.5	0	0	0	0	112.5	D770 N775 E776	D770-S773 WeakPolarHBondContact O-CB 3.33Å; D770-S773 PolarHBondContact O-N 3.47Å; D770-S773 PolarHBondContact O-OG 3.27Å; S773-N775 PolarHBondContact O-N 3.47Å; S773-E776 PolarHBondContact O-N 2.92Å
774	I	53.5	Low	53	Low	20 Å²	20	77.6 Å²	77.6	10%	0.103	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-70.7	-17	177	-52.4	179.9	0	0	0	111.1	W731 I769 I771 N772 E776 I777 F793	W731-I774 HydrophobicContact CH2-CD1 4.48Å; W731-I774 HydrophobicContact CH2-CG2 3.84Å; W731-I774 HydrophobicContact CZ3-CD1 4.32Å; I769-I774 HydrophobicContact CG2-CD1 4.34Å; I771-I774 VanDerWaalsContact O-CB 3.3Å; I771-I774 WeakPolarHBondContact O-CB 3.42Å; I771-I774 PolarHBondContact O-N 2.88Å; N772-I774 PolarHBondContact O-N 2.81Å; I774-E776 PolarHBondContact O-N 3.46Å; I774-I777 HydrophobicContact CG2-CD1 4.14Å; I774-I777 VanDerWaalsContact O-CB 3.26Å; I774-I777 WeakPolarHBondContact O-CB 3.45Å; I774-I777 PolarHBondContact O-N 3.5Å; I774-F793 HydrophobicContact CD1-CZ 4.28Å
775	N	42.1	Very low	51.4	Low	82 Å²	82	74.3 Å²	74.3	44%	0.439	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-69.1	-14.6	178.4	-68.1	-43.1	0	0	0	114.3	N772 S773 I777	N772-N775 WeakPolarHBondContact CA-ND2 3.1Å; N772-N775 WeakPolarHBondContact O-CB 3.5Å; N772-N775 PolarHBondContact O-N 3.16Å; N772-N775 VanDerWaalsContact O-N 3.16Å; N772-N775 PolarHBondContact O-ND2 3.41Å; N772-N775 PolarHBondContact OD1-ND2 3.18Å; S773-N775 PolarHBondContact O-N 3.47Å; N775-I777 VanDerWaalsContact C-N 3.25Å
776	E	40.6	Very low	49.9	Very low	180 Å²	180	78 Å²	78	84%	0.841	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-72.3	-21.6	169	-63	-164.5	159.1	0	0	112.2	S773 I774	S773-E776 PolarHBondContact O-N 2.92Å; I774-E776 PolarHBondContact O-N 3.46Å
777	I	47	Very low	48.2	Very low	61 Å²	61	84.3 Å²	84.3	31%	0.313	45%	0.447	S	S	.	.	S	Bend	trans	-71.7	120.7	172	-56.9	-175.8	0	0	0	107.7	W731 I774 N775 F779 T781	W731-I777 HydrophobicContact CZ2-CD1 4.13Å; I774-I777 HydrophobicContact CG2-CD1 4.14Å; I774-I777 VanDerWaalsContact O-CB 3.26Å; I774-I777 WeakPolarHBondContact O-CB 3.45Å; I774-I777 PolarHBondContact O-N 3.5Å; N775-I777 VanDerWaalsContact C-N 3.25Å; I777-F779 PolarHBondContact O-N 2.7Å; I777-T781 WeakPolarHBondContact CG2-OG1 3.4Å
778	P	39.6	Very low	46.7	Very low	85 Å²	85	90.5 Å²	90.5	55%	0.552	48%	0.477	S	S	*	.			trans	-62.9	130.1	-162.4	21.8	-33.9	0	0	0	112.3	K780 T781	P778-K780 PolarHBondContact O-N 3.27Å; P778-T781 HydrophobicContact CG-CG2 4.35Å; P778-T781 PolarHBondContact O-N 3.31Å; P778-T781 PolarHBondContact O-OG1 2.84Å
779	F	36.4	Very low	45.1	Very low	139 Å²	139	87.7 Å²	87.7	61%	0.61	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.6	-30.1	-177.5	-110.5	-97.5	0	0	0	115.8	I777 T781 L782 F783	I777-F779 PolarHBondContact O-N 2.7Å; F779-T781 PolarHBondContact O-N 2.88Å; F779-L782 PolarHBondContact O-N 3.46Å; F779-F783 HydrophobicContact CD1-CD2 4.06Å; F779-F783 AromaticContact CD1-CE2 3.92Å; F779-F783 HydrophobicContact CD1-CE2 3.92Å; F779-F783 HydrophobicContact CE1-CD2 4.44Å; F779-F783 AromaticContact CE1-CE2 3.86Å; F779-F783 HydrophobicContact CE1-CE2 3.86Å
780	K	40.6	Very low	44.2	Very low	97 Å²	97	88.9 Å²	88.9	42%	0.422	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.7	174.6	-84.5	-173.3	168.8	-175.7	0	115.4	P778 T983	P778-K780 PolarHBondContact O-N 3.27Å; K780-T983 HydrophobicContact CD-CG2 4.27Å
781	T	43.7	Very low	43.5	Very low	83 Å²	83	90.3 Å²	90.3	51%	0.509	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-26.6	179	56.9	0	0	0	0	112.8	I777 P778 F779	I777-T781 WeakPolarHBondContact CG2-OG1 3.4Å; P778-T781 HydrophobicContact CG-CG2 4.35Å; P778-T781 PolarHBondContact O-N 3.31Å; P778-T781 PolarHBondContact O-OG1 2.84Å; F779-T781 PolarHBondContact O-N 2.88Å
782	L	39.6	Very low	43.4	Very low	44 Å²	44	89.3 Å²	89.3	23%	0.23	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-24.7	178.2	-70.7	164.7	0	0	0	113.4	F779 T790	F779-L782 PolarHBondContact O-N 3.46Å; L782-T790 VanDerWaalsContact O-CG2 3.23Å; L782-T790 WeakPolarHBondContact O-CG2 3.37Å
783	F	34.9	Very low	44	Very low	120 Å²	120	86.2 Å²	86.2	53%	0.526	46%	0.464	S	S	.	.			trans	-123.7	64	-174.8	-63.8	-81.1	0	0	0	112.6	F779	F779-F783 HydrophobicContact CD1-CD2 4.06Å; F779-F783 AromaticContact CD1-CE2 3.92Å; F779-F783 HydrophobicContact CD1-CE2 3.92Å; F779-F783 HydrophobicContact CE1-CD2 4.44Å; F779-F783 AromaticContact CE1-CE2 3.86Å; F779-F783 HydrophobicContact CE1-CE2 3.86Å
784	S	36.7	Very low	44.5	Very low	102 Å²	102	84.1 Å²	84.1	71%	0.713	45%	0.447	S	S	*	.	S	Bend	trans	-84.5	-15.1	-176.2	57.4	0	0	0	0	115.2
785	S	36.3	Very low	45.4	Very low	60 Å²	60	83.3 Å²	83.3	42%	0.42	44%	0.443	S	S	.	.	S	Bend	trans	-145.4	152.7	166.8	79.6	0	0	0	0	111.5	F787	S785-F787 VanDerWaalsContact C-N 3.3Å; S785-F787 PolarHBondContact O-N 2.99Å
786	S	37	Very low	46.6	Very low	113 Å²	113	81.9 Å²	81.9	79%	0.79	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	4.8	-173.1	45.4	0	0	0	0	115.4
787	F	35.7	Very low	47.9	Very low	195 Å²	195	74 Å²	74	86%	0.855	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.5	18.3	-167.8	-83.5	-74.2	0	0	0	115.9	S785	S785-F787 VanDerWaalsContact C-N 3.3Å; S785-F787 PolarHBondContact O-N 2.99Å
788	Q	39.5	Very low	48.7	Very low	146 Å²	146	72.8 Å²	72.8	68%	0.682	39%	0.391	S	S	*	.	S	Bend	trans	-130.5	146	-177.7	-66.2	-173.2	-24.4	0	0	113.6
789	P	38.4	Very low	49.7	Very low	67 Å²	67	70.1 Å²	70.1	44%	0.435	37%	0.371	S	S	.	.			trans	-68.5	133.7	177.4	28.8	-34.4	0	0	0	111	Y809 T810	P789-Y809 HydrophobicContact CG-CD1 4.47Å; P789-T810 WeakPolarHBondContact CB-O 3.47Å
790	T	47.9	Very low	50.8	Low	55 Å²	55	65.5 Å²	65.5	34%	0.337	36%	0.356	S	S	.	.			trans	-68.9	134.4	-178.4	40	0	0	0	0	111.1	L782 Y809 T810	L782-T790 VanDerWaalsContact O-CG2 3.23Å; L782-T790 WeakPolarHBondContact O-CG2 3.37Å; T790-Y809 CarbonylContact O-C 3.57Å; T790-Y809 WeakPolarHBondContact O-CA 3.38Å; T790-T810 PolarHBondContact O-N 3.5Å; T790-T810 PolarHBondContact O-OG1 3.49Å; T790-T810 WeakPolarHBondContact OG1-CB 3.36Å; T790-T810 PolarHBondContact OG1-OG1 3.09Å
791	L	52.1	Low	51.5	Low	70 Å²	70	66.3 Å²	66.3	37%	0.366	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.8	-168.9	-161.1	172.7	0	0	0	107.6	P732 R807 Y809	P732-L791 HydrophobicContact CB-CD2 3.82Å; P732-L791 HydrophobicContact CG-CD2 3.41Å; P732-L791 VanDerWaalsContact CG-CD2 3.41Å; L791-R807 HydrophobicContact CD2-CG 3.81Å; L791-R807 HydrophobicContact CG-CG 4.21Å; L791-Y809 HydrophobicContact CB-CD1 4.02Å; L791-Y809 HydrophobicContact CB-CE1 4.32Å; L791-Y809 HydrophobicContact CD1-CD1 4.24Å; L791-Y809 HydrophobicContact CD1-CE1 3.68Å; L791-Y809 HydrophobicContact CG-CD1 3.73Å; L791-Y809 HydrophobicContact CG-CE1 3.65Å; L791-Y809 HydrophobicContact CG-CG 4.38Å
792	I	58.9	Low	51.9	Low	20 Å²	20	63.5 Å²	63.5	10%	0.103	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-52.6	-158.9	-22.1	175.7	0	0	0	113.2	W731 P732 I808 T810	W731-I792 HydrophobicContact CH2-CG2 4.35Å; W731-I792 HydrophobicContact CZ3-CG2 3.92Å; W731-I792 WeakPolarHBondContact CZ3-O 3.48Å; P732-I792 WeakPolarHBondContact CD-O 3.14Å; I792-I808 HydrophobicContact CD1-CG2 4.43Å; I792-I808 PolarHBondContact N-O 3.19Å; I792-T810 HydrophobicContact CD1-CG2 3.76Å; I792-T810 VanDerWaalsContact CD1-OG1 3.26Å; I792-T810 WeakPolarHBondContact CD1-OG1 3.45Å; I792-T810 VanDerWaalsContact CG1-OG1 3.25Å; I792-T810 WeakPolarHBondContact CG1-OG1 3.31Å
793	F	68.5	Low	52.8	Low	4 Å²	4	65.5 Å²	65.5	2%	0.018	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	140	-172.5	-57.7	-70.9	0	0	0	111.5	L710 I712 L729 W731 L738 I769 I774 I808	L710-F793 HydrophobicContact CD2-CD2 3.71Å; L710-F793 HydrophobicContact CD2-CE2 3.44Å; L710-F793 VanDerWaalsContact CD2-CE2 3.44Å; I712-F793 HydrophobicContact CD1-CD2 4.36Å; L729-F793 HydrophobicContact CD1-CB 4.01Å; L729-F793 HydrophobicContact CD1-CG 4.46Å; L729-F793 HydrophobicContact CD2-CD1 4.38Å; L729-F793 HydrophobicContact CG-CD1 4.43Å; W731-F793 AromaticContact CE3-CD1 3.92Å; W731-F793 HydrophobicContact CE3-CD1 3.92Å; W731-F793 AromaticContact CE3-CE1 3.5Å; W731-F793 HydrophobicContact CE3-CE1 3.5Å; W731-F793 VanDerWaalsContact CE3-CE1 3.5Å; W731-F793 HydrophobicContact CE3-CZ 4.18Å; W731-F793 HydrophobicContact CZ3-CD1 4.34Å; W731-F793 AromaticContact CZ3-CE1 3.66Å; W731-F793 HydrophobicContact CZ3-CE1 3.66Å; W731-F793 AromaticContact CZ3-CZ 3.84Å; W731-F793 HydrophobicContact CZ3-CZ 3.84Å; L738-F793 HydrophobicContact CD1-CD1 3.4Å; L738-F793 HydrophobicContact CD1-CE1 3.41Å; L738-F793 VanDerWaalsContact CD1-CE1 3.41Å; I769-F793 HydrophobicContact CD1-CD1 4.44Å; I769-F793 HydrophobicContact CD1-CD2 4.37Å; I769-F793 HydrophobicContact CD1-CE1 3.87Å; I769-F793 HydrophobicContact CD1-CE2 3.81Å; I769-F793 HydrophobicContact CD1-CZ 3.55Å; I769-F793 HydrophobicContact CG2-CZ 4.02Å; I774-F793 HydrophobicContact CD1-CZ 4.28Å; F793-I808 HydrophobicContact CB-CD1 4.4Å; F793-I808 PolarHBondContact O-N 3.35Å
794	D	66.2	Low	53.8	Low	24 Å²	24	60.5 Å²	60.5	13%	0.128	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.3	165.4	-78.6	-15.3	0	0	0	108.8	I730 L806 R807	I730-D794 HydrophobicContact CB-CB 4.32Å; I730-D794 PolarHBondContact N-O 2.66Å; I730-D794 PolarHBondContact O-N 3.05Å; D794-L806 CarbonylContact C-O 3.56Å; D794-L806 VanDerWaalsContact CA-O 3.32Å; D794-L806 WeakPolarHBondContact CA-O 3.35Å; D794-R807 VanDerWaalsContact OD1-CB 3.28Å; D794-R807 WeakPolarHBondContact OD1-CB 3.23Å; D794-R807 WeakPolarHBondContact OD1-CG 3.22Å; D794-R807 IonicContact OD1-CZ 3.42Å; D794-R807 IonicContact OD1-NE 3.6Å; D794-R807 PolarHBondContact OD1-NE 3.47Å; D794-R807 IonicContact OD1-NH2 2.72Å; D794-R807 IonicContact OD2-CZ 3.97Å; D794-R807 IonicContact OD2-NE 3.49Å; D794-R807 PolarHBondContact OD2-NE 3.44Å; D794-R807 IonicContact OD2-NH2 3.21Å; D794-R807 PolarHBondContact OD2-NH2 3.1Å
795	L	71.5	Confident	54.9	Low	3 Å²	3	56.5 Å²	56.5	2%	0.016	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121.1	172.6	176	68.1	0	0	0	109.1	V714 K728 L729 Y767 L806	V714-L795 HydrophobicContact CG2-CD2 3.9Å; K728-L795 CarbonylContact O-C 3.55Å; K728-L795 WeakPolarHBondContact O-CA 3.35Å; L729-L795 HydrophobicContact CD1-CB 4.21Å; L729-L795 HydrophobicContact CD1-CD1 4.26Å; Y767-L795 HydrophobicContact CE2-CD1 4.48Å; L795-L806 HydrophobicContact CB-CB 4.13Å; L795-L806 HydrophobicContact CD2-CD1 4.27Å; L795-L806 PolarHBondContact N-O 3.15Å; L795-L806 PolarHBondContact O-N 2.82Å
796	I	68.4	Low	56.1	Low	51 Å²	51	54.4 Å²	54.4	26%	0.262	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	136.2	176.4	-57.2	-175	0	0	0	109.7	K728 I730 Q798 V804	K728-I796 HydrophobicContact CB-CB 4.34Å; K728-I796 PolarHBondContact N-O 2.81Å; K728-I796 PolarHBondContact O-N 3.08Å; I730-I796 HydrophobicContact CD1-CD1 3.65Å; I730-I796 HydrophobicContact CD1-CG1 4.21Å; I796-Q798 HydrophobicContact CG2-CG 3.97Å; I796-V804 CarbonylContact C-O 3.56Å; I796-V804 VanDerWaalsContact CA-O 3.31Å; I796-V804 WeakPolarHBondContact CA-O 3.5Å
797	I	67.7	Low	57.4	Low	15 Å²	15	52.5 Å²	52.5	8%	0.077	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.8	171.5	-49.5	176.8	0	0	0	107.6	I694 I725 N726 F727 N803 V804	I694-I797 HydrophobicContact CD1-CD1 4Å; I694-I797 HydrophobicContact CD1-CG2 3.76Å; I694-I797 HydrophobicContact CG2-CD1 4.25Å; I725-I797 HydrophobicContact CG2-CG2 3.86Å; N726-I797 CarbonylContact O-C 3.35Å; N726-I797 WeakPolarHBondContact O-CA 3.46Å; F727-I797 HydrophobicContact CD1-CD1 4.36Å; F727-I797 HydrophobicContact CD1-CG1 3.92Å; F727-I797 HydrophobicContact CD1-CG2 4.3Å; F727-I797 HydrophobicContact CE1-CD1 3.97Å; F727-I797 HydrophobicContact CE1-CG1 3.97Å; F727-I797 HydrophobicContact CE1-CG2 4Å; I797-N803 CarbonylContact O-C 3.59Å; I797-N803 WeakPolarHBondContact O-CA 3.34Å; I797-V804 PolarHBondContact N-O 3.15Å; I797-V804 PolarHBondContact O-N 3.03Å
798	Q	63.4	Low	58.6	Low	35 Å²	35	44 Å²	44	16%	0.164	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.4	175.8	-38.6	-166.8	-88.6	0	0	111	N726 I796 A802 N803	N726-Q798 HydrophobicContact CB-CB 4.16Å; N726-Q798 PolarHBondContact N-O 3.19Å; N726-Q798 PolarHBondContact O-N 2.73Å; N726-Q798 PolarHBondContact OD1-OE1 3.2Å; I796-Q798 HydrophobicContact CG2-CG 3.97Å; Q798-A802 WeakPolarHBondContact CA-O 3.5Å; Q798-N803 VanDerWaalsContact CB-OD1 3.32Å; Q798-N803 WeakPolarHBondContact CB-OD1 3.33Å; Q798-N803 VanDerWaalsContact CG-OD1 3.28Å; Q798-N803 WeakPolarHBondContact CG-OD1 3.35Å; Q798-N803 PolarHBondContact NE2-OD1 2.91Å
799	E	60.9	Low	59.4	Low	29 Å²	29	39.4 Å²	39.4	14%	0.136	22%	0.215	C	C	.	.			trans	-100.2	-169.4	165.5	-64.9	-179.7	141.2	0	0	109.1	R660 D801 A802	R660-E799 PolarHBondContact NH2-O 2.85Å; E799-D801 VanDerWaalsContact C-N 3.33Å; E799-A802 PolarHBondContact N-O 2.92Å
800	C	59.2	Low	60	Low	42 Å²	42	37.6 Å²	37.6	28%	0.284	20%	0.203	S	C	.	.	S	Bend	trans	-62	-41.4	171.2	-64.2	0	0	0	0	111.5	C664	C664-C800 HydrophobicContact CB-CB 3.89Å; C664-C800 WeakPolarHBondContact CB-SG 3.19Å; C664-C800 WeakPolarHBondContact SG-CB 3.49Å; C664-C800 CovalentContact SG-SG 2.05Å; C664-C800 PolarHBondContact SG-SG 3.36Å
801	D	54.8	Low	59.9	Low	114 Å²	114	38.3 Å²	38.3	61%	0.61	21%	0.208	S	C	*	.	S	Bend	trans	-105.4	-15.3	-168.5	-61.8	-22.9	0	0	0	115.5	E799	E799-D801 VanDerWaalsContact C-N 3.33Å
802	A	53.3	Low	59.3	Low	24 Å²	24	41.2 Å²	41.2	20%	0.198	22%	0.223	C	C	.	.			trans	-143.6	149.4	-168.3	0	0	0	0	0	114.3	L675 Q798 E799	L675-A802 HydrophobicContact CB-CB 4.49Å; Q798-A802 WeakPolarHBondContact CA-O 3.5Å; E799-A802 PolarHBondContact N-O 2.92Å
803	N	57.7	Low	58.3	Low	86 Å²	86	48 Å²	48	46%	0.46	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	136.8	174	-64.6	-37.2	0	0	0	110.2	I797 Q798	I797-N803 CarbonylContact O-C 3.59Å; I797-N803 WeakPolarHBondContact O-CA 3.34Å; Q798-N803 VanDerWaalsContact CB-OD1 3.32Å; Q798-N803 WeakPolarHBondContact CB-OD1 3.33Å; Q798-N803 VanDerWaalsContact CG-OD1 3.28Å; Q798-N803 WeakPolarHBondContact CG-OD1 3.35Å; Q798-N803 PolarHBondContact NE2-OD1 2.91Å
804	V	56.8	Low	56.5	Low	15 Å²	15	51.6 Å²	51.6	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.8	176.5	-176.2	0	0	0	0	110	L675 I796 I797	L675-V804 HydrophobicContact CD1-CG2 3.49Å; L675-V804 VanDerWaalsContact CD1-CG2 3.49Å; L675-V804 HydrophobicContact CD2-CG2 3.74Å; L675-V804 HydrophobicContact CG-CG2 4.16Å; I796-V804 CarbonylContact C-O 3.56Å; I796-V804 VanDerWaalsContact CA-O 3.31Å; I796-V804 WeakPolarHBondContact CA-O 3.5Å; I797-V804 PolarHBondContact N-O 3.15Å; I797-V804 PolarHBondContact O-N 3.03Å
805	G	59.5	Low	54.8	Low	19 Å²	19	58.1 Å²	58.1	20%	0.196	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.4	178.1	0	0	0	0	0	113.8	H835	G805-H835 PolarHBondContact N-O 3.3Å; G805-H835 PolarHBondContact O-N 2.9Å
806	L	61.1	Low	52.9	Low	16 Å²	16	69.6 Å²	69.6	8%	0.084	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	122.9	-180	-89	156.8	0	0	0	111.1	I689 D794 L795 I834	I689-L806 HydrophobicContact CD1-CD1 3.41Å; I689-L806 VanDerWaalsContact CD1-CD1 3.41Å; I689-L806 HydrophobicContact CD1-CD2 3.39Å; I689-L806 HydrophobicContact CD1-CG 3.92Å; D794-L806 CarbonylContact C-O 3.56Å; D794-L806 VanDerWaalsContact CA-O 3.32Å; D794-L806 WeakPolarHBondContact CA-O 3.35Å; L795-L806 HydrophobicContact CB-CB 4.13Å; L795-L806 HydrophobicContact CD2-CD1 4.27Å; L795-L806 PolarHBondContact N-O 3.15Å; L795-L806 PolarHBondContact O-N 2.82Å; L806-I834 HydrophobicContact CD2-CD1 4.31Å; L806-I834 HydrophobicContact CD2-CG1 3.86Å
807	R	63.6	Low	51.2	Low	73 Å²	73	76.9 Å²	76.9	28%	0.275	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.3	-174.9	-179.7	167.1	-78.4	165.1	-1.1	113.1	L791 D794 Y809 S833	L791-R807 HydrophobicContact CD2-CG 3.81Å; L791-R807 HydrophobicContact CG-CG 4.21Å; D794-R807 VanDerWaalsContact OD1-CB 3.28Å; D794-R807 WeakPolarHBondContact OD1-CB 3.23Å; D794-R807 WeakPolarHBondContact OD1-CG 3.22Å; D794-R807 IonicContact OD1-CZ 3.42Å; D794-R807 IonicContact OD1-NE 3.6Å; D794-R807 PolarHBondContact OD1-NE 3.47Å; D794-R807 IonicContact OD1-NH2 2.72Å; D794-R807 IonicContact OD2-CZ 3.97Å; D794-R807 IonicContact OD2-NE 3.49Å; D794-R807 PolarHBondContact OD2-NE 3.44Å; D794-R807 IonicContact OD2-NH2 3.21Å; D794-R807 PolarHBondContact OD2-NH2 3.1Å; R807-Y809 HydrophobicContact CB-CE2 4.21Å; R807-Y809 WeakPolarHBondContact CD-OH 3.34Å; R807-Y809 HydrophobicContact CG-CD2 4.17Å; R807-Y809 HydrophobicContact CG-CE2 3.53Å; R807-S833 WeakPolarHBondContact CB-O 3.34Å; R807-S833 PolarHBondContact N-O 3.36Å; R807-S833 PolarHBondContact O-N 3.13Å
808	I	62.3	Low	49.6	Very low	15 Å²	15	85 Å²	85	8%	0.077	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	130.6	-172.2	-56.3	168	0	0	0	110.6	V698 I712 I792 F793	V698-I808 HydrophobicContact CG2-CD1 3.87Å; I712-I808 HydrophobicContact CD1-CD1 4.1Å; I792-I808 HydrophobicContact CD1-CG2 4.43Å; I792-I808 PolarHBondContact N-O 3.19Å; F793-I808 HydrophobicContact CB-CD1 4.4Å; F793-I808 PolarHBondContact O-N 3.35Å
809	Y	55.3	Low	48	Very low	50 Å²	50	89.4 Å²	89.4	20%	0.196	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.4	-178.6	-53.9	-114.4	0	0	0	112	P789 T790 L791 R807 I831 S833	P789-Y809 HydrophobicContact CG-CD1 4.47Å; T790-Y809 CarbonylContact O-C 3.57Å; T790-Y809 WeakPolarHBondContact O-CA 3.38Å; L791-Y809 HydrophobicContact CB-CD1 4.02Å; L791-Y809 HydrophobicContact CB-CE1 4.32Å; L791-Y809 HydrophobicContact CD1-CD1 4.24Å; L791-Y809 HydrophobicContact CD1-CE1 3.68Å; L791-Y809 HydrophobicContact CG-CD1 3.73Å; L791-Y809 HydrophobicContact CG-CE1 3.65Å; L791-Y809 HydrophobicContact CG-CG 4.38Å; R807-Y809 HydrophobicContact CB-CE2 4.21Å; R807-Y809 WeakPolarHBondContact CD-OH 3.34Å; R807-Y809 HydrophobicContact CG-CD2 4.17Å; R807-Y809 HydrophobicContact CG-CE2 3.53Å; Y809-I831 WeakPolarHBondContact CB-O 3.43Å; Y809-I831 WeakPolarHBondContact CD2-O 3.24Å; Y809-S833 WeakPolarHBondContact CE2-OG 3.33Å; Y809-S833 PolarHBondContact OH-OG 2.95Å; Y809-S833 VanDerWaalsContact OH-OG 3.06Å
810	T	51.1	Low	46.4	Very low	29 Å²	29	97.4 Å²	97.4	18%	0.178	48%	0.48	C	S	.	.			trans	-97.9	137.6	176.7	-2.1	0	0	0	0	112.9	F700 P789 T790 I792	F700-T810 HydrophobicContact CE1-CG2 4.43Å; F700-T810 HydrophobicContact CZ-CG2 4.31Å; P789-T810 WeakPolarHBondContact CB-O 3.47Å; T790-T810 PolarHBondContact O-N 3.5Å; T790-T810 PolarHBondContact O-OG1 3.49Å; T790-T810 WeakPolarHBondContact OG1-CB 3.36Å; T790-T810 PolarHBondContact OG1-OG1 3.09Å; I792-T810 HydrophobicContact CD1-CG2 3.76Å; I792-T810 VanDerWaalsContact CD1-OG1 3.26Å; I792-T810 WeakPolarHBondContact CD1-OG1 3.45Å; I792-T810 VanDerWaalsContact CG1-OG1 3.25Å; I792-T810 WeakPolarHBondContact CG1-OG1 3.31Å
811	P	45.6	Very low	44.8	Very low	70 Å²	70	103.8 Å²	103.8	46%	0.455	51%	0.507	S	S	.	.			trans	-86.5	107.8	167.8	34.2	-34	0	0	0	112.5	S830	P811-S830 WeakPolarHBondContact CG-OG 3.23Å
812	L	38.9	Very low	43.6	Very low	131 Å²	131	105.8 Å²	105.8	69%	0.686	52%	0.518	S	S	*	.			trans	34.9	92.1	153.1	-75.5	160.7	0	0	0	119	S814	L812-S814 PolarHBondContact O-N 3.12Å
813	F	38.2	Very low	42.4	Very low	162 Å²	162	114 Å²	114	71%	0.711	55%	0.552	S	S	*	*			trans	-71.2	72.9	154.9	-106	-84.7	0	0	0	110.8	E708	E708-F813 WeakPolarHBondContact OE2-CZ 3.48Å
814	S	30.9	Very low	40.8	Very low	80 Å²	80	114 Å²	114	56%	0.559	57%	0.573	S	S	*	*			trans	-148.1	79.3	-178.2	-163.2	0	0	0	0	112.3	L812	L812-S814 PolarHBondContact O-N 3.12Å
815	N	31.5	Very low	39.4	Very low	162 Å²	162	116.7 Å²	116.7	87%	0.866	60%	0.603	S	S	*	*			trans	169.2	73.3	152.2	-90.7	-24.2	0	0	0	112.2
816	R	31.7	Very low	37.8	Very low	243 Å²	243	122.2 Å²	122.2	92%	0.917	63%	0.633	S	S	*	*			trans	-144.1	68.3	167.1	-76.3	-163.3	177.4	172.4	2.2	113.4
817	K	32.8	Very low	36.2	Very low	204 Å²	204	128 Å²	128	89%	0.887	67%	0.669	S	S	*	*	S	Bend	trans	-158.4	112.5	154.2	-114.8	164.5	-171.6	173.7	0	111.8
818	K	33.3	Very low	34.6	Very low	186 Å²	186	133.8 Å²	133.8	81%	0.809	70%	0.695	S	S	*	*	S	Bend	trans	69.3	107	168.8	-64.2	-159.1	172	-165.5	0	119.2
819	D	29	Very low	33.2	Very low	127 Å²	127	136.1 Å²	136.1	68%	0.679	72%	0.724	S	S	*	*				71.6	111.9	127.3	-53.2	-45.8	0	0	0	121.5
820	K	28.3	Very low	32.1	Very low	198 Å²	198	136.9 Å²	136.9	86%	0.861	74%	0.736	S	S	*	*			trans	45.9	85.3	140	-59.8	179.3	179.7	178.1	0	118
821	M	25.3	Very low	31.5	Very low	175 Å²	175	140.9 Å²	140.9	86%	0.862	76%	0.755	S	S	*	*			trans	-162.2	146	132.7	-116.3	-178.2	179	0	0	115.4
822	L	29.5	Very low	31.5	Very low	157 Å²	157	139.4 Å²	139.4	82%	0.822	75%	0.745	S	S	*	*			trans	69.1	128.6	154.9	-66.5	162.5	0	0	0	120.4
823	Q	28.1	Very low	31.6	Very low	196 Å²	196	134.4 Å²	134.4	92%	0.916	72%	0.721	S	S	*	*			trans	-87.8	151.4	174.3	-61.1	146.4	-61.1	0	0	110.8
824	G	25.2	Very low	31.8	Very low	87 Å²	87	129.5 Å²	129.5	90%	0.897	70%	0.701	S	S	*	*			trans	86.3	110.8	161.9	0	0	0	0	0	116
825	G	25.6	Very low	32.6	Very low	71 Å²	71	130.2 Å²	130.2	73%	0.732	70%	0.696	S	S	*	*			trans	167.5	106.1	173.7	0	0	0	0	0	113.5
826	V	25.8	Very low	33	Very low	135 Å²	135	126 Å²	126	82%	0.818	68%	0.679	S	S	*	*			trans	-55.7	130.2	-179.9	176.8	0	0	0	0	112.7	K828	V826-K828 HydrophobicContact CG1-CG 4.44Å
827	V	29.2	Very low	33.4	Very low	138 Å²	138	119.5 Å²	119.5	84%	0.836	66%	0.662	S	S	*	*			trans	-122.2	136.2	167.9	-176.8	0	0	0	0	109.6
828	K	29.8	Very low	33.3	Very low	193 Å²	193	118.4 Å²	118.4	84%	0.839	66%	0.658	S	S	*	*			trans	-109.3	125.4	-170.7	-75.4	-178.8	174.5	178.3	0	113.8	V826	V826-K828 HydrophobicContact CG1-CG 4.44Å
829	G	31.3	Very low	33	Very low	65 Å²	65	115 Å²	115	67%	0.67	66%	0.658	S	S	*	*			trans	72.5	116.6	130.4	0	0	0	0	0	120
830	S	34	Very low	33	Very low	66 Å²	66	114.6 Å²	114.6	46%	0.462	66%	0.659	S	S	.	*			trans	-67.4	140.8	153	-50.2	0	0	0	0	110.2	P811	P811-S830 WeakPolarHBondContact CG-OG 3.23Å
831	I	38.1	Very low	33.1	Very low	112 Å²	112	110.8 Å²	110.8	57%	0.574	65%	0.652	S	S	*	*			trans	-109	132.9	175.7	-59.4	173.6	0	0	0	108	Y809	Y809-I831 WeakPolarHBondContact CB-O 3.43Å; Y809-I831 WeakPolarHBondContact CD2-O 3.24Å
832	V	44.8	Very low	33.3	Very low	40 Å²	40	111 Å²	111	24%	0.242	65%	0.651	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.5	135.2	166.7	167.8	0	0	0	0	106.4	F687	F687-V832 HydrophobicContact CD1-CB 4.11Å; F687-V832 HydrophobicContact CD1-CG2 4.34Å; F687-V832 HydrophobicContact CD2-CG2 3.92Å; F687-V832 HydrophobicContact CE1-CB 3.9Å; F687-V832 HydrophobicContact CE1-CG2 4.03Å; F687-V832 HydrophobicContact CE2-CB 4.33Å; F687-V832 HydrophobicContact CE2-CG2 3.57Å; F687-V832 HydrophobicContact CG-CB 4.41Å; F687-V832 HydrophobicContact CG-CG2 4.29Å; F687-V832 HydrophobicContact CZ-CB 4.02Å; F687-V832 HydrophobicContact CZ-CG2 3.63Å
833	S	40.6	Very low	33.4	Very low	25 Å²	25	112.3 Å²	112.3	18%	0.175	65%	0.653	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.1	128.2	-178.9	62	0	0	0	0	111.6	R807 Y809 H835	R807-S833 WeakPolarHBondContact CB-O 3.34Å; R807-S833 PolarHBondContact N-O 3.36Å; R807-S833 PolarHBondContact O-N 3.13Å; Y809-S833 WeakPolarHBondContact CE2-OG 3.33Å; Y809-S833 PolarHBondContact OH-OG 2.95Å; Y809-S833 VanDerWaalsContact OH-OG 3.06Å; S833-H835 PolarHBondContact OG-CE1 3.06Å
834	I	42.7	Very low	33.7	Very low	59 Å²	59	107.4 Å²	107.4	30%	0.303	64%	0.64	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.2	127.1	178	-54.1	-178.7	0	0	0	107.5	T677 T679 I689 L806	T677-I834 HydrophobicContact CG2-CG2 4.12Å; T679-I834 HydrophobicContact CG2-CD1 4.26Å; I689-I834 HydrophobicContact CG1-CD1 4.43Å; L806-I834 HydrophobicContact CD2-CD1 4.31Å; L806-I834 HydrophobicContact CD2-CG1 3.86Å
835	H	48.3	Very low	34.2	Very low	95 Å²	95	106.9 Å²	106.9	44%	0.44	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.8	114.2	179	-70.7	76.7	0	0	0	109.8	G805 S833	G805-H835 PolarHBondContact N-O 3.3Å; G805-H835 PolarHBondContact O-N 2.9Å; S833-H835 PolarHBondContact OG-CE1 3.06Å
836	S	40.3	Very low	34.6	Very low	74 Å²	74	110.4 Å²	110.4	52%	0.517	62%	0.621	S	S	.	*			trans	-109.4	90.5	177.7	178	0	0	0	0	109.1
837	N	38.4	Very low	35.2	Very low	106 Å²	106	113.8 Å²	113.8	57%	0.567	62%	0.619	S	S	*	*			trans	-100.9	108.4	-179.6	-106.5	21.7	0	0	0	111	S839	N837-S839 PolarHBondContact O-N 2.81Å
838	K	30.9	Very low	35.7	Very low	182 Å²	182	111.9 Å²	111.9	79%	0.791	61%	0.607	S	S	*	*			trans	-69.3	114.6	159.1	-84.9	-174.9	172.3	-177.5	0	109.7	T840	K838-T840 PolarHBondContact O-N 2.96Å; K838-T840 VanDerWaalsContact O-N 3.13Å
839	S	28.1	Very low	36.2	Very low	115 Å²	115	110.3 Å²	110.3	80%	0.804	61%	0.605	S	S	*	*	S	Bend	trans	48.6	46	143.7	66.2	0	0	0	0	119.3	N837	N837-S839 PolarHBondContact O-N 2.81Å
840	T	28.9	Very low	36.5	Very low	117 Å²	117	113.8 Å²	113.8	72%	0.718	60%	0.602	S	S	*	*			trans	-151.6	74.6	160.9	52.8	0	0	0	0	111.7	K838	K838-T840 PolarHBondContact O-N 2.96Å; K838-T840 VanDerWaalsContact O-N 3.13Å
841	V	30	Very low	36.9	Very low	118 Å²	118	112.9 Å²	112.9	72%	0.715	60%	0.595	S	S	*	*			trans	-138	54.7	175.4	-162.7	0	0	0	0	111.7
842	E	29.4	Very low	37.5	Very low	180 Å²	180	110.8 Å²	110.8	84%	0.841	59%	0.589	S	S	*	*	S	Bend	trans	-152.4	176.4	161.2	-115.1	157.3	-163.4	0	0	109.2	S844	E842-S844 VanDerWaalsContact C-N 3.32Å; E842-S844 PolarHBondContact O-N 2.86Å
843	E	31.7	Very low	37.9	Very low	185 Å²	185	114 Å²	114	86%	0.864	60%	0.604	S	S	*	*	S	Bend	trans	64.6	-31.8	178.9	-55.4	-159.4	123	0	0	120.5	S845	E843-S845 PolarHBondContact O-N 2.89Å
844	S	34.6	Very low	38.6	Very low	92 Å²	92	117.3 Å²	117.3	64%	0.643	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-16.8	-169.1	70.4	0	0	0	0	116.4	E842 H846	E842-S844 VanDerWaalsContact C-N 3.32Å; E842-S844 PolarHBondContact O-N 2.86Å; S844-H846 PolarHBondContact O-N 2.85Å
845	S	36	Very low	39.7	Very low	77 Å²	77	121.3 Å²	121.3	54%	0.538	64%	0.635	S	S	.	*	H	α-helix	trans	-71.8	-27.5	-168.8	59.4	0	0	0	0	115.4	E843 V848	E843-S845 PolarHBondContact O-N 2.89Å; S845-V848 PolarHBondContact O-N 2.88Å
846	H	34	Very low	40.7	Very low	145 Å²	145	121.3 Å²	121.3	67%	0.671	64%	0.637	S	S	*	*	H	α-helix	trans	-69.3	-35.7	-177.8	-90.8	-113	0	0	0	113.1	S844 V848 M849 F850	S844-H846 PolarHBondContact O-N 2.85Å; H846-V848 VanDerWaalsContact C-N 3.31Å; H846-V848 PolarHBondContact O-N 2.84Å; H846-M849 PolarHBondContact O-N 2.82Å; H846-F850 WeakPolarHBondContact O-CD2 3.41Å
847	W	37.2	Very low	41.8	Very low	205 Å²	205	120.9 Å²	120.9	78%	0.777	63%	0.632	S	S	*	*	H	α-helix	trans	-71.2	-26.7	175.5	-73.6	99.8	0	0	0	112.6	M849 F850 S851	W847-M849 VanDerWaalsContact C-N 3.3Å; W847-M849 PolarHBondContact O-N 3.49Å; W847-F850 PolarHBondContact O-N 2.89Å; W847-S851 WeakPolarHBondContact O-CB 3.38Å; W847-S851 PolarHBondContact O-N 2.81Å
848	V	40.1	Very low	43.4	Very low	99 Å²	99	119.7 Å²	119.7	60%	0.6	63%	0.625	S	S	*	*	H	α-helix	trans	-70.6	-22.2	178.1	-179.5	0	0	0	0	112.6	S845 H846 P852	S845-V848 PolarHBondContact O-N 2.88Å; H846-V848 VanDerWaalsContact C-N 3.31Å; H846-V848 PolarHBondContact O-N 2.84Å; V848-P852 WeakPolarHBondContact O-CD 3.26Å; V848-P852 WeakPolarHBondContact O-CG 3.26Å
849	M	40.6	Very low	45.2	Very low	160 Å²	160	112.9 Å²	112.9	79%	0.788	61%	0.606	S	S	*	*	H	α-helix	trans	-76.6	-36.2	171	-80.1	-155.8	171.6	0	0	113.5	H846 W847	H846-M849 PolarHBondContact O-N 2.82Å; W847-M849 VanDerWaalsContact C-N 3.3Å; W847-M849 PolarHBondContact O-N 3.49Å
850	F	38.2	Very low	47.4	Very low	137 Å²	137	109 Å²	109	60%	0.601	58%	0.575	S	S	*	*	H	α-helix	trans	-88.3	-30.4	-179.2	-68.5	-72.8	0	0	0	113.5	H846 W847 L853 L854	H846-F850 WeakPolarHBondContact O-CD2 3.41Å; W847-F850 PolarHBondContact O-N 2.89Å; F850-L853 CarbonylContact O-C 3.53Å; F850-L853 WeakPolarHBondContact O-CB 3.38Å; F850-L853 PolarHBondContact O-N 3.22Å; F850-L853 VanDerWaalsContact O-N 3.07Å; F850-L854 WeakPolarHBondContact O-CB 3.45Å; F850-L854 PolarHBondContact O-N 2.99Å
851	S	42.2	Very low	49.1	Very low	47 Å²	47	106.9 Å²	106.9	33%	0.329	57%	0.565	S	S	.	*	H	α-helix	trans	-55.7	-49.7	-177.1	171.8	0	0	0	0	113.6	W847 L853 L854 F855	W847-S851 WeakPolarHBondContact O-CB 3.38Å; W847-S851 PolarHBondContact O-N 2.81Å; S851-L853 VanDerWaalsContact C-N 3.28Å; S851-L853 PolarHBondContact O-N 2.86Å; S851-L854 PolarHBondContact O-N 2.81Å; S851-F855 VanDerWaalsContact O-CD2 3.24Å; S851-F855 WeakPolarHBondContact O-CD2 3.44Å; S851-F855 PolarHBondContact O-N 3.41Å; S851-F855 WeakPolarHBondContact OG-CD2 3.15Å; S851-F855 WeakPolarHBondContact OG-CE2 3.44Å
852	P	49.7	Very low	51.2	Low	68 Å²	68	106.3 Å²	106.3	44%	0.442	56%	0.558	S	S	.	*	H	α-helix	trans	-60.1	-37.3	175.1	-23.1	33.9	0	0	0	112.7	V848 I856	V848-P852 WeakPolarHBondContact O-CD 3.26Å; V848-P852 WeakPolarHBondContact O-CG 3.26Å; P852-I856 WeakPolarHBondContact O-CB 3.45Å; P852-I856 WeakPolarHBondContact O-CD1 3.44Å; P852-I856 WeakPolarHBondContact O-CG1 3.32Å; P852-I856 PolarHBondContact O-N 2.79Å
853	L	53.8	Low	53.4	Low	107 Å²	107	103.2 Å²	103.2	56%	0.56	55%	0.547	S	S	*	.	H	α-helix	trans	-72.1	-34.3	179.9	-129.3	160.2	0	0	0	111.6	F850 S851 T857	F850-L853 CarbonylContact O-C 3.53Å; F850-L853 WeakPolarHBondContact O-CB 3.38Å; F850-L853 PolarHBondContact O-N 3.22Å; F850-L853 VanDerWaalsContact O-N 3.07Å; S851-L853 VanDerWaalsContact C-N 3.28Å; S851-L853 PolarHBondContact O-N 2.86Å; L853-T857 HydrophobicContact CD2-CG2 4.4Å; L853-T857 WeakPolarHBondContact O-CB 3.36Å; L853-T857 WeakPolarHBondContact O-CG2 3.35Å; L853-T857 PolarHBondContact O-N 3.38Å; L853-T857 PolarHBondContact O-OG1 2.79Å
854	L	56.5	Low	55.2	Low	96 Å²	96	98.8 Å²	98.8	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-72.6	-44.7	174.7	-166.6	127.6	0	0	0	111.3	F850 S851 I856 T857 I858	F850-L854 WeakPolarHBondContact O-CB 3.45Å; F850-L854 PolarHBondContact O-N 2.99Å; S851-L854 PolarHBondContact O-N 2.81Å; L854-I856 VanDerWaalsContact C-N 3.35Å; L854-I856 PolarHBondContact O-N 3.49Å; L854-T857 WeakPolarHBondContact CA-OG1 3.2Å; L854-T857 PolarHBondContact O-N 3.22Å; L854-T857 PolarHBondContact O-OG1 3.03Å; L854-T857 VanDerWaalsContact O-OG1 3.08Å; L854-I858 HydrophobicContact CD2-CD1 3.62Å; L854-I858 HydrophobicContact CG-CD1 4.21Å; L854-I858 WeakPolarHBondContact O-CB 3.27Å; L854-I858 VanDerWaalsContact O-CG1 3.29Å; L854-I858 WeakPolarHBondContact O-CG1 3.29Å; L854-I858 PolarHBondContact O-N 3.41Å
855	F	65.2	Low	57	Low	142 Å²	142	100.6 Å²	100.6	62%	0.623	52%	0.519	S	S	*	.	H	α-helix	trans	-63.8	-37.3	171.4	-79.6	-63	0	0	0	112.6	S851 G859	S851-F855 VanDerWaalsContact O-CD2 3.24Å; S851-F855 WeakPolarHBondContact O-CD2 3.44Å; S851-F855 PolarHBondContact O-N 3.41Å; S851-F855 WeakPolarHBondContact OG-CD2 3.15Å; S851-F855 WeakPolarHBondContact OG-CE2 3.44Å; F855-G859 PolarHBondContact O-N 2.83Å
856	I	69.4	Low	58.9	Low	96 Å²	96	101.4 Å²	101.4	49%	0.492	52%	0.517	S	S	.	.	H	α-helix	trans	-65.9	-46.1	173.4	-75.9	165.8	0	0	0	110.6	P852 L854 G859 I860	P852-I856 WeakPolarHBondContact O-CB 3.45Å; P852-I856 WeakPolarHBondContact O-CD1 3.44Å; P852-I856 WeakPolarHBondContact O-CG1 3.32Å; P852-I856 PolarHBondContact O-N 2.79Å; L854-I856 VanDerWaalsContact C-N 3.35Å; L854-I856 PolarHBondContact O-N 3.49Å; I856-G859 PolarHBondContact O-N 3.21Å; I856-I860 HydrophobicContact CG2-CD1 3.53Å; I856-I860 HydrophobicContact CG2-CG1 4.28Å; I856-I860 WeakPolarHBondContact O-CB 3.38Å; I856-I860 WeakPolarHBondContact O-CD1 3.39Å; I856-I860 WeakPolarHBondContact O-CG1 3.5Å; I856-I860 PolarHBondContact O-N 2.88Å
857	T	63.2	Low	60.8	Low	65 Å²	65	98.3 Å²	98.3	40%	0.399	51%	0.508	S	S	.	.	H	α-helix	trans	-68	-37.2	178.6	47	0	0	0	0	113.1	L853 L854 S861	L853-T857 HydrophobicContact CD2-CG2 4.4Å; L853-T857 WeakPolarHBondContact O-CB 3.36Å; L853-T857 WeakPolarHBondContact O-CG2 3.35Å; L853-T857 PolarHBondContact O-N 3.38Å; L853-T857 PolarHBondContact O-OG1 2.79Å; L854-T857 WeakPolarHBondContact CA-OG1 3.2Å; L854-T857 PolarHBondContact O-N 3.22Å; L854-T857 PolarHBondContact O-OG1 3.03Å; L854-T857 VanDerWaalsContact O-OG1 3.08Å; T857-S861 VanDerWaalsContact O-CB 3.28Å; T857-S861 WeakPolarHBondContact O-CB 3.34Å; T857-S861 PolarHBondContact O-N 2.66Å; T857-S861 PolarHBondContact O-OG 2.92Å
858	I	71	Confident	62.5	Low	81 Å²	81	92.2 Å²	92.2	42%	0.415	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-43.6	170.2	-69.6	170.9	0	0	0	110.3	L854 S861 L862	L854-I858 HydrophobicContact CD2-CD1 3.62Å; L854-I858 HydrophobicContact CG-CD1 4.21Å; L854-I858 WeakPolarHBondContact O-CB 3.27Å; L854-I858 VanDerWaalsContact O-CG1 3.29Å; L854-I858 WeakPolarHBondContact O-CG1 3.29Å; L854-I858 PolarHBondContact O-N 3.41Å; I858-S861 PolarHBondContact O-N 3.16Å; I858-L862 HydrophobicContact CG2-CD1 3.84Å; I858-L862 HydrophobicContact CG2-CG 4.32Å; I858-L862 WeakPolarHBondContact O-CB 3.49Å; I858-L862 WeakPolarHBondContact O-CG 3.4Å; I858-L862 PolarHBondContact O-N 2.68Å
859	G	70.2	Confident	64	Low	38 Å²	38	91.3 Å²	91.3	39%	0.392	48%	0.481	S	S	.	.	H	α-helix	trans	-62.6	-42.2	176.5	0	0	0	0	0	113.3	F855 I856 L863	F855-G859 PolarHBondContact O-N 2.83Å; I856-G859 PolarHBondContact O-N 3.21Å; G859-L863 WeakPolarHBondContact O-CB 3.29Å; G859-L863 PolarHBondContact O-N 3.41Å
860	I	73.5	Confident	65.7	Low	33 Å²	33	87.8 Å²	87.8	17%	0.169	47%	0.465	C	S	.	.	H	α-helix	trans	-65.2	-42.5	172.7	-63.9	155.3	0	0	0	110.2	I856 L863 Y864 T1645 L1649	I856-I860 HydrophobicContact CG2-CD1 3.53Å; I856-I860 HydrophobicContact CG2-CG1 4.28Å; I856-I860 WeakPolarHBondContact O-CB 3.38Å; I856-I860 WeakPolarHBondContact O-CD1 3.39Å; I856-I860 WeakPolarHBondContact O-CG1 3.5Å; I856-I860 PolarHBondContact O-N 2.88Å; I860-L863 PolarHBondContact O-N 3.25Å; I860-Y864 WeakPolarHBondContact O-CB 3.38Å; I860-Y864 PolarHBondContact O-N 3.01Å; I860-T1645 HydrophobicContact CG2-CG2 4.46Å; I860-L1649 HydrophobicContact CD1-CD1 3.46Å; I860-L1649 VanDerWaalsContact CD1-CD1 3.46Å; I860-L1649 HydrophobicContact CD1-CG 4.26Å; I860-L1649 HydrophobicContact CG1-CD1 3.97Å; I860-L1649 HydrophobicContact CG1-CG 4.27Å
861	S	65.6	Low	66.9	Low	73 Å²	73	85.9 Å²	85.9	51%	0.51	46%	0.456	S	S	.	.	H	α-helix	trans	-66.7	-41.9	179.9	-59.8	0	0	0	0	111.6	T857 I858 Y864 F865	T857-S861 VanDerWaalsContact O-CB 3.28Å; T857-S861 WeakPolarHBondContact O-CB 3.34Å; T857-S861 PolarHBondContact O-N 2.66Å; T857-S861 PolarHBondContact O-OG 2.92Å; I858-S861 PolarHBondContact O-N 3.16Å; S861-Y864 PolarHBondContact O-N 3.02Å; S861-F865 VanDerWaalsContact O-CB 3.22Å; S861-F865 WeakPolarHBondContact O-CB 3.41Å; S861-F865 PolarHBondContact O-N 3.31Å
862	L	73.5	Confident	68.1	Low	107 Å²	107	87.6 Å²	87.6	56%	0.56	47%	0.465	S	S	*	.	H	α-helix	trans	-65.8	-41.8	173	-75.6	171.4	0	0	0	111.6	I858 F865 L866	I858-L862 HydrophobicContact CG2-CD1 3.84Å; I858-L862 HydrophobicContact CG2-CG 4.32Å; I858-L862 WeakPolarHBondContact O-CB 3.49Å; I858-L862 WeakPolarHBondContact O-CG 3.4Å; I858-L862 PolarHBondContact O-N 2.68Å; L862-F865 PolarHBondContact O-N 3.08Å; L862-L866 WeakPolarHBondContact O-CB 3.4Å; L862-L866 PolarHBondContact O-N 3.02Å
863	L	75.1	Confident	69	Low	115 Å²	115	92.2 Å²	92.2	60%	0.602	47%	0.474	S	S	*	.	H	α-helix	trans	-65.1	-41.1	175.4	-174.3	69.2	0	0	0	111.4	G859 I860 L866 V867	G859-L863 WeakPolarHBondContact O-CB 3.29Å; G859-L863 PolarHBondContact O-N 3.41Å; I860-L863 PolarHBondContact O-N 3.25Å; L863-L866 PolarHBondContact O-N 3.32Å; L863-V867 WeakPolarHBondContact O-CB 3.46Å; L863-V867 VanDerWaalsContact O-CG2 3.25Å; L863-V867 WeakPolarHBondContact O-CG2 3.26Å; L863-V867 PolarHBondContact O-N 3.44Å
864	Y	69.6	Low	69.5	Low	92 Å²	92	91.1 Å²	91.1	36%	0.361	47%	0.468	S	S	.	.	H	α-helix	trans	-68.7	-36.6	176.7	-167.7	-98.9	0	0	0	111.4	I860 S861 V867 L868 V1648	I860-Y864 WeakPolarHBondContact O-CB 3.38Å; I860-Y864 PolarHBondContact O-N 3.01Å; S861-Y864 PolarHBondContact O-N 3.02Å; Y864-V867 PolarHBondContact O-N 3.47Å; Y864-L868 HydrophobicContact CD1-CD1 3.94Å; Y864-L868 HydrophobicContact CE1-CD1 3.63Å; Y864-L868 HydrophobicContact CE1-CG 4.36Å; Y864-L868 WeakPolarHBondContact O-CB 3.44Å; Y864-L868 PolarHBondContact O-N 3.31Å; Y864-V1648 HydrophobicContact CD2-CG1 4.14Å; Y864-V1648 HydrophobicContact CE2-CG1 4.28Å
865	F	72.6	Confident	69.1	Low	130 Å²	130	92.4 Å²	92.4	57%	0.57	47%	0.47	S	S	*	.	H	α-helix	trans	-69.6	-38.4	172.9	-165.4	-108.9	0	0	0	111.8	S861 L862 L868 I869	S861-F865 VanDerWaalsContact O-CB 3.22Å; S861-F865 WeakPolarHBondContact O-CB 3.41Å; S861-F865 PolarHBondContact O-N 3.31Å; L862-F865 PolarHBondContact O-N 3.08Å; F865-L868 PolarHBondContact O-N 2.89Å; F865-I869 HydrophobicContact CD1-CD1 3.69Å; F865-I869 HydrophobicContact CD1-CG1 4.47Å; F865-I869 HydrophobicContact CE1-CD1 3.55Å; F865-I869 HydrophobicContact CE1-CG1 4.38Å; F865-I869 HydrophobicContact CZ-CD1 4.3Å; F865-I869 WeakPolarHBondContact O-CB 3.49Å; F865-I869 WeakPolarHBondContact O-CG1 3.5Å; F865-I869 PolarHBondContact O-N 3.35Å
866	L	75	Confident	68.4	Low	93 Å²	93	93 Å²	93	49%	0.487	47%	0.474	S	S	.	.	H	α-helix	trans	-65.2	-41.5	170.7	-106.8	166.6	0	0	0	111.8	L862 L863 L868 I869 I870	L862-L866 WeakPolarHBondContact O-CB 3.4Å; L862-L866 PolarHBondContact O-N 3.02Å; L863-L866 PolarHBondContact O-N 3.32Å; L866-L868 VanDerWaalsContact C-N 3.32Å; L866-I869 PolarHBondContact O-N 3.04Å; L866-I870 HydrophobicContact CD2-CD1 4.13Å; L866-I870 WeakPolarHBondContact O-CB 3.49Å; L866-I870 WeakPolarHBondContact O-CD1 3.5Å; L866-I870 WeakPolarHBondContact O-CG1 3.33Å; L866-I870 PolarHBondContact O-N 2.87Å
867	V	75.3	Confident	67.3	Low	80 Å²	80	92 Å²	92	49%	0.485	48%	0.475	S	S	.	.	H	α-helix	trans	-68.2	-32.2	174.4	168.5	0	0	0	0	111	L863 Y864 F871	L863-V867 WeakPolarHBondContact O-CB 3.46Å; L863-V867 VanDerWaalsContact O-CG2 3.25Å; L863-V867 WeakPolarHBondContact O-CG2 3.26Å; L863-V867 PolarHBondContact O-N 3.44Å; Y864-V867 PolarHBondContact O-N 3.47Å; V867-F871 WeakPolarHBondContact O-CA 3.5Å; V867-F871 WeakPolarHBondContact O-CB 3.46Å; V867-F871 PolarHBondContact O-N 3.11Å
868	L	71.2	Confident	66.3	Low	77 Å²	77	95.1 Å²	95.1	40%	0.403	49%	0.488	S	S	.	.	H	α-helix	trans	-70.4	-43.4	171.2	-102	167.3	0	0	0	112.1	Y864 F865 L866 F871 V872	Y864-L868 HydrophobicContact CD1-CD1 3.94Å; Y864-L868 HydrophobicContact CE1-CD1 3.63Å; Y864-L868 HydrophobicContact CE1-CG 4.36Å; Y864-L868 WeakPolarHBondContact O-CB 3.44Å; Y864-L868 PolarHBondContact O-N 3.31Å; F865-L868 PolarHBondContact O-N 2.89Å; L866-L868 VanDerWaalsContact C-N 3.32Å; L868-F871 PolarHBondContact O-N 2.88Å; L868-V872 WeakPolarHBondContact O-CB 3.45Å; L868-V872 VanDerWaalsContact O-CG2 3.26Å; L868-V872 WeakPolarHBondContact O-CG2 3.45Å; L868-V872 PolarHBondContact O-N 3.37Å
869	I	73.6	Confident	64.6	Low	81 Å²	81	97.2 Å²	97.2	42%	0.415	50%	0.499	S	S	.	.	H	α-helix	trans	-60.6	-49.3	172.8	-74	168.2	0	0	0	109.5	F865 L866 F871 V872 Y873	F865-I869 HydrophobicContact CD1-CD1 3.69Å; F865-I869 HydrophobicContact CD1-CG1 4.47Å; F865-I869 HydrophobicContact CE1-CD1 3.55Å; F865-I869 HydrophobicContact CE1-CG1 4.38Å; F865-I869 HydrophobicContact CZ-CD1 4.3Å; F865-I869 WeakPolarHBondContact O-CB 3.49Å; F865-I869 WeakPolarHBondContact O-CG1 3.5Å; F865-I869 PolarHBondContact O-N 3.35Å; L866-I869 PolarHBondContact O-N 3.04Å; I869-F871 VanDerWaalsContact C-N 3.34Å; I869-F871 PolarHBondContact O-N 2.96Å; I869-V872 PolarHBondContact O-N 3.28Å; I869-Y873 VanDerWaalsContact O-CB 3.25Å; I869-Y873 WeakPolarHBondContact O-CB 3.36Å; I869-Y873 PolarHBondContact O-N 2.85Å
870	I	74.9	Confident	62.6	Low	86 Å²	86	99.3 Å²	99.3	44%	0.441	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-37.5	177.7	-71	165.8	0	0	0	110.9	L866 Y873 I874	L866-I870 HydrophobicContact CD2-CD1 4.13Å; L866-I870 WeakPolarHBondContact O-CB 3.49Å; L866-I870 WeakPolarHBondContact O-CD1 3.5Å; L866-I870 WeakPolarHBondContact O-CG1 3.33Å; L866-I870 PolarHBondContact O-N 2.87Å; I870-Y873 PolarHBondContact O-N 2.87Å; I870-I874 HydrophobicContact CG2-CD1 3.56Å; I870-I874 HydrophobicContact CG2-CG1 4.19Å; I870-I874 WeakPolarHBondContact O-CB 3.27Å; I870-I874 WeakPolarHBondContact O-CG1 3.18Å; I870-I874 PolarHBondContact O-N 3.28Å
871	F	63.6	Low	60.5	Low	96 Å²	96	105.4 Å²	105.4	42%	0.421	54%	0.54	S	S	.	.	H	α-helix	trans	-70.3	-40	175.9	177.3	-100.5	0	0	0	112.1	V867 L868 I869 K875 I1882	V867-F871 WeakPolarHBondContact O-CA 3.5Å; V867-F871 WeakPolarHBondContact O-CB 3.46Å; V867-F871 PolarHBondContact O-N 3.11Å; L868-F871 PolarHBondContact O-N 2.88Å; I869-F871 VanDerWaalsContact C-N 3.34Å; I869-F871 PolarHBondContact O-N 2.96Å; F871-K875 HydrophobicContact CE1-CD 4.39Å; F871-K875 WeakPolarHBondContact O-CB 3.46Å; F871-K875 PolarHBondContact O-N 3.49Å; F871-I1882 HydrophobicContact CE2-CD1 3.91Å; F871-I1882 HydrophobicContact CZ-CD1 4.47Å
872	V	67.8	Low	58.7	Low	84 Å²	84	109.2 Å²	109.2	51%	0.509	55%	0.548	S	S	.	.	H	α-helix	trans	-63	-48.5	171.8	168.1	0	0	0	0	109.5	L868 I869 I874 K875 H876	L868-V872 WeakPolarHBondContact O-CB 3.45Å; L868-V872 VanDerWaalsContact O-CG2 3.26Å; L868-V872 WeakPolarHBondContact O-CG2 3.45Å; L868-V872 PolarHBondContact O-N 3.37Å; I869-V872 PolarHBondContact O-N 3.28Å; V872-I874 PolarHBondContact O-N 3.44Å; V872-K875 CarbonylContact O-C 3.6Å; V872-K875 PolarHBondContact O-N 2.91Å; V872-H876 VanDerWaalsContact O-CB 3.25Å; V872-H876 WeakPolarHBondContact O-CB 3.45Å; V872-H876 PolarHBondContact O-N 3.39Å
873	Y	67.8	Low	56.4	Low	164 Å²	164	107.7 Å²	107.7	64%	0.643	56%	0.558	S	S	*	*	H	α-helix	trans	-61.3	-45.3	178	-149.1	-79.4	0	0	0	111.5	I869 I870 H876 C877	I869-Y873 VanDerWaalsContact O-CB 3.25Å; I869-Y873 WeakPolarHBondContact O-CB 3.36Å; I869-Y873 PolarHBondContact O-N 2.85Å; I870-Y873 PolarHBondContact O-N 2.87Å; Y873-H876 CarbonylContact O-C 3.56Å; Y873-H876 PolarHBondContact O-N 2.76Å; Y873-C877 WeakPolarHBondContact O-CB 3.35Å; Y873-C877 PolarHBondContact O-N 2.88Å; Y873-C877 PolarHBondContact O-SG 3.01Å
874	I	64.1	Low	54	Low	85 Å²	85	110.9 Å²	110.9	44%	0.436	56%	0.563	S	S	.	*	H	α-helix	trans	-62.3	-43.6	174.2	-75.5	172.9	0	0	0	110.6	I870 V872 H876 C877 I878	I870-I874 HydrophobicContact CG2-CD1 3.56Å; I870-I874 HydrophobicContact CG2-CG1 4.19Å; I870-I874 WeakPolarHBondContact O-CB 3.27Å; I870-I874 WeakPolarHBondContact O-CG1 3.18Å; I870-I874 PolarHBondContact O-N 3.28Å; V872-I874 PolarHBondContact O-N 3.44Å; I874-H876 VanDerWaalsContact C-N 3.32Å; I874-H876 PolarHBondContact O-N 3.13Å; I874-C877 PolarHBondContact O-N 3.33Å; I874-I878 HydrophobicContact CG2-CD1 3.49Å; I874-I878 VanDerWaalsContact CG2-CD1 3.49Å; I874-I878 HydrophobicContact CG2-CG1 4.12Å; I874-I878 WeakPolarHBondContact O-CB 3.4Å; I874-I878 VanDerWaalsContact O-CG1 3.27Å; I874-I878 WeakPolarHBondContact O-CG1 3.46Å; I874-I878 PolarHBondContact O-N 3.1Å
875	K	48.5	Very low	51.9	Low	123 Å²	123	112.2 Å²	112.2	54%	0.535	58%	0.583	S	S	.	*	H	α-helix	trans	-65.7	-35.8	176.2	-169.6	178	-179.3	-173.5	0	111.7	F871 V872 I879	F871-K875 HydrophobicContact CE1-CD 4.39Å; F871-K875 WeakPolarHBondContact O-CB 3.46Å; F871-K875 PolarHBondContact O-N 3.49Å; V872-K875 CarbonylContact O-C 3.6Å; V872-K875 PolarHBondContact O-N 2.91Å; K875-I879 HydrophobicContact CG-CD1 3.95Å; K875-I879 VanDerWaalsContact O-CG1 3.28Å; K875-I879 WeakPolarHBondContact O-CG1 3.49Å; K875-I879 PolarHBondContact O-N 2.89Å; K875-I879 VanDerWaalsContact O-N 3.14Å
876	H	51.2	Low	49.8	Very low	153 Å²	153	110.7 Å²	110.7	71%	0.708	58%	0.58	S	S	*	*	H	α-helix	trans	-75.5	-23.4	177.7	-145.2	-40.3	0	0	0	113	V872 Y873 I874	V872-H876 VanDerWaalsContact O-CB 3.25Å; V872-H876 WeakPolarHBondContact O-CB 3.45Å; V872-H876 PolarHBondContact O-N 3.39Å; Y873-H876 CarbonylContact O-C 3.56Å; Y873-H876 PolarHBondContact O-N 2.76Å; I874-H876 VanDerWaalsContact C-N 3.32Å; I874-H876 PolarHBondContact O-N 3.13Å
877	C	46.5	Very low	47.4	Very low	76 Å²	76	109.6 Å²	109.6	51%	0.514	58%	0.58	S	S	.	*	H	α-helix	trans	-93.5	-27.4	173.4	-67.9	0	0	0	0	114	Y873 I874	Y873-C877 WeakPolarHBondContact O-CB 3.35Å; Y873-C877 PolarHBondContact O-N 2.88Å; Y873-C877 PolarHBondContact O-SG 3.01Å; I874-C877 PolarHBondContact O-N 3.33Å
878	I	41.6	Very low	45.3	Very low	131 Å²	131	109.8 Å²	109.8	67%	0.672	58%	0.581	S	S	*	*	H	α-helix	trans	-81.4	-27.4	177.3	-73.2	-177.9	0	0	0	111.4	I874 S880	I874-I878 HydrophobicContact CG2-CD1 3.49Å; I874-I878 VanDerWaalsContact CG2-CD1 3.49Å; I874-I878 HydrophobicContact CG2-CG1 4.12Å; I874-I878 WeakPolarHBondContact O-CB 3.4Å; I874-I878 VanDerWaalsContact O-CG1 3.27Å; I874-I878 WeakPolarHBondContact O-CG1 3.46Å; I874-I878 PolarHBondContact O-N 3.1Å; I878-S880 PolarHBondContact O-N 3.27Å
879	I	35.4	Very low	43.1	Very low	125 Å²	125	111.8 Å²	111.8	64%	0.641	59%	0.588	S	S	*	*	S	Bend	trans	-83.5	65.9	168.4	-54.8	170.9	0	0	0	108.7	K875	K875-I879 HydrophobicContact CG-CD1 3.95Å; K875-I879 VanDerWaalsContact O-CG1 3.28Å; K875-I879 WeakPolarHBondContact O-CG1 3.49Å; K875-I879 PolarHBondContact O-N 2.89Å; K875-I879 VanDerWaalsContact O-N 3.14Å
880	S	28.5	Very low	40.9	Very low	82 Å²	82	117.4 Å²	117.4	57%	0.573	61%	0.606	S	S	*	*			trans	-129.8	103.6	172	174.8	0	0	0	0	109.1	I878 K882	I878-S880 PolarHBondContact O-N 3.27Å; S880-K882 PolarHBondContact O-N 2.91Å
881	N	28	Very low	38.6	Very low	160 Å²	160	118.9 Å²	118.9	86%	0.856	61%	0.611	S	S	*	*			trans	-65.9	104.5	178.6	-77.2	-21.7	0	0	0	111.2
882	K	27.8	Very low	36.9	Very low	154 Å²	154	123 Å²	123	67%	0.67	63%	0.629	S	S	*	*			trans	-163.3	122.4	156.5	-101.9	144.7	-174.2	177	0	109.4	S880 Y884	S880-K882 PolarHBondContact O-N 2.91Å; K882-Y884 HydrophobicContact CB-CE2 3.69Å
883	G	25.3	Very low	35	Very low	75 Å²	75	127.5 Å²	127.5	77%	0.773	64%	0.644	S	S	*	*			trans	-85.4	146.4	174.5	0	0	0	0	0	111.5
884	Y	25.8	Very low	33.1	Very low	182 Å²	182	126.2 Å²	126.2	71%	0.714	65%	0.647	S	S	*	*			trans	-137.9	138.9	177.6	-69.4	-75.5	0	0	0	111.2	K882	K882-Y884 HydrophobicContact CB-CE2 3.69Å
885	P	25.2	Very low	31.4	Very low	119 Å²	119	126.7 Å²	126.7	77%	0.773	66%	0.658	S	S	*	*			trans	-80.9	146.4	-179.1	33.5	-35	0	0	0	111.8
886	I	28.8	Very low	30.4	Very low	99 Å²	99	127.8 Å²	127.8	51%	0.508	67%	0.669	S	S	.	*			trans	-129.9	117.1	172.7	-69.2	145.2	0	0	0	108.1	V888 W1904	I886-V888 HydrophobicContact CG2-CG2 4.42Å; I886-W1904 HydrophobicContact CD1-CH2 3.73Å; I886-W1904 HydrophobicContact CD1-CZ3 4.3Å; I886-W1904 HydrophobicContact CG1-CH2 3.93Å; I886-W1904 HydrophobicContact CG1-CZ2 4.42Å; I886-W1904 HydrophobicContact CG2-CH2 3.82Å; I886-W1904 HydrophobicContact CG2-CZ2 3.76Å
887	S	25.5	Very low	29.2	Very low	69 Å²	69	127.5 Å²	127.5	48%	0.483	67%	0.673	S	S	.	*			trans	-76.9	135	164.7	50	0	0	0	0	109.9
888	V	29.2	Very low	28.3	Very low	85 Å²	85	132 Å²	132	52%	0.515	69%	0.686	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.4	131.6	173.6	-178	0	0	0	0	109.4	I886 Y890	I886-V888 HydrophobicContact CG2-CG2 4.42Å; V888-Y890 HydrophobicContact CG1-CD2 4.31Å; V888-Y890 HydrophobicContact CG1-CE2 4.25Å
889	E	25.9	Very low	27.7	Very low	119 Å²	119	136.8 Å²	136.8	56%	0.556	70%	0.697	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-109.4	121.8	-173.7	179.7	-179.3	-149.6	0	0	109.1	L903	E889-L903 HydrophobicContact CG-CD2 3.93Å
890	Y	27.4	Very low	27.4	Very low	198 Å²	198	134.3 Å²	134.3	78%	0.776	70%	0.703	S	S	*	*			trans	-107.8	99.5	-178.7	-100.3	-85	0	0	0	111.3	V888	V888-Y890 HydrophobicContact CG1-CD2 4.31Å; V888-Y890 HydrophobicContact CG1-CE2 4.25Å
891	Q	27.6	Very low	27.3	Very low	117 Å²	117	136.6 Å²	136.6	55%	0.547	71%	0.708	S	S	.	*			trans	-91	102.9	173.4	-165.3	172.9	21.7	0	0	111.3	Q893 N901 L903	Q891-Q893 PolarHBondContact O-N 2.94Å; Q891-N901 PolarHBondContact NE2-OD1 3.47Å; Q891-L903 HydrophobicContact CB-CD2 3.89Å; Q891-L903 HydrophobicContact CG-CD2 4.17Å
892	K	26.7	Very low	27.4	Very low	184 Å²	184	136.9 Å²	136.9	80%	0.8	71%	0.71	S	S	*	*			trans	-84.6	85.7	176.8	-172.7	-177.8	-178.9	-177.8	0	110.5	I894	K892-I894 PolarHBondContact O-N 2.75Å; K892-I894 VanDerWaalsContact O-N 3.16Å
893	Q	29.4	Very low	27.4	Very low	178 Å²	178	131.8 Å²	131.8	83%	0.832	69%	0.69	S	S	*	*			trans	-76.7	104.6	-178.4	-161.5	167.6	27.3	0	0	111.8	Q891	Q891-Q893 PolarHBondContact O-N 2.94Å
894	I	27.3	Very low	27.5	Very low	136 Å²	136	135.2 Å²	135.2	70%	0.697	69%	0.686	S	S	*	*			trans	-74.7	147.4	178.9	-64.9	168.9	0	0	0	110.3	K892	K892-I894 PolarHBondContact O-N 2.75Å; K892-I894 VanDerWaalsContact O-N 3.16Å
895	S	28.6	Very low	27.5	Very low	96 Å²	96	134 Å²	134	67%	0.671	68%	0.681	S	S	*	*	S	Bend	trans	-77.4	137.8	174.9	47.5	0	0	0	0	112.2
896	N	26.4	Very low	27.6	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	67%	0.672	S	S	*	*	S	Bend	trans	72.4	120.2	176.7	-53.3	-27.8	0	0	0	116.7
897	N	27	Very low	27.5	Very low	148 Å²	148	137.6 Å²	137.6	79%	0.791	69%	0.685	S	S	*	*	S	Bend	trans	48	122.6	147.8	-63.9	-9.4	0	0	0	121
898	H	28	Very low	27.6	Very low	169 Å²	169	140.7 Å²	140.7	78%	0.782	70%	0.695	S	S	*	*			trans	85.3	135	163	-69	44.5	0	0	0	118.5
899	Y	27.6	Very low	27.4	Very low	233 Å²	233	143.2 Å²	143.2	91%	0.914	71%	0.705	S	S	*	*			trans	12.2	123.9	157.6	-70.7	-93.1	0	0	0	120.7
900	G	29.2	Very low	27.5	Very low	73 Å²	73	145.2 Å²	145.2	75%	0.753	72%	0.719	S	S	*	*			trans	145.1	104.3	159.9	0	0	0	0	0	113.4
901	N	26.6	Very low	27.4	Very low	129 Å²	129	142.8 Å²	142.8	69%	0.69	72%	0.715	S	S	*	*			trans	-115.7	90.3	169.6	-86.5	-30	0	0	0	108.8	Q891	Q891-N901 PolarHBondContact NE2-OD1 3.47Å
902	D	29.3	Very low	27.2	Very low	166 Å²	166	142.8 Å²	142.8	89%	0.888	73%	0.725	S	S	*	*			trans	-101.5	125.2	164.9	-94.1	-52.2	0	0	0	110
903	L	28.3	Very low	27.2	Very low	47 Å²	47	142.2 Å²	142.2	25%	0.246	72%	0.723	C	S	.	*			trans	-125.6	103.4	-172.6	-79.5	157.4	0	0	0	109.1	E889 Q891	E889-L903 HydrophobicContact CG-CD2 3.93Å; Q891-L903 HydrophobicContact CB-CD2 3.89Å; Q891-L903 HydrophobicContact CG-CD2 4.17Å
904	Q	27.3	Very low	27	Very low	148 Å²	148	139.5 Å²	139.5	69%	0.692	72%	0.72	S	S	*	*			trans	-85.2	127.3	176.1	-69.4	-172.3	-5.3	0	0	110.8
905	Y	25.5	Very low	26.8	Very low	156 Å²	156	139.7 Å²	139.7	61%	0.612	72%	0.721	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.7	144.2	176.9	-61.1	-94.7	0	0	0	110.6
906	H	28.1	Very low	26.7	Very low	128 Å²	128	142.1 Å²	142.1	59%	0.593	72%	0.719	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-126.7	139.6	162.8	-85.9	33.2	0	0	0	110.3
907	Q	26.1	Very low	26.5	Very low	165 Å²	165	143 Å²	143	77%	0.771	72%	0.723	S	S	*	*			trans	-117.3	127.6	172.2	-69.8	-179.5	-19.6	0	0	108.4
908	L	28.1	Very low	26.4	Very low	134 Å²	134	142.7 Å²	142.7	70%	0.702	72%	0.722	S	S	*	*			trans	-123.3	125.9	167.7	-86.5	90.9	0	0	0	109.8
909	L	25	Very low	26.2	Very low	139 Å²	139	141.5 Å²	141.5	73%	0.728	72%	0.721	S	S	*	*			trans	-88.4	136.9	161	-86.9	81.6	0	0	0	109.1
910	L	28.1	Very low	26	Very low	160 Å²	160	141.4 Å²	141.4	84%	0.838	72%	0.719	S	S	*	*			trans	-131.5	101.4	170.9	-78.1	167.1	0	0	0	109.7
911	H	25.4	Very low	25.9	Very low	148 Å²	148	144 Å²	144	69%	0.685	72%	0.72	S	S	*	*			trans	-79	148.1	172.3	-92.3	-98.3	0	0	0	111.5
912	P	23.9	Very low	25.7	Very low	117 Å²	117	144.9 Å²	144.9	76%	0.76	72%	0.724	S	S	*	*			trans	-86.9	109	170.5	32.9	-30.6	0	0	0	111.3
913	F	25.8	Very low	25.5	Very low	172 Å²	172	146.8 Å²	146.8	75%	0.754	72%	0.721	S	S	*	*			trans	-143.7	140.1	171.4	-99	-82.3	0	0	0	112.5
914	P	25.8	Very low	25.2	Very low	120 Å²	120	154.9 Å²	154.9	78%	0.779	75%	0.749	S	S	*	*			trans	-106.4	116.9	179.4	36	-27.7	0	0	0	112.9
915	I	22.7	Very low	25.1	Very low	140 Å²	140	153 Å²	153	72%	0.718	75%	0.748	S	S	*	*			trans	-139.6	135.4	179.3	-59.8	-178.6	0	0	0	111	L917	I915-L917 HydrophobicContact CG2-CD1 4.31Å
916	K	25.9	Very low	25	Very low	147 Å²	147	151.9 Å²	151.9	64%	0.639	76%	0.758	S	S	*	*			trans	-82.9	139.5	164.9	-68.2	175.2	179.6	170.8	0	109.5
917	L	23.9	Very low	24.7	Very low	164 Å²	164	151.2 Å²	151.2	86%	0.859	77%	0.768	S	S	*	*			trans	-145.9	137.2	162.2	-103.7	151.8	0	0	0	110.7	I915	I915-L917 HydrophobicContact CG2-CD1 4.31Å
918	N	22.9	Very low	24.7	Very low	141 Å²	141	154.6 Å²	154.6	75%	0.754	77%	0.773	S	S	*	*			trans	-99.3	149.6	-179.9	-102.1	-2.5	0	0	0	110.7
919	N	24	Very low	24.6	Very low	144 Å²	144	158.4 Å²	158.4	77%	0.77	78%	0.784	S	S	*	*			trans	62.3	135.6	154.1	-66.8	-14.3	0	0	0	120.3
920	R	23.2	Very low	24.5	Very low	231 Å²	231	154.7 Å²	154.7	87%	0.872	78%	0.78	S	S	*	*			trans	68.2	102.5	158.3	-70.1	-178.3	174.7	174	-2.2	118.2
921	T	28.2	Very low	24.4	Very low	127 Å²	127	150 Å²	150	78%	0.779	77%	0.77	S	S	*	*				28.7	115.7	124.4	55.6	0	0	0	0	118.4
922	L	22.2	Very low	24.4	Very low	148 Å²	148	149.2 Å²	149.2	78%	0.775	77%	0.771	S	S	*	*			trans	-152	127.9	140.4	-114.5	161.9	0	0	0	110.2	Y924	L922-Y924 HydrophobicContact CD2-CE2 3.9Å
923	Y	25.4	Very low	24.5	Very low	207 Å²	207	153.1 Å²	153.1	81%	0.812	77%	0.772	S	S	*	*			trans	-71.1	139.4	165.9	-67	-107.4	0	0	0	108.5
924	Y	22.5	Very low	24.6	Very low	216 Å²	216	150.6 Å²	150.6	85%	0.847	77%	0.765	S	S	*	*			trans	-140.5	140.5	141.2	-87.7	-64.3	0	0	0	111.5	L922	L922-Y924 HydrophobicContact CD2-CE2 3.9Å
925	T	24.7	Very low	24.7	Very low	108 Å²	108	152.8 Å²	152.8	66%	0.663	77%	0.765	S	S	*	*			trans	-108.6	-160.9	178.9	61	0	0	0	0	109
926	T	22.2	Very low	24.8	Very low	134 Å²	134	151.6 Å²	151.6	82%	0.822	76%	0.764	S	S	*	*			trans	75.3	153.9	176	85.2	0	0	0	0	114.8
927	S	23.1	Very low	24.7	Very low	114 Å²	114	152.8 Å²	152.8	80%	0.797	77%	0.77	S	S	*	*			cis	-139.7	148.7	1.7	-161.7	0	0	0	0	113.9
928	R	26.6	Very low	24.7	Very low	235 Å²	235	149.5 Å²	149.5	89%	0.887	76%	0.758	S	S	*	*			trans	-60.7	140.3	175.3	-98.6	170.7	157.8	169.3	-8.8	113.3
929	K	24.1	Very low	25	Very low	214 Å²	214	149 Å²	149	93%	0.93	76%	0.763	S	S	*	*				-160.2	130.3	128.6	-98.6	-178.6	-178.1	-178.5	0	106.4
930	G	24.3	Very low	25	Very low	62 Å²	62	148 Å²	148	64%	0.639	76%	0.762	S	S	*	*			cis	176	175.1	-3.8	0	0	0	0	0	107.8
931	G	25.2	Very low	24.9	Very low	61 Å²	61	147.6 Å²	147.6	63%	0.629	76%	0.761	S	S	*	*			trans	92.9	48.9	172.7	0	0	0	0	0	116.5
932	D	25.9	Very low	24.7	Very low	131 Å²	131	150.9 Å²	150.9	70%	0.701	77%	0.767	S	S	*	*				59.2	-179.7	121.7	-45	-33.4	0	0	0	121.3
933	Y	26.5	Very low	24.7	Very low	199 Å²	199	149 Å²	149	78%	0.78	76%	0.761	S	S	*	*			trans	52	83.7	176.3	-59.1	-73.1	0	0	0	116.4
934	I	26.2	Very low	24.5	Very low	120 Å²	120	147 Å²	147	62%	0.615	76%	0.764	S	S	*	*				53.2	102.3	63.7	-42.4	156.2	0	0	0	111.3
935	Q	28.3	Very low	24.4	Very low	165 Å²	165	145.1 Å²	145.1	77%	0.771	76%	0.757	S	S	*	*				-155.5	85.9	119.2	-108.4	164.7	19.1	0	0	112.3	F937	Q935-F937 HydrophobicContact CG-CD2 4.45Å; Q935-F937 HydrophobicContact CG-CE2 4.15Å; Q935-F937 PolarHBondContact O-N 3.15Å
936	T	26.3	Very low	24.3	Very low	115 Å²	115	146.2 Å²	146.2	71%	0.706	75%	0.754	S	S	*	*			trans	-31.2	119	140.5	46.4	0	0	0	0	113.3
937	F	23.3	Very low	24.5	Very low	172 Å²	172	146.2 Å²	146.2	75%	0.754	76%	0.757	S	S	*	*			trans	-145.1	150.7	154.7	-90.9	-70.3	0	0	0	108.9	Q935	Q935-F937 HydrophobicContact CG-CD2 4.45Å; Q935-F937 HydrophobicContact CG-CE2 4.15Å; Q935-F937 PolarHBondContact O-N 3.15Å
938	P	24.2	Very low	24.7	Very low	95 Å²	95	144.6 Å²	144.6	62%	0.617	74%	0.742	S	S	*	*				-126	173.6	-113.5	17.3	7.3	0	0	0	114.7	T940	P938-T940 PolarHBondContact O-N 3.44Å
939	P	27.8	Very low	24.5	Very low	131 Å²	131	139.3 Å²	139.3	85%	0.851	73%	0.73	S	S	*	*			trans	-87.1	101.6	-172.1	33.1	-34	0	0	0	113.2
940	T	23.7	Very low	24.3	Very low	123 Å²	123	134.4 Å²	134.4	76%	0.755	72%	0.718	S	S	*	*			trans	-141.5	130.2	174.3	47.2	0	0	0	0	114.9	P938	P938-T940 PolarHBondContact O-N 3.44Å
941	R	22.5	Very low	24.1	Very low	223 Å²	223	136 Å²	136	84%	0.842	73%	0.725	S	S	*	*			trans	59.4	97.5	159.6	-67.2	-175.4	172.9	174.7	-2	119.6	T943	R941-T943 PolarHBondContact O-N 3.43Å
942	Q	24.2	Very low	24	Very low	195 Å²	195	139.9 Å²	139.9	91%	0.911	72%	0.724	S	S	*	*				23.1	93.7	118.9	-65.9	171.2	-28.9	0	0	116.7
943	T	21.1	Very low	24.1	Very low	108 Å²	108	141.6 Å²	141.6	66%	0.663	73%	0.728	S	S	*	*			trans	-144.2	142.7	154.7	39.5	0	0	0	0	110.4	R941 Y945	R941-T943 PolarHBondContact O-N 3.43Å; T943-Y945 PolarHBondContact O-N 2.94Å; T943-Y945 VanDerWaalsContact O-N 3.13Å
944	L	22.4	Very low	24.1	Very low	167 Å²	167	136.7 Å²	136.7	87%	0.874	72%	0.72	S	S	*	*			trans	-78.3	93.7	-177.3	-72.3	68.9	0	0	0	110
945	Y	20.5	Very low	24	Very low	176 Å²	176	139.6 Å²	139.6	69%	0.69	73%	0.725	S	S	*	*			trans	-122	59.5	179.9	-90.3	-83.7	0	0	0	114.4	T943 I949	T943-Y945 PolarHBondContact O-N 2.94Å; T943-Y945 VanDerWaalsContact O-N 3.13Å; Y945-I949 HydrophobicContact CD1-CD1 4.37Å; Y945-I949 HydrophobicContact CE1-CD1 3.71Å
946	H	21.4	Very low	23.9	Very low	130 Å²	130	137.9 Å²	137.9	60%	0.602	72%	0.716	S	S	*	*				10.6	117.6	111.3	-126.9	-20.7	0	0	0	116.1	T948	H946-T948 PolarHBondContact CD2-OG1 3.16Å; H946-T948 PolarHBondContact O-N 2.88Å; H946-T948 VanDerWaalsContact O-N 3.09Å
947	P	26.4	Very low	23.8	Very low	135 Å²	135	138.4 Å²	138.4	88%	0.877	71%	0.711	S	S	*	*	S	Bend	trans	-78.6	58.2	149	32.9	-33.6	0	0	0	110.3
948	T	27.8	Very low	24	Very low	79 Å²	79	139.2 Å²	139.2	49%	0.485	71%	0.71	S	S	.	*			trans	-80.5	-165.1	142.3	42.6	0	0	0	0	107.8	H946	H946-T948 PolarHBondContact CD2-OG1 3.16Å; H946-T948 PolarHBondContact O-N 2.88Å; H946-T948 VanDerWaalsContact O-N 3.09Å
949	I	22	Very low	24.1	Very low	125 Å²	125	137.8 Å²	137.8	64%	0.641	71%	0.712	S	S	*	*			trans	70.5	99.8	-178	-48.7	171.7	0	0	0	111.3	Y945	Y945-I949 HydrophobicContact CD1-CD1 4.37Å; Y945-I949 HydrophobicContact CE1-CD1 3.71Å
950	V	19.7	Very low	24.1	Very low	111 Å²	111	136.9 Å²	136.9	67%	0.673	70%	0.701	S	S	*	*			cis	-134.6	128.4	9.3	-166.6	0	0	0	0	110.1	K952	V950-K952 HydrophobicContact CG1-CB 4.26Å; V950-K952 HydrophobicContact CG1-CG 4.37Å; V950-K952 PolarHBondContact O-N 3.42Å
951	A	21.7	Very low	24.3	Very low	95 Å²	95	138.8 Å²	138.8	79%	0.785	70%	0.701	S	S	*	*			trans	-68.7	84.4	155.7	0	0	0	0	0	107.7	H953	A951-H953 VanDerWaalsContact C-N 3.29Å; A951-H953 PolarHBondContact O-N 3.47Å
952	K	22.5	Very low	24.7	Very low	143 Å²	143	133 Å²	133	62%	0.622	69%	0.694	S	S	*	*			trans	-75.2	85.8	-172.1	-147.1	-169.4	-178.7	-177.1	0	110	V950 P954	V950-K952 HydrophobicContact CG1-CB 4.26Å; V950-K952 HydrophobicContact CG1-CG 4.37Å; V950-K952 PolarHBondContact O-N 3.42Å; K952-P954 WeakPolarHBondContact O-CD 3.41Å
953	H	28.4	Very low	24.9	Very low	166 Å²	166	131.7 Å²	131.7	77%	0.769	69%	0.689	S	S	*	*			trans	-81.3	96.2	149.2	-69.7	-20.4	0	0	0	108.5	A951 Y955	A951-H953 VanDerWaalsContact C-N 3.29Å; A951-H953 PolarHBondContact O-N 3.47Å; H953-Y955 WeakPolarHBondContact O-CD2 3.44Å; H953-Y955 PolarHBondContact O-N 2.88Å
954	P	25.9	Very low	25.3	Very low	96 Å²	96	131.7 Å²	131.7	62%	0.623	69%	0.693	S	S	*	*				-74.3	87.5	128.1	29.1	-13.9	0	0	0	106.6	K952	K952-P954 WeakPolarHBondContact O-CD 3.41Å
955	Y	24.3	Very low	25.7	Very low	182 Å²	182	128.4 Å²	128.4	71%	0.714	68%	0.681	S	S	*	*				63.2	133.7	114.8	-88.6	-122.8	0	0	0	119.3	H953	H953-Y955 WeakPolarHBondContact O-CD2 3.44Å; H953-Y955 PolarHBondContact O-N 2.88Å
956	H	25.2	Very low	26.2	Very low	128 Å²	128	129.1 Å²	129.1	59%	0.593	68%	0.684	S	S	*	*				35	126.7	124.3	-62.3	-103	0	0	0	116.9
957	H	25.5	Very low	26.4	Very low	126 Å²	126	133.3 Å²	133.3	58%	0.583	70%	0.695	S	S	*	*			cis	-173.2	-167.7	25.7	-124.2	-28.8	0	0	0	110.9
958	Y	26.2	Very low	26.6	Very low	189 Å²	189	136.4 Å²	136.4	74%	0.741	69%	0.694	S	S	*	*			trans	3.9	130.2	162.2	-54.4	-69	0	0	0	118.7
959	G	27.1	Very low	26.7	Very low	65 Å²	65	141.7 Å²	141.7	67%	0.67	71%	0.711	S	S	*	*			cis	132.6	-162.2	12.3	0	0	0	0	0	110.7
960	N	28.6	Very low	26.9	Very low	113 Å²	113	140.3 Å²	140.3	60%	0.604	71%	0.712	S	S	*	*			trans	60.3	93.2	165.5	-58.1	66	0	0	0	114.3
961	E	27.6	Very low	27.4	Very low	163 Å²	163	140.9 Å²	140.9	76%	0.762	72%	0.721	S	S	*	*				87.1	134.7	90.3	-78.3	158.6	167.8	0	0	111.3
962	S	30.1	Very low	27.6	Very low	100 Å²	100	143.6 Å²	143.6	70%	0.699	72%	0.722	S	S	*	*			cis	-161	141.8	43	32.9	0	0	0	0	113.5
963	Q	29.1	Very low	27.7	Very low	169 Å²	169	141.2 Å²	141.2	79%	0.79	72%	0.724	S	S	*	*			trans	42.7	102.5	132.8	-57.7	168.4	3.4	0	0	120
964	S	28.4	Very low	27.6	Very low	107 Å²	107	139 Å²	139	75%	0.748	72%	0.722	S	S	*	*				46.7	169.6	109.4	81.9	0	0	0	0	121.7
965	P	31.4	Very low	27.7	Very low	98 Å²	98	143.8 Å²	143.8	64%	0.636	73%	0.728	S	S	*	*			cis	-136.7	-165.1	1.8	22	6.2	0	0	0	115.4
966	Y	29.9	Very low	27.8	Very low	191 Å²	191	141.2 Å²	141.2	75%	0.749	73%	0.726	S	S	*	*			trans	87.3	81	160.6	-71.1	-75.7	0	0	0	123.1
967	R	26.4	Very low	28	Very low	219 Å²	219	140.6 Å²	140.6	83%	0.826	73%	0.727	S	S	*	*				34.4	121.5	116	-64.4	176.8	171.7	168.5	-2.4	119.9
968	K	31.2	Very low	28	Very low	200 Å²	200	143.4 Å²	143.4	87%	0.87	74%	0.74	S	S	*	*				-157.1	154.4	110.9	-110.9	175	-178.5	-179.7	0	112
969	F	28.7	Very low	28	Very low	190 Å²	190	141.1 Å²	141.1	83%	0.833	74%	0.741	S	S	*	*			trans	-55.1	142.5	-171.4	-58	-103.5	0	0	0	113.6
970	S	27.1	Very low	28	Very low	96 Å²	96	143.3 Å²	143.3	67%	0.671	74%	0.741	S	S	*	*			cis	87.7	93	12.6	92.4	0	0	0	0	118.6
971	S	30.1	Very low	28	Very low	123 Å²	123	147.8 Å²	147.8	86%	0.86	75%	0.75	S	S	*	*			trans	-134.2	138.6	142.9	56.1	0	0	0	0	108.2
972	N	25.5	Very low	28.2	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	74%	0.735	S	S	*	*			trans	-114.7	135.1	-169	-70.1	-54.5	0	0	0	111.5
973	S	24.1	Very low	28.6	Very low	94 Å²	94	143.1 Å²	143.1	66%	0.657	73%	0.725	S	S	*	*				163.2	121.7	123.1	51.2	0	0	0	0	112.7
974	T	28.2	Very low	28.8	Very low	118 Å²	118	141.2 Å²	141.2	72%	0.724	72%	0.72	S	S	*	*			trans	-175.2	133.2	149.1	10.7	0	0	0	0	108.4	L976	T974-L976 VanDerWaalsContact C-N 3.28Å; T974-L976 PolarHBondContact O-N 2.71Å
975	W	27.8	Very low	29.3	Very low	197 Å²	197	139 Å²	139	75%	0.746	70%	0.7	S	S	*	*			trans	-81.7	72.9	-172.3	-122	64.3	0	0	0	113.1	M1404	W975-M1404 HydrophobicContact CB-SD 4.06Å; W975-M1404 VanDerWaalsContact CD1-SD 3.56Å; W975-M1404 HydrophobicContact CG-CB 4.39Å; W975-M1404 HydrophobicContact CG-SD 4.11Å
976	L	25.8	Very low	29.6	Very low	129 Å²	129	138.2 Å²	138.2	68%	0.675	70%	0.697	S	S	*	*			trans	-35.8	150.9	146.8	-70.6	160.8	0	0	0	112	T974	T974-L976 VanDerWaalsContact C-N 3.28Å; T974-L976 PolarHBondContact O-N 2.71Å
977	N	29.1	Very low	30.1	Very low	115 Å²	115	136.2 Å²	136.2	62%	0.615	69%	0.694	S	S	*	*			cis	-153.9	22.3	3.2	-143.6	-6.3	0	0	0	114.2
978	H	25.6	Very low	31	Very low	185 Å²	185	129.2 Å²	129.2	86%	0.856	67%	0.673	S	S	*	*	S	Bend	trans	-111.7	87.8	-169.3	-78.3	-72.6	0	0	0	114
979	N	26.6	Very low	31.4	Very low	141 Å²	141	127 Å²	127	75%	0.754	66%	0.663	S	S	*	*			trans	178.2	66.3	138.3	-92.8	-27	0	0	0	111.6	W981	N979-W981 PolarHBondContact O-N 2.89Å
980	T	26.7	Very low	32.1	Very low	110 Å²	110	127.9 Å²	127.9	68%	0.675	66%	0.661	S	S	*	*			trans	-76.2	49.3	178.4	39.7	0	0	0	0	113.4
981	W	28.9	Very low	33.4	Very low	207 Å²	207	128.2 Å²	128.2	78%	0.784	65%	0.654	S	S	*	*			trans	-65.4	148	179.3	-82	22.3	0	0	0	112.8	N979	N979-W981 PolarHBondContact O-N 2.89Å
982	N	32.6	Very low	34.5	Very low	87 Å²	87	129.3 Å²	129.3	47%	0.465	64%	0.643	S	S	.	*			trans	-85.2	163.2	-145.3	-146.8	-5.6	0	0	0	114.6	N984 N985	N982-N984 PolarHBondContact O-N 2.9Å; N982-N984 VanDerWaalsContact O-N 3.14Å; N982-N985 PolarHBondContact O-N 2.68Å
983	T	36.4	Very low	35.6	Very low	79 Å²	79	127.6 Å²	127.6	49%	0.485	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.7	-7.8	-166.8	-0	0	0	0	0	116	K780 N985	K780-T983 HydrophobicContact CD-CG2 4.27Å; T983-N985 PolarHBondContact O-N 2.99Å
984	N	35.1	Very low	36.9	Very low	128 Å²	128	130.2 Å²	130.2	68%	0.684	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-8.3	170.8	-63.7	1.1	0	0	0	113	N982 S986	N982-N984 PolarHBondContact O-N 2.9Å; N982-N984 VanDerWaalsContact O-N 3.14Å; N984-S986 PolarHBondContact O-N 3Å; N984-S986 VanDerWaalsContact O-N 3.08Å
985	N	38.6	Very low	38.1	Very low	62 Å²	62	126.6 Å²	126.6	33%	0.332	61%	0.611	S	S	.	*	H	α-helix	trans	-68.2	2.4	-178.7	-100.2	-40.7	0	0	0	116.2	N982 T983 I988 K989	N982-N985 PolarHBondContact O-N 2.68Å; T983-N985 PolarHBondContact O-N 2.99Å; N985-I988 WeakPolarHBondContact OD1-CG2 3.42Å; N985-K989 WeakPolarHBondContact O-CB 3.44Å; N985-K989 VanDerWaalsContact O-CG 3.28Å; N985-K989 WeakPolarHBondContact O-CG 3.44Å; N985-K989 PolarHBondContact O-N 2.94Å
986	S	37.7	Very low	39.2	Very low	81 Å²	81	121.8 Å²	121.8	57%	0.566	60%	0.597	S	S	*	*	H	α-helix	trans	-73.7	-47.3	175.3	61.4	0	0	0	0	112.4	N984 R990	N984-S986 PolarHBondContact O-N 3Å; N984-S986 VanDerWaalsContact O-N 3.08Å; S986-R990 PolarHBondContact O-N 3.49Å
987	Q	39	Very low	40.4	Very low	148 Å²	148	120 Å²	120	69%	0.692	59%	0.588	S	S	*	*	H	α-helix	trans	-66.1	-43.4	171.7	-71.2	-173.9	-6.2	0	0	110.8	K989 R990 I991	Q987-K989 PolarHBondContact O-N 3.19Å; Q987-R990 WeakPolarHBondContact O-CB 3.2Å; Q987-R990 PolarHBondContact O-N 3.38Å; Q987-R990 VanDerWaalsContact O-N 3.1Å; Q987-I991 WeakPolarHBondContact O-CG1 3.45Å; Q987-I991 PolarHBondContact O-N 3.33Å
988	I	46.1	Very low	41.3	Very low	73 Å²	73	116.9 Å²	116.9	37%	0.374	58%	0.578	S	S	.	*	H	α-helix	trans	-64.6	-39.6	178.5	-63.4	171.6	0	0	0	111.1	N985 I991 F992	N985-I988 WeakPolarHBondContact OD1-CG2 3.42Å; I988-I991 PolarHBondContact O-N 2.91Å; I988-F992 HydrophobicContact CG2-CD2 3.59Å; I988-F992 HydrophobicContact CG2-CE2 3.7Å; I988-F992 WeakPolarHBondContact O-CD2 3.29Å; I988-F992 PolarHBondContact O-N 3.09Å
989	K	39.5	Very low	42.6	Very low	154 Å²	154	112.3 Å²	112.3	67%	0.67	56%	0.556	S	S	*	*	H	α-helix	trans	-61.6	-41	169.6	-86.6	-173.6	173	-175	0	112.5	N985 Q987 L993	N985-K989 WeakPolarHBondContact O-CB 3.44Å; N985-K989 VanDerWaalsContact O-CG 3.28Å; N985-K989 WeakPolarHBondContact O-CG 3.44Å; N985-K989 PolarHBondContact O-N 2.94Å; Q987-K989 PolarHBondContact O-N 3.19Å; K989-L993 WeakPolarHBondContact O-CB 3.41Å; K989-L993 PolarHBondContact O-N 3.46Å
990	R	44	Very low	43.9	Very low	207 Å²	207	113.4 Å²	113.4	78%	0.781	55%	0.549	S	S	*	.	H	α-helix	trans	-63.2	-41.6	175.1	-77.8	-175.2	175.4	-171	-0.3	111.6	S986 Q987 L993 F994	S986-R990 PolarHBondContact O-N 3.49Å; Q987-R990 WeakPolarHBondContact O-CB 3.2Å; Q987-R990 PolarHBondContact O-N 3.38Å; Q987-R990 VanDerWaalsContact O-N 3.1Å; R990-L993 PolarHBondContact O-N 3.01Å; R990-F994 VanDerWaalsContact O-CB 3.25Å; R990-F994 WeakPolarHBondContact O-CB 3.4Å; R990-F994 PolarHBondContact O-N 2.85Å
991	I	54.5	Low	45.4	Very low	103 Å²	103	112.1 Å²	112.1	53%	0.528	54%	0.541	S	S	.	.	H	α-helix	trans	-63.3	-52.9	174.9	-67.4	164.1	0	0	0	110.3	Q987 I988 L993 F994 T995	Q987-I991 WeakPolarHBondContact O-CG1 3.45Å; Q987-I991 PolarHBondContact O-N 3.33Å; I988-I991 PolarHBondContact O-N 2.91Å; I991-L993 VanDerWaalsContact C-N 3.31Å; I991-L993 PolarHBondContact O-N 3.49Å; I991-F994 PolarHBondContact O-N 3.26Å; I991-T995 WeakPolarHBondContact O-CB 3.21Å; I991-T995 PolarHBondContact O-N 3.29Å; I991-T995 PolarHBondContact O-OG1 3.35Å
992	F	52.3	Low	46.4	Very low	146 Å²	146	106.8 Å²	106.8	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-59.5	-38.2	177	-90.9	-75.2	0	0	0	113.2	I988 H996	I988-F992 HydrophobicContact CG2-CD2 3.59Å; I988-F992 HydrophobicContact CG2-CE2 3.7Å; I988-F992 WeakPolarHBondContact O-CD2 3.29Å; I988-F992 PolarHBondContact O-N 3.09Å; F992-H996 WeakPolarHBondContact O-CB 3.45Å; F992-H996 PolarHBondContact O-N 2.94Å
993	L	49.3	Very low	47.3	Very low	115 Å²	115	107.4 Å²	107.4	60%	0.602	52%	0.52	S	S	*	.	H	α-helix	trans	-73	-34.3	179.2	-167.5	147.7	0	0	0	111.8	K989 R990 I991 L997	K989-L993 WeakPolarHBondContact O-CB 3.41Å; K989-L993 PolarHBondContact O-N 3.46Å; R990-L993 PolarHBondContact O-N 3.01Å; I991-L993 VanDerWaalsContact C-N 3.31Å; I991-L993 PolarHBondContact O-N 3.49Å; L993-L997 HydrophobicContact CD2-CD1 4.3Å; L993-L997 WeakPolarHBondContact O-CB 3.14Å; L993-L997 PolarHBondContact O-N 2.88Å
994	F	51.3	Low	48.1	Very low	150 Å²	150	106.7 Å²	106.7	66%	0.658	52%	0.516	S	S	*	.	H	α-helix	trans	-71.3	-42.5	172.1	-163	-89.7	0	0	0	111.8	R990 I991 H996 L997 A998	R990-F994 VanDerWaalsContact O-CB 3.25Å; R990-F994 WeakPolarHBondContact O-CB 3.4Å; R990-F994 PolarHBondContact O-N 2.85Å; I991-F994 PolarHBondContact O-N 3.26Å; F994-H996 VanDerWaalsContact C-N 3.35Å; F994-L997 WeakPolarHBondContact O-CB 3.38Å; F994-L997 PolarHBondContact O-N 3.44Å; F994-A998 WeakPolarHBondContact O-CB 3.04Å; F994-A998 PolarHBondContact O-N 2.77Å
995	T	53.5	Low	49.1	Very low	42 Å²	42	106.8 Å²	106.8	26%	0.258	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-41.1	172	-60.8	0	0	0	0	111.2	I991 A998 F999 L1650	I991-T995 WeakPolarHBondContact O-CB 3.21Å; I991-T995 PolarHBondContact O-N 3.29Å; I991-T995 PolarHBondContact O-OG1 3.35Å; T995-A998 PolarHBondContact O-N 3.39Å; T995-F999 WeakPolarHBondContact O-CB 3.39Å; T995-F999 PolarHBondContact O-N 2.65Å; T995-L1650 HydrophobicContact CG2-CD1 3.75Å
996	H	49.9	Very low	50	Low	95 Å²	95	106.1 Å²	106.1	44%	0.44	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-38.4	173.3	173.7	-83.4	0	0	0	111.9	F992 F994 R1000	F992-H996 WeakPolarHBondContact O-CB 3.45Å; F992-H996 PolarHBondContact O-N 2.94Å; F994-H996 VanDerWaalsContact C-N 3.35Å; H996-R1000 WeakPolarHBondContact O-CB 3.4Å; H996-R1000 PolarHBondContact O-N 2.81Å
997	L	51.2	Low	50.7	Low	93 Å²	93	107.5 Å²	107.5	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-65	-48.8	173.2	-108.3	163.6	0	0	0	111.9	L993 F994 R1000 V1001	L993-L997 HydrophobicContact CD2-CD1 4.3Å; L993-L997 WeakPolarHBondContact O-CB 3.14Å; L993-L997 PolarHBondContact O-N 2.88Å; F994-L997 WeakPolarHBondContact O-CB 3.38Å; F994-L997 PolarHBondContact O-N 3.44Å; L997-R1000 PolarHBondContact O-N 3.17Å; L997-V1001 WeakPolarHBondContact O-CG2 3.45Å; L997-V1001 PolarHBondContact O-N 2.94Å
998	A	49	Very low	51.5	Low	49 Å²	49	104.3 Å²	104.3	41%	0.405	49%	0.493	S	S	.	.	H	α-helix	trans	-61.9	-43.7	177.2	0	0	0	0	0	111.8	F994 T995 V1001 F1002	F994-A998 WeakPolarHBondContact O-CB 3.04Å; F994-A998 PolarHBondContact O-N 2.77Å; T995-A998 PolarHBondContact O-N 3.39Å; A998-V1001 PolarHBondContact O-N 2.65Å; A998-F1002 WeakPolarHBondContact O-CB 3.28Å; A998-F1002 PolarHBondContact O-N 3.33Å
999	F	52.5	Low	51.9	Low	88 Å²	88	105.9 Å²	105.9	39%	0.386	50%	0.497	S	S	.	.	H	α-helix	trans	-62.9	-41.5	174.4	-175.2	-97.7	0	0	0	111.6	T995 V1001 F1002 Y1003 C1422	T995-F999 WeakPolarHBondContact O-CB 3.39Å; T995-F999 PolarHBondContact O-N 2.65Å; F999-V1001 PolarHBondContact O-N 3.05Å; F999-F1002 PolarHBondContact O-N 3.08Å; F999-Y1003 WeakPolarHBondContact O-CB 3.38Å; F999-Y1003 PolarHBondContact O-N 3.23Å; F999-C1422 VanDerWaalsContact CZ-SG 3.52Å
1000	R	54	Low	52.7	Low	164 Å²	164	100.8 Å²	100.8	62%	0.619	48%	0.481	S	S	*	.	H	α-helix	trans	-64.9	-37.5	176.4	-172.1	177.8	-176	-162.8	0.8	112.7	H996 L997 T1004	H996-R1000 WeakPolarHBondContact O-CB 3.4Å; H996-R1000 PolarHBondContact O-N 2.81Å; L997-R1000 PolarHBondContact O-N 3.17Å; R1000-T1004 PolarHBondContact O-N 3.27Å; R1000-T1004 PolarHBondContact O-OG1 3.36Å
1001	V	57.1	Low	53.3	Low	84 Å²	84	93.6 Å²	93.6	51%	0.509	46%	0.46	S	S	.	.	H	α-helix	trans	-68	-43.4	174.2	171.9	0	0	0	0	110.9	L997 A998 F999 T1004 F1005	L997-V1001 WeakPolarHBondContact O-CG2 3.45Å; L997-V1001 PolarHBondContact O-N 2.94Å; A998-V1001 PolarHBondContact O-N 2.65Å; F999-V1001 PolarHBondContact O-N 3.05Å; V1001-T1004 WeakPolarHBondContact CA-OG1 3.43Å; V1001-T1004 PolarHBondContact O-N 2.81Å; V1001-T1004 PolarHBondContact O-OG1 3.13Å; V1001-F1005 PolarHBondContact O-N 3.19Å
1002	F	51.1	Low	53.2	Low	95 Å²	95	90.8 Å²	90.8	42%	0.417	45%	0.452	S	S	.	.	H	α-helix	trans	-66	-40.6	175.8	-176.1	-109.4	0	0	0	112.6	A998 F999 F1005 L1006	A998-F1002 WeakPolarHBondContact O-CB 3.28Å; A998-F1002 PolarHBondContact O-N 3.33Å; F999-F1002 PolarHBondContact O-N 3.08Å; F1002-F1005 PolarHBondContact O-N 3.26Å; F1002-L1006 HydrophobicContact CD1-CD1 4.07Å; F1002-L1006 HydrophobicContact CE1-CD1 3.47Å; F1002-L1006 VanDerWaalsContact CE1-CD1 3.47Å; F1002-L1006 HydrophobicContact CE1-CG 4.18Å; F1002-L1006 HydrophobicContact CE2-CD1 4.49Å; F1002-L1006 HydrophobicContact CE2-CG 4.43Å; F1002-L1006 HydrophobicContact CZ-CD1 3.72Å; F1002-L1006 HydrophobicContact CZ-CD2 4.42Å; F1002-L1006 HydrophobicContact CZ-CG 4.12Å; F1002-L1006 PolarHBondContact O-N 2.9Å
1003	Y	50.4	Low	53.5	Low	100 Å²	100	86.1 Å²	86.1	39%	0.392	44%	0.436	S	S	.	.	H	α-helix	trans	-59.8	-48	172.6	161.8	-97.5	0	0	0	111.6	F999 F1005 L1006 F1007 I1425	F999-Y1003 WeakPolarHBondContact O-CB 3.38Å; F999-Y1003 PolarHBondContact O-N 3.23Å; Y1003-F1005 VanDerWaalsContact C-N 3.31Å; Y1003-F1005 PolarHBondContact O-N 3.09Å; Y1003-L1006 PolarHBondContact O-N 3.13Å; Y1003-F1007 VanDerWaalsContact O-CB 3.23Å; Y1003-F1007 WeakPolarHBondContact O-CB 3.46Å; Y1003-F1007 PolarHBondContact O-N 3.33Å; Y1003-I1425 HydrophobicContact CD2-CD1 3.99Å; Y1003-I1425 HydrophobicContact CE2-CD1 3.67Å
1004	T	53.4	Low	53.5	Low	63 Å²	63	84.3 Å²	84.3	39%	0.387	43%	0.433	S	S	.	.	H	α-helix	trans	-65.3	-35.1	177.5	40.2	0	0	0	0	112	R1000 V1001 T1008	R1000-T1004 PolarHBondContact O-N 3.27Å; R1000-T1004 PolarHBondContact O-OG1 3.36Å; V1001-T1004 WeakPolarHBondContact CA-OG1 3.43Å; V1001-T1004 PolarHBondContact O-N 2.81Å; V1001-T1004 PolarHBondContact O-OG1 3.13Å; T1004-T1008 WeakPolarHBondContact O-CB 3.37Å; T1004-T1008 WeakPolarHBondContact O-CG2 3.48Å; T1004-T1008 PolarHBondContact O-N 2.62Å; T1004-T1008 PolarHBondContact O-OG1 2.71Å
1005	F	57.7	Low	53.2	Low	130 Å²	130	81.1 Å²	81.1	57%	0.57	42%	0.422	S	S	*	.	H	α-helix	trans	-63.6	-49.6	171.8	-179.7	-100.4	0	0	0	112.6	V1001 F1002 Y1003 F1007 T1008 F1009	V1001-F1005 PolarHBondContact O-N 3.19Å; F1002-F1005 PolarHBondContact O-N 3.26Å; Y1003-F1005 VanDerWaalsContact C-N 3.31Å; Y1003-F1005 PolarHBondContact O-N 3.09Å; F1005-F1007 PolarHBondContact O-N 2.9Å; F1005-T1008 PolarHBondContact O-N 2.79Å; F1005-T1008 PolarHBondContact O-OG1 2.98Å; F1005-T1008 VanDerWaalsContact O-OG1 3.06Å; F1005-F1009 WeakPolarHBondContact O-CB 3.37Å; F1005-F1009 PolarHBondContact O-N 2.89Å
1006	L	56.1	Low	52.9	Low	49 Å²	49	84.4 Å²	84.4	26%	0.257	44%	0.437	S	S	.	.	H	α-helix	trans	-65.1	-38.8	177.1	-71	-176.4	0	0	0	112.6	F1002 Y1003 F1009 S1010 F1429	F1002-L1006 HydrophobicContact CD1-CD1 4.07Å; F1002-L1006 HydrophobicContact CE1-CD1 3.47Å; F1002-L1006 VanDerWaalsContact CE1-CD1 3.47Å; F1002-L1006 HydrophobicContact CE1-CG 4.18Å; F1002-L1006 HydrophobicContact CE2-CD1 4.49Å; F1002-L1006 HydrophobicContact CE2-CG 4.43Å; F1002-L1006 HydrophobicContact CZ-CD1 3.72Å; F1002-L1006 HydrophobicContact CZ-CD2 4.42Å; F1002-L1006 HydrophobicContact CZ-CG 4.12Å; F1002-L1006 PolarHBondContact O-N 2.9Å; Y1003-L1006 PolarHBondContact O-N 3.13Å; L1006-F1009 PolarHBondContact O-N 3.1Å; L1006-S1010 WeakPolarHBondContact O-CB 3.48Å; L1006-S1010 PolarHBondContact O-N 3.08Å; L1006-S1010 PolarHBondContact O-OG 3.09Å; L1006-F1429 HydrophobicContact CB-CE2 4.36Å; L1006-F1429 HydrophobicContact CB-CZ 4.4Å; L1006-F1429 HydrophobicContact CD1-CE2 4.24Å; L1006-F1429 HydrophobicContact CD1-CZ 4.25Å; L1006-F1429 HydrophobicContact CD2-CZ 4.18Å
1007	F	52	Low	52.6	Low	109 Å²	109	86.7 Å²	86.7	48%	0.478	45%	0.446	S	S	.	.	H	α-helix	trans	-63.8	-51.2	176.4	179.3	-99.1	0	0	0	111.1	Y1003 F1005 F1009 S1010 V1011	Y1003-F1007 VanDerWaalsContact O-CB 3.23Å; Y1003-F1007 WeakPolarHBondContact O-CB 3.46Å; Y1003-F1007 PolarHBondContact O-N 3.33Å; F1005-F1007 PolarHBondContact O-N 2.9Å; F1007-F1009 VanDerWaalsContact C-N 3.31Å; F1007-F1009 PolarHBondContact O-N 3.08Å; F1007-S1010 PolarHBondContact O-N 2.97Å; F1007-S1010 VanDerWaalsContact O-N 3.15Å; F1007-S1010 PolarHBondContact O-OG 3.19Å; F1007-V1011 HydrophobicContact CD1-CG2 4.28Å; F1007-V1011 HydrophobicContact CD2-CG2 4.43Å; F1007-V1011 HydrophobicContact CE1-CG2 3.88Å; F1007-V1011 HydrophobicContact CE2-CG2 4.05Å; F1007-V1011 HydrophobicContact CZ-CG2 3.76Å; F1007-V1011 WeakPolarHBondContact O-CG2 3.48Å; F1007-V1011 PolarHBondContact O-N 2.95Å
1008	T	56	Low	51.9	Low	82 Å²	82	86 Å²	86	50%	0.503	45%	0.449	S	S	.	.	H	α-helix	trans	-61.9	-37	176.8	49.3	0	0	0	0	112.3	T1004 F1005 A1012	T1004-T1008 WeakPolarHBondContact O-CB 3.37Å; T1004-T1008 WeakPolarHBondContact O-CG2 3.48Å; T1004-T1008 PolarHBondContact O-N 2.62Å; T1004-T1008 PolarHBondContact O-OG1 2.71Å; F1005-T1008 PolarHBondContact O-N 2.79Å; F1005-T1008 PolarHBondContact O-OG1 2.98Å; F1005-T1008 VanDerWaalsContact O-OG1 3.06Å; T1008-A1012 WeakPolarHBondContact O-CB 3.15Å; T1008-A1012 PolarHBondContact O-N 3.49Å
1009	F	56	Low	51.2	Low	105 Å²	105	90 Å²	90	46%	0.461	46%	0.463	S	S	.	.	H	α-helix	trans	-64.7	-44.3	172.7	-171.6	-99.6	0	0	0	112.1	F1005 L1006 F1007 A1012 V1013 M1873	F1005-F1009 WeakPolarHBondContact O-CB 3.37Å; F1005-F1009 PolarHBondContact O-N 2.89Å; L1006-F1009 PolarHBondContact O-N 3.1Å; F1007-F1009 VanDerWaalsContact C-N 3.31Å; F1007-F1009 PolarHBondContact O-N 3.08Å; F1009-A1012 PolarHBondContact O-N 3.26Å; F1009-V1013 HydrophobicContact CD1-CG2 4.17Å; F1009-V1013 HydrophobicContact CE1-CG2 3.82Å; F1009-V1013 HydrophobicContact CE2-CG2 4.4Å; F1009-V1013 HydrophobicContact CZ-CG2 3.95Å; F1009-V1013 WeakPolarHBondContact O-CB 3.37Å; F1009-V1013 VanDerWaalsContact O-CG2 3.29Å; F1009-V1013 WeakPolarHBondContact O-CG2 3.43Å; F1009-V1013 PolarHBondContact O-N 2.88Å; F1009-M1873 HydrophobicContact CE1-CE 4.47Å; F1009-M1873 HydrophobicContact CZ-CE 4.22Å
1010	S	54.9	Low	50.1	Low	47 Å²	47	92.4 Å²	92.4	33%	0.329	48%	0.475	S	S	.	.	H	α-helix	trans	-63.6	-41.5	176.6	67.4	0	0	0	0	112.6	L1006 F1007 V1013 S1014	L1006-S1010 WeakPolarHBondContact O-CB 3.48Å; L1006-S1010 PolarHBondContact O-N 3.08Å; L1006-S1010 PolarHBondContact O-OG 3.09Å; F1007-S1010 PolarHBondContact O-N 2.97Å; F1007-S1010 VanDerWaalsContact O-N 3.15Å; F1007-S1010 PolarHBondContact O-OG 3.19Å; S1010-V1013 PolarHBondContact O-N 2.83Å; S1010-S1014 WeakPolarHBondContact O-CB 3.24Å; S1010-S1014 PolarHBondContact O-N 2.84Å; S1010-S1014 PolarHBondContact O-OG 2.86Å; S1010-S1014 VanDerWaalsContact O-OG 3.1Å
1011	V	56.9	Low	48.9	Very low	57 Å²	57	90.5 Å²	90.5	35%	0.345	48%	0.484	S	S	.	.	H	α-helix	trans	-68.7	-39.7	176.9	172.3	0	0	0	0	111.3	F1007 S1014 L1015	F1007-V1011 HydrophobicContact CD1-CG2 4.28Å; F1007-V1011 HydrophobicContact CD2-CG2 4.43Å; F1007-V1011 HydrophobicContact CE1-CG2 3.88Å; F1007-V1011 HydrophobicContact CE2-CG2 4.05Å; F1007-V1011 HydrophobicContact CZ-CG2 3.76Å; F1007-V1011 WeakPolarHBondContact O-CG2 3.48Å; F1007-V1011 PolarHBondContact O-N 2.95Å; V1011-S1014 PolarHBondContact O-N 3.26Å; V1011-L1015 HydrophobicContact CG1-CD1 3.86Å; V1011-L1015 HydrophobicContact CG1-CG 4.35Å; V1011-L1015 WeakPolarHBondContact O-CB 3.34Å; V1011-L1015 VanDerWaalsContact O-CG 3.32Å; V1011-L1015 WeakPolarHBondContact O-CG 3.35Å; V1011-L1015 PolarHBondContact O-N 2.84Å
1012	A	53	Low	47.6	Very low	43 Å²	43	91.1 Å²	91.1	36%	0.355	49%	0.492	S	S	.	.	H	α-helix	trans	-62.5	-45.8	174.1	0	0	0	0	0	111.5	T1008 F1009 S1014 L1015 I1016	T1008-A1012 WeakPolarHBondContact O-CB 3.15Å; T1008-A1012 PolarHBondContact O-N 3.49Å; F1009-A1012 PolarHBondContact O-N 3.26Å; A1012-S1014 PolarHBondContact O-N 2.94Å; A1012-L1015 PolarHBondContact O-N 2.92Å; A1012-I1016 WeakPolarHBondContact O-CB 3.45Å; A1012-I1016 WeakPolarHBondContact O-CD1 3.21Å; A1012-I1016 WeakPolarHBondContact O-CG1 3.32Å; A1012-I1016 PolarHBondContact O-N 3.2Å
1013	V	58.7	Low	46.6	Very low	49 Å²	49	89.6 Å²	89.6	30%	0.297	50%	0.503	S	S	.	.	H	α-helix	trans	-61.9	-42.6	175	170.9	0	0	0	0	111.2	F1009 S1010 F1017	F1009-V1013 HydrophobicContact CD1-CG2 4.17Å; F1009-V1013 HydrophobicContact CE1-CG2 3.82Å; F1009-V1013 HydrophobicContact CE2-CG2 4.4Å; F1009-V1013 HydrophobicContact CZ-CG2 3.95Å; F1009-V1013 WeakPolarHBondContact O-CB 3.37Å; F1009-V1013 VanDerWaalsContact O-CG2 3.29Å; F1009-V1013 WeakPolarHBondContact O-CG2 3.43Å; F1009-V1013 PolarHBondContact O-N 2.88Å; S1010-V1013 PolarHBondContact O-N 2.83Å; V1013-F1017 HydrophobicContact CG1-CD2 3.8Å; V1013-F1017 HydrophobicContact CG1-CE2 3.6Å; V1013-F1017 WeakPolarHBondContact O-CD2 3.23Å; V1013-F1017 PolarHBondContact O-N 3.06Å; V1013-F1017 VanDerWaalsContact O-N 3.13Å
1014	S	49	Very low	45.5	Very low	77 Å²	77	94.1 Å²	94.1	54%	0.538	52%	0.52	S	S	.	.	H	α-helix	trans	-63.1	-40.8	174.4	-66.8	0	0	0	0	113.1	S1010 V1011 A1012 F1017 S1018	S1010-S1014 WeakPolarHBondContact O-CB 3.24Å; S1010-S1014 PolarHBondContact O-N 2.84Å; S1010-S1014 PolarHBondContact O-OG 2.86Å; S1010-S1014 VanDerWaalsContact O-OG 3.1Å; V1011-S1014 PolarHBondContact O-N 3.26Å; A1012-S1014 PolarHBondContact O-N 2.94Å; S1014-F1017 CarbonylContact O-C 3.58Å; S1014-F1017 PolarHBondContact O-N 2.86Å; S1014-S1018 WeakPolarHBondContact O-CB 3.46Å; S1014-S1018 PolarHBondContact O-N 3.19Å; S1014-S1018 PolarHBondContact O-OG 2.83Å
1015	L	44.9	Very low	44.3	Very low	83 Å²	83	98.5 Å²	98.5	44%	0.435	54%	0.539	S	S	.	.	H	α-helix	trans	-68.7	-42.4	177.9	-77.2	169.1	0	0	0	112.2	V1011 A1012 F1017 S1018 L1019	V1011-L1015 HydrophobicContact CG1-CD1 3.86Å; V1011-L1015 HydrophobicContact CG1-CG 4.35Å; V1011-L1015 WeakPolarHBondContact O-CB 3.34Å; V1011-L1015 VanDerWaalsContact O-CG 3.32Å; V1011-L1015 WeakPolarHBondContact O-CG 3.35Å; V1011-L1015 PolarHBondContact O-N 2.84Å; A1012-L1015 PolarHBondContact O-N 2.92Å; L1015-F1017 PolarHBondContact O-N 3.34Å; L1015-S1018 WeakPolarHBondContact CA-OG 3.32Å; L1015-S1018 PolarHBondContact O-N 2.92Å; L1015-S1018 PolarHBondContact O-OG 3.25Å; L1015-L1019 HydrophobicContact CB-CD1 4.17Å; L1015-L1019 HydrophobicContact CD2-CD1 4.44Å; L1015-L1019 WeakPolarHBondContact O-CB 3.14Å; L1015-L1019 WeakPolarHBondContact O-CD1 3.07Å; L1015-L1019 VanDerWaalsContact O-CG 3.3Å; L1015-L1019 WeakPolarHBondContact O-CG 3.24Å; L1015-L1019 PolarHBondContact O-N 3.02Å
1016	I	47.1	Very low	42.7	Very low	111 Å²	111	96.9 Å²	96.9	57%	0.569	54%	0.544	S	S	*	.	H	α-helix	trans	-57.4	-37.9	173.9	-71.4	163.7	0	0	0	110.4	A1012	A1012-I1016 WeakPolarHBondContact O-CB 3.45Å; A1012-I1016 WeakPolarHBondContact O-CD1 3.21Å; A1012-I1016 WeakPolarHBondContact O-CG1 3.32Å; A1012-I1016 PolarHBondContact O-N 3.2Å
1017	F	42.5	Very low	41.2	Very low	142 Å²	142	100.6 Å²	100.6	62%	0.623	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-7.3	174.4	-67.7	-50	0	0	0	115.3	V1013 S1014 L1015 M1729	V1013-F1017 HydrophobicContact CG1-CD2 3.8Å; V1013-F1017 HydrophobicContact CG1-CE2 3.6Å; V1013-F1017 WeakPolarHBondContact O-CD2 3.23Å; V1013-F1017 PolarHBondContact O-N 3.06Å; V1013-F1017 VanDerWaalsContact O-N 3.13Å; S1014-F1017 CarbonylContact O-C 3.58Å; S1014-F1017 PolarHBondContact O-N 2.86Å; L1015-F1017 PolarHBondContact O-N 3.34Å; F1017-M1729 HydrophobicContact CB-CE 4.23Å
1018	S	38.4	Very low	40	Very low	80 Å²	80	101.8 Å²	101.8	56%	0.559	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-10.7	178.9	79.4	0	0	0	0	115	S1014 L1015	S1014-S1018 WeakPolarHBondContact O-CB 3.46Å; S1014-S1018 PolarHBondContact O-N 3.19Å; S1014-S1018 PolarHBondContact O-OG 2.83Å; L1015-S1018 WeakPolarHBondContact CA-OG 3.32Å; L1015-S1018 PolarHBondContact O-N 2.92Å; L1015-S1018 PolarHBondContact O-OG 3.25Å
1019	L	33.6	Very low	38.5	Very low	132 Å²	132	104.9 Å²	104.9	69%	0.691	60%	0.598	S	S	*	*	S	Bend	trans	-100	4	-170.7	-75.5	168.1	0	0	0	115.7	L1015	L1015-L1019 HydrophobicContact CB-CD1 4.17Å; L1015-L1019 HydrophobicContact CD2-CD1 4.44Å; L1015-L1019 WeakPolarHBondContact O-CB 3.14Å; L1015-L1019 WeakPolarHBondContact O-CD1 3.07Å; L1015-L1019 VanDerWaalsContact O-CG 3.3Å; L1015-L1019 WeakPolarHBondContact O-CG 3.24Å; L1015-L1019 PolarHBondContact O-N 3.02Å
1020	Q	29.8	Very low	36.9	Very low	139 Å²	139	106.1 Å²	106.1	65%	0.65	61%	0.61	S	S	*	*	S	Bend	trans	-88.9	143.2	177	-78.6	-167.5	-27.2	0	0	113.7
1021	P	28.8	Very low	35.4	Very low	124 Å²	124	110.6 Å²	110.6	81%	0.805	63%	0.628	S	S	*	*			trans	-71.3	141.3	-169.1	-18.8	33.1	0	0	0	114.5	G1023	P1021-G1023 PolarHBondContact O-N 2.75Å; P1021-G1023 VanDerWaalsContact O-N 3.08Å
1022	S	28.7	Very low	33.8	Very low	97 Å²	97	115.5 Å²	115.5	68%	0.678	65%	0.652	S	S	*	*			trans	-79.2	88.8	175.9	-176.4	0	0	0	0	112	R1024	S1022-R1024 PolarHBondContact O-N 2.99Å
1023	G	29.7	Very low	32.4	Very low	63 Å²	63	121.9 Å²	121.9	65%	0.649	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-55.6	133.5	165.1	0	0	0	0	0	111.4	P1021	P1021-G1023 PolarHBondContact O-N 2.75Å; P1021-G1023 VanDerWaalsContact O-N 3.08Å
1024	R	28.2	Very low	30.7	Very low	195 Å²	195	130.2 Å²	130.2	74%	0.736	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-63.5	134.3	-174.2	-75.8	177	162.2	-165.4	-9.5	112.4	S1022 I1195	S1022-R1024 PolarHBondContact O-N 2.99Å; R1024-I1195 VanDerWaalsContact NH1-CD1 3.34Å; R1024-I1195 VanDerWaalsContact NH2-CG2 3.26Å
1025	I	27.2	Very low	29.4	Very low	155 Å²	155	132.1 Å²	132.1	80%	0.795	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-89.9	125	153.7	-63.2	174.6	0	0	0	106.6
1026	S	25	Very low	28.5	Very low	95 Å²	95	137.5 Å²	137.5	66%	0.664	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-82.7	156.5	172.1	50.6	0	0	0	0	111.2
1027	T	24.9	Very low	27.4	Very low	128 Å²	128	139.8 Å²	139.8	79%	0.785	74%	0.743	S	S	*	*			trans	62	109.2	176.7	66.2	0	0	0	0	115.7
1028	V	26.3	Very low	26.4	Very low	134 Å²	134	139.3 Å²	139.3	81%	0.812	75%	0.747	S	S	*	*				-172.8	118.5	91.6	157.2	0	0	0	0	107.3
1029	D	24.7	Very low	25.7	Very low	146 Å²	146	146.7 Å²	146.7	78%	0.781	76%	0.762	S	S	*	*			trans	-78.8	127.1	164.2	-65.2	-76.4	0	0	0	109.3
1030	N	22.8	Very low	25.2	Very low	132 Å²	132	148.2 Å²	148.2	71%	0.706	77%	0.766	S	S	*	*				165	136.9	129.9	-88.6	-38.4	0	0	0	113.7
1031	I	22.6	Very low	24.9	Very low	141 Å²	141	146 Å²	146	72%	0.723	77%	0.766	S	S	*	*			trans	45.3	102.2	137	-48.3	163.3	0	0	0	117.3
1032	L	24.1	Very low	24.7	Very low	159 Å²	159	147.6 Å²	147.6	83%	0.832	77%	0.766	S	S	*	*				-156.3	137.5	109.7	-148.1	62.5	0	0	0	114.2
1033	Q	23	Very low	24.6	Very low	178 Å²	178	150.9 Å²	150.9	83%	0.832	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-63.3	134.7	-177.6	-153.3	165.4	3.7	0	0	113
1034	W	23.1	Very low	24.3	Very low	224 Å²	224	157 Å²	157	85%	0.848	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-77.4	142.1	162.5	-82.8	64.8	0	0	0	110
1035	P	22.3	Very low	24.1	Very low	117 Å²	117	155.8 Å²	155.8	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.9	138.3	177.3	28.3	-33.9	0	0	0	112.3
1036	K	26.4	Very low	24	Very low	195 Å²	195	152.8 Å²	152.8	85%	0.848	78%	0.78	S	S	*	*			trans	-78.8	-179.4	152.6	-73.2	-179.1	175.7	177.3	0	109
1037	I	23	Very low	24.1	Very low	159 Å²	159	156.2 Å²	156.2	82%	0.815	79%	0.79	S	S	*	*			trans	96.7	126.9	-179.7	-58.2	160.1	0	0	0	111.5
1038	N	22	Very low	24.3	Very low	133 Å²	133	161 Å²	161	71%	0.711	80%	0.796	S	S	*	*			cis	-143.1	165.9	-17.6	-115.6	3.1	0	0	0	110
1039	R	23.5	Very low	24.2	Very low	235 Å²	235	161.4 Å²	161.4	89%	0.887	79%	0.793	S	S	*	*			trans	-130.2	95.5	-177.8	-174.4	-169.9	-168.3	-170	3.8	110.3
1040	E	23.5	Very low	24.2	Very low	164 Å²	164	159.5 Å²	159.5	77%	0.766	79%	0.791	S	S	*	*			trans	-104.4	97.5	176	-72.9	-179	-172.5	0	0	110.7
1041	S	22.6	Very low	24.2	Very low	92 Å²	92	160.8 Å²	160.8	64%	0.643	80%	0.795	S	S	*	*			trans	-89.4	109.8	160.5	49	0	0	0	0	108.2	E1043	S1041-E1043 PolarHBondContact O-N 2.74Å
1042	I	25.4	Very low	24.4	Very low	158 Å²	158	161.8 Å²	161.8	81%	0.81	80%	0.796	S	S	*	*			trans	-85.4	96.8	172.1	-60.1	179.2	0	0	0	108.2
1043	E	25.9	Very low	24.4	Very low	166 Å²	166	165.3 Å²	165.3	78%	0.776	80%	0.798	S	S	*	*			trans	-69.9	148	156	-56.9	175	125	0	0	108.6	S1041	S1041-E1043 PolarHBondContact O-N 2.74Å
1044	F	24.8	Very low	25.1	Very low	190 Å²	190	162.2 Å²	162.2	83%	0.833	79%	0.794	S	S	*	*			trans	-165.3	109.5	131.7	-113.1	-68.9	0	0	0	111.3
1045	N	24.2	Very low	25.1	Very low	170 Å²	170	156.7 Å²	156.7	91%	0.909	79%	0.79	S	S	*	*			trans	-85.5	124	155.1	-86	-33	0	0	0	107.7
1046	S	24.6	Very low	25.3	Very low	92 Å²	92	159 Å²	159	64%	0.643	79%	0.79	S	S	*	*			trans	-148.1	161.4	163	65.5	0	0	0	0	109.9
1047	L	26.8	Very low	25.3	Very low	167 Å²	167	157 Å²	157	87%	0.874	79%	0.787	S	S	*	*			trans	64	59.1	176.1	-69.3	154.4	0	0	0	116.5
1048	Y	29.5	Very low	25.4	Very low	230 Å²	230	153.8 Å²	153.8	90%	0.902	78%	0.779	S	S	*	*			trans	-78.4	114.4	137.6	-141	-88.3	0	0	0	107.2
1049	N	24.1	Very low	25.5	Very low	142 Å²	142	153 Å²	153	76%	0.759	78%	0.778	S	S	*	*			trans	171.4	160.8	151.9	-93.3	-30.6	0	0	0	114.4
1050	S	25.1	Very low	25.7	Very low	105 Å²	105	150 Å²	150	73%	0.734	78%	0.779	S	S	*	*			trans	66.8	124.2	-171.7	75.2	0	0	0	0	112.9
1051	M	22.6	Very low	25.8	Very low	160 Å²	160	147.3 Å²	147.3	79%	0.788	77%	0.774	S	S	*	*				58.2	103.3	51.2	-56.4	-171.8	173.3	0	0	111.7
1052	H	26.9	Very low	25.9	Very low	162 Å²	162	148.9 Å²	148.9	75%	0.75	78%	0.78	S	S	*	*				-170.5	144.6	67.1	-98.1	-72.3	0	0	0	114.8
1053	R	24.2	Very low	26	Very low	232 Å²	232	147 Å²	147	88%	0.875	78%	0.78	S	S	*	*			trans	43.8	152.5	142.3	-93	-165.2	161.2	133.3	-1	123.3
1054	P	36.6	Very low	26	Very low	113 Å²	113	144.1 Å²	144.1	73%	0.734	78%	0.779	S	S	*	*			trans	-101	158.6	-174.5	40.6	-35.2	0	0	0	114.6
1055	S	24.3	Very low	26	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	78%	0.778	S	S	*	*			trans	-168.9	152.6	158.6	38.4	0	0	0	0	108.5
1056	Q	25.3	Very low	26.1	Very low	166 Å²	166	140.3 Å²	140.3	78%	0.776	77%	0.773	S	S	*	*			cis	-173.7	167.5	-23.1	-119.1	169.9	-9.3	0	0	106.5
1057	I	26.1	Very low	26	Very low	153 Å²	153	143.5 Å²	143.5	79%	0.785	78%	0.78	S	S	*	*			trans	67.1	133.2	157.4	-65.3	156.2	0	0	0	115.8
1058	S	25	Very low	26.1	Very low	91 Å²	91	142.6 Å²	142.6	64%	0.636	77%	0.771	S	S	*	*			cis	-161.2	132.8	-11.3	49.2	0	0	0	0	112.8
1059	V	24.4	Very low	25.9	Very low	116 Å²	116	140.7 Å²	140.7	70%	0.703	77%	0.77	S	S	*	*				35.5	109.9	125.5	-169.2	0	0	0	0	118.2
1060	L	29	Very low	26	Very low	173 Å²	173	139 Å²	139	91%	0.906	77%	0.765	S	S	*	*				-148.1	147.8	106.1	-134.9	91.8	0	0	0	110.9
1061	T	24.8	Very low	25.9	Very low	106 Å²	106	142.8 Å²	142.8	65%	0.65	77%	0.771	S	S	*	*			trans	-115.8	170.2	-155.6	46.4	0	0	0	0	115.3
1062	T	24.6	Very low	26.1	Very low	125 Å²	125	142 Å²	142	77%	0.767	77%	0.769	S	S	*	*			trans	70.7	94.8	147.2	39.2	0	0	0	0	120.2
1063	S	28.2	Very low	26.1	Very low	118 Å²	118	140 Å²	140	83%	0.825	76%	0.764	S	S	*	*				-159.2	71.7	120	14	0	0	0	0	112.4	L1065	S1063-L1065 PolarHBondContact O-N 3.2Å
1064	S	25.5	Very low	26.2	Very low	106 Å²	106	136.5 Å²	136.5	74%	0.741	76%	0.757	S	S	*	*			trans	24	89.6	146	58.6	0	0	0	0	120.4
1065	L	25.2	Very low	25.8	Very low	156 Å²	156	137.4 Å²	137.4	82%	0.817	76%	0.755	S	S	*	*				178.7	160.6	103.9	-112.8	66.1	0	0	0	109.6	S1063	S1063-L1065 PolarHBondContact O-N 3.2Å
1066	P	25.5	Very low	26	Very low	124 Å²	124	139.4 Å²	139.4	81%	0.805	75%	0.751	S	S	*	*			trans	-77.6	146.5	-148.4	28.2	-35.9	0	0	0	116.5
1067	M	23.1	Very low	26.3	Very low	159 Å²	159	137.3 Å²	137.3	78%	0.783	75%	0.745	S	S	*	*			trans	-80.1	164.8	167.6	-69.1	179.8	80	0	0	111.7
1068	H	28.8	Very low	26.6	Very low	149 Å²	149	133.5 Å²	133.5	69%	0.69	73%	0.728	S	S	*	*			trans	30.5	122.4	145.7	-77.2	-103.5	0	0	0	118.7
1069	E	24.2	Very low	27	Very low	189 Å²	189	131.3 Å²	131.3	88%	0.883	72%	0.721	S	S	*	*				-135.8	146.3	99.9	-139.3	161.5	-149	0	0	110.6	E1071	E1069-E1071 PolarHBondContact O-N 3.2Å
1070	T	26.3	Very low	27.5	Very low	106 Å²	106	129.4 Å²	129.4	65%	0.65	71%	0.71	S	S	*	*			trans	-97	82.5	-178.5	46.9	0	0	0	0	109.5	I1072	T1070-I1072 PolarHBondContact O-N 2.84Å
1071	E	23.8	Very low	27.9	Very low	185 Å²	185	125.3 Å²	125.3	86%	0.864	69%	0.689	S	S	*	*			trans	-60.5	120.6	165.5	-76	-163.5	119.5	0	0	109.2	E1069	E1069-E1071 PolarHBondContact O-N 3.2Å
1072	I	26.2	Very low	28.5	Very low	145 Å²	145	125.2 Å²	125.2	74%	0.744	68%	0.684	S	S	*	*			trans	-81.1	123.7	176.7	-64.2	171.4	0	0	0	107	T1070 Q1074	T1070-I1072 PolarHBondContact O-N 2.84Å; I1072-Q1074 VanDerWaalsContact C-N 3.26Å; I1072-Q1074 PolarHBondContact O-N 3.04Å
1073	D	26.5	Very low	29.2	Very low	120 Å²	120	127 Å²	127	64%	0.642	68%	0.677	S	S	*	*			trans	-58.4	68.9	-174.9	-84.8	-53.8	0	0	0	115.4	I1075	D1073-I1075 PolarHBondContact O-N 3.42Å
1074	Q	27.2	Very low	29.8	Very low	157 Å²	157	126.6 Å²	126.6	73%	0.734	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-19.3	171.4	-67.2	-169.9	-4.9	0	0	112.1	I1072 H1076 L1077	I1072-Q1074 VanDerWaalsContact C-N 3.26Å; I1072-Q1074 PolarHBondContact O-N 3.04Å; Q1074-H1076 PolarHBondContact O-N 2.85Å; Q1074-H1076 VanDerWaalsContact O-N 3.1Å; Q1074-L1077 PolarHBondContact O-N 3.41Å
1075	I	27.7	Very low	30.6	Very low	133 Å²	133	126.8 Å²	126.8	68%	0.682	65%	0.654	S	S	*	*	H	α-helix	trans	-57	-27.8	179.5	-60.8	175.1	0	0	0	111.9	D1073 L1077 V1078	D1073-I1075 PolarHBondContact O-N 3.42Å; I1075-L1077 PolarHBondContact O-N 3.29Å; I1075-V1078 PolarHBondContact O-N 3.12Å
1076	H	29.4	Very low	31.5	Very low	150 Å²	150	122.3 Å²	122.3	69%	0.694	64%	0.639	S	S	*	*	H	α-helix	trans	-75.3	-13.6	-178.4	-92.8	-54.8	0	0	0	116.1	Q1074	Q1074-H1076 PolarHBondContact O-N 2.85Å; Q1074-H1076 VanDerWaalsContact O-N 3.1Å
1077	L	31.8	Very low	32.3	Very low	122 Å²	122	120.5 Å²	120.5	64%	0.639	62%	0.62	S	S	*	*	H	α-helix	trans	-93.8	-23.1	172.3	-98.4	78.5	0	0	0	114	Q1074 I1075 G1079 P1080 I1081	Q1074-L1077 PolarHBondContact O-N 3.41Å; I1075-L1077 PolarHBondContact O-N 3.29Å; L1077-G1079 PolarHBondContact O-N 2.88Å; L1077-P1080 WeakPolarHBondContact O-CD 3.01Å; L1077-I1081 HydrophobicContact CB-CD1 4.35Å; L1077-I1081 WeakPolarHBondContact O-CG1 3.36Å; L1077-I1081 PolarHBondContact O-N 3.24Å
1078	V	31.1	Very low	33.3	Very low	73 Å²	73	116.1 Å²	116.1	44%	0.442	60%	0.602	S	S	.	*	H	α-helix	trans	-64.2	-41.7	-175.4	-179.2	0	0	0	0	111.5	I1075 I1081 L1082	I1075-V1078 PolarHBondContact O-N 3.12Å; V1078-I1081 PolarHBondContact O-N 3.14Å; V1078-L1082 HydrophobicContact CG1-CD1 3.65Å; V1078-L1082 HydrophobicContact CG1-CG 3.92Å; V1078-L1082 WeakPolarHBondContact O-CB 3.3Å; V1078-L1082 WeakPolarHBondContact O-CG 3.35Å; V1078-L1082 PolarHBondContact O-N 3.35Å
1079	G	34.5	Very low	34.1	Very low	46 Å²	46	114.9 Å²	114.9	47%	0.474	60%	0.596	S	S	.	*	H	α-helix	trans	-57.6	-51.8	178.7	0	0	0	0	0	114.3	L1077 I1081 R1083	L1077-G1079 PolarHBondContact O-N 2.88Å; G1079-I1081 PolarHBondContact O-N 2.83Å; G1079-R1083 WeakPolarHBondContact O-CB 3.37Å; G1079-R1083 PolarHBondContact O-N 3.07Å; G1079-R1083 VanDerWaalsContact O-N 3.07Å
1080	P	35.3	Very low	35.3	Very low	75 Å²	75	113.6 Å²	113.6	49%	0.487	58%	0.583	S	S	.	*	H	α-helix	trans	-59.9	-37.1	172.4	-28.4	35.5	0	0	0	115	L1077 L1084	L1077-P1080 WeakPolarHBondContact O-CD 3.01Å; P1080-L1084 WeakPolarHBondContact O-CG 3.48Å; P1080-L1084 PolarHBondContact O-N 3.29Å
1081	I	36.8	Very low	36.3	Very low	88 Å²	88	113 Å²	113	45%	0.451	58%	0.575	S	S	.	*	H	α-helix	trans	-74.1	-48.4	-177.7	-66.5	170.5	0	0	0	111.1	L1077 V1078 G1079 R1083 L1084 Q1085	L1077-I1081 HydrophobicContact CB-CD1 4.35Å; L1077-I1081 WeakPolarHBondContact O-CG1 3.36Å; L1077-I1081 PolarHBondContact O-N 3.24Å; V1078-I1081 PolarHBondContact O-N 3.14Å; G1079-I1081 PolarHBondContact O-N 2.83Å; I1081-R1083 PolarHBondContact O-N 2.84Å; I1081-L1084 PolarHBondContact O-N 3.35Å; I1081-Q1085 PolarHBondContact O-N 3.03Å
1082	L	37	Very low	37.4	Very low	104 Å²	104	106.8 Å²	106.8	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-58.4	-35.4	173	-72.1	179.8	0	0	0	111.6	V1078 Q1085 A1086	V1078-L1082 HydrophobicContact CG1-CD1 3.65Å; V1078-L1082 HydrophobicContact CG1-CG 3.92Å; V1078-L1082 WeakPolarHBondContact O-CB 3.3Å; V1078-L1082 WeakPolarHBondContact O-CG 3.35Å; V1078-L1082 PolarHBondContact O-N 3.35Å; L1082-Q1085 PolarHBondContact O-N 3.31Å; L1082-A1086 WeakPolarHBondContact O-CB 3.44Å; L1082-A1086 PolarHBondContact O-N 3.48Å
1083	R	40.3	Very low	38.8	Very low	163 Å²	163	104.5 Å²	104.5	62%	0.615	53%	0.532	S	S	*	.	H	α-helix	trans	-66.3	-41.3	173.7	179.5	176.6	175.5	142.1	11.8	112.5	G1079 I1081 A1086 E1087	G1079-R1083 WeakPolarHBondContact O-CB 3.37Å; G1079-R1083 PolarHBondContact O-N 3.07Å; G1079-R1083 VanDerWaalsContact O-N 3.07Å; I1081-R1083 PolarHBondContact O-N 2.84Å; R1083-A1086 PolarHBondContact O-N 2.85Å; R1083-E1087 HydrophobicContact CG-CG 4.44Å; R1083-E1087 IonicContact CZ-OE1 2.74Å; R1083-E1087 IonicContact NE-OE1 3.54Å; R1083-E1087 PolarHBondContact NE-OE1 2.97Å; R1083-E1087 IonicContact NH2-OE1 3.56Å; R1083-E1087 PolarHBondContact NH2-OE1 2.99Å; R1083-E1087 WeakPolarHBondContact O-CB 3.46Å; R1083-E1087 WeakPolarHBondContact O-CG 3.32Å; R1083-E1087 PolarHBondContact O-N 3.42Å
1084	L	39.1	Very low	40.2	Very low	109 Å²	109	104 Å²	104	57%	0.571	53%	0.525	S	S	*	.	H	α-helix	trans	-66.7	-40	175.2	-80.5	164.3	0	0	0	111.6	P1080 I1081 E1087 V1088	P1080-L1084 WeakPolarHBondContact O-CG 3.48Å; P1080-L1084 PolarHBondContact O-N 3.29Å; I1081-L1084 PolarHBondContact O-N 3.35Å; L1084-E1087 PolarHBondContact O-N 2.8Å; L1084-V1088 WeakPolarHBondContact O-CB 3.37Å; L1084-V1088 VanDerWaalsContact O-CG2 3.29Å; L1084-V1088 WeakPolarHBondContact O-CG2 3.48Å; L1084-V1088 PolarHBondContact O-N 3.49Å
1085	Q	43.4	Very low	41.1	Very low	110 Å²	110	100.4 Å²	100.4	51%	0.514	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-42	172.6	-72.1	178	-80.2	0	0	111.8	I1081 L1082 V1088 H1089	I1081-Q1085 PolarHBondContact O-N 3.03Å; L1082-Q1085 PolarHBondContact O-N 3.31Å; Q1085-V1088 PolarHBondContact O-N 2.75Å; Q1085-H1089 VanDerWaalsContact O-CB 3.31Å; Q1085-H1089 WeakPolarHBondContact O-CB 3.45Å; Q1085-H1089 PolarHBondContact O-N 2.76Å
1086	A	44.3	Very low	42.4	Very low	61 Å²	61	99.2 Å²	99.2	50%	0.504	51%	0.505	S	S	.	.	H	α-helix	trans	-66.7	-39.4	175.5	0	0	0	0	0	112.9	L1082 R1083 W1090	L1082-A1086 WeakPolarHBondContact O-CB 3.44Å; L1082-A1086 PolarHBondContact O-N 3.48Å; R1083-A1086 PolarHBondContact O-N 2.85Å; A1086-W1090 VanDerWaalsContact O-CB 3.24Å; A1086-W1090 WeakPolarHBondContact O-CB 3.48Å; A1086-W1090 PolarHBondContact O-N 2.87Å
1087	E	41.3	Very low	43.8	Very low	86 Å²	86	97 Å²	97	40%	0.402	50%	0.495	S	S	.	.	H	α-helix	trans	-70.2	-31.1	176	-73.7	177.4	-174	0	0	111.8	R1083 L1084 I1091	R1083-E1087 HydrophobicContact CG-CG 4.44Å; R1083-E1087 IonicContact CZ-OE1 2.74Å; R1083-E1087 IonicContact NE-OE1 3.54Å; R1083-E1087 PolarHBondContact NE-OE1 2.97Å; R1083-E1087 IonicContact NH2-OE1 3.56Å; R1083-E1087 PolarHBondContact NH2-OE1 2.99Å; R1083-E1087 WeakPolarHBondContact O-CB 3.46Å; R1083-E1087 WeakPolarHBondContact O-CG 3.32Å; R1083-E1087 PolarHBondContact O-N 3.42Å; L1084-E1087 PolarHBondContact O-N 2.8Å; E1087-I1091 WeakPolarHBondContact O-CD1 3.09Å; E1087-I1091 VanDerWaalsContact O-CG1 3.28Å; E1087-I1091 WeakPolarHBondContact O-CG1 3.32Å; E1087-I1091 PolarHBondContact O-N 2.89Å
1088	V	44.2	Very low	44.9	Very low	67 Å²	67	93.9 Å²	93.9	41%	0.406	48%	0.477	S	S	.	.	H	α-helix	trans	-72.2	-51.7	171.9	168.5	0	0	0	0	112.1	L1084 Q1085 W1090 I1091 E1092	L1084-V1088 WeakPolarHBondContact O-CB 3.37Å; L1084-V1088 VanDerWaalsContact O-CG2 3.29Å; L1084-V1088 WeakPolarHBondContact O-CG2 3.48Å; L1084-V1088 PolarHBondContact O-N 3.49Å; Q1085-V1088 PolarHBondContact O-N 2.75Å; V1088-W1090 PolarHBondContact O-N 3.04Å; V1088-I1091 WeakPolarHBondContact O-CA 3.35Å; V1088-I1091 WeakPolarHBondContact O-CB 3.37Å; V1088-I1091 PolarHBondContact O-N 3.09Å; V1088-E1092 PolarHBondContact O-N 2.84Å
1089	H	46	Very low	45.7	Very low	123 Å²	123	96.3 Å²	96.3	57%	0.569	49%	0.487	S	S	*	.	H	α-helix	trans	-61.3	-31.3	-179.7	-170.5	-49.7	0	0	0	111.8	Q1085 E1093	Q1085-H1089 VanDerWaalsContact O-CB 3.31Å; Q1085-H1089 WeakPolarHBondContact O-CB 3.45Å; Q1085-H1089 PolarHBondContact O-N 2.76Å; H1089-E1093 WeakPolarHBondContact O-CB 3.38Å; H1089-E1093 PolarHBondContact O-N 2.96Å
1090	W	49.4	Very low	46.9	Very low	163 Å²	163	100.2 Å²	100.2	62%	0.617	49%	0.491	S	S	*	.	H	α-helix	trans	-68.8	-34.6	172.6	-176	75.8	0	0	0	113	A1086 V1088 F1094	A1086-W1090 VanDerWaalsContact O-CB 3.24Å; A1086-W1090 WeakPolarHBondContact O-CB 3.48Å; A1086-W1090 PolarHBondContact O-N 2.87Å; V1088-W1090 PolarHBondContact O-N 3.04Å; W1090-F1094 WeakPolarHBondContact O-CB 3.46Å; W1090-F1094 PolarHBondContact O-N 2.93Å
1091	I	47.4	Very low	47.6	Very low	94 Å²	94	103.1 Å²	103.1	48%	0.482	49%	0.492	S	S	.	.	H	α-helix	trans	-69.7	-41.4	174.5	-69.9	164.8	0	0	0	110.5	E1087 V1088 F1094 T1095	E1087-I1091 WeakPolarHBondContact O-CD1 3.09Å; E1087-I1091 VanDerWaalsContact O-CG1 3.28Å; E1087-I1091 WeakPolarHBondContact O-CG1 3.32Å; E1087-I1091 PolarHBondContact O-N 2.89Å; V1088-I1091 WeakPolarHBondContact O-CA 3.35Å; V1088-I1091 WeakPolarHBondContact O-CB 3.37Å; V1088-I1091 PolarHBondContact O-N 3.09Å; I1091-F1094 PolarHBondContact O-N 3.01Å; I1091-T1095 HydrophobicContact CG2-CG2 4.47Å; I1091-T1095 WeakPolarHBondContact O-CG2 3.43Å; I1091-T1095 PolarHBondContact O-N 3.06Å; I1091-T1095 PolarHBondContact O-OG1 2.78Å; I1091-T1095 VanDerWaalsContact O-OG1 3.09Å
1092	E	47	Very low	48.2	Very low	53 Å²	53	103.2 Å²	103.2	25%	0.248	49%	0.49	C	S	.	.	H	α-helix	trans	-62.1	-49.6	176.3	-68.4	-179.3	137.4	0	0	111.1	V1088 F1094 T1095 E1096	V1088-E1092 PolarHBondContact O-N 2.84Å; E1092-F1094 VanDerWaalsContact C-N 3.34Å; E1092-F1094 PolarHBondContact O-N 2.88Å; E1092-T1095 PolarHBondContact O-N 2.83Å; E1092-T1095 PolarHBondContact O-OG1 3.01Å; E1092-E1096 PolarHBondContact O-N 2.89Å
1093	E	55.5	Low	48.9	Very low	97 Å²	97	103.1 Å²	103.1	45%	0.453	49%	0.49	S	S	.	.	H	α-helix	trans	-60.6	-40.9	176.2	-165.1	-172.3	172.8	0	0	112.3	H1089 E1096 Q1097	H1089-E1093 WeakPolarHBondContact O-CB 3.38Å; H1089-E1093 PolarHBondContact O-N 2.96Å; E1093-E1096 PolarHBondContact O-N 3.43Å; E1093-Q1097 WeakPolarHBondContact O-CB 3.32Å; E1093-Q1097 WeakPolarHBondContact O-CG 3.1Å; E1093-Q1097 PolarHBondContact O-N 3.48Å; E1093-Q1097 PolarHBondContact OE1-NE2 3.33Å; E1093-Q1097 VanDerWaalsContact OE1-NE2 3.11Å
1094	F	55	Low	49.7	Very low	111 Å²	111	98.7 Å²	98.7	49%	0.487	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-43	175.4	178.6	-98	0	0	0	112.3	W1090 I1091 E1092 Q1097 E1098	W1090-F1094 WeakPolarHBondContact O-CB 3.46Å; W1090-F1094 PolarHBondContact O-N 2.93Å; I1091-F1094 PolarHBondContact O-N 3.01Å; E1092-F1094 VanDerWaalsContact C-N 3.34Å; E1092-F1094 PolarHBondContact O-N 2.88Å; F1094-Q1097 PolarHBondContact O-N 3.27Å; F1094-E1098 WeakPolarHBondContact O-CB 3.12Å; F1094-E1098 PolarHBondContact O-N 3.46Å
1095	T	47.3	Very low	50.2	Low	80 Å²	80	99.9 Å²	99.9	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-69.1	-34.5	179.4	53.8	0	0	0	0	113.2	I1091 E1092 L1099	I1091-T1095 HydrophobicContact CG2-CG2 4.47Å; I1091-T1095 WeakPolarHBondContact O-CG2 3.43Å; I1091-T1095 PolarHBondContact O-N 3.06Å; I1091-T1095 PolarHBondContact O-OG1 2.78Å; I1091-T1095 VanDerWaalsContact O-OG1 3.09Å; E1092-T1095 PolarHBondContact O-N 2.83Å; E1092-T1095 PolarHBondContact O-OG1 3.01Å; T1095-L1099 VanDerWaalsContact O-CB 3.27Å; T1095-L1099 WeakPolarHBondContact O-CB 3.49Å; T1095-L1099 PolarHBondContact O-N 3.4Å
1096	E	55.1	Low	50.4	Low	108 Å²	108	98.2 Å²	98.2	51%	0.505	47%	0.473	S	S	.	.	H	α-helix	trans	-69.6	-40.8	173.6	-157.2	-160.2	127.6	0	0	111.8	E1092 E1093 L1099 K1100	E1092-E1096 PolarHBondContact O-N 2.89Å; E1093-E1096 PolarHBondContact O-N 3.43Å; E1096-L1099 PolarHBondContact O-N 3.45Å; E1096-K1100 PolarHBondContact O-N 3.17Å; E1096-K1100 VanDerWaalsContact OE1-CE 3.28Å; E1096-K1100 WeakPolarHBondContact OE1-CE 3.46Å; E1096-K1100 IonicContact OE1-NZ 3.75Å; E1096-K1100 PolarHBondContact OE1-NZ 3.36Å
1097	Q	57.9	Low	50.8	Low	105 Å²	105	101 Å²	101	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-65.1	-43.8	177	-73.3	-177	24.7	0	0	112.1	E1093 F1094 K1100 R1101	E1093-Q1097 WeakPolarHBondContact O-CB 3.32Å; E1093-Q1097 WeakPolarHBondContact O-CG 3.1Å; E1093-Q1097 PolarHBondContact O-N 3.48Å; E1093-Q1097 PolarHBondContact OE1-NE2 3.33Å; E1093-Q1097 VanDerWaalsContact OE1-NE2 3.11Å; F1094-Q1097 PolarHBondContact O-N 3.27Å; Q1097-K1100 PolarHBondContact O-N 3.37Å; Q1097-R1101 WeakPolarHBondContact O-CB 3.49Å; Q1097-R1101 PolarHBondContact O-N 2.92Å
1098	E	55.9	Low	51.5	Low	56 Å²	56	104.5 Å²	104.5	26%	0.262	49%	0.486	S	S	.	.	H	α-helix	trans	-67.6	-38.6	176.8	-176.7	58.9	-162.6	0	0	111.5	F1094 K1100 R1101 Q1102	F1094-E1098 WeakPolarHBondContact O-CB 3.12Å; F1094-E1098 PolarHBondContact O-N 3.46Å; E1098-K1100 VanDerWaalsContact C-N 3.34Å; E1098-K1100 PolarHBondContact O-N 2.87Å; E1098-R1101 PolarHBondContact O-N 3.27Å; E1098-R1101 VanDerWaalsContact O-N 3.15Å; E1098-R1101 IonicContact OE1-CZ 2.7Å; E1098-R1101 IonicContact OE1-NE 3.55Å; E1098-R1101 IonicContact OE1-NH2 3.59Å; E1098-R1101 PolarHBondContact OE1-NH2 2.74Å; E1098-R1101 IonicContact OE2-CZ 2.95Å; E1098-R1101 IonicContact OE2-NE 2.66Å; E1098-R1101 PolarHBondContact OE2-NE 2.75Å; E1098-R1101 IonicContact OE2-NH2 3.3Å; E1098-R1101 PolarHBondContact OE2-NH2 3.3Å; E1098-Q1102 HydrophobicContact CG-CG 4.43Å; E1098-Q1102 VanDerWaalsContact O-CG 3.27Å; E1098-Q1102 WeakPolarHBondContact O-CG 3.48Å; E1098-Q1102 PolarHBondContact O-N 3.37Å; E1098-Q1102 PolarHBondContact OE1-NE2 2.78Å
1099	L	47.4	Very low	51.6	Low	123 Å²	123	107 Å²	107	64%	0.644	49%	0.494	S	S	*	.	H	α-helix	trans	-60.8	-42.7	174.8	-171	70.7	0	0	0	111.7	T1095 E1096 Q1102 L1103	T1095-L1099 VanDerWaalsContact O-CB 3.27Å; T1095-L1099 WeakPolarHBondContact O-CB 3.49Å; T1095-L1099 PolarHBondContact O-N 3.4Å; E1096-L1099 PolarHBondContact O-N 3.45Å; L1099-Q1102 PolarHBondContact O-N 2.66Å; L1099-L1103 PolarHBondContact O-N 2.77Å
1100	K	59.8	Low	52	Low	129 Å²	129	106.5 Å²	106.5	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-40.9	172.8	-80.6	169.7	169.7	167.5	0	112.3	E1096 Q1097 E1098 L1103 D1104	E1096-K1100 PolarHBondContact O-N 3.17Å; E1096-K1100 VanDerWaalsContact OE1-CE 3.28Å; E1096-K1100 WeakPolarHBondContact OE1-CE 3.46Å; E1096-K1100 IonicContact OE1-NZ 3.75Å; E1096-K1100 PolarHBondContact OE1-NZ 3.36Å; Q1097-K1100 PolarHBondContact O-N 3.37Å; E1098-K1100 VanDerWaalsContact C-N 3.34Å; E1098-K1100 PolarHBondContact O-N 2.87Å; K1100-L1103 PolarHBondContact O-N 2.72Å; K1100-D1104 WeakPolarHBondContact O-CB 3.39Å; K1100-D1104 PolarHBondContact O-N 2.63Å
1101	R	50.5	Low	52.3	Low	136 Å²	136	104.6 Å²	104.6	51%	0.513	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-39.2	177.6	-163.1	-176.7	73	83.6	4.7	112.3	Q1097 E1098 Y1105	Q1097-R1101 WeakPolarHBondContact O-CB 3.49Å; Q1097-R1101 PolarHBondContact O-N 2.92Å; E1098-R1101 PolarHBondContact O-N 3.27Å; E1098-R1101 VanDerWaalsContact O-N 3.15Å; E1098-R1101 IonicContact OE1-CZ 2.7Å; E1098-R1101 IonicContact OE1-NE 3.55Å; E1098-R1101 IonicContact OE1-NH2 3.59Å; E1098-R1101 PolarHBondContact OE1-NH2 2.74Å; E1098-R1101 IonicContact OE2-CZ 2.95Å; E1098-R1101 IonicContact OE2-NE 2.66Å; E1098-R1101 PolarHBondContact OE2-NE 2.75Å; E1098-R1101 IonicContact OE2-NH2 3.3Å; E1098-R1101 PolarHBondContact OE2-NH2 3.3Å; R1101-Y1105 VanDerWaalsContact O-CB 3.29Å; R1101-Y1105 WeakPolarHBondContact O-CB 3.41Å; R1101-Y1105 PolarHBondContact O-N 2.77Å
1102	Q	48.9	Very low	52.5	Low	90 Å²	90	103 Å²	103	42%	0.421	49%	0.492	S	S	.	.	H	α-helix	trans	-66.8	-39.7	174.1	-67	-70.3	-24.7	0	0	111.5	E1098 L1099 Y1105 V1106	E1098-Q1102 HydrophobicContact CG-CG 4.43Å; E1098-Q1102 VanDerWaalsContact O-CG 3.27Å; E1098-Q1102 WeakPolarHBondContact O-CG 3.48Å; E1098-Q1102 PolarHBondContact O-N 3.37Å; E1098-Q1102 PolarHBondContact OE1-NE2 2.78Å; L1099-Q1102 PolarHBondContact O-N 2.66Å; Q1102-Y1105 PolarHBondContact O-N 3.35Å; Q1102-V1106 WeakPolarHBondContact O-CB 3.49Å; Q1102-V1106 WeakPolarHBondContact O-CG2 3.39Å; Q1102-V1106 PolarHBondContact O-N 3.46Å
1103	L	52.1	Low	52.3	Low	101 Å²	101	104.2 Å²	104.2	53%	0.529	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-47.7	177.6	-150.2	81.3	0	0	0	112.2	L1099 K1100 V1106 E1107	L1099-L1103 PolarHBondContact O-N 2.77Å; K1100-L1103 PolarHBondContact O-N 2.72Å; L1103-V1106 PolarHBondContact O-N 2.84Å; L1103-E1107 PolarHBondContact O-N 2.92Å
1104	D	56	Low	52.1	Low	70 Å²	70	103.9 Å²	103.9	37%	0.374	50%	0.504	S	S	.	.	H	α-helix	trans	-64.7	-39.8	176.7	175	13.8	0	0	0	111.8	K1100 V1106 E1107 R1108	K1100-D1104 WeakPolarHBondContact O-CB 3.39Å; K1100-D1104 PolarHBondContact O-N 2.63Å; D1104-V1106 PolarHBondContact O-N 3.46Å; D1104-E1107 PolarHBondContact O-N 3.28Å; D1104-R1108 VanDerWaalsContact CG-NH2 3.26Å; D1104-R1108 WeakPolarHBondContact O-CB 3.05Å; D1104-R1108 PolarHBondContact O-N 3.49Å; D1104-R1108 IonicContact OD1-CZ 3.2Å; D1104-R1108 IonicContact OD1-NE 3.88Å; D1104-R1108 PolarHBondContact OD1-NE 2.97Å; D1104-R1108 IonicContact OD1-NH2 3.2Å; D1104-R1108 PolarHBondContact OD1-NH2 2.77Å; D1104-R1108 IonicContact OD2-CZ 2.74Å; D1104-R1108 IonicContact OD2-NE 2.84Å; D1104-R1108 IonicContact OD2-NH2 3.69Å; D1104-R1108 PolarHBondContact OD2-NH2 3.44Å
1105	Y	49.9	Very low	52.1	Low	135 Å²	135	104.8 Å²	104.8	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-61.1	-44.2	172.2	-174.1	-94.1	0	0	0	112.1	R1101 Q1102 R1108 M1109	R1101-Y1105 VanDerWaalsContact O-CB 3.29Å; R1101-Y1105 WeakPolarHBondContact O-CB 3.41Å; R1101-Y1105 PolarHBondContact O-N 2.77Å; Q1102-Y1105 PolarHBondContact O-N 3.35Å; Y1105-R1108 PolarHBondContact O-N 2.76Å; Y1105-M1109 HydrophobicContact CE1-SD 3.78Å; Y1105-M1109 WeakPolarHBondContact O-CB 3.48Å; Y1105-M1109 PolarHBondContact O-N 3.47Å
1106	V	48.5	Very low	52.4	Low	74 Å²	74	103.4 Å²	103.4	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-38.3	175.8	168.4	0	0	0	0	111.7	Q1102 L1103 D1104 K1110	Q1102-V1106 WeakPolarHBondContact O-CB 3.49Å; Q1102-V1106 WeakPolarHBondContact O-CG2 3.39Å; Q1102-V1106 PolarHBondContact O-N 3.46Å; L1103-V1106 PolarHBondContact O-N 2.84Å; D1104-V1106 PolarHBondContact O-N 3.46Å; V1106-K1110 VanDerWaalsContact O-CB 3.24Å; V1106-K1110 WeakPolarHBondContact O-CB 3.46Å; V1106-K1110 PolarHBondContact O-N 2.84Å
1107	E	52.2	Low	52.1	Low	121 Å²	121	104.3 Å²	104.3	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-69.1	-41.4	177.2	-175.9	150.4	-128.9	0	0	112.4	L1103 D1104 K1110 L1111	L1103-E1107 PolarHBondContact O-N 2.92Å; D1104-E1107 PolarHBondContact O-N 3.28Å; E1107-K1110 WeakPolarHBondContact O-CB 3.14Å; E1107-K1110 PolarHBondContact O-N 2.92Å; E1107-L1111 PolarHBondContact O-N 3.05Å
1108	R	55.8	Low	51.8	Low	159 Å²	159	103.1 Å²	103.1	60%	0.6	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-41.2	172.8	-75	-169.8	-106.2	167.3	-9.5	112.7	D1104 Y1105 K1110 L1111 A1112	D1104-R1108 VanDerWaalsContact CG-NH2 3.26Å; D1104-R1108 WeakPolarHBondContact O-CB 3.05Å; D1104-R1108 PolarHBondContact O-N 3.49Å; D1104-R1108 IonicContact OD1-CZ 3.2Å; D1104-R1108 IonicContact OD1-NE 3.88Å; D1104-R1108 PolarHBondContact OD1-NE 2.97Å; D1104-R1108 IonicContact OD1-NH2 3.2Å; D1104-R1108 PolarHBondContact OD1-NH2 2.77Å; D1104-R1108 IonicContact OD2-CZ 2.74Å; D1104-R1108 IonicContact OD2-NE 2.84Å; D1104-R1108 IonicContact OD2-NH2 3.69Å; D1104-R1108 PolarHBondContact OD2-NH2 3.44Å; Y1105-R1108 PolarHBondContact O-N 2.76Å; R1108-K1110 VanDerWaalsContact C-N 3.34Å; R1108-L1111 PolarHBondContact O-N 3.02Å; R1108-A1112 WeakPolarHBondContact O-CB 3.42Å; R1108-A1112 PolarHBondContact O-N 3.29Å
1109	M	46.9	Very low	51.8	Low	118 Å²	118	103.1 Å²	103.1	58%	0.581	52%	0.516	S	S	*	.	H	α-helix	trans	-66.1	-36.5	176.8	-174.2	168.7	168.8	0	0	111.7	Y1105 C1113	Y1105-M1109 HydrophobicContact CE1-SD 3.78Å; Y1105-M1109 WeakPolarHBondContact O-CB 3.48Å; Y1105-M1109 PolarHBondContact O-N 3.47Å; M1109-C1113 VanDerWaalsContact O-CB 3.22Å; M1109-C1113 WeakPolarHBondContact O-CB 3.37Å; M1109-C1113 PolarHBondContact O-N 3.06Å
1110	K	53.1	Low	51.9	Low	114 Å²	114	104.1 Å²	104.1	50%	0.496	52%	0.517	S	S	.	.	H	α-helix	trans	-60.9	-49.7	167.8	170.7	-167.2	164.9	-157.7	0	111.2	V1106 E1107 R1108 A1112 C1113 Q1114	V1106-K1110 VanDerWaalsContact O-CB 3.24Å; V1106-K1110 WeakPolarHBondContact O-CB 3.46Å; V1106-K1110 PolarHBondContact O-N 2.84Å; E1107-K1110 WeakPolarHBondContact O-CB 3.14Å; E1107-K1110 PolarHBondContact O-N 2.92Å; R1108-K1110 VanDerWaalsContact C-N 3.34Å; K1110-A1112 PolarHBondContact O-N 3.19Å; K1110-C1113 PolarHBondContact O-N 2.91Å; K1110-Q1114 WeakPolarHBondContact O-CB 3.33Å; K1110-Q1114 WeakPolarHBondContact O-CG 3.42Å; K1110-Q1114 PolarHBondContact O-N 3.48Å
1111	L	56.7	Low	51.6	Low	122 Å²	122	103 Å²	103	64%	0.639	52%	0.517	S	S	*	.	H	α-helix	trans	-62.3	-43.4	-178.4	-152.4	84.6	0	0	0	111.7	E1107 R1108 Q1114 H1115	E1107-L1111 PolarHBondContact O-N 3.05Å; R1108-L1111 PolarHBondContact O-N 3.02Å; L1111-Q1114 PolarHBondContact O-N 3.18Å; L1111-H1115 WeakPolarHBondContact O-CB 3.33Å; L1111-H1115 PolarHBondContact O-N 3.47Å
1112	A	51.7	Low	51.8	Low	61 Å²	61	100.2 Å²	100.2	50%	0.504	52%	0.515	S	S	.	.	H	α-helix	trans	-63.6	-42.5	175.3	0	0	0	0	0	112.1	R1108 K1110 H1115 A1116	R1108-A1112 WeakPolarHBondContact O-CB 3.42Å; R1108-A1112 PolarHBondContact O-N 3.29Å; K1110-A1112 PolarHBondContact O-N 3.19Å; A1112-H1115 PolarHBondContact O-N 2.8Å; A1112-A1116 WeakPolarHBondContact O-CB 3.04Å; A1112-A1116 PolarHBondContact O-N 3.17Å
1113	C	42.7	Very low	52	Low	78 Å²	78	100 Å²	100	53%	0.527	52%	0.517	S	S	.	.	H	α-helix	trans	-67.9	-36.4	176.7	-167.7	0	0	0	0	112.4	M1109 K1110 M1117	M1109-C1113 VanDerWaalsContact O-CB 3.22Å; M1109-C1113 WeakPolarHBondContact O-CB 3.37Å; M1109-C1113 PolarHBondContact O-N 3.06Å; K1110-C1113 PolarHBondContact O-N 2.91Å; C1113-M1117 VanDerWaalsContact O-CB 3.23Å; C1113-M1117 WeakPolarHBondContact O-CB 3.44Å; C1113-M1117 PolarHBondContact O-N 2.6Å
1114	Q	50.6	Low	51.9	Low	91 Å²	91	98 Å²	98	43%	0.425	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-40.4	171.5	-72.3	-173.2	-89.5	0	0	111.2	K1110 L1111 T1118	K1110-Q1114 WeakPolarHBondContact O-CB 3.33Å; K1110-Q1114 WeakPolarHBondContact O-CG 3.42Å; K1110-Q1114 PolarHBondContact O-N 3.48Å; L1111-Q1114 PolarHBondContact O-N 3.18Å; Q1114-T1118 WeakPolarHBondContact O-CB 3.48Å; Q1114-T1118 PolarHBondContact O-N 3.04Å; Q1114-T1118 PolarHBondContact O-OG1 3.07Å
1115	H	54.9	Low	51.6	Low	130 Å²	130	98.3 Å²	98.3	60%	0.602	52%	0.516	S	S	*	.	H	α-helix	trans	-66.4	-50.1	177.3	-170.3	50.8	0	0	0	111.3	L1111 A1112 M1117 T1118 V1119	L1111-H1115 WeakPolarHBondContact O-CB 3.33Å; L1111-H1115 PolarHBondContact O-N 3.47Å; A1112-H1115 PolarHBondContact O-N 2.8Å; H1115-M1117 PolarHBondContact O-N 3.32Å; H1115-T1118 WeakPolarHBondContact O-CA 3.21Å; H1115-T1118 WeakPolarHBondContact O-CB 3Å; H1115-T1118 PolarHBondContact O-N 2.8Å; H1115-V1119 WeakPolarHBondContact O-CG2 3.17Å; H1115-V1119 PolarHBondContact O-N 3.18Å
1116	A	53.7	Low	51.8	Low	51 Å²	51	95.5 Å²	95.5	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-58.4	-47.2	177	0	0	0	0	0	112.4	A1112 T1118 V1119 E1120	A1112-A1116 WeakPolarHBondContact O-CB 3.04Å; A1112-A1116 PolarHBondContact O-N 3.17Å; A1116-T1118 VanDerWaalsContact C-N 3.25Å; A1116-T1118 PolarHBondContact O-N 2.95Å; A1116-V1119 PolarHBondContact O-N 2.99Å; A1116-E1120 WeakPolarHBondContact O-CB 2.97Å; A1116-E1120 VanDerWaalsContact O-CG 3.27Å; A1116-E1120 WeakPolarHBondContact O-CG 3.4Å; A1116-E1120 PolarHBondContact O-N 3.23Å
1117	M	49.6	Very low	52.2	Low	126 Å²	126	99 Å²	99	62%	0.621	52%	0.516	S	S	*	.	H	α-helix	trans	-61.2	-33.5	174.7	-177.4	177.5	-74.3	0	0	112.5	C1113 H1115 L1121	C1113-M1117 VanDerWaalsContact O-CB 3.23Å; C1113-M1117 WeakPolarHBondContact O-CB 3.44Å; C1113-M1117 PolarHBondContact O-N 2.6Å; H1115-M1117 PolarHBondContact O-N 3.32Å; M1117-L1121 WeakPolarHBondContact O-CB 2.92Å; M1117-L1121 PolarHBondContact O-N 2.8Å; M1117-L1121 VanDerWaalsContact O-N 3.1Å
1118	T	51.5	Low	52.2	Low	81 Å²	81	95 Å²	95	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-71.8	-42.4	176.2	-53.3	0	0	0	0	111.4	Q1114 H1115 A1116 T1122	Q1114-T1118 WeakPolarHBondContact O-CB 3.48Å; Q1114-T1118 PolarHBondContact O-N 3.04Å; Q1114-T1118 PolarHBondContact O-OG1 3.07Å; H1115-T1118 WeakPolarHBondContact O-CA 3.21Å; H1115-T1118 WeakPolarHBondContact O-CB 3Å; H1115-T1118 PolarHBondContact O-N 2.8Å; A1116-T1118 VanDerWaalsContact C-N 3.25Å; A1116-T1118 PolarHBondContact O-N 2.95Å; T1118-T1122 WeakPolarHBondContact O-CB 3.19Å; T1118-T1122 WeakPolarHBondContact O-CG2 3.39Å; T1118-T1122 PolarHBondContact O-N 2.89Å; T1118-T1122 PolarHBondContact O-OG1 2.96Å
1119	V	56.6	Low	52.2	Low	55 Å²	55	95.7 Å²	95.7	33%	0.333	51%	0.509	S	S	.	.	H	α-helix	trans	-63.7	-55.4	177	172.2	0	0	0	0	110.2	H1115 A1116 L1121 T1122 D1123	H1115-V1119 WeakPolarHBondContact O-CG2 3.17Å; H1115-V1119 PolarHBondContact O-N 3.18Å; A1116-V1119 PolarHBondContact O-N 2.99Å; V1119-L1121 VanDerWaalsContact C-N 3.28Å; V1119-L1121 PolarHBondContact O-N 3.36Å; V1119-T1122 WeakPolarHBondContact CA-OG1 3.3Å; V1119-T1122 CarbonylContact O-C 3.57Å; V1119-T1122 PolarHBondContact O-N 3.27Å; V1119-T1122 PolarHBondContact O-OG1 2.78Å; V1119-D1123 PolarHBondContact O-N 3.15Å
1120	E	48.6	Very low	52.8	Low	145 Å²	145	95.2 Å²	95.2	68%	0.678	51%	0.506	S	S	*	.	H	α-helix	trans	-54.8	-40.9	177.2	-69.1	-83.2	173.2	0	0	112.3	A1116 A1124	A1116-E1120 WeakPolarHBondContact O-CB 2.97Å; A1116-E1120 VanDerWaalsContact O-CG 3.27Å; A1116-E1120 WeakPolarHBondContact O-CG 3.4Å; A1116-E1120 PolarHBondContact O-N 3.23Å; E1120-A1124 VanDerWaalsContact O-CB 3.24Å; E1120-A1124 WeakPolarHBondContact O-CB 3.44Å; E1120-A1124 PolarHBondContact O-N 2.03Å
1121	L	53.1	Low	52.8	Low	106 Å²	106	94.9 Å²	94.9	56%	0.555	51%	0.508	S	S	*	.	H	α-helix	trans	-69.1	-40.3	175.9	-172.2	70.9	0	0	0	112.3	M1117 V1119 L1125	M1117-L1121 WeakPolarHBondContact O-CB 2.92Å; M1117-L1121 PolarHBondContact O-N 2.8Å; M1117-L1121 VanDerWaalsContact O-N 3.1Å; V1119-L1121 VanDerWaalsContact C-N 3.28Å; V1119-L1121 PolarHBondContact O-N 3.36Å; L1121-L1125 HydrophobicContact CG-CD1 4.22Å; L1121-L1125 WeakPolarHBondContact O-CB 3.34Å; L1121-L1125 WeakPolarHBondContact O-CD1 3.42Å; L1121-L1125 WeakPolarHBondContact O-CG 3.45Å; L1121-L1125 PolarHBondContact O-N 3.44Å
1122	T	54.7	Low	52.8	Low	77 Å²	77	92.7 Å²	92.7	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-71.9	-33.7	178	46.3	0	0	0	0	112.5	T1118 V1119 L1125 R1126	T1118-T1122 WeakPolarHBondContact O-CB 3.19Å; T1118-T1122 WeakPolarHBondContact O-CG2 3.39Å; T1118-T1122 PolarHBondContact O-N 2.89Å; T1118-T1122 PolarHBondContact O-OG1 2.96Å; V1119-T1122 WeakPolarHBondContact CA-OG1 3.3Å; V1119-T1122 CarbonylContact O-C 3.57Å; V1119-T1122 PolarHBondContact O-N 3.27Å; V1119-T1122 PolarHBondContact O-OG1 2.78Å; T1122-L1125 PolarHBondContact O-N 2.82Å; T1122-R1126 WeakPolarHBondContact O-CB 3.31Å; T1122-R1126 PolarHBondContact O-N 2.85Å
1123	D	52.7	Low	53.3	Low	84 Å²	84	93.4 Å²	93.4	45%	0.449	50%	0.495	S	S	.	.	H	α-helix	trans	-74.2	-38.6	174.1	-77.7	-32.9	0	0	0	112.1	V1119 L1125 R1126 E1127	V1119-D1123 PolarHBondContact O-N 3.15Å; D1123-L1125 VanDerWaalsContact C-N 3.32Å; D1123-L1125 PolarHBondContact O-N 2.81Å; D1123-R1126 WeakPolarHBondContact O-CB 3.44Å; D1123-R1126 PolarHBondContact O-N 2.93Å; D1123-R1126 VanDerWaalsContact O-N 3.15Å; D1123-E1127 WeakPolarHBondContact O-CB 3.49Å; D1123-E1127 PolarHBondContact O-N 3.13Å
1124	A	50.1	Low	54	Low	60 Å²	60	91.6 Å²	91.6	50%	0.496	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-38.4	170.1	0	0	0	0	0	112.3	E1120 G1128	E1120-A1124 VanDerWaalsContact O-CB 3.24Å; E1120-A1124 WeakPolarHBondContact O-CB 3.44Å; E1120-A1124 PolarHBondContact O-N 2.03Å; A1124-G1128 PolarHBondContact O-N 2.82Å
1125	L	49.5	Very low	53.8	Low	76 Å²	76	95.4 Å²	95.4	40%	0.398	49%	0.492	S	S	.	.	H	α-helix	trans	-69.3	-35.7	172.1	-73.6	168.6	0	0	0	112.1	L1121 T1122 D1123 R1129 F1174	L1121-L1125 HydrophobicContact CG-CD1 4.22Å; L1121-L1125 WeakPolarHBondContact O-CB 3.34Å; L1121-L1125 WeakPolarHBondContact O-CD1 3.42Å; L1121-L1125 WeakPolarHBondContact O-CG 3.45Å; L1121-L1125 PolarHBondContact O-N 3.44Å; T1122-L1125 PolarHBondContact O-N 2.82Å; D1123-L1125 VanDerWaalsContact C-N 3.32Å; D1123-L1125 PolarHBondContact O-N 2.81Å; L1125-R1129 VanDerWaalsContact O-CB 3.26Å; L1125-R1129 WeakPolarHBondContact O-CB 3.3Å; L1125-R1129 PolarHBondContact O-N 2.98Å; L1125-F1174 HydrophobicContact CD2-CE1 4.13Å; L1125-F1174 HydrophobicContact CD2-CZ 4.16Å
1126	R	54.2	Low	53.6	Low	77 Å²	77	92 Å²	92	29%	0.291	48%	0.479	S	S	.	.	H	α-helix	trans	-65.8	-50.8	176.2	-173.2	-170.7	-163.1	84	17.9	111.1	T1122 D1123 R1129 H1130 L1976 L1978 T1979	T1122-R1126 WeakPolarHBondContact O-CB 3.31Å; T1122-R1126 PolarHBondContact O-N 2.85Å; D1123-R1126 WeakPolarHBondContact O-CB 3.44Å; D1123-R1126 PolarHBondContact O-N 2.93Å; D1123-R1126 VanDerWaalsContact O-N 3.15Å; R1126-R1129 PolarHBondContact O-N 2.86Å; R1126-H1130 WeakPolarHBondContact O-CB 3.36Å; R1126-H1130 PolarHBondContact O-N 3.22Å; R1126-L1976 PolarHBondContact NH2-O 2.94Å; R1126-L1978 PolarHBondContact NH1-O 3.19Å; R1126-L1978 PolarHBondContact NH2-O 2.92Å; R1126-T1979 PolarHBondContact NH1-OG1 2.69Å
1127	E	57.6	Low	53.5	Low	148 Å²	148	94 Å²	94	69%	0.692	48%	0.479	S	S	*	.	H	α-helix	trans	-65.1	-41.9	178.1	-170.4	179.9	-133.9	0	0	110.6	D1123 R1129 H1130 L1131	D1123-E1127 WeakPolarHBondContact O-CB 3.49Å; D1123-E1127 PolarHBondContact O-N 3.13Å; E1127-R1129 VanDerWaalsContact C-N 3.34Å; E1127-R1129 PolarHBondContact O-N 2.81Å; E1127-H1130 CarbonylContact O-C 3.49Å; E1127-H1130 PolarHBondContact O-N 3.12Å; E1127-L1131 WeakPolarHBondContact O-CB 3.24Å; E1127-L1131 PolarHBondContact O-N 2.95Å
1128	G	52.7	Low	53.6	Low	35 Å²	35	94.9 Å²	94.9	36%	0.361	48%	0.479	S	S	.	.	H	α-helix	trans	-57.5	-44.3	171.4	0	0	0	0	0	112.8	A1124 L1131 V1132	A1124-G1128 PolarHBondContact O-N 2.82Å; G1128-L1131 PolarHBondContact O-N 3.5Å; G1128-V1132 WeakPolarHBondContact O-CG2 3.36Å; G1128-V1132 PolarHBondContact O-N 3.41Å
1129	R	55.5	Low	53.3	Low	175 Å²	175	99.8 Å²	99.8	66%	0.66	49%	0.489	S	S	*	.	H	α-helix	trans	-66.4	-37.9	175.3	-163.6	179.7	-159.3	172	7.3	112.1	L1125 R1126 E1127 V1132 N1133	L1125-R1129 VanDerWaalsContact O-CB 3.26Å; L1125-R1129 WeakPolarHBondContact O-CB 3.3Å; L1125-R1129 PolarHBondContact O-N 2.98Å; R1126-R1129 PolarHBondContact O-N 2.86Å; E1127-R1129 VanDerWaalsContact C-N 3.34Å; E1127-R1129 PolarHBondContact O-N 2.81Å; R1129-V1132 PolarHBondContact O-N 3.04Å; R1129-N1133 WeakPolarHBondContact O-CB 3.05Å; R1129-N1133 PolarHBondContact O-N 3.03Å; R1129-N1133 PolarHBondContact O-OD1 3.13Å
1130	H	58.9	Low	52.7	Low	108 Å²	108	103.8 Å²	103.8	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-68.1	-40.7	175.9	-144.4	-49.5	0	0	0	111.5	R1126 E1127 V1132 N1133 T1134	R1126-H1130 WeakPolarHBondContact O-CB 3.36Å; R1126-H1130 PolarHBondContact O-N 3.22Å; E1127-H1130 CarbonylContact O-C 3.49Å; E1127-H1130 PolarHBondContact O-N 3.12Å; H1130-V1132 VanDerWaalsContact C-N 3.3Å; H1130-V1132 PolarHBondContact O-N 3.31Å; H1130-N1133 PolarHBondContact O-N 2.99Å; H1130-T1134 PolarHBondContact ND1-OG1 2.95Å; H1130-T1134 VanDerWaalsContact O-CB 3.28Å; H1130-T1134 WeakPolarHBondContact O-CB 3.4Å; H1130-T1134 PolarHBondContact O-N 3.39Å; H1130-T1134 PolarHBondContact O-OG1 2.85Å
1131	L	54.1	Low	52.4	Low	106 Å²	106	104.8 Å²	104.8	56%	0.555	51%	0.506	S	S	*	.	H	α-helix	trans	-64.2	-35.8	175.8	-163.2	81.5	0	0	0	111.7	E1127 G1128 R1135	E1127-L1131 WeakPolarHBondContact O-CB 3.24Å; E1127-L1131 PolarHBondContact O-N 2.95Å; G1128-L1131 PolarHBondContact O-N 3.5Å; L1131-R1135 WeakPolarHBondContact O-CB 3.37Å; L1131-R1135 VanDerWaalsContact O-CG 3.31Å; L1131-R1135 WeakPolarHBondContact O-CG 3.19Å; L1131-R1135 PolarHBondContact O-N 3.49Å; L1131-R1135 VanDerWaalsContact O-N 3.13Å
1132	V	56.1	Low	51.8	Low	76 Å²	76	106.9 Å²	106.9	46%	0.461	52%	0.518	S	S	.	.	H	α-helix	trans	-69.4	-49.7	172.3	169.5	0	0	0	0	111	G1128 R1129 H1130 R1135 L1136	G1128-V1132 WeakPolarHBondContact O-CG2 3.36Å; G1128-V1132 PolarHBondContact O-N 3.41Å; R1129-V1132 PolarHBondContact O-N 3.04Å; H1130-V1132 VanDerWaalsContact C-N 3.3Å; H1130-V1132 PolarHBondContact O-N 3.31Å; V1132-R1135 WeakPolarHBondContact O-CB 3.22Å; V1132-R1135 PolarHBondContact O-N 3.22Å; V1132-L1136 HydrophobicContact CG1-CD1 3.88Å; V1132-L1136 HydrophobicContact CG1-CG 4.48Å; V1132-L1136 WeakPolarHBondContact O-CG 3.44Å; V1132-L1136 PolarHBondContact O-N 3.07Å
1133	N	61.6	Low	51.1	Low	76 Å²	76	106.5 Å²	106.5	41%	0.406	52%	0.519	S	S	.	.	H	α-helix	trans	-60.6	-48.4	178	-79.5	16.2	0	0	0	111.9	R1129 H1130 R1135 L1136 E1137	R1129-N1133 WeakPolarHBondContact O-CB 3.05Å; R1129-N1133 PolarHBondContact O-N 3.03Å; R1129-N1133 PolarHBondContact O-OD1 3.13Å; H1130-N1133 PolarHBondContact O-N 2.99Å; N1133-R1135 PolarHBondContact O-N 3.24Å; N1133-L1136 CarbonylContact O-C 3.59Å; N1133-L1136 WeakPolarHBondContact O-CA 3.21Å; N1133-L1136 WeakPolarHBondContact O-CB 3.07Å; N1133-L1136 PolarHBondContact O-N 3.44Å; N1133-E1137 WeakPolarHBondContact O-CG 3.33Å; N1133-E1137 PolarHBondContact O-N 3.2Å
1134	T	57.5	Low	50.4	Low	40 Å²	40	107 Å²	107	25%	0.245	53%	0.529	C	S	.	.	H	α-helix	trans	-68	-20.1	178.5	-56.9	0	0	0	0	112.5	H1130 K1138	H1130-T1134 PolarHBondContact ND1-OG1 2.95Å; H1130-T1134 VanDerWaalsContact O-CB 3.28Å; H1130-T1134 WeakPolarHBondContact O-CB 3.4Å; H1130-T1134 PolarHBondContact O-N 3.39Å; H1130-T1134 PolarHBondContact O-OG1 2.85Å; T1134-K1138 HydrophobicContact CG2-CD 4.31Å; T1134-K1138 VanDerWaalsContact O-CB 3.32Å; T1134-K1138 WeakPolarHBondContact O-CB 3.48Å; T1134-K1138 WeakPolarHBondContact O-CD 3.31Å; T1134-K1138 WeakPolarHBondContact O-CG 3.2Å; T1134-K1138 PolarHBondContact O-N 3.43Å
1135	R	47.6	Very low	49.8	Very low	172 Å²	172	109.5 Å²	109.5	65%	0.649	54%	0.542	S	S	*	.	H	α-helix	trans	-75.9	-42.1	165.3	-85.6	177.7	166.6	169.6	-1.8	112.4	L1131 V1132 N1133 K1138 W1139	L1131-R1135 WeakPolarHBondContact O-CB 3.37Å; L1131-R1135 VanDerWaalsContact O-CG 3.31Å; L1131-R1135 WeakPolarHBondContact O-CG 3.19Å; L1131-R1135 PolarHBondContact O-N 3.49Å; L1131-R1135 VanDerWaalsContact O-N 3.13Å; V1132-R1135 WeakPolarHBondContact O-CB 3.22Å; V1132-R1135 PolarHBondContact O-N 3.22Å; N1133-R1135 PolarHBondContact O-N 3.24Å; R1135-K1138 PolarHBondContact O-N 2.69Å; R1135-W1139 VanDerWaalsContact O-CD1 3.3Å; R1135-W1139 PolarHBondContact O-N 3.2Å
1136	L	50.4	Low	49.4	Very low	59 Å²	59	114.7 Å²	114.7	31%	0.309	57%	0.565	S	S	.	*	H	α-helix	trans	-64	-45.2	176.4	-72.8	166.3	0	0	0	111.6	V1132 N1133 K1138 W1139 Q1140 F1167	V1132-L1136 HydrophobicContact CG1-CD1 3.88Å; V1132-L1136 HydrophobicContact CG1-CG 4.48Å; V1132-L1136 WeakPolarHBondContact O-CG 3.44Å; V1132-L1136 PolarHBondContact O-N 3.07Å; N1133-L1136 CarbonylContact O-C 3.59Å; N1133-L1136 WeakPolarHBondContact O-CA 3.21Å; N1133-L1136 WeakPolarHBondContact O-CB 3.07Å; N1133-L1136 PolarHBondContact O-N 3.44Å; L1136-K1138 PolarHBondContact O-N 3.22Å; L1136-W1139 CarbonylContact O-C 3.56Å; L1136-W1139 WeakPolarHBondContact O-CA 3.42Å; L1136-W1139 WeakPolarHBondContact O-CB 3.4Å; L1136-W1139 PolarHBondContact O-N 3.09Å; L1136-Q1140 PolarHBondContact O-N 2.85Å; L1136-F1167 HydrophobicContact CD2-CD2 4.17Å; L1136-F1167 HydrophobicContact CD2-CE1 4.41Å; L1136-F1167 HydrophobicContact CD2-CE2 3.77Å; L1136-F1167 HydrophobicContact CD2-CZ 3.91Å
1137	E	51.9	Low	48.8	Very low	91 Å²	91	117.6 Å²	117.6	43%	0.425	59%	0.586	S	S	.	*	H	α-helix	trans	-60.7	-44.5	174.3	-71	164.1	169.8	0	0	111.3	N1133 W1139 Q1140 F1141	N1133-E1137 WeakPolarHBondContact O-CG 3.33Å; N1133-E1137 PolarHBondContact O-N 3.2Å; E1137-W1139 PolarHBondContact O-N 2.91Å; E1137-Q1140 PolarHBondContact O-N 3.1Å; E1137-F1141 WeakPolarHBondContact O-CB 3.39Å; E1137-F1141 WeakPolarHBondContact O-CD2 3.04Å; E1137-F1141 PolarHBondContact O-N 2.91Å
1138	K	50.6	Low	47.8	Very low	145 Å²	145	115.3 Å²	115.3	63%	0.63	58%	0.582	S	S	*	*	H	α-helix	trans	-68.5	-13.7	174.4	-74.1	175.4	-179.3	173.9	0	113.9	T1134 R1135 L1136 N1142	T1134-K1138 HydrophobicContact CG2-CD 4.31Å; T1134-K1138 VanDerWaalsContact O-CB 3.32Å; T1134-K1138 WeakPolarHBondContact O-CB 3.48Å; T1134-K1138 WeakPolarHBondContact O-CD 3.31Å; T1134-K1138 WeakPolarHBondContact O-CG 3.2Å; T1134-K1138 PolarHBondContact O-N 3.43Å; R1135-K1138 PolarHBondContact O-N 2.69Å; L1136-K1138 PolarHBondContact O-N 3.22Å; K1138-N1142 PolarHBondContact O-ND2 3.44Å
1139	W	44.7	Very low	47.1	Very low	185 Å²	185	121.9 Å²	121.9	70%	0.701	61%	0.609	S	S	*	*	H	α-helix	trans	-88.2	-42.6	167.4	-85.9	46.2	0	0	0	111.6	R1135 L1136 E1137 N1142	R1135-W1139 VanDerWaalsContact O-CD1 3.3Å; R1135-W1139 PolarHBondContact O-N 3.2Å; L1136-W1139 CarbonylContact O-C 3.56Å; L1136-W1139 WeakPolarHBondContact O-CA 3.42Å; L1136-W1139 WeakPolarHBondContact O-CB 3.4Å; L1136-W1139 PolarHBondContact O-N 3.09Å; E1137-W1139 PolarHBondContact O-N 2.91Å; W1139-N1142 PolarHBondContact O-N 2.82Å
1140	Q	44.9	Very low	46.8	Very low	139 Å²	139	119.4 Å²	119.4	65%	0.65	61%	0.614	S	S	*	*	H	α-helix	trans	-67.8	-40.2	178.4	-78.2	-175.9	-59.8	0	0	113.1	L1136 E1137 N1142 S1143	L1136-Q1140 PolarHBondContact O-N 2.85Å; E1137-Q1140 PolarHBondContact O-N 3.1Å; Q1140-N1142 PolarHBondContact O-N 3.06Å; Q1140-S1143 PolarHBondContact O-N 3.41Å; Q1140-S1143 PolarHBondContact O-OG 2.81Å
1141	F	41.6	Very low	45.8	Very low	166 Å²	166	120.6 Å²	120.6	73%	0.728	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-70.3	-17.8	178.5	-86.2	-80.8	0	0	0	114.1	E1137 S1143 S1144	E1137-F1141 WeakPolarHBondContact O-CB 3.39Å; E1137-F1141 WeakPolarHBondContact O-CD2 3.04Å; E1137-F1141 PolarHBondContact O-N 2.91Å; F1141-S1143 VanDerWaalsContact C-N 3.28Å; F1141-S1144 PolarHBondContact O-OG 3.05Å; F1141-S1144 VanDerWaalsContact O-OG 3.11Å
1142	N	41.7	Very low	45.4	Very low	149 Å²	149	120.3 Å²	120.3	80%	0.797	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-82.4	1.1	170.3	-87.3	-16	0	0	0	113.8	K1138 W1139 Q1140	K1138-N1142 PolarHBondContact O-ND2 3.44Å; W1139-N1142 PolarHBondContact O-N 2.82Å; Q1140-N1142 PolarHBondContact O-N 3.06Å
1143	S	38.3	Very low	45	Very low	70 Å²	70	122.8 Å²	122.8	49%	0.49	63%	0.633	S	S	.	*	G	3₁₀ helix	trans	-98.3	8.3	176.9	68.4	0	0	0	0	114.5	Q1140 F1141 S1145	Q1140-S1143 PolarHBondContact O-N 3.41Å; Q1140-S1143 PolarHBondContact O-OG 2.81Å; F1141-S1143 VanDerWaalsContact C-N 3.28Å; S1143-S1145 PolarHBondContact O-N 2.84Å; S1143-S1145 VanDerWaalsContact O-N 3.12Å
1144	S	38.2	Very low	44.8	Very low	94 Å²	94	124.5 Å²	124.5	66%	0.657	64%	0.642	S	S	*	*			trans	-78.3	90.9	172.8	51.1	0	0	0	0	111	F1141 Q1146	F1141-S1144 PolarHBondContact O-OG 3.05Å; F1141-S1144 VanDerWaalsContact O-OG 3.11Å; S1144-Q1146 VanDerWaalsContact C-N 3.28Å; S1144-Q1146 PolarHBondContact O-N 2.88Å
1145	S	39.2	Very low	44.6	Very low	112 Å²	112	126.1 Å²	126.1	78%	0.783	65%	0.652	S	S	*	*			trans	-74.4	62.5	-171.8	47.4	0	0	0	0	114.9	S1143 N1147	S1143-S1145 PolarHBondContact O-N 2.84Å; S1143-S1145 VanDerWaalsContact O-N 3.12Å; S1145-N1147 PolarHBondContact O-N 3.26Å
1146	Q	41	Very low	44.6	Very low	186 Å²	186	121.9 Å²	121.9	87%	0.869	64%	0.642	S	S	*	*			trans	-82.1	16.8	168.1	-97.1	-171	-6.9	0	0	114.2	S1144	S1144-Q1146 VanDerWaalsContact C-N 3.28Å; S1144-Q1146 PolarHBondContact O-N 2.88Å
1147	N	40.7	Very low	44.9	Very low	137 Å²	137	127 Å²	127	73%	0.733	66%	0.657	S	S	*	*	S	Bend	trans	-145.3	122.5	173.4	-83	-73.1	0	0	0	113.8	S1145	S1145-N1147 PolarHBondContact O-N 3.26Å
1148	T	37.1	Very low	45.3	Very low	101 Å²	101	125.7 Å²	125.7	62%	0.62	66%	0.658	S	S	*	*			trans	73.3	62.1	144.4	60.1	0	0	0	0	120.8	T1150	T1148-T1150 PolarHBondContact O-N 3.33Å; T1148-T1150 PolarHBondContact O-OG1 2.87Å; T1148-T1150 VanDerWaalsContact O-OG1 3.06Å
1149	D	37.8	Very low	45.6	Very low	172 Å²	172	122.7 Å²	122.7	92%	0.92	65%	0.651	S	S	*	*	S	Bend		47.1	6.6	120.2	-53.7	-6.9	0	0	0	122.4
1150	T	48.2	Very low	46.4	Very low	124 Å²	124	118.3 Å²	118.3	76%	0.761	64%	0.642	S	S	*	*			trans	-137.3	-3.7	-169.2	53	0	0	0	0	116.1	T1148	T1148-T1150 PolarHBondContact O-N 3.33Å; T1148-T1150 PolarHBondContact O-OG1 2.87Å; T1148-T1150 VanDerWaalsContact O-OG1 3.06Å
1151	L	39.3	Very low	47.4	Very low	133 Å²	133	116.6 Å²	116.6	70%	0.696	63%	0.634	S	S	*	*	S	Bend	trans	-90.7	124.6	170.8	-112.3	72.4	0	0	0	110.7	D1153	L1151-D1153 PolarHBondContact O-N 3.12Å
1152	N	46	Very low	48.8	Very low	99 Å²	99	114.1 Å²	114.1	53%	0.529	63%	0.627	S	S	.	*			trans	-68	121.4	179.2	-173.2	-16.3	0	0	0	110.2	N1154 T1155 L1156	N1152-N1154 PolarHBondContact O-N 2.84Å; N1152-N1154 PolarHBondContact OD1-N 3.3Å; N1152-N1154 PolarHBondContact OD1-ND2 3.48Å; N1152-N1154 VanDerWaalsContact OD1-ND2 3.15Å; N1152-T1155 WeakPolarHBondContact O-CA 3.42Å; N1152-T1155 WeakPolarHBondContact O-CB 3.44Å; N1152-T1155 PolarHBondContact O-N 3.16Å; N1152-T1155 PolarHBondContact O-OG1 3.12Å; N1152-L1156 PolarHBondContact O-N 3.01Å
1153	D	47.1	Very low	49.6	Very low	128 Å²	128	108 Å²	108	68%	0.684	60%	0.598	S	S	*	*	H	α-helix	trans	-52	-34.7	-176.1	-77.5	-48.2	0	0	0	113.4	L1151 T1155 L1156 R1157	L1151-D1153 PolarHBondContact O-N 3.12Å; D1153-T1155 PolarHBondContact O-N 3.12Å; D1153-L1156 PolarHBondContact O-N 2.81Å; D1153-R1157 VanDerWaalsContact O-CB 3.32Å; D1153-R1157 WeakPolarHBondContact O-CB 3.21Å; D1153-R1157 PolarHBondContact O-N 3.15Å
1154	N	57.9	Low	51	Low	113 Å²	113	109.5 Å²	109.5	60%	0.604	60%	0.6	S	S	*	*	H	α-helix	trans	-61.3	-30.7	177.2	-64.1	-56.8	0	0	0	112.6	N1152 S1158	N1152-N1154 PolarHBondContact O-N 2.84Å; N1152-N1154 PolarHBondContact OD1-N 3.3Å; N1152-N1154 PolarHBondContact OD1-ND2 3.48Å; N1152-N1154 VanDerWaalsContact OD1-ND2 3.15Å; N1154-S1158 WeakPolarHBondContact O-CB 3.49Å; N1154-S1158 PolarHBondContact O-N 2.81Å; N1154-S1158 PolarHBondContact O-OG 2.89Å
1155	T	52.7	Low	52.6	Low	74 Å²	74	110.3 Å²	110.3	45%	0.454	60%	0.596	S	S	.	*	H	α-helix	trans	-76	-40.5	176.3	-47.1	0	0	0	0	111	N1152 D1153 S1158 V1159	N1152-T1155 WeakPolarHBondContact O-CA 3.42Å; N1152-T1155 WeakPolarHBondContact O-CB 3.44Å; N1152-T1155 PolarHBondContact O-N 3.16Å; N1152-T1155 PolarHBondContact O-OG1 3.12Å; D1153-T1155 PolarHBondContact O-N 3.12Å; T1155-S1158 WeakPolarHBondContact CA-OG 3.39Å; T1155-S1158 PolarHBondContact O-OG 3.45Å; T1155-V1159 WeakPolarHBondContact O-CB 3.39Å; T1155-V1159 VanDerWaalsContact O-CG2 3.28Å; T1155-V1159 WeakPolarHBondContact O-CG2 3.21Å; T1155-V1159 PolarHBondContact O-N 3.44Å
1156	L	47.6	Very low	53.8	Low	83 Å²	83	110.6 Å²	110.6	44%	0.435	59%	0.585	S	S	.	*	H	α-helix	trans	-65.9	-42.2	176	-159.3	78.4	0	0	0	111.2	N1152 D1153 V1159 N1160	N1152-L1156 PolarHBondContact O-N 3.01Å; D1153-L1156 PolarHBondContact O-N 2.81Å; L1156-V1159 PolarHBondContact O-N 2.94Å; L1156-N1160 PolarHBondContact O-N 3.02Å
1157	R	57	Low	54.5	Low	166 Å²	166	105.6 Å²	105.6	63%	0.626	56%	0.56	S	S	*	*	H	α-helix	trans	-62.8	-48	176.7	-171.5	175.7	-173.1	147.6	6.3	112.4	D1153 V1159 N1160 E1161	D1153-R1157 VanDerWaalsContact O-CB 3.32Å; D1153-R1157 WeakPolarHBondContact O-CB 3.21Å; D1153-R1157 PolarHBondContact O-N 3.15Å; R1157-V1159 PolarHBondContact O-N 3.16Å; R1157-N1160 PolarHBondContact O-N 2.89Å; R1157-E1161 WeakPolarHBondContact CG-OE1 3.43Å; R1157-E1161 IonicContact NE-OE1 3.17Å; R1157-E1161 PolarHBondContact NE-OE1 3.39Å; R1157-E1161 WeakPolarHBondContact O-CG 3.22Å; R1157-E1161 PolarHBondContact O-N 3.26Å
1158	S	59	Low	55.9	Low	64 Å²	64	104 Å²	104	45%	0.448	55%	0.552	S	S	.	*	H	α-helix	trans	-68.1	-30.3	178.2	51.6	0	0	0	0	113.4	N1154 T1155 L1162	N1154-S1158 WeakPolarHBondContact O-CB 3.49Å; N1154-S1158 PolarHBondContact O-N 2.81Å; N1154-S1158 PolarHBondContact O-OG 2.89Å; T1155-S1158 WeakPolarHBondContact CA-OG 3.39Å; T1155-S1158 PolarHBondContact O-OG 3.45Å; S1158-L1162 WeakPolarHBondContact O-CB 3.26Å; S1158-L1162 PolarHBondContact O-N 3.06Å
1159	V	58.8	Low	57.5	Low	81 Å²	81	107.9 Å²	107.9	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-66.8	-42	169.7	169.3	0	0	0	0	111.5	T1155 L1156 R1157 L1162 A1163	T1155-V1159 WeakPolarHBondContact O-CB 3.39Å; T1155-V1159 VanDerWaalsContact O-CG2 3.28Å; T1155-V1159 WeakPolarHBondContact O-CG2 3.21Å; T1155-V1159 PolarHBondContact O-N 3.44Å; L1156-V1159 PolarHBondContact O-N 2.94Å; R1157-V1159 PolarHBondContact O-N 3.16Å; V1159-L1162 PolarHBondContact O-N 2.75Å; V1159-A1163 VanDerWaalsContact O-CB 3.31Å; V1159-A1163 WeakPolarHBondContact O-CB 3.04Å; V1159-A1163 PolarHBondContact O-N 3.46Å
1160	N	59.8	Low	58.4	Low	94 Å²	94	104.7 Å²	104.7	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-66	-40.9	174.9	-99.8	-14.7	0	0	0	112.6	L1156 R1157 A1163 N1164	L1156-N1160 PolarHBondContact O-N 3.02Å; R1157-N1160 PolarHBondContact O-N 2.89Å; N1160-A1163 PolarHBondContact O-N 2.82Å; N1160-N1164 WeakPolarHBondContact O-CB 3.28Å; N1160-N1164 PolarHBondContact O-N 3.35Å; N1160-N1164 PolarHBondContact O-ND2 2.87Å
1161	E	66.5	Low	59.2	Low	102 Å²	102	106.3 Å²	106.3	48%	0.477	53%	0.527	S	S	.	.	H	α-helix	trans	-64.5	-44.3	175	-73.8	171.1	-169.2	0	0	111.1	R1157 A1163 N1164 I1165	R1157-E1161 WeakPolarHBondContact CG-OE1 3.43Å; R1157-E1161 IonicContact NE-OE1 3.17Å; R1157-E1161 PolarHBondContact NE-OE1 3.39Å; R1157-E1161 WeakPolarHBondContact O-CG 3.22Å; R1157-E1161 PolarHBondContact O-N 3.26Å; E1161-A1163 PolarHBondContact O-N 2.95Å; E1161-N1164 PolarHBondContact O-N 2.77Å; E1161-I1165 WeakPolarHBondContact O-CB 3.34Å; E1161-I1165 WeakPolarHBondContact O-CD1 3.49Å; E1161-I1165 VanDerWaalsContact O-CG1 3.25Å; E1161-I1165 WeakPolarHBondContact O-CG1 3.5Å; E1161-I1165 PolarHBondContact O-N 3.44Å
1162	L	70.4	Confident	60.7	Low	114 Å²	114	104.1 Å²	104.1	60%	0.597	52%	0.519	S	S	*	.	H	α-helix	trans	-62.8	-41.4	175.7	-171.9	68.4	0	0	0	112.1	S1158 V1159 I1165 H1166	S1158-L1162 WeakPolarHBondContact O-CB 3.26Å; S1158-L1162 PolarHBondContact O-N 3.06Å; V1159-L1162 PolarHBondContact O-N 2.75Å; L1162-I1165 PolarHBondContact O-N 3.45Å; L1162-H1166 WeakPolarHBondContact O-CB 3.35Å; L1162-H1166 PolarHBondContact O-N 3.46Å
1163	A	59.1	Low	61.9	Low	22 Å²	22	104.5 Å²	104.5	18%	0.182	52%	0.521	C	S	.	.	H	α-helix	trans	-62.2	-48.4	174.9	0	0	0	0	0	111.5	V1159 N1160 E1161 I1165 H1166 F1167	V1159-A1163 VanDerWaalsContact O-CB 3.31Å; V1159-A1163 WeakPolarHBondContact O-CB 3.04Å; V1159-A1163 PolarHBondContact O-N 3.46Å; N1160-A1163 PolarHBondContact O-N 2.82Å; E1161-A1163 PolarHBondContact O-N 2.95Å; A1163-I1165 VanDerWaalsContact C-N 3.34Å; A1163-I1165 PolarHBondContact O-N 2.79Å; A1163-H1166 PolarHBondContact O-N 3.47Å; A1163-H1166 VanDerWaalsContact O-N 3.1Å; A1163-F1167 HydrophobicContact CB-CD2 4.38Å; A1163-F1167 HydrophobicContact CB-CE2 4.33Å; A1163-F1167 WeakPolarHBondContact O-CD2 3.3Å; A1163-F1167 PolarHBondContact O-N 2.86Å
1164	N	67.6	Low	62.4	Low	101 Å²	101	104.4 Å²	104.4	54%	0.54	51%	0.514	S	S	.	.	H	α-helix	trans	-60.2	-41.5	177	-80	-27	0	0	0	112.4	N1160 E1161 H1166 N1168	N1160-N1164 WeakPolarHBondContact O-CB 3.28Å; N1160-N1164 PolarHBondContact O-N 3.35Å; N1160-N1164 PolarHBondContact O-ND2 2.87Å; E1161-N1164 PolarHBondContact O-N 2.77Å; N1164-H1166 VanDerWaalsContact C-N 3.34Å; N1164-N1168 VanDerWaalsContact O-CB 3.29Å; N1164-N1168 WeakPolarHBondContact O-CB 3.28Å; N1164-N1168 PolarHBondContact O-N 3.22Å; N1164-N1168 PolarHBondContact O-ND2 2.84Å
1165	I	71.4	Confident	62.9	Low	111 Å²	111	103 Å²	103	57%	0.569	51%	0.507	S	S	*	.	H	α-helix	trans	-60.7	-44.7	173.3	-70.3	163.4	0	0	0	110.6	E1161 L1162 A1163 R1169	E1161-I1165 WeakPolarHBondContact O-CB 3.34Å; E1161-I1165 WeakPolarHBondContact O-CD1 3.49Å; E1161-I1165 VanDerWaalsContact O-CG1 3.25Å; E1161-I1165 WeakPolarHBondContact O-CG1 3.5Å; E1161-I1165 PolarHBondContact O-N 3.44Å; L1162-I1165 PolarHBondContact O-N 3.45Å; A1163-I1165 VanDerWaalsContact C-N 3.34Å; A1163-I1165 PolarHBondContact O-N 2.79Å; I1165-R1169 WeakPolarHBondContact O-CB 3.42Å; I1165-R1169 PolarHBondContact O-N 3.47Å
1166	H	64.3	Low	63.9	Low	117 Å²	117	105 Å²	105	54%	0.542	51%	0.511	S	S	.	.	H	α-helix	trans	-70.8	-36.1	-177.2	-149	-54	0	0	0	113.1	L1162 A1163 N1164 Q1170	L1162-H1166 WeakPolarHBondContact O-CB 3.35Å; L1162-H1166 PolarHBondContact O-N 3.46Å; A1163-H1166 PolarHBondContact O-N 3.47Å; A1163-H1166 VanDerWaalsContact O-N 3.1Å; N1164-H1166 VanDerWaalsContact C-N 3.34Å; H1166-Q1170 PolarHBondContact O-N 2.9Å; H1166-Q1170 VanDerWaalsContact O-N 3.1Å
1167	F	56.2	Low	64.5	Low	82 Å²	82	105.9 Å²	105.9	36%	0.36	52%	0.515	S	S	.	.	H	α-helix	trans	-74	-41.7	175.1	-74.6	-58.6	0	0	0	112.6	L1136 A1163 R1169 Q1170 R1171	L1136-F1167 HydrophobicContact CD2-CD2 4.17Å; L1136-F1167 HydrophobicContact CD2-CE1 4.41Å; L1136-F1167 HydrophobicContact CD2-CE2 3.77Å; L1136-F1167 HydrophobicContact CD2-CZ 3.91Å; A1163-F1167 HydrophobicContact CB-CD2 4.38Å; A1163-F1167 HydrophobicContact CB-CE2 4.33Å; A1163-F1167 WeakPolarHBondContact O-CD2 3.3Å; A1163-F1167 PolarHBondContact O-N 2.86Å; F1167-R1169 VanDerWaalsContact C-N 3.26Å; F1167-R1169 PolarHBondContact O-N 2.89Å; F1167-Q1170 PolarHBondContact O-N 2.99Å; F1167-Q1170 VanDerWaalsContact O-N 3.15Å; F1167-R1171 PolarHBondContact O-N 2.74Å
1168	N	69.7	Low	64.3	Low	104 Å²	104	105.2 Å²	105.2	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-60.2	-38.4	173.2	-79	-24.8	0	0	0	111.5	N1164 R1171 T1172	N1164-N1168 VanDerWaalsContact O-CB 3.29Å; N1164-N1168 WeakPolarHBondContact O-CB 3.28Å; N1164-N1168 PolarHBondContact O-N 3.22Å; N1164-N1168 PolarHBondContact O-ND2 2.84Å; N1168-R1171 PolarHBondContact O-N 2.85Å; N1168-T1172 PolarHBondContact O-N 2.81Å; N1168-T1172 PolarHBondContact O-OG1 3.27Å
1169	R	71.9	Confident	64.6	Low	181 Å²	181	107.5 Å²	107.5	68%	0.683	52%	0.517	S	S	*	.	H	α-helix	trans	-68.8	-32.3	175.4	-165.2	176.1	-170	176.6	4.5	113.5	I1165 F1167 T1172 L1173	I1165-R1169 WeakPolarHBondContact O-CB 3.42Å; I1165-R1169 PolarHBondContact O-N 3.47Å; F1167-R1169 VanDerWaalsContact C-N 3.26Å; F1167-R1169 PolarHBondContact O-N 2.89Å; R1169-T1172 PolarHBondContact O-OG1 2.95Å; R1169-L1173 WeakPolarHBondContact O-CD1 3.47Å; R1169-L1173 WeakPolarHBondContact O-CG 3.36Å; R1169-L1173 PolarHBondContact O-N 2.89Å
1170	Q	55.9	Low	64.8	Low	105 Å²	105	107.8 Å²	107.8	49%	0.491	51%	0.514	S	S	.	.	H	α-helix	trans	-70.8	-39.2	170.8	-79.2	-177.2	-16.7	0	0	111.8	H1166 F1167 L1173 F1174	H1166-Q1170 PolarHBondContact O-N 2.9Å; H1166-Q1170 VanDerWaalsContact O-N 3.1Å; F1167-Q1170 PolarHBondContact O-N 2.99Å; F1167-Q1170 VanDerWaalsContact O-N 3.15Å; Q1170-L1173 PolarHBondContact O-N 2.88Å; Q1170-F1174 PolarHBondContact O-N 3.39Å
1171	R	64.2	Low	64	Low	158 Å²	158	108.7 Å²	108.7	60%	0.596	52%	0.516	S	S	*	.	H	α-helix	trans	-62.4	-49.4	177.6	-176.7	170.2	178.6	171	-2.6	112	F1167 N1168 L1173 F1174 D1175	F1167-R1171 PolarHBondContact O-N 2.74Å; N1168-R1171 PolarHBondContact O-N 2.85Å; R1171-L1173 VanDerWaalsContact C-N 3.3Å; R1171-L1173 PolarHBondContact O-N 2.77Å; R1171-F1174 WeakPolarHBondContact O-CA 3.35Å; R1171-F1174 WeakPolarHBondContact O-CB 3.46Å; R1171-F1174 PolarHBondContact O-N 2.89Å; R1171-D1175 WeakPolarHBondContact CG-OD2 3.2Å; R1171-D1175 PolarHBondContact O-N 2.81Å
1172	T	71.3	Confident	63.1	Low	87 Å²	87	107.3 Å²	107.3	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-64.1	-32.3	177.6	53.3	0	0	0	0	113.2	N1168 R1169 H1176	N1168-T1172 PolarHBondContact O-N 2.81Å; N1168-T1172 PolarHBondContact O-OG1 3.27Å; R1169-T1172 PolarHBondContact O-OG1 2.95Å; T1172-H1176 VanDerWaalsContact O-CB 3.29Å; T1172-H1176 WeakPolarHBondContact O-CB 3.33Å; T1172-H1176 PolarHBondContact O-N 2.74Å; T1172-H1176 VanDerWaalsContact O-N 3.09Å
1173	L	70.8	Confident	62.3	Low	107 Å²	107	109.1 Å²	109.1	56%	0.56	52%	0.523	S	S	*	.	H	α-helix	trans	-64.7	-38.7	169.5	-81.7	167.7	0	0	0	112.5	R1169 Q1170 R1171 L1177	R1169-L1173 WeakPolarHBondContact O-CD1 3.47Å; R1169-L1173 WeakPolarHBondContact O-CG 3.36Å; R1169-L1173 PolarHBondContact O-N 2.89Å; Q1170-L1173 PolarHBondContact O-N 2.88Å; R1171-L1173 VanDerWaalsContact C-N 3.3Å; R1171-L1173 PolarHBondContact O-N 2.77Å; L1173-L1177 WeakPolarHBondContact O-CB 3.28Å; L1173-L1177 WeakPolarHBondContact O-CG 3.49Å; L1173-L1177 PolarHBondContact O-N 3.04Å
1174	F	58.8	Low	61.9	Low	127 Å²	127	115.3 Å²	115.3	56%	0.557	55%	0.546	S	S	*	.	H	α-helix	trans	-71.7	-44.2	179.7	-149.8	-82.2	0	0	0	111.9	L1125 Q1170 R1171 H1176 L1177 Y1178	L1125-F1174 HydrophobicContact CD2-CE1 4.13Å; L1125-F1174 HydrophobicContact CD2-CZ 4.16Å; Q1170-F1174 PolarHBondContact O-N 3.39Å; R1171-F1174 WeakPolarHBondContact O-CA 3.35Å; R1171-F1174 WeakPolarHBondContact O-CB 3.46Å; R1171-F1174 PolarHBondContact O-N 2.89Å; F1174-H1176 VanDerWaalsContact C-N 3.34Å; F1174-H1176 PolarHBondContact O-N 3.28Å; F1174-L1177 PolarHBondContact O-N 3.07Å; F1174-Y1178 WeakPolarHBondContact O-CB 3.31Å; F1174-Y1178 PolarHBondContact O-N 3.12Å
1175	D	68	Low	60.5	Low	82 Å²	82	115 Å²	115	44%	0.439	54%	0.544	S	S	.	.	H	α-helix	trans	-62.5	-41	176.9	-64.3	-32.8	0	0	0	110.8	R1171 Y1178 E1179	R1171-D1175 WeakPolarHBondContact CG-OD2 3.2Å; R1171-D1175 PolarHBondContact O-N 2.81Å; D1175-Y1178 WeakPolarHBondContact O-CB 3.46Å; D1175-Y1178 PolarHBondContact O-N 3.14Å; D1175-E1179 PolarHBondContact O-N 2.89Å
1176	H	72.9	Confident	59.1	Low	117 Å²	117	113.6 Å²	113.6	54%	0.542	54%	0.537	S	S	.	.	H	α-helix	trans	-71.6	-34.3	176.8	-164.1	55.5	0	0	0	113.1	T1172 F1174 Y1178 E1179 Q1180	T1172-H1176 VanDerWaalsContact O-CB 3.29Å; T1172-H1176 WeakPolarHBondContact O-CB 3.33Å; T1172-H1176 PolarHBondContact O-N 2.74Å; T1172-H1176 VanDerWaalsContact O-N 3.09Å; F1174-H1176 VanDerWaalsContact C-N 3.34Å; F1174-H1176 PolarHBondContact O-N 3.28Å; H1176-Y1178 VanDerWaalsContact C-N 3.33Å; H1176-E1179 IonicContact ND1-OE2 2.95Å; H1176-Q1180 WeakPolarHBondContact O-CB 3.19Å; H1176-Q1180 PolarHBondContact O-N 3.38Å
1177	L	60.6	Low	57.7	Low	102 Å²	102	114.3 Å²	114.3	53%	0.534	54%	0.539	S	S	.	.	H	α-helix	trans	-65.3	-36.3	169.4	-82.4	167.2	0	0	0	111.9	L1173 F1174 Q1180 M1181	L1173-L1177 WeakPolarHBondContact O-CB 3.28Å; L1173-L1177 WeakPolarHBondContact O-CG 3.49Å; L1173-L1177 PolarHBondContact O-N 3.04Å; F1174-L1177 PolarHBondContact O-N 3.07Å; L1177-Q1180 PolarHBondContact O-N 3.33Å; L1177-M1181 WeakPolarHBondContact O-CG 3.48Å; L1177-M1181 PolarHBondContact O-N 3.13Å
1178	Y	54.2	Low	56.9	Low	152 Å²	152	119.2 Å²	119.2	60%	0.596	56%	0.555	S	S	*	*	H	α-helix	trans	-65.8	-46.5	176.5	178.7	-96	0	0	0	111.9	F1174 D1175 H1176 Q1180 M1181 S1182	F1174-Y1178 WeakPolarHBondContact O-CB 3.31Å; F1174-Y1178 PolarHBondContact O-N 3.12Å; D1175-Y1178 WeakPolarHBondContact O-CB 3.46Å; D1175-Y1178 PolarHBondContact O-N 3.14Å; H1176-Y1178 VanDerWaalsContact C-N 3.33Å; Y1178-Q1180 VanDerWaalsContact C-N 3.34Å; Y1178-Q1180 PolarHBondContact O-N 2.89Å; Y1178-M1181 PolarHBondContact O-N 2.04Å; Y1178-S1182 VanDerWaalsContact O-CB 3.3Å; Y1178-S1182 WeakPolarHBondContact O-CB 3.24Å; Y1178-S1182 PolarHBondContact O-N 2.76Å
1179	E	65.3	Low	55.7	Low	111 Å²	111	119 Å²	119	52%	0.519	55%	0.554	S	S	.	*	H	α-helix	trans	-57.5	-46.4	170.7	-76.8	-161.3	121.4	0	0	111.9	D1175 H1176 M1181 S1182 Q1183	D1175-E1179 PolarHBondContact O-N 2.89Å; H1176-E1179 IonicContact ND1-OE2 2.95Å; E1179-M1181 VanDerWaalsContact C-N 3.31Å; E1179-M1181 PolarHBondContact O-N 3.13Å; E1179-S1182 WeakPolarHBondContact O-CB 3.33Å; E1179-S1182 PolarHBondContact O-N 3.28Å; E1179-Q1183 PolarHBondContact O-N 3.23Å
1180	Q	60.9	Low	54.6	Low	88 Å²	88	112.2 Å²	112.2	41%	0.411	54%	0.535	S	S	.	.	H	α-helix	trans	-67.4	-30.9	-177.1	-158.7	-171.6	98	0	0	112.6	H1176 L1177 Y1178 K1184	H1176-Q1180 WeakPolarHBondContact O-CB 3.19Å; H1176-Q1180 PolarHBondContact O-N 3.38Å; L1177-Q1180 PolarHBondContact O-N 3.33Å; Y1178-Q1180 VanDerWaalsContact C-N 3.34Å; Y1178-Q1180 PolarHBondContact O-N 2.89Å; Q1180-K1184 HydrophobicContact CG-CD 4.49Å; Q1180-K1184 WeakPolarHBondContact O-CB 3.32Å; Q1180-K1184 WeakPolarHBondContact O-CD 3.24Å; Q1180-K1184 VanDerWaalsContact O-CG 3.24Å; Q1180-K1184 WeakPolarHBondContact O-CG 3.39Å; Q1180-K1184 PolarHBondContact O-N 3.09Å
1181	M	45.1	Very low	54.1	Low	113 Å²	113	114.4 Å²	114.4	56%	0.557	55%	0.545	S	S	*	.	H	α-helix	trans	-74.7	-41.6	169.8	-71.5	-147.3	-63.4	0	0	112.1	L1177 Y1178 E1179 Q1183 K1184 L1185	L1177-M1181 WeakPolarHBondContact O-CG 3.48Å; L1177-M1181 PolarHBondContact O-N 3.13Å; Y1178-M1181 PolarHBondContact O-N 2.04Å; E1179-M1181 VanDerWaalsContact C-N 3.31Å; E1179-M1181 PolarHBondContact O-N 3.13Å; M1181-Q1183 PolarHBondContact O-N 3.44Å; M1181-K1184 CarbonylContact O-C 3.51Å; M1181-K1184 PolarHBondContact O-N 3.21Å; M1181-K1184 VanDerWaalsContact O-N 3.11Å; M1181-L1185 HydrophobicContact CB-CD1 4.26Å; M1181-L1185 VanDerWaalsContact O-CB 3.3Å; M1181-L1185 WeakPolarHBondContact O-CB 3.24Å; M1181-L1185 VanDerWaalsContact O-CG 3.26Å; M1181-L1185 WeakPolarHBondContact O-CG 3.29Å; M1181-L1185 PolarHBondContact O-N 3.05Å
1182	S	46.9	Very low	52.9	Low	73 Å²	73	111.1 Å²	111.1	51%	0.51	55%	0.546	S	S	.	.	H	α-helix	trans	-54.6	-49.6	176.6	-178.4	0	0	0	0	111.8	Y1178 E1179 K1184 L1185	Y1178-S1182 VanDerWaalsContact O-CB 3.3Å; Y1178-S1182 WeakPolarHBondContact O-CB 3.24Å; Y1178-S1182 PolarHBondContact O-N 2.76Å; E1179-S1182 WeakPolarHBondContact O-CB 3.33Å; E1179-S1182 PolarHBondContact O-N 3.28Å; S1182-K1184 PolarHBondContact O-N 3.45Å; S1182-L1185 PolarHBondContact O-N 2.8Å
1183	Q	53.5	Low	51.7	Low	152 Å²	152	112.7 Å²	112.7	71%	0.71	54%	0.543	S	S	*	.	H	α-helix	trans	-65.5	-34.5	176.7	-67.4	-179.2	2.8	0	0	113	E1179 M1181	E1179-Q1183 PolarHBondContact O-N 3.23Å; M1181-Q1183 PolarHBondContact O-N 3.44Å
1184	K	49.8	Very low	50.7	Low	152 Å²	152	112.7 Å²	112.7	66%	0.661	54%	0.538	S	S	*	.	H	α-helix	trans	-77.5	-19.5	177.6	-75.5	173.4	179.6	169.9	0	114.1	Q1180 M1181 S1182	Q1180-K1184 HydrophobicContact CG-CD 4.49Å; Q1180-K1184 WeakPolarHBondContact O-CB 3.32Å; Q1180-K1184 WeakPolarHBondContact O-CD 3.24Å; Q1180-K1184 VanDerWaalsContact O-CG 3.24Å; Q1180-K1184 WeakPolarHBondContact O-CG 3.39Å; Q1180-K1184 PolarHBondContact O-N 3.09Å; M1181-K1184 CarbonylContact O-C 3.51Å; M1181-K1184 PolarHBondContact O-N 3.21Å; M1181-K1184 VanDerWaalsContact O-N 3.11Å; S1182-K1184 PolarHBondContact O-N 3.45Å
1185	L	37.9	Very low	50.2	Low	94 Å²	94	109.1 Å²	109.1	49%	0.492	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	13.7	-176.3	-75.8	167.4	0	0	0	114	M1181 S1182 F1187	M1181-L1185 HydrophobicContact CB-CD1 4.26Å; M1181-L1185 VanDerWaalsContact O-CB 3.3Å; M1181-L1185 WeakPolarHBondContact O-CB 3.24Å; M1181-L1185 VanDerWaalsContact O-CG 3.26Å; M1181-L1185 WeakPolarHBondContact O-CG 3.29Å; M1181-L1185 PolarHBondContact O-N 3.05Å; S1182-L1185 PolarHBondContact O-N 2.8Å; L1185-F1187 VanDerWaalsContact C-N 3.31Å; L1185-F1187 HydrophobicContact CD2-CE2 4.48Å; L1185-F1187 HydrophobicContact CD2-CZ 4.11Å; L1185-F1187 WeakPolarHBondContact O-CD2 3.28Å; L1185-F1187 WeakPolarHBondContact O-CE2 3.47Å; L1185-F1187 PolarHBondContact O-N 3.24Å
1186	N	43.5	Very low	49	Very low	82 Å²	82	110.8 Å²	110.8	44%	0.439	53%	0.526	S	S	.	.			trans	-71.1	83.7	172.3	-169	18.1	0	0	0	111.5	R1188 D1189	N1186-R1188 PolarHBondContact O-N 3.09Å; N1186-D1189 PolarHBondContact ND2-OD2 3.26Å; N1186-D1189 PolarHBondContact O-N 3.15Å
1187	F	35.2	Very low	47.7	Very low	132 Å²	132	106.9 Å²	106.9	58%	0.579	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-22.6	-173.8	-68	-84.6	0	0	0	115.2	L1185 D1189 S1190 Y1193	L1185-F1187 VanDerWaalsContact C-N 3.31Å; L1185-F1187 HydrophobicContact CD2-CE2 4.48Å; L1185-F1187 HydrophobicContact CD2-CZ 4.11Å; L1185-F1187 WeakPolarHBondContact O-CD2 3.28Å; L1185-F1187 WeakPolarHBondContact O-CE2 3.47Å; L1185-F1187 PolarHBondContact O-N 3.24Å; F1187-D1189 VanDerWaalsContact C-N 3.27Å; F1187-D1189 PolarHBondContact O-N 3.28Å; F1187-S1190 WeakPolarHBondContact O-CB 3.08Å; F1187-S1190 PolarHBondContact O-N 2.91Å; F1187-S1190 PolarHBondContact O-OG 3.08Å; F1187-Y1193 WeakPolarHBondContact O-CB 3.22Å
1188	R	38.1	Very low	47.4	Very low	185 Å²	185	107.4 Å²	107.4	70%	0.698	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.9	175	-70.8	-180	172.8	178.4	-0.8	113.4	N1186 Y1193	N1186-R1188 PolarHBondContact O-N 3.09Å; R1188-Y1193 WeakPolarHBondContact O-CD1 3.5Å
1189	D	45	Very low	47	Very low	98 Å²	98	106.2 Å²	106.2	52%	0.524	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-17.4	178.9	-72	-56.2	0	0	0	113.3	N1186 F1187 K1194	N1186-D1189 PolarHBondContact ND2-OD2 3.26Å; N1186-D1189 PolarHBondContact O-N 3.15Å; F1187-D1189 VanDerWaalsContact C-N 3.27Å; F1187-D1189 PolarHBondContact O-N 3.28Å; D1189-K1194 PolarHBondContact O-NZ 2.87Å; D1189-K1194 IonicContact OD1-NZ 2.67Å
1190	S	47.8	Very low	45.8	Very low	40 Å²	40	104.6 Å²	104.6	28%	0.28	51%	0.513	S	S	.	.	S	Bend	trans	-57.5	137.4	-178.2	74.9	0	0	0	0	112	F1187 S1192 Y1193 K1194	F1187-S1190 WeakPolarHBondContact O-CB 3.08Å; F1187-S1190 PolarHBondContact O-N 2.91Å; F1187-S1190 PolarHBondContact O-OG 3.08Å; S1190-S1192 PolarHBondContact O-N 3.1Å; S1190-Y1193 PolarHBondContact O-N 3.26Å; S1190-Y1193 WeakPolarHBondContact OG-CB 2.83Å; S1190-Y1193 PolarHBondContact OG-N 3.28Å; S1190-K1194 PolarHBondContact O-N 3.24Å; S1190-K1194 VanDerWaalsContact O-N 3.16Å
1191	E	45.4	Very low	45.4	Very low	150 Å²	150	105 Å²	105	70%	0.701	52%	0.518	S	S	*	.	H	α-helix	trans	-60.1	-34.8	178.1	-164.3	172.4	-166.3	0	0	111.1	Y1193 K1194 I1195	E1191-Y1193 VanDerWaalsContact C-N 3.35Å; E1191-Y1193 PolarHBondContact O-N 2.91Å; E1191-K1194 PolarHBondContact O-N 3.11Å; E1191-I1195 HydrophobicContact CG-CD1 4.02Å; E1191-I1195 VanDerWaalsContact O-CB 3.28Å; E1191-I1195 WeakPolarHBondContact O-CB 3.25Å; E1191-I1195 WeakPolarHBondContact O-CD1 3.4Å; E1191-I1195 WeakPolarHBondContact O-CG1 3.4Å; E1191-I1195 PolarHBondContact O-N 2.85Å
1192	S	40.7	Very low	45.6	Very low	89 Å²	89	103.4 Å²	103.4	62%	0.622	52%	0.518	S	S	*	.	H	α-helix	trans	-55.5	-41.9	171.6	-53.7	0	0	0	0	113.5	S1190 I1195 Y1196	S1190-S1192 PolarHBondContact O-N 3.1Å; S1192-I1195 WeakPolarHBondContact O-CB 3.34Å; S1192-Y1196 WeakPolarHBondContact O-CB 3.05Å; S1192-Y1196 PolarHBondContact O-N 3.33Å
1193	Y	45.5	Very low	45.4	Very low	121 Å²	121	103.6 Å²	103.6	48%	0.475	52%	0.516	S	S	.	.	H	α-helix	trans	-71.5	-42.2	176.6	-179.5	-100.8	0	0	0	111.8	F1187 R1188 S1190 E1191 I1195 Y1196 A1197	F1187-Y1193 WeakPolarHBondContact O-CB 3.22Å; R1188-Y1193 WeakPolarHBondContact O-CD1 3.5Å; S1190-Y1193 PolarHBondContact O-N 3.26Å; S1190-Y1193 WeakPolarHBondContact OG-CB 2.83Å; S1190-Y1193 PolarHBondContact OG-N 3.28Å; E1191-Y1193 VanDerWaalsContact C-N 3.35Å; E1191-Y1193 PolarHBondContact O-N 2.91Å; Y1193-I1195 VanDerWaalsContact C-N 3.31Å; Y1193-I1195 PolarHBondContact O-N 3.34Å; Y1193-Y1196 PolarHBondContact O-N 2.81Å; Y1193-A1197 WeakPolarHBondContact O-CB 3.1Å; Y1193-A1197 PolarHBondContact O-N 3.44Å
1194	K	49.8	Very low	44.8	Very low	106 Å²	106	103.1 Å²	103.1	46%	0.461	51%	0.512	S	S	.	.	H	α-helix	trans	-61.5	-39.5	173.9	-71.2	164.3	-179.8	155.5	0	111.6	D1189 S1190 E1191 N1198	D1189-K1194 PolarHBondContact O-NZ 2.87Å; D1189-K1194 IonicContact OD1-NZ 2.67Å; S1190-K1194 PolarHBondContact O-N 3.24Å; S1190-K1194 VanDerWaalsContact O-N 3.16Å; E1191-K1194 PolarHBondContact O-N 3.11Å; K1194-N1198 WeakPolarHBondContact O-CB 3.34Å; K1194-N1198 PolarHBondContact O-N 3.03Å
1195	I	48.8	Very low	44.4	Very low	53 Å²	53	100.1 Å²	100.1	27%	0.272	50%	0.5	S	S	.	.	H	α-helix	trans	-60.2	-49	171.6	-78.6	162.3	0	0	0	111.2	R1024 E1191 S1192 Y1193 N1198 M1199	R1024-I1195 VanDerWaalsContact NH1-CD1 3.34Å; R1024-I1195 VanDerWaalsContact NH2-CG2 3.26Å; E1191-I1195 HydrophobicContact CG-CD1 4.02Å; E1191-I1195 VanDerWaalsContact O-CB 3.28Å; E1191-I1195 WeakPolarHBondContact O-CB 3.25Å; E1191-I1195 WeakPolarHBondContact O-CD1 3.4Å; E1191-I1195 WeakPolarHBondContact O-CG1 3.4Å; E1191-I1195 PolarHBondContact O-N 2.85Å; S1192-I1195 WeakPolarHBondContact O-CB 3.34Å; Y1193-I1195 VanDerWaalsContact C-N 3.31Å; Y1193-I1195 PolarHBondContact O-N 3.34Å; I1195-N1198 PolarHBondContact O-N 2.83Å; I1195-M1199 WeakPolarHBondContact O-CB 3.38Å; I1195-M1199 PolarHBondContact O-N 2.93Å
1196	Y	41.6	Very low	44.6	Very low	116 Å²	116	97.3 Å²	97.3	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-66.1	-42.5	-178.2	-174	-103.7	0	0	0	112.2	S1192 Y1193 M1199 L1200	S1192-Y1196 WeakPolarHBondContact O-CB 3.05Å; S1192-Y1196 PolarHBondContact O-N 3.33Å; Y1193-Y1196 PolarHBondContact O-N 2.81Å; Y1196-M1199 PolarHBondContact O-N 3.4Å; Y1196-L1200 HydrophobicContact CD1-CD1 3.9Å; Y1196-L1200 HydrophobicContact CE1-CD1 3.53Å; Y1196-L1200 HydrophobicContact CE1-CG 4.37Å; Y1196-L1200 PolarHBondContact O-N 3.5Å
1197	A	45.6	Very low	44.5	Very low	36 Å²	36	96.2 Å²	96.2	30%	0.298	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-43.2	174.4	0	0	0	0	0	112.4	Y1193 M1199 L1200 N1201	Y1193-A1197 WeakPolarHBondContact O-CB 3.1Å; Y1193-A1197 PolarHBondContact O-N 3.44Å; A1197-M1199 VanDerWaalsContact C-N 3.34Å; A1197-M1199 PolarHBondContact O-N 3.33Å; A1197-L1200 PolarHBondContact O-N 2.83Å; A1197-N1201 PolarHBondContact O-N 3.31Å
1198	N	55	Low	44.8	Very low	112 Å²	112	98.4 Å²	98.4	60%	0.599	50%	0.501	S	S	*	.	H	α-helix	trans	-66.7	-34.1	174.5	-78.6	-17.4	0	0	0	112.5	K1194 I1195 S1202	K1194-N1198 WeakPolarHBondContact O-CB 3.34Å; K1194-N1198 PolarHBondContact O-N 3.03Å; I1195-N1198 PolarHBondContact O-N 2.83Å; N1198-S1202 VanDerWaalsContact O-CB 3.25Å; N1198-S1202 WeakPolarHBondContact O-CB 3.34Å; N1198-S1202 PolarHBondContact O-N 3.01Å
1199	M	44.8	Very low	45	Very low	127 Å²	127	93 Å²	93	63%	0.626	49%	0.485	S	S	*	.	H	α-helix	trans	-66.6	-42.4	174.3	-171.1	172.9	176.4	0	0	111.5	I1195 Y1196 A1197 S1202 V1203	I1195-M1199 WeakPolarHBondContact O-CB 3.38Å; I1195-M1199 PolarHBondContact O-N 2.93Å; Y1196-M1199 PolarHBondContact O-N 3.4Å; A1197-M1199 VanDerWaalsContact C-N 3.34Å; A1197-M1199 PolarHBondContact O-N 3.33Å; M1199-S1202 WeakPolarHBondContact O-CB 3.32Å; M1199-S1202 PolarHBondContact O-N 2.86Å; M1199-V1203 WeakPolarHBondContact O-CG2 3.4Å; M1199-V1203 PolarHBondContact O-N 2.98Å
1200	L	42.1	Very low	45.2	Very low	77 Å²	77	93 Å²	93	40%	0.403	48%	0.482	S	S	.	.	H	α-helix	trans	-62	-46.7	173.4	-77.2	169.2	0	0	0	112	Y1196 A1197 S1202 V1203 F1204	Y1196-L1200 HydrophobicContact CD1-CD1 3.9Å; Y1196-L1200 HydrophobicContact CE1-CD1 3.53Å; Y1196-L1200 HydrophobicContact CE1-CG 4.37Å; Y1196-L1200 PolarHBondContact O-N 3.5Å; A1197-L1200 PolarHBondContact O-N 2.83Å; L1200-S1202 VanDerWaalsContact C-N 3.32Å; L1200-S1202 PolarHBondContact O-N 2.98Å; L1200-V1203 PolarHBondContact O-N 3.31Å; L1200-F1204 WeakPolarHBondContact O-CB 3.36Å; L1200-F1204 PolarHBondContact O-N 3.5Å
1201	N	51.1	Low	44.8	Very low	96 Å²	96	98.4 Å²	98.4	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-59.9	-40.7	173.7	-94.4	-17.2	0	0	0	112.3	A1197 F1204 H1205	A1197-N1201 PolarHBondContact O-N 3.31Å; N1201-F1204 PolarHBondContact O-N 3.13Å; N1201-H1205 WeakPolarHBondContact O-CB 3.34Å; N1201-H1205 PolarHBondContact O-N 3.37Å
1202	S	49.7	Very low	44.5	Very low	81 Å²	81	93.1 Å²	93.1	57%	0.566	48%	0.475	S	S	*	.	H	α-helix	trans	-62.6	-41.7	176.9	-176.9	0	0	0	0	112.1	N1198 M1199 L1200 H1205 S1206	N1198-S1202 VanDerWaalsContact O-CB 3.25Å; N1198-S1202 WeakPolarHBondContact O-CB 3.34Å; N1198-S1202 PolarHBondContact O-N 3.01Å; M1199-S1202 WeakPolarHBondContact O-CB 3.32Å; M1199-S1202 PolarHBondContact O-N 2.86Å; L1200-S1202 VanDerWaalsContact C-N 3.32Å; L1200-S1202 PolarHBondContact O-N 2.98Å; S1202-H1205 CarbonylContact O-C 3.57Å; S1202-H1205 PolarHBondContact O-N 2.88Å; S1202-S1206 WeakPolarHBondContact O-CA 3.24Å; S1202-S1206 WeakPolarHBondContact O-CB 3.2Å; S1202-S1206 PolarHBondContact O-N 2.95Å
1203	V	42.9	Very low	44.5	Very low	76 Å²	76	95 Å²	95	46%	0.461	47%	0.472	S	S	.	.	H	α-helix	trans	-65.5	-45.2	173.9	171.8	0	0	0	0	111.1	M1199 L1200 H1205 S1206	M1199-V1203 WeakPolarHBondContact O-CG2 3.4Å; M1199-V1203 PolarHBondContact O-N 2.98Å; L1200-V1203 PolarHBondContact O-N 3.31Å; V1203-H1205 PolarHBondContact O-N 3.42Å; V1203-S1206 VanDerWaalsContact O-CB 3.28Å; V1203-S1206 WeakPolarHBondContact O-CB 3.39Å; V1203-S1206 PolarHBondContact O-N 3.47Å; V1203-S1206 VanDerWaalsContact O-N 3.09Å; V1203-S1206 PolarHBondContact O-OG 2.99Å
1204	F	40.7	Very low	44.2	Very low	143 Å²	143	97.3 Å²	97.3	63%	0.627	48%	0.48	S	S	*	.	H	α-helix	trans	-63.9	-20.8	178	-120.8	-83	0	0	0	114.3	L1200 N1201	L1200-F1204 WeakPolarHBondContact O-CB 3.36Å; L1200-F1204 PolarHBondContact O-N 3.5Å; N1201-F1204 PolarHBondContact O-N 3.13Å
1205	H	40.9	Very low	43.7	Very low	89 Å²	89	96.1 Å²	96.1	41%	0.412	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	4.6	175.8	-68.4	-9.7	0	0	0	113.4	N1201 S1202 V1203	N1201-H1205 WeakPolarHBondContact O-CB 3.34Å; N1201-H1205 PolarHBondContact O-N 3.37Å; S1202-H1205 CarbonylContact O-C 3.57Å; S1202-H1205 PolarHBondContact O-N 2.88Å; V1203-H1205 PolarHBondContact O-N 3.42Å
1206	S	43.4	Very low	43	Very low	34 Å²	34	97.3 Å²	97.3	24%	0.238	48%	0.484	C	S	.	.			trans	-61.9	144.9	-173.7	66.5	0	0	0	0	112.9	S1202 V1203 W1208 L1209 Q1210	S1202-S1206 WeakPolarHBondContact O-CA 3.24Å; S1202-S1206 WeakPolarHBondContact O-CB 3.2Å; S1202-S1206 PolarHBondContact O-N 2.95Å; V1203-S1206 VanDerWaalsContact O-CB 3.28Å; V1203-S1206 WeakPolarHBondContact O-CB 3.39Å; V1203-S1206 PolarHBondContact O-N 3.47Å; V1203-S1206 VanDerWaalsContact O-N 3.09Å; V1203-S1206 PolarHBondContact O-OG 2.99Å; S1206-W1208 PolarHBondContact O-N 2.85Å; S1206-W1208 VanDerWaalsContact O-N 3.13Å; S1206-L1209 PolarHBondContact O-N 3.09Å; S1206-L1209 VanDerWaalsContact O-N 3.12Å; S1206-L1209 PolarHBondContact OG-N 2.71Å; S1206-Q1210 PolarHBondContact O-N 2.81Å
1207	G	40.6	Very low	42.7	Very low	59 Å²	59	96 Å²	96	61%	0.608	49%	0.485	S	S	*	.	H	α-helix	trans	-59	-24.4	176.1	0	0	0	0	0	113.4	Y1211	G1207-Y1211 VanDerWaalsContact O-CB 3.28Å; G1207-Y1211 WeakPolarHBondContact O-CB 3.06Å; G1207-Y1211 PolarHBondContact O-N 3.46Å
1208	W	41.5	Very low	42.2	Very low	179 Å²	179	98.9 Å²	98.9	68%	0.678	50%	0.498	S	S	*	.	H	α-helix	trans	-71.4	-46.5	173.9	-174.5	83.9	0	0	0	112.2	S1206 Q1210 Y1211 V1212	S1206-W1208 PolarHBondContact O-N 2.85Å; S1206-W1208 VanDerWaalsContact O-N 3.13Å; W1208-Q1210 VanDerWaalsContact C-N 3.28Å; W1208-Q1210 PolarHBondContact O-N 2.9Å; W1208-Y1211 WeakPolarHBondContact O-CB 3.02Å; W1208-Y1211 PolarHBondContact O-N 3.18Å; W1208-V1212 HydrophobicContact CD2-CG2 4.31Å; W1208-V1212 HydrophobicContact CE3-CG2 4.45Å; W1208-V1212 HydrophobicContact CH2-CG2 4.24Å; W1208-V1212 HydrophobicContact CZ2-CG2 4.08Å; W1208-V1212 HydrophobicContact CZ3-CG2 4.42Å; W1208-V1212 PolarHBondContact O-N 3.12Å
1209	L	42.8	Very low	41	Very low	70 Å²	70	97 Å²	97	37%	0.366	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-35.5	173	-119	103.3	0	0	0	111.6	S1206 K1213	S1206-L1209 PolarHBondContact O-N 3.09Å; S1206-L1209 VanDerWaalsContact O-N 3.12Å; S1206-L1209 PolarHBondContact OG-N 2.71Å; L1209-K1213 VanDerWaalsContact O-CB 3.27Å; L1209-K1213 WeakPolarHBondContact O-CB 3.47Å; L1209-K1213 PolarHBondContact O-N 3Å
1210	Q	48.1	Very low	40.3	Very low	99 Å²	99	96.5 Å²	96.5	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-67.9	-32.3	171.4	-67.6	-163.1	20.2	0	0	113	S1206 W1208 R1214	S1206-Q1210 PolarHBondContact O-N 2.81Å; W1208-Q1210 VanDerWaalsContact C-N 3.28Å; W1208-Q1210 PolarHBondContact O-N 2.9Å; Q1210-R1214 WeakPolarHBondContact O-CB 3.42Å; Q1210-R1214 VanDerWaalsContact O-CG 3.26Å; Q1210-R1214 WeakPolarHBondContact O-CG 3.49Å; Q1210-R1214 PolarHBondContact O-N 3Å
1211	Y	39.1	Very low	39.6	Very low	153 Å²	153	98.2 Å²	98.2	60%	0.6	50%	0.504	S	S	*	.	H	α-helix	trans	-69.5	-48	175.7	178.2	-93.5	0	0	0	111.3	G1207 W1208 K1213 R1214 M1215	G1207-Y1211 VanDerWaalsContact O-CB 3.28Å; G1207-Y1211 WeakPolarHBondContact O-CB 3.06Å; G1207-Y1211 PolarHBondContact O-N 3.46Å; W1208-Y1211 WeakPolarHBondContact O-CB 3.02Å; W1208-Y1211 PolarHBondContact O-N 3.18Å; Y1211-K1213 VanDerWaalsContact C-N 3.3Å; Y1211-K1213 PolarHBondContact O-N 3.42Å; Y1211-R1214 CarbonylContact O-C 3.53Å; Y1211-R1214 WeakPolarHBondContact O-CB 3.37Å; Y1211-R1214 PolarHBondContact O-N 3.4Å; Y1211-R1214 VanDerWaalsContact O-N 3.08Å; Y1211-M1215 PolarHBondContact O-N 3.45Å
1212	V	40	Very low	38.6	Very low	39 Å²	39	101.6 Å²	101.6	24%	0.236	52%	0.521	C	S	.	.	H	α-helix	trans	-57.1	-45.8	172.6	174.6	0	0	0	0	110.2	W1208 R1214 M1215 L1216	W1208-V1212 HydrophobicContact CD2-CG2 4.31Å; W1208-V1212 HydrophobicContact CE3-CG2 4.45Å; W1208-V1212 HydrophobicContact CH2-CG2 4.24Å; W1208-V1212 HydrophobicContact CZ2-CG2 4.08Å; W1208-V1212 HydrophobicContact CZ3-CG2 4.42Å; W1208-V1212 PolarHBondContact O-N 3.12Å; V1212-R1214 VanDerWaalsContact C-N 3.33Å; V1212-R1214 PolarHBondContact O-N 2.75Å; V1212-M1215 WeakPolarHBondContact O-CB 3.21Å; V1212-M1215 PolarHBondContact O-N 3.07Å; V1212-M1215 VanDerWaalsContact O-N 3.08Å; V1212-L1216 HydrophobicContact CG1-CD1 4.12Å; V1212-L1216 WeakPolarHBondContact O-CG 3.24Å; V1212-L1216 PolarHBondContact O-N 3.04Å
1213	K	40	Very low	37.6	Very low	129 Å²	129	106.5 Å²	106.5	56%	0.561	54%	0.535	S	S	*	.	H	α-helix	trans	-61.9	-36.1	175.1	-171.2	166.8	-174.7	167.3	0	113.4	L1209 Y1211 N1217	L1209-K1213 VanDerWaalsContact O-CB 3.27Å; L1209-K1213 WeakPolarHBondContact O-CB 3.47Å; L1209-K1213 PolarHBondContact O-N 3Å; Y1211-K1213 VanDerWaalsContact C-N 3.3Å; Y1211-K1213 PolarHBondContact O-N 3.42Å; K1213-N1217 VanDerWaalsContact O-CB 3.3Å; K1213-N1217 WeakPolarHBondContact O-CB 3.45Å; K1213-N1217 PolarHBondContact O-N 3.3Å; K1213-N1217 PolarHBondContact O-OD1 3.47Å; K1213-N1217 VanDerWaalsContact O-OD1 3.12Å
1214	R	39.9	Very low	36.9	Very low	169 Å²	169	113.5 Å²	113.5	64%	0.638	55%	0.553	S	S	*	*	H	α-helix	trans	-70	-32.9	172.2	-77.2	174.2	-173.3	-179.5	5.6	112.5	Q1210 Y1211 V1212 N1217 T1218	Q1210-R1214 WeakPolarHBondContact O-CB 3.42Å; Q1210-R1214 VanDerWaalsContact O-CG 3.26Å; Q1210-R1214 WeakPolarHBondContact O-CG 3.49Å; Q1210-R1214 PolarHBondContact O-N 3Å; Y1211-R1214 CarbonylContact O-C 3.53Å; Y1211-R1214 WeakPolarHBondContact O-CB 3.37Å; Y1211-R1214 PolarHBondContact O-N 3.4Å; Y1211-R1214 VanDerWaalsContact O-N 3.08Å; V1212-R1214 VanDerWaalsContact C-N 3.33Å; V1212-R1214 PolarHBondContact O-N 2.75Å; R1214-N1217 CarbonylContact O-C 3.6Å; R1214-T1218 WeakPolarHBondContact O-CG2 3.05Å; R1214-T1218 PolarHBondContact O-N 2.81Å; R1214-T1218 PolarHBondContact O-OG1 3.3Å
1215	M	38.4	Very low	36.2	Very low	81 Å²	81	112.5 Å²	112.5	40%	0.399	55%	0.554	S	S	.	*	H	α-helix	trans	-67	-47.5	175.9	-156.2	-177.2	79.3	0	0	110.5	Y1211 V1212 N1217 T1218 S1219	Y1211-M1215 PolarHBondContact O-N 3.45Å; V1212-M1215 WeakPolarHBondContact O-CB 3.21Å; V1212-M1215 PolarHBondContact O-N 3.07Å; V1212-M1215 VanDerWaalsContact O-N 3.08Å; M1215-N1217 PolarHBondContact O-N 2.75Å; M1215-T1218 WeakPolarHBondContact CA-OG1 3.41Å; M1215-T1218 PolarHBondContact O-N 2.78Å; M1215-T1218 PolarHBondContact O-OG1 2.93Å; M1215-S1219 PolarHBondContact O-N 3.42Å
1216	L	35.2	Very low	35.5	Very low	79 Å²	79	114.4 Å²	114.4	41%	0.414	57%	0.574	S	S	.	*	H	α-helix	trans	-58.1	-47.2	172.3	-68.2	165.1	0	0	0	111.5	V1212 T1218 S1219	V1212-L1216 HydrophobicContact CG1-CD1 4.12Å; V1212-L1216 WeakPolarHBondContact O-CG 3.24Å; V1212-L1216 PolarHBondContact O-N 3.04Å; L1216-T1218 PolarHBondContact O-N 3.46Å; L1216-T1218 VanDerWaalsContact O-N 3.15Å; L1216-S1219 PolarHBondContact O-N 2.71Å; L1216-S1219 PolarHBondContact O-OG 3.39Å
1217	N	35.4	Very low	34.8	Very low	88 Å²	88	122.7 Å²	122.7	47%	0.471	60%	0.601	S	S	.	*	H	α-helix	trans	-68.5	-4	174.4	-87.6	96.8	0	0	0	115	K1213 R1214 M1215	K1213-N1217 VanDerWaalsContact O-CB 3.3Å; K1213-N1217 WeakPolarHBondContact O-CB 3.45Å; K1213-N1217 PolarHBondContact O-N 3.3Å; K1213-N1217 PolarHBondContact O-OD1 3.47Å; K1213-N1217 VanDerWaalsContact O-OD1 3.12Å; R1214-N1217 CarbonylContact O-C 3.6Å; M1215-N1217 PolarHBondContact O-N 2.75Å
1218	T	34	Very low	34.2	Very low	96 Å²	96	127.6 Å²	127.6	59%	0.589	61%	0.607	S	S	*	*	H	α-helix	trans	-100.4	-15.4	173.6	39.6	0	0	0	0	113.7	R1214 M1215 L1216 D1220	R1214-T1218 WeakPolarHBondContact O-CG2 3.05Å; R1214-T1218 PolarHBondContact O-N 2.81Å; R1214-T1218 PolarHBondContact O-OG1 3.3Å; M1215-T1218 WeakPolarHBondContact CA-OG1 3.41Å; M1215-T1218 PolarHBondContact O-N 2.78Å; M1215-T1218 PolarHBondContact O-OG1 2.93Å; L1216-T1218 PolarHBondContact O-N 3.46Å; L1216-T1218 VanDerWaalsContact O-N 3.15Å; T1218-D1220 VanDerWaalsContact C-N 3.29Å
1219	S	30.6	Very low	33.6	Very low	73 Å²	73	129 Å²	129	51%	0.51	62%	0.619	S	S	.	*	H	α-helix	trans	-65.4	-29.9	162.2	10.4	0	0	0	0	113.1	M1215 L1216 N1221	M1215-S1219 PolarHBondContact O-N 3.42Å; L1216-S1219 PolarHBondContact O-N 2.71Å; L1216-S1219 PolarHBondContact O-OG 3.39Å; S1219-N1221 PolarHBondContact O-N 3.39Å
1220	D	29.3	Very low	32.8	Very low	117 Å²	117	130.1 Å²	130.1	63%	0.626	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-5.5	-172.8	-67.4	-27.3	0	0	0	115.7	T1218	T1218-D1220 VanDerWaalsContact C-N 3.29Å
1221	N	28.7	Very low	31.7	Very low	113 Å²	113	132.7 Å²	132.7	60%	0.604	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-0.2	-172.7	-76.8	-66.6	0	0	0	115.4	S1219	S1219-N1221 PolarHBondContact O-N 3.39Å
1222	L	29.7	Very low	31.2	Very low	167 Å²	167	135 Å²	135	87%	0.874	67%	0.665	S	S	*	*	S	Bend	trans	-100.3	14.2	-166.9	-142.5	81.7	0	0	0	117
1223	E	29.3	Very low	30.5	Very low	184 Å²	184	142.8 Å²	142.8	86%	0.86	70%	0.696	S	S	*	*			trans	-141.7	31.4	179.6	-139.2	167.1	-131.5	0	0	115.9	N1225	E1223-N1225 PolarHBondContact O-N 2.98Å; E1223-N1225 VanDerWaalsContact O-N 3.17Å
1224	R	26.8	Very low	30	Very low	222 Å²	222	142.9 Å²	142.9	84%	0.838	71%	0.706	S	S	*	*			trans	-84.6	67.4	176.6	-89.7	-172.2	169.4	-169.5	-1.3	114.3
1225	N	26.7	Very low	29.4	Very low	122 Å²	122	142.3 Å²	142.3	65%	0.652	71%	0.711	S	S	*	*			trans	-170.7	86.9	146.4	-114.4	-30.5	0	0	0	116.2	E1223 R1227	E1223-N1225 PolarHBondContact O-N 2.98Å; E1223-N1225 VanDerWaalsContact O-N 3.17Å; N1225-R1227 PolarHBondContact O-N 2.94Å
1226	P	27.1	Very low	28.8	Very low	129 Å²	129	144 Å²	144	84%	0.838	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	7.8	176.5	-17.3	32.7	0	0	0	116.1
1227	R	27.4	Very low	28.4	Very low	209 Å²	209	149 Å²	149	79%	0.789	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	1.1	-160.6	-75.7	-171.4	173.7	-175.9	-0.7	117.2	N1225	N1225-R1227 PolarHBondContact O-N 2.94Å
1228	H	28.8	Very low	28.1	Very low	161 Å²	161	151.1 Å²	151.1	75%	0.745	76%	0.763	S	S	*	*	S	Bend	trans	-105	-6	-169.5	-98.3	-72.6	0	0	0	117.8
1229	F	28	Very low	27.8	Very low	210 Å²	210	156.1 Å²	156.1	92%	0.921	78%	0.777	S	S	*	*			trans	-100.4	8.1	-179.8	-84.2	-78.4	0	0	0	115.5	N1231	F1229-N1231 PolarHBondContact O-N 3.38Å
1230	S	25.9	Very low	27.7	Very low	93 Å²	93	159.4 Å²	159.4	65%	0.65	79%	0.788	S	S	*	*			trans	-90	70.7	171.7	61.2	0	0	0	0	112
1231	N	26.2	Very low	27.7	Very low	152 Å²	152	158.3 Å²	158.3	81%	0.813	78%	0.782	S	S	*	*			trans	177.3	78.2	153.3	-94.1	-27.2	0	0	0	113.5	F1229	F1229-N1231 PolarHBondContact O-N 3.38Å
1232	H	28	Very low	27.8	Very low	201 Å²	201	160 Å²	160	93%	0.931	78%	0.784	S	S	*	*			trans	-153.2	134.5	136.1	-92.9	-55.1	0	0	0	109.9
1233	K	26.1	Very low	28.1	Very low	204 Å²	204	159.7 Å²	159.7	89%	0.887	78%	0.778	S	S	*	*			trans	-85	142.8	174.2	-59.6	171.9	-179.9	175.3	0	109
1234	V	27.9	Very low	28.6	Very low	130 Å²	130	154.1 Å²	154.1	79%	0.788	75%	0.754	S	S	*	*			trans	-168.9	121	133.2	140.4	0	0	0	0	109.5
1235	H	28.7	Very low	29.2	Very low	158 Å²	158	146.9 Å²	146.9	73%	0.731	74%	0.737	S	S	*	*			trans	32.3	90	153.7	-62.7	-72.4	0	0	0	122.2
1236	T	26.3	Very low	29.9	Very low	116 Å²	116	144.7 Å²	144.7	71%	0.712	72%	0.724	S	S	*	*				56.5	97.6	105.7	57.2	0	0	0	0	121
1237	E	25.9	Very low	31.1	Very low	185 Å²	185	145.9 Å²	145.9	86%	0.864	71%	0.712	S	S	*	*				-164.4	170.8	112.9	-108.8	172.9	-156.1	0	0	111.4
1238	T	29.6	Very low	32.2	Very low	131 Å²	131	144.3 Å²	144.3	80%	0.804	71%	0.706	S	S	*	*			trans	60.6	86.9	-175.6	64.6	0	0	0	0	117.5	L1240	T1238-L1240 PolarHBondContact O-N 3.22Å
1239	K	26.7	Very low	33.1	Very low	202 Å²	202	139.3 Å²	139.3	88%	0.878	68%	0.681	S	S	*	*			trans	-76.5	99.3	164.2	-79.8	-175.9	176.2	178.1	0	111.3
1240	L	28.9	Very low	34.5	Very low	142 Å²	142	131.7 Å²	131.7	74%	0.743	65%	0.647	S	S	*	*			trans	-90.2	100	166.2	-94.8	161.6	0	0	0	110.6	T1238 F1242	T1238-L1240 PolarHBondContact O-N 3.22Å; L1240-F1242 VanDerWaalsContact C-N 3.35Å; L1240-F1242 PolarHBondContact O-N 2.88Å
1241	N	30.1	Very low	36	Very low	94 Å²	94	131.2 Å²	131.2	50%	0.503	63%	0.634	S	S	.	*			trans	-69.3	87.5	175.6	-83.3	5.7	0	0	0	111.2	H1243 D1244 S1245	N1241-H1243 PolarHBondContact O-N 3.07Å; N1241-H1243 VanDerWaalsContact O-N 3.14Å; N1241-D1244 HydrophobicContact CB-CB 4.01Å; N1241-D1244 WeakPolarHBondContact CB-OD2 3.39Å; N1241-D1244 PolarHBondContact ND2-OD2 3.36Å; N1241-D1244 PolarHBondContact O-N 2.88Å; N1241-S1245 PolarHBondContact O-N 3.41Å
1242	F	29.2	Very low	37.2	Very low	148 Å²	148	129 Å²	129	65%	0.649	62%	0.618	S	S	*	*	H	α-helix	trans	-53.8	-33.6	174.8	-142.5	-88.6	0	0	0	112.2	L1240 S1245 M1246	L1240-F1242 VanDerWaalsContact C-N 3.35Å; L1240-F1242 PolarHBondContact O-N 2.88Å; F1242-S1245 PolarHBondContact O-N 2.91Å; F1242-M1246 HydrophobicContact CD1-CG 4.33Å; F1242-M1246 WeakPolarHBondContact O-CG 3.24Å; F1242-M1246 PolarHBondContact O-N 2.89Å; F1242-M1246 VanDerWaalsContact O-N 3.11Å
1243	H	36.3	Very low	38.2	Very low	161 Å²	161	119.6 Å²	119.6	75%	0.745	58%	0.575	S	S	*	*	H	α-helix	trans	-68.5	-31.9	179.2	-150.7	-35.5	0	0	0	113.6	N1241 R1247	N1241-H1243 PolarHBondContact O-N 3.07Å; N1241-H1243 VanDerWaalsContact O-N 3.14Å; H1243-R1247 WeakPolarHBondContact O-CB 3.34Å; H1243-R1247 PolarHBondContact O-N 3.26Å; H1243-R1247 VanDerWaalsContact O-N 3.12Å
1244	D	39.4	Very low	39.8	Very low	66 Å²	66	114.1 Å²	114.1	35%	0.353	55%	0.552	S	S	.	*	H	α-helix	trans	-77.4	-34.7	175	-74.2	-45.4	0	0	0	111.6	N1241 R1247 R1248	N1241-D1244 HydrophobicContact CB-CB 4.01Å; N1241-D1244 WeakPolarHBondContact CB-OD2 3.39Å; N1241-D1244 PolarHBondContact ND2-OD2 3.36Å; N1241-D1244 PolarHBondContact O-N 2.88Å; D1244-R1247 PolarHBondContact O-N 2.87Å; D1244-R1248 WeakPolarHBondContact O-CB 3.34Å; D1244-R1248 WeakPolarHBondContact O-CG 3.39Å; D1244-R1248 PolarHBondContact O-N 2.9Å
1245	S	39.6	Very low	41.2	Very low	70 Å²	70	115.6 Å²	115.6	49%	0.49	55%	0.551	S	S	.	*	H	α-helix	trans	-63.7	-46.3	175.2	-61.4	0	0	0	0	111.2	N1241 F1242 R1247 R1248 Y1249	N1241-S1245 PolarHBondContact O-N 3.41Å; F1242-S1245 PolarHBondContact O-N 2.91Å; S1245-R1247 PolarHBondContact O-N 3.49Å; S1245-R1248 PolarHBondContact O-N 3.01Å; S1245-Y1249 WeakPolarHBondContact O-CB 3.49Å; S1245-Y1249 PolarHBondContact O-N 3.44Å
1246	M	41.4	Very low	42.1	Very low	77 Å²	77	114.7 Å²	114.7	38%	0.379	54%	0.541	S	S	.	.	H	α-helix	trans	-63	-40.3	174.3	-70.8	-67.5	-76.7	0	0	112.2	F1242 Y1249 Y1250	F1242-M1246 HydrophobicContact CD1-CG 4.33Å; F1242-M1246 WeakPolarHBondContact O-CG 3.24Å; F1242-M1246 PolarHBondContact O-N 2.89Å; F1242-M1246 VanDerWaalsContact O-N 3.11Å; M1246-Y1249 PolarHBondContact O-N 3.36Å; M1246-Y1250 HydrophobicContact CB-CE2 4.48Å; M1246-Y1250 HydrophobicContact CE-CE2 4.13Å; M1246-Y1250 WeakPolarHBondContact CE-OH 3.28Å; M1246-Y1250 WeakPolarHBondContact O-CD2 3.08Å; M1246-Y1250 PolarHBondContact O-N 3.45Å
1247	R	53.2	Low	43	Very low	153 Å²	153	110.1 Å²	110.1	58%	0.577	51%	0.514	S	S	*	.	H	α-helix	trans	-62	-50.3	176.8	-176.1	176.7	-171.4	151.6	8.5	111.8	H1243 D1244 S1245 Y1249 Y1250 E1251	H1243-R1247 WeakPolarHBondContact O-CB 3.34Å; H1243-R1247 PolarHBondContact O-N 3.26Å; H1243-R1247 VanDerWaalsContact O-N 3.12Å; D1244-R1247 PolarHBondContact O-N 2.87Å; S1245-R1247 PolarHBondContact O-N 3.49Å; R1247-Y1249 VanDerWaalsContact C-N 3.29Å; R1247-Y1249 PolarHBondContact O-N 3.34Å; R1247-Y1250 PolarHBondContact O-N 3.06Å; R1247-E1251 VanDerWaalsContact CG-OE1 3.26Å; R1247-E1251 WeakPolarHBondContact CG-OE1 3.3Å; R1247-E1251 IonicContact CZ-OE1 3.96Å; R1247-E1251 IonicContact NE-OE1 2.71Å; R1247-E1251 PolarHBondContact NE-OE1 2.68Å; R1247-E1251 WeakPolarHBondContact O-CG 3.42Å; R1247-E1251 PolarHBondContact O-N 3.2Å
1248	R	49.6	Very low	44	Very low	176 Å²	176	104.7 Å²	104.7	66%	0.664	51%	0.507	S	S	*	.	H	α-helix	trans	-59.9	-38.4	175.9	-72.1	177.8	-170.5	-178.4	4.5	112	D1244 S1245 E1251 F1252	D1244-R1248 WeakPolarHBondContact O-CB 3.34Å; D1244-R1248 WeakPolarHBondContact O-CG 3.39Å; D1244-R1248 PolarHBondContact O-N 2.9Å; S1245-R1248 PolarHBondContact O-N 3.01Å; R1248-E1251 PolarHBondContact O-N 3.09Å; R1248-F1252 WeakPolarHBondContact O-CB 3.47Å; R1248-F1252 PolarHBondContact O-N 2.97Å
1249	Y	47.9	Very low	44.9	Very low	56 Å²	56	100 Å²	100	22%	0.22	48%	0.477	C	S	.	.	H	α-helix	trans	-62.7	-44.3	176.9	-171.4	-103.7	0	0	0	112	S1245 M1246 R1247 F1252 G1253 D1276 C1608	S1245-Y1249 WeakPolarHBondContact O-CB 3.49Å; S1245-Y1249 PolarHBondContact O-N 3.44Å; M1246-Y1249 PolarHBondContact O-N 3.36Å; R1247-Y1249 VanDerWaalsContact C-N 3.29Å; R1247-Y1249 PolarHBondContact O-N 3.34Å; Y1249-F1252 PolarHBondContact O-N 3.08Å; Y1249-G1253 PolarHBondContact O-N 2.9Å; Y1249-D1276 PolarHBondContact OH-OD2 3.1Å; Y1249-C1608 HydrophobicContact CE2-CB 4.37Å; Y1249-C1608 WeakPolarHBondContact OH-CB 3.39Å; Y1249-C1608 PolarHBondContact OH-SG 3.28Å
1250	Y	57.9	Low	46.6	Very low	50 Å²	50	97.3 Å²	97.3	20%	0.196	47%	0.465	C	S	.	.	H	α-helix	trans	-69.3	-33.1	174.2	-63.1	-47.8	0	0	0	113.7	M1246 R1247 G1253 Q1254 V1264 A1265	M1246-Y1250 HydrophobicContact CB-CE2 4.48Å; M1246-Y1250 HydrophobicContact CE-CE2 4.13Å; M1246-Y1250 WeakPolarHBondContact CE-OH 3.28Å; M1246-Y1250 WeakPolarHBondContact O-CD2 3.08Å; M1246-Y1250 PolarHBondContact O-N 3.45Å; R1247-Y1250 PolarHBondContact O-N 3.06Å; Y1250-G1253 PolarHBondContact O-N 3.27Å; Y1250-Q1254 WeakPolarHBondContact O-CB 3.21Å; Y1250-Q1254 PolarHBondContact O-N 3.42Å; Y1250-V1264 HydrophobicContact CD1-CB 4.31Å; Y1250-V1264 HydrophobicContact CD1-CG1 3.96Å; Y1250-A1265 HydrophobicContact CD1-CB 4.29Å; Y1250-A1265 HydrophobicContact CE1-CB 3.85Å; Y1250-A1265 HydrophobicContact CE2-CB 4.14Å
1251	E	56.5	Low	47.8	Very low	84 Å²	84	91.7 Å²	91.7	39%	0.393	44%	0.439	S	S	.	.	H	α-helix	trans	-68.8	-37.7	173.8	-72.7	165.1	-179.3	0	0	111.4	R1247 R1248 Q1254 Q1255	R1247-E1251 VanDerWaalsContact CG-OE1 3.26Å; R1247-E1251 WeakPolarHBondContact CG-OE1 3.3Å; R1247-E1251 IonicContact CZ-OE1 3.96Å; R1247-E1251 IonicContact NE-OE1 2.71Å; R1247-E1251 PolarHBondContact NE-OE1 2.68Å; R1247-E1251 WeakPolarHBondContact O-CG 3.42Å; R1247-E1251 PolarHBondContact O-N 3.2Å; R1248-E1251 PolarHBondContact O-N 3.09Å; E1251-Q1254 PolarHBondContact O-N 2.91Å; E1251-Q1255 WeakPolarHBondContact O-CG 3.5Å; E1251-Q1255 PolarHBondContact O-N 2.7Å
1252	F	52.4	Low	49	Very low	106 Å²	106	90.5 Å²	90.5	47%	0.465	44%	0.436	S	S	.	.	H	α-helix	trans	-63.8	-44.9	170.5	-127.2	-99.7	0	0	0	111.8	R1248 Y1249 Q1254 Q1255 R1256	R1248-F1252 WeakPolarHBondContact O-CB 3.47Å; R1248-F1252 PolarHBondContact O-N 2.97Å; Y1249-F1252 PolarHBondContact O-N 3.08Å; F1252-Q1254 VanDerWaalsContact C-N 3.31Å; F1252-Q1254 PolarHBondContact O-N 3.46Å; F1252-Q1255 PolarHBondContact O-N 2.73Å; F1252-R1256 PolarHBondContact O-N 3.21Å
1253	G	48.5	Very low	50	Low	3 Å²	3	88.7 Å²	88.7	3%	0.031	43%	0.426	C	S	.	.	H	α-helix	trans	-59.2	-41	173.9	0	0	0	0	0	112.1	Y1249 Y1250 S1257	Y1249-G1253 PolarHBondContact O-N 2.9Å; Y1250-G1253 PolarHBondContact O-N 3.27Å; G1253-S1257 WeakPolarHBondContact O-CB 3.34Å; G1253-S1257 PolarHBondContact O-N 3.28Å; G1253-S1257 PolarHBondContact O-OG 3.09Å
1254	Q	59.4	Low	50.9	Low	89 Å²	89	81.4 Å²	81.4	42%	0.416	39%	0.393	S	S	.	.	H	α-helix	trans	-65.6	-45.6	174.5	177.8	172.2	-58.1	0	0	112.3	Y1250 E1251 F1252 R1256 G1258 I1259	Y1250-Q1254 WeakPolarHBondContact O-CB 3.21Å; Y1250-Q1254 PolarHBondContact O-N 3.42Å; E1251-Q1254 PolarHBondContact O-N 2.91Å; F1252-Q1254 VanDerWaalsContact C-N 3.31Å; F1252-Q1254 PolarHBondContact O-N 3.46Å; Q1254-R1256 VanDerWaalsContact C-N 3.31Å; Q1254-R1256 PolarHBondContact O-N 3.36Å; Q1254-G1258 PolarHBondContact O-N 3.37Å; Q1254-G1258 VanDerWaalsContact O-N 3.11Å; Q1254-I1259 WeakPolarHBondContact CA-O 3.32Å; Q1254-I1259 WeakPolarHBondContact CG-O 3.44Å
1255	Q	58.5	Low	51.4	Low	160 Å²	160	79.7 Å²	79.7	75%	0.748	39%	0.388	S	S	*	.	H	α-helix	trans	-60.3	-38.4	177.3	-78.7	-176.9	-14	0	0	112.7	E1251 F1252	E1251-Q1255 WeakPolarHBondContact O-CG 3.5Å; E1251-Q1255 PolarHBondContact O-N 2.7Å; F1252-Q1255 PolarHBondContact O-N 2.73Å
1256	R	47.7	Very low	51.9	Low	140 Å²	140	80 Å²	80	53%	0.528	38%	0.383	S	S	.	.	H	α-helix	trans	-78.7	-46.2	178.6	-74.1	-177.9	167.8	171.5	-5.2	113.2	F1252 Q1254 H1279	F1252-R1256 PolarHBondContact O-N 3.21Å; Q1254-R1256 VanDerWaalsContact C-N 3.31Å; Q1254-R1256 PolarHBondContact O-N 3.36Å; R1256-H1279 PolarHBondContact O-CE1 3.49Å
1257	S	44.8	Very low	52.1	Low	20 Å²	20	78.7 Å²	78.7	14%	0.14	38%	0.377	C	S	.	.	H	α-helix	trans	-87.6	-20.3	-168	66.6	0	0	0	0	115.1	G1253 I1259	G1253-S1257 WeakPolarHBondContact O-CB 3.34Å; G1253-S1257 PolarHBondContact O-N 3.28Å; G1253-S1257 PolarHBondContact O-OG 3.09Å; S1257-I1259 PolarHBondContact O-N 3.48Å; S1257-I1259 WeakPolarHBondContact OG-CB 3.19Å; S1257-I1259 PolarHBondContact OG-N 2.78Å; S1257-I1259 VanDerWaalsContact OG-N 3.12Å
1258	G	46.1	Very low	51.9	Low	71 Å²	71	72.7 Å²	72.7	73%	0.732	36%	0.357	S	S	*	.	S	Bend	trans	68.6	8.2	-168.4	0	0	0	0	0	114.1	Q1254	Q1254-G1258 PolarHBondContact O-N 3.37Å; Q1254-G1258 VanDerWaalsContact O-N 3.11Å
1259	I	48.8	Very low	51.6	Low	32 Å²	32	73.7 Å²	73.7	16%	0.164	36%	0.361	C	S	.	.	S	Bend	trans	-99.2	135.4	177	-62.1	-177.6	0	0	0	109	Q1254 S1257 Y1263 V1264 V1278	Q1254-I1259 WeakPolarHBondContact CA-O 3.32Å; Q1254-I1259 WeakPolarHBondContact CG-O 3.44Å; S1257-I1259 PolarHBondContact O-N 3.48Å; S1257-I1259 WeakPolarHBondContact OG-CB 3.19Å; S1257-I1259 PolarHBondContact OG-N 2.78Å; S1257-I1259 VanDerWaalsContact OG-N 3.12Å; I1259-Y1263 HydrophobicContact CG2-CD2 4.19Å; I1259-Y1263 HydrophobicContact CG2-CG 4.25Å; I1259-V1264 HydrophobicContact CG2-CG2 4.37Å; I1259-V1278 HydrophobicContact CD1-CG1 3.8Å; I1259-V1278 HydrophobicContact CD1-CG2 4.49Å
1260	K	62.6	Low	51.1	Low	146 Å²	146	74.7 Å²	74.7	64%	0.635	37%	0.369	S	S	*	.			trans	-61.9	139.2	180	-56.9	179.9	-178.8	176.8	0	111	P1262 Y1263	K1260-P1262 VanDerWaalsContact C-N 3.31Å; K1260-P1262 WeakPolarHBondContact O-CD 3.5Å; K1260-Y1263 HydrophobicContact CB-CD2 4.04Å; K1260-Y1263 HydrophobicContact CB-CE2 4.27Å; K1260-Y1263 PolarHBondContact O-N 3.15Å
1261	A	52.9	Low	49.8	Very low	23 Å²	23	77.6 Å²	77.6	19%	0.19	39%	0.388	C	S	.	.	H	α-helix	trans	-44.7	-38	-176.6	0	0	0	0	0	116.4	Y1263 V1264 A1265	A1261-Y1263 VanDerWaalsContact C-N 3.28Å; A1261-Y1263 PolarHBondContact O-N 3.21Å; A1261-V1264 WeakPolarHBondContact O-CB 3.4Å; A1261-V1264 PolarHBondContact O-N 3.06Å; A1261-V1264 VanDerWaalsContact O-N 3.15Å; A1261-A1265 PolarHBondContact O-N 2.71Å
1262	P	55.7	Low	48.8	Very low	69 Å²	69	79.3 Å²	79.3	45%	0.448	40%	0.395	S	S	.	.	H	α-helix	trans	-59.1	-33.6	176.5	-27.3	37	0	0	0	114.6	K1260 L1266 I1546	K1260-P1262 VanDerWaalsContact C-N 3.31Å; K1260-P1262 WeakPolarHBondContact O-CD 3.5Å; P1262-L1266 WeakPolarHBondContact O-CB 3.45Å; P1262-L1266 PolarHBondContact O-N 3.18Å; P1262-I1546 HydrophobicContact CB-CD1 3.87Å; P1262-I1546 HydrophobicContact CG-CD1 4.09Å
1263	Y	51.7	Low	48.1	Very low	111 Å²	111	80.4 Å²	80.4	44%	0.435	40%	0.396	S	S	.	.	H	α-helix	trans	-80.5	-28.5	177.4	-55.4	-81.6	0	0	0	112.1	I1259 K1260 A1261 L1266 M1267	I1259-Y1263 HydrophobicContact CG2-CD2 4.19Å; I1259-Y1263 HydrophobicContact CG2-CG 4.25Å; K1260-Y1263 HydrophobicContact CB-CD2 4.04Å; K1260-Y1263 HydrophobicContact CB-CE2 4.27Å; K1260-Y1263 PolarHBondContact O-N 3.15Å; A1261-Y1263 VanDerWaalsContact C-N 3.28Å; A1261-Y1263 PolarHBondContact O-N 3.21Å; Y1263-L1266 PolarHBondContact O-N 2.75Å; Y1263-M1267 WeakPolarHBondContact O-CG 3.43Å; Y1263-M1267 PolarHBondContact O-N 2.83Å
1264	V	54.2	Low	47.9	Very low	8 Å²	8	84.3 Å²	84.3	5%	0.048	41%	0.414	C	S	.	.	H	α-helix	trans	-64.7	-44.4	170.7	-173.2	0	0	0	0	109.7	Y1250 I1259 A1261 M1267 N1268 A1275	Y1250-V1264 HydrophobicContact CD1-CB 4.31Å; Y1250-V1264 HydrophobicContact CD1-CG1 3.96Å; I1259-V1264 HydrophobicContact CG2-CG2 4.37Å; A1261-V1264 WeakPolarHBondContact O-CB 3.4Å; A1261-V1264 PolarHBondContact O-N 3.06Å; A1261-V1264 VanDerWaalsContact O-N 3.15Å; V1264-M1267 PolarHBondContact O-N 3.37Å; V1264-N1268 PolarHBondContact O-N 2.85Å; V1264-N1268 VanDerWaalsContact O-N 3.12Å; V1264-A1275 HydrophobicContact CG1-CB 4.09Å
1265	A	50.2	Low	46.7	Very low	29 Å²	29	80.4 Å²	80.4	24%	0.24	40%	0.397	C	S	.	.	H	α-helix	trans	-62.6	-40.3	172.2	0	0	0	0	0	112.3	Y1250 A1261 N1268 Y1269	Y1250-A1265 HydrophobicContact CD1-CB 4.29Å; Y1250-A1265 HydrophobicContact CE1-CB 3.85Å; Y1250-A1265 HydrophobicContact CE2-CB 4.14Å; A1261-A1265 PolarHBondContact O-N 2.71Å; A1265-N1268 PolarHBondContact O-N 3.29Å; A1265-Y1269 WeakPolarHBondContact O-CB 3.42Å; A1265-Y1269 PolarHBondContact O-N 3.33Å
1266	L	49.5	Very low	45.7	Very low	77 Å²	77	74.7 Å²	74.7	40%	0.403	37%	0.372	S	S	.	.	H	α-helix	trans	-63.8	-41.4	175.3	-173.6	64.6	0	0	0	112.3	P1262 Y1263 Y1269 M1270	P1262-L1266 WeakPolarHBondContact O-CB 3.45Å; P1262-L1266 PolarHBondContact O-N 3.18Å; Y1263-L1266 PolarHBondContact O-N 2.75Å; L1266-Y1269 WeakPolarHBondContact O-CB 3.46Å; L1266-Y1269 PolarHBondContact O-N 3.01Å; L1266-M1270 HydrophobicContact CG-CG 4.49Å; L1266-M1270 WeakPolarHBondContact O-CG 3.49Å; L1266-M1270 PolarHBondContact O-N 3.14Å
1267	M	46.8	Very low	45.2	Very low	49 Å²	49	68.9 Å²	68.9	24%	0.241	35%	0.354	C	S	.	.	H	α-helix	trans	-64	-44.1	176.6	-76	-178.1	171.9	0	0	111.9	Y1263 V1264 Y1269 M1270 F1272	Y1263-M1267 WeakPolarHBondContact O-CG 3.43Å; Y1263-M1267 PolarHBondContact O-N 2.83Å; V1264-M1267 PolarHBondContact O-N 3.37Å; M1267-Y1269 VanDerWaalsContact C-N 3.33Å; M1267-Y1269 PolarHBondContact O-N 2.99Å; M1267-M1270 WeakPolarHBondContact O-CB 3.4Å; M1267-M1270 PolarHBondContact O-N 2.99Å; M1267-M1270 VanDerWaalsContact O-N 3.09Å; M1267-F1272 HydrophobicContact CB-CB 4.43Å; M1267-F1272 WeakPolarHBondContact O-CB 3.32Å; M1267-F1272 PolarHBondContact O-N 2.87Å; M1267-F1272 VanDerWaalsContact O-N 3.1Å
1268	N	48.1	Very low	44.8	Very low	28 Å²	28	68.6 Å²	68.6	15%	0.15	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-41	172.3	-80.4	1	0	0	0	112.2	V1264 A1265 M1270 N1271 F1272 A1275	V1264-N1268 PolarHBondContact O-N 2.85Å; V1264-N1268 VanDerWaalsContact O-N 3.12Å; A1265-N1268 PolarHBondContact O-N 3.29Å; N1268-M1270 PolarHBondContact O-N 2.7Å; N1268-N1271 PolarHBondContact O-N 2.83Å; N1268-N1271 VanDerWaalsContact O-N 3.13Å; N1268-F1272 PolarHBondContact OD1-O 3.19Å; N1268-A1275 VanDerWaalsContact OD1-CB 3.32Å; N1268-A1275 WeakPolarHBondContact OD1-CB 3.34Å
1269	Y	43.8	Very low	44.2	Very low	196 Å²	196	70.3 Å²	70.3	77%	0.769	34%	0.34	S	S	*	.	H	α-helix	trans	-63.2	-23.1	175.4	-175.5	-94	0	0	0	113.1	A1265 L1266 M1267 N1271	A1265-Y1269 WeakPolarHBondContact O-CB 3.42Å; A1265-Y1269 PolarHBondContact O-N 3.33Å; L1266-Y1269 WeakPolarHBondContact O-CB 3.46Å; L1266-Y1269 PolarHBondContact O-N 3.01Å; M1267-Y1269 VanDerWaalsContact C-N 3.33Å; M1267-Y1269 PolarHBondContact O-N 2.99Å; Y1269-N1271 VanDerWaalsContact C-N 3.26Å; Y1269-N1271 PolarHBondContact O-N 3.3Å
1270	M	36.1	Very low	43.5	Very low	77 Å²	77	72.4 Å²	72.4	38%	0.379	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	15.5	176	-59.5	-104.5	-64.3	0	0	113.1	L1266 M1267 N1268 F1272 M1541	L1266-M1270 HydrophobicContact CG-CG 4.49Å; L1266-M1270 WeakPolarHBondContact O-CG 3.49Å; L1266-M1270 PolarHBondContact O-N 3.14Å; M1267-M1270 WeakPolarHBondContact O-CB 3.4Å; M1267-M1270 PolarHBondContact O-N 2.99Å; M1267-M1270 VanDerWaalsContact O-N 3.09Å; N1268-M1270 PolarHBondContact O-N 2.7Å; M1270-F1272 HydrophobicContact CB-CD2 3.85Å; M1270-F1272 HydrophobicContact CB-CE2 4.44Å; M1270-F1272 PolarHBondContact O-N 3.44Å; M1270-F1272 VanDerWaalsContact O-N 3.14Å; M1270-M1541 HydrophobicContact CE-CE 4.28Å; M1270-M1541 HydrophobicContact CE-SD 3.9Å; M1270-M1541 HydrophobicContact SD-CE 3.36Å; M1270-M1541 WeakPolarHBondContact SD-CE 3.37Å; M1270-M1541 HydrophobicContact SD-CG 4.37Å; M1270-M1541 HydrophobicContact SD-SD 3.43Å
1271	N	31.1	Very low	42.1	Very low	112 Å²	112	68 Å²	68	60%	0.599	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	15	-169.6	-84.5	-23.3	0	0	0	114.8	N1268 Y1269 Y1273	N1268-N1271 PolarHBondContact O-N 2.83Å; N1268-N1271 VanDerWaalsContact O-N 3.13Å; Y1269-N1271 VanDerWaalsContact C-N 3.26Å; Y1269-N1271 PolarHBondContact O-N 3.3Å; N1271-Y1273 HydrophobicContact CB-CE2 3.98Å; N1271-Y1273 WeakPolarHBondContact O-CD2 3.06Å; N1271-Y1273 PolarHBondContact O-N 3.21Å; N1271-Y1273 VanDerWaalsContact OD1-CE2 3.22Å; N1271-Y1273 WeakPolarHBondContact OD1-CE2 3.36Å; N1271-Y1273 PolarHBondContact OD1-OH 2.92Å
1272	F	35.3	Very low	41.1	Very low	120 Å²	120	70.7 Å²	70.7	53%	0.526	35%	0.35	S	S	.	.			trans	-79.7	77.6	165.3	-73.8	-97	0	0	0	109.4	M1267 N1268 M1270 Q1274 A1275	M1267-F1272 HydrophobicContact CB-CB 4.43Å; M1267-F1272 WeakPolarHBondContact O-CB 3.32Å; M1267-F1272 PolarHBondContact O-N 2.87Å; M1267-F1272 VanDerWaalsContact O-N 3.1Å; N1268-F1272 PolarHBondContact OD1-O 3.19Å; M1270-F1272 HydrophobicContact CB-CD2 3.85Å; M1270-F1272 HydrophobicContact CB-CE2 4.44Å; M1270-F1272 PolarHBondContact O-N 3.44Å; M1270-F1272 VanDerWaalsContact O-N 3.14Å; F1272-Q1274 PolarHBondContact O-N 2.63Å; F1272-A1275 PolarHBondContact O-N 3.49Å
1273	Y	39.2	Very low	40.2	Very low	128 Å²	128	73.4 Å²	73.4	50%	0.502	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	3.3	169.6	-64	-84.4	0	0	0	113.8	N1271 P1610	N1271-Y1273 HydrophobicContact CB-CE2 3.98Å; N1271-Y1273 WeakPolarHBondContact O-CD2 3.06Å; N1271-Y1273 PolarHBondContact O-N 3.21Å; N1271-Y1273 VanDerWaalsContact OD1-CE2 3.22Å; N1271-Y1273 WeakPolarHBondContact OD1-CE2 3.36Å; N1271-Y1273 PolarHBondContact OD1-OH 2.92Å; Y1273-P1610 VanDerWaalsContact O-CB 3.25Å; Y1273-P1610 WeakPolarHBondContact O-CB 3.46Å
1274	Q	43.4	Very low	39.7	Very low	85 Å²	85	72 Å²	72	40%	0.397	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	16.2	-175.5	-47.3	-167.5	-21.9	0	0	113.8	F1272 D1276 A1277 P1610 P1611	F1272-Q1274 PolarHBondContact O-N 2.63Å; Q1274-D1276 PolarHBondContact O-N 2.03Å; Q1274-A1277 WeakPolarHBondContact O-CB 3.34Å; Q1274-A1277 PolarHBondContact O-N 2.88Å; Q1274-P1610 HydrophobicContact CB-CB 4.02Å; Q1274-P1610 HydrophobicContact CG-CB 3.84Å; Q1274-P1611 HydrophobicContact CB-CG 4.38Å; Q1274-P1611 HydrophobicContact CG-CB 4.47Å
1275	A	34.5	Very low	39	Very low	8 Å²	8	75.7 Å²	75.7	7%	0.066	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-59.2	-26.9	-178.7	0	0	0	0	0	114.7	V1264 N1268 F1272 A1277 V1278	V1264-A1275 HydrophobicContact CG1-CB 4.09Å; N1268-A1275 VanDerWaalsContact OD1-CB 3.32Å; N1268-A1275 WeakPolarHBondContact OD1-CB 3.34Å; F1272-A1275 PolarHBondContact O-N 3.49Å; A1275-A1277 PolarHBondContact O-N 2.93Å; A1275-V1278 WeakPolarHBondContact O-CG2 3.46Å
1276	D	36.3	Very low	38.6	Very low	39 Å²	39	76 Å²	76	21%	0.209	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-69.2	-7.6	172.6	-85.2	-41.2	0	0	0	114.2	Y1249 Q1274 P1610	Y1249-D1276 PolarHBondContact OH-OD2 3.1Å; Q1274-D1276 PolarHBondContact O-N 2.03Å; D1276-P1610 HydrophobicContact CB-CG 4.4Å
1277	A	37.7	Very low	38.5	Very low	19 Å²	19	76.7 Å²	76.7	16%	0.157	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-118.1	18.4	-169.8	0	0	0	0	0	114.2	Q1274 A1275 H1279 L1280 P1611	Q1274-A1277 WeakPolarHBondContact O-CB 3.34Å; Q1274-A1277 PolarHBondContact O-N 2.88Å; A1275-A1277 PolarHBondContact O-N 2.93Å; A1277-H1279 PolarHBondContact O-N 3.07Å; A1277-L1280 HydrophobicContact CB-CD1 4.33Å; A1277-L1280 WeakPolarHBondContact O-CB 3.2Å; A1277-L1280 PolarHBondContact O-N 3.32Å; A1277-P1611 HydrophobicContact CB-CG 3.32Å
1278	V	36.4	Very low	38.2	Very low	13 Å²	13	78.2 Å²	78.2	8%	0.079	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-53.1	-22	179.5	167	0	0	0	0	113.4	I1259 A1275 L1280 L1281 L1286	I1259-V1278 HydrophobicContact CD1-CG1 3.8Å; I1259-V1278 HydrophobicContact CD1-CG2 4.49Å; A1275-V1278 WeakPolarHBondContact O-CG2 3.46Å; V1278-L1280 PolarHBondContact O-N 3.04Å; V1278-L1280 VanDerWaalsContact O-N 3.17Å; V1278-L1281 HydrophobicContact CG1-CD1 4.24Å; V1278-L1281 PolarHBondContact O-N 3.24Å; V1278-L1286 HydrophobicContact CG1-CD1 4.24Å
1279	H	34.9	Very low	37.8	Very low	108 Å²	108	79.4 Å²	79.4	50%	0.5	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-65.6	-9.7	174.5	-29.8	-51.7	0	0	0	114.8	R1256 A1277	R1256-H1279 PolarHBondContact O-CE1 3.49Å; A1277-H1279 PolarHBondContact O-N 3.07Å
1280	L	33.5	Very low	37.6	Very low	76 Å²	76	76.1 Å²	76.1	40%	0.398	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-91.9	-7.8	176.4	-81.5	155.3	0	0	0	113.6	A1277 V1278 P1611	A1277-L1280 HydrophobicContact CB-CD1 4.33Å; A1277-L1280 WeakPolarHBondContact O-CB 3.2Å; A1277-L1280 PolarHBondContact O-N 3.32Å; V1278-L1280 PolarHBondContact O-N 3.04Å; V1278-L1280 VanDerWaalsContact O-N 3.17Å; L1280-P1611 HydrophobicContact CD1-CG 4.12Å
1281	L	33.4	Very low	37.9	Very low	52 Å²	52	78.9 Å²	78.9	27%	0.272	39%	0.388	S	S	.	.	S	Bend	trans	-70.2	126.7	168.6	-69.7	163.2	0	0	0	109.1	V1278 L1285 L1286 L1289	V1278-L1281 HydrophobicContact CG1-CD1 4.24Å; V1278-L1281 PolarHBondContact O-N 3.24Å; L1281-L1285 HydrophobicContact CD2-CD2 3.85Å; L1281-L1286 HydrophobicContact CB-CB 4.42Å; L1281-L1286 HydrophobicContact CD1-CD1 4.17Å; L1281-L1289 HydrophobicContact CD1-CD1 4.13Å; L1281-L1289 HydrophobicContact CD2-CD1 4.02Å
1282	P	31.2	Very low	38.2	Very low	81 Å²	81	78.4 Å²	78.4	53%	0.526	39%	0.388	S	S	.	.			trans	-54.2	145.5	172.4	-25.2	33.2	0	0	0	110.9	Q1284 L1285 L1286	P1282-Q1284 PolarHBondContact O-N 2.85Å; P1282-Q1284 VanDerWaalsContact O-N 3.16Å; P1282-L1285 HydrophobicContact CB-CB 4.23Å; P1282-L1285 HydrophobicContact CG-CB 4.29Å; P1282-L1285 CarbonylContact O-C 3.48Å; P1282-L1285 WeakPolarHBondContact O-CA 3.28Å; P1282-L1285 PolarHBondContact O-N 2.97Å; P1282-L1286 PolarHBondContact O-N 2.8Å
1283	M	37.7	Very low	38.2	Very low	125 Å²	125	78.4 Å²	78.4	62%	0.616	39%	0.389	S	S	*	.	H	α-helix	trans	-53.6	-39.9	179.5	-100.4	-67.3	-68.5	0	0	112.3	L1285 L1286 E1287	M1283-L1285 PolarHBondContact O-N 3Å; M1283-L1286 PolarHBondContact O-N 2.84Å; M1283-L1286 HydrophobicContact SD-CD2 4.37Å; M1283-E1287 HydrophobicContact CE-CG 4.25Å; M1283-E1287 WeakPolarHBondContact O-CB 3.47Å; M1283-E1287 WeakPolarHBondContact O-CG 3.24Å; M1283-E1287 PolarHBondContact O-N 2.9Å
1284	Q	40.1	Very low	37.9	Very low	83 Å²	83	76.5 Å²	76.5	39%	0.388	39%	0.394	S	S	.	.	H	α-helix	trans	-65.9	-32.3	173	-77.2	179.5	-44.5	0	0	113.9	P1282 N1288	P1282-Q1284 PolarHBondContact O-N 2.85Å; P1282-Q1284 VanDerWaalsContact O-N 3.16Å; Q1284-N1288 WeakPolarHBondContact O-CB 3.36Å; Q1284-N1288 PolarHBondContact O-N 3.42Å; Q1284-N1288 PolarHBondContact O-ND2 3.28Å
1285	L	41.1	Very low	37.2	Very low	85 Å²	85	76 Å²	76	45%	0.445	40%	0.4	S	S	.	.	H	α-helix	trans	-76.8	-33.8	174.2	-148.2	77.2	0	0	0	111.4	L1281 P1282 M1283 N1288 L1289	L1281-L1285 HydrophobicContact CD2-CD2 3.85Å; P1282-L1285 HydrophobicContact CB-CB 4.23Å; P1282-L1285 HydrophobicContact CG-CB 4.29Å; P1282-L1285 CarbonylContact O-C 3.48Å; P1282-L1285 WeakPolarHBondContact O-CA 3.28Å; P1282-L1285 PolarHBondContact O-N 2.97Å; M1283-L1285 PolarHBondContact O-N 3Å; L1285-N1288 PolarHBondContact O-N 3.09Å; L1285-L1289 VanDerWaalsContact O-CB 3.24Å; L1285-L1289 WeakPolarHBondContact O-CB 3.43Å; L1285-L1289 WeakPolarHBondContact O-CD1 3.29Å; L1285-L1289 WeakPolarHBondContact O-CG 3.43Å; L1285-L1289 PolarHBondContact O-N 3.38Å
1286	L	41.7	Very low	36.9	Very low	36 Å²	36	80.4 Å²	80.4	19%	0.188	43%	0.427	C	S	.	.	H	α-helix	trans	-69.3	-34.7	172.8	-170.3	66.4	0	0	0	111.6	V1278 L1281 P1282 M1283 K1290	V1278-L1286 HydrophobicContact CG1-CD1 4.24Å; L1281-L1286 HydrophobicContact CB-CB 4.42Å; L1281-L1286 HydrophobicContact CD1-CD1 4.17Å; P1282-L1286 PolarHBondContact O-N 2.8Å; M1283-L1286 PolarHBondContact O-N 2.84Å; M1283-L1286 HydrophobicContact SD-CD2 4.37Å; L1286-K1290 VanDerWaalsContact O-CB 3.27Å; L1286-K1290 WeakPolarHBondContact O-CB 3.43Å; L1286-K1290 VanDerWaalsContact O-CG 3.3Å; L1286-K1290 WeakPolarHBondContact O-CG 3.39Å; L1286-K1290 PolarHBondContact O-N 3.24Å
1287	E	45.7	Very low	36.4	Very low	91 Å²	91	85.7 Å²	85.7	43%	0.425	46%	0.456	S	S	.	.	H	α-helix	trans	-73.6	-37.6	171.1	-77.6	-170.9	163.8	0	0	112.8	M1283 K1290 K1291	M1283-E1287 HydrophobicContact CE-CG 4.25Å; M1283-E1287 WeakPolarHBondContact O-CB 3.47Å; M1283-E1287 WeakPolarHBondContact O-CG 3.24Å; M1283-E1287 PolarHBondContact O-N 2.9Å; E1287-K1290 CarbonylContact O-C 3.09Å; E1287-K1290 PolarHBondContact O-N 2.75Å; E1287-K1291 WeakPolarHBondContact O-CB 3.31Å; E1287-K1291 WeakPolarHBondContact O-CG 3.44Å; E1287-K1291 PolarHBondContact O-N 3.47Å
1288	N	41.3	Very low	36	Very low	81 Å²	81	93.5 Å²	93.5	43%	0.433	49%	0.489	S	S	.	.	H	α-helix	trans	-70.2	-38.4	174.1	-74.7	-23.5	0	0	0	111.4	Q1284 L1285 K1291 V1292	Q1284-N1288 WeakPolarHBondContact O-CB 3.36Å; Q1284-N1288 PolarHBondContact O-N 3.42Å; Q1284-N1288 PolarHBondContact O-ND2 3.28Å; L1285-N1288 PolarHBondContact O-N 3.09Å; N1288-K1291 PolarHBondContact O-N 2.87Å; N1288-V1292 WeakPolarHBondContact O-CB 3.43Å; N1288-V1292 VanDerWaalsContact O-CG2 3.26Å; N1288-V1292 WeakPolarHBondContact O-CG2 3.28Å; N1288-V1292 PolarHBondContact O-N 3.31Å
1289	L	40.6	Very low	35.4	Very low	52 Å²	52	101.6 Å²	101.6	27%	0.272	52%	0.519	S	S	.	.	H	α-helix	trans	-67.4	-38.9	170.1	-71.1	167.6	0	0	0	111.2	L1281 L1285 V1292 F1293	L1281-L1289 HydrophobicContact CD1-CD1 4.13Å; L1281-L1289 HydrophobicContact CD2-CD1 4.02Å; L1285-L1289 VanDerWaalsContact O-CB 3.24Å; L1285-L1289 WeakPolarHBondContact O-CB 3.43Å; L1285-L1289 WeakPolarHBondContact O-CD1 3.29Å; L1285-L1289 WeakPolarHBondContact O-CG 3.43Å; L1285-L1289 PolarHBondContact O-N 3.38Å; L1289-V1292 PolarHBondContact O-N 3.43Å; L1289-F1293 HydrophobicContact CB-CD2 4.2Å; L1289-F1293 HydrophobicContact CB-CE2 4.16Å; L1289-F1293 HydrophobicContact CD2-CE2 3.84Å; L1289-F1293 HydrophobicContact CD2-CZ 4.33Å; L1289-F1293 WeakPolarHBondContact O-CB 3.47Å; L1289-F1293 WeakPolarHBondContact O-CD2 3.44Å; L1289-F1293 WeakPolarHBondContact O-CG 3.38Å; L1289-F1293 PolarHBondContact O-N 2.7Å
1290	K	39.3	Very low	34.9	Very low	127 Å²	127	107.7 Å²	107.7	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-59.5	-44.5	169.1	-86.3	177.3	175.8	176.5	0	111.5	L1286 E1287 F1293 S1294	L1286-K1290 VanDerWaalsContact O-CB 3.27Å; L1286-K1290 WeakPolarHBondContact O-CB 3.43Å; L1286-K1290 VanDerWaalsContact O-CG 3.3Å; L1286-K1290 WeakPolarHBondContact O-CG 3.39Å; L1286-K1290 PolarHBondContact O-N 3.24Å; E1287-K1290 CarbonylContact O-C 3.09Å; E1287-K1290 PolarHBondContact O-N 2.75Å; K1290-F1293 PolarHBondContact O-N 3.11Å; K1290-S1294 WeakPolarHBondContact O-CA 3.06Å; K1290-S1294 WeakPolarHBondContact O-CB 3.49Å; K1290-S1294 PolarHBondContact O-N 3.27Å; K1290-S1294 PolarHBondContact O-OG 2.94Å
1291	K	41	Very low	34.4	Very low	136 Å²	136	108.9 Å²	108.9	59%	0.591	55%	0.553	S	S	*	*	H	α-helix	trans	-59.6	-55.7	175.1	-78.1	171.6	178.5	170.9	0	110.3	E1287 N1288 F1293 S1294 S1295	E1287-K1291 WeakPolarHBondContact O-CB 3.31Å; E1287-K1291 WeakPolarHBondContact O-CG 3.44Å; E1287-K1291 PolarHBondContact O-N 3.47Å; N1288-K1291 PolarHBondContact O-N 2.87Å; K1291-F1293 VanDerWaalsContact C-N 3.29Å; K1291-F1293 PolarHBondContact O-N 2.84Å; K1291-S1294 PolarHBondContact O-N 3.27Å; K1291-S1294 VanDerWaalsContact O-N 3.08Å; K1291-S1295 WeakPolarHBondContact O-CB 3.14Å; K1291-S1295 PolarHBondContact O-N 3.23Å; K1291-S1295 PolarHBondContact O-OG 2.87Å
1292	V	38.6	Very low	34.1	Very low	101 Å²	101	112.9 Å²	112.9	61%	0.612	57%	0.573	S	S	*	*	H	α-helix	trans	-56.6	-36.6	179.3	167.8	0	0	0	0	113.3	N1288 L1289	N1288-V1292 WeakPolarHBondContact O-CB 3.43Å; N1288-V1292 VanDerWaalsContact O-CG2 3.26Å; N1288-V1292 WeakPolarHBondContact O-CG2 3.28Å; N1288-V1292 PolarHBondContact O-N 3.31Å; L1289-V1292 PolarHBondContact O-N 3.43Å
1293	F	34.1	Very low	33.7	Very low	121 Å²	121	118.5 Å²	118.5	53%	0.531	59%	0.59	S	S	.	*	H	α-helix	trans	-93	-7.6	178	-62.8	-50.3	0	0	0	114.9	L1289 K1290 K1291	L1289-F1293 HydrophobicContact CB-CD2 4.2Å; L1289-F1293 HydrophobicContact CB-CE2 4.16Å; L1289-F1293 HydrophobicContact CD2-CE2 3.84Å; L1289-F1293 HydrophobicContact CD2-CZ 4.33Å; L1289-F1293 WeakPolarHBondContact O-CB 3.47Å; L1289-F1293 WeakPolarHBondContact O-CD2 3.44Å; L1289-F1293 WeakPolarHBondContact O-CG 3.38Å; L1289-F1293 PolarHBondContact O-N 2.7Å; K1290-F1293 PolarHBondContact O-N 3.11Å; K1291-F1293 VanDerWaalsContact C-N 3.29Å; K1291-F1293 PolarHBondContact O-N 2.84Å
1294	S	33.7	Very low	33.1	Very low	88 Å²	88	120.7 Å²	120.7	62%	0.615	60%	0.598	S	S	*	*	H	α-helix	trans	-115.3	-2.5	179.4	-45.6	0	0	0	0	114	K1290 K1291 P1296	K1290-S1294 WeakPolarHBondContact O-CA 3.06Å; K1290-S1294 WeakPolarHBondContact O-CB 3.49Å; K1290-S1294 PolarHBondContact O-N 3.27Å; K1290-S1294 PolarHBondContact O-OG 2.94Å; K1291-S1294 PolarHBondContact O-N 3.27Å; K1291-S1294 VanDerWaalsContact O-N 3.08Å; S1294-P1296 VanDerWaalsContact C-CD 3.47Å; S1294-P1296 WeakPolarHBondContact O-CD 3.31Å
1295	S	29.1	Very low	32.4	Very low	75 Å²	75	123.9 Å²	123.9	52%	0.524	62%	0.617	S	S	.	*			trans	-99.5	86	172.1	64.8	0	0	0	0	111.3	K1291	K1291-S1295 WeakPolarHBondContact O-CB 3.14Å; K1291-S1295 PolarHBondContact O-N 3.23Å; K1291-S1295 PolarHBondContact O-OG 2.87Å
1296	P	26.9	Very low	31.6	Very low	99 Å²	99	125 Å²	125	64%	0.643	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	153.6	165.5	29.6	-34.7	0	0	0	110.4	S1294	S1294-P1296 VanDerWaalsContact C-CD 3.47Å; S1294-P1296 WeakPolarHBondContact O-CD 3.31Å
1297	N	27.4	Very low	30.9	Very low	151 Å²	151	128.7 Å²	128.7	81%	0.807	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.3	21.3	163.5	-47.2	-24.9	0	0	0	119.7
1298	H	28.1	Very low	29.9	Very low	182 Å²	182	133.3 Å²	133.3	84%	0.843	68%	0.68	S	S	*	*			trans	-128	73.4	167.6	-91.7	70.4	0	0	0	114
1299	Y	24.7	Very low	29.1	Very low	184 Å²	184	133.8 Å²	133.8	72%	0.722	70%	0.695	S	S	*	*			trans	-88.4	170	148.6	-117.4	-111.1	0	0	0	109	Y1542	Y1299-Y1542 WeakPolarHBondContact CD2-OH 3.45Å; Y1299-Y1542 AromaticContact CE2-CE2 3.91Å; Y1299-Y1542 HydrophobicContact CE2-CE2 3.91Å; Y1299-Y1542 AromaticContact CE2-CZ 4Å; Y1299-Y1542 WeakPolarHBondContact CE2-OH 3.48Å
1300	R	24.1	Very low	28.4	Very low	235 Å²	235	136.2 Å²	136.2	89%	0.887	72%	0.717	S	S	*	*			trans	74.2	90.8	156.2	-163.4	-168.5	-149.6	170.5	6	117.3
1301	S	23.6	Very low	27.7	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	72%	0.722	S	S	*	*				170.6	163.5	111	58.1	0	0	0	0	112.9
1302	L	25.7	Very low	27.2	Very low	135 Å²	135	136.9 Å²	136.9	71%	0.707	73%	0.734	S	S	*	*			trans	59.8	120.5	163.5	-55.2	161.2	0	0	0	117.1	H1304	L1302-H1304 HydrophobicContact CD2-CB 4.44Å
1303	F	24.2	Very low	26.8	Very low	200 Å²	200	137.1 Å²	137.1	88%	0.877	74%	0.738	S	S	*	*			cis	53.6	75.4	4.7	-86.8	-73.4	0	0	0	115.6
1304	H	25.2	Very low	26.5	Very low	170 Å²	170	138.7 Å²	138.7	79%	0.787	75%	0.748	S	S	*	*			trans	-146.4	158.9	145.5	-118.3	-89.2	0	0	0	110.4	L1302	L1302-H1304 HydrophobicContact CD2-CB 4.44Å
1305	L	25.4	Very low	26.1	Very low	151 Å²	151	141.1 Å²	141.1	79%	0.791	76%	0.755	S	S	*	*			trans	-105	159.7	-171.8	-64.1	85.9	0	0	0	112.4
1306	S	24.3	Very low	26	Very low	109 Å²	109	142.9 Å²	142.9	76%	0.762	77%	0.767	S	S	*	*			trans	-19	155.4	141	-167.2	0	0	0	0	116.6
1307	P	26.8	Very low	25.9	Very low	112 Å²	112	147 Å²	147	73%	0.727	78%	0.777	S	S	*	*			cis	-127.8	-164.1	1.6	38.8	-20.6	0	0	0	113.8
1308	E	23.4	Very low	25.9	Very low	188 Å²	188	145.5 Å²	145.5	88%	0.879	78%	0.779	S	S	*	*			trans	-65.3	133.3	164.8	-59.9	150	107.7	0	0	112.8
1309	A	25.6	Very low	25.7	Very low	91 Å²	91	142.4 Å²	142.4	75%	0.752	77%	0.773	S	S	*	*			trans	-168	127	153.8	0	0	0	0	0	113.1
1310	S	25.2	Very low	25.8	Very low	104 Å²	104	143.5 Å²	143.5	73%	0.727	78%	0.782	S	S	*	*			trans	30.7	102.5	152.1	60.6	0	0	0	0	121.6
1311	S	25.8	Very low	25.9	Very low	95 Å²	95	141 Å²	141	66%	0.664	78%	0.777	S	S	*	*				23.1	111.4	125.3	59.5	0	0	0	0	121.1
1312	H	29.3	Very low	26.1	Very low	182 Å²	182	140.3 Å²	140.3	84%	0.843	78%	0.777	S	S	*	*				173	161.3	104.4	-99.1	-77.5	0	0	0	112.3
1313	P	30.9	Very low	26.2	Very low	106 Å²	106	139.6 Å²	139.6	69%	0.688	78%	0.775	S	S	*	*			trans	-112.9	178	-170.2	40.8	-32	0	0	0	116.3
1314	M	27	Very low	26.3	Very low	153 Å²	153	136.8 Å²	136.8	75%	0.754	76%	0.764	S	S	*	*			trans	99.4	128.5	161.8	-55.4	-160.3	83.5	0	0	119.3
1315	N	26.1	Very low	26.4	Very low	140 Å²	140	136.2 Å²	136.2	75%	0.749	76%	0.762	S	S	*	*			trans	67.5	150.8	144.8	-62.6	0.6	0	0	0	118.5
1316	S	26.7	Very low	26.4	Very low	111 Å²	111	134.2 Å²	134.2	78%	0.776	76%	0.755	S	S	*	*			cis	-153.6	177.7	-5.8	40.1	0	0	0	0	110.8
1317	E	24.7	Very low	26.7	Very low	185 Å²	185	136.2 Å²	136.2	86%	0.864	76%	0.757	S	S	*	*			trans	-59.4	151.4	178.6	-56	161.6	103.7	0	0	114.1
1318	S	26.6	Very low	26.5	Very low	120 Å²	120	135.3 Å²	135.3	84%	0.839	75%	0.754	S	S	*	*				-174.4	148.2	113.5	37.4	0	0	0	0	113.1
1319	T	25.4	Very low	26.5	Very low	117 Å²	117	134.7 Å²	134.7	72%	0.718	75%	0.749	S	S	*	*			trans	-68.6	155.3	172.5	54	0	0	0	0	112.3
1320	F	26.6	Very low	26.5	Very low	208 Å²	208	138.8 Å²	138.8	91%	0.912	75%	0.75	S	S	*	*				-146.6	150.1	124.3	-122.6	-80	0	0	0	114
1321	K	26.7	Very low	26.3	Very low	182 Å²	182	140 Å²	140	79%	0.791	75%	0.753	S	S	*	*			trans	-98.7	141.1	-169.2	-80.1	173.5	173.8	171	0	113
1322	A	27.1	Very low	26.4	Very low	87 Å²	87	140.5 Å²	140.5	72%	0.719	75%	0.747	S	S	*	*			trans	70.2	-179.7	136	0	0	0	0	0	116.3
1323	N	26.8	Very low	26.4	Very low	121 Å²	121	137 Å²	137	65%	0.647	73%	0.731	S	S	*	*			cis	-159.2	154	17.2	-149.5	2.3	0	0	0	114.6
1324	H	27.4	Very low	26	Very low	141 Å²	141	136.9 Å²	136.9	65%	0.653	73%	0.733	S	S	*	*			trans	61	164.9	157	-68.5	-30	0	0	0	118.5
1325	Q	26.1	Very low	25.9	Very low	158 Å²	158	136.9 Å²	136.9	74%	0.738	73%	0.731	S	S	*	*			cis	-145.6	132.4	-2.7	-130.9	149	3.1	0	0	111.8
1326	V	26.1	Very low	25.8	Very low	109 Å²	109	138.5 Å²	138.5	66%	0.661	73%	0.731	S	S	*	*				46.5	113.5	126.7	-178.8	0	0	0	0	120.1
1327	N	29.8	Very low	25.7	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	73%	0.733	S	S	*	*				-165.9	98.3	119	-99.3	-24.6	0	0	0	113.7
1328	S	24.4	Very low	25.7	Very low	94 Å²	94	138.3 Å²	138.3	66%	0.657	73%	0.727	S	S	*	*				24.6	137	108.7	-176.6	0	0	0	0	119
1329	F	22.9	Very low	25.6	Very low	174 Å²	174	142.1 Å²	142.1	76%	0.763	73%	0.732	S	S	*	*			cis	-170.7	131.5	-11.7	-128.1	-88.9	0	0	0	109
1330	K	24.4	Very low	25.5	Very low	178 Å²	178	142.2 Å²	142.2	77%	0.774	72%	0.724	S	S	*	*			trans	59.2	153.1	162.9	-76.5	175.9	178.4	-176.3	0	120.7
1331	T	22.8	Very low	25.3	Very low	129 Å²	129	142 Å²	142	79%	0.791	72%	0.717	S	S	*	*			trans	66.3	148.5	174.4	32.7	0	0	0	0	117.1
1332	L	26.9	Very low	25.1	Very low	105 Å²	105	139.3 Å²	139.3	55%	0.55	72%	0.716	S	S	.	*			trans	66.8	109	-173	-67.3	61.8	0	0	0	113.9	Y1352 T1353	L1332-Y1352 WeakPolarHBondContact CD2-O 3.33Å; L1332-Y1352 VanDerWaalsContact CG-O 3.25Å; L1332-Y1352 WeakPolarHBondContact CG-O 3.4Å; L1332-T1353 WeakPolarHBondContact CD2-OG1 3.34Å
1333	Q	28.9	Very low	24.8	Very low	110 Å²	110	141.1 Å²	141.1	51%	0.514	71%	0.708	S	S	.	*			cis	87	73	1.1	-76.2	-90.5	100	0	0	119.9	L1349 E1350 E1351 Y1352	Q1333-L1349 PolarHBondContact NE2-O 3.2Å; Q1333-E1350 PolarHBondContact NE2-O 3.49Å; Q1333-E1351 WeakPolarHBondContact CB-O 3.1Å; Q1333-E1351 CarbonylContact O-C 3.48Å; Q1333-Y1352 PolarHBondContact O-N 2.86Å
1334	S	22.6	Very low	24.5	Very low	102 Å²	102	143.2 Å²	143.2	71%	0.713	72%	0.718	S	S	*	*			trans	-162.9	144	135.2	56.2	0	0	0	0	116.5
1335	Q	25.4	Very low	24.3	Very low	153 Å²	153	141.7 Å²	141.7	72%	0.715	72%	0.719	S	S	*	*			trans	-3.6	152.3	157.6	-68.7	-178.5	19.6	0	0	120.2
1336	K	24	Very low	24.2	Very low	175 Å²	175	139.4 Å²	139.4	76%	0.761	72%	0.716	S	S	*	*			cis	-165.7	152	20.9	-122	156.3	179.3	151.4	0	106.2
1337	T	23.8	Very low	24.1	Very low	131 Å²	131	140.8 Å²	140.8	80%	0.804	72%	0.72	S	S	*	*			cis	-136.9	-146.6	9	51.1	0	0	0	0	109.9
1338	Q	25.9	Very low	23.8	Very low	160 Å²	160	139.4 Å²	139.4	75%	0.748	71%	0.712	S	S	*	*			trans	-126	158.3	-177.5	-62	175.9	-56.2	0	0	113.6
1339	Q	24	Very low	23.9	Very low	201 Å²	201	140.6 Å²	140.6	94%	0.939	71%	0.711	S	S	*	*				-147	63.7	124.1	-116.6	172.5	17	0	0	110.7
1340	E	22.8	Very low	24.2	Very low	119 Å²	119	138.8 Å²	138.8	56%	0.556	70%	0.704	S	S	*	*			trans	-89.7	141.1	178	-79.2	-151.7	118.4	0	0	111.5
1341	R	22.4	Very low	24.4	Very low	202 Å²	202	136.6 Å²	136.6	76%	0.762	70%	0.697	S	S	*	*				65.7	142.8	63.2	-56.8	-175.8	-160.3	148	-8.4	113.9
1342	V	22.6	Very low	24.6	Very low	127 Å²	127	136.8 Å²	136.8	77%	0.77	68%	0.684	S	S	*	*			trans	72.4	143.3	147.5	163.5	0	0	0	0	118.6
1343	F	20.4	Very low	24.6	Very low	125 Å²	125	134.6 Å²	134.6	55%	0.548	68%	0.675	S	S	.	*			trans	-79.3	139.5	167.1	-56.8	-102.3	0	0	0	109.2	Y1542	F1343-Y1542 WeakPolarHBondContact CE1-O 3.25Å
1344	L	22	Very low	24.4	Very low	164 Å²	164	136.8 Å²	136.8	86%	0.859	69%	0.691	S	S	*	*			trans	-171.7	168	140.5	-105	159.3	0	0	0	112.7
1345	T	22.8	Very low	24.5	Very low	109 Å²	109	135.3 Å²	135.3	67%	0.669	69%	0.691	S	S	*	*			trans	-85.8	148.6	-171.6	49.2	0	0	0	0	113.3
1346	T	22.8	Very low	24.6	Very low	111 Å²	111	133.7 Å²	133.7	68%	0.681	69%	0.692	S	S	*	*			trans	43.1	115.2	142.3	59.2	0	0	0	0	120.2
1347	N	24.2	Very low	24.6	Very low	138 Å²	138	132.7 Å²	132.7	74%	0.738	69%	0.693	S	S	*	*			trans	72.1	153.4	141.4	-60.7	62.6	0	0	0	117.3
1348	D	25.1	Very low	24.8	Very low	121 Å²	121	131.2 Å²	131.2	65%	0.647	69%	0.688	S	S	*	*			cis	-156.7	171.9	-6.6	-123.9	-29.5	0	0	0	114.7
1349	L	26	Very low	24.8	Very low	119 Å²	119	128.8 Å²	128.8	62%	0.623	69%	0.689	S	S	*	*			trans	32.5	137.9	144.4	-138.8	71.7	0	0	0	123.9	Q1333	Q1333-L1349 PolarHBondContact NE2-O 3.2Å
1350	E	27.9	Very low	24.9	Very low	135 Å²	135	125 Å²	125	63%	0.631	68%	0.68	S	S	*	*			trans	63.8	124.2	147.3	-83.3	153.2	-149.7	0	0	125	Q1333	Q1333-E1350 PolarHBondContact NE2-O 3.49Å
1351	E	30.3	Very low	24.9	Very low	132 Å²	132	123.6 Å²	123.6	62%	0.617	68%	0.682	S	S	*	*			trans	44	152.5	134.2	-61.2	-160.6	125.4	0	0	123.6	Q1333	Q1333-E1351 WeakPolarHBondContact CB-O 3.1Å; Q1333-E1351 CarbonylContact O-C 3.48Å
1352	Y	26.7	Very low	25	Very low	134 Å²	134	119.2 Å²	119.2	53%	0.525	67%	0.674	S	S	.	*			cis	-159.7	175.8	24.8	-155	-141.1	0	0	0	113.7	L1332 Q1333	L1332-Y1352 WeakPolarHBondContact CD2-O 3.33Å; L1332-Y1352 VanDerWaalsContact CG-O 3.25Å; L1332-Y1352 WeakPolarHBondContact CG-O 3.4Å; Q1333-Y1352 PolarHBondContact O-N 2.86Å
1353	T	26.4	Very low	25.1	Very low	59 Å²	59	121.1 Å²	121.1	36%	0.362	67%	0.672	S	S	.	*			trans	48.5	137.5	151.4	39.9	0	0	0	0	126.5	L1332	L1332-T1353 WeakPolarHBondContact CD2-OG1 3.34Å
1354	D	24.7	Very low	25.4	Very low	156 Å²	156	120.1 Å²	120.1	83%	0.834	68%	0.681	S	S	*	*			trans	64.2	147.1	137.2	-57	-16.6	0	0	0	122.8
1355	G	24.9	Very low	25.7	Very low	70 Å²	70	118.4 Å²	118.4	72%	0.722	68%	0.677	S	S	*	*			trans	162.3	-4.9	-179.9	0	0	0	0	0	119
1356	T	26.6	Very low	26.1	Very low	120 Å²	120	120.6 Å²	120.6	74%	0.736	68%	0.68	S	S	*	*			trans	24.3	141.7	151.6	4.7	0	0	0	0	123
1357	I	25.5	Very low	26.2	Very low	153 Å²	153	121.6 Å²	121.6	79%	0.785	68%	0.681	S	S	*	*			trans	81.3	114.5	157.5	-57.1	152.8	0	0	0	114.7
1358	S	26.1	Very low	26.3	Very low	100 Å²	100	124 Å²	124	70%	0.699	69%	0.685	S	S	*	*				-158.9	134.3	64.8	17.4	0	0	0	0	115.1
1359	S	26.1	Very low	26.3	Very low	109 Å²	109	125.6 Å²	125.6	76%	0.762	69%	0.687	S	S	*	*			trans	39	124.1	145.6	63	0	0	0	0	119.5
1360	V	25.9	Very low	26.5	Very low	123 Å²	123	128 Å²	128	75%	0.745	70%	0.7	S	S	*	*			cis	-150.5	120.8	27.8	179.9	0	0	0	0	109.6
1361	S	23.1	Very low	26.5	Very low	88 Å²	88	128.7 Å²	128.7	62%	0.615	70%	0.704	S	S	*	*				31.9	151.9	111.7	116.7	0	0	0	0	120.3
1362	D	24.9	Very low	26.3	Very low	110 Å²	110	128.2 Å²	128.2	59%	0.588	70%	0.701	S	S	*	*			cis	-149.5	147.6	7.9	-109	-44.3	0	0	0	114
1363	K	25.8	Very low	26.4	Very low	167 Å²	167	129.2 Å²	129.2	73%	0.726	72%	0.716	S	S	*	*			trans	26.8	155.5	140.5	-61.7	175.3	-168.7	85.4	0	123.1
1364	S	25.8	Very low	26.6	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	72%	0.722	S	S	*	*			trans	64.2	122.6	151.4	61.4	0	0	0	0	116.4
1365	T	29.3	Very low	26.7	Very low	128 Å²	128	126.9 Å²	126.9	79%	0.785	70%	0.704	S	S	*	*			cis	-140.5	141.2	31.9	32.8	0	0	0	0	108.7
1366	Q	29.3	Very low	26.9	Very low	155 Å²	155	129 Å²	129	72%	0.724	70%	0.702	S	S	*	*			cis	73.5	113.8	39.2	-166.3	165.8	-8.8	0	0	113
1367	D	26.3	Very low	27.1	Very low	132 Å²	132	126.6 Å²	126.6	71%	0.706	69%	0.69	S	S	*	*			trans	68.1	160.2	-179.8	-50.1	-37.3	0	0	0	116.5
1368	F	24.7	Very low	27.4	Very low	188 Å²	188	125 Å²	125	83%	0.825	68%	0.68	S	S	*	*	S	Bend	trans	74.2	131.2	-166.9	-64.9	-90.3	0	0	0	117.6	N1370	F1368-N1370 PolarHBondContact O-N 3.47Å
1369	F	27.1	Very low	27.7	Very low	156 Å²	156	123.8 Å²	123.8	68%	0.684	67%	0.665	S	S	*	*	S	Bend	trans	69.9	11	176.6	-61.3	-69.8	0	0	0	119.9	E1371	F1369-E1371 PolarHBondContact O-N 2.97Å
1370	N	28.2	Very low	28	Very low	169 Å²	169	124.9 Å²	124.9	90%	0.904	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	20.4	169.5	-130.4	13.1	0	0	0	114.5	F1368	F1368-N1370 PolarHBondContact O-N 3.47Å
1371	E	28.1	Very low	28.4	Very low	150 Å²	150	123.9 Å²	123.9	70%	0.701	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.7	-9.1	-165.2	-155	173.4	-145.5	0	0	115.4	F1369 L1375	F1369-E1371 PolarHBondContact O-N 2.97Å; E1371-L1375 HydrophobicContact CG-CD1 4.31Å; E1371-L1375 WeakPolarHBondContact O-CB 3.39Å; E1371-L1375 VanDerWaalsContact O-CD1 3.26Å; E1371-L1375 WeakPolarHBondContact O-CD1 3.43Å
1372	Q	27.2	Very low	29.1	Very low	121 Å²	121	125.5 Å²	125.5	57%	0.565	64%	0.644	S	S	*	*	S	Bend	trans	-96.6	-33	-170.8	-98.9	-177.9	-6.3	0	0	116.4
1373	N	27.7	Very low	29.6	Very low	156 Å²	156	127.7 Å²	127.7	83%	0.834	65%	0.645	S	S	*	*	S	Bend	trans	-96.5	-10.2	-168.7	-69.6	-27.6	0	0	0	115.1
1374	T	30.5	Very low	30.2	Very low	79 Å²	79	124.2 Å²	124.2	49%	0.485	63%	0.633	S	S	.	*	S	Bend	trans	-80.9	-23	162.1	44.5	0	0	0	0	111.9	V1376 S1377 E1378	T1374-V1376 PolarHBondContact O-N 3.49Å; T1374-S1377 PolarHBondContact O-N 2.88Å; T1374-E1378 PolarHBondContact O-N 3.45Å
1375	L	27.8	Very low	30.6	Very low	87 Å²	87	125.2 Å²	125.2	46%	0.455	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.7	11.3	-164.1	-144.6	123.6	0	0	0	115.1	E1371 N1379	E1371-L1375 HydrophobicContact CG-CD1 4.31Å; E1371-L1375 WeakPolarHBondContact O-CB 3.39Å; E1371-L1375 VanDerWaalsContact O-CD1 3.26Å; E1371-L1375 WeakPolarHBondContact O-CD1 3.43Å; L1375-N1379 VanDerWaalsContact CD2-ND2 3.33Å; L1375-N1379 WeakPolarHBondContact CD2-ND2 3.36Å; L1375-N1379 WeakPolarHBondContact CG-ND2 3.11Å; L1375-N1379 WeakPolarHBondContact O-CB 3.34Å; L1375-N1379 PolarHBondContact O-ND2 3.3Å
1376	V	29.1	Very low	31	Very low	114 Å²	114	123.9 Å²	123.9	69%	0.691	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.4	-23.6	178.3	-175.2	0	0	0	0	112.8	T1374 F1380	T1374-V1376 PolarHBondContact O-N 3.49Å; V1376-F1380 WeakPolarHBondContact O-CB 3.48Å
1377	S	30	Very low	31.2	Very low	69 Å²	69	119.9 Å²	119.9	48%	0.483	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.5	-57.1	176.1	50.8	0	0	0	0	111.4	T1374 F1380 I1381	T1374-S1377 PolarHBondContact O-N 2.88Å; S1377-F1380 PolarHBondContact O-N 2.87Å; S1377-I1381 PolarHBondContact O-N 3.43Å; S1377-I1381 VanDerWaalsContact O-N 3.09Å
1378	E	31.5	Very low	31.6	Very low	121 Å²	121	117.2 Å²	117.2	57%	0.565	58%	0.584	S	S	*	*	H	α-helix	trans	-67.5	-39.7	177.7	-64.3	-160.4	110.8	0	0	111.2	T1374 F1380 I1381 Q1382	T1374-E1378 PolarHBondContact O-N 3.45Å; E1378-F1380 VanDerWaalsContact C-N 3.28Å; E1378-F1380 PolarHBondContact O-N 2.93Å; E1378-I1381 PolarHBondContact O-N 3.39Å; E1378-Q1382 WeakPolarHBondContact O-CB 3.19Å; E1378-Q1382 WeakPolarHBondContact O-CG 3.31Å; E1378-Q1382 PolarHBondContact O-N 3.06Å
1379	N	32.9	Very low	32.1	Very low	73 Å²	73	114.7 Å²	114.7	39%	0.39	58%	0.575	S	S	.	*	H	α-helix	trans	-66.9	-27.4	176.6	-122.1	12	0	0	0	112.6	L1375 Y1383	L1375-N1379 VanDerWaalsContact CD2-ND2 3.33Å; L1375-N1379 WeakPolarHBondContact CD2-ND2 3.36Å; L1375-N1379 WeakPolarHBondContact CG-ND2 3.11Å; L1375-N1379 WeakPolarHBondContact O-CB 3.34Å; L1375-N1379 PolarHBondContact O-ND2 3.3Å; N1379-Y1383 WeakPolarHBondContact O-CB 3.05Å; N1379-Y1383 PolarHBondContact O-N 3.15Å
1380	F	32.3	Very low	32.3	Very low	132 Å²	132	113.1 Å²	113.1	58%	0.579	57%	0.57	S	S	*	*	H	α-helix	trans	-77	-38.6	174.1	-167.5	-105.8	0	0	0	111.2	V1376 S1377 E1378 Y1383 I1384	V1376-F1380 WeakPolarHBondContact O-CB 3.48Å; S1377-F1380 PolarHBondContact O-N 2.87Å; E1378-F1380 VanDerWaalsContact C-N 3.28Å; E1378-F1380 PolarHBondContact O-N 2.93Å; F1380-Y1383 PolarHBondContact O-N 3.27Å; F1380-I1384 HydrophobicContact CD1-CD1 3.73Å; F1380-I1384 HydrophobicContact CE1-CD1 3.64Å; F1380-I1384 HydrophobicContact CG-CD1 4.41Å; F1380-I1384 HydrophobicContact CZ-CD1 4.25Å; F1380-I1384 WeakPolarHBondContact O-CB 3.27Å; F1380-I1384 WeakPolarHBondContact O-CD1 3.23Å; F1380-I1384 VanDerWaalsContact O-CG1 3.24Å; F1380-I1384 WeakPolarHBondContact O-CG1 3.2Å; F1380-I1384 PolarHBondContact O-N 3.01Å
1381	I	35.1	Very low	32.3	Very low	103 Å²	103	111.6 Å²	111.6	53%	0.528	56%	0.562	S	S	.	*	H	α-helix	trans	-68.7	-38.2	172.9	-66.9	171.5	0	0	0	111.3	S1377 E1378 K1385	S1377-I1381 PolarHBondContact O-N 3.43Å; S1377-I1381 VanDerWaalsContact O-N 3.09Å; E1378-I1381 PolarHBondContact O-N 3.39Å; I1381-K1385 WeakPolarHBondContact O-CB 3.45Å; I1381-K1385 WeakPolarHBondContact O-CG 3.27Å; I1381-K1385 PolarHBondContact O-N 3.02Å
1382	Q	36.8	Very low	32.3	Very low	122 Å²	122	109.5 Å²	109.5	57%	0.57	56%	0.559	S	S	*	*	H	α-helix	trans	-69	-42	171.2	-75.1	-164.7	10.7	0	0	111.4	E1378 I1384 K1385 H1386	E1378-Q1382 WeakPolarHBondContact O-CB 3.19Å; E1378-Q1382 WeakPolarHBondContact O-CG 3.31Å; E1378-Q1382 PolarHBondContact O-N 3.06Å; Q1382-I1384 VanDerWaalsContact C-N 3.28Å; Q1382-I1384 PolarHBondContact O-N 3.49Å; Q1382-K1385 CarbonylContact O-C 3.54Å; Q1382-K1385 PolarHBondContact O-N 2.92Å; Q1382-H1386 WeakPolarHBondContact O-CA 2.98Å; Q1382-H1386 WeakPolarHBondContact O-CB 3.32Å; Q1382-H1386 PolarHBondContact O-N 2.96Å
1383	Y	36.7	Very low	32.3	Very low	156 Å²	156	112.2 Å²	112.2	61%	0.612	57%	0.571	S	S	*	*	H	α-helix	trans	-62.1	-36.9	175.1	-174.2	-101.7	0	0	0	111.5	N1379 F1380 N1387	N1379-Y1383 WeakPolarHBondContact O-CB 3.05Å; N1379-Y1383 PolarHBondContact O-N 3.15Å; F1380-Y1383 PolarHBondContact O-N 3.27Å; Y1383-N1387 WeakPolarHBondContact CD1-ND2 3.44Å; Y1383-N1387 VanDerWaalsContact CD2-ND2 3.34Å; Y1383-N1387 WeakPolarHBondContact CD2-ND2 3.47Å; Y1383-N1387 WeakPolarHBondContact CE1-ND2 3.38Å; Y1383-N1387 VanDerWaalsContact CE2-ND2 3.34Å; Y1383-N1387 WeakPolarHBondContact CE2-ND2 3.48Å; Y1383-N1387 VanDerWaalsContact O-CB 3.24Å; Y1383-N1387 WeakPolarHBondContact O-CB 3.44Å; Y1383-N1387 PolarHBondContact O-N 3.29Å; Y1383-N1387 PolarHBondContact O-ND2 3.45Å
1384	I	37.3	Very low	32.3	Very low	94 Å²	94	109.7 Å²	109.7	48%	0.482	57%	0.566	S	S	.	*	H	α-helix	trans	-69.6	-43	173.3	-70.7	166.7	0	0	0	111.6	F1380 Q1382 S1388	F1380-I1384 HydrophobicContact CD1-CD1 3.73Å; F1380-I1384 HydrophobicContact CE1-CD1 3.64Å; F1380-I1384 HydrophobicContact CG-CD1 4.41Å; F1380-I1384 HydrophobicContact CZ-CD1 4.25Å; F1380-I1384 WeakPolarHBondContact O-CB 3.27Å; F1380-I1384 WeakPolarHBondContact O-CD1 3.23Å; F1380-I1384 VanDerWaalsContact O-CG1 3.24Å; F1380-I1384 WeakPolarHBondContact O-CG1 3.2Å; F1380-I1384 PolarHBondContact O-N 3.01Å; Q1382-I1384 VanDerWaalsContact C-N 3.28Å; Q1382-I1384 PolarHBondContact O-N 3.49Å; I1384-S1388 WeakPolarHBondContact O-CB 3.41Å; I1384-S1388 PolarHBondContact O-N 3.04Å; I1384-S1388 VanDerWaalsContact O-N 3.12Å; I1384-S1388 PolarHBondContact O-OG 2.91Å
1385	K	35.3	Very low	32.1	Very low	125 Å²	125	114.7 Å²	114.7	54%	0.543	58%	0.583	S	S	.	*	H	α-helix	trans	-64.3	-50.3	173.6	-81.2	-178.1	174	178.7	0	112.4	I1381 Q1382 N1387 S1388 Q1389	I1381-K1385 WeakPolarHBondContact O-CB 3.45Å; I1381-K1385 WeakPolarHBondContact O-CG 3.27Å; I1381-K1385 PolarHBondContact O-N 3.02Å; Q1382-K1385 CarbonylContact O-C 3.54Å; Q1382-K1385 PolarHBondContact O-N 2.92Å; K1385-N1387 PolarHBondContact O-N 3.03Å; K1385-S1388 WeakPolarHBondContact CA-OG 3.47Å; K1385-S1388 CarbonylContact O-C 3.54Å; K1385-S1388 PolarHBondContact O-N 3.01Å; K1385-S1388 VanDerWaalsContact O-N 3.12Å; K1385-S1388 PolarHBondContact O-OG 3.36Å; K1385-Q1389 VanDerWaalsContact O-CB 3.31Å; K1385-Q1389 WeakPolarHBondContact O-CB 3.34Å; K1385-Q1389 VanDerWaalsContact O-CG 3.28Å; K1385-Q1389 WeakPolarHBondContact O-CG 3.38Å; K1385-Q1389 PolarHBondContact O-N 3.3Å
1386	H	37.1	Very low	32	Very low	100 Å²	100	115 Å²	115	46%	0.463	59%	0.593	S	S	.	*	H	α-helix	trans	-62.8	-44.7	-177.2	-161.9	-99.5	0	0	0	111.2	Q1382 S1388 Q1389 Q1390	Q1382-H1386 WeakPolarHBondContact O-CA 2.98Å; Q1382-H1386 WeakPolarHBondContact O-CB 3.32Å; Q1382-H1386 PolarHBondContact O-N 2.96Å; H1386-S1388 VanDerWaalsContact C-N 3.33Å; H1386-S1388 PolarHBondContact O-N 3.04Å; H1386-Q1389 PolarHBondContact O-N 2.77Å; H1386-Q1390 PolarHBondContact CE1-NE2 2.88Å; H1386-Q1390 PolarHBondContact CE1-OE1 2.82Å; H1386-Q1390 PolarHBondContact ND1-OE1 3.07Å; H1386-Q1390 PolarHBondContact NE2-NE2 2.97Å; H1386-Q1390 VanDerWaalsContact NE2-NE2 3.15Å; H1386-Q1390 WeakPolarHBondContact O-CB 3.47Å; H1386-Q1390 WeakPolarHBondContact O-CG 3.44Å; H1386-Q1390 PolarHBondContact O-N 2.71Å
1387	N	34.4	Very low	32	Very low	71 Å²	71	116.9 Å²	116.9	38%	0.38	60%	0.599	S	S	.	*	H	α-helix	trans	-72.1	-21.9	174.8	-70.8	-56.1	0	0	0	114	Y1383 K1385	Y1383-N1387 WeakPolarHBondContact CD1-ND2 3.44Å; Y1383-N1387 VanDerWaalsContact CD2-ND2 3.34Å; Y1383-N1387 WeakPolarHBondContact CD2-ND2 3.47Å; Y1383-N1387 WeakPolarHBondContact CE1-ND2 3.38Å; Y1383-N1387 VanDerWaalsContact CE2-ND2 3.34Å; Y1383-N1387 WeakPolarHBondContact CE2-ND2 3.48Å; Y1383-N1387 VanDerWaalsContact O-CB 3.24Å; Y1383-N1387 WeakPolarHBondContact O-CB 3.44Å; Y1383-N1387 PolarHBondContact O-N 3.29Å; Y1383-N1387 PolarHBondContact O-ND2 3.45Å; K1385-N1387 PolarHBondContact O-N 3.03Å
1388	S	34.4	Very low	31.9	Very low	76 Å²	76	124 Å²	124	53%	0.531	62%	0.617	S	S	.	*	H	α-helix	trans	-86.6	-18	171.3	55.8	0	0	0	0	113.9	I1384 K1385 H1386	I1384-S1388 WeakPolarHBondContact O-CB 3.41Å; I1384-S1388 PolarHBondContact O-N 3.04Å; I1384-S1388 VanDerWaalsContact O-N 3.12Å; I1384-S1388 PolarHBondContact O-OG 2.91Å; K1385-S1388 WeakPolarHBondContact CA-OG 3.47Å; K1385-S1388 CarbonylContact O-C 3.54Å; K1385-S1388 PolarHBondContact O-N 3.01Å; K1385-S1388 VanDerWaalsContact O-N 3.12Å; K1385-S1388 PolarHBondContact O-OG 3.36Å; H1386-S1388 VanDerWaalsContact C-N 3.33Å; H1386-S1388 PolarHBondContact O-N 3.04Å
1389	Q	33.9	Very low	31.9	Very low	135 Å²	135	123.2 Å²	123.2	63%	0.631	62%	0.623	S	S	*	*	H	α-helix	trans	-103.5	-25.7	-180	-67.1	-178.6	-72.5	0	0	114	K1385 H1386 V1392	K1385-Q1389 VanDerWaalsContact O-CB 3.31Å; K1385-Q1389 WeakPolarHBondContact O-CB 3.34Å; K1385-Q1389 VanDerWaalsContact O-CG 3.28Å; K1385-Q1389 WeakPolarHBondContact O-CG 3.38Å; K1385-Q1389 PolarHBondContact O-N 3.3Å; H1386-Q1389 PolarHBondContact O-N 2.77Å; Q1389-V1392 WeakPolarHBondContact O-CB 3.44Å; Q1389-V1392 WeakPolarHBondContact O-CG2 3.34Å
1390	Q	32.3	Very low	31.6	Very low	123 Å²	123	126.6 Å²	126.6	58%	0.575	64%	0.641	S	S	*	*	H	α-helix	trans	-86	-24	-179.9	-71.8	-162.7	-25.4	0	0	115	H1386 V1392	H1386-Q1390 PolarHBondContact CE1-NE2 2.88Å; H1386-Q1390 PolarHBondContact CE1-OE1 2.82Å; H1386-Q1390 PolarHBondContact ND1-OE1 3.07Å; H1386-Q1390 PolarHBondContact NE2-NE2 2.97Å; H1386-Q1390 VanDerWaalsContact NE2-NE2 3.15Å; H1386-Q1390 WeakPolarHBondContact O-CB 3.47Å; H1386-Q1390 WeakPolarHBondContact O-CG 3.44Å; H1386-Q1390 PolarHBondContact O-N 2.71Å; Q1390-V1392 PolarHBondContact O-N 3.42Å; Q1390-V1392 VanDerWaalsContact O-N 3.16Å
1391	N	28.8	Very low	31.4	Very low	136 Å²	136	129.5 Å²	129.5	73%	0.727	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	16.7	171.8	-82.3	-43.1	0	0	0	113.6
1392	V	27.8	Very low	31.2	Very low	106 Å²	106	131.8 Å²	131.8	64%	0.642	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-7.1	178.5	-178.9	0	0	0	0	112.1	Q1389 Q1390	Q1389-V1392 WeakPolarHBondContact O-CB 3.44Å; Q1389-V1392 WeakPolarHBondContact O-CG2 3.34Å; Q1390-V1392 PolarHBondContact O-N 3.42Å; Q1390-V1392 VanDerWaalsContact O-N 3.16Å
1393	Q	27.4	Very low	30.7	Very low	178 Å²	178	131.6 Å²	131.6	83%	0.832	67%	0.67	S	S	*	*	S	Bend	trans	-126.2	60.9	-174.6	-68.2	-174.4	-21.6	0	0	114.5
1394	S	27.5	Very low	30.1	Very low	103 Å²	103	128 Å²	128	72%	0.72	66%	0.66	S	S	*	*	S	Bend	trans	-161.9	85.7	154.9	12.9	0	0	0	0	113.8
1395	H	25.9	Very low	29.7	Very low	184 Å²	184	130.3 Å²	130.3	85%	0.852	67%	0.673	S	S	*	*			trans	25.8	104.3	153.2	-61.1	-47.7	0	0	0	122
1396	S	26.4	Very low	29.3	Very low	95 Å²	95	129.7 Å²	129.7	66%	0.664	68%	0.681	S	S	*	*				81.6	145.8	120.7	75.1	0	0	0	0	122.1
1397	N	29	Very low	28.9	Very low	153 Å²	153	131 Å²	131	82%	0.818	70%	0.696	S	S	*	*			trans	67.6	41.5	157.2	-62.3	-14.9	0	0	0	119.5
1398	Y	27.5	Very low	28.8	Very low	217 Å²	217	131.5 Å²	131.5	85%	0.851	70%	0.697	S	S	*	*			trans	-120.1	132.2	152.9	-98	-92.7	0	0	0	111.7
1399	P	30.6	Very low	29	Very low	105 Å²	105	131.2 Å²	131.2	68%	0.682	69%	0.692	S	S	*	*			trans	-76.8	130.6	176.1	30.3	-33.1	0	0	0	110.9	K1401	P1399-K1401 PolarHBondContact O-N 3.14Å
1400	N	28.3	Very low	29.4	Very low	144 Å²	144	129.9 Å²	129.9	77%	0.77	69%	0.689	S	S	*	*			trans	-59.1	89.9	-174.6	-77.1	-7.7	0	0	0	113.9	H1402	N1400-H1402 PolarHBondContact O-N 2.88Å
1401	K	27.2	Very low	30.1	Very low	193 Å²	193	128.8 Å²	128.8	84%	0.839	69%	0.691	S	S	*	*			trans	-87.5	83.1	161.5	-74	-176.5	176.7	177.6	0	109.3	P1399	P1399-K1401 PolarHBondContact O-N 3.14Å
1402	H	30.1	Very low	30.9	Very low	152 Å²	152	127.6 Å²	127.6	70%	0.704	68%	0.681	S	S	*	*			trans	-57.3	136.6	165.5	-68.9	-89.2	0	0	0	109.5	N1400 M1404	N1400-H1402 PolarHBondContact O-N 2.88Å; H1402-M1404 VanDerWaalsContact C-N 3.33Å; H1402-M1404 PolarHBondContact O-N 3.38Å
1403	P	26.4	Very low	32.1	Very low	117 Å²	117	126.1 Å²	126.1	76%	0.76	67%	0.668	S	S	*	*			trans	-70.5	91.6	175.7	28.8	-33.5	0	0	0	109.3	L1405	P1403-L1405 PolarHBondContact O-N 2.81Å; P1403-L1405 VanDerWaalsContact O-N 3.11Å
1404	M	25.4	Very low	33	Very low	81 Å²	81	125.3 Å²	125.3	40%	0.399	66%	0.658	S	S	.	*			trans	-58.3	113.7	178.7	-168.5	174.2	-171	0	0	109.4	W975 H1402	W975-M1404 HydrophobicContact CB-SD 4.06Å; W975-M1404 VanDerWaalsContact CD1-SD 3.56Å; W975-M1404 HydrophobicContact CG-CB 4.39Å; W975-M1404 HydrophobicContact CG-SD 4.11Å; H1402-M1404 VanDerWaalsContact C-N 3.33Å; H1402-M1404 PolarHBondContact O-N 3.38Å
1405	L	28.3	Very low	34.4	Very low	143 Å²	143	125 Å²	125	75%	0.749	65%	0.648	S	S	*	*			trans	-57.3	131.7	179.3	-90.1	77.4	0	0	0	109.5	P1403 V1407	P1403-L1405 PolarHBondContact O-N 2.81Å; P1403-L1405 VanDerWaalsContact O-N 3.11Å; L1405-V1407 PolarHBondContact O-N 2.72Å
1406	P	26.7	Very low	35.9	Very low	111 Å²	111	118.9 Å²	118.9	72%	0.721	63%	0.625	S	S	*	*			trans	-71	94.6	173.2	29.1	-33	0	0	0	108.7	M1408	P1406-M1408 PolarHBondContact O-N 2.65Å
1407	V	28.9	Very low	37.3	Very low	127 Å²	127	118.9 Å²	118.9	77%	0.77	62%	0.618	S	S	*	*			trans	-56.5	104.5	177.9	179.6	0	0	0	0	109.1	L1405 T1409	L1405-V1407 PolarHBondContact O-N 2.72Å; V1407-T1409 PolarHBondContact O-N 3.28Å
1408	M	33.3	Very low	38.4	Very low	83 Å²	83	114.3 Å²	114.3	41%	0.409	59%	0.593	S	S	.	*			trans	-61.9	110.2	171.1	-84.9	-158	174.9	0	0	108.2	P1406 H1412 I1413 L1692	P1406-M1408 PolarHBondContact O-N 2.65Å; M1408-H1412 HydrophobicContact CB-CB 4.46Å; M1408-H1412 HydrophobicContact CG-CB 4.49Å; M1408-H1412 HydrophobicContact SD-CB 4.45Å; M1408-I1413 HydrophobicContact CB-CD1 4.14Å; M1408-I1413 HydrophobicContact CB-CG1 3.62Å; M1408-I1413 WeakPolarHBondContact O-CD1 3.32Å; M1408-I1413 HydrophobicContact SD-CG1 4.22Å; M1408-L1692 HydrophobicContact CE-CD1 4.36Å; M1408-L1692 HydrophobicContact CE-CD2 3.99Å
1409	T	37.2	Very low	40.1	Very low	69 Å²	69	108.4 Å²	108.4	42%	0.423	58%	0.575	S	S	.	*			trans	-52	146.5	171.1	60.3	0	0	0	0	109.9	V1407 T1411 H1412 I1413	V1407-T1409 PolarHBondContact O-N 3.28Å; T1409-T1411 PolarHBondContact O-N 3.42Å; T1409-T1411 PolarHBondContact OG1-OG1 2.71Å; T1409-T1411 VanDerWaalsContact OG1-OG1 3.04Å; T1409-H1412 WeakPolarHBondContact O-CA 3.42Å; T1409-H1412 PolarHBondContact O-N 2.68Å; T1409-H1412 PolarHBondContact OG1-ND1 2.78Å; T1409-I1413 PolarHBondContact O-N 3.23Å
1410	L	43.4	Very low	41.6	Very low	107 Å²	107	108.1 Å²	108.1	56%	0.56	57%	0.567	S	S	*	*	H	α-helix	trans	-49.7	-29.3	179.8	-172.1	64.6	0	0	0	114.1	R1414	L1410-R1414 WeakPolarHBondContact O-CB 3.27Å; L1410-R1414 VanDerWaalsContact O-CG 3.22Å; L1410-R1414 WeakPolarHBondContact O-CG 3.38Å; L1410-R1414 PolarHBondContact O-N 3.29Å
1411	T	46.2	Very low	42.6	Very low	101 Å²	101	105.3 Å²	105.3	62%	0.62	55%	0.552	S	S	*	*	H	α-helix	trans	-69.2	-35.9	173.3	40.8	0	0	0	0	114.6	T1409 L1415	T1409-T1411 PolarHBondContact O-N 3.42Å; T1409-T1411 PolarHBondContact OG1-OG1 2.71Å; T1409-T1411 VanDerWaalsContact OG1-OG1 3.04Å; T1411-L1415 WeakPolarHBondContact O-CB 3.22Å; T1411-L1415 PolarHBondContact O-N 2.88Å
1412	H	45.4	Very low	43.6	Very low	110 Å²	110	98.2 Å²	98.2	51%	0.509	53%	0.526	S	S	.	.	H	α-helix	trans	-73.3	-42.4	175.1	-75.7	104	0	0	0	110.9	M1408 T1409 R1414 L1415 S1416	M1408-H1412 HydrophobicContact CB-CB 4.46Å; M1408-H1412 HydrophobicContact CG-CB 4.49Å; M1408-H1412 HydrophobicContact SD-CB 4.45Å; T1409-H1412 WeakPolarHBondContact O-CA 3.42Å; T1409-H1412 PolarHBondContact O-N 2.68Å; T1409-H1412 PolarHBondContact OG1-ND1 2.78Å; H1412-R1414 VanDerWaalsContact C-N 3.35Å; H1412-R1414 PolarHBondContact O-N 2.93Å; H1412-L1415 PolarHBondContact O-N 3.01Å; H1412-S1416 PolarHBondContact O-N 3.39Å; H1412-S1416 PolarHBondContact O-OG 2.68Å
1413	I	52.9	Low	44.9	Very low	75 Å²	75	98.1 Å²	98.1	39%	0.385	52%	0.524	S	S	.	.	H	α-helix	trans	-58.7	-47.9	174.1	-55.6	-177.9	0	0	0	110.3	M1408 T1409 L1415 S1416 L1417	M1408-I1413 HydrophobicContact CB-CD1 4.14Å; M1408-I1413 HydrophobicContact CB-CG1 3.62Å; M1408-I1413 WeakPolarHBondContact O-CD1 3.32Å; M1408-I1413 HydrophobicContact SD-CG1 4.22Å; T1409-I1413 PolarHBondContact O-N 3.23Å; I1413-L1415 VanDerWaalsContact C-N 3.33Å; I1413-L1415 PolarHBondContact O-N 2.6Å; I1413-S1416 PolarHBondContact O-N 3Å; I1413-L1417 HydrophobicContact CG2-CD1 3.99Å; I1413-L1417 HydrophobicContact CG2-CG 4.45Å; I1413-L1417 WeakPolarHBondContact O-CB 3.28Å; I1413-L1417 WeakPolarHBondContact O-CG 3.4Å; I1413-L1417 PolarHBondContact O-N 2.82Å
1414	R	46.8	Very low	46.4	Very low	161 Å²	161	96.1 Å²	96.1	61%	0.608	51%	0.506	S	S	*	.	H	α-helix	trans	-62.7	-34.9	176.2	-75.4	172.9	176.8	173.4	0.1	113.5	L1410 H1412 L1418	L1410-R1414 WeakPolarHBondContact O-CB 3.27Å; L1410-R1414 VanDerWaalsContact O-CG 3.22Å; L1410-R1414 WeakPolarHBondContact O-CG 3.38Å; L1410-R1414 PolarHBondContact O-N 3.29Å; H1412-R1414 VanDerWaalsContact C-N 3.35Å; H1412-R1414 PolarHBondContact O-N 2.93Å; R1414-L1418 VanDerWaalsContact O-CB 3.24Å; R1414-L1418 WeakPolarHBondContact O-CB 3.47Å; R1414-L1418 PolarHBondContact O-N 2.84Å
1415	L	57.6	Low	47.7	Very low	98 Å²	98	95 Å²	95	51%	0.513	50%	0.502	S	S	.	.	H	α-helix	trans	-70.5	-43.6	176.4	-173.2	68.6	0	0	0	111.5	T1411 H1412 I1413 L1418 I1419	T1411-L1415 WeakPolarHBondContact O-CB 3.22Å; T1411-L1415 PolarHBondContact O-N 2.88Å; H1412-L1415 PolarHBondContact O-N 3.01Å; I1413-L1415 VanDerWaalsContact C-N 3.33Å; I1413-L1415 PolarHBondContact O-N 2.6Å; L1415-L1418 PolarHBondContact O-N 2.85Å; L1415-I1419 HydrophobicContact CG-CD1 4.19Å; L1415-I1419 WeakPolarHBondContact O-CG1 3.37Å; L1415-I1419 PolarHBondContact O-N 3.49Å
1416	S	56	Low	48.9	Very low	54 Å²	54	91.2 Å²	91.2	38%	0.378	49%	0.49	S	S	.	.	H	α-helix	trans	-62.1	-46.6	175.9	-63.4	0	0	0	0	111.6	H1412 I1413 L1418 I1419 L1420	H1412-S1416 PolarHBondContact O-N 3.39Å; H1412-S1416 PolarHBondContact O-OG 2.68Å; I1413-S1416 PolarHBondContact O-N 3Å; S1416-L1418 PolarHBondContact O-N 3.19Å; S1416-I1419 PolarHBondContact O-N 2.82Å; S1416-L1420 WeakPolarHBondContact O-CB 3.38Å; S1416-L1420 PolarHBondContact O-N 2.95Å
1417	L	56.8	Low	50.3	Low	96 Å²	96	91.5 Å²	91.5	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-59.3	-45.5	174.4	-71.9	171.6	0	0	0	111.4	I1413 I1419 L1420 D1421	I1413-L1417 HydrophobicContact CG2-CD1 3.99Å; I1413-L1417 HydrophobicContact CG2-CG 4.45Å; I1413-L1417 WeakPolarHBondContact O-CB 3.28Å; I1413-L1417 WeakPolarHBondContact O-CG 3.4Å; I1413-L1417 PolarHBondContact O-N 2.82Å; L1417-I1419 VanDerWaalsContact C-N 3.32Å; L1417-I1419 PolarHBondContact O-N 2.98Å; L1417-L1420 CarbonylContact O-C 3.56Å; L1417-L1420 PolarHBondContact O-N 3.44Å; L1417-L1420 VanDerWaalsContact O-N 3.11Å; L1417-D1421 WeakPolarHBondContact O-CB 3.17Å; L1417-D1421 PolarHBondContact O-N 3.45Å
1418	L	52.7	Low	51.1	Low	56 Å²	56	93.6 Å²	93.6	29%	0.293	47%	0.472	S	S	.	.	H	α-helix	trans	-63.1	-34.7	178.8	-174.5	149.4	0	0	0	112.9	R1414 L1415 S1416 C1422	R1414-L1418 VanDerWaalsContact O-CB 3.24Å; R1414-L1418 WeakPolarHBondContact O-CB 3.47Å; R1414-L1418 PolarHBondContact O-N 2.84Å; L1415-L1418 PolarHBondContact O-N 2.85Å; S1416-L1418 PolarHBondContact O-N 3.19Å; L1418-C1422 WeakPolarHBondContact O-CB 3.29Å; L1418-C1422 PolarHBondContact O-N 2.91Å; L1418-C1422 PolarHBondContact O-SG 3.34Å
1419	I	61.7	Low	51.8	Low	93 Å²	93	94.5 Å²	94.5	48%	0.477	47%	0.474	S	S	.	.	H	α-helix	trans	-69.9	-39.3	173.8	-68.9	166.1	0	0	0	111	L1415 S1416 L1417 C1422 F1423	L1415-I1419 HydrophobicContact CG-CD1 4.19Å; L1415-I1419 WeakPolarHBondContact O-CG1 3.37Å; L1415-I1419 PolarHBondContact O-N 3.49Å; S1416-I1419 PolarHBondContact O-N 2.82Å; L1417-I1419 VanDerWaalsContact C-N 3.32Å; L1417-I1419 PolarHBondContact O-N 2.98Å; I1419-C1422 WeakPolarHBondContact O-CB 3.46Å; I1419-C1422 PolarHBondContact O-N 3.27Å; I1419-F1423 PolarHBondContact O-N 3.32Å
1420	L	62.1	Low	52.6	Low	99 Å²	99	93.9 Å²	93.9	52%	0.518	47%	0.465	S	S	.	.	H	α-helix	trans	-68.1	-43.4	178.2	-145.2	165.6	0	0	0	110.8	S1416 L1417 C1422 F1423 I1424	S1416-L1420 WeakPolarHBondContact O-CB 3.38Å; S1416-L1420 PolarHBondContact O-N 2.95Å; L1417-L1420 CarbonylContact O-C 3.56Å; L1417-L1420 PolarHBondContact O-N 3.44Å; L1417-L1420 VanDerWaalsContact O-N 3.11Å; L1420-C1422 PolarHBondContact O-N 3.01Å; L1420-F1423 WeakPolarHBondContact O-CB 3.44Å; L1420-F1423 PolarHBondContact O-N 3.16Å; L1420-F1423 VanDerWaalsContact O-N 3.15Å; L1420-I1424 HydrophobicContact CD2-CD1 3.45Å; L1420-I1424 VanDerWaalsContact CD2-CD1 3.45Å; L1420-I1424 HydrophobicContact CD2-CG1 3.99Å; L1420-I1424 WeakPolarHBondContact O-CG1 3.48Å; L1420-I1424 PolarHBondContact O-N 3.46Å
1421	D	49	Very low	52.9	Low	86 Å²	86	92.2 Å²	92.2	46%	0.46	45%	0.454	S	S	.	.	H	α-helix	trans	-58.3	-44.1	169.7	-74.4	-28.2	0	0	0	111.3	L1417 F1423 I1424 I1425	L1417-D1421 WeakPolarHBondContact O-CB 3.17Å; L1417-D1421 PolarHBondContact O-N 3.45Å; D1421-F1423 VanDerWaalsContact C-N 3.29Å; D1421-F1423 PolarHBondContact O-N 3.23Å; D1421-I1424 PolarHBondContact O-N 2.97Å; D1421-I1425 HydrophobicContact CB-CD1 4.33Å; D1421-I1425 VanDerWaalsContact O-CB 3.26Å; D1421-I1425 WeakPolarHBondContact O-CB 3.31Å; D1421-I1425 WeakPolarHBondContact O-CD1 3.23Å; D1421-I1425 WeakPolarHBondContact O-CG1 3.24Å; D1421-I1425 PolarHBondContact O-N 3.24Å
1422	C	48.2	Very low	53.3	Low	44 Å²	44	90.9 Å²	90.9	30%	0.297	45%	0.447	S	S	.	.	H	α-helix	trans	-59.2	-40.3	175.1	-73.4	0	0	0	0	112	F999 L1418 I1419 L1420 A1426	F999-C1422 VanDerWaalsContact CZ-SG 3.52Å; L1418-C1422 WeakPolarHBondContact O-CB 3.29Å; L1418-C1422 PolarHBondContact O-N 2.91Å; L1418-C1422 PolarHBondContact O-SG 3.34Å; I1419-C1422 WeakPolarHBondContact O-CB 3.46Å; I1419-C1422 PolarHBondContact O-N 3.27Å; L1420-C1422 PolarHBondContact O-N 3.01Å; C1422-A1426 WeakPolarHBondContact O-CB 3.22Å; C1422-A1426 PolarHBondContact O-N 3.29Å
1423	F	57.8	Low	53.5	Low	150 Å²	150	87.5 Å²	87.5	66%	0.658	43%	0.429	S	S	*	.	H	α-helix	trans	-67.1	-46.9	174.9	-104.7	-85.5	0	0	0	112.2	I1419 L1420 D1421 I1425 A1426 Y1427	I1419-F1423 PolarHBondContact O-N 3.32Å; L1420-F1423 WeakPolarHBondContact O-CB 3.44Å; L1420-F1423 PolarHBondContact O-N 3.16Å; L1420-F1423 VanDerWaalsContact O-N 3.15Å; D1421-F1423 VanDerWaalsContact C-N 3.29Å; D1421-F1423 PolarHBondContact O-N 3.23Å; F1423-I1425 PolarHBondContact O-N 3.28Å; F1423-A1426 PolarHBondContact O-N 3.23Å; F1423-Y1427 WeakPolarHBondContact O-CB 3.27Å; F1423-Y1427 PolarHBondContact O-N 3.32Å
1424	I	58.4	Low	53.5	Low	75 Å²	75	87.1 Å²	87.1	39%	0.385	43%	0.426	S	S	.	.	H	α-helix	trans	-62.1	-42.8	177.8	-70	170	0	0	0	111.1	L1420 D1421 Y1427 R1428	L1420-I1424 HydrophobicContact CD2-CD1 3.45Å; L1420-I1424 VanDerWaalsContact CD2-CD1 3.45Å; L1420-I1424 HydrophobicContact CD2-CG1 3.99Å; L1420-I1424 WeakPolarHBondContact O-CG1 3.48Å; L1420-I1424 PolarHBondContact O-N 3.46Å; D1421-I1424 PolarHBondContact O-N 2.97Å; I1424-Y1427 PolarHBondContact O-N 2.87Å; I1424-R1428 HydrophobicContact CG2-CG 4.49Å; I1424-R1428 WeakPolarHBondContact O-CB 3.49Å; I1424-R1428 WeakPolarHBondContact O-CG 3.35Å; I1424-R1428 PolarHBondContact O-N 2.93Å
1425	I	53.1	Low	53.8	Low	58 Å²	58	84.5 Å²	84.5	30%	0.297	42%	0.423	S	S	.	.	H	α-helix	trans	-69.2	-43.9	179.7	-67.1	162.8	0	0	0	110.5	Y1003 D1421 F1423 Y1427 R1428 F1429	Y1003-I1425 HydrophobicContact CD2-CD1 3.99Å; Y1003-I1425 HydrophobicContact CE2-CD1 3.67Å; D1421-I1425 HydrophobicContact CB-CD1 4.33Å; D1421-I1425 VanDerWaalsContact O-CB 3.26Å; D1421-I1425 WeakPolarHBondContact O-CB 3.31Å; D1421-I1425 WeakPolarHBondContact O-CD1 3.23Å; D1421-I1425 WeakPolarHBondContact O-CG1 3.24Å; D1421-I1425 PolarHBondContact O-N 3.24Å; F1423-I1425 PolarHBondContact O-N 3.28Å; I1425-Y1427 VanDerWaalsContact C-N 3.34Å; I1425-Y1427 PolarHBondContact O-N 3.37Å; I1425-R1428 PolarHBondContact O-N 2.96Å; I1425-F1429 HydrophobicContact CG2-CD2 4.22Å; I1425-F1429 WeakPolarHBondContact O-CB 3.32Å; I1425-F1429 PolarHBondContact O-N 2.93Å
1426	A	52.1	Low	53.4	Low	62 Å²	62	84 Å²	84	51%	0.512	42%	0.421	S	S	.	.	H	α-helix	trans	-62.8	-40.8	175.3	0	0	0	0	0	111.8	C1422 F1423 F1429 F1430	C1422-A1426 WeakPolarHBondContact O-CB 3.22Å; C1422-A1426 PolarHBondContact O-N 3.29Å; F1423-A1426 PolarHBondContact O-N 3.23Å; A1426-F1429 PolarHBondContact O-N 3.15Å; A1426-F1430 WeakPolarHBondContact O-CB 3.5Å; A1426-F1430 PolarHBondContact O-N 3.35Å
1427	Y	56.1	Low	53.1	Low	118 Å²	118	84.9 Å²	84.9	46%	0.463	42%	0.417	S	S	.	.	H	α-helix	trans	-65.2	-44.6	175.9	-173	-102.3	0	0	0	112.1	F1423 I1424 I1425 F1430 H1431 W1452	F1423-Y1427 WeakPolarHBondContact O-CB 3.27Å; F1423-Y1427 PolarHBondContact O-N 3.32Å; I1424-Y1427 PolarHBondContact O-N 2.87Å; I1425-Y1427 VanDerWaalsContact C-N 3.34Å; I1425-Y1427 PolarHBondContact O-N 3.37Å; Y1427-F1430 PolarHBondContact O-N 2.85Å; Y1427-H1431 AromaticContact CD1-CD2 3.9Å; Y1427-H1431 AromaticContact CE1-CD2 3.5Å; Y1427-H1431 VanDerWaalsContact CE1-CD2 3.5Å; Y1427-H1431 WeakPolarHBondContact CE1-CD2 3.42Å; Y1427-H1431 AromaticContact CE1-NE2 3.64Å; Y1427-H1431 AromaticContact CE2-CD2 3.85Å; Y1427-H1431 AromaticContact CE2-NE2 3.64Å; Y1427-H1431 AromaticContact CZ-CD2 3.47Å; Y1427-H1431 VanDerWaalsContact CZ-CD2 3.47Å; Y1427-H1431 AromaticContact CZ-NE2 3.17Å; Y1427-H1431 PolarHBondContact O-CD2 2.73Å; Y1427-H1431 PolarHBondContact O-N 3.11Å; Y1427-H1431 PolarHBondContact OH-NE2 2.9Å; Y1427-W1452 WeakPolarHBondContact OH-CH2 3.24Å
1428	R	47.4	Very low	52.6	Low	170 Å²	170	81.2 Å²	81.2	64%	0.642	40%	0.401	S	S	*	.	H	α-helix	trans	-63.9	-41.8	173.6	-77.2	-176	175.3	-149.6	-1.8	112.1	I1424 I1425 H1431 T1432	I1424-R1428 HydrophobicContact CG2-CG 4.49Å; I1424-R1428 WeakPolarHBondContact O-CB 3.49Å; I1424-R1428 WeakPolarHBondContact O-CG 3.35Å; I1424-R1428 PolarHBondContact O-N 2.93Å; I1425-R1428 PolarHBondContact O-N 2.96Å; R1428-H1431 PolarHBondContact O-N 3.17Å; R1428-T1432 VanDerWaalsContact O-CB 3.29Å; R1428-T1432 WeakPolarHBondContact O-CB 3.42Å; R1428-T1432 PolarHBondContact O-N 2.92Å; R1428-T1432 PolarHBondContact O-OG1 3.04Å
1429	F	46.9	Very low	52.1	Low	102 Å²	102	85.6 Å²	85.6	45%	0.447	42%	0.418	S	S	.	.	H	α-helix	trans	-64.8	-38.5	175.3	-111.8	-83.6	0	0	0	111.9	L1006 I1425 A1426 Y1433	L1006-F1429 HydrophobicContact CB-CE2 4.36Å; L1006-F1429 HydrophobicContact CB-CZ 4.4Å; L1006-F1429 HydrophobicContact CD1-CE2 4.24Å; L1006-F1429 HydrophobicContact CD1-CZ 4.25Å; L1006-F1429 HydrophobicContact CD2-CZ 4.18Å; I1425-F1429 HydrophobicContact CG2-CD2 4.22Å; I1425-F1429 WeakPolarHBondContact O-CB 3.32Å; I1425-F1429 PolarHBondContact O-N 2.93Å; A1426-F1429 PolarHBondContact O-N 3.15Å; F1429-Y1433 WeakPolarHBondContact O-CB 3.44Å; F1429-Y1433 PolarHBondContact O-N 3.02Å
1430	F	53.5	Low	51.1	Low	57 Å²	57	91.4 Å²	91.4	25%	0.25	43%	0.434	C	S	.	.	H	α-helix	trans	-64.4	-46.3	175.8	-178.6	-93.8	0	0	0	112	A1426 Y1427 Y1433 E1434 K1888	A1426-F1430 WeakPolarHBondContact O-CB 3.5Å; A1426-F1430 PolarHBondContact O-N 3.35Å; Y1427-F1430 PolarHBondContact O-N 2.85Å; F1430-Y1433 PolarHBondContact O-N 3.29Å; F1430-E1434 HydrophobicContact CD1-CG 4.5Å; F1430-E1434 HydrophobicContact CE1-CG 4.04Å; F1430-E1434 HydrophobicContact CZ-CG 4.08Å; F1430-E1434 PolarHBondContact O-N 3.03Å; F1430-K1888 HydrophobicContact CZ-CD 4.44Å
1431	H	51.2	Low	50	Low	71 Å²	71	90.4 Å²	90.4	33%	0.329	43%	0.432	S	S	.	.	H	α-helix	trans	-65.5	-46.5	175	-88.4	-75.9	0	0	0	112.7	Y1427 R1428 Y1433 E1434 I1435	Y1427-H1431 AromaticContact CD1-CD2 3.9Å; Y1427-H1431 AromaticContact CE1-CD2 3.5Å; Y1427-H1431 VanDerWaalsContact CE1-CD2 3.5Å; Y1427-H1431 WeakPolarHBondContact CE1-CD2 3.42Å; Y1427-H1431 AromaticContact CE1-NE2 3.64Å; Y1427-H1431 AromaticContact CE2-CD2 3.85Å; Y1427-H1431 AromaticContact CE2-NE2 3.64Å; Y1427-H1431 AromaticContact CZ-CD2 3.47Å; Y1427-H1431 VanDerWaalsContact CZ-CD2 3.47Å; Y1427-H1431 AromaticContact CZ-NE2 3.17Å; Y1427-H1431 PolarHBondContact O-CD2 2.73Å; Y1427-H1431 PolarHBondContact O-N 3.11Å; Y1427-H1431 PolarHBondContact OH-NE2 2.9Å; R1428-H1431 PolarHBondContact O-N 3.17Å; H1431-Y1433 PolarHBondContact O-N 3.42Å; H1431-E1434 PolarHBondContact O-N 3.2Å; H1431-I1435 WeakPolarHBondContact O-CB 3.31Å; H1431-I1435 WeakPolarHBondContact O-CD1 3.27Å; H1431-I1435 VanDerWaalsContact O-CG1 3.26Å; H1431-I1435 WeakPolarHBondContact O-CG1 3.47Å; H1431-I1435 PolarHBondContact O-N 3.42Å
1432	T	53	Low	49.1	Very low	74 Å²	74	89.4 Å²	89.4	45%	0.454	44%	0.443	S	S	.	.	H	α-helix	trans	-61	-32.3	175.3	-49.1	0	0	0	0	111.1	R1428 L1436	R1428-T1432 VanDerWaalsContact O-CB 3.29Å; R1428-T1432 WeakPolarHBondContact O-CB 3.42Å; R1428-T1432 PolarHBondContact O-N 2.92Å; R1428-T1432 PolarHBondContact O-OG1 3.04Å; T1432-L1436 HydrophobicContact CG2-CD1 4.08Å; T1432-L1436 VanDerWaalsContact O-CB 3.27Å; T1432-L1436 WeakPolarHBondContact O-CB 3.49Å; T1432-L1436 WeakPolarHBondContact O-CG 3.09Å; T1432-L1436 PolarHBondContact O-N 3.43Å
1433	Y	50.8	Low	48.2	Very low	38 Å²	38	93.4 Å²	93.4	15%	0.149	46%	0.457	C	S	.	.	H	α-helix	trans	-71.8	-45.9	173.2	173.7	-112.9	0	0	0	113	F1429 F1430 H1431 I1435 L1436 K1437 I1877 V1880 D1881	F1429-Y1433 WeakPolarHBondContact O-CB 3.44Å; F1429-Y1433 PolarHBondContact O-N 3.02Å; F1430-Y1433 PolarHBondContact O-N 3.29Å; H1431-Y1433 PolarHBondContact O-N 3.42Å; Y1433-I1435 VanDerWaalsContact C-N 3.27Å; Y1433-I1435 PolarHBondContact O-N 2.84Å; Y1433-L1436 PolarHBondContact O-N 3.24Å; Y1433-K1437 HydrophobicContact CE1-CD 4.06Å; Y1433-K1437 HydrophobicContact CE2-CB 4.36Å; Y1433-K1437 HydrophobicContact CE2-CD 4.47Å; Y1433-K1437 WeakPolarHBondContact O-CB 3.24Å; Y1433-K1437 PolarHBondContact O-N 2.78Å; Y1433-I1877 HydrophobicContact CE2-CG2 3.93Å; Y1433-V1880 HydrophobicContact CD1-CG1 4.24Å; Y1433-V1880 HydrophobicContact CE1-CG1 4.5Å; Y1433-V1880 HydrophobicContact CG-CG1 4.43Å; Y1433-D1881 WeakPolarHBondContact OH-CB 3.49Å; Y1433-D1881 PolarHBondContact OH-OD1 3.04Å
1434	E	52.3	Low	46.9	Very low	67 Å²	67	91.3 Å²	91.3	31%	0.313	46%	0.456	S	S	.	.	H	α-helix	trans	-63.3	-35.9	175.5	-66.7	-129.8	119.3	0	0	111.3	F1430 H1431 A1438 K1888	F1430-E1434 HydrophobicContact CD1-CG 4.5Å; F1430-E1434 HydrophobicContact CE1-CG 4.04Å; F1430-E1434 HydrophobicContact CZ-CG 4.08Å; F1430-E1434 PolarHBondContact O-N 3.03Å; H1431-E1434 PolarHBondContact O-N 3.2Å; E1434-A1438 WeakPolarHBondContact O-CB 3.26Å; E1434-A1438 PolarHBondContact O-N 2.78Å; E1434-K1888 IonicContact OE1-NZ 3.72Å; E1434-K1888 PolarHBondContact OE1-NZ 3.29Å; E1434-K1888 IonicContact OE2-NZ 3.77Å; E1434-K1888 PolarHBondContact OE2-NZ 3.49Å
1435	I	53.1	Low	45.4	Very low	106 Å²	106	92.8 Å²	92.8	54%	0.544	47%	0.465	S	S	.	.	H	α-helix	trans	-63.3	-55.9	171.9	-67.8	164	0	0	0	111.1	H1431 Y1433 K1437 A1438 F1439	H1431-I1435 WeakPolarHBondContact O-CB 3.31Å; H1431-I1435 WeakPolarHBondContact O-CD1 3.27Å; H1431-I1435 VanDerWaalsContact O-CG1 3.26Å; H1431-I1435 WeakPolarHBondContact O-CG1 3.47Å; H1431-I1435 PolarHBondContact O-N 3.42Å; Y1433-I1435 VanDerWaalsContact C-N 3.27Å; Y1433-I1435 PolarHBondContact O-N 2.84Å; I1435-K1437 VanDerWaalsContact C-N 3.27Å; I1435-K1437 PolarHBondContact O-N 3Å; I1435-A1438 PolarHBondContact O-N 3.33Å; I1435-F1439 WeakPolarHBondContact O-CB 3.4Å; I1435-F1439 PolarHBondContact O-N 2.87Å
1436	L	49.9	Very low	44.2	Very low	89 Å²	89	99.4 Å²	99.4	47%	0.466	49%	0.492	S	S	.	.	H	α-helix	trans	-60.6	-36.6	179.5	-82.7	168.7	0	0	0	112.4	T1432 Y1433 F1439 W1440	T1432-L1436 HydrophobicContact CG2-CD1 4.08Å; T1432-L1436 VanDerWaalsContact O-CB 3.27Å; T1432-L1436 WeakPolarHBondContact O-CB 3.49Å; T1432-L1436 WeakPolarHBondContact O-CG 3.09Å; T1432-L1436 PolarHBondContact O-N 3.43Å; Y1433-L1436 PolarHBondContact O-N 3.24Å; L1436-F1439 WeakPolarHBondContact O-CB 3.44Å; L1436-F1439 PolarHBondContact O-N 3.44Å; L1436-W1440 WeakPolarHBondContact O-CB 3.31Å; L1436-W1440 PolarHBondContact O-N 2.77Å
1437	K	49.4	Very low	43.1	Very low	71 Å²	71	101.8 Å²	101.8	31%	0.309	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-48.2	176.2	-175.8	179.9	-175.9	177.4	0	111	Y1433 I1435 F1439 W1440 T1441 D1881	Y1433-K1437 HydrophobicContact CE1-CD 4.06Å; Y1433-K1437 HydrophobicContact CE2-CB 4.36Å; Y1433-K1437 HydrophobicContact CE2-CD 4.47Å; Y1433-K1437 WeakPolarHBondContact O-CB 3.24Å; Y1433-K1437 PolarHBondContact O-N 2.78Å; I1435-K1437 VanDerWaalsContact C-N 3.27Å; I1435-K1437 PolarHBondContact O-N 3Å; K1437-F1439 VanDerWaalsContact C-N 3.28Å; K1437-F1439 PolarHBondContact O-N 2.88Å; K1437-W1440 PolarHBondContact O-N 3.24Å; K1437-T1441 WeakPolarHBondContact O-CG2 3.27Å; K1437-T1441 PolarHBondContact O-N 3.17Å; K1437-T1441 PolarHBondContact O-OG1 3.13Å; K1437-D1881 IonicContact NZ-OD1 3.42Å; K1437-D1881 PolarHBondContact NZ-OD1 3.03Å
1438	A	46.8	Very low	41.6	Very low	19 Å²	19	100.4 Å²	100.4	16%	0.157	50%	0.5	C	S	.	.	H	α-helix	trans	-60.2	-39.2	174.3	0	0	0	0	0	111.9	E1434 I1435 G1442 Q1443 L1445	E1434-A1438 WeakPolarHBondContact O-CB 3.26Å; E1434-A1438 PolarHBondContact O-N 2.78Å; I1435-A1438 PolarHBondContact O-N 3.33Å; A1438-G1442 PolarHBondContact O-N 3.42Å; A1438-Q1443 PolarHBondContact O-N 3.18Å; A1438-L1445 HydrophobicContact CB-CB 4.41Å; A1438-L1445 HydrophobicContact CB-CD1 4.04Å
1439	F	42.4	Very low	40.6	Very low	148 Å²	148	93.8 Å²	93.8	65%	0.649	48%	0.482	S	S	*	.	H	α-helix	trans	-61.8	-46.5	174.7	-134.2	-83.8	0	0	0	112	I1435 L1436 K1437	I1435-F1439 WeakPolarHBondContact O-CB 3.4Å; I1435-F1439 PolarHBondContact O-N 2.87Å; L1436-F1439 WeakPolarHBondContact O-CB 3.44Å; L1436-F1439 PolarHBondContact O-N 3.44Å; K1437-F1439 VanDerWaalsContact C-N 3.28Å; K1437-F1439 PolarHBondContact O-N 2.88Å
1440	W	39.3	Very low	39.7	Very low	215 Å²	215	92.2 Å²	92.2	81%	0.814	48%	0.483	S	S	*	.	H	α-helix	trans	-75.7	-30	-178.8	-83	35.1	0	0	0	113.7	L1436 K1437 G1442	L1436-W1440 WeakPolarHBondContact O-CB 3.31Å; L1436-W1440 PolarHBondContact O-N 2.77Å; K1437-W1440 PolarHBondContact O-N 3.24Å; W1440-G1442 VanDerWaalsContact C-N 3.29Å
1441	T	39.7	Very low	38.6	Very low	78 Å²	78	92 Å²	92	48%	0.479	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-0.7	175.9	59.4	0	0	0	0	113.5	K1437 Q1443	K1437-T1441 WeakPolarHBondContact O-CG2 3.27Å; K1437-T1441 PolarHBondContact O-N 3.17Å; K1437-T1441 PolarHBondContact O-OG1 3.13Å; T1441-Q1443 PolarHBondContact O-N 2.81Å; T1441-Q1443 VanDerWaalsContact O-N 3.13Å
1442	G	30.7	Very low	37.5	Very low	66 Å²	66	95.4 Å²	95.4	68%	0.68	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	19.3	-178.8	0	0	0	0	0	114.2	A1438 W1440	A1438-G1442 PolarHBondContact O-N 3.42Å; W1440-G1442 VanDerWaalsContact C-N 3.29Å
1443	Q	29.1	Very low	36.3	Very low	128 Å²	128	97.5 Å²	97.5	60%	0.598	51%	0.507	S	S	*	.			trans	-86.9	120.8	-175	-75	-173.9	-28.8	0	0	109.9	A1438 T1441 L1445	A1438-Q1443 PolarHBondContact O-N 3.18Å; T1441-Q1443 PolarHBondContact O-N 2.81Å; T1441-Q1443 VanDerWaalsContact O-N 3.13Å; Q1443-L1445 PolarHBondContact O-N 3.45Å
1444	T	29	Very low	35.2	Very low	105 Å²	105	101.6 Å²	101.6	64%	0.644	53%	0.528	S	S	*	.			trans	-71.7	77.3	176.1	51.9	0	0	0	0	110.6	F1446	T1444-F1446 PolarHBondContact O-N 3.42Å; T1444-F1446 VanDerWaalsContact O-N 3.15Å
1445	L	28.6	Very low	34.1	Very low	107 Å²	107	108.1 Å²	108.1	56%	0.56	55%	0.549	S	S	*	.			trans	-76.3	99.2	178.2	-128.3	162.3	0	0	0	109	A1438 Q1443 V1447	A1438-L1445 HydrophobicContact CB-CB 4.41Å; A1438-L1445 HydrophobicContact CB-CD1 4.04Å; Q1443-L1445 PolarHBondContact O-N 3.45Å; L1445-V1447 HydrophobicContact CB-CG2 4.47Å; L1445-V1447 HydrophobicContact CD2-CG2 3.67Å; L1445-V1447 PolarHBondContact O-N 3.42Å
1446	F	26.8	Very low	32.9	Very low	197 Å²	197	110 Å²	110	86%	0.864	56%	0.556	S	S	*	*			trans	-68.9	81.9	167.5	-82.6	-97.7	0	0	0	109	T1444 D1448	T1444-F1446 PolarHBondContact O-N 3.42Å; T1444-F1446 VanDerWaalsContact O-N 3.15Å; F1446-D1448 VanDerWaalsContact C-N 3.31Å; F1446-D1448 PolarHBondContact O-N 3.24Å; F1446-D1448 VanDerWaalsContact O-N 3.15Å
1447	V	28.5	Very low	31.8	Very low	112 Å²	112	108.4 Å²	108.4	68%	0.679	55%	0.549	S	S	*	.			trans	-80.9	85.4	166.6	-175.2	0	0	0	0	107.4	L1445 A1449	L1445-V1447 HydrophobicContact CB-CG2 4.47Å; L1445-V1447 HydrophobicContact CD2-CG2 3.67Å; L1445-V1447 PolarHBondContact O-N 3.42Å; V1447-A1449 PolarHBondContact O-N 2.78Å; V1447-A1449 VanDerWaalsContact O-N 3.17Å
1448	D	24.5	Very low	30.6	Very low	88 Å²	88	111.5 Å²	111.5	47%	0.471	57%	0.565	S	S	.	*			trans	-71.2	108.2	167.8	-165.4	-26	0	0	0	108.6	F1446 S1450 S1451	F1446-D1448 VanDerWaalsContact C-N 3.31Å; F1446-D1448 PolarHBondContact O-N 3.24Å; F1446-D1448 VanDerWaalsContact O-N 3.15Å; D1448-S1450 PolarHBondContact O-N 3.43Å; D1448-S1450 WeakPolarHBondContact OD1-CB 3.31Å; D1448-S1450 PolarHBondContact OD1-N 2.8Å; D1448-S1450 PolarHBondContact OD1-OG 3.01Å; D1448-S1450 PolarHBondContact OD2-OG 2.8Å; D1448-S1451 WeakPolarHBondContact O-CB 3.16Å; D1448-S1451 PolarHBondContact O-N 3.15Å; D1448-S1451 PolarHBondContact O-OG 2.78Å
1449	A	28	Very low	29.6	Very low	31 Å²	31	116.2 Å²	116.2	26%	0.256	59%	0.592	S	S	.	*	S	Bend	trans	-64.2	-22.7	180	0	0	0	0	0	112.9	V1447 W1452 L1453 L1719	V1447-A1449 PolarHBondContact O-N 2.78Å; V1447-A1449 VanDerWaalsContact O-N 3.17Å; A1449-W1452 PolarHBondContact O-N 3.48Å; A1449-L1453 PolarHBondContact O-N 3.46Å; A1449-L1719 HydrophobicContact CB-CD2 3.35Å
1450	S	27.8	Very low	28.8	Very low	69 Å²	69	115.7 Å²	115.7	48%	0.483	60%	0.601	S	S	.	*	H	α-helix	trans	-63.2	-44.2	170.5	68.8	0	0	0	0	110.4	D1448 W1452 L1453 E1454	D1448-S1450 PolarHBondContact O-N 3.43Å; D1448-S1450 WeakPolarHBondContact OD1-CB 3.31Å; D1448-S1450 PolarHBondContact OD1-N 2.8Å; D1448-S1450 PolarHBondContact OD1-OG 3.01Å; D1448-S1450 PolarHBondContact OD2-OG 2.8Å; S1450-W1452 PolarHBondContact O-N 3Å; S1450-W1452 VanDerWaalsContact O-N 3.08Å; S1450-L1453 CarbonylContact O-C 3.53Å; S1450-L1453 WeakPolarHBondContact O-CB 3.22Å; S1450-L1453 PolarHBondContact O-N 3.05Å; S1450-L1453 VanDerWaalsContact O-N 3.13Å; S1450-E1454 VanDerWaalsContact O-CB 3.32Å; S1450-E1454 WeakPolarHBondContact O-CB 3.42Å; S1450-E1454 PolarHBondContact O-N 3.47Å
1451	S	29.2	Very low	28.1	Very low	54 Å²	54	110.6 Å²	110.6	38%	0.378	59%	0.593	S	S	.	*	H	α-helix	trans	-65.6	-10.3	176.3	79.6	0	0	0	0	115.1	D1448 R1455	D1448-S1451 WeakPolarHBondContact O-CB 3.16Å; D1448-S1451 PolarHBondContact O-N 3.15Å; D1448-S1451 PolarHBondContact O-OG 2.78Å; S1451-R1455 WeakPolarHBondContact O-CB 3.3Å
1452	W	29.1	Very low	27.4	Very low	142 Å²	142	114.3 Å²	114.3	54%	0.538	61%	0.61	S	S	.	*	H	α-helix	trans	-93.2	-38.8	172.1	-152.7	67.7	0	0	0	111.7	Y1427 A1449 S1450 E1454 R1455 Q1456	Y1427-W1452 WeakPolarHBondContact OH-CH2 3.24Å; A1449-W1452 PolarHBondContact O-N 3.48Å; S1450-W1452 PolarHBondContact O-N 3Å; S1450-W1452 VanDerWaalsContact O-N 3.08Å; W1452-E1454 VanDerWaalsContact C-N 3.26Å; W1452-E1454 PolarHBondContact O-N 3.22Å; W1452-R1455 PolarHBondContact O-N 2.87Å; W1452-R1455 VanDerWaalsContact O-N 3.1Å; W1452-Q1456 PolarHBondContact O-N 2.9Å
1453	L	28.5	Very low	27.1	Very low	117 Å²	117	117.8 Å²	117.8	61%	0.613	61%	0.613	S	S	*	*	H	α-helix	trans	-59.1	-39	165.1	-96.3	152.1	0	0	0	111.3	A1449 S1450 R1455 T1457	A1449-L1453 PolarHBondContact O-N 3.46Å; S1450-L1453 CarbonylContact O-C 3.53Å; S1450-L1453 WeakPolarHBondContact O-CB 3.22Å; S1450-L1453 PolarHBondContact O-N 3.05Å; S1450-L1453 VanDerWaalsContact O-N 3.13Å; L1453-R1455 PolarHBondContact O-N 3.39Å; L1453-T1457 WeakPolarHBondContact O-CG2 3.48Å; L1453-T1457 PolarHBondContact O-N 2.92Å; L1453-T1457 PolarHBondContact O-OG1 2.89Å
1454	E	27.7	Very low	27	Very low	125 Å²	125	118 Å²	118	58%	0.584	61%	0.614	S	S	*	*	H	α-helix	trans	-70.3	-1.6	174.2	-159.1	177	-143.3	0	0	113.9	S1450 W1452 H1458	S1450-E1454 VanDerWaalsContact O-CB 3.32Å; S1450-E1454 WeakPolarHBondContact O-CB 3.42Å; S1450-E1454 PolarHBondContact O-N 3.47Å; W1452-E1454 VanDerWaalsContact C-N 3.26Å; W1452-E1454 PolarHBondContact O-N 3.22Å; E1454-H1458 PolarHBondContact O-CD2 3.45Å
1455	R	27.3	Very low	26.9	Very low	204 Å²	204	121.6 Å²	121.6	77%	0.77	62%	0.616	S	S	*	*	H	α-helix	trans	-123	-1.3	-177.2	-139.3	171.5	-168.8	162.2	5.5	115.9	S1451 W1452 L1453	S1451-R1455 WeakPolarHBondContact O-CB 3.3Å; W1452-R1455 PolarHBondContact O-N 2.87Å; W1452-R1455 VanDerWaalsContact O-N 3.1Å; L1453-R1455 PolarHBondContact O-N 3.39Å
1456	Q	27.9	Very low	26.9	Very low	146 Å²	146	122.4 Å²	122.4	68%	0.682	62%	0.621	S	S	*	*	H	α-helix	trans	-110.8	-14.4	159.9	-75.7	-162.7	-26.8	0	0	113.3	W1452 H1458	W1452-Q1456 PolarHBondContact O-N 2.9Å; Q1456-H1458 VanDerWaalsContact C-N 3.32Å
1457	T	27	Very low	27	Very low	54 Å²	54	120 Å²	120	33%	0.331	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74	-22	168	49.6	0	0	0	0	113.2	L1453	L1453-T1457 WeakPolarHBondContact O-CG2 3.48Å; L1453-T1457 PolarHBondContact O-N 2.92Å; L1453-T1457 PolarHBondContact O-OG1 2.89Å
1458	H	25.6	Very low	26.9	Very low	136 Å²	136	117.5 Å²	117.5	63%	0.63	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	24.2	-174.1	-75.2	-88.6	0	0	0	115.6	E1454 Q1456	E1454-H1458 PolarHBondContact O-CD2 3.45Å; Q1456-H1458 VanDerWaalsContact C-N 3.32Å
1459	T	24.8	Very low	27.1	Very low	118 Å²	118	120 Å²	120	72%	0.724	63%	0.627	S	S	*	*	S	Bend	trans	-161.1	99.2	154.6	48.9	0	0	0	0	107.9
1460	T	25.5	Very low	27	Very low	137 Å²	137	125.5 Å²	125.5	84%	0.84	65%	0.646	S	S	*	*	S	Bend	cis	-127.5	102.8	21.1	52	0	0	0	0	112.8
1461	V	25.3	Very low	27	Very low	108 Å²	108	131.3 Å²	131.3	66%	0.655	67%	0.665	S	S	*	*			trans	-103.1	113	143	174.2	0	0	0	0	105.3
1462	D	23.9	Very low	27.1	Very low	157 Å²	157	136 Å²	136	84%	0.84	68%	0.681	S	S	*	*			trans	-168	60.5	164.5	-98.2	-24.8	0	0	0	108.7
1463	N	25.8	Very low	27.1	Very low	139 Å²	139	132.8 Å²	132.8	74%	0.743	69%	0.685	S	S	*	*	S	Bend	trans	-168	107.6	139.9	-94.4	-13.5	0	0	0	106.6
1464	E	26.4	Very low	27.2	Very low	132 Å²	132	131.2 Å²	131.2	62%	0.617	68%	0.684	S	S	*	*				78.2	124.6	98.3	-68.1	-153	149.5	0	0	113.1
1465	R	27	Very low	27.4	Very low	181 Å²	181	134.5 Å²	134.5	68%	0.683	70%	0.696	S	S	*	*			cis	-157	165.6	1.7	-111.9	179.8	-145.3	160.9	9.4	111
1466	D	27.9	Very low	27.4	Very low	123 Å²	123	130.8 Å²	130.8	66%	0.658	70%	0.696	S	S	*	*			trans	15.2	121.6	141.1	-33.7	-31.3	0	0	0	116.2
1467	N	30	Very low	27.6	Very low	147 Å²	147	129.5 Å²	129.5	79%	0.786	70%	0.699	S	S	*	*			cis	-143.2	157.3	33.5	-69.8	-91.6	0	0	0	109.4
1468	G	26.4	Very low	27.5	Very low	60 Å²	60	132.9 Å²	132.9	62%	0.619	72%	0.719	S	S	*	*			cis	93.6	133.4	32.3	0	0	0	0	0	109.1
1469	N	27.3	Very low	27.5	Very low	139 Å²	139	133.8 Å²	133.8	74%	0.743	72%	0.723	S	S	*	*			cis	-148.8	157.2	6.4	-97.8	-40.1	0	0	0	113
1470	F	26.7	Very low	27.6	Very low	148 Å²	148	132.8 Å²	132.8	65%	0.649	72%	0.719	S	S	*	*			trans	0.7	137.7	138.9	-74	-105.9	0	0	0	117.5	E1472	F1470-E1472 HydrophobicContact CD1-CB 3.77Å; F1470-E1472 HydrophobicContact CE1-CB 4.33Å
1471	H	27.6	Very low	27.5	Very low	190 Å²	190	133 Å²	133	88%	0.88	71%	0.708	S	S	*	*				-129.3	79.1	120.9	-98	-54.9	0	0	0	112.1
1472	E	31.1	Very low	27.7	Very low	152 Å²	152	130.9 Å²	130.9	71%	0.71	69%	0.693	S	S	*	*			trans	-66.4	122.8	139.9	-177.6	-175.8	-176.1	0	0	108.1	F1470	F1470-E1472 HydrophobicContact CD1-CB 3.77Å; F1470-E1472 HydrophobicContact CE1-CB 4.33Å
1473	A	29.6	Very low	28	Very low	76 Å²	76	125.8 Å²	125.8	63%	0.628	67%	0.67	S	S	*	*			trans	-166.8	95	164.3	0	0	0	0	0	106.5
1474	S	31.2	Very low	28	Very low	84 Å²	84	122.9 Å²	122.9	59%	0.587	65%	0.652	S	S	*	*				75	130.5	56.5	94.9	0	0	0	0	113.4
1475	K	31.5	Very low	28.1	Very low	194 Å²	194	119.2 Å²	119.2	84%	0.843	64%	0.641	S	S	*	*			trans	72.5	154.9	170.6	-57	165.9	-173.2	169.2	0	113.5
1476	T	27.9	Very low	28.3	Very low	126 Å²	126	114.4 Å²	114.4	77%	0.773	63%	0.634	S	S	*	*			cis	-136.9	169.9	18.3	-28.2	0	0	0	0	112.6
1477	T	30.4	Very low	28.6	Very low	119 Å²	119	113.3 Å²	113.3	73%	0.73	62%	0.621	S	S	*	*			trans	-56.6	167.2	158.6	44.3	0	0	0	0	113.1
1478	V	25.4	Very low	28.8	Very low	125 Å²	125	114.8 Å²	114.8	76%	0.758	62%	0.615	S	S	*	*			trans	89.4	166	173	-168.5	0	0	0	0	114.1
1479	E	26.7	Very low	29	Very low	154 Å²	154	120.3 Å²	120.3	72%	0.72	62%	0.623	S	S	*	*			trans	-81.8	-144.8	-170	-56.3	159.8	124.9	0	0	111.8	H1518	E1479-H1518 PolarHBondContact O-NE2 2.9Å
1480	P	26.7	Very low	29.2	Very low	97 Å²	97	118.4 Å²	118.4	63%	0.63	62%	0.62	S	S	*	*				-105.9	164.8	-96.5	27.3	-9.2	0	0	0	114.4	H1518	P1480-H1518 VanDerWaalsContact CA-NE2 3.31Å; P1480-H1518 WeakPolarHBondContact CA-NE2 3.48Å
1481	F	23.7	Very low	29.5	Very low	141 Å²	141	118 Å²	118	62%	0.618	62%	0.62	S	S	*	*			trans	70	152.2	162.9	-96.6	-100.4	0	0	0	121.3	L1516 H1518	F1481-L1516 HydrophobicContact CD1-CD2 3.78Å; F1481-L1516 HydrophobicContact CE1-CD1 4.44Å; F1481-L1516 HydrophobicContact CE1-CD2 4Å; F1481-L1516 HydrophobicContact CG-CD2 4.12Å; F1481-H1518 PolarHBondContact N-CD2 2.85Å
1482	D	27.9	Very low	29.8	Very low	64 Å²	64	116.9 Å²	116.9	34%	0.342	61%	0.613	S	S	.	*			trans	27.2	117.1	158.4	-96.9	-47.5	0	0	0	126.4	A1515 L1516	D1482-A1515 WeakPolarHBondContact OD1-CA 3.5Å; D1482-A1515 WeakPolarHBondContact OD1-CB 3.35Å; D1482-L1516 PolarHBondContact OD1-N 2.64Å
1483	S	31.5	Very low	29.6	Very low	51 Å²	51	113.5 Å²	113.5	36%	0.357	62%	0.619	S	S	.	*				72.9	159.1	123.9	84.5	0	0	0	0	123.5	F1517	S1483-F1517 VanDerWaalsContact N-CD2 3.29Å
1484	H	26	Very low	29.9	Very low	77 Å²	77	118.1 Å²	118.1	36%	0.356	62%	0.624	S	S	.	*			trans	58	82.8	146	-71.4	-47.7	0	0	0	121.4	R1510 S1512 I1514	H1484-R1510 PolarHBondContact O-NH2 2.6Å; H1484-S1512 VanDerWaalsContact CE1-CB 3.47Å; H1484-S1512 WeakPolarHBondContact CE1-CB 3.49Å; H1484-I1514 PolarHBondContact CE1-N 3.1Å; H1484-I1514 PolarHBondContact NE2-N 3.02Å
1485	S	27.4	Very low	29.8	Very low	56 Å²	56	122.9 Å²	122.9	39%	0.392	63%	0.631	S	S	.	*				64.3	128.4	114.8	69	0	0	0	0	121.1	R1510	S1485-R1510 PolarHBondContact O-NE 3.06Å; S1485-R1510 PolarHBondContact O-NH2 2.71Å; S1485-R1510 PolarHBondContact OG-NE 2.99Å
1486	C	32.4	Very low	29.6	Very low	79 Å²	79	120.6 Å²	120.6	53%	0.534	63%	0.627	S	S	.	*			trans	65.4	140.3	143.5	-56.3	0	0	0	0	121.6	N1509	C1486-N1509 WeakPolarHBondContact CB-OD1 3.26Å; C1486-N1509 PolarHBondContact SG-OD1 3.03Å
1487	R	32.4	Very low	29.6	Very low	100 Å²	100	122.6 Å²	122.6	38%	0.377	63%	0.628	S	S	.	*			trans	93.1	127.7	134.6	-175.9	-178.9	-132.6	174	15.7	119.6	P1507 N1508	R1487-P1507 PolarHBondContact NH2-O 2.92Å; R1487-P1507 VanDerWaalsContact NH2-O 3.1Å; R1487-N1508 HydrophobicContact CG-CB 4.43Å; R1487-N1508 VanDerWaalsContact NH2-C 3.34Å; R1487-N1508 PolarHBondContact NH2-O 2.95Å
1488	R	35	Very low	29.7	Very low	178 Å²	178	120.7 Å²	120.7	67%	0.672	62%	0.619	S	S	*	*			trans	69.1	162.2	167.3	-69.1	160.5	-174.7	168.5	-3.1	114.1
1489	F	31.5	Very low	30.3	Very low	177 Å²	177	121.4 Å²	121.4	78%	0.776	62%	0.619	S	S	*	*			cis	-127.5	146	15.5	-83.5	-93.9	0	0	0	111
1490	S	30.5	Very low	30.6	Very low	98 Å²	98	121.4 Å²	121.4	69%	0.685	62%	0.623	S	S	*	*				70.2	150.2	92.3	-136.5	0	0	0	0	113.4
1491	E	32.4	Very low	30.8	Very low	140 Å²	140	120.8 Å²	120.8	65%	0.654	62%	0.621	S	S	*	*			cis	-172.2	164.3	35.2	-157.1	175.2	-142.6	0	0	114.1
1492	K	35.3	Very low	31	Very low	166 Å²	166	120.2 Å²	120.2	72%	0.722	63%	0.625	S	S	*	*			trans	43.5	88.3	153.8	-75.2	155	-157.7	156.7	0	121.3
1493	G	27.1	Very low	31.1	Very low	81 Å²	81	125.3 Å²	125.3	84%	0.835	64%	0.644	S	S	*	*				45.1	-168.3	119.2	0	0	0	0	0	124.9
1494	K	36	Very low	31.1	Very low	173 Å²	173	127.5 Å²	127.5	75%	0.752	65%	0.651	S	S	*	*			trans	72.5	111.4	168.7	-83.1	-178.1	167.3	-174	0	120.9
1495	Y	27.9	Very low	31.5	Very low	185 Å²	185	131.2 Å²	131.2	73%	0.725	67%	0.669	S	S	*	*			trans	81.2	120	144.6	-58.2	-52.9	0	0	0	121.6
1496	L	27.1	Very low	31.9	Very low	146 Å²	146	134.1 Å²	134.1	76%	0.764	68%	0.684	S	S	*	*			trans	50.5	123.9	143.3	-75.4	74.8	0	0	0	118.2
1497	E	28.7	Very low	32.7	Very low	167 Å²	167	134.8 Å²	134.8	78%	0.78	69%	0.688	S	S	*	*	S	Bend	cis	-153.5	155.2	2.2	-102.7	-158	-118.1	0	0	109.7
1498	S	33.1	Very low	33	Very low	79 Å²	79	134.2 Å²	134.2	55%	0.552	69%	0.692	S	S	*	*			cis	-154.6	174.5	-6.6	51	0	0	0	0	111.2
1499	N	37.3	Very low	32.9	Very low	141 Å²	141	129.1 Å²	129.1	75%	0.754	68%	0.678	S	S	*	*			trans	49.4	68.9	161.3	-60	-2.6	0	0	0	117
1500	L	33.1	Very low	33.1	Very low	154 Å²	154	126.3 Å²	126.3	81%	0.806	66%	0.663	S	S	*	*				53.7	146.8	113.3	-83.1	64.9	0	0	0	119.4
1501	S	29.4	Very low	33.3	Very low	84 Å²	84	129.9 Å²	129.9	59%	0.587	67%	0.666	S	S	*	*			cis	-170.7	137.2	0.4	45.2	0	0	0	0	112
1502	D	28.7	Very low	33.4	Very low	129 Å²	129	126.4 Å²	126.4	69%	0.69	66%	0.657	S	S	*	*				59.1	157	122.6	-49.2	-20.9	0	0	0	121
1503	F	29.9	Very low	33.4	Very low	170 Å²	170	129.4 Å²	129.4	75%	0.746	66%	0.664	S	S	*	*			cis	-166.6	170	-4.8	-120.3	-153.8	0	0	0	107.9
1504	N	31.2	Very low	33.4	Very low	97 Å²	97	131.9 Å²	131.9	52%	0.519	66%	0.657	S	S	.	*			cis	-170.8	139.6	-41.1	-113.2	33.9	0	0	0	110.1
1505	E	34.5	Very low	32.8	Very low	156 Å²	156	126.3 Å²	126.3	73%	0.729	64%	0.643	S	S	*	*			trans	65.1	169.7	135.6	-67.4	-172.6	122.1	0	0	121.6
1506	T	36.4	Very low	32.6	Very low	116 Å²	116	121.9 Å²	121.9	71%	0.712	63%	0.632	S	S	*	*			cis	-152.5	169.9	-12.3	17.7	0	0	0	0	111.9
1507	P	49.5	Very low	32.5	Very low	93 Å²	93	121.3 Å²	121.3	60%	0.604	62%	0.623	S	S	*	*			trans	-120.7	-163.7	-166.8	41.1	-28	0	0	0	117.7	R1487	R1487-P1507 PolarHBondContact NH2-O 2.92Å; R1487-P1507 VanDerWaalsContact NH2-O 3.1Å
1508	N	37.9	Very low	32.4	Very low	89 Å²	89	117.6 Å²	117.6	48%	0.476	61%	0.605	S	S	.	*			trans	75.3	160.8	178.3	-41.7	-98.3	0	0	0	114.8	R1487	R1487-N1508 HydrophobicContact CG-CB 4.43Å; R1487-N1508 VanDerWaalsContact NH2-C 3.34Å; R1487-N1508 PolarHBondContact NH2-O 2.95Å
1509	N	33.3	Very low	31.9	Very low	70 Å²	70	118.6 Å²	118.6	37%	0.374	61%	0.612	S	S	.	*			cis	-162.9	172.1	13.8	-141.5	12.8	0	0	0	107.3	C1486	C1486-N1509 WeakPolarHBondContact CB-OD1 3.26Å; C1486-N1509 PolarHBondContact SG-OD1 3.03Å
1510	R	35.6	Very low	31.7	Very low	118 Å²	118	120.1 Å²	120.1	45%	0.445	62%	0.619	S	S	.	*			cis	-163.4	-163.3	4.7	-155.1	-177.7	-162.8	-176.5	4	106.5	H1484 S1485	H1484-R1510 PolarHBondContact O-NH2 2.6Å; S1485-R1510 PolarHBondContact O-NE 3.06Å; S1485-R1510 PolarHBondContact O-NH2 2.71Å; S1485-R1510 PolarHBondContact OG-NE 2.99Å
1511	F	34.1	Very low	31.6	Very low	173 Å²	173	117.4 Å²	117.4	76%	0.759	61%	0.61	S	S	*	*			trans	87.6	143	153	-54.7	-62.9	0	0	0	119.6
1512	S	36.1	Very low	31.5	Very low	67 Å²	67	121.1 Å²	121.1	47%	0.469	62%	0.618	S	S	.	*			cis	179.9	132.6	-43.7	42.2	0	0	0	0	111.3	H1484	H1484-S1512 VanDerWaalsContact CE1-CB 3.47Å; H1484-S1512 WeakPolarHBondContact CE1-CB 3.49Å
1513	R	34.1	Very low	31.6	Very low	229 Å²	229	122 Å²	122	86%	0.864	62%	0.618	S	S	*	*			trans	-161.4	105.6	140.9	-106.2	148.6	-174.4	-166.3	0	109.9
1514	I	26.6	Very low	31.8	Very low	134 Å²	134	121.2 Å²	121.2	69%	0.687	62%	0.617	S	S	*	*				57.8	124.1	113.9	-64.9	168.8	0	0	0	115.4	H1484	H1484-I1514 PolarHBondContact CE1-N 3.1Å; H1484-I1514 PolarHBondContact NE2-N 3.02Å
1515	A	24.3	Very low	31.6	Very low	56 Å²	56	122.8 Å²	122.8	46%	0.463	63%	0.625	S	S	.	*			cis	-159.5	177.3	7.9	0	0	0	0	0	111.2	D1482	D1482-A1515 WeakPolarHBondContact OD1-CA 3.5Å; D1482-A1515 WeakPolarHBondContact OD1-CB 3.35Å
1516	L	23.7	Very low	31.3	Very low	92 Å²	92	120.7 Å²	120.7	48%	0.482	62%	0.618	S	S	.	*			trans	55.3	124.1	160.2	-74	158.2	0	0	0	118.2	F1481 D1482	F1481-L1516 HydrophobicContact CD1-CD2 3.78Å; F1481-L1516 HydrophobicContact CE1-CD1 4.44Å; F1481-L1516 HydrophobicContact CE1-CD2 4Å; F1481-L1516 HydrophobicContact CG-CD2 4.12Å; D1482-L1516 PolarHBondContact OD1-N 2.64Å
1517	F	25.8	Very low	30.8	Very low	133 Å²	133	123.8 Å²	123.8	58%	0.583	62%	0.618	S	S	*	*			cis	60.7	133.6	30	-104.9	-85.5	0	0	0	114.9	S1483	S1483-F1517 VanDerWaalsContact N-CD2 3.29Å
1518	H	24.7	Very low	29.8	Very low	89 Å²	89	127 Å²	127	41%	0.412	63%	0.625	S	S	.	*			trans	81	136.8	167.7	-80.6	-81	0	0	0	124.2	E1479 P1480 F1481	E1479-H1518 PolarHBondContact O-NE2 2.9Å; P1480-H1518 VanDerWaalsContact CA-NE2 3.31Å; P1480-H1518 WeakPolarHBondContact CA-NE2 3.48Å; F1481-H1518 PolarHBondContact N-CD2 2.85Å
1519	C	23.7	Very low	29.4	Very low	101 Å²	101	126.9 Å²	126.9	68%	0.682	63%	0.631	S	S	*	*			trans	70.1	97.3	141.7	-66.1	0	0	0	0	123.4
1520	L	32	Very low	29.1	Very low	172 Å²	172	132.8 Å²	132.8	90%	0.901	65%	0.647	S	S	*	*			trans	46.3	-117.2	144.4	-71.9	80.1	0	0	0	119.4
1521	P	31.7	Very low	28.8	Very low	98 Å²	98	134.5 Å²	134.5	64%	0.636	66%	0.66	S	S	*	*				-131.1	170.4	-127.5	40.8	-22.4	0	0	0	118.4
1522	Q	27.8	Very low	28.6	Very low	161 Å²	161	132.8 Å²	132.8	75%	0.752	66%	0.655	S	S	*	*			trans	79.8	131.9	155.8	-76.8	177.2	-68.4	0	0	122.8
1523	H	31.5	Very low	28.1	Very low	148 Å²	148	136.5 Å²	136.5	69%	0.685	66%	0.662	S	S	*	*			trans	62.9	126.3	140.4	-72.5	-64.9	0	0	0	126
1524	Q	33.5	Very low	27.7	Very low	154 Å²	154	133.2 Å²	133.2	72%	0.72	66%	0.657	S	S	*	*			trans	72.8	141.1	131.8	-87.2	-176.9	-27.3	0	0	124.1
1525	N	26.3	Very low	27.6	Very low	130 Å²	130	130.9 Å²	130.9	70%	0.695	66%	0.658	S	S	*	*			trans	70.3	154.8	144.6	-68.5	-2.2	0	0	0	118.9
1526	L	28.7	Very low	27.7	Very low	111 Å²	111	133.2 Å²	133.2	58%	0.581	66%	0.662	S	S	*	*			cis	-171.5	176.3	-32.6	-137.7	172.7	0	0	0	106.5
1527	Y	25.8	Very low	27.9	Very low	181 Å²	181	135.2 Å²	135.2	71%	0.71	66%	0.664	S	S	*	*			trans	68.7	137.2	170.4	-62	-66.4	0	0	0	114.1
1528	E	28.9	Very low	28	Very low	160 Å²	160	134.9 Å²	134.9	75%	0.748	66%	0.664	S	S	*	*			cis	125.6	145	41.5	-179.3	156.3	-152.1	0	0	105.7
1529	C	28.2	Very low	28	Very low	88 Å²	88	137.3 Å²	137.3	60%	0.595	69%	0.688	S	S	*	*			cis	-152.4	-174.5	11.7	-146.8	0	0	0	0	112.4
1530	R	28.8	Very low	28.1	Very low	193 Å²	193	135.8 Å²	135.8	73%	0.728	68%	0.678	S	S	*	*			trans	60.2	117.4	146.3	-73.9	-161.8	157.2	110.4	4.3	120.6
1531	H	28.3	Very low	27.8	Very low	154 Å²	154	133.3 Å²	133.3	71%	0.713	66%	0.663	S	S	*	*				59.4	151.9	126.6	-43.5	-34.9	0	0	0	118.4
1532	E	29.3	Very low	27.5	Very low	137 Å²	137	135.1 Å²	135.1	64%	0.64	66%	0.658	S	S	*	*			cis	-146.7	125.2	18.8	-174.3	140.3	-150	0	0	112.6
1533	K	27.3	Very low	27.4	Very low	146 Å²	146	131.6 Å²	131.6	64%	0.635	65%	0.652	S	S	*	*			trans	56.2	142.1	145.6	-70.7	172.1	-165.6	154.2	0	119
1534	Q	25.5	Very low	27.1	Very low	160 Å²	160	129.5 Å²	129.5	75%	0.748	65%	0.654	S	S	*	*				44.2	137	88.7	-40	160.5	-18	0	0	112.4
1535	A	24.5	Very low	26.6	Very low	85 Å²	85	125.7 Å²	125.7	70%	0.702	66%	0.656	S	S	*	*			cis	-145.4	156.6	35.9	0	0	0	0	0	109.8
1536	L	25.7	Very low	26.9	Very low	105 Å²	105	125.5 Å²	125.5	55%	0.55	65%	0.653	S	S	.	*				49	128	61.5	-67.9	85.9	0	0	0	111.6
1537	Y	26.9	Very low	26.7	Very low	134 Å²	134	125.1 Å²	125.1	53%	0.525	66%	0.658	S	S	.	*			cis	-165.5	173	-4.1	-121.3	-177.8	0	0	0	109.5
1538	Q	29.5	Very low	26.6	Very low	126 Å²	126	127.1 Å²	127.1	59%	0.589	66%	0.664	S	S	*	*			trans	32.5	89.4	142	-60.5	163.4	-34.5	0	0	117.4	S1540	Q1538-S1540 PolarHBondContact O-N 2.73Å
1539	P	23.7	Very low	26.5	Very low	139 Å²	139	125 Å²	125	90%	0.903	66%	0.658	S	S	*	*			trans	-70	93.8	155.7	30.3	-32.5	0	0	0	109
1540	S	25.6	Very low	26.3	Very low	70 Å²	70	127 Å²	127	49%	0.49	67%	0.673	S	S	.	*			trans	-145.3	109.1	176.1	59.1	0	0	0	0	114	Q1538	Q1538-S1540 PolarHBondContact O-N 2.73Å
1541	M	27	Very low	26.1	Very low	119 Å²	119	124.9 Å²	124.9	59%	0.586	67%	0.671	S	S	*	*			trans	76.4	92	139.7	-61.4	145.8	-173.4	0	0	119.6	M1270	M1270-M1541 HydrophobicContact CE-CE 4.28Å; M1270-M1541 HydrophobicContact CE-SD 3.9Å; M1270-M1541 HydrophobicContact SD-CE 3.36Å; M1270-M1541 WeakPolarHBondContact SD-CE 3.37Å; M1270-M1541 HydrophobicContact SD-CG 4.37Å; M1270-M1541 HydrophobicContact SD-SD 3.43Å
1542	Y	25.2	Very low	25.9	Very low	136 Å²	136	122.9 Å²	122.9	53%	0.533	68%	0.675	S	S	.	*			trans	-124.2	117.2	130.6	-90.5	-89	0	0	0	104.2	Y1299 F1343	Y1299-Y1542 WeakPolarHBondContact CD2-OH 3.45Å; Y1299-Y1542 AromaticContact CE2-CE2 3.91Å; Y1299-Y1542 HydrophobicContact CE2-CE2 3.91Å; Y1299-Y1542 AromaticContact CE2-CZ 4Å; Y1299-Y1542 WeakPolarHBondContact CE2-OH 3.48Å; F1343-Y1542 WeakPolarHBondContact CE1-O 3.25Å
1543	S	25.4	Very low	25.6	Very low	88 Å²	88	120.8 Å²	120.8	62%	0.615	68%	0.675	S	S	*	*			cis	54.2	115.5	48.1	-156.4	0	0	0	0	110.9
1544	S	24.8	Very low	25.5	Very low	104 Å²	104	121.7 Å²	121.7	73%	0.727	68%	0.682	S	S	*	*			cis	-142.5	126.6	20.2	54.8	0	0	0	0	112.8
1545	G	23.5	Very low	25.5	Very low	74 Å²	74	119.3 Å²	119.3	76%	0.763	68%	0.678	S	S	*	*			trans	-79.1	114	156.2	0	0	0	0	0	109.7
1546	I	32.3	Very low	25.5	Very low	125 Å²	125	121.4 Å²	121.4	64%	0.641	68%	0.682	S	S	*	*			trans	165.2	122.6	144.8	-85	152.6	0	0	0	107.4	P1262	P1262-I1546 HydrophobicContact CB-CD1 3.87Å; P1262-I1546 HydrophobicContact CG-CD1 4.09Å
1547	P	24.3	Very low	25.4	Very low	104 Å²	104	120.9 Å²	120.9	68%	0.675	69%	0.687	S	S	*	*			trans	-125.4	148.9	134.4	36.1	-29.4	0	0	0	110.9
1548	R	24.8	Very low	25.3	Very low	223 Å²	223	119.8 Å²	119.8	84%	0.842	70%	0.699	S	S	*	*			trans	54.5	119	139.2	-66.1	171.7	-169.6	160.5	1.6	116.9
1549	N	25.7	Very low	25.1	Very low	114 Å²	114	118.3 Å²	118.3	61%	0.61	70%	0.703	S	S	*	*			cis	-156.3	155.7	38.3	-87.6	-39	0	0	0	114
1550	S	23.7	Very low	25.2	Very low	131 Å²	131	119.7 Å²	119.7	92%	0.916	70%	0.701	S	S	*	*			trans	-151.6	75.6	144.1	-67.4	0	0	0	0	106.6
1551	Q	24.6	Very low	25.1	Very low	148 Å²	148	124.1 Å²	124.1	69%	0.692	72%	0.718	S	S	*	*			trans	-75.1	151.9	169	-67.6	175.1	-92.9	0	0	109.2
1552	S	23.8	Very low	25.1	Very low	112 Å²	112	122.3 Å²	122.3	78%	0.783	72%	0.717	S	S	*	*			trans	59.7	151.3	153.1	52.3	0	0	0	0	116.9
1553	S	24.7	Very low	25.1	Very low	94 Å²	94	122.6 Å²	122.6	66%	0.657	73%	0.728	S	S	*	*			cis	-164.7	164.8	1.3	20.4	0	0	0	0	106.6
1554	E	24.7	Very low	25.3	Very low	164 Å²	164	126.7 Å²	126.7	77%	0.766	74%	0.738	S	S	*	*			cis	-163.8	178.9	-8.4	-112.7	161.9	145.4	0	0	108.9
1555	T	25	Very low	25.5	Very low	111 Å²	111	127.1 Å²	127.1	68%	0.681	74%	0.736	S	S	*	*			trans	56.1	101.7	147.2	49.7	0	0	0	0	120.6
1556	T	24.5	Very low	25.6	Very low	128 Å²	128	128.8 Å²	128.8	79%	0.785	73%	0.731	S	S	*	*				61.8	146.8	116.1	57.5	0	0	0	0	121.3
1557	S	23.3	Very low	25.4	Very low	94 Å²	94	129.7 Å²	129.7	66%	0.657	74%	0.738	S	S	*	*			cis	-176	174	-9.8	49.1	0	0	0	0	109.9
1558	S	25.3	Very low	25.6	Very low	111 Å²	111	130 Å²	130	78%	0.776	74%	0.742	S	S	*	*			trans	67.7	150.7	162.5	72	0	0	0	0	116.7
1559	S	25.4	Very low	25.7	Very low	95 Å²	95	128.2 Å²	128.2	66%	0.664	74%	0.743	S	S	*	*			cis	-162.2	126.5	-15.1	39.2	0	0	0	0	110.8
1560	I	25.5	Very low	25.7	Very low	169 Å²	169	127.5 Å²	127.5	87%	0.867	75%	0.747	S	S	*	*				56.2	131.7	116.1	-60	160.2	0	0	0	119.3
1561	L	24.3	Very low	25.9	Very low	162 Å²	162	129.8 Å²	129.8	85%	0.848	74%	0.741	S	S	*	*			trans	-52.8	156.2	165.8	-128.6	72.4	0	0	0	111.8
1562	S	25.3	Very low	26.1	Very low	81 Å²	81	129.3 Å²	129.3	57%	0.566	74%	0.743	S	S	*	*			cis	-174.6	176.4	30.5	55.9	0	0	0	0	112.4
1563	N	27.1	Very low	26.3	Very low	143 Å²	143	132.8 Å²	132.8	77%	0.765	74%	0.744	S	S	*	*			trans	97.3	137.1	133.1	-85.4	-5.9	0	0	0	123.5
1564	Q	28.5	Very low	26.3	Very low	173 Å²	173	133.2 Å²	133.2	81%	0.808	75%	0.747	S	S	*	*			trans	93.4	118.2	146	-79.6	-172.6	1.8	0	0	122.8
1565	V	28.8	Very low	26.4	Very low	113 Å²	113	135 Å²	135	69%	0.685	75%	0.752	S	S	*	*				102.1	101.4	122.2	165.6	0	0	0	0	120.5
1566	T	26.9	Very low	26.6	Very low	109 Å²	109	139 Å²	139	67%	0.669	76%	0.763	S	S	*	*			trans	67.5	128.6	137.2	62.7	0	0	0	0	124.2
1567	D	28.2	Very low	26.7	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	76%	0.755	S	S	*	*				90.1	140.2	124.3	-72.6	-1.5	0	0	0	125.4
1568	S	28.5	Very low	26.9	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	76%	0.759	S	S	*	*			trans	82	103.9	147.7	71.3	0	0	0	0	120.6
1569	Q	26.2	Very low	27.1	Very low	185 Å²	185	142.5 Å²	142.5	86%	0.864	76%	0.755	S	S	*	*			trans	0.5	127.8	139.5	-48.5	177.1	5.5	0	0	118.3
1570	S	26.5	Very low	27.2	Very low	100 Å²	100	144.3 Å²	144.3	70%	0.699	76%	0.756	S	S	*	*				157.3	159.3	89.7	64.9	0	0	0	0	115.4
1571	K	27.8	Very low	27.3	Very low	179 Å²	179	142.4 Å²	142.4	78%	0.778	75%	0.748	S	S	*	*			trans	50	113.9	148.5	-71.8	169.5	-178.8	171.2	0	121
1572	N	27.2	Very low	27.3	Very low	138 Å²	138	138.7 Å²	138.7	74%	0.738	74%	0.736	S	S	*	*				79.3	134.6	126.4	-67	-20.9	0	0	0	122.5
1573	K	28.6	Very low	27.3	Very low	185 Å²	185	142 Å²	142	80%	0.804	75%	0.746	S	S	*	*			trans	66.9	89.6	140.7	-69.7	-179.3	178.2	-176.1	0	120.5
1574	S	25.6	Very low	27.1	Very low	102 Å²	102	140.1 Å²	140.1	71%	0.713	74%	0.743	S	S	*	*				60.6	118.6	116.8	65.5	0	0	0	0	123.2
1575	K	26.8	Very low	26.9	Very low	202 Å²	202	138 Å²	138	88%	0.878	74%	0.737	S	S	*	*			trans	77.8	156.7	139	-76.4	-171.2	173.2	-175.2	0	120.4
1576	Q	28.7	Very low	26.9	Very low	196 Å²	196	140.5 Å²	140.5	92%	0.916	74%	0.741	S	S	*	*			trans	73.5	139.5	-179.7	-60.7	177.3	-19.5	0	0	113.9
1577	S	26.8	Very low	26.7	Very low	87 Å²	87	140.4 Å²	140.4	61%	0.608	75%	0.745	S	S	*	*			cis	-146	165.4	-6	39.3	0	0	0	0	108.2
1578	F	27	Very low	26.6	Very low	170 Å²	170	137.8 Å²	137.8	75%	0.746	74%	0.743	S	S	*	*			cis	-155.8	142.4	49.7	-92.1	-99.7	0	0	0	113.3
1579	H	29.7	Very low	26.5	Very low	149 Å²	149	138.1 Å²	138.1	69%	0.69	74%	0.741	S	S	*	*			trans	47.9	139.4	135.6	-70.9	-129.7	0	0	0	121.3
1580	L	26.9	Very low	26.5	Very low	132 Å²	132	136.5 Å²	136.5	69%	0.691	74%	0.738	S	S	*	*			cis	-172.5	172.1	-14.5	-136.6	68.7	0	0	0	106
1581	N	27.3	Very low	26.8	Very low	130 Å²	130	137 Å²	137	70%	0.695	74%	0.74	S	S	*	*			cis	-154.2	-174.1	2.2	-155.5	4.5	0	0	0	112
1582	S	25.3	Very low	26.8	Very low	84 Å²	84	134.8 Å²	134.8	59%	0.587	75%	0.745	S	S	*	*			trans	-29.7	170	159.8	58.5	0	0	0	0	122
1583	L	24.2	Very low	26.7	Very low	149 Å²	149	137 Å²	137	78%	0.78	75%	0.751	S	S	*	*			cis	171	153.2	-25.2	-163.9	75.1	0	0	0	108.1
1584	C	24.7	Very low	26.6	Very low	105 Å²	105	132.3 Å²	132.3	71%	0.709	75%	0.746	S	S	*	*			trans	63	168.1	161.2	-80.4	0	0	0	0	117.5
1585	D	24.2	Very low	26.5	Very low	129 Å²	129	135.8 Å²	135.8	69%	0.69	76%	0.756	S	S	*	*			cis	-159.7	-176.9	-41.6	-130.3	-58	0	0	0	109.8
1586	H	27.4	Very low	26.3	Very low	164 Å²	164	131.7 Å²	131.7	76%	0.759	75%	0.75	S	S	*	*			trans	68.6	106.6	162.3	-69.7	-66.4	0	0	0	121.9
1587	S	23.5	Very low	26.1	Very low	107 Å²	107	129 Å²	129	75%	0.748	74%	0.742	S	S	*	*				27.8	125.7	128.9	60.1	0	0	0	0	122.7
1588	A	26.7	Very low	26.2	Very low	90 Å²	90	136.1 Å²	136.1	74%	0.744	76%	0.755	S	S	*	*				169.1	116.3	113.5	0	0	0	0	0	115.1
1589	T	26.3	Very low	25.9	Very low	118 Å²	118	133.4 Å²	133.4	72%	0.724	76%	0.758	S	S	*	*			trans	39.7	117.5	145.3	55.6	0	0	0	0	123.2
1590	N	26.4	Very low	25.6	Very low	150 Å²	150	133.3 Å²	133.3	80%	0.802	76%	0.761	S	S	*	*			trans	73.5	156.5	131.3	-60.6	-1.2	0	0	0	120.2
1591	P	31.7	Very low	25.8	Very low	112 Å²	112	132.7 Å²	132.7	73%	0.727	76%	0.757	S	S	*	*			cis	-137.3	143.5	-49.2	37	-21.9	0	0	0	112.9
1592	C	27.9	Very low	25.5	Very low	131 Å²	131	132.8 Å²	132.8	89%	0.885	77%	0.765	S	S	*	*			trans	-156.5	141.4	150.9	-105.6	0	0	0	0	112.9
1593	E	25.1	Very low	25.4	Very low	186 Å²	186	136 Å²	136	87%	0.869	77%	0.774	S	S	*	*			trans	-54.2	155.4	173.3	-68.9	158.8	149.4	0	0	113.5
1594	A	25.6	Very low	25.5	Very low	85 Å²	85	131.8 Å²	131.8	70%	0.702	77%	0.767	S	S	*	*			cis	-160.6	147.6	-7.3	0	0	0	0	0	111.9
1595	L	24.9	Very low	25.6	Very low	175 Å²	175	132.1 Å²	132.1	92%	0.916	77%	0.768	S	S	*	*			trans	-165.2	106	150.8	-115.2	162.5	0	0	0	109.6
1596	P	23	Very low	25.7	Very low	117 Å²	117	130.8 Å²	130.8	76%	0.76	77%	0.766	S	S	*	*			trans	-96.4	178.8	-171.1	38.1	-36.9	0	0	0	114.4
1597	D	24.5	Very low	25.5	Very low	140 Å²	140	130 Å²	130	75%	0.749	77%	0.767	S	S	*	*	S	Bend	trans	-51	153.4	173.7	-98.2	-63.4	0	0	0	116
1598	R	28.7	Very low	25.5	Very low	235 Å²	235	127.8 Å²	127.8	89%	0.887	75%	0.75	S	S	*	*			trans	42	95	150.1	-64.8	172.8	163.5	-170.6	-3.3	117.5
1599	S	20.2	Very low	25.4	Very low	114 Å²	114	131 Å²	131	80%	0.797	76%	0.755	S	S	*	*			trans	-159.4	155.1	144.2	31.2	0	0	0	0	116.6
1600	L	23.1	Very low	25.4	Very low	146 Å²	146	127.6 Å²	127.6	76%	0.764	73%	0.734	S	S	*	*			trans	-16.9	145.8	156.3	-75.8	58.2	0	0	0	118.6
1601	I	30.9	Very low	25.4	Very low	119 Å²	119	122.3 Å²	122.3	61%	0.61	71%	0.708	S	S	*	*			trans	74.2	128.9	136.1	-69.6	169.5	0	0	0	117.6	I1603	I1601-I1603 HydrophobicContact CD1-CD1 4.28Å; I1601-I1603 HydrophobicContact CG2-CB 4.35Å; I1601-I1603 HydrophobicContact CG2-CD1 3.95Å; I1601-I1603 HydrophobicContact CG2-CG1 3.78Å
1602	P	21.7	Very low	25.2	Very low	132 Å²	132	121 Å²	121	86%	0.857	70%	0.702	S	S	*	*				-117.7	143	110.3	33.4	-33.6	0	0	0	113.2
1603	I	23.4	Very low	25	Very low	151 Å²	151	119.1 Å²	119.1	77%	0.774	69%	0.69	S	S	*	*			trans	-99.4	132.2	176.4	-79.3	156.8	0	0	0	109	I1601	I1601-I1603 HydrophobicContact CD1-CD1 4.28Å; I1601-I1603 HydrophobicContact CG2-CB 4.35Å; I1601-I1603 HydrophobicContact CG2-CD1 3.95Å; I1601-I1603 HydrophobicContact CG2-CG1 3.78Å
1604	G	26.3	Very low	25.1	Very low	61 Å²	61	114.4 Å²	114.4	63%	0.629	68%	0.677	S	S	*	*			trans	78.1	-174.8	174.7	0	0	0	0	0	114.3
1605	P	26.1	Very low	25.1	Very low	113 Å²	113	116.8 Å²	116.8	73%	0.734	67%	0.672	S	S	*	*			cis	-98.1	-167.5	5.9	41.3	-33	0	0	0	111.9
1606	P	25.5	Very low	25.1	Very low	100 Å²	100	110.9 Å²	110.9	65%	0.649	65%	0.645	S	S	*	*			trans	-118.3	-176.8	-149	41.2	-29.9	0	0	0	117.2
1607	L	23.8	Very low	25.3	Very low	149 Å²	149	112.7 Å²	112.7	78%	0.78	65%	0.647	S	S	*	*			trans	76.6	168.8	162.6	-69.7	158.1	0	0	0	118.7
1608	C	22.9	Very low	25.3	Very low	59 Å²	59	111.1 Å²	111.1	40%	0.399	64%	0.636	S	S	.	*			trans	76.6	88.9	174	-56.7	0	0	0	0	118.6	Y1249	Y1249-C1608 HydrophobicContact CE2-CB 4.37Å; Y1249-C1608 WeakPolarHBondContact OH-CB 3.39Å; Y1249-C1608 PolarHBondContact OH-SG 3.28Å
1609	L	25.3	Very low	25.2	Very low	159 Å²	159	102.8 Å²	102.8	83%	0.832	61%	0.607	S	S	*	*			trans	-144.6	117.3	157.6	-92.6	-179.6	0	0	0	111.1
1610	P	26.2	Very low	25.5	Very low	46 Å²	46	103.8 Å²	103.8	30%	0.299	60%	0.603	S	S	.	*			trans	-126.8	-155.7	-174	43.5	-29.1	0	0	0	115.3	Y1273 Q1274 D1276	Y1273-P1610 VanDerWaalsContact O-CB 3.25Å; Y1273-P1610 WeakPolarHBondContact O-CB 3.46Å; Q1274-P1610 HydrophobicContact CB-CB 4.02Å; Q1274-P1610 HydrophobicContact CG-CB 3.84Å; D1276-P1610 HydrophobicContact CB-CG 4.4Å
1611	P	27.5	Very low	25.6	Very low	39 Å²	39	102.6 Å²	102.6	25%	0.253	60%	0.602	S	S	.	*				-56.7	152.9	-128.2	34.5	-33.3	0	0	0	116.5	Q1274 A1277 L1280	Q1274-P1611 HydrophobicContact CB-CG 4.38Å; Q1274-P1611 HydrophobicContact CG-CB 4.47Å; A1277-P1611 HydrophobicContact CB-CG 3.32Å; L1280-P1611 HydrophobicContact CD1-CG 4.12Å
1612	S	25.9	Very low	25.4	Very low	84 Å²	84	100.1 Å²	100.1	59%	0.587	61%	0.606	S	S	*	*			cis	81.2	88.3	35	88	0	0	0	0	116.3
1613	S	24.9	Very low	25.5	Very low	91 Å²	91	97.9 Å²	97.9	64%	0.636	59%	0.592	S	S	*	*			trans	-174.3	164.8	148.7	34.2	0	0	0	0	111.7
1614	S	26.7	Very low	25.8	Very low	87 Å²	87	99.1 Å²	99.1	61%	0.608	60%	0.599	S	S	*	*			trans	51	95.7	174.9	61.1	0	0	0	0	117.8
1615	F	26.1	Very low	25.9	Very low	135 Å²	135	101.8 Å²	101.8	59%	0.592	60%	0.598	S	S	*	*			trans	-89.5	114.4	154.8	-106.5	-71.9	0	0	0	109.3	N433 Q1619	N433-F1615 WeakPolarHBondContact OD1-CD1 3.45Å; N433-F1615 WeakPolarHBondContact OD1-CE1 3.35Å; F1615-Q1619 HydrophobicContact CE1-CB 4.47Å; F1615-Q1619 HydrophobicContact CE1-CG 4.18Å
1616	S	25.6	Very low	25.9	Very low	51 Å²	51	99.7 Å²	99.7	36%	0.357	60%	0.596	S	S	.	*			trans	-79.1	162.1	159.3	44.4	0	0	0	0	110.6
1617	I	25.8	Very low	26	Very low	156 Å²	156	99.9 Å²	99.9	80%	0.8	59%	0.591	S	S	*	*	S	Bend	trans	-53.8	154.2	-178.9	-57.6	160	0	0	0	111.5
1618	E	25.9	Very low	26.3	Very low	107 Å²	107	100 Å²	100	50%	0.5	58%	0.581	S	S	.	*			trans	83.9	62	176.6	-51.2	-156.4	153.9	0	0	119.7
1619	Q	26.1	Very low	26.6	Very low	60 Å²	60	102.3 Å²	102.3	28%	0.28	60%	0.598	S	S	.	*			trans	-125.2	76	155.9	-70.8	-146.1	6.2	0	0	113.9	F1615 T1621	F1615-Q1619 HydrophobicContact CE1-CB 4.47Å; F1615-Q1619 HydrophobicContact CE1-CG 4.18Å; Q1619-T1621 VanDerWaalsContact C-N 3.31Å; Q1619-T1621 PolarHBondContact O-N 3.06Å
1620	N	25.5	Very low	26.8	Very low	135 Å²	135	98.8 Å²	98.8	72%	0.722	59%	0.591	S	S	*	*			trans	-77.9	63.1	-177.1	-134.3	-22.3	0	0	0	113.5	G1622	N1620-G1622 PolarHBondContact O-N 3.15Å
1621	T	25.2	Very low	26.9	Very low	120 Å²	120	99.8 Å²	99.8	74%	0.736	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	48.5	175.8	41.5	0	0	0	0	113.5	Q1619	Q1619-T1621 VanDerWaalsContact C-N 3.31Å; Q1619-T1621 PolarHBondContact O-N 3.06Å
1622	G	26.9	Very low	27.2	Very low	67 Å²	67	98.4 Å²	98.4	69%	0.691	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.3	-7.1	174.5	0	0	0	0	0	115	N1620	N1620-G1622 PolarHBondContact O-N 3.15Å
1623	C	24.6	Very low	27.8	Very low	86 Å²	86	99.6 Å²	99.6	58%	0.581	58%	0.582	S	S	*	*			trans	-107.1	25.1	-163.9	-75.8	0	0	0	0	117.1	L1625 G1626	C1623-L1625 PolarHBondContact O-N 2.97Å; C1623-G1626 PolarHBondContact O-N 3.4Å
1624	I	28.6	Very low	28.3	Very low	176 Å²	176	103 Å²	103	90%	0.903	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	55.7	169.4	-50.5	-179.9	0	0	0	110.8
1625	L	28.6	Very low	28.8	Very low	118 Å²	118	101.2 Å²	101.2	62%	0.618	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.4	13.5	158.4	-109.1	158.8	0	0	0	111.4	C1623 I1627 H1636	C1623-L1625 PolarHBondContact O-N 2.97Å; L1625-I1627 PolarHBondContact O-N 2.99Å; L1625-H1636 VanDerWaalsContact CD2-CE1 3.46Å; L1625-H1636 WeakPolarHBondContact CD2-CE1 3.43Å
1626	G	26.4	Very low	29.5	Very low	68 Å²	68	98.8 Å²	98.8	70%	0.701	56%	0.563	S	S	*	*			trans	-74.9	31.7	179.1	0	0	0	0	0	114.9	C1623 R1628	C1623-G1626 PolarHBondContact O-N 3.4Å; G1626-R1628 PolarHBondContact O-N 3.46Å
1627	I	28.4	Very low	30.3	Very low	104 Å²	104	101.1 Å²	101.1	53%	0.533	57%	0.565	S	S	.	*	S	Bend	trans	-67.1	111.7	172.5	-45.4	-179.2	0	0	0	107.4	L1625 C1632	L1625-I1627 PolarHBondContact O-N 2.99Å; I1627-C1632 HydrophobicContact CB-CB 4.15Å; I1627-C1632 HydrophobicContact CG2-CB 3.93Å; I1627-C1632 WeakPolarHBondContact CG2-SG 3.46Å; I1627-C1632 VanDerWaalsContact O-CB 3.24Å; I1627-C1632 WeakPolarHBondContact O-CB 3.35Å
1628	R	29.6	Very low	31.6	Very low	153 Å²	153	98.6 Å²	98.6	58%	0.577	55%	0.552	S	S	*	*			trans	40.1	84.8	161.6	-58.3	154.1	144.7	-168.9	-0	114.7	G1626 A1630 C1631 C1632 R1633	G1626-R1628 PolarHBondContact O-N 3.46Å; R1628-A1630 PolarHBondContact O-N 2.83Å; R1628-C1631 HydrophobicContact CB-CB 3.83Å; R1628-C1631 HydrophobicContact CG-CB 4.03Å; R1628-C1631 VanDerWaalsContact CZ-SG 3.58Å; R1628-C1631 PolarHBondContact O-N 2.86Å; R1628-C1631 VanDerWaalsContact O-N 3.15Å; R1628-C1632 HydrophobicContact CB-CB 3.89Å; R1628-C1632 WeakPolarHBondContact CD-SG 3.45Å; R1628-C1632 WeakPolarHBondContact O-CA 3.44Å; R1628-C1632 PolarHBondContact O-N 2.94Å; R1628-R1633 PolarHBondContact O-N 3.08Å
1629	S	29.1	Very low	32.6	Very low	106 Å²	106	97.1 Å²	97.1	74%	0.741	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	-33.9	172.8	57.7	0	0	0	0	113.5	R1633	S1629-R1633 WeakPolarHBondContact O-CB 3.41Å; S1629-R1633 WeakPolarHBondContact O-CD 3.46Å; S1629-R1633 WeakPolarHBondContact O-CG 3.45Å
1630	A	30.1	Very low	33.6	Very low	85 Å²	85	97.9 Å²	97.9	70%	0.702	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-46.3	172.7	0	0	0	0	0	114.4	R1628	R1628-A1630 PolarHBondContact O-N 2.83Å
1631	C	28.2	Very low	35.3	Very low	68 Å²	68	95.2 Å²	95.2	46%	0.459	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102	-9.4	-166.9	-167.1	0	0	0	0	115	R1628	R1628-C1631 HydrophobicContact CB-CB 3.83Å; R1628-C1631 HydrophobicContact CG-CB 4.03Å; R1628-C1631 VanDerWaalsContact CZ-SG 3.58Å; R1628-C1631 PolarHBondContact O-N 2.86Å; R1628-C1631 VanDerWaalsContact O-N 3.15Å
1632	C	33.8	Very low	37.1	Very low	9 Å²	9	94 Å²	94	6%	0.061	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	3.1	166.7	-79.7	0	0	0	0	112.8	I1627 R1628 K1634 S1635 H1636	I1627-C1632 HydrophobicContact CB-CB 4.15Å; I1627-C1632 HydrophobicContact CG2-CB 3.93Å; I1627-C1632 WeakPolarHBondContact CG2-SG 3.46Å; I1627-C1632 VanDerWaalsContact O-CB 3.24Å; I1627-C1632 WeakPolarHBondContact O-CB 3.35Å; R1628-C1632 HydrophobicContact CB-CB 3.89Å; R1628-C1632 WeakPolarHBondContact CD-SG 3.45Å; R1628-C1632 WeakPolarHBondContact O-CA 3.44Å; R1628-C1632 PolarHBondContact O-N 2.94Å; C1632-K1634 PolarHBondContact O-N 3.12Å; C1632-S1635 WeakPolarHBondContact CB-OG 3.41Å; C1632-S1635 PolarHBondContact O-N 3.01Å; C1632-S1635 PolarHBondContact O-OG 3.03Å; C1632-S1635 PolarHBondContact SG-OG 2.88Å; C1632-H1636 WeakPolarHBondContact O-CB 3.22Å; C1632-H1636 PolarHBondContact O-CD2 3.08Å; C1632-H1636 PolarHBondContact O-N 3.37Å
1633	R	37.4	Very low	38.4	Very low	110 Å²	110	92 Å²	92	42%	0.415	52%	0.521	S	S	.	.	H	α-helix	trans	-46.9	-39.9	148.8	-107.4	176	-172.9	174	3.2	110.7	R1628 S1629 Y1637	R1628-R1633 PolarHBondContact O-N 3.08Å; S1629-R1633 WeakPolarHBondContact O-CB 3.41Å; S1629-R1633 WeakPolarHBondContact O-CD 3.46Å; S1629-R1633 WeakPolarHBondContact O-CG 3.45Å; R1633-Y1637 VanDerWaalsContact O-CB 3.31Å; R1633-Y1637 WeakPolarHBondContact O-CB 3.49Å; R1633-Y1637 WeakPolarHBondContact O-CD2 3.47Å; R1633-Y1637 PolarHBondContact O-N 2.96Å
1634	K	35.2	Very low	40	Very low	161 Å²	161	90.8 Å²	90.8	70%	0.7	51%	0.506	S	S	*	.	H	α-helix	trans	-65.8	-44.5	171.4	-82.5	-174.1	174.5	178.2	0	114.5	C1632 Y1637 I1638	C1632-K1634 PolarHBondContact O-N 3.12Å; K1634-Y1637 PolarHBondContact O-N 3.39Å; K1634-I1638 WeakPolarHBondContact O-CB 3.45Å; K1634-I1638 WeakPolarHBondContact O-CD1 3.32Å; K1634-I1638 VanDerWaalsContact O-CG1 3.23Å; K1634-I1638 WeakPolarHBondContact O-CG1 3.46Å; K1634-I1638 PolarHBondContact O-N 2.88Å
1635	S	38.3	Very low	41.7	Very low	51 Å²	51	84.3 Å²	84.3	36%	0.357	48%	0.475	S	S	.	.	H	α-helix	trans	-77.8	-27.4	-179.3	73.2	0	0	0	0	113.3	C1632 S1639	C1632-S1635 WeakPolarHBondContact CB-OG 3.41Å; C1632-S1635 PolarHBondContact O-N 3.01Å; C1632-S1635 PolarHBondContact O-OG 3.03Å; C1632-S1635 PolarHBondContact SG-OG 2.88Å; S1635-S1639 WeakPolarHBondContact O-CB 3.38Å; S1635-S1639 PolarHBondContact O-N 3.3Å
1636	H	39.9	Very low	43.4	Very low	83 Å²	83	81.6 Å²	81.6	38%	0.384	46%	0.463	S	S	.	.	H	α-helix	trans	-74.1	-33.7	168.5	-77.1	-73.9	0	0	0	111.4	L1625 C1632 S1640	L1625-H1636 VanDerWaalsContact CD2-CE1 3.46Å; L1625-H1636 WeakPolarHBondContact CD2-CE1 3.43Å; C1632-H1636 WeakPolarHBondContact O-CB 3.22Å; C1632-H1636 PolarHBondContact O-CD2 3.08Å; C1632-H1636 PolarHBondContact O-N 3.37Å; H1636-S1640 WeakPolarHBondContact O-CA 3.36Å; H1636-S1640 WeakPolarHBondContact O-CB 3.4Å; H1636-S1640 PolarHBondContact O-N 2.78Å
1637	Y	43.5	Very low	45	Very low	101 Å²	101	81.8 Å²	81.8	40%	0.396	45%	0.447	S	S	.	.	H	α-helix	trans	-60.6	-51.8	164.4	-108.7	-95.7	0	0	0	111.3	R1633 K1634 S1639 S1640 V1641 I1868	R1633-Y1637 VanDerWaalsContact O-CB 3.31Å; R1633-Y1637 WeakPolarHBondContact O-CB 3.49Å; R1633-Y1637 WeakPolarHBondContact O-CD2 3.47Å; R1633-Y1637 PolarHBondContact O-N 2.96Å; K1634-Y1637 PolarHBondContact O-N 3.39Å; Y1637-S1639 VanDerWaalsContact C-N 3.35Å; Y1637-S1639 PolarHBondContact O-N 3.09Å; Y1637-S1640 PolarHBondContact O-N 3.28Å; Y1637-V1641 VanDerWaalsContact O-CB 3.29Å; Y1637-V1641 WeakPolarHBondContact O-CB 3.2Å; Y1637-V1641 VanDerWaalsContact O-CG2 3.24Å; Y1637-V1641 WeakPolarHBondContact O-CG2 3.44Å; Y1637-V1641 PolarHBondContact O-N 3.41Å; Y1637-I1868 WeakPolarHBondContact OH-CG2 2.97Å
1638	I	52.6	Low	46.8	Very low	102 Å²	102	79.1 Å²	79.1	52%	0.523	44%	0.436	S	S	.	.	H	α-helix	trans	-62.7	-41.2	-179.4	-69.8	162.2	0	0	0	111	K1634 I1642	K1634-I1638 WeakPolarHBondContact O-CB 3.45Å; K1634-I1638 WeakPolarHBondContact O-CD1 3.32Å; K1634-I1638 VanDerWaalsContact O-CG1 3.23Å; K1634-I1638 WeakPolarHBondContact O-CG1 3.46Å; K1634-I1638 PolarHBondContact O-N 2.88Å; I1638-I1642 HydrophobicContact CG2-CD1 3.64Å; I1638-I1642 HydrophobicContact CG2-CG1 4.39Å; I1638-I1642 VanDerWaalsContact O-CB 3.25Å; I1638-I1642 WeakPolarHBondContact O-CB 3.28Å; I1638-I1642 WeakPolarHBondContact O-CG1 3.35Å; I1638-I1642 PolarHBondContact O-N 3.22Å
1639	S	46.3	Very low	48.4	Very low	77 Å²	77	75 Å²	75	54%	0.538	42%	0.424	S	S	.	.	H	α-helix	trans	-73.4	-30.3	177	-170.7	0	0	0	0	113.1	S1635 Y1637 G1643	S1635-S1639 WeakPolarHBondContact O-CB 3.38Å; S1635-S1639 PolarHBondContact O-N 3.3Å; Y1637-S1639 VanDerWaalsContact C-N 3.35Å; Y1637-S1639 PolarHBondContact O-N 3.09Å; S1639-G1643 WeakPolarHBondContact O-CA 3.49Å; S1639-G1643 PolarHBondContact O-N 3.03Å
1640	S	48.3	Very low	49.9	Very low	76 Å²	76	73.3 Å²	73.3	53%	0.531	41%	0.407	S	S	.	.	H	α-helix	trans	-74	-40.3	173	-179.2	0	0	0	0	110.6	H1636 Y1637 G1643 F1644	H1636-S1640 WeakPolarHBondContact O-CA 3.36Å; H1636-S1640 WeakPolarHBondContact O-CB 3.4Å; H1636-S1640 PolarHBondContact O-N 2.78Å; Y1637-S1640 PolarHBondContact O-N 3.28Å; S1640-G1643 PolarHBondContact O-N 2.91Å; S1640-F1644 WeakPolarHBondContact O-CA 3.43Å; S1640-F1644 WeakPolarHBondContact O-CB 3.3Å; S1640-F1644 PolarHBondContact O-N 2.85Å
1641	V	59.3	Low	51.2	Low	79 Å²	79	75 Å²	75	48%	0.479	40%	0.399	S	S	.	.	H	α-helix	trans	-68.8	-39.4	174	170.6	0	0	0	0	111.3	Y1637 T1645	Y1637-V1641 VanDerWaalsContact O-CB 3.29Å; Y1637-V1641 WeakPolarHBondContact O-CB 3.2Å; Y1637-V1641 VanDerWaalsContact O-CG2 3.24Å; Y1637-V1641 WeakPolarHBondContact O-CG2 3.44Å; Y1637-V1641 PolarHBondContact O-N 3.41Å; V1641-T1645 VanDerWaalsContact O-CB 3.31Å; V1641-T1645 WeakPolarHBondContact O-CB 3.39Å; V1641-T1645 WeakPolarHBondContact O-CG2 3.34Å; V1641-T1645 PolarHBondContact O-N 3.48Å; V1641-T1645 PolarHBondContact O-OG1 3.3Å
1642	I	64.5	Low	52.6	Low	94 Å²	94	73 Å²	73	48%	0.482	39%	0.389	S	S	.	.	H	α-helix	trans	-67.3	-44.8	171.8	-71.5	168.5	0	0	0	110.3	I1638 F1644 T1645 V1646	I1638-I1642 HydrophobicContact CG2-CD1 3.64Å; I1638-I1642 HydrophobicContact CG2-CG1 4.39Å; I1638-I1642 VanDerWaalsContact O-CB 3.25Å; I1638-I1642 WeakPolarHBondContact O-CB 3.28Å; I1638-I1642 WeakPolarHBondContact O-CG1 3.35Å; I1638-I1642 PolarHBondContact O-N 3.22Å; I1642-F1644 PolarHBondContact O-N 2.98Å; I1642-T1645 WeakPolarHBondContact CA-OG1 3.35Å; I1642-T1645 PolarHBondContact O-N 3.37Å; I1642-T1645 PolarHBondContact O-OG1 3.12Å; I1642-V1646 HydrophobicContact CG2-CG2 4.39Å; I1642-V1646 VanDerWaalsContact O-CB 3.27Å; I1642-V1646 WeakPolarHBondContact O-CB 3.46Å; I1642-V1646 VanDerWaalsContact O-CG2 3.23Å; I1642-V1646 WeakPolarHBondContact O-CG2 3.18Å; I1642-V1646 PolarHBondContact O-N 3.13Å
1643	G	52.6	Low	53.9	Low	25 Å²	25	76.3 Å²	76.3	26%	0.258	41%	0.406	S	S	.	.	H	α-helix	trans	-61.4	-43.5	175.9	0	0	0	0	0	112.3	S1639 S1640 V1646 I1647	S1639-G1643 WeakPolarHBondContact O-CA 3.49Å; S1639-G1643 PolarHBondContact O-N 3.03Å; S1640-G1643 PolarHBondContact O-N 2.91Å; G1643-V1646 PolarHBondContact O-N 3.1Å; G1643-I1647 WeakPolarHBondContact O-CB 3.48Å; G1643-I1647 WeakPolarHBondContact O-CD1 3.37Å; G1643-I1647 WeakPolarHBondContact O-CG1 3.27Å; G1643-I1647 PolarHBondContact O-N 3.05Å
1644	F	60.1	Low	54.5	Low	61 Å²	61	74.2 Å²	74.2	27%	0.268	41%	0.406	S	S	.	.	H	α-helix	trans	-71.8	-39.5	178.7	-172.7	-96.1	0	0	0	112	S1640 I1642 I1647 V1648 I1879	S1640-F1644 WeakPolarHBondContact O-CA 3.43Å; S1640-F1644 WeakPolarHBondContact O-CB 3.3Å; S1640-F1644 PolarHBondContact O-N 2.85Å; I1642-F1644 PolarHBondContact O-N 2.98Å; F1644-I1647 PolarHBondContact O-N 3.39Å; F1644-V1648 HydrophobicContact CD1-CG2 4.05Å; F1644-V1648 HydrophobicContact CE1-CG2 3.82Å; F1644-V1648 HydrophobicContact CZ-CG2 4.21Å; F1644-V1648 WeakPolarHBondContact O-CB 3.39Å; F1644-V1648 VanDerWaalsContact O-CG2 3.27Å; F1644-V1648 WeakPolarHBondContact O-CG2 3.49Å; F1644-V1648 PolarHBondContact O-N 2.95Å; F1644-I1879 HydrophobicContact CE2-CD1 4.34Å; F1644-I1879 HydrophobicContact CZ-CD1 3.63Å
1645	T	63.6	Low	55.1	Low	40 Å²	40	69.5 Å²	69.5	25%	0.245	39%	0.388	C	S	.	.	H	α-helix	trans	-67.9	-37.8	171.8	49.2	0	0	0	0	111.6	I860 V1641 I1642 V1648 L1649	I860-T1645 HydrophobicContact CG2-CG2 4.46Å; V1641-T1645 VanDerWaalsContact O-CB 3.31Å; V1641-T1645 WeakPolarHBondContact O-CB 3.39Å; V1641-T1645 WeakPolarHBondContact O-CG2 3.34Å; V1641-T1645 PolarHBondContact O-N 3.48Å; V1641-T1645 PolarHBondContact O-OG1 3.3Å; I1642-T1645 WeakPolarHBondContact CA-OG1 3.35Å; I1642-T1645 PolarHBondContact O-N 3.37Å; I1642-T1645 PolarHBondContact O-OG1 3.12Å; T1645-V1648 PolarHBondContact O-N 3.34Å; T1645-L1649 WeakPolarHBondContact O-CB 3.28Å; T1645-L1649 PolarHBondContact O-N 2.76Å
1646	V	65.1	Low	55.7	Low	60 Å²	60	71.5 Å²	71.5	36%	0.364	40%	0.397	S	S	.	.	H	α-helix	trans	-64.7	-38.2	171	168	0	0	0	0	111.3	I1642 G1643 L1649 L1650	I1642-V1646 HydrophobicContact CG2-CG2 4.39Å; I1642-V1646 VanDerWaalsContact O-CB 3.27Å; I1642-V1646 WeakPolarHBondContact O-CB 3.46Å; I1642-V1646 VanDerWaalsContact O-CG2 3.23Å; I1642-V1646 WeakPolarHBondContact O-CG2 3.18Å; I1642-V1646 PolarHBondContact O-N 3.13Å; G1643-V1646 PolarHBondContact O-N 3.1Å; V1646-L1649 PolarHBondContact O-N 3.05Å; V1646-L1650 HydrophobicContact CG1-CD1 3.79Å; V1646-L1650 HydrophobicContact CG1-CG 4.27Å; V1646-L1650 VanDerWaalsContact O-CB 3.25Å; V1646-L1650 WeakPolarHBondContact O-CB 3.28Å; V1646-L1650 VanDerWaalsContact O-CG 3.24Å; V1646-L1650 WeakPolarHBondContact O-CG 3.47Å; V1646-L1650 PolarHBondContact O-N 3.07Å
1647	I	59.5	Low	55.9	Low	73 Å²	73	74.2 Å²	74.2	37%	0.374	41%	0.41	S	S	.	.	H	α-helix	trans	-66.4	-44.4	172.7	-73.4	163.9	0	0	0	110.7	G1643 F1644 L1649 L1650 F1651	G1643-I1647 WeakPolarHBondContact O-CB 3.48Å; G1643-I1647 WeakPolarHBondContact O-CD1 3.37Å; G1643-I1647 WeakPolarHBondContact O-CG1 3.27Å; G1643-I1647 PolarHBondContact O-N 3.05Å; F1644-I1647 PolarHBondContact O-N 3.39Å; I1647-L1649 VanDerWaalsContact C-N 3.3Å; I1647-L1649 PolarHBondContact O-N 3.06Å; I1647-L1650 PolarHBondContact O-N 2.8Å; I1647-F1651 WeakPolarHBondContact O-CA 3.48Å; I1647-F1651 WeakPolarHBondContact O-CB 3.41Å; I1647-F1651 PolarHBondContact O-N 2.63Å
1648	V	66	Low	55.6	Low	48 Å²	48	76.9 Å²	76.9	29%	0.291	43%	0.428	S	S	.	.	H	α-helix	trans	-66.5	-30.6	176.2	168.8	0	0	0	0	111.8	Y864 F1644 T1645 G1652	Y864-V1648 HydrophobicContact CD2-CG1 4.14Å; Y864-V1648 HydrophobicContact CE2-CG1 4.28Å; F1644-V1648 HydrophobicContact CD1-CG2 4.05Å; F1644-V1648 HydrophobicContact CE1-CG2 3.82Å; F1644-V1648 HydrophobicContact CZ-CG2 4.21Å; F1644-V1648 WeakPolarHBondContact O-CB 3.39Å; F1644-V1648 VanDerWaalsContact O-CG2 3.27Å; F1644-V1648 WeakPolarHBondContact O-CG2 3.49Å; F1644-V1648 PolarHBondContact O-N 2.95Å; T1645-V1648 PolarHBondContact O-N 3.34Å; V1648-G1652 VanDerWaalsContact O-CA 3.24Å; V1648-G1652 WeakPolarHBondContact O-CA 3.43Å; V1648-G1652 PolarHBondContact O-N 2.85Å
1649	L	63.4	Low	54.8	Low	65 Å²	65	79.1 Å²	79.1	34%	0.34	43%	0.431	S	S	.	.	H	α-helix	trans	-77.8	-39.2	174.8	-152.9	-170.1	0	0	0	111.2	I860 T1645 V1646 I1647 G1652 L1653	I860-L1649 HydrophobicContact CD1-CD1 3.46Å; I860-L1649 VanDerWaalsContact CD1-CD1 3.46Å; I860-L1649 HydrophobicContact CD1-CG 4.26Å; I860-L1649 HydrophobicContact CG1-CD1 3.97Å; I860-L1649 HydrophobicContact CG1-CG 4.27Å; T1645-L1649 WeakPolarHBondContact O-CB 3.28Å; T1645-L1649 PolarHBondContact O-N 2.76Å; V1646-L1649 PolarHBondContact O-N 3.05Å; I1647-L1649 VanDerWaalsContact C-N 3.3Å; I1647-L1649 PolarHBondContact O-N 3.06Å; L1649-G1652 CarbonylContact O-C 3.6Å; L1649-G1652 PolarHBondContact O-N 2.9Å; L1649-L1653 HydrophobicContact CD2-CD1 3.55Å; L1649-L1653 HydrophobicContact CD2-CG 3.76Å; L1649-L1653 VanDerWaalsContact O-CB 3.28Å; L1649-L1653 WeakPolarHBondContact O-CB 3.41Å; L1649-L1653 VanDerWaalsContact O-CG 3.29Å; L1649-L1653 WeakPolarHBondContact O-CG 3.23Å; L1649-L1653 PolarHBondContact O-N 2.91Å
1650	L	60.6	Low	54.1	Low	72 Å²	72	83.3 Å²	83.3	38%	0.377	44%	0.44	S	S	.	.	H	α-helix	trans	-70.7	-46	174.9	-76	171.5	0	0	0	111.5	T995 V1646 I1647 G1652 L1653 V1654	T995-L1650 HydrophobicContact CG2-CD1 3.75Å; V1646-L1650 HydrophobicContact CG1-CD1 3.79Å; V1646-L1650 HydrophobicContact CG1-CG 4.27Å; V1646-L1650 VanDerWaalsContact O-CB 3.25Å; V1646-L1650 WeakPolarHBondContact O-CB 3.28Å; V1646-L1650 VanDerWaalsContact O-CG 3.24Å; V1646-L1650 WeakPolarHBondContact O-CG 3.47Å; V1646-L1650 PolarHBondContact O-N 3.07Å; I1647-L1650 PolarHBondContact O-N 2.8Å; L1650-G1652 VanDerWaalsContact C-N 3.27Å; L1650-G1652 PolarHBondContact O-N 3.44Å; L1650-L1653 PolarHBondContact O-N 3.46Å; L1650-V1654 WeakPolarHBondContact O-CB 3.29Å; L1650-V1654 WeakPolarHBondContact O-CG2 3.26Å; L1650-V1654 PolarHBondContact O-N 2.8Å
1651	F	56.6	Low	53.3	Low	120 Å²	120	83.2 Å²	83.2	53%	0.526	44%	0.437	S	S	.	.	H	α-helix	trans	-65.6	-34.6	172.5	-154.5	-91.4	0	0	0	110.3	I1647 L1655	I1647-F1651 WeakPolarHBondContact O-CA 3.48Å; I1647-F1651 WeakPolarHBondContact O-CB 3.41Å; I1647-F1651 PolarHBondContact O-N 2.63Å; F1651-L1655 HydrophobicContact CD1-CD1 3.68Å; F1651-L1655 HydrophobicContact CD1-CG 4.06Å; F1651-L1655 HydrophobicContact CE1-CD1 3.98Å; F1651-L1655 HydrophobicContact CE1-CG 4.22Å; F1651-L1655 WeakPolarHBondContact O-CB 3.05Å; F1651-L1655 WeakPolarHBondContact O-CG 3.29Å; F1651-L1655 PolarHBondContact O-N 2.77Å
1652	G	57.9	Low	51.9	Low	26 Å²	26	88.9 Å²	88.9	27%	0.268	46%	0.458	S	S	.	.	H	α-helix	trans	-66.5	-35.1	170.1	0	0	0	0	0	113.7	V1648 L1649 L1650 V1656	V1648-G1652 VanDerWaalsContact O-CA 3.24Å; V1648-G1652 WeakPolarHBondContact O-CA 3.43Å; V1648-G1652 PolarHBondContact O-N 2.85Å; L1649-G1652 CarbonylContact O-C 3.6Å; L1649-G1652 PolarHBondContact O-N 2.9Å; L1650-G1652 VanDerWaalsContact C-N 3.27Å; L1650-G1652 PolarHBondContact O-N 3.44Å; G1652-V1656 VanDerWaalsContact O-CB 3.31Å; G1652-V1656 WeakPolarHBondContact O-CB 3.37Å; G1652-V1656 VanDerWaalsContact O-CG2 3.22Å; G1652-V1656 WeakPolarHBondContact O-CG2 3.49Å; G1652-V1656 PolarHBondContact O-N 2.78Å
1653	L	60.3	Low	50.2	Low	79 Å²	79	88.4 Å²	88.4	41%	0.414	46%	0.459	S	S	.	.	H	α-helix	trans	-76.1	-38.4	174.3	-82.9	169.9	0	0	0	112	L1649 L1650 V1656 Q1657	L1649-L1653 HydrophobicContact CD2-CD1 3.55Å; L1649-L1653 HydrophobicContact CD2-CG 3.76Å; L1649-L1653 VanDerWaalsContact O-CB 3.28Å; L1649-L1653 WeakPolarHBondContact O-CB 3.41Å; L1649-L1653 VanDerWaalsContact O-CG 3.29Å; L1649-L1653 WeakPolarHBondContact O-CG 3.23Å; L1649-L1653 PolarHBondContact O-N 2.91Å; L1650-L1653 PolarHBondContact O-N 3.46Å; L1653-V1656 CarbonylContact O-C 3.58Å; L1653-V1656 PolarHBondContact O-N 3.26Å; L1653-Q1657 VanDerWaalsContact O-CB 3.31Å; L1653-Q1657 WeakPolarHBondContact O-CB 3.14Å; L1653-Q1657 VanDerWaalsContact O-CG 3.22Å; L1653-Q1657 WeakPolarHBondContact O-CG 3.18Å; L1653-Q1657 PolarHBondContact O-N 3.39Å
1654	V	50.5	Low	49	Very low	66 Å²	66	91.4 Å²	91.4	40%	0.4	48%	0.482	S	S	.	.	H	α-helix	trans	-64.7	-43.5	171.3	169.5	0	0	0	0	109.7	L1650 Q1657 M1658	L1650-V1654 WeakPolarHBondContact O-CB 3.29Å; L1650-V1654 WeakPolarHBondContact O-CG2 3.26Å; L1650-V1654 PolarHBondContact O-N 2.8Å; V1654-Q1657 PolarHBondContact O-N 2.99Å; V1654-M1658 HydrophobicContact CG1-CE 4.19Å; V1654-M1658 HydrophobicContact CG1-SD 4.14Å; V1654-M1658 WeakPolarHBondContact O-CB 3.34Å; V1654-M1658 WeakPolarHBondContact O-CG 3.09Å; V1654-M1658 PolarHBondContact O-N 3.19Å
1655	L	48.4	Very low	47.5	Very low	62 Å²	62	93.3 Å²	93.3	33%	0.325	50%	0.498	S	S	.	.	H	α-helix	trans	-59.1	-47.9	169.3	-77	169.3	0	0	0	110.8	F1651 Q1657 M1658 Y1659	F1651-L1655 HydrophobicContact CD1-CD1 3.68Å; F1651-L1655 HydrophobicContact CD1-CG 4.06Å; F1651-L1655 HydrophobicContact CE1-CD1 3.98Å; F1651-L1655 HydrophobicContact CE1-CG 4.22Å; F1651-L1655 WeakPolarHBondContact O-CB 3.05Å; F1651-L1655 WeakPolarHBondContact O-CG 3.29Å; F1651-L1655 PolarHBondContact O-N 2.77Å; L1655-Q1657 VanDerWaalsContact C-N 3.26Å; L1655-Q1657 PolarHBondContact O-N 2.89Å; L1655-M1658 PolarHBondContact O-N 2.85Å; L1655-Y1659 HydrophobicContact CB-CD2 4.45Å; L1655-Y1659 HydrophobicContact CD2-CD2 3.86Å; L1655-Y1659 HydrophobicContact CD2-CE2 3.65Å; L1655-Y1659 WeakPolarHBondContact O-CA 3.38Å; L1655-Y1659 WeakPolarHBondContact O-CB 3.44Å; L1655-Y1659 WeakPolarHBondContact O-CD2 3.41Å; L1655-Y1659 PolarHBondContact O-N 2.93Å
1656	V	50.6	Low	46	Very low	93 Å²	93	96.5 Å²	96.5	56%	0.564	52%	0.52	S	S	*	.	H	α-helix	trans	-67	-23.8	177.7	164.2	0	0	0	0	113.3	G1652 L1653 K1660	G1652-V1656 VanDerWaalsContact O-CB 3.31Å; G1652-V1656 WeakPolarHBondContact O-CB 3.37Å; G1652-V1656 VanDerWaalsContact O-CG2 3.22Å; G1652-V1656 WeakPolarHBondContact O-CG2 3.49Å; G1652-V1656 PolarHBondContact O-N 2.78Å; L1653-V1656 CarbonylContact O-C 3.58Å; L1653-V1656 PolarHBondContact O-N 3.26Å; V1656-K1660 WeakPolarHBondContact O-CB 3.35Å; V1656-K1660 PolarHBondContact O-N 2.85Å
1657	Q	43.3	Very low	44.1	Very low	140 Å²	140	103.1 Å²	103.1	65%	0.654	54%	0.544	S	S	*	.	H	α-helix	trans	-80.2	-35.9	172.9	-75.3	174.6	4.3	0	0	112.2	L1653 V1654 L1655	L1653-Q1657 VanDerWaalsContact O-CB 3.31Å; L1653-Q1657 WeakPolarHBondContact O-CB 3.14Å; L1653-Q1657 VanDerWaalsContact O-CG 3.22Å; L1653-Q1657 WeakPolarHBondContact O-CG 3.18Å; L1653-Q1657 PolarHBondContact O-N 3.39Å; V1654-Q1657 PolarHBondContact O-N 2.99Å; L1655-Q1657 VanDerWaalsContact C-N 3.26Å; L1655-Q1657 PolarHBondContact O-N 2.89Å
1658	M	38.4	Very low	42.5	Very low	157 Å²	157	107.7 Å²	107.7	77%	0.773	56%	0.561	S	S	*	*	H	α-helix	trans	-84.2	-31.9	176.3	-68.3	-174.6	172.7	0	0	113.4	V1654 L1655 K1660	V1654-M1658 HydrophobicContact CG1-CE 4.19Å; V1654-M1658 HydrophobicContact CG1-SD 4.14Å; V1654-M1658 WeakPolarHBondContact O-CB 3.34Å; V1654-M1658 WeakPolarHBondContact O-CG 3.09Å; V1654-M1658 PolarHBondContact O-N 3.19Å; L1655-M1658 PolarHBondContact O-N 2.85Å; M1658-K1660 VanDerWaalsContact C-N 3.29Å
1659	Y	35.8	Very low	40.6	Very low	148 Å²	148	112.3 Å²	112.3	58%	0.58	58%	0.583	S	S	*	*	S	Bend	trans	-89.3	18	169.6	-79.1	-96.4	0	0	0	112.4	L1655 P1661	L1655-Y1659 HydrophobicContact CB-CD2 4.45Å; L1655-Y1659 HydrophobicContact CD2-CD2 3.86Å; L1655-Y1659 HydrophobicContact CD2-CE2 3.65Å; L1655-Y1659 WeakPolarHBondContact O-CA 3.38Å; L1655-Y1659 WeakPolarHBondContact O-CB 3.44Å; L1655-Y1659 WeakPolarHBondContact O-CD2 3.41Å; L1655-Y1659 PolarHBondContact O-N 2.93Å; Y1659-P1661 WeakPolarHBondContact O-CD 3.46Å; Y1659-P1661 WeakPolarHBondContact O-CG 3.25Å
1660	K	31.8	Very low	38.9	Very low	166 Å²	166	114.2 Å²	114.2	72%	0.722	60%	0.601	S	S	*	*			trans	-77.4	91.8	163.2	-133.5	-179	-175.5	-177.1	0	106.7	V1656 M1658	V1656-K1660 WeakPolarHBondContact O-CB 3.35Å; V1656-K1660 PolarHBondContact O-N 2.85Å; M1658-K1660 VanDerWaalsContact C-N 3.29Å
1661	P	32.1	Very low	37.4	Very low	73 Å²	73	116.6 Å²	116.6	47%	0.474	62%	0.621	S	S	.	*			trans	-80.7	153.6	-160.3	5.1	14.6	0	0	0	109	Y1659 V1663	Y1659-P1661 WeakPolarHBondContact O-CD 3.46Å; Y1659-P1661 WeakPolarHBondContact O-CG 3.25Å; P1661-V1663 HydrophobicContact CB-CG2 3.88Å; P1661-V1663 HydrophobicContact CG-CG2 4.02Å; P1661-V1663 PolarHBondContact O-N 3.31Å
1662	H	28.1	Very low	36.6	Very low	198 Å²	198	116.3 Å²	116.3	92%	0.917	63%	0.631	S	S	*	*			trans	-70.2	69.5	169.4	-81.2	-50.2	0	0	0	111.3	A1664	H1662-A1664 PolarHBondContact O-N 2.95Å; H1662-A1664 VanDerWaalsContact O-N 3.12Å
1663	V	28.7	Very low	35.1	Very low	84 Å²	84	121.2 Å²	121.2	51%	0.509	66%	0.656	S	S	.	*			trans	-87	57.1	170.2	-164	0	0	0	0	109.4	P1661 T1665	P1661-V1663 HydrophobicContact CB-CG2 3.88Å; P1661-V1663 HydrophobicContact CG-CG2 4.02Å; P1661-V1663 PolarHBondContact O-N 3.31Å; V1663-T1665 HydrophobicContact CG1-CG2 3.8Å; V1663-T1665 PolarHBondContact O-N 3.15Å
1664	A	28.8	Very low	33.5	Very low	88 Å²	88	122 Å²	122	73%	0.727	67%	0.668	S	S	*	*			trans	-74	83.3	158.5	0	0	0	0	0	107.7	H1662 P1666	H1662-A1664 PolarHBondContact O-N 2.95Å; H1662-A1664 VanDerWaalsContact O-N 3.12Å; A1664-P1666 VanDerWaalsContact C-CD 3.5Å; A1664-P1666 WeakPolarHBondContact O-CD 3.46Å
1665	T	27.4	Very low	32.4	Very low	101 Å²	101	124 Å²	124	62%	0.62	68%	0.681	S	S	*	*			trans	-102.5	89	171.9	46.2	0	0	0	0	110.1	V1663	V1663-T1665 HydrophobicContact CG1-CG2 3.8Å; V1663-T1665 PolarHBondContact O-N 3.15Å
1666	P	33	Very low	31.5	Very low	108 Å²	108	130.8 Å²	130.8	70%	0.701	70%	0.703	S	S	*	*			trans	-74.9	145.6	173.2	32.7	-35.8	0	0	0	110.9	A1664	A1664-P1666 VanDerWaalsContact C-CD 3.5Å; A1664-P1666 WeakPolarHBondContact O-CD 3.46Å
1667	K	25.5	Very low	30.3	Very low	199 Å²	199	130.4 Å²	130.4	87%	0.865	71%	0.705	S	S	*	*			trans	168.2	142.5	157.5	-91.5	151	-174.4	178.8	0	105.5
1668	K	25	Very low	29.6	Very low	169 Å²	169	132.1 Å²	132.1	74%	0.735	71%	0.71	S	S	*	*			cis	-161.7	156.8	13.3	-135	173.7	176.7	-169.9	0	109
1669	I	27.1	Very low	29.3	Very low	145 Å²	145	132.3 Å²	132.3	74%	0.744	71%	0.71	S	S	*	*			trans	68.8	132.8	153.7	-67.3	157.2	0	0	0	115.6
1670	S	26.4	Very low	28.9	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	72%	0.718	S	S	*	*			cis	-156.3	166	-7.5	39.5	0	0	0	0	111
1671	P	30.6	Very low	28.7	Very low	123 Å²	123	127.8 Å²	127.8	80%	0.799	72%	0.72	S	S	*	*			trans	-112.8	-144.5	-161.9	38.7	-20.5	0	0	0	113
1672	P	38.2	Very low	28.5	Very low	113 Å²	113	129.5 Å²	129.5	73%	0.734	73%	0.734	S	S	*	*				-129.4	-178.9	-105.6	41.3	-23.4	0	0	0	114.7
1673	T	26.8	Very low	28.4	Very low	130 Å²	130	128.1 Å²	128.1	80%	0.798	73%	0.728	S	S	*	*			trans	-151.8	119	158.2	-0.1	0	0	0	0	111.3
1674	S	26.9	Very low	28.4	Very low	96 Å²	96	130.3 Å²	130.3	67%	0.671	74%	0.741	S	S	*	*				45.1	143.6	124.9	66.4	0	0	0	0	120.9
1675	T	27.3	Very low	28.1	Very low	108 Å²	108	133.6 Å²	133.6	66%	0.663	75%	0.746	S	S	*	*			cis	-168.8	178.4	-6.1	19.4	0	0	0	0	106.7
1676	Y	29.2	Very low	28	Very low	203 Å²	203	132.8 Å²	132.8	80%	0.796	75%	0.749	S	S	*	*			cis	-140.2	160.8	5.9	-108	-62.9	0	0	0	111
1677	S	26.8	Very low	27.7	Very low	86 Å²	86	135 Å²	135	60%	0.601	76%	0.755	S	S	*	*			trans	-4.9	159.6	142.2	83.2	0	0	0	0	120.7
1678	K	27.3	Very low	27.7	Very low	175 Å²	175	132.6 Å²	132.6	76%	0.761	75%	0.745	S	S	*	*			cis	-160.1	159.4	40	-138.4	161.8	-165	178.5	0	113.6
1679	Q	32.2	Very low	27.8	Very low	162 Å²	162	132.3 Å²	132.3	76%	0.757	75%	0.75	S	S	*	*			trans	59.2	108.1	170.6	-70.6	152.6	-82.2	0	0	116.3
1680	S	27	Very low	27.8	Very low	109 Å²	109	130.9 Å²	130.9	76%	0.762	75%	0.749	S	S	*	*				70.1	133.7	52.9	82.1	0	0	0	0	113.6
1681	S	28.8	Very low	27.7	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	74%	0.741	S	S	*	*			cis	-140.9	138.9	9.8	46.2	0	0	0	0	109.6
1682	S	27.5	Very low	27.5	Very low	109 Å²	109	133.1 Å²	133.1	76%	0.762	74%	0.736	S	S	*	*				64.8	91.2	58.5	-177.7	0	0	0	0	114.8
1683	Q	26.7	Very low	27.1	Very low	169 Å²	169	130.7 Å²	130.7	79%	0.79	72%	0.722	S	S	*	*				-153.2	141.2	128.4	-116.2	166.2	16.6	0	0	114.1
1684	V	27.2	Very low	27.2	Very low	130 Å²	130	129.5 Å²	129.5	79%	0.788	72%	0.715	S	S	*	*			trans	-67.5	138.3	-171.4	176.9	0	0	0	0	113.3
1685	L	24.2	Very low	27.3	Very low	158 Å²	158	129.4 Å²	129.4	83%	0.827	71%	0.712	S	S	*	*			trans	-154.7	147.1	138.5	-142.9	68	0	0	0	112.9	N1687	L1685-N1687 PolarHBondContact O-N 2.87Å
1686	A	25.1	Very low	27.5	Very low	84 Å²	84	128.4 Å²	128.4	69%	0.694	70%	0.702	S	S	*	*			trans	-88	99.4	-175.7	0	0	0	0	0	111.9	K1688	A1686-K1688 PolarHBondContact O-N 3.2Å
1687	N	26.9	Very low	27.5	Very low	153 Å²	153	120.3 Å²	120.3	82%	0.818	68%	0.68	S	S	*	*			trans	-78.9	87.7	-179.2	-80.3	-8	0	0	0	113	L1685 I1689	L1685-N1687 PolarHBondContact O-N 2.87Å; N1687-I1689 PolarHBondContact O-N 2.95Å
1688	K	24.9	Very low	27.7	Very low	150 Å²	150	124.7 Å²	124.7	65%	0.652	69%	0.689	S	S	*	*			trans	-34.4	118.9	166.2	-52.8	174.8	173.4	-178.5	0	113.1	A1686 Y1691	A1686-K1688 PolarHBondContact O-N 3.2Å; K1688-Y1691 HydrophobicContact CB-CD2 4.11Å; K1688-Y1691 HydrophobicContact CB-CE2 3.92Å; K1688-Y1691 HydrophobicContact CD-CD2 3.88Å; K1688-Y1691 HydrophobicContact CD-CE2 3.53Å; K1688-Y1691 HydrophobicContact CG-CD2 4.24Å; K1688-Y1691 HydrophobicContact CG-CE2 3.67Å
1689	I	26.7	Very low	27.8	Very low	163 Å²	163	122 Å²	122	84%	0.836	68%	0.678	S	S	*	*	S	Bend	trans	-73.6	133.1	153.4	-64	178.7	0	0	0	106.1	N1687	N1687-I1689 PolarHBondContact O-N 2.95Å
1690	P	26.4	Very low	28	Very low	114 Å²	114	117.9 Å²	117.9	74%	0.74	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-72.6	138.7	-139.2	23.3	-34.6	0	0	0	115.2
1691	Y	24.5	Very low	28.5	Very low	139 Å²	139	116.6 Å²	116.6	55%	0.545	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-69.3	135.8	168.7	-68.6	-125.8	0	0	0	108.4	K1688 S1693	K1688-Y1691 HydrophobicContact CB-CD2 4.11Å; K1688-Y1691 HydrophobicContact CB-CE2 3.92Å; K1688-Y1691 HydrophobicContact CD-CD2 3.88Å; K1688-Y1691 HydrophobicContact CD-CE2 3.53Å; K1688-Y1691 HydrophobicContact CG-CD2 4.24Å; K1688-Y1691 HydrophobicContact CG-CE2 3.67Å; Y1691-S1693 WeakPolarHBondContact CB-OG 3.4Å; Y1691-S1693 PolarHBondContact O-N 3.29Å
1692	L	27.6	Very low	28.7	Very low	135 Å²	135	118.9 Å²	118.9	71%	0.707	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	27.2	175.6	-153.1	85.2	0	0	0	112.9	M1408 I1696	M1408-L1692 HydrophobicContact CE-CD1 4.36Å; M1408-L1692 HydrophobicContact CE-CD2 3.99Å; L1692-I1696 WeakPolarHBondContact O-CD1 3.45Å
1693	S	29.3	Very low	29.3	Very low	63 Å²	63	120.1 Å²	120.1	44%	0.441	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.9	-5.6	-166.8	66.5	0	0	0	0	115.2	Y1691 G1697	Y1691-S1693 WeakPolarHBondContact CB-OG 3.4Å; Y1691-S1693 PolarHBondContact O-N 3.29Å; S1693-G1697 PolarHBondContact O-N 2.98Å
1694	T	28.6	Very low	30	Very low	105 Å²	105	117.8 Å²	117.8	64%	0.644	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-25.2	-169.7	47	0	0	0	0	118
1695	P	29.2	Very low	30.8	Very low	94 Å²	94	117.6 Å²	117.6	61%	0.61	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-30.2	162.1	30.6	-31.8	0	0	0	110.7	G1697	P1695-G1697 VanDerWaalsContact C-N 3.33Å
1696	I	31.4	Very low	31.7	Very low	86 Å²	86	114 Å²	114	44%	0.441	60%	0.595	S	S	.	*	H	α-helix	trans	-62.8	-42.6	172.3	-54.5	-178	0	0	0	109.4	L1692 F1698 F1699 L1700	L1692-I1696 WeakPolarHBondContact O-CD1 3.45Å; I1696-F1698 PolarHBondContact O-N 2.9Å; I1696-F1699 CarbonylContact O-C 3.6Å; I1696-F1699 WeakPolarHBondContact O-CA 3.4Å; I1696-F1699 PolarHBondContact O-N 3.48Å; I1696-L1700 HydrophobicContact CG2-CD1 4.2Å; I1696-L1700 WeakPolarHBondContact O-CB 3.45Å; I1696-L1700 PolarHBondContact O-N 2.73Å
1697	G	29.4	Very low	32.4	Very low	34 Å²	34	115.1 Å²	115.1	35%	0.351	59%	0.589	S	S	.	*	H	α-helix	trans	-50.9	-26.7	179.7	0	0	0	0	0	116.6	S1693 P1695 P1701	S1693-G1697 PolarHBondContact O-N 2.98Å; P1695-G1697 VanDerWaalsContact C-N 3.33Å; G1697-P1701 WeakPolarHBondContact O-CD 3.31Å
1698	F	30.5	Very low	33.4	Very low	178 Å²	178	115.5 Å²	115.5	78%	0.781	58%	0.579	S	S	*	*	H	α-helix	trans	-79.3	-32.2	176	-157.8	-89	0	0	0	112.6	I1696	I1696-F1698 PolarHBondContact O-N 2.9Å
1699	F	30	Very low	34.6	Very low	119 Å²	119	112.8 Å²	112.8	52%	0.522	57%	0.571	S	S	.	*	H	α-helix	trans	-93.5	-5.9	172.2	-64.4	-86.4	0	0	0	112.6	I1696 Y1702 Y1703	I1696-F1699 CarbonylContact O-C 3.6Å; I1696-F1699 WeakPolarHBondContact O-CA 3.4Å; I1696-F1699 PolarHBondContact O-N 3.48Å; F1699-Y1702 CarbonylContact O-C 3.51Å; F1699-Y1702 WeakPolarHBondContact O-CA 3.36Å; F1699-Y1702 WeakPolarHBondContact O-CB 3.41Å; F1699-Y1702 PolarHBondContact O-N 2.84Å; F1699-Y1703 HydrophobicContact CB-CD2 3.64Å; F1699-Y1703 HydrophobicContact CB-CE2 3.79Å; F1699-Y1703 HydrophobicContact CG-CE2 4.43Å; F1699-Y1703 WeakPolarHBondContact O-CD2 3.48Å; F1699-Y1703 PolarHBondContact O-N 2.92Å
1700	L	36.8	Very low	35.3	Very low	75 Å²	75	109.8 Å²	109.8	39%	0.393	55%	0.553	S	S	.	*	H	α-helix	trans	-62.9	-41.8	-174.8	-171.1	71.7	0	0	0	112	I1696 Y1702 E1704	I1696-L1700 HydrophobicContact CG2-CD1 4.2Å; I1696-L1700 WeakPolarHBondContact O-CB 3.45Å; I1696-L1700 PolarHBondContact O-N 2.73Å; L1700-Y1702 VanDerWaalsContact C-N 3.28Å; L1700-Y1702 PolarHBondContact O-N 3.18Å; L1700-E1704 HydrophobicContact CD1-CG 4.32Å; L1700-E1704 HydrophobicContact CG-CG 4.4Å; L1700-E1704 VanDerWaalsContact O-CB 3.24Å; L1700-E1704 WeakPolarHBondContact O-CB 3.41Å; L1700-E1704 WeakPolarHBondContact O-CG 3.17Å; L1700-E1704 PolarHBondContact O-N 3.39Å
1701	P	36.9	Very low	35.9	Very low	82 Å²	82	106.2 Å²	106.2	53%	0.532	53%	0.531	S	S	.	.	H	α-helix	trans	-62.7	-36	171.9	-21.1	33.6	0	0	0	112.2	G1697 L1705	G1697-P1701 WeakPolarHBondContact O-CD 3.31Å; P1701-L1705 VanDerWaalsContact O-CB 3.3Å; P1701-L1705 WeakPolarHBondContact O-CB 3.22Å; P1701-L1705 WeakPolarHBondContact O-CD1 3.41Å; P1701-L1705 PolarHBondContact O-N 3.27Å
1702	Y	33.8	Very low	37	Very low	157 Å²	157	102.8 Å²	102.8	62%	0.616	52%	0.522	S	S	*	.	H	α-helix	trans	-74.9	-40.9	-177.6	-163.9	-97.8	0	0	0	112.3	F1699 L1700 L1706	F1699-Y1702 CarbonylContact O-C 3.51Å; F1699-Y1702 WeakPolarHBondContact O-CA 3.36Å; F1699-Y1702 WeakPolarHBondContact O-CB 3.41Å; F1699-Y1702 PolarHBondContact O-N 2.84Å; L1700-Y1702 VanDerWaalsContact C-N 3.28Å; L1700-Y1702 PolarHBondContact O-N 3.18Å; Y1702-L1706 HydrophobicContact CD1-CD1 3.94Å; Y1702-L1706 HydrophobicContact CE1-CD1 3.59Å; Y1702-L1706 WeakPolarHBondContact O-CB 3.45Å; Y1702-L1706 PolarHBondContact O-N 2.71Å
1703	Y	39.2	Very low	37.7	Very low	135 Å²	135	103.2 Å²	103.2	53%	0.529	51%	0.514	S	S	.	.	H	α-helix	trans	-73.2	-35.7	172	-81.9	-63.1	0	0	0	112.2	F1699 L1706 I1707	F1699-Y1703 HydrophobicContact CB-CD2 3.64Å; F1699-Y1703 HydrophobicContact CB-CE2 3.79Å; F1699-Y1703 HydrophobicContact CG-CE2 4.43Å; F1699-Y1703 WeakPolarHBondContact O-CD2 3.48Å; F1699-Y1703 PolarHBondContact O-N 2.92Å; Y1703-L1706 PolarHBondContact O-N 2.88Å; Y1703-I1707 WeakPolarHBondContact O-CA 3.34Å; Y1703-I1707 WeakPolarHBondContact O-CB 3.45Å; Y1703-I1707 WeakPolarHBondContact O-CD1 3.28Å; Y1703-I1707 WeakPolarHBondContact O-CG1 3.26Å; Y1703-I1707 PolarHBondContact O-N 3.14Å
1704	E	41.4	Very low	38.2	Very low	120 Å²	120	105.1 Å²	105.1	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-69.3	-36.1	171.5	-76.6	-168	-172.3	0	0	111.4	L1700 R1708	L1700-E1704 HydrophobicContact CD1-CG 4.32Å; L1700-E1704 HydrophobicContact CG-CG 4.4Å; L1700-E1704 VanDerWaalsContact O-CB 3.24Å; L1700-E1704 WeakPolarHBondContact O-CB 3.41Å; L1700-E1704 WeakPolarHBondContact O-CG 3.17Å; L1700-E1704 PolarHBondContact O-N 3.39Å; E1704-R1708 WeakPolarHBondContact O-CA 3.48Å; E1704-R1708 WeakPolarHBondContact O-CB 3.31Å; E1704-R1708 PolarHBondContact O-N 2.73Å
1705	L	44.9	Very low	38.9	Very low	126 Å²	126	104.2 Å²	104.2	66%	0.66	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-49.6	169	-99.3	134	0	0	0	111.6	P1701 I1707 R1708 D1709	P1701-L1705 VanDerWaalsContact O-CB 3.3Å; P1701-L1705 WeakPolarHBondContact O-CB 3.22Å; P1701-L1705 WeakPolarHBondContact O-CD1 3.41Å; P1701-L1705 PolarHBondContact O-N 3.27Å; L1705-I1707 PolarHBondContact O-N 3.05Å; L1705-R1708 PolarHBondContact O-N 3.17Å; L1705-D1709 WeakPolarHBondContact O-CB 3.43Å; L1705-D1709 PolarHBondContact O-N 3.24Å
1706	L	41.7	Very low	39.8	Very low	81 Å²	81	106.9 Å²	106.9	42%	0.424	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-41.1	177.8	-97.7	162	0	0	0	112.6	Y1702 Y1703 H1710	Y1702-L1706 HydrophobicContact CD1-CD1 3.94Å; Y1702-L1706 HydrophobicContact CE1-CD1 3.59Å; Y1702-L1706 WeakPolarHBondContact O-CB 3.45Å; Y1702-L1706 PolarHBondContact O-N 2.71Å; Y1703-L1706 PolarHBondContact O-N 2.88Å; L1706-H1710 VanDerWaalsContact O-CB 3.28Å; L1706-H1710 WeakPolarHBondContact O-CB 3.26Å; L1706-H1710 PolarHBondContact O-N 2.94Å
1707	I	40	Very low	40.4	Very low	109 Å²	109	107.7 Å²	107.7	56%	0.559	52%	0.52	S	S	*	.	H	α-helix	trans	-72.6	-37.4	177.8	-68.1	165.5	0	0	0	110.5	Y1703 L1705 S1711	Y1703-I1707 WeakPolarHBondContact O-CA 3.34Å; Y1703-I1707 WeakPolarHBondContact O-CB 3.45Å; Y1703-I1707 WeakPolarHBondContact O-CD1 3.28Å; Y1703-I1707 WeakPolarHBondContact O-CG1 3.26Å; Y1703-I1707 PolarHBondContact O-N 3.14Å; L1705-I1707 PolarHBondContact O-N 3.05Å; I1707-S1711 WeakPolarHBondContact O-CA 3.3Å; I1707-S1711 WeakPolarHBondContact O-CB 3.42Å; I1707-S1711 PolarHBondContact O-N 3.19Å; I1707-S1711 PolarHBondContact O-OG 3.49Å
1708	R	48.1	Very low	40.9	Very low	161 Å²	161	113.4 Å²	113.4	61%	0.608	53%	0.531	S	S	*	.	H	α-helix	trans	-70.5	-38.5	176.1	-170.2	172.7	-172.9	166.5	-0.9	111.4	E1704 L1705 S1711 N1712	E1704-R1708 WeakPolarHBondContact O-CA 3.48Å; E1704-R1708 WeakPolarHBondContact O-CB 3.31Å; E1704-R1708 PolarHBondContact O-N 2.73Å; L1705-R1708 PolarHBondContact O-N 3.17Å; R1708-S1711 WeakPolarHBondContact CA-OG 3.07Å; R1708-S1711 PolarHBondContact O-OG 2.81Å; R1708-N1712 WeakPolarHBondContact O-CB 3.16Å; R1708-N1712 PolarHBondContact O-N 2.99Å; R1708-N1712 PolarHBondContact O-ND2 2.96Å; R1708-N1712 PolarHBondContact O-OD1 2.94Å
1709	D	49.4	Very low	41.4	Very low	93 Å²	93	108 Å²	108	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-74.4	-45.5	177.2	-166.8	64.8	0	0	0	111.9	L1705 S1711 N1712 R1713	L1705-D1709 WeakPolarHBondContact O-CB 3.43Å; L1705-D1709 PolarHBondContact O-N 3.24Å; D1709-S1711 VanDerWaalsContact C-N 3.34Å; D1709-S1711 PolarHBondContact O-N 2.99Å; D1709-N1712 PolarHBondContact O-N 3.38Å; D1709-R1713 PolarHBondContact O-N 3.12Å
1710	H	41.4	Very low	42.6	Very low	99 Å²	99	107.2 Å²	107.2	46%	0.458	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-35.4	171.3	-110	-33.5	0	0	0	112.3	L1706 L1714	L1706-H1710 VanDerWaalsContact O-CB 3.28Å; L1706-H1710 WeakPolarHBondContact O-CB 3.26Å; L1706-H1710 PolarHBondContact O-N 2.94Å; H1710-L1714 WeakPolarHBondContact O-CA 3.34Å; H1710-L1714 WeakPolarHBondContact O-CB 3.36Å; H1710-L1714 WeakPolarHBondContact O-CD1 3.44Å; H1710-L1714 WeakPolarHBondContact O-CG 3.33Å; H1710-L1714 PolarHBondContact O-N 3.1Å
1711	S	40.6	Very low	43.1	Very low	39 Å²	39	110.6 Å²	110.6	27%	0.273	52%	0.515	S	S	.	.	H	α-helix	trans	-78.3	-23.2	175.3	69.6	0	0	0	0	113	I1707 R1708 D1709 N1715	I1707-S1711 WeakPolarHBondContact O-CA 3.3Å; I1707-S1711 WeakPolarHBondContact O-CB 3.42Å; I1707-S1711 PolarHBondContact O-N 3.19Å; I1707-S1711 PolarHBondContact O-OG 3.49Å; R1708-S1711 WeakPolarHBondContact CA-OG 3.07Å; R1708-S1711 PolarHBondContact O-OG 2.81Å; D1709-S1711 VanDerWaalsContact C-N 3.34Å; D1709-S1711 PolarHBondContact O-N 2.99Å; S1711-N1715 WeakPolarHBondContact O-CA 3.49Å; S1711-N1715 WeakPolarHBondContact O-CB 3.48Å; S1711-N1715 PolarHBondContact O-N 3.27Å; S1711-N1715 PolarHBondContact O-ND2 2.8Å
1712	N	47.5	Very low	43.3	Very low	68 Å²	68	109.3 Å²	109.3	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-70.1	-52.3	168	-77.6	-5.2	0	0	0	109.4	R1708 D1709 L1714 N1715 E1716	R1708-N1712 WeakPolarHBondContact O-CB 3.16Å; R1708-N1712 PolarHBondContact O-N 2.99Å; R1708-N1712 PolarHBondContact O-ND2 2.96Å; R1708-N1712 PolarHBondContact O-OD1 2.94Å; D1709-N1712 PolarHBondContact O-N 3.38Å; N1712-L1714 PolarHBondContact O-N 2.87Å; N1712-N1715 PolarHBondContact O-N 2.67Å; N1712-E1716 WeakPolarHBondContact O-CB 3.48Å; N1712-E1716 WeakPolarHBondContact O-CG 3.21Å; N1712-E1716 PolarHBondContact O-N 3.17Å
1713	R	42.6	Very low	43.9	Very low	143 Å²	143	107.6 Å²	107.6	54%	0.54	50%	0.502	S	S	.	.	H	α-helix	trans	-57.4	-48.7	174.1	-81.6	177	57.1	-164.4	-3	112.6	D1709 E1716 D1717	D1709-R1713 PolarHBondContact O-N 3.12Å; R1713-E1716 PolarHBondContact O-N 3.14Å; R1713-D1717 VanDerWaalsContact O-CB 3.25Å; R1713-D1717 WeakPolarHBondContact O-CB 3.42Å; R1713-D1717 PolarHBondContact O-N 3.19Å
1714	L	38.4	Very low	44.5	Very low	103 Å²	103	108 Å²	108	54%	0.539	50%	0.503	S	S	.	.	H	α-helix	trans	-66.5	-40.3	177.4	-75.1	167	0	0	0	111.7	H1710 N1712 W1718	H1710-L1714 WeakPolarHBondContact O-CA 3.34Å; H1710-L1714 WeakPolarHBondContact O-CB 3.36Å; H1710-L1714 WeakPolarHBondContact O-CD1 3.44Å; H1710-L1714 WeakPolarHBondContact O-CG 3.33Å; H1710-L1714 PolarHBondContact O-N 3.1Å; N1712-L1714 PolarHBondContact O-N 2.87Å; L1714-W1718 WeakPolarHBondContact O-CA 3.28Å; L1714-W1718 WeakPolarHBondContact O-CB 3.34Å; L1714-W1718 PolarHBondContact O-N 3.39Å
1715	N	43.2	Very low	44.7	Very low	86 Å²	86	105.1 Å²	105.1	46%	0.46	49%	0.491	S	S	.	.	H	α-helix	trans	-73.1	-32.3	177.9	-70.2	-36.2	0	0	0	111.8	S1711 N1712 L1719	S1711-N1715 WeakPolarHBondContact O-CA 3.49Å; S1711-N1715 WeakPolarHBondContact O-CB 3.48Å; S1711-N1715 PolarHBondContact O-N 3.27Å; S1711-N1715 PolarHBondContact O-ND2 2.8Å; N1712-N1715 PolarHBondContact O-N 2.67Å; N1715-L1719 HydrophobicContact CB-CD1 3.94Å; N1715-L1719 WeakPolarHBondContact O-CA 3.25Å; N1715-L1719 WeakPolarHBondContact O-CB 3.33Å; N1715-L1719 WeakPolarHBondContact O-CD1 3.08Å; N1715-L1719 PolarHBondContact O-N 3.22Å
1716	E	48.3	Very low	44.5	Very low	150 Å²	150	102.9 Å²	102.9	70%	0.701	48%	0.477	S	S	*	.	H	α-helix	trans	-70.7	-58.3	173	-71.8	-165.3	134.8	0	0	111	N1712 R1713 W1718 L1719 E1720	N1712-E1716 WeakPolarHBondContact O-CB 3.48Å; N1712-E1716 WeakPolarHBondContact O-CG 3.21Å; N1712-E1716 PolarHBondContact O-N 3.17Å; R1713-E1716 PolarHBondContact O-N 3.14Å; E1716-W1718 PolarHBondContact O-N 2.71Å; E1716-L1719 PolarHBondContact O-N 3.26Å; E1716-E1720 WeakPolarHBondContact O-CB 3.47Å; E1716-E1720 PolarHBondContact O-N 3.4Å
1717	D	44.2	Very low	44.9	Very low	104 Å²	104	105 Å²	105	56%	0.556	49%	0.488	S	S	*	.	H	α-helix	trans	-54	-43.3	177.7	-76.3	-36.8	0	0	0	111	R1713 W1721	R1713-D1717 VanDerWaalsContact O-CB 3.25Å; R1713-D1717 WeakPolarHBondContact O-CB 3.42Å; R1713-D1717 PolarHBondContact O-N 3.19Å; D1717-W1721 WeakPolarHBondContact O-CB 3.36Å; D1717-W1721 PolarHBondContact O-N 3.25Å
1718	W	40.1	Very low	45.2	Very low	154 Å²	154	101.7 Å²	101.7	58%	0.583	48%	0.477	S	S	*	.	H	α-helix	trans	-86.6	-27.3	-175.3	-147.3	74	0	0	0	113.7	L1714 E1716 W1721 T1722	L1714-W1718 WeakPolarHBondContact O-CA 3.28Å; L1714-W1718 WeakPolarHBondContact O-CB 3.34Å; L1714-W1718 PolarHBondContact O-N 3.39Å; E1716-W1718 PolarHBondContact O-N 2.71Å; W1718-W1721 AromaticContact CD1-CE3 3.97Å; W1718-W1721 AromaticContact NE1-CE3 3.84Å; W1718-W1721 AromaticContact NE1-CZ3 3.81Å; W1718-T1722 WeakPolarHBondContact O-CA 3.05Å; W1718-T1722 WeakPolarHBondContact O-CB 3.37Å; W1718-T1722 PolarHBondContact O-N 3.16Å; W1718-T1722 PolarHBondContact O-OG1 3.4Å
1719	L	41.6	Very low	44.8	Very low	64 Å²	64	98.3 Å²	98.3	34%	0.335	47%	0.47	S	S	.	.	H	α-helix	trans	-73.1	-35.1	165.9	-91.2	86.3	0	0	0	111.4	A1449 N1715 E1716 T1722 K1723	A1449-L1719 HydrophobicContact CB-CD2 3.35Å; N1715-L1719 HydrophobicContact CB-CD1 3.94Å; N1715-L1719 WeakPolarHBondContact O-CA 3.25Å; N1715-L1719 WeakPolarHBondContact O-CB 3.33Å; N1715-L1719 WeakPolarHBondContact O-CD1 3.08Å; N1715-L1719 PolarHBondContact O-N 3.22Å; E1716-L1719 PolarHBondContact O-N 3.26Å; L1719-T1722 PolarHBondContact O-N 3.44Å; L1719-K1723 VanDerWaalsContact O-CB 3.24Å; L1719-K1723 WeakPolarHBondContact O-CB 3.22Å; L1719-K1723 WeakPolarHBondContact O-CG 3.41Å; L1719-K1723 PolarHBondContact O-N 3.03Å
1720	E	54.4	Low	44.5	Very low	102 Å²	102	100.6 Å²	100.6	48%	0.477	47%	0.471	S	S	.	.	H	α-helix	trans	-70.2	-44.8	177	-132.2	-132.7	130.9	0	0	110.1	E1716 T1722 K1723 R1724	E1716-E1720 WeakPolarHBondContact O-CB 3.47Å; E1716-E1720 PolarHBondContact O-N 3.4Å; E1720-T1722 VanDerWaalsContact C-N 3.35Å; E1720-T1722 PolarHBondContact O-N 2.89Å; E1720-K1723 PolarHBondContact O-N 2.96Å; E1720-R1724 WeakPolarHBondContact O-CB 3.19Å; E1720-R1724 WeakPolarHBondContact O-CG 3.11Å; E1720-R1724 PolarHBondContact O-N 3.41Å; E1720-R1724 IonicContact OE1-CZ 2.68Å; E1720-R1724 IonicContact OE1-NE 2.75Å; E1720-R1724 PolarHBondContact OE1-NE 3Å; E1720-R1724 IonicContact OE1-NH2 2.65Å; E1720-R1724 PolarHBondContact OE1-NH2 2.93Å; E1720-R1724 IonicContact OE2-CZ 3.12Å; E1720-R1724 IonicContact OE2-NE 3.18Å; E1720-R1724 IonicContact OE2-NH2 2.81Å; E1720-R1724 PolarHBondContact OE2-NH2 3.26Å
1721	W	47	Very low	44.8	Very low	146 Å²	146	97.7 Å²	97.7	55%	0.553	47%	0.468	S	S	*	.	H	α-helix	trans	-59.3	-42.2	170.9	-174.8	87.1	0	0	0	112.2	D1717 W1718 N1725	D1717-W1721 WeakPolarHBondContact O-CB 3.36Å; D1717-W1721 PolarHBondContact O-N 3.25Å; W1718-W1721 AromaticContact CD1-CE3 3.97Å; W1718-W1721 AromaticContact NE1-CE3 3.84Å; W1718-W1721 AromaticContact NE1-CZ3 3.81Å; W1721-N1725 VanDerWaalsContact CZ2-ND2 3.31Å; W1721-N1725 WeakPolarHBondContact CZ2-ND2 3.44Å; W1721-N1725 VanDerWaalsContact O-CB 3.28Å; W1721-N1725 WeakPolarHBondContact O-CB 3.01Å; W1721-N1725 PolarHBondContact O-N 2.99Å; W1721-N1725 PolarHBondContact O-ND2 3.43Å
1722	T	40.9	Very low	44.8	Very low	55 Å²	55	101.5 Å²	101.5	34%	0.337	48%	0.476	S	S	.	.	H	α-helix	trans	-71.8	-38.8	177.9	-59	0	0	0	0	112.1	W1718 L1719 E1720 N1725 E1726	W1718-T1722 WeakPolarHBondContact O-CA 3.05Å; W1718-T1722 WeakPolarHBondContact O-CB 3.37Å; W1718-T1722 PolarHBondContact O-N 3.16Å; W1718-T1722 PolarHBondContact O-OG1 3.4Å; L1719-T1722 PolarHBondContact O-N 3.44Å; E1720-T1722 VanDerWaalsContact C-N 3.35Å; E1720-T1722 PolarHBondContact O-N 2.89Å; T1722-N1725 CarbonylContact O-C 3.54Å; T1722-N1725 PolarHBondContact O-N 3.2Å; T1722-E1726 WeakPolarHBondContact O-CB 3.07Å; T1722-E1726 PolarHBondContact O-N 3.37Å
1723	K	47.4	Very low	44.6	Very low	121 Å²	121	101.8 Å²	101.8	53%	0.526	48%	0.48	S	S	.	.	H	α-helix	trans	-63.2	-45.2	172.7	-83.5	-178.9	174.6	177.3	0	111.4	L1719 E1720 E1726 L1727	L1719-K1723 VanDerWaalsContact O-CB 3.24Å; L1719-K1723 WeakPolarHBondContact O-CB 3.22Å; L1719-K1723 WeakPolarHBondContact O-CG 3.41Å; L1719-K1723 PolarHBondContact O-N 3.03Å; E1720-K1723 PolarHBondContact O-N 2.96Å; K1723-E1726 PolarHBondContact O-N 3.5Å; K1723-L1727 WeakPolarHBondContact O-CB 3.33Å; K1723-L1727 WeakPolarHBondContact O-CG 3.45Å; K1723-L1727 PolarHBondContact O-N 3.32Å
1724	R	50.6	Low	44.8	Very low	144 Å²	144	100.9 Å²	100.9	54%	0.543	49%	0.486	S	S	.	.	H	α-helix	trans	-59.7	-45.6	174.6	-71	172.6	-171.9	-176.5	5	110.7	E1720 A1728	E1720-R1724 WeakPolarHBondContact O-CB 3.19Å; E1720-R1724 WeakPolarHBondContact O-CG 3.11Å; E1720-R1724 PolarHBondContact O-N 3.41Å; E1720-R1724 IonicContact OE1-CZ 2.68Å; E1720-R1724 IonicContact OE1-NE 2.75Å; E1720-R1724 PolarHBondContact OE1-NE 3Å; E1720-R1724 IonicContact OE1-NH2 2.65Å; E1720-R1724 PolarHBondContact OE1-NH2 2.93Å; E1720-R1724 IonicContact OE2-CZ 3.12Å; E1720-R1724 IonicContact OE2-NE 3.18Å; E1720-R1724 IonicContact OE2-NH2 2.81Å; E1720-R1724 PolarHBondContact OE2-NH2 3.26Å; R1724-A1728 WeakPolarHBondContact O-CB 3.19Å; R1724-A1728 PolarHBondContact O-N 2.87Å
1725	N	46	Very low	45.1	Very low	59 Å²	59	101.2 Å²	101.2	32%	0.316	49%	0.488	S	S	.	.	H	α-helix	trans	-69.8	-35	177.4	-79.6	-33	0	0	0	113.6	W1721 T1722 A1728 M1729	W1721-N1725 VanDerWaalsContact CZ2-ND2 3.31Å; W1721-N1725 WeakPolarHBondContact CZ2-ND2 3.44Å; W1721-N1725 VanDerWaalsContact O-CB 3.28Å; W1721-N1725 WeakPolarHBondContact O-CB 3.01Å; W1721-N1725 PolarHBondContact O-N 2.99Å; W1721-N1725 PolarHBondContact O-ND2 3.43Å; T1722-N1725 CarbonylContact O-C 3.54Å; T1722-N1725 PolarHBondContact O-N 3.2Å; N1725-A1728 CarbonylContact O-C 3.56Å; N1725-A1728 PolarHBondContact O-N 2.93Å; N1725-M1729 WeakPolarHBondContact O-CB 3.21Å; N1725-M1729 PolarHBondContact O-N 3.27Å
1726	E	40.7	Very low	44.9	Very low	79 Å²	79	103.8 Å²	103.8	37%	0.369	49%	0.492	S	S	.	.	H	α-helix	trans	-70.4	-44.9	177.2	-164.8	-159.1	168.8	0	0	110.8	T1722 K1723 A1728 M1729 R1730	T1722-E1726 WeakPolarHBondContact O-CB 3.07Å; T1722-E1726 PolarHBondContact O-N 3.37Å; K1723-E1726 PolarHBondContact O-N 3.5Å; E1726-A1728 VanDerWaalsContact C-N 3.32Å; E1726-A1728 PolarHBondContact O-N 2.87Å; E1726-M1729 CarbonylContact O-C 3.52Å; E1726-M1729 PolarHBondContact O-N 2.78Å; E1726-M1729 VanDerWaalsContact O-N 3.16Å; E1726-R1730 WeakPolarHBondContact O-CB 3.41Å; E1726-R1730 WeakPolarHBondContact O-CG 3.39Å; E1726-R1730 PolarHBondContact O-N 3.02Å; E1726-R1730 IonicContact OE1-CZ 3.17Å; E1726-R1730 IonicContact OE1-NE 2.7Å; E1726-R1730 PolarHBondContact OE1-NE 3Å; E1726-R1730 IonicContact OE1-NH2 2.68Å; E1726-R1730 PolarHBondContact OE1-NH2 3.04Å
1727	L	49.8	Very low	44.6	Very low	125 Å²	125	102.1 Å²	102.1	65%	0.654	49%	0.487	S	S	*	.	H	α-helix	trans	-60	-44	172.1	-76.3	165.7	0	0	0	110.9	K1723 M1729 R1730 G1731	K1723-L1727 WeakPolarHBondContact O-CB 3.33Å; K1723-L1727 WeakPolarHBondContact O-CG 3.45Å; K1723-L1727 PolarHBondContact O-N 3.32Å; L1727-M1729 VanDerWaalsContact C-N 3.33Å; L1727-M1729 PolarHBondContact O-N 3.28Å; L1727-R1730 PolarHBondContact O-N 2.85Å; L1727-G1731 PolarHBondContact O-N 2.83Å
1728	A	46.2	Very low	44.8	Very low	40 Å²	40	100 Å²	100	33%	0.331	48%	0.481	S	S	.	.	H	α-helix	trans	-67.5	-28.8	175	0	0	0	0	0	113.2	R1724 N1725 E1726 R1732	R1724-A1728 WeakPolarHBondContact O-CB 3.19Å; R1724-A1728 PolarHBondContact O-N 2.87Å; N1725-A1728 CarbonylContact O-C 3.56Å; N1725-A1728 PolarHBondContact O-N 2.93Å; E1726-A1728 VanDerWaalsContact C-N 3.32Å; E1726-A1728 PolarHBondContact O-N 2.87Å; A1728-R1732 VanDerWaalsContact O-CB 3.29Å; A1728-R1732 WeakPolarHBondContact O-CB 3.39Å; A1728-R1732 VanDerWaalsContact O-CG 3.24Å; A1728-R1732 WeakPolarHBondContact O-CG 3.33Å; A1728-R1732 PolarHBondContact O-N 2.54Å; A1728-R1732 PolarHBondContact O-NE 2.04Å
1729	M	39.6	Very low	45	Very low	91 Å²	91	100.5 Å²	100.5	45%	0.448	48%	0.483	S	S	.	.	H	α-helix	trans	-74.2	-47.4	172	-95.5	-166.6	164.5	0	0	111.4	F1017 N1725 E1726 L1727 G1731 R1732 V1733	F1017-M1729 HydrophobicContact CB-CE 4.23Å; N1725-M1729 WeakPolarHBondContact O-CB 3.21Å; N1725-M1729 PolarHBondContact O-N 3.27Å; E1726-M1729 CarbonylContact O-C 3.52Å; E1726-M1729 PolarHBondContact O-N 2.78Å; E1726-M1729 VanDerWaalsContact O-N 3.16Å; L1727-M1729 VanDerWaalsContact C-N 3.33Å; L1727-M1729 PolarHBondContact O-N 3.28Å; M1729-G1731 VanDerWaalsContact C-N 3.3Å; M1729-G1731 PolarHBondContact O-N 2.83Å; M1729-R1732 PolarHBondContact O-N 2.93Å; M1729-R1732 VanDerWaalsContact O-N 3.17Å; M1729-V1733 WeakPolarHBondContact O-CB 3.42Å; M1729-V1733 WeakPolarHBondContact O-CG2 3.12Å; M1729-V1733 PolarHBondContact O-N 3.37Å
1730	R	43.1	Very low	45.1	Very low	140 Å²	140	103.3 Å²	103.3	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-58	-43.8	176	-72	177.6	-179.4	-142.2	7.5	110.6	E1726 L1727 L1734	E1726-R1730 WeakPolarHBondContact O-CB 3.41Å; E1726-R1730 WeakPolarHBondContact O-CG 3.39Å; E1726-R1730 PolarHBondContact O-N 3.02Å; E1726-R1730 IonicContact OE1-CZ 3.17Å; E1726-R1730 IonicContact OE1-NE 2.7Å; E1726-R1730 PolarHBondContact OE1-NE 3Å; E1726-R1730 IonicContact OE1-NH2 2.68Å; E1726-R1730 PolarHBondContact OE1-NH2 3.04Å; L1727-R1730 PolarHBondContact O-N 2.85Å; R1730-L1734 VanDerWaalsContact O-CB 3.3Å; R1730-L1734 WeakPolarHBondContact O-CB 3.39Å; R1730-L1734 VanDerWaalsContact O-CG 3.24Å; R1730-L1734 WeakPolarHBondContact O-CG 3.48Å; R1730-L1734 PolarHBondContact O-N 2.84Å
1731	G	49.6	Very low	45	Very low	38 Å²	38	105 Å²	105	39%	0.392	50%	0.498	S	S	.	.	H	α-helix	trans	-60.2	-49.5	172.3	0	0	0	0	0	113	L1727 M1729 N1735	L1727-G1731 PolarHBondContact O-N 2.83Å; M1729-G1731 VanDerWaalsContact C-N 3.3Å; M1729-G1731 PolarHBondContact O-N 2.83Å; G1731-N1735 VanDerWaalsContact O-CB 3.32Å; G1731-N1735 WeakPolarHBondContact O-CB 3.44Å; G1731-N1735 PolarHBondContact O-N 3.48Å
1732	R	40.5	Very low	45.3	Very low	119 Å²	119	104.4 Å²	104.4	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-60.1	-47.8	176.9	-82.6	176.5	-86.2	-173.7	-7.1	112.6	A1728 M1729 N1735 Y1736	A1728-R1732 VanDerWaalsContact O-CB 3.29Å; A1728-R1732 WeakPolarHBondContact O-CB 3.39Å; A1728-R1732 VanDerWaalsContact O-CG 3.24Å; A1728-R1732 WeakPolarHBondContact O-CG 3.33Å; A1728-R1732 PolarHBondContact O-N 2.54Å; A1728-R1732 PolarHBondContact O-NE 2.04Å; M1729-R1732 PolarHBondContact O-N 2.93Å; M1729-R1732 VanDerWaalsContact O-N 3.17Å; R1732-N1735 PolarHBondContact O-N 2.82Å; R1732-Y1736 WeakPolarHBondContact O-CB 3.33Å; R1732-Y1736 PolarHBondContact O-N 3.5Å
1733	V	43	Very low	45.4	Very low	74 Å²	74	106.5 Å²	106.5	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-66.4	-43	-178.8	171.7	0	0	0	0	111.6	M1729 Y1736 L1737	M1729-V1733 WeakPolarHBondContact O-CB 3.42Å; M1729-V1733 WeakPolarHBondContact O-CG2 3.12Å; M1729-V1733 PolarHBondContact O-N 3.37Å; V1733-Y1736 PolarHBondContact O-N 3.46Å; V1733-L1737 HydrophobicContact CG1-CD1 3.92Å; V1733-L1737 WeakPolarHBondContact O-CB 3.32Å; V1733-L1737 PolarHBondContact O-N 2.79Å
1734	L	45.6	Very low	45.4	Very low	124 Å²	124	104.7 Å²	104.7	65%	0.649	50%	0.503	S	S	*	.	H	α-helix	trans	-65.2	-38.7	176.5	-72.6	170.4	0	0	0	112	R1730 L1737 S1738	R1730-L1734 VanDerWaalsContact O-CB 3.3Å; R1730-L1734 WeakPolarHBondContact O-CB 3.39Å; R1730-L1734 VanDerWaalsContact O-CG 3.24Å; R1730-L1734 WeakPolarHBondContact O-CG 3.48Å; R1730-L1734 PolarHBondContact O-N 2.84Å; L1734-L1737 PolarHBondContact O-N 3.29Å; L1734-S1738 WeakPolarHBondContact O-CB 3.38Å; L1734-S1738 PolarHBondContact O-N 3.42Å; L1734-S1738 PolarHBondContact O-OG 3.16Å
1735	N	46.2	Very low	45.8	Very low	111 Å²	111	102.1 Å²	102.1	59%	0.594	50%	0.5	S	S	*	.	H	α-helix	trans	-73.9	-27.7	177.1	-154.5	20.4	0	0	0	112.7	G1731 R1732 S1738 R1739	G1731-N1735 VanDerWaalsContact O-CB 3.32Å; G1731-N1735 WeakPolarHBondContact O-CB 3.44Å; G1731-N1735 PolarHBondContact O-N 3.48Å; R1732-N1735 PolarHBondContact O-N 2.82Å; N1735-S1738 WeakPolarHBondContact CA-OG 2.98Å; N1735-S1738 PolarHBondContact O-OG 2.84Å; N1735-S1738 PolarHBondContact OD1-OG 2.98Å; N1735-R1739 VanDerWaalsContact O-CB 3.32Å; N1735-R1739 WeakPolarHBondContact O-CB 3.44Å; N1735-R1739 PolarHBondContact O-N 2.96Å; N1735-R1739 VanDerWaalsContact O-N 3.15Å
1736	Y	37.9	Very low	46.1	Very low	139 Å²	139	105.7 Å²	105.7	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-71.3	-43.5	170.7	-156.4	-85.1	0	0	0	111	R1732 V1733 R1739 F1740	R1732-Y1736 WeakPolarHBondContact O-CB 3.33Å; R1732-Y1736 PolarHBondContact O-N 3.5Å; V1733-Y1736 PolarHBondContact O-N 3.46Å; Y1736-R1739 PolarHBondContact O-N 3.13Å; Y1736-F1740 HydrophobicContact CE1-CD2 4.46Å; Y1736-F1740 WeakPolarHBondContact O-CB 3.41Å; Y1736-F1740 PolarHBondContact O-N 2.76Å
1737	L	42.9	Very low	46.1	Very low	115 Å²	115	105.5 Å²	105.5	60%	0.602	51%	0.511	S	S	*	.	H	α-helix	trans	-66.1	-38.1	176.1	-103.6	135.7	0	0	0	113.1	V1733 L1734 K1741	V1733-L1737 HydrophobicContact CG1-CD1 3.92Å; V1733-L1737 WeakPolarHBondContact O-CB 3.32Å; V1733-L1737 PolarHBondContact O-N 2.79Å; L1734-L1737 PolarHBondContact O-N 3.29Å; L1737-K1741 WeakPolarHBondContact O-CB 3.45Å; L1737-K1741 PolarHBondContact O-N 3.14Å
1738	S	47.8	Very low	46.5	Very low	61 Å²	61	103.9 Å²	103.9	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-66.3	-46.8	175.1	62.7	0	0	0	0	111.3	L1734 N1735 K1741 H1742	L1734-S1738 WeakPolarHBondContact O-CB 3.38Å; L1734-S1738 PolarHBondContact O-N 3.42Å; L1734-S1738 PolarHBondContact O-OG 3.16Å; N1735-S1738 WeakPolarHBondContact CA-OG 2.98Å; N1735-S1738 PolarHBondContact O-OG 2.84Å; N1735-S1738 PolarHBondContact OD1-OG 2.98Å; S1738-K1741 PolarHBondContact O-N 2.9Å; S1738-H1742 WeakPolarHBondContact O-CB 3.34Å; S1738-H1742 PolarHBondContact O-N 3.41Å
1739	R	43.6	Very low	47.3	Very low	163 Å²	163	108.2 Å²	108.2	62%	0.615	52%	0.517	S	S	*	.	H	α-helix	trans	-66.4	-49.6	179	-170.2	171.7	-178.5	166.8	1.8	111.8	N1735 Y1736 K1741 H1742 E1743	N1735-R1739 VanDerWaalsContact O-CB 3.32Å; N1735-R1739 WeakPolarHBondContact O-CB 3.44Å; N1735-R1739 PolarHBondContact O-N 2.96Å; N1735-R1739 VanDerWaalsContact O-N 3.15Å; Y1736-R1739 PolarHBondContact O-N 3.13Å; R1739-K1741 VanDerWaalsContact C-N 3.26Å; R1739-K1741 PolarHBondContact O-N 2.98Å; R1739-H1742 WeakPolarHBondContact O-CB 3.46Å; R1739-H1742 PolarHBondContact O-N 3.19Å; R1739-E1743 HydrophobicContact CG-CG 4.03Å; R1739-E1743 IonicContact CZ-OE1 3.17Å; R1739-E1743 IonicContact NE-OE1 2.65Å; R1739-E1743 PolarHBondContact NE-OE1 3.28Å; R1739-E1743 IonicContact NH2-OE1 2.71Å; R1739-E1743 WeakPolarHBondContact O-CG 3.32Å; R1739-E1743 PolarHBondContact O-N 2.62Å
1740	F	43.6	Very low	48.2	Very low	124 Å²	124	107 Å²	107	54%	0.544	51%	0.51	S	S	.	.	H	α-helix	trans	-59	-37.4	177.9	-165.9	-100.8	0	0	0	111.9	Y1736 L1744	Y1736-F1740 HydrophobicContact CE1-CD2 4.46Å; Y1736-F1740 WeakPolarHBondContact O-CB 3.41Å; Y1736-F1740 PolarHBondContact O-N 2.76Å; F1740-L1744 HydrophobicContact CD1-CD1 3.79Å; F1740-L1744 HydrophobicContact CE1-CD1 3.45Å; F1740-L1744 VanDerWaalsContact CE1-CD1 3.45Å; F1740-L1744 HydrophobicContact CZ-CD1 4.14Å; F1740-L1744 WeakPolarHBondContact O-CB 3.49Å; F1740-L1744 PolarHBondContact O-N 3.44Å
1741	K	54.2	Low	48.5	Very low	137 Å²	137	104.9 Å²	104.9	60%	0.596	51%	0.507	S	S	*	.	H	α-helix	trans	-69.4	-37.2	172.8	-174.8	178.1	179.2	-177	0	113	L1737 S1738 R1739 N1745	L1737-K1741 WeakPolarHBondContact O-CB 3.45Å; L1737-K1741 PolarHBondContact O-N 3.14Å; S1738-K1741 PolarHBondContact O-N 2.9Å; R1739-K1741 VanDerWaalsContact C-N 3.26Å; R1739-K1741 PolarHBondContact O-N 2.98Å; K1741-N1745 VanDerWaalsContact O-CB 3.31Å; K1741-N1745 WeakPolarHBondContact O-CB 3.47Å; K1741-N1745 PolarHBondContact O-N 3.4Å; K1741-N1745 PolarHBondContact O-OD1 3.23Å
1742	H	51.7	Low	49.1	Very low	133 Å²	133	108.4 Å²	108.4	62%	0.616	52%	0.517	S	S	*	.	H	α-helix	trans	-64.8	-47	175.4	-176.7	-75	0	0	0	111.2	S1738 R1739 N1745 Y1746	S1738-H1742 WeakPolarHBondContact O-CB 3.34Å; S1738-H1742 PolarHBondContact O-N 3.41Å; R1739-H1742 WeakPolarHBondContact O-CB 3.46Å; R1739-H1742 PolarHBondContact O-N 3.19Å; H1742-N1745 PolarHBondContact O-N 2.83Å; H1742-Y1746 WeakPolarHBondContact O-CB 3.35Å; H1742-Y1746 PolarHBondContact O-N 3.07Å
1743	E	44.6	Very low	50.2	Low	99 Å²	99	106.6 Å²	106.6	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-64.6	-41.9	-179.9	-49.9	-109.5	-177.6	0	0	110.1	R1739 Y1746 L1747	R1739-E1743 HydrophobicContact CG-CG 4.03Å; R1739-E1743 IonicContact CZ-OE1 3.17Å; R1739-E1743 IonicContact NE-OE1 2.65Å; R1739-E1743 PolarHBondContact NE-OE1 3.28Å; R1739-E1743 IonicContact NH2-OE1 2.71Å; R1739-E1743 WeakPolarHBondContact O-CG 3.32Å; R1739-E1743 PolarHBondContact O-N 2.62Å; E1743-Y1746 PolarHBondContact O-N 3.37Å; E1743-L1747 WeakPolarHBondContact O-CB 3.21Å; E1743-L1747 PolarHBondContact O-N 2.97Å
1744	L	47	Very low	50.3	Low	84 Å²	84	107.5 Å²	107.5	44%	0.44	52%	0.519	S	S	.	.	H	α-helix	trans	-63.3	-45.7	172.4	-104.3	155.9	0	0	0	113.5	F1740 Y1746 L1747 D1748	F1740-L1744 HydrophobicContact CD1-CD1 3.79Å; F1740-L1744 HydrophobicContact CE1-CD1 3.45Å; F1740-L1744 VanDerWaalsContact CE1-CD1 3.45Å; F1740-L1744 HydrophobicContact CZ-CD1 4.14Å; F1740-L1744 WeakPolarHBondContact O-CB 3.49Å; F1740-L1744 PolarHBondContact O-N 3.44Å; L1744-Y1746 VanDerWaalsContact C-N 3.3Å; L1744-Y1746 PolarHBondContact O-N 2.92Å; L1744-L1747 PolarHBondContact O-N 3.45Å; L1744-D1748 PolarHBondContact O-N 3.32Å
1745	N	57.6	Low	50.9	Low	90 Å²	90	105.6 Å²	105.6	48%	0.481	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-37.2	177.9	-87.6	34.9	0	0	0	111.9	K1741 H1742 Q1749	K1741-N1745 VanDerWaalsContact O-CB 3.31Å; K1741-N1745 WeakPolarHBondContact O-CB 3.47Å; K1741-N1745 PolarHBondContact O-N 3.4Å; K1741-N1745 PolarHBondContact O-OD1 3.23Å; H1742-N1745 PolarHBondContact O-N 2.83Å; N1745-Q1749 WeakPolarHBondContact O-CB 3.45Å; N1745-Q1749 WeakPolarHBondContact O-CG 3.29Å; N1745-Q1749 PolarHBondContact O-N 2.89Å; N1745-Q1749 VanDerWaalsContact O-N 3.09Å
1746	Y	53.1	Low	51.5	Low	134 Å²	134	103.4 Å²	103.4	53%	0.525	50%	0.503	S	S	.	.	H	α-helix	trans	-66.6	-42.2	175	-177.5	-101.1	0	0	0	111.3	H1742 E1743 L1744 Q1749 Q1750	H1742-Y1746 WeakPolarHBondContact O-CB 3.35Å; H1742-Y1746 PolarHBondContact O-N 3.07Å; E1743-Y1746 PolarHBondContact O-N 3.37Å; L1744-Y1746 VanDerWaalsContact C-N 3.3Å; L1744-Y1746 PolarHBondContact O-N 2.92Å; Y1746-Q1749 PolarHBondContact O-N 2.92Å; Y1746-Q1750 WeakPolarHBondContact O-CB 3.43Å; Y1746-Q1750 PolarHBondContact O-N 3.49Å
1747	L	41.4	Very low	52.4	Low	74 Å²	74	100.6 Å²	100.6	39%	0.387	50%	0.5	S	S	.	.	H	α-helix	trans	-71.9	-36.2	-179.3	-160.4	148.9	0	0	0	112.6	E1743 L1744 Q1750 M1751 F1796	E1743-L1747 WeakPolarHBondContact O-CB 3.21Å; E1743-L1747 PolarHBondContact O-N 2.97Å; L1744-L1747 PolarHBondContact O-N 3.45Å; L1747-Q1750 PolarHBondContact O-N 3.35Å; L1747-M1751 HydrophobicContact CD2-CG 4.15Å; L1747-M1751 WeakPolarHBondContact O-CB 3.48Å; L1747-M1751 VanDerWaalsContact O-CG 3.28Å; L1747-M1751 WeakPolarHBondContact O-CG 3.44Å; L1747-M1751 PolarHBondContact O-N 3.36Å; L1747-F1796 HydrophobicContact CD1-CZ 4.08Å
1748	D	57.4	Low	52.7	Low	92 Å²	92	98.8 Å²	98.8	49%	0.492	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-45.8	167.8	-99.8	-3.9	0	0	0	110.6	L1744 Q1750 M1751 D1752	L1744-D1748 PolarHBondContact O-N 3.32Å; D1748-Q1750 PolarHBondContact O-N 3.46Å; D1748-M1751 PolarHBondContact O-N 3.12Å; D1748-D1752 WeakPolarHBondContact O-CB 3.44Å; D1748-D1752 PolarHBondContact O-N 3.11Å
1749	Q	63.7	Low	52.9	Low	131 Å²	131	101.8 Å²	101.8	61%	0.612	50%	0.5	S	S	*	.	H	α-helix	trans	-64.4	-37.5	177.5	-77.9	-176.5	-12.8	0	0	113.4	N1745 Y1746 T1753	N1745-Q1749 WeakPolarHBondContact O-CB 3.45Å; N1745-Q1749 WeakPolarHBondContact O-CG 3.29Å; N1745-Q1749 PolarHBondContact O-N 2.89Å; N1745-Q1749 VanDerWaalsContact O-N 3.09Å; Y1746-Q1749 PolarHBondContact O-N 2.92Å; Q1749-T1753 WeakPolarHBondContact O-CB 3.3Å; Q1749-T1753 WeakPolarHBondContact O-CG2 3.39Å; Q1749-T1753 PolarHBondContact O-N 3.38Å; Q1749-T1753 PolarHBondContact O-OG1 2.82Å
1750	Q	57.4	Low	53.5	Low	66 Å²	66	96.6 Å²	96.6	31%	0.308	49%	0.49	S	S	.	.	H	α-helix	trans	-70.1	-41.5	175.4	-172.8	169	-16.6	0	0	111.2	Y1746 L1747 D1748 T1753 E1754	Y1746-Q1750 WeakPolarHBondContact O-CB 3.43Å; Y1746-Q1750 PolarHBondContact O-N 3.49Å; L1747-Q1750 PolarHBondContact O-N 3.35Å; D1748-Q1750 PolarHBondContact O-N 3.46Å; Q1750-T1753 WeakPolarHBondContact CA-OG1 3.32Å; Q1750-T1753 PolarHBondContact O-N 3.33Å; Q1750-T1753 PolarHBondContact O-OG1 3.02Å; Q1750-T1753 VanDerWaalsContact O-OG1 3.09Å; Q1750-E1754 HydrophobicContact CG-CG 4.41Å; Q1750-E1754 WeakPolarHBondContact CG-OE1 3.35Å; Q1750-E1754 PolarHBondContact NE2-OE1 3.37Å; Q1750-E1754 WeakPolarHBondContact O-CB 3.47Å; Q1750-E1754 WeakPolarHBondContact O-CG 3.4Å; Q1750-E1754 PolarHBondContact O-N 3.46Å
1751	M	49.8	Very low	53.5	Low	95 Å²	95	95.3 Å²	95.3	47%	0.468	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-44.7	173.2	-75.2	-120	-65.7	0	0	112.4	L1747 D1748 T1753 N1755	L1747-M1751 HydrophobicContact CD2-CG 4.15Å; L1747-M1751 WeakPolarHBondContact O-CB 3.48Å; L1747-M1751 VanDerWaalsContact O-CG 3.28Å; L1747-M1751 WeakPolarHBondContact O-CG 3.44Å; L1747-M1751 PolarHBondContact O-N 3.36Å; D1748-M1751 PolarHBondContact O-N 3.12Å; M1751-T1753 PolarHBondContact O-N 3.22Å; M1751-N1755 WeakPolarHBondContact O-CB 3.39Å; M1751-N1755 PolarHBondContact O-N 3.39Å
1752	D	63.1	Low	52.8	Low	111 Å²	111	92.7 Å²	92.7	59%	0.594	48%	0.48	S	S	*	.	H	α-helix	trans	-64.2	-39.3	177.7	-85.3	-17.5	0	0	0	111.9	D1748 S1756	D1748-D1752 WeakPolarHBondContact O-CB 3.44Å; D1748-D1752 PolarHBondContact O-N 3.11Å; D1752-S1756 WeakPolarHBondContact O-CB 3.38Å; D1752-S1756 PolarHBondContact O-N 3.26Å
1753	T	62.9	Low	52.5	Low	82 Å²	82	89.4 Å²	89.4	50%	0.503	47%	0.472	S	S	.	.	H	α-helix	trans	-70.4	-45.7	177	46.2	0	0	0	0	112.5	Q1749 Q1750 M1751 N1755 S1756 V1757	Q1749-T1753 WeakPolarHBondContact O-CB 3.3Å; Q1749-T1753 WeakPolarHBondContact O-CG2 3.39Å; Q1749-T1753 PolarHBondContact O-N 3.38Å; Q1749-T1753 PolarHBondContact O-OG1 2.82Å; Q1750-T1753 WeakPolarHBondContact CA-OG1 3.32Å; Q1750-T1753 PolarHBondContact O-N 3.33Å; Q1750-T1753 PolarHBondContact O-OG1 3.02Å; Q1750-T1753 VanDerWaalsContact O-OG1 3.09Å; M1751-T1753 PolarHBondContact O-N 3.22Å; T1753-N1755 PolarHBondContact O-N 3.41Å; T1753-S1756 PolarHBondContact O-N 3.09Å; T1753-S1756 PolarHBondContact O-OG 3.01Å; T1753-V1757 WeakPolarHBondContact O-CG2 3.43Å; T1753-V1757 PolarHBondContact O-N 3.43Å
1754	E	44.6	Very low	52.4	Low	93 Å²	93	90.9 Å²	90.9	44%	0.435	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-41.4	174.8	-73.1	-179.9	-158.4	0	0	111.9	Q1750 S1756 V1757 V1758	Q1750-E1754 HydrophobicContact CG-CG 4.41Å; Q1750-E1754 WeakPolarHBondContact CG-OE1 3.35Å; Q1750-E1754 PolarHBondContact NE2-OE1 3.37Å; Q1750-E1754 WeakPolarHBondContact O-CB 3.47Å; Q1750-E1754 WeakPolarHBondContact O-CG 3.4Å; Q1750-E1754 PolarHBondContact O-N 3.46Å; E1754-S1756 VanDerWaalsContact C-N 3.31Å; E1754-S1756 PolarHBondContact O-N 3.12Å; E1754-V1757 PolarHBondContact O-N 2.93Å; E1754-V1757 VanDerWaalsContact O-N 3.16Å; E1754-V1758 WeakPolarHBondContact O-CG2 3.4Å; E1754-V1758 PolarHBondContact O-N 3.27Å
1755	N	59.4	Low	52.1	Low	83 Å²	83	92 Å²	92	44%	0.444	49%	0.488	S	S	.	.	H	α-helix	trans	-64.9	-33.8	175.5	-166.9	9.2	0	0	0	111.8	M1751 T1753 Q1759	M1751-N1755 WeakPolarHBondContact O-CB 3.39Å; M1751-N1755 PolarHBondContact O-N 3.39Å; T1753-N1755 PolarHBondContact O-N 3.41Å; N1755-Q1759 WeakPolarHBondContact O-CB 3.38Å; N1755-Q1759 WeakPolarHBondContact O-CG 3.24Å; N1755-Q1759 PolarHBondContact O-N 3.04Å; N1755-Q1759 PolarHBondContact OD1-NE2 3.13Å
1756	S	58.3	Low	51.1	Low	66 Å²	66	93.8 Å²	93.8	46%	0.462	49%	0.494	S	S	.	.	H	α-helix	trans	-68	-37.4	171.7	81.3	0	0	0	0	112.9	D1752 T1753 E1754 Q1759 S1760	D1752-S1756 WeakPolarHBondContact O-CB 3.38Å; D1752-S1756 PolarHBondContact O-N 3.26Å; T1753-S1756 PolarHBondContact O-N 3.09Å; T1753-S1756 PolarHBondContact O-OG 3.01Å; E1754-S1756 VanDerWaalsContact C-N 3.31Å; E1754-S1756 PolarHBondContact O-N 3.12Å; S1756-Q1759 PolarHBondContact O-N 3.44Å; S1756-S1760 WeakPolarHBondContact O-CB 3.32Å; S1756-S1760 PolarHBondContact O-N 3.41Å
1757	V	56.1	Low	50.5	Low	79 Å²	79	91.8 Å²	91.8	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-66.8	-44.8	174.6	172	0	0	0	0	110.2	T1753 E1754 Q1759 S1760 L1761	T1753-V1757 WeakPolarHBondContact O-CG2 3.43Å; T1753-V1757 PolarHBondContact O-N 3.43Å; E1754-V1757 PolarHBondContact O-N 2.93Å; E1754-V1757 VanDerWaalsContact O-N 3.16Å; V1757-Q1759 VanDerWaalsContact C-N 3.35Å; V1757-Q1759 PolarHBondContact O-N 3.26Å; V1757-S1760 PolarHBondContact O-N 2.87Å; V1757-S1760 VanDerWaalsContact O-N 3.15Å; V1757-S1760 PolarHBondContact O-OG 3.19Å; V1757-L1761 HydrophobicContact CG1-CD1 4.07Å; V1757-L1761 PolarHBondContact O-N 3.5Å
1758	V	49	Very low	50.2	Low	78 Å²	78	92.7 Å²	92.7	47%	0.473	51%	0.512	S	S	.	.	H	α-helix	trans	-60.8	-40.9	175.4	169.9	0	0	0	0	111.6	E1754 L1761 L1762	E1754-V1758 WeakPolarHBondContact O-CG2 3.4Å; E1754-V1758 PolarHBondContact O-N 3.27Å; V1758-L1761 PolarHBondContact O-N 3.47Å; V1758-L1762 HydrophobicContact CG1-CD1 3.95Å; V1758-L1762 WeakPolarHBondContact O-CB 3.31Å; V1758-L1762 PolarHBondContact O-N 3.15Å
1759	Q	51.6	Low	48.9	Very low	123 Å²	123	93 Å²	93	58%	0.575	52%	0.522	S	S	*	.	H	α-helix	trans	-69	-33.9	173.5	-74.6	-176.7	37.1	0	0	113.2	N1755 S1756 V1757 S1763	N1755-Q1759 WeakPolarHBondContact O-CB 3.38Å; N1755-Q1759 WeakPolarHBondContact O-CG 3.24Å; N1755-Q1759 PolarHBondContact O-N 3.04Å; N1755-Q1759 PolarHBondContact OD1-NE2 3.13Å; S1756-Q1759 PolarHBondContact O-N 3.44Å; V1757-Q1759 VanDerWaalsContact C-N 3.35Å; V1757-Q1759 PolarHBondContact O-N 3.26Å; Q1759-S1763 WeakPolarHBondContact O-CB 3.34Å; Q1759-S1763 PolarHBondContact O-N 3.23Å; Q1759-S1763 PolarHBondContact O-OG 3.03Å
1760	S	56.1	Low	47.4	Very low	55 Å²	55	91.8 Å²	91.8	39%	0.385	53%	0.525	S	S	.	.	H	α-helix	trans	-67.7	-37.9	174.7	76.6	0	0	0	0	112.2	S1756 V1757 S1763 Q1764	S1756-S1760 WeakPolarHBondContact O-CB 3.32Å; S1756-S1760 PolarHBondContact O-N 3.41Å; V1757-S1760 PolarHBondContact O-N 2.87Å; V1757-S1760 VanDerWaalsContact O-N 3.15Å; V1757-S1760 PolarHBondContact O-OG 3.19Å; S1760-S1763 PolarHBondContact O-OG 3.05Å; S1760-Q1764 WeakPolarHBondContact O-CG 3.41Å; S1760-Q1764 PolarHBondContact O-N 2.87Å; S1760-Q1764 VanDerWaalsContact O-N 3.08Å
1761	L	43.5	Very low	46.3	Very low	97 Å²	97	97.1 Å²	97.1	51%	0.508	55%	0.554	S	S	.	*	H	α-helix	trans	-70	-44.9	174.3	-73.2	166.5	0	0	0	111.6	V1757 V1758 S1763 Q1764 V1765	V1757-L1761 HydrophobicContact CG1-CD1 4.07Å; V1757-L1761 PolarHBondContact O-N 3.5Å; V1758-L1761 PolarHBondContact O-N 3.47Å; L1761-S1763 PolarHBondContact O-N 2.69Å; L1761-Q1764 PolarHBondContact O-N 3.06Å; L1761-V1765 WeakPolarHBondContact O-CG2 3.44Å; L1761-V1765 PolarHBondContact O-N 2.89Å
1762	L	40.4	Very low	45.4	Very low	81 Å²	81	99.2 Å²	99.2	42%	0.424	57%	0.565	S	S	.	*	H	α-helix	trans	-60	-44	175.4	-86.4	161.9	0	0	0	112	V1758 Q1764 V1765 E1766	V1758-L1762 HydrophobicContact CG1-CD1 3.95Å; V1758-L1762 WeakPolarHBondContact O-CB 3.31Å; V1758-L1762 PolarHBondContact O-N 3.15Å; L1762-Q1764 PolarHBondContact O-N 3.44Å; L1762-V1765 PolarHBondContact O-N 2.83Å; L1762-V1765 VanDerWaalsContact O-N 3.16Å; L1762-E1766 WeakPolarHBondContact O-CB 3.41Å; L1762-E1766 WeakPolarHBondContact O-CG 3.45Å; L1762-E1766 PolarHBondContact O-N 3.47Å
1763	S	44.5	Very low	43.9	Very low	64 Å²	64	102.7 Å²	102.7	45%	0.448	58%	0.575	S	S	.	*	H	α-helix	trans	-70.7	-26.5	178	53	0	0	0	0	113.8	Q1759 S1760 L1761 S1767	Q1759-S1763 WeakPolarHBondContact O-CB 3.34Å; Q1759-S1763 PolarHBondContact O-N 3.23Å; Q1759-S1763 PolarHBondContact O-OG 3.03Å; S1760-S1763 PolarHBondContact O-OG 3.05Å; L1761-S1763 PolarHBondContact O-N 2.69Å; S1763-S1767 VanDerWaalsContact O-CB 3.29Å; S1763-S1767 WeakPolarHBondContact O-CB 3.46Å; S1763-S1767 PolarHBondContact O-N 2.9Å; S1763-S1767 PolarHBondContact O-OG 3.34Å
1764	Q	43.8	Very low	42.3	Very low	131 Å²	131	104 Å²	104	61%	0.612	59%	0.588	S	S	*	*	H	α-helix	trans	-70.3	-34.2	167.7	-77.2	-177.7	-7.8	0	0	112.8	S1760 L1761 L1762 S1767 S1768	S1760-Q1764 WeakPolarHBondContact O-CG 3.41Å; S1760-Q1764 PolarHBondContact O-N 2.87Å; S1760-Q1764 VanDerWaalsContact O-N 3.08Å; L1761-Q1764 PolarHBondContact O-N 3.06Å; L1762-Q1764 PolarHBondContact O-N 3.44Å; Q1764-S1767 PolarHBondContact O-OG 3.21Å; Q1764-S1768 PolarHBondContact O-OG 3.44Å
1765	V	41	Very low	41.7	Very low	106 Å²	106	108 Å²	108	64%	0.642	61%	0.606	S	S	*	*	H	α-helix	trans	-75.5	-40	175.5	173.2	0	0	0	0	111.8	L1761 L1762 S1767 S1768	L1761-V1765 WeakPolarHBondContact O-CG2 3.44Å; L1761-V1765 PolarHBondContact O-N 2.89Å; L1762-V1765 PolarHBondContact O-N 2.83Å; L1762-V1765 VanDerWaalsContact O-N 3.16Å; V1765-S1767 VanDerWaalsContact C-N 3.3Å; V1765-S1767 PolarHBondContact O-N 2.94Å; V1765-S1768 PolarHBondContact O-OG 3.46Å
1766	E	36.8	Very low	40.1	Very low	128 Å²	128	113.8 Å²	113.8	60%	0.598	63%	0.628	S	S	*	*	H	α-helix	trans	-70	-23.3	176.8	-73.5	-176.8	144.1	0	0	113.2	L1762 H1828	L1762-E1766 WeakPolarHBondContact O-CB 3.41Å; L1762-E1766 WeakPolarHBondContact O-CG 3.45Å; L1762-E1766 PolarHBondContact O-N 3.47Å; E1766-H1828 IonicContact OE1-CE1 2.72Å
1767	S	40.3	Very low	38.8	Very low	93 Å²	93	115.7 Å²	115.7	65%	0.65	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	5.5	-180	55	0	0	0	0	115.4	S1763 Q1764 V1765	S1763-S1767 VanDerWaalsContact O-CB 3.29Å; S1763-S1767 WeakPolarHBondContact O-CB 3.46Å; S1763-S1767 PolarHBondContact O-N 2.9Å; S1763-S1767 PolarHBondContact O-OG 3.34Å; Q1764-S1767 PolarHBondContact O-OG 3.21Å; V1765-S1767 VanDerWaalsContact C-N 3.3Å; V1765-S1767 PolarHBondContact O-N 2.94Å
1768	S	35.1	Very low	37.5	Very low	92 Å²	92	117.5 Å²	117.5	64%	0.643	64%	0.644	S	S	*	*	S	Bend	trans	-120.7	42.5	-173.1	47.7	0	0	0	0	115.3	Q1764 V1765	Q1764-S1768 PolarHBondContact O-OG 3.44Å; V1765-S1768 PolarHBondContact O-OG 3.46Å
1769	S	28.9	Very low	36.6	Very low	100 Å²	100	117 Å²	117	70%	0.699	64%	0.639	S	S	*	*			trans	-151	164	163.3	72.9	0	0	0	0	111.1
1770	P	33.6	Very low	35.5	Very low	105 Å²	105	118.2 Å²	118.2	68%	0.682	64%	0.642	S	S	*	*			cis	-126.4	-178.9	-0.9	42.9	-29.6	0	0	0	113.6
1771	I	34.1	Very low	34.3	Very low	177 Å²	177	121.1 Å²	121.1	91%	0.908	66%	0.659	S	S	*	*			trans	-164.8	156.8	138	-103.1	155.7	0	0	0	108.8
1772	I	31.2	Very low	33.6	Very low	139 Å²	139	121.5 Å²	121.5	71%	0.713	67%	0.666	S	S	*	*			trans	-130.1	139.9	-155.5	-37.3	174.5	0	0	0	111.9
1773	K	31	Very low	33.1	Very low	184 Å²	184	125.4 Å²	125.4	80%	0.8	69%	0.687	S	S	*	*			trans	131	141.4	138.8	-70.8	178.7	-177.8	178.7	0	116.5
1774	S	29.6	Very low	32.2	Very low	109 Å²	109	131.7 Å²	131.7	76%	0.762	70%	0.703	S	S	*	*			trans	74.6	138.8	149.8	36.1	0	0	0	0	122.3
1775	E	31.4	Very low	31.4	Very low	177 Å²	177	131.1 Å²	131.1	83%	0.827	71%	0.71	S	S	*	*			trans	72.8	86.7	154.2	-65.7	-174.1	140.9	0	0	121.5
1776	K	27.2	Very low	30.8	Very low	206 Å²	206	132.6 Å²	132.6	90%	0.896	72%	0.72	S	S	*	*				37.5	91.7	122.7	-64.8	-178.6	177.5	178.2	0	117.7
1777	S	30.3	Very low	30.3	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	72%	0.722	S	S	*	*			trans	-159.3	143.5	134.5	51.4	0	0	0	0	110.6	N1779	S1777-N1779 PolarHBondContact O-N 3.48Å
1778	H	29	Very low	29.8	Very low	117 Å²	117	131.6 Å²	131.6	54%	0.542	72%	0.724	S	S	.	*			trans	-67.7	122.9	-178.3	-68.2	-93	0	0	0	111.4	E1963	H1778-E1963 IonicContact CE1-OE1 3.47Å; H1778-E1963 IonicContact CE1-OE2 2.8Å; H1778-E1963 PolarHBondContact CE1-OE2 2.85Å; H1778-E1963 IonicContact CG-OE1 2.72Å; H1778-E1963 IonicContact ND1-OE1 3.71Å; H1778-E1963 PolarHBondContact ND1-OE1 2.95Å; H1778-E1963 IonicContact ND1-OE2 3.31Å; H1778-E1963 PolarHBondContact ND1-OE2 3.45Å
1779	N	30.2	Very low	29.5	Very low	67 Å²	67	135 Å²	135	36%	0.358	73%	0.734	S	S	.	*			trans	-154.6	116.6	153.9	-85.8	-82.2	0	0	0	106.6	S1777 P1781 K1959	S1777-N1779 PolarHBondContact O-N 3.48Å; N1779-P1781 VanDerWaalsContact O-CD 3.32Å; N1779-P1781 WeakPolarHBondContact O-CD 3.26Å; N1779-K1959 PolarHBondContact ND2-NZ 3.1Å; N1779-K1959 WeakPolarHBondContact OD1-CE 3.43Å; N1779-K1959 PolarHBondContact OD1-NZ 3.41Å
1780	K	28	Very low	29.5	Very low	149 Å²	149	138.3 Å²	138.3	65%	0.648	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-57.4	120.8	171.9	-90.3	179.3	173.9	-178.6	0	109	T1782 P1962	K1780-T1782 PolarHBondContact O-N 2.93Å; K1780-P1962 HydrophobicContact CB-CG 4.47Å; K1780-P1962 HydrophobicContact CD-CB 4.3Å; K1780-P1962 HydrophobicContact CD-CG 4.1Å; K1780-P1962 HydrophobicContact CG-CG 3.83Å
1781	P	30.5	Very low	29.6	Very low	115 Å²	115	137.2 Å²	137.2	75%	0.747	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-63	133.5	162.2	28.4	-31.8	0	0	0	107.4	N1779 N1783	N1779-P1781 VanDerWaalsContact O-CD 3.32Å; N1779-P1781 WeakPolarHBondContact O-CD 3.26Å; P1781-N1783 PolarHBondContact O-N 3.38Å
1782	T	29.5	Very low	29.6	Very low	106 Å²	106	132 Å²	132	65%	0.65	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-62.5	124.8	178.7	43.1	0	0	0	0	109.9	K1780 Y1784	K1780-T1782 PolarHBondContact O-N 2.93Å; T1782-Y1784 VanDerWaalsContact C-N 3.35Å; T1782-Y1784 PolarHBondContact O-N 2.93Å
1783	N	28.5	Very low	29.6	Very low	162 Å²	162	129.8 Å²	129.8	87%	0.866	69%	0.69	S	S	*	*			trans	-59.1	102.3	162	-80.7	1.1	0	0	0	107.7	P1781	P1781-N1783 PolarHBondContact O-N 3.38Å
1784	Y	26	Very low	29.8	Very low	197 Å²	197	127.1 Å²	127.1	77%	0.773	68%	0.679	S	S	*	*			trans	-57.4	139.1	160.6	-78.1	-94	0	0	0	107.6	T1782 T1786	T1782-Y1784 VanDerWaalsContact C-N 3.35Å; T1782-Y1784 PolarHBondContact O-N 2.93Å; Y1784-T1786 PolarHBondContact O-N 3.31Å; Y1784-T1786 VanDerWaalsContact O-N 3.09Å
1785	P	26.5	Very low	30	Very low	118 Å²	118	125.2 Å²	125.2	77%	0.766	66%	0.66	S	S	*	*			trans	-61.5	120.8	177.5	26.2	-32.9	0	0	0	108	S1787	P1785-S1787 PolarHBondContact O-N 2.88Å
1786	T	29.9	Very low	30.3	Very low	137 Å²	137	121.9 Å²	121.9	84%	0.84	64%	0.643	S	S	*	*			trans	-57.7	106	162.1	45	0	0	0	0	106.4	Y1784	Y1784-T1786 PolarHBondContact O-N 3.31Å; Y1784-T1786 VanDerWaalsContact O-N 3.09Å
1787	S	26.3	Very low	30.7	Very low	93 Å²	93	119.4 Å²	119.4	65%	0.65	63%	0.628	S	S	*	*			trans	-49.2	138.2	176.7	49.6	0	0	0	0	109	P1785 I1789	P1785-S1787 PolarHBondContact O-N 2.88Å; S1787-I1789 PolarHBondContact O-N 3.36Å
1788	P	28.6	Very low	31.2	Very low	108 Å²	108	121 Å²	121	70%	0.701	62%	0.623	S	S	*	*			trans	-54.6	124.1	178.9	24.6	-33.7	0	0	0	108.1	F1790	P1788-F1790 PolarHBondContact O-N 3.05Å
1789	I	28.5	Very low	31.6	Very low	163 Å²	163	122 Å²	122	84%	0.836	63%	0.629	S	S	*	*			trans	-58.8	109.8	169.9	-64.6	174.5	0	0	0	104.6	S1787 N1791	S1787-I1789 PolarHBondContact O-N 3.36Å; I1789-N1791 PolarHBondContact O-N 3.15Å
1790	F	29.3	Very low	32.1	Very low	170 Å²	170	121.5 Å²	121.5	75%	0.746	63%	0.625	S	S	*	*			trans	-61.3	103.2	-172.7	-129.6	-95.1	0	0	0	106.9	P1788 S1792 L1795	P1788-F1790 PolarHBondContact O-N 3.05Å; F1790-S1792 PolarHBondContact O-N 3.34Å; F1790-L1795 HydrophobicContact CD1-CD1 4.19Å; F1790-L1795 HydrophobicContact CE1-CD1 4.24Å
1791	N	36.1	Very low	32.3	Very low	81 Å²	81	119.5 Å²	119.5	43%	0.433	63%	0.628	S	S	.	*			trans	-73.2	98	-170	-169.2	6.9	0	0	0	108.1	I1789 E1793 F1794	I1789-N1791 PolarHBondContact O-N 3.15Å; N1791-E1793 PolarHBondContact ND2-OE2 3.3Å; N1791-E1793 VanDerWaalsContact ND2-OE2 3.12Å; N1791-E1793 PolarHBondContact O-N 3.38Å; N1791-E1793 VanDerWaalsContact O-N 3.14Å; N1791-E1793 WeakPolarHBondContact OD1-CB 3.35Å; N1791-E1793 PolarHBondContact OD1-N 2.99Å; N1791-F1794 HydrophobicContact CB-CB 4.4Å; N1791-F1794 VanDerWaalsContact O-CB 3.28Å; N1791-F1794 WeakPolarHBondContact O-CB 3.37Å; N1791-F1794 PolarHBondContact O-N 3.01Å
1792	S	33.2	Very low	32.7	Very low	69 Å²	69	121.8 Å²	121.8	48%	0.483	63%	0.629	S	S	.	*	H	α-helix	trans	-59.3	-24.1	179	56.3	0	0	0	0	111.4	F1790 F1794 L1795 F1796	F1790-S1792 PolarHBondContact O-N 3.34Å; S1792-F1794 VanDerWaalsContact C-N 3.28Å; S1792-F1794 PolarHBondContact O-N 3.47Å; S1792-L1795 PolarHBondContact O-N 2.87Å; S1792-F1796 WeakPolarHBondContact O-CB 3.47Å; S1792-F1796 WeakPolarHBondContact O-CD2 3.4Å; S1792-F1796 PolarHBondContact O-N 2.99Å
1793	E	31.4	Very low	32.8	Very low	91 Å²	91	124.8 Å²	124.8	43%	0.425	63%	0.633	S	S	.	*	H	α-helix	trans	-57.9	-35.5	168.4	-163	-160.3	166.7	0	0	112.7	N1791 R1797	N1791-E1793 PolarHBondContact ND2-OE2 3.3Å; N1791-E1793 VanDerWaalsContact ND2-OE2 3.12Å; N1791-E1793 PolarHBondContact O-N 3.38Å; N1791-E1793 VanDerWaalsContact O-N 3.14Å; N1791-E1793 WeakPolarHBondContact OD1-CB 3.35Å; N1791-E1793 PolarHBondContact OD1-N 2.99Å; E1793-R1797 WeakPolarHBondContact O-CB 3.2Å; E1793-R1797 VanDerWaalsContact O-CG 3.28Å; E1793-R1797 WeakPolarHBondContact O-CG 3.49Å; E1793-R1797 PolarHBondContact O-N 3.26Å; E1793-R1797 IonicContact OE1-CZ 3.77Å; E1793-R1797 IonicContact OE1-NE 2.75Å; E1793-R1797 PolarHBondContact OE1-NE 2.89Å; E1793-R1797 IonicContact OE1-NH2 3.24Å; E1793-R1797 PolarHBondContact OE1-NH2 3.02Å
1794	F	36	Very low	32.9	Very low	129 Å²	129	121.1 Å²	121.1	57%	0.566	61%	0.613	S	S	*	*	H	α-helix	trans	-75.2	-38.3	-179	-156.3	-86.9	0	0	0	111.8	N1791 S1792 R1797 Q1798	N1791-F1794 HydrophobicContact CB-CB 4.4Å; N1791-F1794 VanDerWaalsContact O-CB 3.28Å; N1791-F1794 WeakPolarHBondContact O-CB 3.37Å; N1791-F1794 PolarHBondContact O-N 3.01Å; S1792-F1794 VanDerWaalsContact C-N 3.28Å; S1792-F1794 PolarHBondContact O-N 3.47Å; F1794-R1797 PolarHBondContact O-N 3.36Å; F1794-Q1798 PolarHBondContact O-N 3.45Å
1795	L	34.7	Very low	33.1	Very low	68 Å²	68	117.3 Å²	117.3	36%	0.356	61%	0.613	S	S	.	*	H	α-helix	trans	-67.2	-41.8	169.7	-82.5	164.4	0	0	0	111.5	F1790 S1792 Q1798 Q1799	F1790-L1795 HydrophobicContact CD1-CD1 4.19Å; F1790-L1795 HydrophobicContact CE1-CD1 4.24Å; S1792-L1795 PolarHBondContact O-N 2.87Å; L1795-Q1798 PolarHBondContact O-N 3.32Å; L1795-Q1799 PolarHBondContact O-N 2.85Å; L1795-Q1799 VanDerWaalsContact O-N 3.12Å
1796	F	37.5	Very low	33.2	Very low	108 Å²	108	116.8 Å²	116.8	47%	0.474	61%	0.607	S	S	.	*	H	α-helix	trans	-56.4	-49.5	170.6	-101.7	-119.3	0	0	0	111	L1747 S1792 Q1798 Q1799 I1800	L1747-F1796 HydrophobicContact CD1-CZ 4.08Å; S1792-F1796 WeakPolarHBondContact O-CB 3.47Å; S1792-F1796 WeakPolarHBondContact O-CD2 3.4Å; S1792-F1796 PolarHBondContact O-N 2.99Å; F1796-Q1798 PolarHBondContact O-N 3.34Å; F1796-Q1799 PolarHBondContact O-N 3.43Å; F1796-I1800 HydrophobicContact CB-CD1 4.33Å; F1796-I1800 HydrophobicContact CD1-CD1 3.37Å; F1796-I1800 HydrophobicContact CE1-CD1 3.75Å; F1796-I1800 HydrophobicContact CG-CD1 3.93Å; F1796-I1800 WeakPolarHBondContact O-CB 3.17Å; F1796-I1800 WeakPolarHBondContact O-CG1 3.24Å; F1796-I1800 PolarHBondContact O-N 3.31Å
1797	R	35.8	Very low	33.2	Very low	153 Å²	153	116.2 Å²	116.2	58%	0.577	60%	0.603	S	S	*	*	H	α-helix	trans	-54.6	-52.2	176.5	-79.3	176.3	-172.2	-142.4	6.1	111.2	E1793 F1794 Q1799 I1800 C1801	E1793-R1797 WeakPolarHBondContact O-CB 3.2Å; E1793-R1797 VanDerWaalsContact O-CG 3.28Å; E1793-R1797 WeakPolarHBondContact O-CG 3.49Å; E1793-R1797 PolarHBondContact O-N 3.26Å; E1793-R1797 IonicContact OE1-CZ 3.77Å; E1793-R1797 IonicContact OE1-NE 2.75Å; E1793-R1797 PolarHBondContact OE1-NE 2.89Å; E1793-R1797 IonicContact OE1-NH2 3.24Å; E1793-R1797 PolarHBondContact OE1-NH2 3.02Å; F1794-R1797 PolarHBondContact O-N 3.36Å; R1797-Q1799 VanDerWaalsContact C-N 3.34Å; R1797-Q1799 PolarHBondContact O-N 3.19Å; R1797-I1800 PolarHBondContact O-N 2.84Å; R1797-C1801 WeakPolarHBondContact O-CB 3.43Å; R1797-C1801 PolarHBondContact O-N 3.38Å; R1797-C1801 PolarHBondContact O-SG 3.1Å
1798	Q	40.1	Very low	33.3	Very low	140 Å²	140	117.2 Å²	117.2	65%	0.654	61%	0.61	S	S	*	*	H	α-helix	trans	-61.6	-36.9	-177.8	-77.6	-168	-21.2	0	0	113.9	F1794 L1795 F1796	F1794-Q1798 PolarHBondContact O-N 3.45Å; L1795-Q1798 PolarHBondContact O-N 3.32Å; F1796-Q1798 PolarHBondContact O-N 3.34Å
1799	Q	37.8	Very low	33.4	Very low	139 Å²	139	118.3 Å²	118.3	65%	0.65	62%	0.615	S	S	*	*	H	α-helix	trans	-88.5	-23.9	-178.3	-67	-175.4	-14.3	0	0	114	L1795 F1796 R1797	L1795-Q1799 PolarHBondContact O-N 2.85Å; L1795-Q1799 VanDerWaalsContact O-N 3.12Å; F1796-Q1799 PolarHBondContact O-N 3.43Å; R1797-Q1799 VanDerWaalsContact C-N 3.34Å; R1797-Q1799 PolarHBondContact O-N 3.19Å
1800	I	40.3	Very low	33.5	Very low	55 Å²	55	116 Å²	116	28%	0.282	61%	0.611	S	S	.	*	H	α-helix	trans	-104.2	-6.3	-173.8	-62.1	169.2	0	0	0	113.1	F1796 R1797 H1802 F1803 L1804	F1796-I1800 HydrophobicContact CB-CD1 4.33Å; F1796-I1800 HydrophobicContact CD1-CD1 3.37Å; F1796-I1800 HydrophobicContact CE1-CD1 3.75Å; F1796-I1800 HydrophobicContact CG-CD1 3.93Å; F1796-I1800 WeakPolarHBondContact O-CB 3.17Å; F1796-I1800 WeakPolarHBondContact O-CG1 3.24Å; F1796-I1800 PolarHBondContact O-N 3.31Å; R1797-I1800 PolarHBondContact O-N 2.84Å; I1800-H1802 PolarHBondContact O-N 3.02Å; I1800-F1803 PolarHBondContact O-N 3.04Å; I1800-L1804 HydrophobicContact CG2-CB 3.8Å; I1800-L1804 HydrophobicContact CG2-CD1 3.99Å; I1800-L1804 HydrophobicContact CG2-CG 4.23Å; I1800-L1804 PolarHBondContact O-N 3.09Å
1801	C	31.9	Very low	33.5	Very low	107 Å²	107	115.6 Å²	115.6	72%	0.723	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-8.3	170	-86.9	0	0	0	0	115.1	R1797	R1797-C1801 WeakPolarHBondContact O-CB 3.43Å; R1797-C1801 PolarHBondContact O-N 3.38Å; R1797-C1801 PolarHBondContact O-SG 3.1Å
1802	H	38.3	Very low	33.2	Very low	164 Å²	164	118 Å²	118	76%	0.759	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-9.5	172.2	-128.6	-52.2	0	0	0	114.8	I1800	I1800-H1802 PolarHBondContact O-N 3.02Å
1803	F	32.2	Very low	33.1	Very low	168 Å²	168	123.7 Å²	123.7	74%	0.737	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145	-23	-169.8	-76.2	-72.1	0	0	0	119	I1800	I1800-F1803 PolarHBondContact O-N 3.04Å
1804	L	30.3	Very low	33	Very low	85 Å²	85	126.1 Å²	126.1	45%	0.445	66%	0.659	S	S	.	*			trans	-140.4	124.6	-174.8	-70.8	168.1	0	0	0	114.4	I1800 V1806 T1847	I1800-L1804 HydrophobicContact CG2-CB 3.8Å; I1800-L1804 HydrophobicContact CG2-CD1 3.99Å; I1800-L1804 HydrophobicContact CG2-CG 4.23Å; I1800-L1804 PolarHBondContact O-N 3.09Å; L1804-V1806 HydrophobicContact CB-CG2 4.27Å; L1804-T1847 HydrophobicContact CD2-CG2 4.14Å
1805	P	30.7	Very low	32.6	Very low	118 Å²	118	127.2 Å²	127.2	77%	0.766	67%	0.67	S	S	*	*			trans	-85.2	113.5	160.4	32.6	-28	0	0	0	109.9
1806	V	28.8	Very low	32.5	Very low	106 Å²	106	131.8 Å²	131.8	64%	0.642	69%	0.694	S	S	*	*			trans	-108.4	112.9	177.1	-177.2	0	0	0	0	109.5	L1804	L1804-V1806 HydrophobicContact CB-CG2 4.27Å
1807	T	29.8	Very low	32	Very low	125 Å²	125	132.1 Å²	132.1	77%	0.767	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-82.9	139.7	169.4	43.8	0	0	0	0	110.5	V1809	T1807-V1809 PolarHBondContact O-N 2.89Å
1808	S	28.9	Very low	31.7	Very low	114 Å²	114	132.7 Å²	132.7	80%	0.797	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-73.1	122.3	179.8	51.2	0	0	0	0	111.4
1809	V	29	Very low	31.2	Very low	131 Å²	131	133.1 Å²	133.1	79%	0.794	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-80.7	118.9	166.8	179.8	0	0	0	0	108.2	T1807 L1811	T1807-V1809 PolarHBondContact O-N 2.89Å; V1809-L1811 PolarHBondContact O-N 3.38Å
1810	P	30.6	Very low	31	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-66.9	132.9	178.4	27.3	-33.7	0	0	0	110.9
1811	L	29.8	Very low	30.4	Very low	160 Å²	160	142.6 Å²	142.6	84%	0.838	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-77.4	129.9	167.4	-71.5	170.3	0	0	0	108.6	V1809 E1813	V1809-L1811 PolarHBondContact O-N 3.38Å; L1811-E1813 PolarHBondContact O-N 2.95Å; L1811-E1813 VanDerWaalsContact O-N 3.14Å
1812	N	30.6	Very low	30.2	Very low	132 Å²	132	140.6 Å²	140.6	71%	0.706	77%	0.767	S	S	*	*			trans	-82.1	94.3	-173.2	-154.6	76.7	0	0	0	110.3	E1814	N1812-E1814 PolarHBondContact ND2-OE2 3.36Å; N1812-E1814 PolarHBondContact O-N 3.11Å; N1812-E1814 VanDerWaalsContact O-N 3.1Å
1813	E	31.6	Very low	29.8	Very low	188 Å²	188	138.5 Å²	138.5	88%	0.879	77%	0.766	S	S	*	*			trans	-75.8	13.6	-174.7	-61.9	-162.1	132.2	0	0	115.2	L1811 N1815	L1811-E1813 PolarHBondContact O-N 2.95Å; L1811-E1813 VanDerWaalsContact O-N 3.14Å; E1813-N1815 PolarHBondContact O-N 3.42Å
1814	E	28.5	Very low	29.7	Very low	143 Å²	143	139 Å²	139	67%	0.668	77%	0.774	S	S	*	*			trans	-71	124.4	175.5	-64.5	-177.8	134.2	0	0	111.5	N1812	N1812-E1814 PolarHBondContact ND2-OE2 3.36Å; N1812-E1814 PolarHBondContact O-N 3.11Å; N1812-E1814 VanDerWaalsContact O-N 3.1Å
1815	N	28.1	Very low	29.9	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	79%	0.789	S	S	*	*			trans	105.1	43.3	169	-54.3	-74.8	0	0	0	119.4	E1813	E1813-N1815 PolarHBondContact O-N 3.42Å
1816	I	32.6	Very low	30	Very low	164 Å²	164	140.2 Å²	140.2	84%	0.841	79%	0.788	S	S	*	*			trans	-128.2	77.1	152.4	-48.9	-178.8	0	0	0	111
1817	S	26	Very low	30.1	Very low	115 Å²	115	143.4 Å²	143.4	80%	0.804	80%	0.8	S	S	*	*			trans	-94.3	110.8	163.8	47.1	0	0	0	0	109.6
1818	L	29.3	Very low	30.2	Very low	164 Å²	164	144.1 Å²	144.1	86%	0.859	80%	0.795	S	S	*	*			trans	-154.4	119.4	169.6	-116.6	158.6	0	0	0	111.5
1819	N	29.6	Very low	30.4	Very low	150 Å²	150	148.3 Å²	148.3	80%	0.802	80%	0.799	S	S	*	*			trans	-78.8	158.4	177.9	-74.1	-54.2	0	0	0	112.1
1820	K	33.3	Very low	30.5	Very low	197 Å²	197	151.1 Å²	151.1	86%	0.857	80%	0.8	S	S	*	*	S	Bend	trans	79.7	142.1	165.8	-61.8	-174.5	174.6	-175.7	0	118.1
1821	E	28.8	Very low	30.4	Very low	196 Å²	196	152.7 Å²	152.7	92%	0.916	80%	0.801	S	S	*	*			trans	-51.6	132.6	-179.3	-58.1	139.5	115.6	0	0	113.2
1822	G	27.8	Very low	30.4	Very low	64 Å²	64	154.1 Å²	154.1	66%	0.66	80%	0.795	S	S	*	*			trans	-175.2	80.8	-178.7	0	0	0	0	0	116.6
1823	T	29.7	Very low	30.6	Very low	120 Å²	120	152.4 Å²	152.4	74%	0.736	79%	0.791	S	S	*	*			trans	55.9	117.2	158.4	47.2	0	0	0	0	120	T1825	T1823-T1825 PolarHBondContact O-N 2.88Å
1824	I	29.9	Very low	30.8	Very low	178 Å²	178	149.1 Å²	149.1	91%	0.913	78%	0.779	S	S	*	*	S	Bend	trans	-77.6	80.1	179.2	-51.4	169.8	0	0	0	111
1825	T	33.8	Very low	31.5	Very low	123 Å²	123	146.5 Å²	146.5	76%	0.755	77%	0.77	S	S	*	*			trans	-142.2	4.7	-177.8	51.2	0	0	0	0	116.2	T1823	T1823-T1825 PolarHBondContact O-N 2.88Å
1826	S	34.2	Very low	32.2	Very low	106 Å²	106	143 Å²	143	74%	0.741	75%	0.751	S	S	*	*			trans	-105.8	-8.5	-169.4	56.6	0	0	0	0	116.6	H1828	S1826-H1828 PolarHBondContact O-N 2.93Å
1827	L	31.3	Very low	32.7	Very low	174 Å²	174	142.7 Å²	142.7	91%	0.911	74%	0.743	S	S	*	*			trans	-73.8	6.3	-168	-144.4	80.3	0	0	0	115.9
1828	H	31.2	Very low	33.7	Very low	140 Å²	140	142.8 Å²	142.8	65%	0.648	73%	0.726	S	S	*	*			trans	-93.2	11.3	-165.4	-108.7	-105.4	0	0	0	116.6	E1766 S1826 K1830	E1766-H1828 IonicContact OE1-CE1 2.72Å; S1826-H1828 PolarHBondContact O-N 2.93Å; H1828-K1830 PolarHBondContact O-N 2.89Å; H1828-K1830 VanDerWaalsContact O-N 3.09Å
1829	K	32.9	Very low	34.5	Very low	202 Å²	202	140.2 Å²	140.2	88%	0.878	71%	0.712	S	S	*	*			trans	-91.4	67.3	-167	-122.2	175.4	-172.1	173.2	0	115.3
1830	K	31	Very low	35.5	Very low	190 Å²	190	138.1 Å²	138.1	83%	0.826	70%	0.699	S	S	*	*			trans	22.6	98.2	159.8	-78.4	-176.6	171.6	176.2	0	116.9	H1828 R1832	H1828-K1830 PolarHBondContact O-N 2.89Å; H1828-K1830 VanDerWaalsContact O-N 3.09Å; K1830-R1832 PolarHBondContact O-N 2.84Å; K1830-R1832 VanDerWaalsContact O-N 3.13Å
1831	I	29.2	Very low	36.1	Very low	149 Å²	149	137 Å²	137	76%	0.764	69%	0.69	S	S	*	*			trans	-58.5	114.9	157	-61	172.8	0	0	0	107.7
1832	R	30.2	Very low	37.1	Very low	189 Å²	189	131.2 Å²	131.2	71%	0.713	67%	0.668	S	S	*	*			trans	-75.6	135.3	-179.5	-76.9	179.7	168.3	174.7	-4.5	110.2	K1830 N1834 N1835	K1830-R1832 PolarHBondContact O-N 2.84Å; K1830-R1832 VanDerWaalsContact O-N 3.13Å; R1832-N1834 PolarHBondContact O-N 3.09Å; R1832-N1835 PolarHBondContact O-N 3.1Å
1833	P	33.6	Very low	37.9	Very low	96 Å²	96	130 Å²	130	62%	0.623	65%	0.65	S	S	*	*	H	α-helix	trans	-61.7	-20.5	179.4	24.8	-34.7	0	0	0	113.5	N1835 I1836 K1837	P1833-N1835 PolarHBondContact O-N 3.3Å; P1833-I1836 PolarHBondContact O-N 3.42Å; P1833-K1837 PolarHBondContact O-N 3.33Å
1834	N	35.9	Very low	38.7	Very low	119 Å²	119	126.1 Å²	126.1	64%	0.636	63%	0.63	S	S	*	*	H	α-helix	trans	-59.6	-29.8	171.4	-70	12.4	0	0	0	112.9	R1832 R1838	R1832-N1834 PolarHBondContact O-N 3.09Å; N1834-R1838 WeakPolarHBondContact O-CB 3.48Å; N1834-R1838 PolarHBondContact O-N 3.45Å
1835	N	43	Very low	39.5	Very low	88 Å²	88	120.7 Å²	120.7	47%	0.471	60%	0.602	S	S	.	*	H	α-helix	trans	-67.9	-42.2	176.9	-79.4	16.5	0	0	0	111.2	R1832 P1833 R1838 I1839	R1832-N1835 PolarHBondContact O-N 3.1Å; P1833-N1835 PolarHBondContact O-N 3.3Å; N1835-R1838 PolarHBondContact O-N 2.78Å; N1835-R1838 VanDerWaalsContact O-N 3.15Å; N1835-I1839 WeakPolarHBondContact O-CB 3.47Å; N1835-I1839 WeakPolarHBondContact O-CD1 3.22Å; N1835-I1839 VanDerWaalsContact O-CG1 3.23Å; N1835-I1839 WeakPolarHBondContact O-CG1 3.29Å; N1835-I1839 PolarHBondContact O-N 3.28Å
1836	I	42.1	Very low	39.9	Very low	80 Å²	80	116.9 Å²	116.9	41%	0.41	58%	0.58	S	S	.	*	H	α-helix	trans	-62.2	-48.5	178.2	-61.1	173.7	0	0	0	110	P1833 R1838 I1839 I1840	P1833-I1836 PolarHBondContact O-N 3.42Å; I1836-R1838 VanDerWaalsContact C-N 3.26Å; I1836-R1838 PolarHBondContact O-N 3.01Å; I1836-I1839 PolarHBondContact O-N 3.12Å; I1836-I1840 HydrophobicContact CG2-CD1 3.83Å; I1836-I1840 VanDerWaalsContact O-CG1 3.32Å; I1836-I1840 WeakPolarHBondContact O-CG1 3.36Å; I1836-I1840 PolarHBondContact O-N 3.35Å
1837	K	43.2	Very low	40.1	Very low	157 Å²	157	114.9 Å²	114.9	68%	0.683	56%	0.563	S	S	*	*	H	α-helix	trans	-62.1	-31.6	175.1	-74.9	-173.2	174.5	179.4	0	113.2	P1833 W1841	P1833-K1837 PolarHBondContact O-N 3.33Å; K1837-W1841 WeakPolarHBondContact O-CB 3.3Å; K1837-W1841 PolarHBondContact O-N 3.01Å; K1837-W1841 VanDerWaalsContact O-N 3.12Å
1838	R	47.1	Very low	40.6	Very low	117 Å²	117	115.1 Å²	115.1	44%	0.442	56%	0.557	S	S	.	*	H	α-helix	trans	-73.7	-41.9	176.5	-162.8	175.3	-165.2	-138.5	-0.2	111.9	N1834 N1835 I1836 W1841 T1842 E1856	N1834-R1838 WeakPolarHBondContact O-CB 3.48Å; N1834-R1838 PolarHBondContact O-N 3.45Å; N1835-R1838 PolarHBondContact O-N 2.78Å; N1835-R1838 VanDerWaalsContact O-N 3.15Å; I1836-R1838 VanDerWaalsContact C-N 3.26Å; I1836-R1838 PolarHBondContact O-N 3.01Å; R1838-W1841 PolarHBondContact O-N 3.09Å; R1838-T1842 PolarHBondContact O-N 3.42Å; R1838-T1842 PolarHBondContact O-OG1 3.31Å; R1838-T1842 VanDerWaalsContact O-OG1 3.06Å; R1838-E1856 IonicContact CZ-OE1 3.3Å; R1838-E1856 VanDerWaalsContact NH1-CD 3.34Å; R1838-E1856 IonicContact NH1-OE1 2.66Å; R1838-E1856 PolarHBondContact NH1-OE1 3.11Å; R1838-E1856 IonicContact NH1-OE2 3.46Å; R1838-E1856 IonicContact NH2-OE1 2.71Å; R1838-E1856 PolarHBondContact NH2-OE1 3.39Å
1839	I	47.2	Very low	41.4	Very low	110 Å²	110	111.5 Å²	111.5	56%	0.564	55%	0.545	S	S	*	.	H	α-helix	trans	-62.1	-47.5	175.3	-70.9	162.3	0	0	0	110.5	N1835 I1836 W1841 T1842 S1843	N1835-I1839 WeakPolarHBondContact O-CB 3.47Å; N1835-I1839 WeakPolarHBondContact O-CD1 3.22Å; N1835-I1839 VanDerWaalsContact O-CG1 3.23Å; N1835-I1839 WeakPolarHBondContact O-CG1 3.29Å; N1835-I1839 PolarHBondContact O-N 3.28Å; I1836-I1839 PolarHBondContact O-N 3.12Å; I1839-W1841 VanDerWaalsContact C-N 3.32Å; I1839-W1841 PolarHBondContact O-N 2.93Å; I1839-T1842 WeakPolarHBondContact CA-OG1 3.25Å; I1839-T1842 PolarHBondContact O-N 3.16Å; I1839-T1842 PolarHBondContact O-OG1 3.15Å; I1839-S1843 WeakPolarHBondContact O-CB 3.5Å; I1839-S1843 PolarHBondContact O-N 2.94Å
1840	I	49.3	Very low	41.5	Very low	105 Å²	105	108.9 Å²	108.9	54%	0.538	54%	0.541	S	S	.	.	H	α-helix	trans	-59.8	-43.2	175.5	-67.6	167.7	0	0	0	110.6	I1836 S1843 A1844	I1836-I1840 HydrophobicContact CG2-CD1 3.83Å; I1836-I1840 VanDerWaalsContact O-CG1 3.32Å; I1836-I1840 WeakPolarHBondContact O-CG1 3.36Å; I1836-I1840 PolarHBondContact O-N 3.35Å; I1840-S1843 PolarHBondContact O-N 3.28Å; I1840-A1844 WeakPolarHBondContact O-CB 3.3Å; I1840-A1844 PolarHBondContact O-N 2.89Å
1841	W	47.2	Very low	42.1	Very low	174 Å²	174	106.5 Å²	106.5	66%	0.659	53%	0.531	S	S	*	.	H	α-helix	trans	-67.6	-38	176.1	-99.6	106.8	0	0	0	113.8	K1837 R1838 I1839 A1844 I1845	K1837-W1841 WeakPolarHBondContact O-CB 3.3Å; K1837-W1841 PolarHBondContact O-N 3.01Å; K1837-W1841 VanDerWaalsContact O-N 3.12Å; R1838-W1841 PolarHBondContact O-N 3.09Å; I1839-W1841 VanDerWaalsContact C-N 3.32Å; I1839-W1841 PolarHBondContact O-N 2.93Å; W1841-A1844 PolarHBondContact O-N 3.43Å; W1841-I1845 HydrophobicContact CE3-CD1 3.77Å; W1841-I1845 HydrophobicContact CE3-CG1 3.94Å; W1841-I1845 HydrophobicContact CZ3-CD1 4.29Å; W1841-I1845 HydrophobicContact CZ3-CG1 4.25Å; W1841-I1845 WeakPolarHBondContact O-CB 3.38Å; W1841-I1845 WeakPolarHBondContact O-CD1 3.41Å; W1841-I1845 VanDerWaalsContact O-CG1 3.26Å; W1841-I1845 WeakPolarHBondContact O-CG1 3.3Å; W1841-I1845 PolarHBondContact O-N 2.81Å
1842	T	48.4	Very low	42.7	Very low	74 Å²	74	104.4 Å²	104.4	45%	0.454	52%	0.521	S	S	.	.	H	α-helix	trans	-67.4	-37.3	174	44.1	0	0	0	0	112	R1838 I1839 I1845 S1846	R1838-T1842 PolarHBondContact O-N 3.42Å; R1838-T1842 PolarHBondContact O-OG1 3.31Å; R1838-T1842 VanDerWaalsContact O-OG1 3.06Å; I1839-T1842 WeakPolarHBondContact CA-OG1 3.25Å; I1839-T1842 PolarHBondContact O-N 3.16Å; I1839-T1842 PolarHBondContact O-OG1 3.15Å; T1842-I1845 PolarHBondContact O-N 3.47Å; T1842-S1846 PolarHBondContact O-N 3.46Å; T1842-S1846 PolarHBondContact O-OG 2.78Å
1843	S	44.5	Very low	43.6	Very low	40 Å²	40	98.9 Å²	98.9	28%	0.28	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-46.8	173.4	-174.3	0	0	0	0	111.4	I1839 I1840 I1845 S1846 T1847	I1839-S1843 WeakPolarHBondContact O-CB 3.5Å; I1839-S1843 PolarHBondContact O-N 2.94Å; I1840-S1843 PolarHBondContact O-N 3.28Å; S1843-I1845 VanDerWaalsContact C-N 3.26Å; S1843-I1845 PolarHBondContact O-N 3.18Å; S1843-S1846 WeakPolarHBondContact CA-OG 3.27Å; S1843-S1846 PolarHBondContact O-N 2.88Å; S1843-S1846 PolarHBondContact O-OG 3.04Å; S1843-T1847 PolarHBondContact O-N 3.25Å; S1843-T1847 VanDerWaalsContact O-N 3.08Å; S1843-T1847 PolarHBondContact O-OG1 2.78Å
1844	A	48.3	Very low	44.2	Very low	38 Å²	38	101.2 Å²	101.2	31%	0.314	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-31.9	177.3	0	0	0	0	0	112.6	I1840 W1841 T1847 F1848	I1840-A1844 WeakPolarHBondContact O-CB 3.3Å; I1840-A1844 PolarHBondContact O-N 2.89Å; W1841-A1844 PolarHBondContact O-N 3.43Å; A1844-T1847 WeakPolarHBondContact CA-OG1 3.37Å; A1844-T1847 PolarHBondContact O-OG1 3.26Å; A1844-F1848 WeakPolarHBondContact O-CB 3.3Å; A1844-F1848 PolarHBondContact O-N 3.48Å
1845	I	46.7	Very low	44.8	Very low	64 Å²	64	97.7 Å²	97.7	33%	0.328	49%	0.492	S	S	.	.	H	α-helix	trans	-79.6	-37.8	176.3	-71.5	166.9	0	0	0	111.9	W1841 T1842 S1843 T1847 F1848 V1849	W1841-I1845 HydrophobicContact CE3-CD1 3.77Å; W1841-I1845 HydrophobicContact CE3-CG1 3.94Å; W1841-I1845 HydrophobicContact CZ3-CD1 4.29Å; W1841-I1845 HydrophobicContact CZ3-CG1 4.25Å; W1841-I1845 WeakPolarHBondContact O-CB 3.38Å; W1841-I1845 WeakPolarHBondContact O-CD1 3.41Å; W1841-I1845 VanDerWaalsContact O-CG1 3.26Å; W1841-I1845 WeakPolarHBondContact O-CG1 3.3Å; W1841-I1845 PolarHBondContact O-N 2.81Å; T1842-I1845 PolarHBondContact O-N 3.47Å; S1843-I1845 VanDerWaalsContact C-N 3.26Å; S1843-I1845 PolarHBondContact O-N 3.18Å; I1845-T1847 VanDerWaalsContact C-N 3.31Å; I1845-T1847 PolarHBondContact O-N 2.84Å; I1845-F1848 PolarHBondContact O-N 2.81Å; I1845-F1848 VanDerWaalsContact O-N 3.15Å; I1845-V1849 HydrophobicContact CG2-CG2 4.4Å; I1845-V1849 WeakPolarHBondContact O-CB 3.46Å; I1845-V1849 WeakPolarHBondContact O-CG2 3.1Å; I1845-V1849 PolarHBondContact O-N 2.8Å
1846	S	41.3	Very low	45	Very low	42 Å²	42	99 Å²	99	29%	0.294	50%	0.495	S	S	.	.	H	α-helix	trans	-61.8	-41.5	173.4	51.6	0	0	0	0	111.3	T1842 S1843 F1848 V1849 D1850	T1842-S1846 PolarHBondContact O-N 3.46Å; T1842-S1846 PolarHBondContact O-OG 2.78Å; S1843-S1846 WeakPolarHBondContact CA-OG 3.27Å; S1843-S1846 PolarHBondContact O-N 2.88Å; S1843-S1846 PolarHBondContact O-OG 3.04Å; S1846-F1848 VanDerWaalsContact C-N 3.26Å; S1846-F1848 PolarHBondContact O-N 3.33Å; S1846-V1849 PolarHBondContact O-N 2.96Å; S1846-D1850 PolarHBondContact O-N 3.37Å
1847	T	38.4	Very low	45.7	Very low	64 Å²	64	102 Å²	102	39%	0.393	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-11.4	175.3	53.6	0	0	0	0	114.7	L1804 S1843 A1844 I1845	L1804-T1847 HydrophobicContact CD2-CG2 4.14Å; S1843-T1847 PolarHBondContact O-N 3.25Å; S1843-T1847 VanDerWaalsContact O-N 3.08Å; S1843-T1847 PolarHBondContact O-OG1 2.78Å; A1844-T1847 WeakPolarHBondContact CA-OG1 3.37Å; A1844-T1847 PolarHBondContact O-OG1 3.26Å; I1845-T1847 VanDerWaalsContact C-N 3.31Å; I1845-T1847 PolarHBondContact O-N 2.84Å
1848	F	41.1	Very low	46.1	Very low	179 Å²	179	99.6 Å²	99.6	79%	0.785	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.2	174.6	-117.8	-79.5	0	0	0	113.4	A1844 I1845 S1846	A1844-F1848 WeakPolarHBondContact O-CB 3.3Å; A1844-F1848 PolarHBondContact O-N 3.48Å; I1845-F1848 PolarHBondContact O-N 2.81Å; I1845-F1848 VanDerWaalsContact O-N 3.15Å; S1846-F1848 VanDerWaalsContact C-N 3.26Å; S1846-F1848 PolarHBondContact O-N 3.33Å
1849	V	48.3	Very low	46.1	Very low	64 Å²	64	95.5 Å²	95.5	39%	0.388	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135	-14.7	-167	-175.4	0	0	0	0	113.6	I1845 S1846 F1851 W1853	I1845-V1849 HydrophobicContact CG2-CG2 4.4Å; I1845-V1849 WeakPolarHBondContact O-CB 3.46Å; I1845-V1849 WeakPolarHBondContact O-CG2 3.1Å; I1845-V1849 PolarHBondContact O-N 2.8Å; S1846-V1849 PolarHBondContact O-N 2.96Å; V1849-F1851 HydrophobicContact CG1-CB 4.47Å; V1849-F1851 HydrophobicContact CG1-CD2 4.28Å; V1849-F1851 WeakPolarHBondContact O-CD2 3.32Å; V1849-F1851 PolarHBondContact O-N 3.36Å; V1849-W1853 HydrophobicContact CG1-CZ2 4.17Å
1850	D	36.4	Very low	46.3	Very low	147 Å²	147	93.4 Å²	93.4	79%	0.786	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	50.5	179.6	-72.3	-18.5	0	0	0	113.9	S1846	S1846-D1850 PolarHBondContact O-N 3.37Å
1851	F	41.9	Very low	46.6	Very low	141 Å²	141	92.4 Å²	92.4	62%	0.618	48%	0.476	S	S	*	.			trans	-137	131.5	178.2	-97.9	-85.3	0	0	0	113.8	V1849 W1853	V1849-F1851 HydrophobicContact CG1-CB 4.47Å; V1849-F1851 HydrophobicContact CG1-CD2 4.28Å; V1849-F1851 WeakPolarHBondContact O-CD2 3.32Å; V1849-F1851 PolarHBondContact O-N 3.36Å; F1851-W1853 HydrophobicContact CB-CZ2 4.09Å; F1851-W1853 VanDerWaalsContact O-CD1 3.29Å; F1851-W1853 PolarHBondContact O-N 3.49Å; F1851-W1853 PolarHBondContact O-NE1 3.21Å
1852	D	42.8	Very low	46.8	Very low	104 Å²	104	86.6 Å²	86.6	56%	0.556	46%	0.457	S	S	*	.			trans	-65.4	119.3	168.3	-61.6	-38.3	0	0	0	110.4	K593	K593-D1852 IonicContact NZ-OD2 3.41Å; K593-D1852 PolarHBondContact NZ-OD2 2.85Å
1853	W	49.1	Very low	46.9	Very low	74 Å²	74	89 Å²	89	28%	0.28	46%	0.462	S	S	.	.			trans	-97.8	89.8	-179.2	-63.3	104.9	0	0	0	112.8	V1849 F1851 S1855 Q1858 L1862	V1849-W1853 HydrophobicContact CG1-CZ2 4.17Å; F1851-W1853 HydrophobicContact CB-CZ2 4.09Å; F1851-W1853 VanDerWaalsContact O-CD1 3.29Å; F1851-W1853 PolarHBondContact O-N 3.49Å; F1851-W1853 PolarHBondContact O-NE1 3.21Å; W1853-S1855 PolarHBondContact O-N 2.76Å; W1853-S1855 VanDerWaalsContact O-N 3.08Å; W1853-Q1858 HydrophobicContact CE3-CB 4.48Å; W1853-L1862 HydrophobicContact CH2-CB 4.32Å; W1853-L1862 HydrophobicContact CH2-CD1 3.73Å; W1853-L1862 HydrophobicContact CH2-CD2 3.75Å; W1853-L1862 HydrophobicContact CH2-CG 4.12Å; W1853-L1862 HydrophobicContact CZ2-CD2 4.41Å; W1853-L1862 HydrophobicContact CZ3-CB 4.29Å; W1853-L1862 HydrophobicContact CZ3-CD1 3.94Å; W1853-L1862 HydrophobicContact CZ3-CG 4.47Å
1854	N	45.5	Very low	47.8	Very low	144 Å²	144	91.5 Å²	91.5	77%	0.77	47%	0.471	S	S	*	.			trans	-71.4	0.9	-177.7	-69.7	4.6	0	0	0	115.5
1855	S	48.8	Very low	48.3	Very low	46 Å²	46	91.2 Å²	91.2	32%	0.322	47%	0.465	S	S	.	.			trans	-162.8	149.8	167.2	62.4	0	0	0	0	113.4	W1853 E1857 Q1858 A1859	W1853-S1855 PolarHBondContact O-N 2.76Å; W1853-S1855 VanDerWaalsContact O-N 3.08Å; S1855-E1857 PolarHBondContact O-N 3.21Å; S1855-Q1858 PolarHBondContact O-N 2.76Å; S1855-Q1858 WeakPolarHBondContact OG-CG 3.41Å; S1855-Q1858 PolarHBondContact OG-N 3.29Å; S1855-A1859 PolarHBondContact O-N 2.55Å
1856	E	48.2	Very low	48.7	Very low	114 Å²	114	90.9 Å²	90.9	53%	0.533	47%	0.472	S	S	.	.	H	α-helix	trans	-60.2	-33	172.2	-162.5	-167.1	139.6	0	0	112	R1838 Q1858 A1859 N1860	R1838-E1856 IonicContact CZ-OE1 3.3Å; R1838-E1856 VanDerWaalsContact NH1-CD 3.34Å; R1838-E1856 IonicContact NH1-OE1 2.66Å; R1838-E1856 PolarHBondContact NH1-OE1 3.11Å; R1838-E1856 IonicContact NH1-OE2 3.46Å; R1838-E1856 IonicContact NH2-OE1 2.71Å; R1838-E1856 PolarHBondContact NH2-OE1 3.39Å; E1856-Q1858 PolarHBondContact O-N 2.9Å; E1856-A1859 PolarHBondContact O-N 3.23Å; E1856-N1860 WeakPolarHBondContact O-CB 3.26Å; E1856-N1860 PolarHBondContact O-N 3.07Å; E1856-N1860 PolarHBondContact O-ND2 2.71Å; E1856-N1860 PolarHBondContact OE1-ND2 3.48Å
1857	E	56	Low	49.8	Very low	143 Å²	143	92.7 Å²	92.7	67%	0.668	48%	0.478	S	S	*	.	H	α-helix	trans	-67.6	-34	178.6	-168.7	175.7	-143.2	0	0	112.2	S1855 N1861	S1855-E1857 PolarHBondContact O-N 3.21Å; E1857-N1861 WeakPolarHBondContact O-CB 3.13Å; E1857-N1861 PolarHBondContact O-N 2.95Å; E1857-N1861 PolarHBondContact O-ND2 3.19Å
1858	Q	50.9	Low	50.9	Low	108 Å²	108	93 Å²	93	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-67.3	-42.5	171.3	-77.5	-179.8	1.4	0	0	112	W1853 S1855 E1856 N1861 L1862	W1853-Q1858 HydrophobicContact CE3-CB 4.48Å; S1855-Q1858 PolarHBondContact O-N 2.76Å; S1855-Q1858 WeakPolarHBondContact OG-CG 3.41Å; S1855-Q1858 PolarHBondContact OG-N 3.29Å; E1856-Q1858 PolarHBondContact O-N 2.9Å; Q1858-N1861 PolarHBondContact O-N 3.3Å; Q1858-L1862 WeakPolarHBondContact O-CB 3.36Å; Q1858-L1862 PolarHBondContact O-N 3.38Å
1859	A	46.9	Very low	51.9	Low	31 Å²	31	87.7 Å²	87.7	26%	0.256	46%	0.458	S	S	.	.	H	α-helix	trans	-61.6	-46.4	176.4	0	0	0	0	0	111.4	S1855 E1856 N1861 L1862 F1863	S1855-A1859 PolarHBondContact O-N 2.55Å; E1856-A1859 PolarHBondContact O-N 3.23Å; A1859-N1861 PolarHBondContact O-N 3.27Å; A1859-L1862 PolarHBondContact O-N 2.83Å; A1859-F1863 WeakPolarHBondContact O-CB 3.2Å; A1859-F1863 PolarHBondContact O-N 2.84Å
1860	N	52	Low	52.3	Low	66 Å²	66	85.9 Å²	85.9	35%	0.353	45%	0.452	S	S	.	.	H	α-helix	trans	-62.3	-43.2	175.7	-73.2	-37.3	0	0	0	112.1	E1856 L1862 F1863 I1864	E1856-N1860 WeakPolarHBondContact O-CB 3.26Å; E1856-N1860 PolarHBondContact O-N 3.07Å; E1856-N1860 PolarHBondContact O-ND2 2.71Å; E1856-N1860 PolarHBondContact OE1-ND2 3.48Å; N1860-L1862 VanDerWaalsContact C-N 3.33Å; N1860-L1862 PolarHBondContact O-N 3.45Å; N1860-F1863 PolarHBondContact O-N 2.83Å; N1860-I1864 WeakPolarHBondContact O-CG1 3.13Å; N1860-I1864 PolarHBondContact O-N 3.25Å
1861	N	55.2	Low	53.7	Low	83 Å²	83	83.3 Å²	83.3	44%	0.444	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-34.1	175.8	-85.9	-70.9	0	0	0	112.8	E1857 Q1858 A1859 T1865	E1857-N1861 WeakPolarHBondContact O-CB 3.13Å; E1857-N1861 PolarHBondContact O-N 2.95Å; E1857-N1861 PolarHBondContact O-ND2 3.19Å; Q1858-N1861 PolarHBondContact O-N 3.3Å; A1859-N1861 PolarHBondContact O-N 3.27Å; N1861-T1865 WeakPolarHBondContact O-CB 2.99Å; N1861-T1865 PolarHBondContact O-N 3.19Å; N1861-T1865 PolarHBondContact O-OG1 2.78Å
1862	L	52.3	Low	54.5	Low	53 Å²	53	79.8 Å²	79.8	28%	0.277	43%	0.427	S	S	.	.	H	α-helix	trans	-75.6	-34.5	176.6	-152.7	121	0	0	0	112	W1853 Q1858 A1859 N1860 T1865 A1866	W1853-L1862 HydrophobicContact CH2-CB 4.32Å; W1853-L1862 HydrophobicContact CH2-CD1 3.73Å; W1853-L1862 HydrophobicContact CH2-CD2 3.75Å; W1853-L1862 HydrophobicContact CH2-CG 4.12Å; W1853-L1862 HydrophobicContact CZ2-CD2 4.41Å; W1853-L1862 HydrophobicContact CZ3-CB 4.29Å; W1853-L1862 HydrophobicContact CZ3-CD1 3.94Å; W1853-L1862 HydrophobicContact CZ3-CG 4.47Å; Q1858-L1862 WeakPolarHBondContact O-CB 3.36Å; Q1858-L1862 PolarHBondContact O-N 3.38Å; A1859-L1862 PolarHBondContact O-N 2.83Å; N1860-L1862 VanDerWaalsContact C-N 3.33Å; N1860-L1862 PolarHBondContact O-N 3.45Å; L1862-T1865 CarbonylContact O-C 3.57Å; L1862-T1865 WeakPolarHBondContact O-CB 3.28Å; L1862-T1865 PolarHBondContact O-N 2.82Å; L1862-A1866 WeakPolarHBondContact O-CB 3.34Å; L1862-A1866 PolarHBondContact O-N 3.42Å
1863	F	50.1	Low	54.8	Low	125 Å²	125	79.1 Å²	79.1	55%	0.548	42%	0.422	S	S	.	.	H	α-helix	trans	-61.8	-45.4	169.8	-179.6	-107	0	0	0	111.8	A1859 N1860 T1865 A1866 I1867	A1859-F1863 WeakPolarHBondContact O-CB 3.2Å; A1859-F1863 PolarHBondContact O-N 2.84Å; N1860-F1863 PolarHBondContact O-N 2.83Å; F1863-T1865 VanDerWaalsContact C-N 3.32Å; F1863-T1865 PolarHBondContact O-N 3.33Å; F1863-A1866 PolarHBondContact O-N 3.45Å; F1863-I1867 HydrophobicContact CD1-CD1 3.88Å; F1863-I1867 HydrophobicContact CE1-CD1 3.44Å; F1863-I1867 VanDerWaalsContact CE1-CD1 3.44Å; F1863-I1867 HydrophobicContact CE2-CD1 4.34Å; F1863-I1867 HydrophobicContact CG-CD1 4.5Å; F1863-I1867 HydrophobicContact CZ-CD1 3.71Å; F1863-I1867 WeakPolarHBondContact O-CG1 3.46Å; F1863-I1867 PolarHBondContact O-N 2.88Å
1864	I	63.5	Low	55.5	Low	91 Å²	91	81.1 Å²	81.1	47%	0.467	44%	0.437	S	S	.	.	H	α-helix	trans	-59.7	-43.3	171.1	-68.7	165.4	0	0	0	110.6	N1860 A1866 I1867 I1868	N1860-I1864 WeakPolarHBondContact O-CG1 3.13Å; N1860-I1864 PolarHBondContact O-N 3.25Å; I1864-A1866 VanDerWaalsContact C-N 3.35Å; I1864-A1866 PolarHBondContact O-N 2.67Å; I1864-I1867 PolarHBondContact O-N 3.07Å; I1864-I1868 HydrophobicContact CG2-CD1 3.86Å; I1864-I1868 VanDerWaalsContact O-CG1 3.29Å; I1864-I1868 WeakPolarHBondContact O-CG1 3.13Å; I1864-I1868 PolarHBondContact O-N 3.4Å
1865	T	58.3	Low	56	Low	33 Å²	33	77.2 Å²	77.2	20%	0.202	42%	0.421	C	S	.	.	H	α-helix	trans	-62	-42.3	176.5	-54.9	0	0	0	0	111.4	N1861 L1862 F1863 I1868 V1869	N1861-T1865 WeakPolarHBondContact O-CB 2.99Å; N1861-T1865 PolarHBondContact O-N 3.19Å; N1861-T1865 PolarHBondContact O-OG1 2.78Å; L1862-T1865 CarbonylContact O-C 3.57Å; L1862-T1865 WeakPolarHBondContact O-CB 3.28Å; L1862-T1865 PolarHBondContact O-N 2.82Å; F1863-T1865 VanDerWaalsContact C-N 3.32Å; F1863-T1865 PolarHBondContact O-N 3.33Å; T1865-I1868 PolarHBondContact O-N 3.4Å; T1865-V1869 VanDerWaalsContact O-CG2 3.32Å; T1865-V1869 WeakPolarHBondContact O-CG2 3.49Å; T1865-V1869 PolarHBondContact O-N 2.72Å
1866	A	55.6	Low	56.3	Low	56 Å²	56	77.3 Å²	77.3	46%	0.463	42%	0.421	S	S	.	.	H	α-helix	trans	-66.9	-37.9	178	0	0	0	0	0	112.1	L1862 F1863 I1864 V1869 G1870	L1862-A1866 WeakPolarHBondContact O-CB 3.34Å; L1862-A1866 PolarHBondContact O-N 3.42Å; F1863-A1866 PolarHBondContact O-N 3.45Å; I1864-A1866 VanDerWaalsContact C-N 3.35Å; I1864-A1866 PolarHBondContact O-N 2.67Å; A1866-V1869 PolarHBondContact O-N 2.77Å; A1866-G1870 PolarHBondContact O-N 2.03Å
1867	I	64.2	Low	56.5	Low	81 Å²	81	75.4 Å²	75.4	42%	0.415	41%	0.414	S	S	.	.	H	α-helix	trans	-62.6	-44.9	171.2	-73.9	172.3	0	0	0	110.8	F1863 I1864 G1870 I1871	F1863-I1867 HydrophobicContact CD1-CD1 3.88Å; F1863-I1867 HydrophobicContact CE1-CD1 3.44Å; F1863-I1867 VanDerWaalsContact CE1-CD1 3.44Å; F1863-I1867 HydrophobicContact CE2-CD1 4.34Å; F1863-I1867 HydrophobicContact CG-CD1 4.5Å; F1863-I1867 HydrophobicContact CZ-CD1 3.71Å; F1863-I1867 WeakPolarHBondContact O-CG1 3.46Å; F1863-I1867 PolarHBondContact O-N 2.88Å; I1864-I1867 PolarHBondContact O-N 3.07Å; I1867-G1870 CarbonylContact O-C 3.56Å; I1867-G1870 PolarHBondContact O-N 3.24Å; I1867-I1871 HydrophobicContact CG2-CD1 3.81Å; I1867-I1871 HydrophobicContact CG2-CG1 4.47Å; I1867-I1871 VanDerWaalsContact O-CG1 3.31Å; I1867-I1871 WeakPolarHBondContact O-CG1 2.95Å; I1867-I1871 PolarHBondContact O-N 3.44Å
1868	I	62.9	Low	56.6	Low	69 Å²	69	70 Å²	70	35%	0.354	40%	0.396	S	S	.	.	H	α-helix	trans	-67.4	-40.2	178.8	-59.6	161.7	0	0	0	110.7	Y1637 I1864 T1865 G1870 I1871 V1872	Y1637-I1868 WeakPolarHBondContact OH-CG2 2.97Å; I1864-I1868 HydrophobicContact CG2-CD1 3.86Å; I1864-I1868 VanDerWaalsContact O-CG1 3.29Å; I1864-I1868 WeakPolarHBondContact O-CG1 3.13Å; I1864-I1868 PolarHBondContact O-N 3.4Å; T1865-I1868 PolarHBondContact O-N 3.4Å; I1868-G1870 VanDerWaalsContact C-N 3.31Å; I1868-G1870 PolarHBondContact O-N 3.43Å; I1868-I1871 PolarHBondContact O-N 2.72Å; I1868-V1872 WeakPolarHBondContact O-CG2 3.33Å; I1868-V1872 PolarHBondContact O-N 2.91Å
1869	V	60.6	Low	57	Low	68 Å²	68	68.4 Å²	68.4	41%	0.412	39%	0.391	S	S	.	.	H	α-helix	trans	-60.6	-41.9	171.5	170.6	0	0	0	0	110.7	T1865 A1866 V1872 M1873	T1865-V1869 VanDerWaalsContact O-CG2 3.32Å; T1865-V1869 WeakPolarHBondContact O-CG2 3.49Å; T1865-V1869 PolarHBondContact O-N 2.72Å; A1866-V1869 PolarHBondContact O-N 2.77Å; V1869-V1872 PolarHBondContact O-N 3.34Å; V1869-M1873 HydrophobicContact CG1-CG 4.39Å; V1869-M1873 HydrophobicContact CG1-SD 4.18Å; V1869-M1873 WeakPolarHBondContact O-CB 3.27Å; V1869-M1873 WeakPolarHBondContact O-CG 3.02Å; V1869-M1873 PolarHBondContact O-N 2.65Å
1870	G	57.6	Low	57.2	Low	26 Å²	26	70.3 Å²	70.3	27%	0.268	40%	0.399	S	S	.	.	H	α-helix	trans	-60	-44.2	173.3	0	0	0	0	0	112.8	A1866 I1867 I1868 V1872 M1873 I1874	A1866-G1870 PolarHBondContact O-N 2.03Å; I1867-G1870 CarbonylContact O-C 3.56Å; I1867-G1870 PolarHBondContact O-N 3.24Å; I1868-G1870 VanDerWaalsContact C-N 3.31Å; I1868-G1870 PolarHBondContact O-N 3.43Å; G1870-V1872 PolarHBondContact O-N 2.88Å; G1870-M1873 PolarHBondContact O-N 2.82Å; G1870-I1874 WeakPolarHBondContact O-CB 3.01Å; G1870-I1874 WeakPolarHBondContact O-CD1 3.38Å; G1870-I1874 WeakPolarHBondContact O-CG1 3.43Å; G1870-I1874 PolarHBondContact O-N 3.08Å
1871	I	66.4	Low	57.1	Low	94 Å²	94	68.5 Å²	68.5	48%	0.482	39%	0.389	S	S	.	.	H	α-helix	trans	-64.1	-39.6	175.1	-69.2	164.3	0	0	0	111	I1867 I1868 I1874 S1875	I1867-I1871 HydrophobicContact CG2-CD1 3.81Å; I1867-I1871 HydrophobicContact CG2-CG1 4.47Å; I1867-I1871 VanDerWaalsContact O-CG1 3.31Å; I1867-I1871 WeakPolarHBondContact O-CG1 2.95Å; I1867-I1871 PolarHBondContact O-N 3.44Å; I1868-I1871 PolarHBondContact O-N 2.72Å; I1871-I1874 PolarHBondContact O-N 2.85Å; I1871-S1875 WeakPolarHBondContact O-CB 3.29Å; I1871-S1875 PolarHBondContact O-N 2.78Å; I1871-S1875 PolarHBondContact O-OG 2.89Å
1872	V	58	Low	57.3	Low	66 Å²	66	68.1 Å²	68.1	40%	0.4	39%	0.387	S	S	.	.	H	α-helix	trans	-66.5	-42.8	174.3	170.6	0	0	0	0	110.9	I1868 V1869 G1870 S1875 C1876	I1868-V1872 WeakPolarHBondContact O-CG2 3.33Å; I1868-V1872 PolarHBondContact O-N 2.91Å; V1869-V1872 PolarHBondContact O-N 3.34Å; G1870-V1872 PolarHBondContact O-N 2.88Å; V1872-S1875 CarbonylContact O-C 3.5Å; V1872-S1875 WeakPolarHBondContact O-CB 3.28Å; V1872-S1875 PolarHBondContact O-N 2.83Å; V1872-S1875 VanDerWaalsContact O-N 3.16Å; V1872-C1876 PolarHBondContact O-N 3.4Å; V1872-C1876 PolarHBondContact O-SG 3.36Å; V1872-C1876 VanDerWaalsContact O-SG 3.37Å
1873	M	48.5	Very low	57.1	Low	91 Å²	91	66.4 Å²	66.4	45%	0.448	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-44.1	174.7	-71.9	-176.6	78.4	0	0	111.5	F1009 V1869 G1870 S1875 C1876 I1877	F1009-M1873 HydrophobicContact CE1-CE 4.47Å; F1009-M1873 HydrophobicContact CZ-CE 4.22Å; V1869-M1873 HydrophobicContact CG1-CG 4.39Å; V1869-M1873 HydrophobicContact CG1-SD 4.18Å; V1869-M1873 WeakPolarHBondContact O-CB 3.27Å; V1869-M1873 WeakPolarHBondContact O-CG 3.02Å; V1869-M1873 PolarHBondContact O-N 2.65Å; G1870-M1873 PolarHBondContact O-N 2.82Å; M1873-S1875 VanDerWaalsContact C-N 3.26Å; M1873-S1875 PolarHBondContact O-N 3.35Å; M1873-C1876 PolarHBondContact O-N 3.18Å; M1873-I1877 WeakPolarHBondContact O-CB 3.42Å; M1873-I1877 WeakPolarHBondContact O-CD1 3.39Å; M1873-I1877 WeakPolarHBondContact O-CG1 3.18Å; M1873-I1877 PolarHBondContact O-N 3.11Å
1874	I	63.8	Low	56.9	Low	116 Å²	116	60.9 Å²	60.9	60%	0.595	36%	0.36	S	S	*	.	H	α-helix	trans	-61.1	-35	173	-70.1	164.1	0	0	0	111.1	G1870 I1871 G1878	G1870-I1874 WeakPolarHBondContact O-CB 3.01Å; G1870-I1874 WeakPolarHBondContact O-CD1 3.38Å; G1870-I1874 WeakPolarHBondContact O-CG1 3.43Å; G1870-I1874 PolarHBondContact O-N 3.08Å; I1871-I1874 PolarHBondContact O-N 2.85Å; I1874-G1878 PolarHBondContact O-N 3.48Å
1875	S	56.4	Low	56.7	Low	61 Å²	61	62 Å²	62	43%	0.427	36%	0.361	S	S	.	.	H	α-helix	trans	-72	-41.1	176.1	-58.7	0	0	0	0	112.3	I1871 V1872 M1873 G1878 I1879	I1871-S1875 WeakPolarHBondContact O-CB 3.29Å; I1871-S1875 PolarHBondContact O-N 2.78Å; I1871-S1875 PolarHBondContact O-OG 2.89Å; V1872-S1875 CarbonylContact O-C 3.5Å; V1872-S1875 WeakPolarHBondContact O-CB 3.28Å; V1872-S1875 PolarHBondContact O-N 2.83Å; V1872-S1875 VanDerWaalsContact O-N 3.16Å; M1873-S1875 VanDerWaalsContact C-N 3.26Å; M1873-S1875 PolarHBondContact O-N 3.35Å; S1875-G1878 PolarHBondContact O-N 3.3Å; S1875-I1879 WeakPolarHBondContact O-CG1 3.18Å; S1875-I1879 PolarHBondContact O-N 2.99Å
1876	C	54	Low	56.3	Low	49 Å²	49	63.6 Å²	63.6	33%	0.331	37%	0.368	S	S	.	.	H	α-helix	trans	-63.8	-43.1	171.6	-70.9	0	0	0	0	111.5	V1872 M1873 G1878 I1879 V1880	V1872-C1876 PolarHBondContact O-N 3.4Å; V1872-C1876 PolarHBondContact O-SG 3.36Å; V1872-C1876 VanDerWaalsContact O-SG 3.37Å; M1873-C1876 PolarHBondContact O-N 3.18Å; C1876-G1878 VanDerWaalsContact C-N 3.3Å; C1876-G1878 PolarHBondContact O-N 2.92Å; C1876-I1879 PolarHBondContact O-N 3.04Å; C1876-V1880 WeakPolarHBondContact O-CG2 3.02Å; C1876-V1880 PolarHBondContact O-N 3.28Å
1877	I	52.4	Low	55.8	Low	73 Å²	73	65.5 Å²	65.5	37%	0.374	37%	0.37	S	S	.	.	H	α-helix	trans	-59.6	-41.5	171.7	-71.9	162.7	0	0	0	110.1	Y1433 M1873 I1879 V1880 D1881	Y1433-I1877 HydrophobicContact CE2-CG2 3.93Å; M1873-I1877 WeakPolarHBondContact O-CB 3.42Å; M1873-I1877 WeakPolarHBondContact O-CD1 3.39Å; M1873-I1877 WeakPolarHBondContact O-CG1 3.18Å; M1873-I1877 PolarHBondContact O-N 3.11Å; I1877-I1879 PolarHBondContact O-N 3.14Å; I1877-V1880 CarbonylContact O-C 3.58Å; I1877-V1880 PolarHBondContact O-N 3.2Å; I1877-D1881 VanDerWaalsContact O-CB 3.3Å; I1877-D1881 WeakPolarHBondContact O-CB 3.4Å; I1877-D1881 PolarHBondContact O-N 2.94Å
1878	G	58.2	Low	54.8	Low	29 Å²	29	65.6 Å²	65.6	30%	0.299	37%	0.367	S	S	.	.	H	α-helix	trans	-61.5	-41.6	174	0	0	0	0	0	113.2	I1874 S1875 C1876 D1881 I1882	I1874-G1878 PolarHBondContact O-N 3.48Å; S1875-G1878 PolarHBondContact O-N 3.3Å; C1876-G1878 VanDerWaalsContact C-N 3.3Å; C1876-G1878 PolarHBondContact O-N 2.92Å; G1878-D1881 PolarHBondContact O-N 3.22Å; G1878-I1882 WeakPolarHBondContact O-CB 3.06Å; G1878-I1882 WeakPolarHBondContact O-CD1 3.36Å; G1878-I1882 WeakPolarHBondContact O-CG1 3.27Å; G1878-I1882 PolarHBondContact O-N 3.17Å
1879	I	59.8	Low	54.1	Low	75 Å²	75	68.4 Å²	68.4	39%	0.385	38%	0.381	S	S	.	.	H	α-helix	trans	-68.6	-37.6	175.6	-69.2	163.9	0	0	0	111.4	F1644 S1875 C1876 I1877 I1882 G1883	F1644-I1879 HydrophobicContact CE2-CD1 4.34Å; F1644-I1879 HydrophobicContact CZ-CD1 3.63Å; S1875-I1879 WeakPolarHBondContact O-CG1 3.18Å; S1875-I1879 PolarHBondContact O-N 2.99Å; C1876-I1879 PolarHBondContact O-N 3.04Å; I1877-I1879 PolarHBondContact O-N 3.14Å; I1879-I1882 PolarHBondContact O-N 2.91Å; I1879-G1883 PolarHBondContact O-N 2.91Å
1880	V	52.2	Low	53.1	Low	72 Å²	72	69 Å²	69	44%	0.436	39%	0.388	S	S	.	.	H	α-helix	trans	-70.9	-33.9	174.2	171.4	0	0	0	0	111.6	Y1433 C1876 I1877 G1884	Y1433-V1880 HydrophobicContact CD1-CG1 4.24Å; Y1433-V1880 HydrophobicContact CE1-CG1 4.5Å; Y1433-V1880 HydrophobicContact CG-CG1 4.43Å; C1876-V1880 WeakPolarHBondContact O-CG2 3.02Å; C1876-V1880 PolarHBondContact O-N 3.28Å; I1877-V1880 CarbonylContact O-C 3.58Å; I1877-V1880 PolarHBondContact O-N 3.2Å; V1880-G1884 WeakPolarHBondContact O-CA 3.41Å; V1880-G1884 PolarHBondContact O-N 3.45Å
1881	D	49.2	Very low	52.3	Low	28 Å²	28	76.2 Å²	76.2	15%	0.15	41%	0.409	C	S	.	.	H	α-helix	trans	-71.3	-35.3	173.6	-163.3	64.5	0	0	0	111.6	Y1433 K1437 I1877 G1878 K1885	Y1433-D1881 WeakPolarHBondContact OH-CB 3.49Å; Y1433-D1881 PolarHBondContact OH-OD1 3.04Å; K1437-D1881 IonicContact NZ-OD1 3.42Å; K1437-D1881 PolarHBondContact NZ-OD1 3.03Å; I1877-D1881 VanDerWaalsContact O-CB 3.3Å; I1877-D1881 WeakPolarHBondContact O-CB 3.4Å; I1877-D1881 PolarHBondContact O-N 2.94Å; G1878-D1881 PolarHBondContact O-N 3.22Å; D1881-K1885 WeakPolarHBondContact O-CB 3.23Å; D1881-K1885 WeakPolarHBondContact O-CD 3.45Å; D1881-K1885 WeakPolarHBondContact O-CG 3.04Å; D1881-K1885 PolarHBondContact O-N 3.49Å; D1881-K1885 WeakPolarHBondContact OD2-CE 3.18Å; D1881-K1885 IonicContact OD2-NZ 3.41Å; D1881-K1885 PolarHBondContact OD2-NZ 3.29Å
1882	I	59.6	Low	50.9	Low	75 Å²	75	77.6 Å²	77.6	39%	0.385	42%	0.416	S	S	.	.	H	α-helix	trans	-68.5	-50.3	171.8	-71.3	163.5	0	0	0	110.6	F871 G1878 I1879 G1884 K1885 I1886	F871-I1882 HydrophobicContact CE2-CD1 3.91Å; F871-I1882 HydrophobicContact CZ-CD1 4.47Å; G1878-I1882 WeakPolarHBondContact O-CB 3.06Å; G1878-I1882 WeakPolarHBondContact O-CD1 3.36Å; G1878-I1882 WeakPolarHBondContact O-CG1 3.27Å; G1878-I1882 PolarHBondContact O-N 3.17Å; I1879-I1882 PolarHBondContact O-N 2.91Å; I1882-G1884 VanDerWaalsContact C-N 3.33Å; I1882-G1884 PolarHBondContact O-N 2.03Å; I1882-K1885 PolarHBondContact O-N 3.07Å; I1882-I1886 HydrophobicContact CG2-CD1 3.84Å; I1882-I1886 WeakPolarHBondContact O-CB 3.31Å; I1882-I1886 VanDerWaalsContact O-CG1 3.26Å; I1882-I1886 WeakPolarHBondContact O-CG1 3.49Å; I1882-I1886 PolarHBondContact O-N 3.11Å
1883	G	48	Very low	49.6	Very low	16 Å²	16	79 Å²	79	17%	0.165	42%	0.421	C	S	.	.	H	α-helix	trans	-62.8	-39.7	177.2	0	0	0	0	0	112.4	I1879 I1886 L1887	I1879-G1883 PolarHBondContact O-N 2.91Å; G1883-I1886 PolarHBondContact O-N 2.91Å; G1883-L1887 WeakPolarHBondContact O-CB 3.46Å; G1883-L1887 WeakPolarHBondContact O-CG 3.35Å; G1883-L1887 PolarHBondContact O-N 2.9Å
1884	G	45.7	Very low	48.8	Very low	9 Å²	9	80.1 Å²	80.1	9%	0.093	44%	0.435	C	S	.	.	H	α-helix	trans	-65.3	-42.8	173.1	0	0	0	0	0	112.4	V1880 I1882 L1887 K1888	V1880-G1884 WeakPolarHBondContact O-CA 3.41Å; V1880-G1884 PolarHBondContact O-N 3.45Å; I1882-G1884 VanDerWaalsContact C-N 3.33Å; I1882-G1884 PolarHBondContact O-N 2.03Å; G1884-L1887 PolarHBondContact O-N 2.97Å; G1884-K1888 WeakPolarHBondContact O-CB 3.45Å; G1884-K1888 PolarHBondContact O-N 3Å
1885	K	58.6	Low	47.3	Very low	115 Å²	115	80.3 Å²	80.3	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-63.3	-41.4	171.6	-81	164.9	175	161.7	0	112	D1881 I1882 K1888 I1889	D1881-K1885 WeakPolarHBondContact O-CB 3.23Å; D1881-K1885 WeakPolarHBondContact O-CD 3.45Å; D1881-K1885 WeakPolarHBondContact O-CG 3.04Å; D1881-K1885 PolarHBondContact O-N 3.49Å; D1881-K1885 WeakPolarHBondContact OD2-CE 3.18Å; D1881-K1885 IonicContact OD2-NZ 3.41Å; D1881-K1885 PolarHBondContact OD2-NZ 3.29Å; I1882-K1885 PolarHBondContact O-N 3.07Å; K1885-K1888 PolarHBondContact O-N 3.17Å; K1885-I1889 WeakPolarHBondContact O-CB 3.43Å; K1885-I1889 WeakPolarHBondContact O-CD1 3.5Å; K1885-I1889 WeakPolarHBondContact O-CG1 3.37Å; K1885-I1889 PolarHBondContact O-N 3.39Å
1886	I	50.7	Low	45.9	Very low	66 Å²	66	81.5 Å²	81.5	34%	0.338	45%	0.446	S	S	.	.	H	α-helix	trans	-61.2	-49.4	175.2	-70.6	164.4	0	0	0	110.1	I1882 G1883 K1888 I1889 S1890	I1882-I1886 HydrophobicContact CG2-CD1 3.84Å; I1882-I1886 WeakPolarHBondContact O-CB 3.31Å; I1882-I1886 VanDerWaalsContact O-CG1 3.26Å; I1882-I1886 WeakPolarHBondContact O-CG1 3.49Å; I1882-I1886 PolarHBondContact O-N 3.11Å; G1883-I1886 PolarHBondContact O-N 2.91Å; I1886-K1888 PolarHBondContact O-N 3.12Å; I1886-I1889 PolarHBondContact O-N 2.96Å; I1886-S1890 WeakPolarHBondContact O-CB 3.23Å; I1886-S1890 PolarHBondContact O-N 2.68Å; I1886-S1890 PolarHBondContact O-OG 3.5Å
1887	L	45.1	Very low	44.8	Very low	96 Å²	96	81.6 Å²	81.6	50%	0.503	45%	0.448	S	S	.	.	H	α-helix	trans	-61	-42.8	175.7	-80.5	163.3	0	0	0	112.6	G1883 G1884 I1889 S1890 Y1891	G1883-L1887 WeakPolarHBondContact O-CB 3.46Å; G1883-L1887 WeakPolarHBondContact O-CG 3.35Å; G1883-L1887 PolarHBondContact O-N 2.9Å; G1884-L1887 PolarHBondContact O-N 2.97Å; L1887-I1889 VanDerWaalsContact C-N 3.33Å; L1887-I1889 PolarHBondContact O-N 3.22Å; L1887-S1890 PolarHBondContact O-N 3.3Å; L1887-S1890 VanDerWaalsContact O-N 3.16Å; L1887-Y1891 HydrophobicContact CD2-CD2 4.29Å; L1887-Y1891 HydrophobicContact CD2-CE2 4.16Å; L1887-Y1891 WeakPolarHBondContact O-CB 3.07Å; L1887-Y1891 PolarHBondContact O-N 3.44Å
1888	K	42.7	Very low	43.9	Very low	84 Å²	84	85 Å²	85	37%	0.365	46%	0.464	S	S	.	.	H	α-helix	trans	-69.5	-30.1	179.9	-157.2	155.6	-176.9	165.1	0	111.7	F1430 E1434 G1884 K1885 I1886 I1892	F1430-K1888 HydrophobicContact CZ-CD 4.44Å; E1434-K1888 IonicContact OE1-NZ 3.72Å; E1434-K1888 PolarHBondContact OE1-NZ 3.29Å; E1434-K1888 IonicContact OE2-NZ 3.77Å; E1434-K1888 PolarHBondContact OE2-NZ 3.49Å; G1884-K1888 WeakPolarHBondContact O-CB 3.45Å; G1884-K1888 PolarHBondContact O-N 3Å; K1885-K1888 PolarHBondContact O-N 3.17Å; I1886-K1888 PolarHBondContact O-N 3.12Å; K1888-I1892 HydrophobicContact CD-CD1 4.47Å; K1888-I1892 HydrophobicContact CG-CD1 3.55Å; K1888-I1892 HydrophobicContact CG-CG1 4.38Å; K1888-I1892 VanDerWaalsContact O-CB 3.27Å; K1888-I1892 WeakPolarHBondContact O-CB 3.03Å; K1888-I1892 WeakPolarHBondContact O-CG1 3.1Å; K1888-I1892 PolarHBondContact O-N 2.87Å
1889	I	47.6	Very low	43	Very low	127 Å²	127	92 Å²	92	65%	0.651	49%	0.486	S	S	*	.	H	α-helix	trans	-70	-42.8	167.6	-71.6	163.6	0	0	0	111.1	K1885 I1886 L1887	K1885-I1889 WeakPolarHBondContact O-CB 3.43Å; K1885-I1889 WeakPolarHBondContact O-CD1 3.5Å; K1885-I1889 WeakPolarHBondContact O-CG1 3.37Å; K1885-I1889 PolarHBondContact O-N 3.39Å; I1886-I1889 PolarHBondContact O-N 2.96Å; L1887-I1889 VanDerWaalsContact C-N 3.33Å; L1887-I1889 PolarHBondContact O-N 3.22Å
1890	S	39.6	Very low	41.9	Very low	80 Å²	80	92.3 Å²	92.3	56%	0.559	49%	0.489	S	S	*	.	H	α-helix	trans	-72.7	-29.2	-178.7	-65.4	0	0	0	0	114.8	I1886 L1887	I1886-S1890 WeakPolarHBondContact O-CB 3.23Å; I1886-S1890 PolarHBondContact O-N 2.68Å; I1886-S1890 PolarHBondContact O-OG 3.5Å; L1887-S1890 PolarHBondContact O-N 3.3Å; L1887-S1890 VanDerWaalsContact O-N 3.16Å
1891	Y	40.8	Very low	41.2	Very low	178 Å²	178	94.1 Å²	94.1	70%	0.698	50%	0.495	S	S	*	.	H	α-helix	trans	-95.3	-24.4	-178	-92.1	-87.6	0	0	0	114.8	L1887	L1887-Y1891 HydrophobicContact CD2-CD2 4.29Å; L1887-Y1891 HydrophobicContact CD2-CE2 4.16Å; L1887-Y1891 WeakPolarHBondContact O-CB 3.07Å; L1887-Y1891 PolarHBondContact O-N 3.44Å
1892	I	38.7	Very low	40.7	Very low	123 Å²	123	99.1 Å²	99.1	63%	0.631	52%	0.515	S	S	*	.	H	α-helix	trans	-92.5	-6.9	-174.3	-61.6	-175.3	0	0	0	112.9	K1888	K1888-I1892 HydrophobicContact CD-CD1 4.47Å; K1888-I1892 HydrophobicContact CG-CD1 3.55Å; K1888-I1892 HydrophobicContact CG-CG1 4.38Å; K1888-I1892 VanDerWaalsContact O-CB 3.27Å; K1888-I1892 WeakPolarHBondContact O-CB 3.03Å; K1888-I1892 WeakPolarHBondContact O-CG1 3.1Å; K1888-I1892 PolarHBondContact O-N 2.87Å
1893	N	30.6	Very low	39.5	Very low	96 Å²	96	102.9 Å²	102.9	51%	0.513	53%	0.529	S	S	.	.			trans	-143.4	77.5	175.5	-147.8	-9.1	0	0	0	114.2	T1895	N1893-T1895 PolarHBondContact O-N 3.17Å; N1893-T1895 VanDerWaalsContact O-N 3.09Å; N1893-T1895 PolarHBondContact OD1-OG1 2.81Å
1894	P	31.6	Very low	38.8	Very low	115 Å²	115	110.5 Å²	110.5	75%	0.747	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-1.7	-174.2	-20.8	34.3	0	0	0	116.4
1895	T	31.5	Very low	38.2	Very low	119 Å²	119	119.5 Å²	119.5	73%	0.73	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	-5.1	-162.9	50.3	0	0	0	0	115.2	N1893 S1897	N1893-T1895 PolarHBondContact O-N 3.17Å; N1893-T1895 VanDerWaalsContact O-N 3.09Å; N1893-T1895 PolarHBondContact OD1-OG1 2.81Å; T1895-S1897 PolarHBondContact O-N 3.29Å
1896	V	27	Very low	37.1	Very low	86 Å²	86	118 Å²	118	52%	0.521	59%	0.593	S	S	.	*			trans	-79.2	109.5	178.1	-177.3	0	0	0	0	110.2	I1901	V1896-I1901 HydrophobicContact CG1-CD1 4.12Å; V1896-I1901 HydrophobicContact CG1-CG1 4.22Å
1897	S	32.1	Very low	36.2	Very low	51 Å²	51	122.3 Å²	122.3	36%	0.357	61%	0.612	S	S	.	*			trans	-69.9	142.3	-178.4	108.4	0	0	0	0	112	T1895 F1899 D1900	T1895-S1897 PolarHBondContact O-N 3.29Å; S1897-F1899 PolarHBondContact O-N 2.95Å; S1897-F1899 VanDerWaalsContact O-N 3.09Å; S1897-F1899 VanDerWaalsContact OG-CB 3.29Å; S1897-F1899 WeakPolarHBondContact OG-CB 3.39Å; S1897-F1899 PolarHBondContact OG-N 3.39Å; S1897-F1899 VanDerWaalsContact OG-N 3.15Å; S1897-D1900 VanDerWaalsContact CB-OD2 3.3Å; S1897-D1900 WeakPolarHBondContact CB-OD2 3.25Å; S1897-D1900 PolarHBondContact O-N 2.9Å; S1897-D1900 PolarHBondContact OG-N 3.36Å; S1897-D1900 PolarHBondContact OG-OD2 2.04Å
1898	M	33.1	Very low	35.5	Very low	145 Å²	145	123.2 Å²	123.2	71%	0.714	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-5.6	175.3	-148	-173.9	-157.5	0	0	113
1899	F	37.8	Very low	34.7	Very low	176 Å²	176	129.4 Å²	129.4	77%	0.772	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-39	174.1	-122.7	-97.7	0	0	0	111.5	S1897 K1902 K1903	S1897-F1899 PolarHBondContact O-N 2.95Å; S1897-F1899 VanDerWaalsContact O-N 3.09Å; S1897-F1899 VanDerWaalsContact OG-CB 3.29Å; S1897-F1899 WeakPolarHBondContact OG-CB 3.39Å; S1897-F1899 PolarHBondContact OG-N 3.39Å; S1897-F1899 VanDerWaalsContact OG-N 3.15Å; F1899-K1902 VanDerWaalsContact O-CB 3.26Å; F1899-K1902 WeakPolarHBondContact O-CB 3.35Å; F1899-K1902 PolarHBondContact O-N 2.88Å; F1899-K1903 PolarHBondContact O-N 3.09Å
1900	D	36.8	Very low	33.9	Very low	81 Å²	81	128.1 Å²	128.1	43%	0.433	66%	0.661	S	S	.	*	H	α-helix	trans	-75.6	-37.1	-174.3	-57	-62.5	0	0	0	112	S1897 K1902 K1903 W1904	S1897-D1900 VanDerWaalsContact CB-OD2 3.3Å; S1897-D1900 WeakPolarHBondContact CB-OD2 3.25Å; S1897-D1900 PolarHBondContact O-N 2.9Å; S1897-D1900 PolarHBondContact OG-N 3.36Å; S1897-D1900 PolarHBondContact OG-OD2 2.04Å; D1900-K1902 PolarHBondContact O-N 3.12Å; D1900-K1902 VanDerWaalsContact O-N 3.17Å; D1900-K1903 WeakPolarHBondContact O-CA 3.49Å; D1900-K1903 VanDerWaalsContact O-CB 3.28Å; D1900-K1903 WeakPolarHBondContact O-CB 3.13Å; D1900-K1903 PolarHBondContact O-N 3.06Å; D1900-W1904 PolarHBondContact O-N 2.67Å
1901	I	38.4	Very low	33.4	Very low	110 Å²	110	129.4 Å²	129.4	56%	0.564	67%	0.67	S	S	*	*	H	α-helix	trans	-59.5	-27.4	170.7	-59.9	175.2	0	0	0	111.3	V1896	V1896-I1901 HydrophobicContact CG1-CD1 4.12Å; V1896-I1901 HydrophobicContact CG1-CG1 4.22Å
1902	K	39.1	Very low	32.8	Very low	134 Å²	134	125.2 Å²	125.2	58%	0.583	67%	0.666	S	S	*	*	H	α-helix	trans	-78.1	-22.8	173.4	-116.1	174.7	-178.6	174.1	0	113.4	F1899 D1900	F1899-K1902 VanDerWaalsContact O-CB 3.26Å; F1899-K1902 WeakPolarHBondContact O-CB 3.35Å; F1899-K1902 PolarHBondContact O-N 2.88Å; D1900-K1902 PolarHBondContact O-N 3.12Å; D1900-K1902 VanDerWaalsContact O-N 3.17Å
1903	K	34.4	Very low	32.4	Very low	154 Å²	154	126 Å²	126	67%	0.67	67%	0.672	S	S	*	*	H	α-helix	trans	-82.9	-28.5	-179.9	-155.2	-178.1	-179	-169.9	0	112.4	F1899 D1900 S1906	F1899-K1903 PolarHBondContact O-N 3.09Å; D1900-K1903 WeakPolarHBondContact O-CA 3.49Å; D1900-K1903 VanDerWaalsContact O-CB 3.28Å; D1900-K1903 WeakPolarHBondContact O-CB 3.13Å; D1900-K1903 PolarHBondContact O-N 3.06Å; K1903-S1906 PolarHBondContact O-OG 3.4Å
1904	W	32.2	Very low	32.4	Very low	176 Å²	176	127.1 Å²	127.1	67%	0.667	68%	0.682	S	S	*	*	H	α-helix	trans	-73.5	-28.2	175.2	-93.2	22.7	0	0	0	114.6	I886 D1900 S1906 H1907	I886-W1904 HydrophobicContact CD1-CH2 3.73Å; I886-W1904 HydrophobicContact CD1-CZ3 4.3Å; I886-W1904 HydrophobicContact CG1-CH2 3.93Å; I886-W1904 HydrophobicContact CG1-CZ2 4.42Å; I886-W1904 HydrophobicContact CG2-CH2 3.82Å; I886-W1904 HydrophobicContact CG2-CZ2 3.76Å; D1900-W1904 PolarHBondContact O-N 2.67Å; W1904-S1906 PolarHBondContact O-N 3.44Å; W1904-S1906 VanDerWaalsContact O-N 3.08Å; W1904-H1907 PolarHBondContact O-N 2.88Å
1905	K	34.4	Very low	32.1	Very low	198 Å²	198	130.3 Å²	130.3	86%	0.861	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	5	-171.7	-127.4	174.9	-173.8	176.9	0	115.3
1906	S	34	Very low	31.9	Very low	82 Å²	82	133.6 Å²	133.6	57%	0.573	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-6.4	175.8	50.9	0	0	0	0	114.9	K1903 W1904	K1903-S1906 PolarHBondContact O-OG 3.4Å; W1904-S1906 PolarHBondContact O-N 3.44Å; W1904-S1906 VanDerWaalsContact O-N 3.08Å
1907	H	32.6	Very low	31.8	Very low	158 Å²	158	135 Å²	135	73%	0.731	71%	0.706	S	S	*	*	S	Bend	trans	-129.9	70.4	-172.8	-63.6	-79.5	0	0	0	113.5	W1904	W1904-H1907 PolarHBondContact O-N 2.88Å
1908	S	30.4	Very low	31.6	Very low	114 Å²	114	140.4 Å²	140.4	80%	0.797	73%	0.727	S	S	*	*			trans	-174.3	67.4	162.1	28.2	0	0	0	0	113.1
1909	K	26.2	Very low	31.2	Very low	215 Å²	215	141 Å²	141	94%	0.935	73%	0.733	S	S	*	*			trans	-111.1	103	162.3	-94.2	-170.8	171.7	-173.4	0	109.2
1910	A	31.1	Very low	30.7	Very low	100 Å²	100	141.2 Å²	141.2	83%	0.826	73%	0.73	S	S	*	*			trans	-170.7	149.5	160.8	0	0	0	0	0	112.1
1911	S	29.4	Very low	30.1	Very low	107 Å²	107	143.9 Å²	143.9	75%	0.748	75%	0.749	S	S	*	*			trans	30.5	118.6	155.1	-158.8	0	0	0	0	120.3
1912	S	28.1	Very low	29.5	Very low	89 Å²	89	148.3 Å²	148.3	62%	0.622	76%	0.759	S	S	*	*			cis	101.4	132.7	24.2	82.8	0	0	0	0	116.6
1913	N	28.7	Very low	28.7	Very low	139 Å²	139	148.3 Å²	148.3	74%	0.743	77%	0.765	S	S	*	*			trans	85.4	151.6	153.5	-59	-1.9	0	0	0	122.2
1914	T	32.1	Very low	28.2	Very low	120 Å²	120	147.4 Å²	147.4	74%	0.736	77%	0.766	S	S	*	*			trans	55	117	168.8	46.3	0	0	0	0	117.3
1915	E	24.4	Very low	27.7	Very low	183 Å²	183	147.2 Å²	147.2	86%	0.855	77%	0.773	S	S	*	*			cis	70.5	104.4	48.6	-59.9	-171.8	144.8	0	0	114.5
1916	E	27.4	Very low	27.1	Very low	187 Å²	187	144.6 Å²	144.6	87%	0.874	77%	0.768	S	S	*	*				-170.3	154.8	122.8	-105.1	-174.2	172.7	0	0	110.6
1917	P	26.2	Very low	26.6	Very low	116 Å²	116	148.2 Å²	148.2	75%	0.753	78%	0.779	S	S	*	*			trans	-96.5	148	179.7	36.8	-31.9	0	0	0	112.9
1918	M	27.7	Very low	26.1	Very low	164 Å²	164	146.4 Å²	146.4	81%	0.808	77%	0.774	S	S	*	*			trans	-137.5	116.5	171	-86.6	-71.3	171.5	0	0	111.3
1919	D	24.1	Very low	25.8	Very low	158 Å²	158	148.2 Å²	148.2	85%	0.845	77%	0.774	S	S	*	*			trans	-74.7	130.9	168.2	-110	-43	0	0	0	110.1
1920	Y	26.3	Very low	25.6	Very low	180 Å²	180	144.9 Å²	144.9	71%	0.706	77%	0.765	S	S	*	*			trans	-144.2	95.8	169.6	-108.8	-79.3	0	0	0	112
1921	V	26	Very low	25.2	Very low	137 Å²	137	144.6 Å²	144.6	83%	0.83	76%	0.756	S	S	*	*			trans	-79.2	118.5	162.9	176.7	0	0	0	0	108.5
1922	R	24.1	Very low	25	Very low	204 Å²	204	145.3 Å²	145.3	77%	0.77	76%	0.759	S	S	*	*			trans	-155.8	132	164.5	-113.4	171.5	-159.6	-155.2	2.7	113.6
1923	N	23.4	Very low	24.8	Very low	133 Å²	133	149.8 Å²	149.8	71%	0.711	77%	0.77	S	S	*	*			trans	24.1	118.9	145.5	-61.9	15.3	0	0	0	118.1
1924	I	23.2	Very low	24.7	Very low	136 Å²	136	148.9 Å²	148.9	70%	0.697	77%	0.771	S	S	*	*				70.8	128.8	71.2	-64.8	163.7	0	0	0	111.5
1925	E	21.8	Very low	24.5	Very low	171 Å²	171	147.3 Å²	147.3	80%	0.799	77%	0.771	S	S	*	*			trans	61	107.4	171.5	-73.1	156.7	-143.1	0	0	117.8
1926	N	22.6	Very low	24.5	Very low	144 Å²	144	144.4 Å²	144.4	77%	0.77	77%	0.768	S	S	*	*				175.1	73.7	127.5	-95.1	-60.3	0	0	0	112.9
1927	I	23.4	Very low	24.3	Very low	158 Å²	158	143 Å²	143	81%	0.81	77%	0.765	S	S	*	*			trans	-128.8	102.5	153.9	-62.8	-175.5	0	0	0	108.1	L1929	I1927-L1929 PolarHBondContact O-N 2.98Å; I1927-L1929 VanDerWaalsContact O-N 3.14Å
1928	I	22.3	Very low	24.2	Very low	120 Å²	120	144.2 Å²	144.2	62%	0.615	76%	0.763	S	S	*	*			trans	-76.7	102	-174.2	-59.4	166.4	0	0	0	109.7	I1930	I1928-I1930 HydrophobicContact CG2-CG1 3.97Å
1929	L	23	Very low	24	Very low	152 Å²	152	141.6 Å²	141.6	80%	0.796	76%	0.758	S	S	*	*			trans	-91.4	94.8	165.1	-77.5	169.2	0	0	0	108.8	I1927 S1931	I1927-L1929 PolarHBondContact O-N 2.98Å; I1927-L1929 VanDerWaalsContact O-N 3.14Å; L1929-S1931 PolarHBondContact O-N 3.28Å
1930	I	23	Very low	24.1	Very low	144 Å²	144	145 Å²	145	74%	0.738	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-60	118.7	177.1	-55.8	174.1	0	0	0	108.9	I1928	I1928-I1930 HydrophobicContact CG2-CG1 3.97Å
1931	S	21.6	Very low	24.1	Very low	94 Å²	94	141.9 Å²	141.9	66%	0.657	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-81	133.4	177.7	54.6	0	0	0	0	111.7	L1929	L1929-S1931 PolarHBondContact O-N 3.28Å
1932	P	26.2	Very low	24.1	Very low	123 Å²	123	141.2 Å²	141.2	80%	0.799	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-60	144.6	149.3	-13.8	29.6	0	0	0	109
1933	Q	23.7	Very low	24.1	Very low	183 Å²	183	140.7 Å²	140.7	86%	0.855	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-64.1	144.5	-177.4	-68.1	166.4	-58.8	0	0	111.7
1934	P	27.4	Very low	24.3	Very low	119 Å²	119	146.2 Å²	146.2	77%	0.773	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.7	145.7	165.3	30.3	-34	0	0	0	110.5
1935	A	26.1	Very low	24.3	Very low	87 Å²	87	147.4 Å²	147.4	72%	0.719	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-62.6	149.6	170.1	0	0	0	0	0	110.7
1936	P	24.3	Very low	24.5	Very low	122 Å²	122	146.9 Å²	146.9	79%	0.792	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-65.5	136.8	-170.8	25.3	-34.6	0	0	0	112.8	I1938	P1936-I1938 PolarHBondContact O-N 2.83Å
1937	I	24.4	Very low	24.6	Very low	159 Å²	159	146 Å²	146	82%	0.815	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-69.6	117.8	175.2	-60.8	167.6	0	0	0	108.8	P1939	I1937-P1939 WeakPolarHBondContact O-CD 3.49Å
1938	I	23.8	Very low	24.8	Very low	140 Å²	140	146.9 Å²	146.9	72%	0.718	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-83.8	117.2	164.2	-59.4	176.9	0	0	0	107.4	P1936	P1936-I1938 PolarHBondContact O-N 2.83Å
1939	P	24.4	Very low	24.8	Very low	109 Å²	109	148.5 Å²	148.5	71%	0.708	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-80.9	128.4	179.2	31.7	-32.8	0	0	0	111.3	I1937	I1937-P1939 WeakPolarHBondContact O-CD 3.49Å
1940	W	24.2	Very low	25.1	Very low	229 Å²	229	145.7 Å²	145.7	87%	0.867	78%	0.782	S	S	*	*			trans	-105.8	142.9	158.4	-129.9	-99.2	0	0	0	108.4
1941	P	28.4	Very low	25.2	Very low	116 Å²	116	147.4 Å²	147.4	75%	0.753	79%	0.787	S	S	*	*			trans	-80.4	134.2	-147.2	28.2	-34.9	0	0	0	114.8
1942	T	23.9	Very low	25.5	Very low	122 Å²	122	150.9 Å²	150.9	75%	0.748	80%	0.797	S	S	*	*			trans	-84.5	156.9	164.2	51.3	0	0	0	0	111.3
1943	K	25.1	Very low	25.6	Very low	194 Å²	194	152.1 Å²	152.1	84%	0.843	80%	0.797	S	S	*	*			trans	73.4	109.5	171.7	-50.3	177.6	-176.5	177.4	0	117.1
1944	R	26.9	Very low	25.9	Very low	248 Å²	248	148.2 Å²	148.2	94%	0.936	79%	0.787	S	S	*	*				-153.6	102	104.9	-103.3	179.1	-170.7	-167.8	2.7	110.9
1945	L	23.7	Very low	26	Very low	162 Å²	162	148.8 Å²	148.8	85%	0.848	78%	0.783	S	S	*	*			trans	-66.6	141.8	143.7	-78.4	104.2	0	0	0	107.5
1946	L	27.1	Very low	26.1	Very low	160 Å²	160	150.1 Å²	150.1	84%	0.838	78%	0.778	S	S	*	*				169.9	109.5	128.3	-91.9	160.9	0	0	0	111.8
1947	N	23.6	Very low	26.2	Very low	126 Å²	126	154.1 Å²	154.1	67%	0.674	78%	0.777	S	S	*	*				39.3	104.4	126.3	-169.4	25	0	0	0	119
1948	M	27.1	Very low	26.5	Very low	176 Å²	176	154.2 Å²	154.2	87%	0.867	77%	0.774	S	S	*	*			trans	-138.4	89.4	153	-92	-63.6	172	0	0	110.8
1949	N	24.1	Very low	26.6	Very low	154 Å²	154	154.5 Å²	154.5	82%	0.824	77%	0.77	S	S	*	*			trans	-86	114.5	163	-93.1	-26.3	0	0	0	109.6
1950	S	28	Very low	26.8	Very low	92 Å²	92	157.5 Å²	157.5	64%	0.643	78%	0.779	S	S	*	*			trans	-162.9	126.1	155	40.3	0	0	0	0	112.5
1951	Q	26.1	Very low	26.9	Very low	180 Å²	180	149.3 Å²	149.3	84%	0.841	76%	0.757	S	S	*	*			trans	40.6	130.9	139.5	-55.6	169.2	-1.6	0	0	118.5
1952	L	28.1	Very low	27.2	Very low	168 Å²	168	146.1 Å²	146.1	88%	0.88	74%	0.736	S	S	*	*			cis	-130.2	144.6	24.6	-82.7	84.8	0	0	0	114.2
1953	N	27	Very low	27.3	Very low	148 Å²	148	146 Å²	146	79%	0.791	73%	0.727	S	S	*	*			trans	-101.5	-173.7	151.3	-135.2	-2	0	0	0	106.3
1954	P	31	Very low	27.4	Very low	101 Å²	101	142 Å²	142	66%	0.656	72%	0.724	S	S	*	*			cis	-126.8	-164.1	-1.2	23.9	4.1	0	0	0	112
1955	I	28.5	Very low	27.3	Very low	132 Å²	132	135.4 Å²	135.4	68%	0.677	72%	0.715	S	S	*	*				-171.3	137.5	56.6	-85.1	-178.2	0	0	0	112.2
1956	N	27.8	Very low	27.4	Very low	114 Å²	114	134.9 Å²	134.9	61%	0.61	72%	0.719	S	S	*	*			trans	55.1	128	153.2	-67.4	-17	0	0	0	122.5
1957	R	27.4	Very low	27.3	Very low	207 Å²	207	132.2 Å²	132.2	78%	0.781	71%	0.713	S	S	*	*				71	144.8	77.3	-60.9	171.9	-172.1	-178.5	0.9	113.9
1958	Q	29.9	Very low	27.4	Very low	161 Å²	161	132.1 Å²	132.1	75%	0.752	72%	0.717	S	S	*	*			cis	-128.9	157.8	-3.6	-90.2	112.4	-52.3	0	0	108.3
1959	K	26.1	Very low	27.2	Very low	146 Å²	146	130.9 Å²	130.9	64%	0.635	71%	0.713	S	S	*	*			cis	84.4	89.6	33	-157.5	-156.4	-161	-147.9	0	115.6	N1779	N1779-K1959 PolarHBondContact ND2-NZ 3.1Å; N1779-K1959 WeakPolarHBondContact OD1-CE 3.43Å; N1779-K1959 PolarHBondContact OD1-NZ 3.41Å
1960	L	29.3	Very low	27.3	Very low	172 Å²	172	130.9 Å²	130.9	90%	0.901	71%	0.705	S	S	*	*			trans	-158.2	149.6	159	-110	157.8	0	0	0	112.2
1961	S	26.7	Very low	27.2	Very low	57 Å²	57	132.5 Å²	132.5	40%	0.399	70%	0.703	S	S	.	*			trans	-178.6	-179.2	-172.3	67.8	0	0	0	0	108.9
1962	P	33.6	Very low	27.1	Very low	49 Å²	49	130.2 Å²	130.2	32%	0.318	70%	0.704	S	S	.	*			cis	-132.1	-150	-37.1	27.2	-2.4	0	0	0	111.2	K1780	K1780-P1962 HydrophobicContact CB-CG 4.47Å; K1780-P1962 HydrophobicContact CD-CB 4.3Å; K1780-P1962 HydrophobicContact CD-CG 4.1Å; K1780-P1962 HydrophobicContact CG-CG 3.83Å
1963	E	26	Very low	27	Very low	118 Å²	118	129.8 Å²	129.8	55%	0.551	70%	0.697	S	S	*	*			trans	86.4	104.4	151.4	-71.1	165	-112.9	0	0	122.2	H1778	H1778-E1963 IonicContact CE1-OE1 3.47Å; H1778-E1963 IonicContact CE1-OE2 2.8Å; H1778-E1963 PolarHBondContact CE1-OE2 2.85Å; H1778-E1963 IonicContact CG-OE1 2.72Å; H1778-E1963 IonicContact ND1-OE1 3.71Å; H1778-E1963 PolarHBondContact ND1-OE1 2.95Å; H1778-E1963 IonicContact ND1-OE2 3.31Å; H1778-E1963 PolarHBondContact ND1-OE2 3.45Å
1964	S	27.6	Very low	26.9	Very low	112 Å²	112	128.9 Å²	128.9	78%	0.783	69%	0.692	S	S	*	*				179	122.4	127.3	29.1	0	0	0	0	107.4
1965	S	25.3	Very low	26.7	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	70%	0.699	S	S	*	*				80.4	92.9	51.1	76.2	0	0	0	0	114.7
1966	V	26	Very low	26.4	Very low	151 Å²	151	131.3 Å²	131.3	92%	0.915	70%	0.695	S	S	*	*			trans	-175.5	159.8	143.3	140.4	0	0	0	0	109.6
1967	S	23.4	Very low	26.3	Very low	104 Å²	104	131.7 Å²	131.7	73%	0.727	70%	0.704	S	S	*	*			trans	-99.5	148.7	-171.2	53.9	0	0	0	0	115.5
1968	V	25.6	Very low	26.2	Very low	125 Å²	125	127.5 Å²	127.5	76%	0.758	70%	0.696	S	S	*	*			trans	175.8	115.4	150.5	139.8	0	0	0	0	105.9
1969	I	24.7	Very low	26	Very low	150 Å²	150	125.2 Å²	125.2	77%	0.769	69%	0.693	S	S	*	*				66.9	136.3	83.4	-60.2	170.6	0	0	0	113.3
1970	K	26.3	Very low	25.9	Very low	153 Å²	153	121.7 Å²	121.7	67%	0.665	69%	0.691	S	S	*	*			trans	80.9	149.6	-167.1	-60.1	-177.7	155	-76.6	0	114.7
1971	E	25.6	Very low	25.7	Very low	126 Å²	126	123.3 Å²	123.3	59%	0.589	69%	0.691	S	S	*	*			cis	-162	148.5	-23.6	-112.4	147.2	-163.7	0	0	107.5	E1973	E1971-E1973 PolarHBondContact O-N 3.25Å
1972	P	24.2	Very low	25.6	Very low	133 Å²	133	130.9 Å²	130.9	86%	0.864	71%	0.713	S	S	*	*			trans	-94.8	91.1	-175.3	35.2	-32.7	0	0	0	113.7
1973	E	26	Very low	25.3	Very low	159 Å²	159	136.4 Å²	136.4	74%	0.743	74%	0.739	S	S	*	*			trans	-91.5	120.3	175.9	-77.5	-158.2	114.2	0	0	115.2	E1971	E1971-E1973 PolarHBondContact O-N 3.25Å
1974	N	24.3	Very low	25.3	Very low	128 Å²	128	136.7 Å²	136.7	68%	0.684	74%	0.744	S	S	*	*			trans	39.5	103.9	133.3	-65.6	-44.7	0	0	0	120.9
1975	Q	25.6	Very low	25.2	Very low	173 Å²	173	136.9 Å²	136.9	81%	0.808	75%	0.745	S	S	*	*			trans	-176.6	152.7	146.7	-102.7	147.3	90.2	0	0	111.5
1976	L	24.2	Very low	25.2	Very low	112 Å²	112	137.4 Å²	137.4	59%	0.586	74%	0.74	S	S	*	*			cis	-162.8	101.3	-38.1	-146.9	152.5	0	0	0	110.6	R1126 L1978	R1126-L1976 PolarHBondContact NH2-O 2.94Å; L1976-L1978 HydrophobicContact CD2-CB 3.86Å; L1976-L1978 HydrophobicContact CD2-CD1 4.21Å; L1976-L1978 HydrophobicContact CD2-CG 3.87Å; L1976-L1978 PolarHBondContact O-N 3.5Å
1977	P	24.4	Very low	25.3	Very low	122 Å²	122	137.6 Å²	137.6	79%	0.792	74%	0.735	S	S	*	*			trans	-36.9	19.1	164.8	37.5	-14.4	0	0	0	123.6	T1979	P1977-T1979 PolarHBondContact O-N 2.79Å; P1977-T1979 VanDerWaalsContact O-N 3.15Å
1978	L	24.7	Very low	25.3	Very low	118 Å²	118	138.3 Å²	138.3	62%	0.618	73%	0.734	S	S	*	*			trans	-58.4	112.3	-172.5	-130.1	176.5	0	0	0	113.8	R1126 L1976	R1126-L1978 PolarHBondContact NH1-O 3.19Å; R1126-L1978 PolarHBondContact NH2-O 2.92Å; L1976-L1978 HydrophobicContact CD2-CB 3.86Å; L1976-L1978 HydrophobicContact CD2-CD1 4.21Å; L1976-L1978 HydrophobicContact CD2-CG 3.87Å; L1976-L1978 PolarHBondContact O-N 3.5Å
1979	T	26.3	Very low	25.4	Very low	114 Å²	114	139.8 Å²	139.8	70%	0.699	74%	0.737	S	S	*	*			trans	-161.3	88.2	149.4	6	0	0	0	0	110.3	R1126 P1977	R1126-T1979 PolarHBondContact NH1-OG1 2.69Å; P1977-T1979 PolarHBondContact O-N 2.79Å; P1977-T1979 VanDerWaalsContact O-N 3.15Å
1980	A	24	Very low	25.6	Very low	72 Å²	72	138 Å²	138	60%	0.595	73%	0.734	S	S	*	*			trans	-92.4	135.1	165	0	0	0	0	0	109.2	Y1982	A1980-Y1982 PolarHBondContact O-N 3.33Å
1981	F	25	Very low	25.5	Very low	205 Å²	205	136.6 Å²	136.6	90%	0.899	74%	0.74	S	S	*	*			trans	-81.1	108.7	166.9	-82.9	-84.2	0	0	0	109.2	L1983	F1981-L1983 PolarHBondContact O-N 3.3Å
1982	Y	24.2	Very low	25.7	Very low	217 Å²	217	137.2 Å²	137.2	85%	0.851	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-70	124.1	164.7	-76.3	-104.5	0	0	0	108.7	A1980	A1980-Y1982 PolarHBondContact O-N 3.33Å
1983	L	27.6	Very low	25.9	Very low	164 Å²	164	137.3 Å²	137.3	86%	0.859	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-88	134.5	157.1	-93.1	162.5	0	0	0	108	F1981	F1981-L1983 PolarHBondContact O-N 3.3Å
1984	D	25.5	Very low	26.1	Very low	124 Å²	124	137 Å²	137	66%	0.663	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-62.5	135.2	-174.1	-166.8	-12.8	0	0	0	111.1	N1986	D1984-N1986 PolarHBondContact O-N 3.25Å; D1984-N1986 PolarHBondContact OD1-N 2.89Å; D1984-N1986 PolarHBondContact OD1-ND2 2.67Å
1985	S	26.4	Very low	26.2	Very low	116 Å²	116	136.6 Å²	136.6	81%	0.811	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	3.9	-174.1	-56.8	0	0	0	0	113.6
1986	N	26.4	Very low	26.5	Very low	120 Å²	120	133.9 Å²	133.9	64%	0.642	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	7	-166.6	-66.8	-65.7	0	0	0	115.8	D1984 V1988	D1984-N1986 PolarHBondContact O-N 3.25Å; D1984-N1986 PolarHBondContact OD1-N 2.89Å; D1984-N1986 PolarHBondContact OD1-ND2 2.67Å; N1986-V1988 PolarHBondContact O-N 2.99Å
1987	L	26.6	Very low	26.6	Very low	155 Å²	155	135.1 Å²	135.1	81%	0.812	76%	0.755	S	S	*	*			trans	-78.7	68.2	-176.6	-153.6	81.8	0	0	0	113.4	L1989	L1987-L1989 PolarHBondContact O-N 3.07Å
1988	V	24.7	Very low	27	Very low	118 Å²	118	136.4 Å²	136.4	72%	0.715	75%	0.754	S	S	*	*			trans	-70.8	108.3	175.2	179.7	0	0	0	0	110.3	N1986 T1990	N1986-V1988 PolarHBondContact O-N 2.99Å; V1988-T1990 HydrophobicContact CG1-CG2 4.2Å
1989	L	27.6	Very low	27.4	Very low	157 Å²	157	136.7 Å²	136.7	82%	0.822	76%	0.756	S	S	*	*			trans	-93	113.7	163.1	-72	175.4	0	0	0	109.1	L1987	L1987-L1989 PolarHBondContact O-N 3.07Å
1990	T	27.6	Very low	27.6	Very low	112 Å²	112	138 Å²	138	69%	0.687	76%	0.759	S	S	*	*			trans	-72.6	136.6	-169.5	44.6	0	0	0	0	112.9	V1988	V1988-T1990 HydrophobicContact CG1-CG2 4.2Å
1991	P	25.6	Very low	27.9	Very low	123 Å²	123	144.6 Å²	144.6	80%	0.799	77%	0.774	S	S	*	*			trans	-77.4	127.7	172.7	31.4	-32.4	0	0	0	109.8
1992	N	29.3	Very low	27.9	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	77%	0.773	S	S	*	*			trans	-128.2	88.7	177.9	-131	-17.1	0	0	0	111.9
1993	N	27.3	Very low	27.9	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	77%	0.772	S	S	*	*			trans	37	107.3	145.9	-59.6	-38.6	0	0	0	119.6
1994	T	31.1	Very low	28	Very low	151 Å²	151	138.4 Å²	138.4	93%	0.926	77%	0.77	S	S	*	*				-167.8	131.5	116.5	14	0	0	0	0	113.2
1995	T	27	Very low	28	Very low	120 Å²	120	140.6 Å²	140.6	74%	0.736	78%	0.781	S	S	*	*			trans	-97.8	154.2	174.8	49.8	0	0	0	0	110.7
1996	P	30.6	Very low	28	Very low	116 Å²	116	141.5 Å²	141.5	75%	0.753	78%	0.777	S	S	*	*				-135	145.7	72	15.9	8.4	0	0	0	114.7
1997	I	27.7	Very low	28	Very low	139 Å²	139	143.7 Å²	143.7	71%	0.713	79%	0.789	S	S	*	*				62	119.4	78.7	-49.7	158.5	0	0	0	112.2
1998	I	31.9	Very low	28.1	Very low	148 Å²	148	144.1 Å²	144.1	76%	0.759	79%	0.79	S	S	*	*				-165.8	130.9	102.4	-91.4	168.4	0	0	0	113.3
1999	N	34	Very low	28.1	Very low	124 Å²	124	142.8 Å²	142.8	66%	0.663	79%	0.786	S	S	*	*			trans	62.9	102.6	151.2	-64.8	-1	0	0	0	125.4
2000	N	30	Very low	28.2	Very low	142 Å²	142	142.8 Å²	142.8	76%	0.759	78%	0.781	S	S	*	*				62.1	100.3	112.9	-57.9	-8	0	0	0	122.1
2001	K	29.6	Very low	28.2	Very low	211 Å²	211	143 Å²	143	92%	0.917	79%	0.787	S	S	*	*				-158.6	139	105.9	-111.4	174.8	-178.3	179.3	0	111.4
2002	T	25.5	Very low	28.3	Very low	142 Å²	142	143.4 Å²	143.4	87%	0.871	79%	0.787	S	S	*	*			trans	-99.2	136.8	-177.5	37.3	0	0	0	0	112.2
2003	V	25.1	Very low	28	Very low	137 Å²	137	140.9 Å²	140.9	83%	0.83	78%	0.778	S	S	*	*			trans	-136.8	147	161.6	-178.7	0	0	0	0	106.6
2004	Q	27.8	Very low	27.9	Very low	176 Å²	176	140.5 Å²	140.5	82%	0.822	78%	0.781	S	S	*	*			trans	-71.3	146.2	-169.1	-67.5	160.8	-74.9	0	0	112.6
2005	L	26.1	Very low	27.6	Very low	170 Å²	170	142.1 Å²	142.1	89%	0.89	78%	0.775	S	S	*	*			trans	-94.5	104.5	167.1	-88.2	75.2	0	0	0	109.1
2006	D	26.1	Very low	27.6	Very low	135 Å²	135	142.6 Å²	142.6	72%	0.722	77%	0.772	S	S	*	*			trans	-129.3	153.3	154.5	-77.3	-60	0	0	0	107.5
2007	D	27	Very low	27.4	Very low	167 Å²	167	141.5 Å²	141.5	89%	0.893	77%	0.773	S	S	*	*	S	Bend	trans	52.8	54.7	170.7	-69	-16.5	0	0	0	119.3
2008	I	28.5	Very low	27.4	Very low	163 Å²	163	143.3 Å²	143.3	84%	0.836	78%	0.778	S	S	*	*			trans	-130	99.8	150.9	-54.3	-178.5	0	0	0	111.6
2009	S	25.4	Very low	27.2	Very low	90 Å²	90	139.1 Å²	139.1	63%	0.629	76%	0.762	S	S	*	*			trans	-88.8	115.6	161.4	57.3	0	0	0	0	110.6
2010	H	30.1	Very low	26.8	Very low	157 Å²	157	140 Å²	140	73%	0.727	77%	0.774	S	S	*	*			trans	-166.8	127.9	151.5	-87.1	-50.8	0	0	0	110.9
2011	S	27.1	Very low	26.7	Very low	116 Å²	116	138.8 Å²	138.8	81%	0.811	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-81.3	122.3	171.4	52.4	0	0	0	0	110.8	P2013	S2011-P2013 WeakPolarHBondContact O-CD 3.38Å
2012	V	26.9	Very low	26.8	Very low	133 Å²	133	130.9 Å²	130.9	81%	0.806	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-72.9	120.5	-178.7	-179.3	0	0	0	0	110.9
2013	P	24.5	Very low	26.9	Very low	85 Å²	85	129.4 Å²	129.4	55%	0.552	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-79.3	126.2	178.5	30.6	-33.7	0	0	0	112.1	S2011 F2015	S2011-P2013 WeakPolarHBondContact O-CD 3.38Å; P2013-F2015 HydrophobicContact CB-CE2 4.15Å; P2013-F2015 HydrophobicContact CB-CZ 4.39Å; P2013-F2015 HydrophobicContact CG-CD2 4.38Å; P2013-F2015 HydrophobicContact CG-CE2 3.66Å; P2013-F2015 HydrophobicContact CG-CZ 4.08Å; P2013-F2015 PolarHBondContact O-N 3.14Å
2014	V	23.7	Very low	26.9	Very low	129 Å²	129	129 Å²	129	78%	0.782	74%	0.739	S	S	*	*			trans	-83.4	104.6	171.9	-179.9	0	0	0	0	109.3	I2016	V2014-I2016 HydrophobicContact CG1-CG1 4.48Å; V2014-I2016 PolarHBondContact O-N 3.1Å
2015	F	26.1	Very low	26.8	Very low	185 Å²	185	126 Å²	126	81%	0.811	73%	0.732	S	S	*	*			trans	-79.7	98.9	-178.6	-75.3	-79.5	0	0	0	112.8	P2013 A2017	P2013-F2015 HydrophobicContact CB-CE2 4.15Å; P2013-F2015 HydrophobicContact CB-CZ 4.39Å; P2013-F2015 HydrophobicContact CG-CD2 4.38Å; P2013-F2015 HydrophobicContact CG-CE2 3.66Å; P2013-F2015 HydrophobicContact CG-CZ 4.08Å; P2013-F2015 PolarHBondContact O-N 3.14Å; F2015-A2017 PolarHBondContact O-N 3.18Å
2016	I	26.1	Very low	26.8	Very low	130 Å²	130	125.9 Å²	125.9	67%	0.667	73%	0.731	S	S	*	*			trans	-89.7	92.3	166.6	-59.8	166.3	0	0	0	108.6	V2014 H2018	V2014-I2016 HydrophobicContact CG1-CG1 4.48Å; V2014-I2016 PolarHBondContact O-N 3.1Å; I2016-H2018 PolarHBondContact O-N 2.78Å
2017	A	26.2	Very low	26.9	Very low	93 Å²	93	123.7 Å²	123.7	77%	0.769	73%	0.732	S	S	*	*			trans	-84.9	97.2	178.4	0	0	0	0	0	111.3	F2015 S2019	F2015-A2017 PolarHBondContact O-N 3.18Å; A2017-S2019 PolarHBondContact O-N 3.29Å
2018	H	27.4	Very low	26.8	Very low	176 Å²	176	123.9 Å²	123.9	82%	0.815	73%	0.732	S	S	*	*			trans	-73.1	121.1	171.1	-78.1	-82.9	0	0	0	111.1	I2016	I2016-H2018 PolarHBondContact O-N 2.78Å
2019	S	28	Very low	26.8	Very low	61 Å²	61	124.1 Å²	124.1	43%	0.427	73%	0.727	S	S	.	*			trans	-123.8	141.5	164.3	89.9	0	0	0	0	109.6	A2017 S2021 S2022	A2017-S2019 PolarHBondContact O-N 3.29Å; S2019-S2021 PolarHBondContact O-N 3.44Å; S2019-S2022 PolarHBondContact OG-OG 2.77Å
2020	P	26.2	Very low	26.9	Very low	141 Å²	141	126.2 Å²	126.2	92%	0.916	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	60.8	-173.5	32.7	-36.6	0	0	0	112.5
2021	S	27.8	Very low	26.9	Very low	117 Å²	117	124.7 Å²	124.7	82%	0.818	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.9	-8.7	166.6	44	0	0	0	0	115.5	S2019	S2019-S2021 PolarHBondContact O-N 3.44Å
2022	S	31.5	Very low	26.9	Very low	45 Å²	45	124.6 Å²	124.6	32%	0.315	73%	0.733	S	S	.	*			trans	-113.9	137.6	-170.5	57.9	0	0	0	0	114.1	S2019	S2019-S2022 PolarHBondContact OG-OG 2.77Å
2023	T	27.2	Very low	27	Very low	111 Å²	111	130.3 Å²	130.3	68%	0.681	74%	0.74	S	S	*	*			trans	-69.6	151.7	167	40.6	0	0	0	0	112.1
2024	P	24.5	Very low	27.3	Very low	128 Å²	128	131 Å²	131	83%	0.831	75%	0.753	S	S	*	*			trans	-68.8	137.2	-177.5	28.1	-35	0	0	0	112
2025	V	26.4	Very low	27.6	Very low	113 Å²	113	129.5 Å²	129.5	69%	0.685	75%	0.748	S	S	*	*			trans	-130.2	123.2	173.1	178.9	0	0	0	0	108.2
2026	I	25.5	Very low	27.6	Very low	168 Å²	168	126.4 Å²	126.4	86%	0.862	74%	0.744	S	S	*	*			trans	-85.2	121.7	175.5	-59.4	170.1	0	0	0	107.9
2027	A	28.9	Very low	27.7	Very low	89 Å²	89	127.1 Å²	127.1	74%	0.736	75%	0.75	S	S	*	*			trans	-130.1	106.6	177.7	0	0	0	0	0	110.4
2028	L	25.5	Very low	27.9	Very low	172 Å²	172	130.9 Å²	130.9	90%	0.901	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-75.5	126.4	170.4	-74	159.2	0	0	0	109.2
2029	K	27.4	Very low	27.9	Very low	168 Å²	168	129.4 Å²	129.4	73%	0.73	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-101.7	120.6	171.1	-172	-176.8	176.3	-115.1	0	109.5	D2031	K2029-D2031 IonicContact NZ-OD1 2.6Å; K2029-D2031 PolarHBondContact NZ-OD1 2.81Å
2030	T	28.2	Very low	27.7	Very low	133 Å²	133	131.8 Å²	131.8	82%	0.816	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-83.6	122.4	169.6	51.2	0	0	0	0	109.6
2031	D	31.1	Very low	27.8	Very low	125 Å²	125	128.8 Å²	128.8	67%	0.668	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-90.5	154.4	170.6	-72.9	-42.2	0	0	0	111.5	K2029	K2029-D2031 IonicContact NZ-OD1 2.6Å; K2029-D2031 PolarHBondContact NZ-OD1 2.81Å
2032	S	26.2	Very low	27.8	Very low	114 Å²	114	131 Å²	131	80%	0.797	76%	0.761	S	S	*	*			trans	-124.2	103.2	-172.7	59.2	0	0	0	0	111
2033	W	27.9	Very low	27.6	Very low	253 Å²	253	137.8 Å²	137.8	96%	0.958	79%	0.785	S	S	*	*			trans	-130.3	113	-175.4	-96.9	28	0	0	0	112.3
2034	A	32.3	Very low	27.7	Very low	100 Å²	100	141.7 Å²	141.7	83%	0.826	79%	0.793	S	S	*	*			trans	169	145	151.7	0	0	0	0	0	109
2035	S	29.4	Very low	27.9	Very low	98 Å²	98	138.5 Å²	138.5	69%	0.685	77%	0.767	S	S	*	*			cis	-167.8	140.2	-18.1	50.2	0	0	0	0	109.8
2036	T	26.2	Very low	28	Very low	119 Å²	119	139.7 Å²	139.7	73%	0.73	76%	0.763	S	S	*	*			trans	58	135.2	151.7	56.5	0	0	0	0	122.3
2037	N	27.4	Very low	28.3	Very low	145 Å²	145	139.8 Å²	139.8	78%	0.775	77%	0.772	S	S	*	*			trans	94.1	127.9	144.8	-63.8	-17	0	0	0	122.1
2038	Q	30.9	Very low	28.3	Very low	173 Å²	173	142.3 Å²	142.3	81%	0.808	77%	0.773	S	S	*	*			trans	85.1	123.3	152.4	-71.5	180	5.1	0	0	122.2
2039	L	27.7	Very low	28.4	Very low	144 Å²	144	140.7 Å²	140.7	75%	0.754	77%	0.767	S	S	*	*			trans	73.6	83.4	142.1	-64.5	166.2	0	0	0	121
2040	S	24.4	Very low	28.5	Very low	112 Å²	112	139.2 Å²	139.2	78%	0.783	77%	0.769	S	S	*	*				30.1	120.1	121.8	59.6	0	0	0	0	120.3
2041	G	27.4	Very low	28.5	Very low	78 Å²	78	139.6 Å²	139.6	80%	0.804	77%	0.766	S	S	*	*			trans	-166.2	53.2	177	0	0	0	0	0	117.6
2042	I	28.7	Very low	28.3	Very low	162 Å²	162	140.5 Å²	140.5	83%	0.831	77%	0.772	S	S	*	*			trans	22.9	123.6	156.6	-58.5	173.5	0	0	0	119.7
2043	F	26.9	Very low	28.5	Very low	188 Å²	188	142.3 Å²	142.3	83%	0.825	77%	0.77	S	S	*	*			trans	-20.5	140.6	156.1	-74.3	-104.7	0	0	0	117.8
2044	F	29.7	Very low	28.5	Very low	193 Å²	193	134.4 Å²	134.4	85%	0.846	76%	0.757	S	S	*	*				-154	163.9	116.8	-120.8	-81.6	0	0	0	111.9
2045	E	27.6	Very low	28.2	Very low	62 Å²	62	137 Å²	137	29%	0.29	75%	0.751	S	S	.	*			trans	-127.7	130.5	-158.4	169.2	-145.7	120.5	0	0	110.6	K624	K624-E2045 WeakPolarHBondContact CB-OE1 3.39Å; K624-E2045 WeakPolarHBondContact CD-OE1 3.47Å; K624-E2045 VanDerWaalsContact CE-OE1 3.29Å; K624-E2045 WeakPolarHBondContact CE-OE1 3.33Å; K624-E2045 VanDerWaalsContact CE-OE2 3.23Å; K624-E2045 WeakPolarHBondContact CE-OE2 3.4Å; K624-E2045 WeakPolarHBondContact CG-OE1 3.13Å; K624-E2045 IonicContact NZ-OE1 3.68Å; K624-E2045 IonicContact NZ-OE2 2.8Å; K624-E2045 PolarHBondContact NZ-OE2 3.43Å
2046	K	28.8	Very low	28.1	Very low	138 Å²	138	140.3 Å²	140.3	60%	0.6	76%	0.757	S	S	*	*			trans	-172.3	83.8	156.3	-117.4	-177.2	-179.5	-173.4	0	114.3	S622	S622-K2046 PolarHBondContact O-NZ 3.37Å
2047	T	31.3	Very low	28.3	Very low	169 Å²	169	142.2 Å²	142.2	100%	1.037	76%	0.759	S	S	*	*				177.9	0	127.1	46.6	0	0	0	0	104.7

Retrieved 2,047 of 2,047 residues in 2218.6 ms (Link to these results)

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