A0A3Q0KFJ5_SCHMA Loading...

VEFS-Box domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KFJ5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,098 aa.

						>A0A3Q0KFJ5_SCHMA|A0A3Q0KFJ5
MESSEKQTPRSSNAFKNKPGRGRTASHVKKSDNRTSRSKASRRTSVDSRKKSNPKCSRGKAYAKLIQTKSQRRILNGRIASRSALYRLKCRTSQAVYVTKRPYRRRIPNVNSQANTSKDILPQTNSEFGIIPTNENPVEQVQSLSCSNRPTGLKRKYTRRNPSSRFSYTRKPNARSAQSNYANSIVDFNNLVKKQEAFIRAFAIPTHLYRYLSHRHRDRPLYLDRTLSYLMPNPSRKQSSGSRRSINRIVERLIERRKDCRQNDELKDSSKYLESTSSSSSTTPGELPQELELIFEGFYDSEKEMDWVTVDASVNVHLRFGWAWRRKICPDDTILNITPNPIRINCYSHSTGYTSLVNSPPTSNNDNSTTATTNTTRTACRFSLTDLINQVKWNTSSGRLTSAQLELHVSATERRWLKRPDLSHGAVGLNGITPNISNNLTNHINHVNHNNNGNNNPSQNSSKSAHTDGKNINSHTTFISGNPLRKGGLSSNSYPVQYSTAPLPLIVSSIGFDSSNTGRQLLLTPGLYELRLGVDTSDGNVSNSGSNGRVMNKVVPLKCLDDNTSEKSYVSANNDKVNDACSGQVEWRRIRFPNSSTALDEYSRWPGLRFSVIWHNKLENNQITSPCRSMETRRQDNTHMHAEGRSSLTRSMTNSHNRDVIKLQNQSVTPHKQIVLKESCDSSVYKDSTGLDKCLSNRVQQSLSAYSGPDVDKPTSTKTPPLIHPITYGFVFGGNLQQWSQSTDLVCPWCHLDCARAGDKGPEALVLHLRTCHPRFRLKVMWDSSHTQLSLQVSLNEAYDGSNDCGIRRWCPSGRNIFILRHHVIPSSSGQLVGSCAALGTNSNPKQSGNQGRHSNSPTIIDATVRIRCPVRRLPYTHLIFWRGAELSTDQLLDPTLSVRPMVTGHNRIYYHTRTSQPVRACEFDVDSEAEDAPVWLRQHYQRKVEEFTDVNPGEKQIMQLWNALLLSIRPSGLVVCDGQVLTLVCQFIHQHSRWIHRRRLRTNLLLHLVNLVDYGLLSSSHLRQLMLIYDKHVQELNPINNTSVNNNHITNTQPLSSPSNASTTSLLPDSKLVNCHINKSQPIIPRLLQMFSSTSNS
					

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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	31.1	Very low	35.4	Very low	241 Å²	241	162.8 Å²	162.8	100%	1.187	85%	0.851	S	S	*	*				0	90.7	0	-65.2	166.2	171.8	0	0	106.1
2	E	33.3	Very low	35	Very low	176 Å²	176	157.3 Å²	157.3	82%	0.822	84%	0.836	S	S	*	*			cis	-125.4	129.6	1.3	-80.2	161.5	115.4	0	0	107.6
3	S	33.9	Very low	35	Very low	102 Å²	102	157.1 Å²	157.1	71%	0.713	84%	0.835	S	S	*	*				49.3	133.9	99.6	37.6	0	0	0	0	114.7
4	S	38	Very low	34.8	Very low	122 Å²	122	152.4 Å²	152.4	85%	0.853	83%	0.829	S	S	*	*			cis	-137.1	168.6	26.6	-60.9	0	0	0	0	115
5	E	33.6	Very low	34.8	Very low	181 Å²	181	155.8 Å²	155.8	85%	0.846	83%	0.834	S	S	*	*			trans	-87.8	161.9	-177.6	-54.3	157.1	98.2	0	0	113.9
6	K	40.2	Very low	34.6	Very low	182 Å²	182	157.5 Å²	157.5	79%	0.791	83%	0.831	S	S	*	*				-177	109	121.9	-97.7	167.9	-178.3	179	0	109.3
7	Q	36	Very low	34.7	Very low	172 Å²	172	156.1 Å²	156.1	80%	0.804	83%	0.825	S	S	*	*				99.3	118.9	87.9	-89.2	-179.6	-15.3	0	0	112
8	T	34	Very low	34.7	Very low	134 Å²	134	158.2 Å²	158.2	82%	0.822	83%	0.825	S	S	*	*			trans	-115.1	147.5	173.1	54.1	0	0	0	0	109.5
9	P	44.7	Very low	35.1	Very low	129 Å²	129	156.6 Å²	156.6	84%	0.838	83%	0.826	S	S	*	*			trans	-99.7	156.2	160.1	34.3	-28.9	0	0	0	112.1
10	R	28.3	Very low	35.3	Very low	243 Å²	243	152.6 Å²	152.6	92%	0.917	82%	0.824	S	S	*	*			trans	-118.6	137.3	172.5	-72.3	172.1	165.9	176.2	-4.8	110.4
11	S	36.2	Very low	35.2	Very low	109 Å²	109	157.8 Å²	157.8	76%	0.762	83%	0.832	S	S	*	*			trans	-166.5	139	149.6	43.8	0	0	0	0	107.6
12	S	30.5	Very low	35.5	Very low	97 Å²	97	149.6 Å²	149.6	68%	0.678	81%	0.809	S	S	*	*			cis	91	139.9	27.4	80.5	0	0	0	0	114.6
13	N	35.3	Very low	35.6	Very low	154 Å²	154	152.7 Å²	152.7	82%	0.824	81%	0.813	S	S	*	*			trans	79.2	121.8	-172.7	-45.5	-13.7	0	0	0	112.9
14	A	31.4	Very low	35.8	Very low	91 Å²	91	153.7 Å²	153.7	75%	0.752	82%	0.815	S	S	*	*			cis	84.7	85.9	8.3	0	0	0	0	0	118.4
15	F	35	Very low	35.7	Very low	204 Å²	204	152.5 Å²	152.5	90%	0.895	81%	0.812	S	S	*	*			trans	-162.5	130.7	149	-90.2	-77.5	0	0	0	106
16	K	32.9	Very low	35.9	Very low	183 Å²	183	148.9 Å²	148.9	80%	0.796	81%	0.807	S	S	*	*			cis	87.2	133.9	43.5	-104.3	-174.7	-179.7	178	0	115.4
17	N	35.3	Very low	35.8	Very low	134 Å²	134	147.6 Å²	147.6	72%	0.717	80%	0.804	S	S	*	*			trans	78.4	128.3	177	-57.5	-27.8	0	0	0	115.5
18	K	35.6	Very low	36.1	Very low	193 Å²	193	146 Å²	146	84%	0.839	81%	0.806	S	S	*	*			cis	90.2	151.7	42.8	-81.9	-174.6	174	-177	0	112.5
19	P	42.2	Very low	36.2	Very low	128 Å²	128	148 Å²	148	83%	0.831	80%	0.803	S	S	*	*			cis	-138.7	-176.5	-38.7	40.4	-23.2	0	0	0	113.1
20	G	38.2	Very low	35.6	Very low	76 Å²	76	151.3 Å²	151.3	78%	0.784	80%	0.804	S	S	*	*			trans	-160.1	153.1	171.4	0	0	0	0	0	114.4
21	R	33.3	Very low	36.1	Very low	263 Å²	263	145.4 Å²	145.4	99%	0.992	80%	0.8	S	S	*	*			trans	-142.7	144.5	-174.1	-85.4	-177.5	165.1	-170.3	-2.8	113.7
22	G	36.9	Very low	36.1	Very low	69 Å²	69	146.8 Å²	146.8	71%	0.711	80%	0.799	S	S	*	*			trans	175.8	119.2	160.8	0	0	0	0	0	109.3
23	R	36.8	Very low	36.5	Very low	240 Å²	240	148.9 Å²	148.9	91%	0.906	80%	0.802	S	S	*	*				72.8	131.6	68.9	-73.6	-167	169.8	175.9	-3.3	112.4
24	T	37.6	Very low	36.5	Very low	123 Å²	123	151.9 Å²	151.9	76%	0.755	80%	0.802	S	S	*	*			cis	-163.9	151.7	6.4	-1.6	0	0	0	0	114.3
25	A	36	Very low	36.8	Very low	97 Å²	97	153.3 Å²	153.3	80%	0.802	80%	0.802	S	S	*	*			trans	64.3	162.1	147.9	0	0	0	0	0	119.4
26	S	38.5	Very low	36.9	Very low	105 Å²	105	148.7 Å²	148.7	73%	0.734	80%	0.795	S	S	*	*			cis	-149.1	153.8	12.9	58.6	0	0	0	0	114.8
27	H	37.4	Very low	37.2	Very low	156 Å²	156	151 Å²	151	72%	0.722	80%	0.799	S	S	*	*			trans	42.4	155.6	149.9	-82.5	-141.6	0	0	0	122
28	V	41.3	Very low	37.3	Very low	139 Å²	139	148.9 Å²	148.9	84%	0.842	79%	0.794	S	S	*	*			cis	-132.6	170.9	33.4	173.4	0	0	0	0	112.8
29	K	37.2	Very low	37.4	Very low	176 Å²	176	149.6 Å²	149.6	77%	0.765	80%	0.797	S	S	*	*			trans	-96.5	170.1	-170.4	-68.3	176.9	176.4	175.7	0	115.5
30	K	32	Very low	37.1	Very low	198 Å²	198	148.4 Å²	148.4	86%	0.861	80%	0.799	S	S	*	*			trans	-63.6	157.2	166.6	-57	173.9	174.8	-178.5	0	114.1
31	S	38	Very low	36.9	Very low	119 Å²	119	149.9 Å²	149.9	83%	0.832	80%	0.797	S	S	*	*			trans	-157.2	167.4	133.1	53.8	0	0	0	0	110.3
32	D	37.5	Very low	37	Very low	138 Å²	138	147.1 Å²	147.1	74%	0.738	79%	0.787	S	S	*	*			trans	-105.7	150.4	-161.4	-53.1	-95.3	0	0	0	114.8
33	N	37.3	Very low	36.9	Very low	141 Å²	141	153.2 Å²	153.2	75%	0.754	79%	0.788	S	S	*	*				-171.5	144.4	118.3	-104.5	-62.1	0	0	0	117.1
34	R	37.1	Very low	36.7	Very low	216 Å²	216	148.2 Å²	148.2	82%	0.815	78%	0.784	S	S	*	*			trans	-3.7	153.7	145.3	-59	173.1	179.3	-177.4	-0.7	118.8
35	T	37.7	Very low	36.6	Very low	121 Å²	121	147.6 Å²	147.6	74%	0.742	79%	0.785	S	S	*	*			cis	-164.7	159.8	21.2	-14.8	0	0	0	0	114.7
36	S	37.2	Very low	36.5	Very low	108 Å²	108	149.3 Å²	149.3	76%	0.755	79%	0.785	S	S	*	*			trans	72.1	157	154.8	86.7	0	0	0	0	117.6
37	R	37.6	Very low	36.2	Very low	231 Å²	231	150 Å²	150	87%	0.872	78%	0.781	S	S	*	*			cis	-164.7	158.3	-6.8	-128.2	170.1	-178.8	172.9	-0.6	108.5
38	S	37.9	Very low	35.9	Very low	90 Å²	90	147.3 Å²	147.3	63%	0.629	78%	0.78	S	S	*	*				-163	139.6	-61.3	59.4	0	0	0	0	112.1
39	K	38.2	Very low	35.5	Very low	207 Å²	207	150.6 Å²	150.6	90%	0.9	78%	0.777	S	S	*	*			trans	74.6	159.4	166.9	-52.6	169.1	-178.5	175.7	0	115.7
40	A	36.5	Very low	35.3	Very low	104 Å²	104	151.5 Å²	151.5	86%	0.86	78%	0.781	S	S	*	*			cis	-141.5	178.1	10.6	0	0	0	0	0	114
41	S	33.1	Very low	35.2	Very low	107 Å²	107	152.2 Å²	152.2	75%	0.748	78%	0.784	S	S	*	*			trans	-141.7	153.2	-178.6	162.2	0	0	0	0	110.4
42	R	35.5	Very low	35.1	Very low	205 Å²	205	152.1 Å²	152.1	77%	0.774	78%	0.783	S	S	*	*			trans	172.9	141.7	134.4	-95.3	160.7	-178.5	-169	1	116.7
43	R	35.2	Very low	34.7	Very low	197 Å²	197	152.4 Å²	152.4	74%	0.743	78%	0.784	S	S	*	*			trans	61.5	104.8	135.5	-68	172.9	176.8	179.9	-4.5	122.9
44	T	32.8	Very low	35	Very low	134 Å²	134	151.9 Å²	151.9	82%	0.822	79%	0.789	S	S	*	*				20.9	116.7	109.9	58.7	0	0	0	0	121
45	S	33.9	Very low	34.6	Very low	110 Å²	110	150.1 Å²	150.1	77%	0.769	79%	0.787	S	S	*	*			trans	-169.1	129.1	135.2	-149.3	0	0	0	0	106.1
46	V	33.9	Very low	34.2	Very low	133 Å²	133	150.2 Å²	150.2	81%	0.806	79%	0.791	S	S	*	*				45.5	95.3	64.5	-169.7	0	0	0	0	113.4
47	D	33.8	Very low	34.1	Very low	120 Å²	120	149.8 Å²	149.8	64%	0.642	79%	0.788	S	S	*	*				-157.2	166.7	120.2	-161.8	11.2	0	0	0	110.3	R49	D47-R49 IonicContact OD2-CZ 3.42Å; D47-R49 IonicContact OD2-NE 2.73Å; D47-R49 PolarHBondContact OD2-NE 3.27Å; D47-R49 VanDerWaalsContact OD2-NE 3.14Å; D47-R49 IonicContact OD2-NH2 3.99Å
48	S	30	Very low	33.9	Very low	100 Å²	100	150.6 Å²	150.6	70%	0.699	79%	0.791	S	S	*	*			trans	-133.2	117.3	-176.5	61.6	0	0	0	0	111.8
49	R	33.9	Very low	33.6	Very low	207 Å²	207	150 Å²	150	78%	0.781	80%	0.8	S	S	*	*			trans	-149.2	115.3	167	-88.5	129.7	-142.7	-106.1	7.5	107.9	D47	D47-R49 IonicContact OD2-CZ 3.42Å; D47-R49 IonicContact OD2-NE 2.73Å; D47-R49 PolarHBondContact OD2-NE 3.27Å; D47-R49 VanDerWaalsContact OD2-NE 3.14Å; D47-R49 IonicContact OD2-NH2 3.99Å
50	K	33	Very low	33.4	Very low	196 Å²	196	150 Å²	150	85%	0.852	80%	0.799	S	S	*	*				77.7	103.6	87.5	-83.4	-175.9	173.9	176.5	0	114.4
51	K	30.2	Very low	33.2	Very low	213 Å²	213	149.2 Å²	149.2	93%	0.926	79%	0.793	S	S	*	*			trans	20.3	116.3	139.8	-63	174.4	176.4	176.2	0	118.1
52	S	34.2	Very low	33.1	Very low	117 Å²	117	153.7 Å²	153.7	82%	0.818	80%	0.795	S	S	*	*			trans	-150.4	145.7	138.3	55.7	0	0	0	0	110.3
53	N	29.1	Very low	32.9	Very low	143 Å²	143	148.4 Å²	148.4	77%	0.765	80%	0.795	S	S	*	*			trans	-106.5	141	168.5	-74.6	-55.7	0	0	0	108.1
54	P	43.4	Very low	32.8	Very low	130 Å²	130	147.1 Å²	147.1	84%	0.844	80%	0.795	S	S	*	*			trans	-75.9	116.6	141.6	3.4	15.2	0	0	0	108.3
55	K	30.6	Very low	32.7	Very low	180 Å²	180	146.9 Å²	146.9	78%	0.783	79%	0.788	S	S	*	*			trans	-89.9	172.1	158.7	-84.2	-177.5	174.8	177.7	0	108.7
56	C	28.8	Very low	32.6	Very low	122 Å²	122	149.4 Å²	149.4	82%	0.824	79%	0.791	S	S	*	*			trans	74.2	146.7	171.8	-66.3	0	0	0	0	115.4
57	S	34.7	Very low	32.5	Very low	99 Å²	99	150.7 Å²	150.7	69%	0.692	79%	0.788	S	S	*	*			cis	-160.2	143.5	-8.6	34.7	0	0	0	0	114.8
58	R	32.2	Very low	32.5	Very low	249 Å²	249	150.5 Å²	150.5	94%	0.94	79%	0.792	S	S	*	*			trans	42.4	89.4	142.2	-56.6	172	93	119.4	-4.3	117.8
59	G	33.3	Very low	32.7	Very low	78 Å²	78	155 Å²	155	80%	0.804	80%	0.799	S	S	*	*			trans	-121.9	104.1	162.9	0	0	0	0	0	111.9	A61	G59-A61 PolarHBondContact O-N 3.43Å
60	K	34	Very low	32.7	Very low	206 Å²	206	149.7 Å²	149.7	90%	0.896	79%	0.793	S	S	*	*			trans	-61	121.7	179.7	-60.2	163.8	-176.3	173	0	109.3
61	A	31.1	Very low	32.7	Very low	88 Å²	88	147.4 Å²	147.4	73%	0.727	79%	0.786	S	S	*	*				65.3	111.2	73.4	0	0	0	0	0	114.1	G59	G59-A61 PolarHBondContact O-N 3.43Å
62	Y	32.5	Very low	32.9	Very low	200 Å²	200	145.8 Å²	145.8	78%	0.784	77%	0.774	S	S	*	*			trans	-144	108.5	157.4	-122.7	-76.9	0	0	0	111.2	K64	Y62-K64 HydrophobicContact CE1-CD 4.15Å; Y62-K64 HydrophobicContact CE1-CG 4.31Å
63	A	30.7	Very low	32.8	Very low	95 Å²	95	150.5 Å²	150.5	79%	0.785	77%	0.774	S	S	*	*			trans	-139.7	110.5	167.4	0	0	0	0	0	108
64	K	32.7	Very low	33.1	Very low	169 Å²	169	151.2 Å²	151.2	74%	0.735	78%	0.776	S	S	*	*			trans	-103.2	120.5	161.7	-74.2	174.7	170	172.7	0	104.9	Y62	Y62-K64 HydrophobicContact CE1-CD 4.15Å; Y62-K64 HydrophobicContact CE1-CG 4.31Å
65	L	30	Very low	32.7	Very low	130 Å²	130	151.8 Å²	151.8	68%	0.681	77%	0.771	S	S	*	*			cis	58.8	90.9	31.7	-155.9	82.8	0	0	0	112.4	Q67	L65-Q67 HydrophobicContact CD1-CG 4.06Å; L65-Q67 HydrophobicContact CG-CG 4.22Å
66	I	32	Very low	32.9	Very low	162 Å²	162	150.1 Å²	150.1	83%	0.831	77%	0.771	S	S	*	*			trans	-113.6	121.5	150.6	-65.1	179.7	0	0	0	105.8
67	Q	31.6	Very low	33.1	Very low	160 Å²	160	146.9 Å²	146.9	75%	0.748	76%	0.758	S	S	*	*			trans	-113.7	124	171.5	-76.6	-178.8	-26.1	0	0	109.2	L65	L65-Q67 HydrophobicContact CD1-CG 4.06Å; L65-Q67 HydrophobicContact CG-CG 4.22Å
68	T	34.7	Very low	33.1	Very low	116 Å²	116	154 Å²	154	71%	0.712	77%	0.77	S	S	*	*			trans	-152.1	125.6	151.5	23.4	0	0	0	0	105.7
69	K	32.9	Very low	33.2	Very low	194 Å²	194	149.7 Å²	149.7	84%	0.843	76%	0.764	S	S	*	*				53.5	120.2	83.6	-63	-178.3	-178.9	178.8	0	110.6
70	S	34.3	Very low	33.2	Very low	96 Å²	96	149.8 Å²	149.8	67%	0.671	76%	0.757	S	S	*	*			cis	-171.4	162.3	11.3	52.5	0	0	0	0	112.7
71	Q	34.2	Very low	33.1	Very low	149 Å²	149	145.3 Å²	145.3	70%	0.696	75%	0.751	S	S	*	*			trans	55.1	139.4	139.5	-72.8	-179.1	51.2	0	0	119.4
72	R	33.2	Very low	33.1	Very low	178 Å²	178	152.5 Å²	152.5	67%	0.672	76%	0.76	S	S	*	*			cis	-162.3	142.7	14	-109.7	164.9	-153.9	-163.3	7.1	109.4
73	R	32.4	Very low	33.1	Very low	217 Å²	217	148.7 Å²	148.7	82%	0.819	76%	0.762	S	S	*	*			trans	58.5	156.5	145.3	-53.2	172.4	-176.8	175	-0.9	116.4
74	I	36.1	Very low	33.2	Very low	158 Å²	158	148.7 Å²	148.7	81%	0.81	76%	0.762	S	S	*	*			cis	-132.2	164.5	21.1	-71.7	172.7	0	0	0	111.1
75	L	34	Very low	33.1	Very low	141 Å²	141	148.9 Å²	148.9	74%	0.738	77%	0.77	S	S	*	*			trans	-41.3	160.6	172.3	-80.5	53.2	0	0	0	114.9
76	N	35.7	Very low	33.1	Very low	145 Å²	145	153.6 Å²	153.6	78%	0.775	78%	0.781	S	S	*	*			cis	-158	175.1	5.4	-118.9	-18.1	0	0	0	109.6
77	G	33.4	Very low	33	Very low	54 Å²	54	156.4 Å²	156.4	56%	0.557	78%	0.781	S	S	*	*			cis	156.1	118.7	-10.6	0	0	0	0	0	115.3
78	R	33.5	Very low	32.9	Very low	248 Å²	248	155.5 Å²	155.5	94%	0.936	78%	0.78	S	S	*	*			trans	74.7	151.2	168.5	-49.8	179	174.9	169.5	-2	115.8
79	I	34.6	Very low	32.7	Very low	160 Å²	160	158.9 Å²	158.9	82%	0.821	79%	0.785	S	S	*	*			cis	-127.6	146.2	16.6	-69.1	171.2	0	0	0	113.3
80	A	33.9	Very low	32.3	Very low	79 Å²	79	156 Å²	156	65%	0.653	79%	0.788	S	S	*	*			trans	4.7	123.6	160.9	0	0	0	0	0	120.8
81	S	32.6	Very low	32.1	Very low	112 Å²	112	162.6 Å²	162.6	78%	0.783	80%	0.798	S	S	*	*				89.1	153.6	75.4	95.9	0	0	0	0	114.1
82	R	31.3	Very low	31.9	Very low	240 Å²	240	162.2 Å²	162.2	91%	0.906	81%	0.806	S	S	*	*			cis	-153.1	143.7	7.9	-151.1	173.1	-171.2	175.6	2.6	109.3
83	S	30.8	Very low	31.7	Very low	119 Å²	119	159 Å²	159	83%	0.832	81%	0.811	S	S	*	*			trans	-102	149.6	173.4	51.8	0	0	0	0	111.7
84	A	32.6	Very low	31.5	Very low	96 Å²	96	158.3 Å²	158.3	79%	0.793	82%	0.817	S	S	*	*			trans	-147.9	121.5	170	0	0	0	0	0	110.4
85	L	32.1	Very low	31.3	Very low	172 Å²	172	154.6 Å²	154.6	90%	0.901	81%	0.81	S	S	*	*			trans	-84.4	136.6	168.3	-75.6	161.5	0	0	0	109.1
86	Y	30.4	Very low	31	Very low	230 Å²	230	154.4 Å²	154.4	90%	0.902	82%	0.815	S	S	*	*			trans	-132.3	141.3	156.9	-104.8	-86.5	0	0	0	111.5
87	R	29.4	Very low	30.7	Very low	220 Å²	220	157.9 Å²	157.9	83%	0.83	82%	0.819	S	S	*	*			trans	-131.6	147.9	-175.5	-164.6	-167.8	-135.9	-165.2	7	106.6
88	L	29.2	Very low	30.6	Very low	141 Å²	141	161.1 Å²	161.1	74%	0.738	83%	0.827	S	S	*	*			trans	67.9	143	-176.3	-56.5	116	0	0	0	113.4
89	K	29.7	Very low	30.3	Very low	187 Å²	187	155.5 Å²	155.5	81%	0.813	82%	0.821	S	S	*	*			cis	-142.8	154.4	12.9	-99.7	122.1	175.8	-173.7	0	110.2
90	C	26.3	Very low	30.2	Very low	133 Å²	133	157.4 Å²	157.4	90%	0.899	82%	0.823	S	S	*	*			trans	-78.2	120.5	155.5	-62.6	0	0	0	0	110.1
91	R	30	Very low	29.9	Very low	235 Å²	235	165 Å²	165	89%	0.887	84%	0.835	S	S	*	*			trans	-157.6	145	144.4	-120.2	177.6	-173	-177.2	2.3	111.7
92	T	28.2	Very low	30	Very low	142 Å²	142	165.4 Å²	165.4	87%	0.871	83%	0.834	S	S	*	*			trans	-56	128	-179.2	46.7	0	0	0	0	114
93	S	30.5	Very low	29.8	Very low	110 Å²	110	164.7 Å²	164.7	77%	0.769	83%	0.833	S	S	*	*			trans	-146.7	128.4	156.2	53.4	0	0	0	0	108.3
94	Q	27.6	Very low	29.6	Very low	202 Å²	202	170.2 Å²	170.2	94%	0.944	84%	0.836	S	S	*	*			trans	-70.1	134.4	-179.2	-68	160.2	-40.2	0	0	110.1
95	A	31.1	Very low	29.5	Very low	81 Å²	81	176.4 Å²	176.4	67%	0.669	84%	0.839	S	S	*	*			trans	-130.7	112.3	171.1	0	0	0	0	0	108.6	Y97	A95-Y97 PolarHBondContact O-N 3.34Å
96	V	27.4	Very low	29.3	Very low	137 Å²	137	179.2 Å²	179.2	83%	0.83	84%	0.837	S	S	*	*			trans	-76.5	107.8	-177.4	177.6	0	0	0	0	109.4
97	Y	30.7	Very low	29.2	Very low	218 Å²	218	175.9 Å²	175.9	86%	0.855	83%	0.833	S	S	*	*			trans	-94.4	115.1	168.3	-94.9	-83.2	0	0	0	111	A95	A95-Y97 PolarHBondContact O-N 3.34Å
98	V	31.2	Very low	29.2	Very low	121 Å²	121	169.8 Å²	169.8	73%	0.733	82%	0.822	S	S	*	*			trans	-63.6	130.9	-174.6	175.7	0	0	0	0	111.2	K100	V98-K100 PolarHBondContact O-N 3.08Å; V98-K100 VanDerWaalsContact O-N 3.12Å
99	T	27.4	Very low	29	Very low	131 Å²	131	170.2 Å²	170.2	80%	0.804	83%	0.826	S	S	*	*			trans	-73.9	99.4	-176.8	54.2	0	0	0	0	112.4
100	K	31.8	Very low	29	Very low	199 Å²	199	166.4 Å²	166.4	87%	0.865	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-90.5	118.9	159.8	-73	-165.6	174.2	-173.9	0	110	V98 P102	V98-K100 PolarHBondContact O-N 3.08Å; V98-K100 VanDerWaalsContact O-N 3.12Å; K100-P102 WeakPolarHBondContact O-CD 3.39Å
101	R	27.9	Very low	29	Very low	240 Å²	240	165.9 Å²	165.9	91%	0.906	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73.5	123.5	-174.5	-60.2	172.2	179.5	170.8	-0.8	111.3
102	P	33.5	Very low	28.8	Very low	119 Å²	119	160.3 Å²	160.3	77%	0.773	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-75.2	161.2	146.8	33.2	-32.1	0	0	0	109.9	K100 R104	K100-P102 WeakPolarHBondContact O-CD 3.39Å; P102-R104 PolarHBondContact O-N 3.12Å
103	Y	29.1	Very low	28.7	Very low	226 Å²	226	161.6 Å²	161.6	89%	0.886	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-63	124.1	-171.9	-149.2	-110.1	0	0	0	112.4	R105	Y103-R105 PolarHBondContact O-N 2.85Å
104	R	26.5	Very low	28.6	Very low	234 Å²	234	160.3 Å²	160.3	88%	0.883	80%	0.795	S	S	*	*			trans	-69.9	87.1	172.7	-90.9	-171.4	170.9	-174.3	-2	110.4	P102 R106	P102-R104 PolarHBondContact O-N 3.12Å; R104-R106 PolarHBondContact O-N 3.07Å
105	R	29.4	Very low	28.6	Very low	226 Å²	226	159 Å²	159	85%	0.853	80%	0.795	S	S	*	*			trans	-66.4	113.3	145.9	-79.9	-171.3	174.9	175.4	0.7	106.6	Y103 I107	Y103-R105 PolarHBondContact O-N 2.85Å; R105-I107 PolarHBondContact O-N 3.38Å; R105-I107 VanDerWaalsContact O-N 3.11Å
106	R	27.6	Very low	28.4	Very low	232 Å²	232	161.1 Å²	161.1	88%	0.875	80%	0.799	S	S	*	*			trans	-62.6	113	173.1	-66.9	-174.3	-174.6	-164.5	3.5	107.4	R104 P108	R104-R106 PolarHBondContact O-N 3.07Å; R106-P108 VanDerWaalsContact O-CD 3.27Å; R106-P108 WeakPolarHBondContact O-CD 3.13Å
107	I	29.1	Very low	28.4	Very low	159 Å²	159	160.2 Å²	160.2	82%	0.815	80%	0.799	S	S	*	*			trans	-71.8	114.8	159.3	-60.3	174	0	0	0	105.3	R105	R105-I107 PolarHBondContact O-N 3.38Å; R105-I107 VanDerWaalsContact O-N 3.11Å
108	P	28.3	Very low	28.1	Very low	92 Å²	92	159.1 Å²	159.1	60%	0.597	80%	0.799	S	S	*	*			trans	-71.3	137.9	171.3	-5.5	23.6	0	0	0	107.9	R106 V110	R106-P108 VanDerWaalsContact O-CD 3.27Å; R106-P108 WeakPolarHBondContact O-CD 3.13Å; P108-V110 HydrophobicContact CB-CG2 3.93Å; P108-V110 HydrophobicContact CG-CG2 4.49Å; P108-V110 PolarHBondContact O-N 2.97Å
109	N	26.1	Very low	27.9	Very low	151 Å²	151	161.4 Å²	161.4	81%	0.807	81%	0.807	S	S	*	*			trans	-76.2	80.3	173.4	-170.6	25.8	0	0	0	109.2	N111	N109-N111 PolarHBondContact O-N 3.21Å
110	V	29.2	Very low	28.1	Very low	107 Å²	107	162.5 Å²	162.5	65%	0.648	81%	0.806	S	S	*	*			trans	-80.4	88	-177.1	-173.9	0	0	0	0	109.9	P108	P108-V110 HydrophobicContact CB-CG2 3.93Å; P108-V110 HydrophobicContact CG-CG2 4.49Å; P108-V110 PolarHBondContact O-N 2.97Å
111	N	25.7	Very low	27.9	Very low	121 Å²	121	159.7 Å²	159.7	65%	0.647	80%	0.8	S	S	*	*			trans	-57.2	152	149.9	-78.2	-18.7	0	0	0	109.8	N109 Q113	N109-N111 PolarHBondContact O-N 3.21Å; N111-Q113 PolarHBondContact O-N 2.89Å; N111-Q113 VanDerWaalsContact O-N 3.14Å
112	S	26.1	Very low	28	Very low	118 Å²	118	153.7 Å²	153.7	83%	0.825	79%	0.792	S	S	*	*			trans	-8	98.2	163.9	53.4	0	0	0	0	117.4
113	Q	27	Very low	27.8	Very low	169 Å²	169	155.9 Å²	155.9	79%	0.79	79%	0.792	S	S	*	*			trans	-132.1	119.2	150.9	-67.1	-173	-26.8	0	0	106.5	N111	N111-Q113 PolarHBondContact O-N 2.89Å; N111-Q113 VanDerWaalsContact O-N 3.14Å
114	A	27.1	Very low	27.6	Very low	83 Å²	83	151.5 Å²	151.5	69%	0.686	79%	0.789	S	S	*	*				72.5	81.9	51.9	0	0	0	0	0	112.2	T116	A114-T116 PolarHBondContact O-N 2.82Å
115	N	28.3	Very low	27.7	Very low	176 Å²	176	148.4 Å²	148.4	94%	0.941	79%	0.79	S	S	*	*			trans	-82.2	106.3	157.8	-96.1	-2.8	0	0	0	107.9
116	T	27.1	Very low	27.6	Very low	124 Å²	124	142.6 Å²	142.6	76%	0.761	78%	0.784	S	S	*	*			trans	-78.8	135.8	-175.8	51.8	0	0	0	0	112.8	A114	A114-T116 PolarHBondContact O-N 2.82Å
117	S	26.5	Very low	27.7	Very low	118 Å²	118	141 Å²	141	83%	0.825	79%	0.786	S	S	*	*			trans	-147.7	62.9	164.7	-78	0	0	0	0	112.8
118	K	25.9	Very low	27.6	Very low	195 Å²	195	143.3 Å²	143.3	85%	0.848	79%	0.791	S	S	*	*			trans	51.6	78.9	164.2	-63	-173.9	175.3	-173.3	0	117.2
119	D	27.1	Very low	27.7	Very low	170 Å²	170	142.1 Å²	142.1	91%	0.909	80%	0.795	S	S	*	*			trans	-79.1	130.5	147.6	-62.3	-60.8	0	0	0	108.9
120	I	31.4	Very low	27.8	Very low	154 Å²	154	142.2 Å²	142.2	79%	0.79	79%	0.794	S	S	*	*			trans	-104.8	121.4	169.7	-70	174.7	0	0	0	107.3
121	L	27.4	Very low	27.9	Very low	140 Å²	140	144.2 Å²	144.2	73%	0.733	80%	0.799	S	S	*	*			trans	-69.9	142.3	173.4	-139.9	75	0	0	0	109.7	Q123	L121-Q123 HydrophobicContact CD2-CG 4Å
122	P	30.4	Very low	28.3	Very low	113 Å²	113	144.1 Å²	144.1	73%	0.734	81%	0.806	S	S	*	*				-120.9	135.3	93	-0.9	21.8	0	0	0	111.3
123	Q	28.1	Very low	28.4	Very low	166 Å²	166	144.1 Å²	144.1	78%	0.776	80%	0.801	S	S	*	*				63.6	113.7	80.9	-67.4	-166.1	-12.5	0	0	113	L121	L121-Q123 HydrophobicContact CD2-CG 4Å
124	T	25.7	Very low	28.7	Very low	133 Å²	133	143.9 Å²	143.9	82%	0.816	81%	0.805	S	S	*	*			trans	-64.7	141.8	170.8	48	0	0	0	0	111.5
125	N	29	Very low	28.8	Very low	169 Å²	169	147.8 Å²	147.8	90%	0.904	81%	0.809	S	S	*	*			trans	-141.5	149.8	141.5	-99	-17.6	0	0	0	109
126	S	27.1	Very low	29	Very low	104 Å²	104	146 Å²	146	73%	0.727	80%	0.799	S	S	*	*			trans	-102.1	138.3	-179.1	52.3	0	0	0	0	110.7
127	E	29.9	Very low	29.4	Very low	200 Å²	200	145.4 Å²	145.4	94%	0.935	80%	0.798	S	S	*	*			trans	-154.1	160.7	155.4	-126.9	156.2	-157	0	0	112.2
128	F	27.1	Very low	29.5	Very low	206 Å²	206	146.7 Å²	146.7	90%	0.904	80%	0.8	S	S	*	*			trans	-105.5	153.3	-170.9	-84.4	-115.3	0	0	0	111.8
129	G	30.1	Very low	29.6	Very low	67 Å²	67	145.8 Å²	145.8	69%	0.691	80%	0.799	S	S	*	*			trans	163.1	88.6	174.3	0	0	0	0	0	110.3
130	I	28.9	Very low	29.7	Very low	153 Å²	153	146 Å²	146	79%	0.785	80%	0.795	S	S	*	*				66.1	87.3	77.2	-54.4	174.9	0	0	0	112.6
131	I	31	Very low	29.4	Very low	149 Å²	149	145.6 Å²	145.6	76%	0.764	80%	0.799	S	S	*	*				33.8	122.2	118.7	-62.5	175.7	0	0	0	115.1
132	P	33.1	Very low	29.5	Very low	120 Å²	120	146.7 Å²	146.7	78%	0.779	80%	0.8	S	S	*	*				-141.9	169	67.8	34.4	-14.3	0	0	0	119.7
133	T	29.3	Very low	29.4	Very low	118 Å²	118	146.7 Å²	146.7	72%	0.724	80%	0.803	S	S	*	*			trans	-50.6	150.4	173	48.5	0	0	0	0	116.6
134	N	32.6	Very low	29.5	Very low	164 Å²	164	146.9 Å²	146.9	88%	0.877	81%	0.808	S	S	*	*				-157.7	163.7	122.1	-114.5	-14.7	0	0	0	113
135	E	28	Very low	29.7	Very low	164 Å²	164	145.8 Å²	145.8	77%	0.766	81%	0.806	S	S	*	*			trans	-97.5	140.4	-168.3	-56	-179.1	150.4	0	0	114.1
136	N	33.4	Very low	29.6	Very low	139 Å²	139	144 Å²	144	74%	0.743	81%	0.806	S	S	*	*				152.2	149.7	119.6	-87.9	-72	0	0	0	113.4
137	P	34.8	Very low	29.6	Very low	112 Å²	112	143.2 Å²	143.2	73%	0.727	80%	0.8	S	S	*	*			trans	-101.1	129.1	178.4	36.2	-29.5	0	0	0	113.4
138	V	29.6	Very low	29.5	Very low	144 Å²	144	140.3 Å²	140.3	87%	0.873	79%	0.791	S	S	*	*			trans	-144.4	152.7	156.5	165.2	0	0	0	0	109.1
139	E	27.9	Very low	29.7	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	79%	0.787	S	S	*	*			trans	-63.5	142.8	178	-52.5	172.3	113.1	0	0	113.2
140	Q	28.3	Very low	29.9	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.813	79%	0.785	S	S	*	*			trans	-157.3	120.5	141	-117.6	165.1	54.1	0	0	112.6
141	V	27.1	Very low	29.9	Very low	145 Å²	145	141.4 Å²	141.4	88%	0.879	79%	0.786	S	S	*	*			trans	-93.2	107.7	168.4	175.8	0	0	0	0	108.3
142	Q	29.3	Very low	30	Very low	163 Å²	163	138.1 Å²	138.1	76%	0.762	79%	0.789	S	S	*	*			trans	-135.2	119.8	161	-83.4	-171.9	10.8	0	0	111.2
143	S	28.4	Very low	29.7	Very low	114 Å²	114	139.8 Å²	139.8	80%	0.797	79%	0.791	S	S	*	*			trans	-87.8	121	173.1	54.4	0	0	0	0	110.3
144	L	30	Very low	29.7	Very low	169 Å²	169	143 Å²	143	89%	0.885	79%	0.794	S	S	*	*			trans	-119.5	124.2	166.3	-87	168.3	0	0	0	111
145	S	29	Very low	29.5	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	80%	0.796	S	S	*	*			trans	-102.3	132.7	-178.3	57	0	0	0	0	111.6
146	C	26.2	Very low	29.5	Very low	133 Å²	133	147.3 Å²	147.3	90%	0.899	80%	0.797	S	S	*	*			trans	-166.1	155.8	158.2	-103.8	0	0	0	0	110.3
147	S	28	Very low	29.3	Very low	87 Å²	87	152.3 Å²	152.3	61%	0.608	81%	0.807	S	S	*	*			cis	-173.5	122.4	-31.9	-177.5	0	0	0	0	109.3
148	N	28.3	Very low	29	Very low	138 Å²	138	152.1 Å²	152.1	74%	0.738	80%	0.803	S	S	*	*			trans	62.3	164.4	163.2	-71.6	-63.2	0	0	0	116.5
149	R	30.7	Very low	29.1	Very low	217 Å²	217	157.3 Å²	157.3	82%	0.819	81%	0.808	S	S	*	*			cis	-165.9	-175.4	-5.5	-115.1	173.8	-171.6	-158.1	4.3	106.7
150	P	35.2	Very low	29.3	Very low	100 Å²	100	160.5 Å²	160.5	65%	0.649	81%	0.812	S	S	*	*			cis	-131.4	161.8	-36.5	38.7	-23.1	0	0	0	114.7
151	T	28.5	Very low	29.6	Very low	132 Å²	132	159.4 Å²	159.4	81%	0.81	81%	0.812	S	S	*	*			trans	20.5	128.4	148.2	60.4	0	0	0	0	123.3
152	G	31.8	Very low	30.1	Very low	80 Å²	80	158.7 Å²	158.7	83%	0.825	81%	0.81	S	S	*	*			trans	-145.2	128.8	151.4	0	0	0	0	0	111.6
153	L	28.3	Very low	30.3	Very low	156 Å²	156	156.7 Å²	156.7	82%	0.817	81%	0.814	S	S	*	*			trans	-102.3	143.2	-171.1	-59.8	97.4	0	0	0	113.9
154	K	28.5	Very low	30.7	Very low	184 Å²	184	156.9 Å²	156.9	80%	0.8	82%	0.815	S	S	*	*				-179.2	115.1	110.5	-97.4	161	-176	172.9	0	115.9
155	R	27.6	Very low	30.8	Very low	241 Å²	241	159 Å²	159	91%	0.909	81%	0.811	S	S	*	*			trans	62.9	151.8	139.6	-67	-177.6	172.3	154.6	0.2	121
156	K	28	Very low	31.2	Very low	179 Å²	179	162.5 Å²	162.5	78%	0.778	81%	0.813	S	S	*	*			trans	-117.6	165.3	-175.4	-57.9	172.7	178.2	176	0	110	T158	K156-T158 HydrophobicContact CB-CG2 4.15Å; K156-T158 HydrophobicContact CD-CG2 4Å
157	Y	30.2	Very low	31.6	Very low	243 Å²	243	160.6 Å²	160.6	95%	0.953	80%	0.801	S	S	*	*			trans	-114.7	144.6	140.2	-105.2	-88.1	0	0	0	109.1
158	T	28	Very low	31.7	Very low	108 Å²	108	168 Å²	168	66%	0.663	82%	0.818	S	S	*	*			trans	-129.8	154.7	-173.6	50.2	0	0	0	0	111.7	K156	K156-T158 HydrophobicContact CB-CG2 4.15Å; K156-T158 HydrophobicContact CD-CG2 4Å
159	R	32.3	Very low	32.2	Very low	254 Å²	254	167.9 Å²	167.9	96%	0.958	82%	0.822	S	S	*	*			trans	-118.6	155.8	154.4	-98.3	-172	171.3	-158.5	-2.4	109.6
160	R	32.3	Very low	32.5	Very low	244 Å²	244	169.1 Å²	169.1	92%	0.921	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-87.9	143.7	-160.9	-61.1	171.8	175.6	163.8	-4.7	112.4
161	N	33.4	Very low	32.5	Very low	151 Å²	151	173.3 Å²	173.3	81%	0.807	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-90.3	150	146.3	-89.7	0.5	0	0	0	109
162	P	38.3	Very low	33.1	Very low	130 Å²	130	172.7 Å²	172.7	84%	0.844	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-76.4	158	169.2	33	-34	0	0	0	111.7
163	S	32.6	Very low	33.3	Very low	120 Å²	120	176.5 Å²	176.5	84%	0.839	83%	0.834	S	S	*	*			trans	-111.8	134.5	-168.1	-53	0	0	0	0	114.1
164	S	37.4	Very low	33.9	Very low	118 Å²	118	173.9 Å²	173.9	83%	0.825	84%	0.836	S	S	*	*			trans	-168.4	147.6	150.9	55.8	0	0	0	0	109.6
165	R	32.8	Very low	34.2	Very low	213 Å²	213	177.2 Å²	177.2	80%	0.804	84%	0.843	S	S	*	*			cis	-171.1	170.2	-23.8	-177.6	174.7	-83.1	-169.9	-2.7	103.6
166	F	36.4	Very low	34.8	Very low	185 Å²	185	170.6 Å²	170.6	81%	0.811	83%	0.834	S	S	*	*			trans	73.1	142.7	178.2	-52.8	-80.3	0	0	0	115.5
167	S	36	Very low	35.2	Very low	93 Å²	93	167.1 Å²	167.1	65%	0.65	84%	0.839	S	S	*	*			cis	-174.4	122.5	-41.7	36.9	0	0	0	0	107
168	Y	28.9	Very low	35.9	Very low	242 Å²	242	164 Å²	164	95%	0.949	83%	0.833	S	S	*	*			trans	-77.2	127.5	174.5	-75.3	-91.8	0	0	0	110.8
169	T	38.5	Very low	36.6	Very low	135 Å²	135	162.3 Å²	162.3	83%	0.828	83%	0.825	S	S	*	*			trans	-108.4	156.7	161.3	48.2	0	0	0	0	110
170	R	36.9	Very low	37.2	Very low	243 Å²	243	156.8 Å²	156.8	92%	0.917	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-81.6	150.9	-166.4	-68.5	176.7	174.3	169	-3.4	112.8
171	K	36	Very low	37.8	Very low	188 Å²	188	154.7 Å²	154.7	82%	0.817	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-64.6	142.3	161.3	-64.8	-176.3	177.1	-173.5	0	110.7
172	P	40.4	Very low	38.6	Very low	120 Å²	120	150.1 Å²	150.1	78%	0.779	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-88.5	150.8	141	33.9	-28.2	0	0	0	110.6
173	N	36.4	Very low	39.2	Very low	159 Å²	159	148.6 Å²	148.6	85%	0.85	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-92.9	124.3	166.5	-80.6	-15.8	0	0	0	109.1
174	A	40.3	Very low	40.2	Very low	102 Å²	102	145.9 Å²	145.9	84%	0.843	76%	0.757	S	S	*	*			trans	-149.5	149.6	164.1	0	0	0	0	0	110.5
175	R	35.6	Very low	41.3	Very low	253 Å²	253	145.1 Å²	145.1	96%	0.955	74%	0.743	S	S	*	*			trans	-79	129.6	-171.4	-58.8	160.3	174.9	160.6	-5.5	111.8
176	S	40.1	Very low	42.6	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	73%	0.728	S	S	*	*			trans	-159.9	139.9	145.8	60.2	0	0	0	0	111.1	Q178	S176-Q178 PolarHBondContact O-N 3.43Å
177	A	37.6	Very low	44.3	Very low	107 Å²	107	135.1 Å²	135.1	88%	0.884	72%	0.717	S	S	*	*			trans	-98.3	60.3	-175.8	0	0	0	0	0	111.7
178	Q	43.7	Very low	46.3	Very low	178 Å²	178	137 Å²	137	83%	0.832	71%	0.713	S	S	*	*			trans	-142.2	77.5	-175.6	-79	176.2	-28.6	0	0	111.7	S176	S176-Q178 PolarHBondContact O-N 3.43Å
179	S	42.1	Very low	48.7	Very low	71 Å²	71	129.1 Å²	129.1	50%	0.497	69%	0.688	S	S	.	*			trans	-144.8	-10.7	179.2	61.3	0	0	0	0	117.2	Y181 A182	S179-Y181 PolarHBondContact O-N 3.11Å; S179-Y181 VanDerWaalsContact O-N 3.13Å; S179-A182 WeakPolarHBondContact O-CB 3.48Å; S179-A182 PolarHBondContact O-N 3.03Å
180	N	46.5	Very low	50.8	Low	138 Å²	138	125.8 Å²	125.8	74%	0.738	67%	0.665	S	S	*	*	H	α-helix	trans	-60.3	-27.3	-179	-74.5	-3.1	0	0	0	113.7
181	Y	45	Very low	53	Low	200 Å²	200	119.4 Å²	119.4	78%	0.784	65%	0.648	S	S	*	*	H	α-helix	trans	-73.9	-22	173.5	-103.9	-85.7	0	0	0	114.5	S179 S184 I185	S179-Y181 PolarHBondContact O-N 3.11Å; S179-Y181 VanDerWaalsContact O-N 3.13Å; Y181-S184 PolarHBondContact O-OG 3.23Å; Y181-S184 VanDerWaalsContact O-OG 3.13Å; Y181-I185 WeakPolarHBondContact O-CD1 3.44Å; Y181-I185 WeakPolarHBondContact O-CG1 3.4Å
182	A	50.2	Low	55.4	Low	56 Å²	56	113.2 Å²	113.2	46%	0.463	63%	0.626	S	S	.	*	H	α-helix	trans	-76.7	-37.5	179.3	0	0	0	0	0	111.5	S179 V186	S179-A182 WeakPolarHBondContact O-CB 3.48Å; S179-A182 PolarHBondContact O-N 3.03Å; A182-V186 WeakPolarHBondContact O-CG2 3.32Å; A182-V186 PolarHBondContact O-N 2.75Å
183	N	50.4	Low	57.6	Low	98 Å²	98	113.6 Å²	113.6	52%	0.524	62%	0.615	S	S	.	*	H	α-helix	trans	-66.7	-44.2	179.6	-67.3	-20.2	0	0	0	111.7	I185 V186 D187	N183-I185 VanDerWaalsContact C-N 3.31Å; N183-I185 PolarHBondContact O-N 2.96Å; N183-V186 PolarHBondContact O-N 3.5Å; N183-V186 VanDerWaalsContact O-N 3.08Å; N183-D187 PolarHBondContact O-N 2.88Å
184	S	52.8	Low	60	Low	63 Å²	63	112.5 Å²	112.5	44%	0.441	60%	0.603	S	S	.	*	H	α-helix	trans	-61.5	-36.3	179.8	58.8	0	0	0	0	113	Y181 D187 F188	Y181-S184 PolarHBondContact O-OG 3.23Å; Y181-S184 VanDerWaalsContact O-OG 3.13Å; S184-D187 PolarHBondContact O-N 2.63Å; S184-F188 WeakPolarHBondContact O-CB 3.29Å; S184-F188 PolarHBondContact O-N 3.45Å
185	I	60.5	Low	62.3	Low	101 Å²	101	111.2 Å²	111.2	52%	0.518	58%	0.58	S	S	.	*	H	α-helix	trans	-65.8	-40.2	174.5	-65.9	169.6	0	0	0	111.1	Y181 N183 N189	Y181-I185 WeakPolarHBondContact O-CD1 3.44Å; Y181-I185 WeakPolarHBondContact O-CG1 3.4Å; N183-I185 VanDerWaalsContact C-N 3.31Å; N183-I185 PolarHBondContact O-N 2.96Å; I185-N189 WeakPolarHBondContact O-CB 3.28Å; I185-N189 PolarHBondContact O-N 3.41Å; I185-N189 VanDerWaalsContact O-N 3.13Å; I185-N189 PolarHBondContact O-ND2 3.03Å
186	V	60.7	Low	65	Low	83 Å²	83	103.5 Å²	103.5	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-65.9	-43.8	176.1	172.9	0	0	0	0	110.9	A182 N183 N189 N190	A182-V186 WeakPolarHBondContact O-CG2 3.32Å; A182-V186 PolarHBondContact O-N 2.75Å; N183-V186 PolarHBondContact O-N 3.5Å; N183-V186 VanDerWaalsContact O-N 3.08Å; V186-N189 PolarHBondContact O-N 2.85Å; V186-N190 VanDerWaalsContact O-CG 3.26Å; V186-N190 PolarHBondContact O-N 2.93Å; V186-N190 PolarHBondContact O-ND2 3.03Å; V186-N190 VanDerWaalsContact O-ND2 3.17Å
187	D	71.6	Confident	67.5	Low	105 Å²	105	100.4 Å²	100.4	56%	0.561	54%	0.535	S	S	*	.	H	α-helix	trans	-69.4	-38.7	179.6	-76.3	-36	0	0	0	113.2	N183 S184 N189 N190 L191	N183-D187 PolarHBondContact O-N 2.88Å; S184-D187 PolarHBondContact O-N 2.63Å; D187-N189 PolarHBondContact O-N 2.97Å; D187-N190 CarbonylContact O-C 3.58Å; D187-N190 WeakPolarHBondContact O-CB 3.42Å; D187-N190 PolarHBondContact O-N 2.69Å; D187-N190 VanDerWaalsContact O-N 3.13Å; D187-L191 PolarHBondContact O-N 3.26Å
188	F	78.3	Confident	70.2	Confident	133 Å²	133	95.5 Å²	95.5	58%	0.583	49%	0.494	S	S	*	.	H	α-helix	trans	-59.8	-45.9	172	-176	-95.7	0	0	0	111.6	S184 N190 L191 V192	S184-F188 WeakPolarHBondContact O-CB 3.29Å; S184-F188 PolarHBondContact O-N 3.45Å; F188-N190 VanDerWaalsContact C-N 3.26Å; F188-N190 PolarHBondContact O-N 3.45Å; F188-L191 WeakPolarHBondContact O-CB 3.14Å; F188-L191 PolarHBondContact O-N 3.4Å; F188-L191 VanDerWaalsContact O-N 3.13Å; F188-V192 HydrophobicContact CD1-CG2 4.13Å; F188-V192 HydrophobicContact CE1-CG2 3.72Å; F188-V192 HydrophobicContact CZ-CG2 3.98Å; F188-V192 WeakPolarHBondContact O-CG2 3.45Å; F188-V192 PolarHBondContact O-N 2.74Å
189	N	80	Confident	72.6	Confident	77 Å²	77	91.5 Å²	91.5	41%	0.412	48%	0.477	S	S	.	.	H	α-helix	trans	-61.2	-33.5	174.7	-86	-80	0	0	0	112.8	I185 V186 D187 K193	I185-N189 WeakPolarHBondContact O-CB 3.28Å; I185-N189 PolarHBondContact O-N 3.41Å; I185-N189 VanDerWaalsContact O-N 3.13Å; I185-N189 PolarHBondContact O-ND2 3.03Å; V186-N189 PolarHBondContact O-N 2.85Å; D187-N189 PolarHBondContact O-N 2.97Å; N189-K193 WeakPolarHBondContact O-CD 3.5Å; N189-K193 VanDerWaalsContact O-CG 3.22Å; N189-K193 WeakPolarHBondContact O-CG 3.45Å; N189-K193 PolarHBondContact O-N 2.78Å
190	N	81.7	Confident	75.1	Confident	65 Å²	65	93.8 Å²	93.8	35%	0.348	48%	0.475	S	S	.	.	H	α-helix	trans	-73.2	-34.9	174.6	-70.8	-32.6	0	0	0	112.3	V186 D187 F188 K194	V186-N190 VanDerWaalsContact O-CG 3.26Å; V186-N190 PolarHBondContact O-N 2.93Å; V186-N190 PolarHBondContact O-ND2 3.03Å; V186-N190 VanDerWaalsContact O-ND2 3.17Å; D187-N190 CarbonylContact O-C 3.58Å; D187-N190 WeakPolarHBondContact O-CB 3.42Å; D187-N190 PolarHBondContact O-N 2.69Å; D187-N190 VanDerWaalsContact O-N 3.13Å; F188-N190 VanDerWaalsContact C-N 3.26Å; F188-N190 PolarHBondContact O-N 3.45Å; N190-K194 WeakPolarHBondContact O-CG 3.49Å; N190-K194 PolarHBondContact O-N 2.72Å; N190-K194 VanDerWaalsContact O-N 3.08Å
191	L	82.1	Confident	77.3	Confident	109 Å²	109	88.5 Å²	88.5	57%	0.571	45%	0.451	S	S	*	.	H	α-helix	trans	-66.3	-48.1	175.2	-174.9	63.7	0	0	0	111.5	D187 F188 K193 K194 Q195	D187-L191 PolarHBondContact O-N 3.26Å; F188-L191 WeakPolarHBondContact O-CB 3.14Å; F188-L191 PolarHBondContact O-N 3.4Å; F188-L191 VanDerWaalsContact O-N 3.13Å; L191-K193 VanDerWaalsContact C-N 3.32Å; L191-K193 PolarHBondContact O-N 3.21Å; L191-K194 WeakPolarHBondContact O-CB 3.46Å; L191-K194 PolarHBondContact O-N 3.22Å; L191-K194 VanDerWaalsContact O-N 3.14Å; L191-Q195 PolarHBondContact O-N 3.32Å
192	V	86.7	Confident	79.7	Confident	58 Å²	58	79.5 Å²	79.5	35%	0.352	42%	0.416	S	S	.	.	H	α-helix	trans	-57.1	-45.3	175.8	174	0	0	0	0	111	F188 K194 Q195 E196	F188-V192 HydrophobicContact CD1-CG2 4.13Å; F188-V192 HydrophobicContact CE1-CG2 3.72Å; F188-V192 HydrophobicContact CZ-CG2 3.98Å; F188-V192 WeakPolarHBondContact O-CG2 3.45Å; F188-V192 PolarHBondContact O-N 2.74Å; V192-K194 PolarHBondContact O-N 3.5Å; V192-Q195 PolarHBondContact O-N 2.98Å; V192-E196 WeakPolarHBondContact O-CB 3.28Å; V192-E196 PolarHBondContact O-N 2.85Å
193	K	86.5	Confident	81.8	Confident	127 Å²	127	78.1 Å²	78.1	55%	0.552	40%	0.404	S	S	*	.	H	α-helix	trans	-62.5	-37.6	176.7	-72.6	167.5	-170.6	169.2	0	113.2	N189 L191 A197	N189-K193 WeakPolarHBondContact O-CD 3.5Å; N189-K193 VanDerWaalsContact O-CG 3.22Å; N189-K193 WeakPolarHBondContact O-CG 3.45Å; N189-K193 PolarHBondContact O-N 2.78Å; L191-K193 VanDerWaalsContact C-N 3.32Å; L191-K193 PolarHBondContact O-N 3.21Å; K193-A197 WeakPolarHBondContact O-CB 3.3Å; K193-A197 PolarHBondContact O-N 3.25Å
194	K	87.3	Confident	83.9	Confident	137 Å²	137	78.5 Å²	78.5	60%	0.596	41%	0.405	S	S	*	.	H	α-helix	trans	-65.5	-44.6	174.2	-74.9	169.9	-178.6	175.4	0	111.3	N190 L191 V192 A197 F198	N190-K194 WeakPolarHBondContact O-CG 3.49Å; N190-K194 PolarHBondContact O-N 2.72Å; N190-K194 VanDerWaalsContact O-N 3.08Å; L191-K194 WeakPolarHBondContact O-CB 3.46Å; L191-K194 PolarHBondContact O-N 3.22Å; L191-K194 VanDerWaalsContact O-N 3.14Å; V192-K194 PolarHBondContact O-N 3.5Å; K194-A197 WeakPolarHBondContact O-CB 3.39Å; K194-A197 PolarHBondContact O-N 2.9Å; K194-F198 PolarHBondContact O-N 2.86Å
195	Q	89.6	Confident	85.9	Confident	75 Å²	75	76 Å²	76	35%	0.35	39%	0.387	S	S	.	.	H	α-helix	trans	-66.6	-41.6	179.3	-174.6	63.3	-4.5	0	0	112	L191 V192 A197 F198 I199	L191-Q195 PolarHBondContact O-N 3.32Å; V192-Q195 PolarHBondContact O-N 2.98Å; Q195-A197 VanDerWaalsContact C-N 3.33Å; Q195-A197 PolarHBondContact O-N 2.81Å; Q195-F198 PolarHBondContact O-N 2.85Å; Q195-I199 HydrophobicContact CG-CD1 4.02Å; Q195-I199 WeakPolarHBondContact O-CG1 3.43Å; Q195-I199 PolarHBondContact O-N 2.97Å
196	E	92	Very high	87.6	Confident	90 Å²	90	72.4 Å²	72.4	42%	0.421	37%	0.37	S	S	.	.	H	α-helix	trans	-57.5	-43.3	169.8	-92.9	-162.3	-142.2	0	0	112.6	V192 I199 R200	V192-E196 WeakPolarHBondContact O-CB 3.28Å; V192-E196 PolarHBondContact O-N 2.85Å; E196-I199 PolarHBondContact O-N 2.84Å; E196-R200 WeakPolarHBondContact O-CB 3.44Å; E196-R200 PolarHBondContact O-N 2.81Å; E196-R200 IonicContact OE2-CZ 3.02Å; E196-R200 IonicContact OE2-NH1 3.48Å; E196-R200 PolarHBondContact OE2-NH1 2.86Å; E196-R200 IonicContact OE2-NH2 2.8Å; E196-R200 PolarHBondContact OE2-NH2 2.94Å
197	A	92	Very high	89.2	Confident	38 Å²	38	74.2 Å²	74.2	31%	0.314	37%	0.373	S	S	.	.	H	α-helix	trans	-64.8	-42.3	179.3	0	0	0	0	0	111.7	K193 K194 Q195 A201 F732	K193-A197 WeakPolarHBondContact O-CB 3.3Å; K193-A197 PolarHBondContact O-N 3.25Å; K194-A197 WeakPolarHBondContact O-CB 3.39Å; K194-A197 PolarHBondContact O-N 2.9Å; Q195-A197 VanDerWaalsContact C-N 3.33Å; Q195-A197 PolarHBondContact O-N 2.81Å; A197-A201 VanDerWaalsContact O-CB 3.25Å; A197-A201 WeakPolarHBondContact O-CB 3.4Å; A197-A201 PolarHBondContact O-N 3.37Å; A197-F732 HydrophobicContact CB-CE1 4Å; A197-F732 HydrophobicContact CB-CZ 4.18Å
198	F	94.3	Very high	90.3	Very high	4 Å²	4	72.1 Å²	72.1	2%	0.018	36%	0.361	C	S	.	.	H	α-helix	trans	-57.2	-56.5	172.2	161.4	-117.1	0	0	0	111.5	K194 Q195 R200 A201 F202 F730 F732 Q737 Q738	K194-F198 PolarHBondContact O-N 2.86Å; Q195-F198 PolarHBondContact O-N 2.85Å; F198-R200 PolarHBondContact O-N 3.45Å; F198-A201 PolarHBondContact O-N 2.89Å; F198-F202 AromaticContact CD2-CD2 3.47Å; F198-F202 HydrophobicContact CD2-CD2 3.47Å; F198-F202 VanDerWaalsContact CD2-CD2 3.47Å; F198-F202 AromaticContact CD2-CE2 3.74Å; F198-F202 HydrophobicContact CD2-CE2 3.74Å; F198-F202 HydrophobicContact CD2-CG 4.34Å; F198-F202 AromaticContact CE2-CD2 3.45Å; F198-F202 HydrophobicContact CE2-CD2 3.45Å; F198-F202 VanDerWaalsContact CE2-CD2 3.45Å; F198-F202 AromaticContact CE2-CE2 3.69Å; F198-F202 HydrophobicContact CE2-CE2 3.69Å; F198-F202 AromaticContact CE2-CG 3.95Å; F198-F202 HydrophobicContact CE2-CG 3.95Å; F198-F202 HydrophobicContact CE2-CZ 4.38Å; F198-F202 PolarHBondContact O-N 3.38Å; F198-F730 HydrophobicContact CE2-CB 4Å; F198-F730 HydrophobicContact CZ-CB 4.05Å; F198-F732 HydrophobicContact CB-CB 4.44Å; F198-F732 HydrophobicContact CB-CD1 3.72Å; F198-F732 HydrophobicContact CB-CE1 4.13Å; F198-F732 HydrophobicContact CB-CG 4.13Å; F198-F732 HydrophobicContact CD2-CB 3.8Å; F198-F732 HydrophobicContact CD2-CG 4.16Å; F198-Q737 HydrophobicContact CB-CG 4.38Å; F198-Q737 HydrophobicContact CD1-CB 3.93Å; F198-Q737 HydrophobicContact CD1-CG 4.44Å; F198-Q737 HydrophobicContact CD2-CB 4.03Å; F198-Q737 HydrophobicContact CD2-CG 3.99Å; F198-Q737 HydrophobicContact CE1-CB 3.98Å; F198-Q737 HydrophobicContact CE2-CB 4.08Å; F198-Q737 HydrophobicContact CE2-CG 4.43Å; F198-Q737 HydrophobicContact CG-CB 3.97Å; F198-Q737 HydrophobicContact CG-CG 4Å; F198-Q737 HydrophobicContact CZ-CB 4.06Å; F198-Q738 HydrophobicContact CE1-CB 4.06Å; F198-Q738 HydrophobicContact CZ-CB 3.91Å
199	I	94.4	Very high	91.2	Very high	94 Å²	94	66.4 Å²	66.4	48%	0.482	34%	0.336	S	S	.	.	H	α-helix	trans	-58.3	-48.6	-178.9	-67.6	167.2	0	0	0	110.3	Q195 E196 A201 F202 A203	Q195-I199 HydrophobicContact CG-CD1 4.02Å; Q195-I199 WeakPolarHBondContact O-CG1 3.43Å; Q195-I199 PolarHBondContact O-N 2.97Å; E196-I199 PolarHBondContact O-N 2.84Å; I199-A201 VanDerWaalsContact C-N 3.32Å; I199-A201 PolarHBondContact O-N 2.93Å; I199-F202 PolarHBondContact O-N 3.37Å; I199-A203 WeakPolarHBondContact O-CB 3.43Å; I199-A203 PolarHBondContact O-N 2.84Å
200	R	93.7	Very high	91.9	Very high	118 Å²	118	69 Å²	69	45%	0.445	34%	0.34	S	S	.	.	H	α-helix	trans	-60.6	-39	-179.3	-174.2	179.3	-71.2	109.7	-3.7	112.2	E196 F198 I204	E196-R200 WeakPolarHBondContact O-CB 3.44Å; E196-R200 PolarHBondContact O-N 2.81Å; E196-R200 IonicContact OE2-CZ 3.02Å; E196-R200 IonicContact OE2-NH1 3.48Å; E196-R200 PolarHBondContact OE2-NH1 2.86Å; E196-R200 IonicContact OE2-NH2 2.8Å; E196-R200 PolarHBondContact OE2-NH2 2.94Å; F198-R200 PolarHBondContact O-N 3.45Å; R200-I204 WeakPolarHBondContact O-CG1 3.49Å
201	A	93.6	Very high	92.6	Very high	28 Å²	28	72.1 Å²	72.1	23%	0.231	35%	0.348	C	S	.	.	H	α-helix	trans	-74.1	-42	-179.6	0	0	0	0	0	113	A197 F198 I199 P205 F732 L795	A197-A201 VanDerWaalsContact O-CB 3.25Å; A197-A201 WeakPolarHBondContact O-CB 3.4Å; A197-A201 PolarHBondContact O-N 3.37Å; F198-A201 PolarHBondContact O-N 2.89Å; I199-A201 VanDerWaalsContact C-N 3.32Å; I199-A201 PolarHBondContact O-N 2.93Å; A201-P205 WeakPolarHBondContact O-CD 3.39Å; A201-F732 HydrophobicContact CB-CE2 3.79Å; A201-F732 HydrophobicContact CB-CZ 4.28Å; A201-L795 HydrophobicContact CB-CD1 3.62Å
202	F	95.5	Very high	93.2	Very high	11 Å²	11	69 Å²	69	5%	0.048	33%	0.332	C	S	.	.	H	α-helix	trans	-77.7	-25.8	177.7	-83.7	-96.6	0	0	0	113.7	F198 I199 I204 T206 F730 F732 F776 V793 L795	F198-F202 AromaticContact CD2-CD2 3.47Å; F198-F202 HydrophobicContact CD2-CD2 3.47Å; F198-F202 VanDerWaalsContact CD2-CD2 3.47Å; F198-F202 AromaticContact CD2-CE2 3.74Å; F198-F202 HydrophobicContact CD2-CE2 3.74Å; F198-F202 HydrophobicContact CD2-CG 4.34Å; F198-F202 AromaticContact CE2-CD2 3.45Å; F198-F202 HydrophobicContact CE2-CD2 3.45Å; F198-F202 VanDerWaalsContact CE2-CD2 3.45Å; F198-F202 AromaticContact CE2-CE2 3.69Å; F198-F202 HydrophobicContact CE2-CE2 3.69Å; F198-F202 AromaticContact CE2-CG 3.95Å; F198-F202 HydrophobicContact CE2-CG 3.95Å; F198-F202 HydrophobicContact CE2-CZ 4.38Å; F198-F202 PolarHBondContact O-N 3.38Å; I199-F202 PolarHBondContact O-N 3.37Å; F202-I204 PolarHBondContact O-N 2.85Å; F202-T206 VanDerWaalsContact O-CB 3.28Å; F202-T206 WeakPolarHBondContact O-CB 3.27Å; F202-T206 PolarHBondContact O-N 2.81Å; F202-T206 PolarHBondContact O-OG1 3.35Å; F202-F730 AromaticContact CD1-CD1 3.84Å; F202-F730 HydrophobicContact CD1-CD1 3.84Å; F202-F730 HydrophobicContact CD1-CE1 4.37Å; F202-F730 AromaticContact CE1-CD1 3.74Å; F202-F730 HydrophobicContact CE1-CD1 3.74Å; F202-F730 HydrophobicContact CE1-CE1 4.5Å; F202-F732 HydrophobicContact CE2-CB 4.15Å; F202-F732 HydrophobicContact CE2-CD2 4.05Å; F202-F732 HydrophobicContact CE2-CG 4.48Å; F202-F776 HydrophobicContact CD1-CD1 4.24Å; F202-F776 AromaticContact CD1-CE1 3.59Å; F202-F776 HydrophobicContact CD1-CE1 3.59Å; F202-F776 HydrophobicContact CD1-CZ 4.4Å; F202-F776 HydrophobicContact CE1-CD1 4.07Å; F202-F776 AromaticContact CE1-CE1 3.9Å; F202-F776 HydrophobicContact CE1-CE1 3.9Å; F202-V793 HydrophobicContact CE1-CG1 4.27Å; F202-L795 HydrophobicContact CD1-CD2 4.15Å; F202-L795 HydrophobicContact CD2-CD1 4.25Å; F202-L795 HydrophobicContact CD2-CD2 4.04Å; F202-L795 HydrophobicContact CD2-CG 4.15Å; F202-L795 HydrophobicContact CE1-CD2 4.08Å; F202-L795 HydrophobicContact CE1-CG 4.39Å; F202-L795 HydrophobicContact CE2-CD1 4.01Å; F202-L795 HydrophobicContact CE2-CD2 3.99Å; F202-L795 HydrophobicContact CE2-CG 3.68Å; F202-L795 HydrophobicContact CG-CD2 4.14Å; F202-L795 HydrophobicContact CZ-CD2 4.02Å; F202-L795 HydrophobicContact CZ-CG 3.83Å
203	A	95.1	Very high	93.6	Very high	26 Å²	26	67.2 Å²	67.2	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-38.9	176.5	0	0	0	0	0	112.6	I199 T206 H207	I199-A203 WeakPolarHBondContact O-CB 3.43Å; I199-A203 PolarHBondContact O-N 2.84Å; A203-T206 PolarHBondContact O-N 2.82Å; A203-H207 WeakPolarHBondContact O-CB 3.36Å; A203-H207 VanDerWaalsContact O-CG 3.26Å; A203-H207 PolarHBondContact O-N 3.01Å; A203-H207 PolarHBondContact O-ND1 3.21Å
204	I	92.9	Very high	93.9	Very high	107 Å²	107	67 Å²	67	55%	0.549	32%	0.322	S	S	.	.	H	α-helix	trans	-62.3	-51.8	-174.7	-68	165.2	0	0	0	112.3	R200 F202 L208	R200-I204 WeakPolarHBondContact O-CG1 3.49Å; F202-I204 PolarHBondContact O-N 2.85Å; I204-L208 PolarHBondContact O-N 2.88Å
205	P	95	Very high	94.2	Very high	10 Å²	10	66.4 Å²	66.4	7%	0.065	32%	0.316	C	S	.	.	H	α-helix	trans	-65.7	-37.6	172.4	-20.1	32.4	0	0	0	112.7	A201 H207 L208 Y209 R775 F776	A201-P205 WeakPolarHBondContact O-CD 3.39Å; P205-H207 PolarHBondContact O-N 3.34Å; P205-L208 WeakPolarHBondContact O-CB 3.25Å; P205-L208 PolarHBondContact O-N 3.25Å; P205-Y209 HydrophobicContact CB-CD2 4.28Å; P205-Y209 HydrophobicContact CB-CE2 3.95Å; P205-Y209 WeakPolarHBondContact O-CD2 3.4Å; P205-Y209 PolarHBondContact O-N 3.44Å; P205-R775 HydrophobicContact CB-CB 4.02Å; P205-R775 HydrophobicContact CG-CB 4.28Å; P205-F776 HydrophobicContact CB-CE1 3.97Å; P205-F776 HydrophobicContact CB-CE2 4.18Å; P205-F776 HydrophobicContact CB-CZ 3.64Å; P205-F776 HydrophobicContact CG-CE1 4.16Å; P205-F776 HydrophobicContact CG-CZ 4.3Å
206	T	96	Very high	94.4	Very high	26 Å²	26	65.3 Å²	65.3	16%	0.16	31%	0.311	C	S	.	.	H	α-helix	trans	-64	-43.5	-177.4	-60	0	0	0	0	112.2	F202 A203 L208 Y209 R210	F202-T206 VanDerWaalsContact O-CB 3.28Å; F202-T206 WeakPolarHBondContact O-CB 3.27Å; F202-T206 PolarHBondContact O-N 2.81Å; F202-T206 PolarHBondContact O-OG1 3.35Å; A203-T206 PolarHBondContact O-N 2.82Å; T206-L208 VanDerWaalsContact C-N 3.35Å; T206-Y209 PolarHBondContact O-N 3.41Å; T206-R210 WeakPolarHBondContact O-CG 3.36Å; T206-R210 PolarHBondContact O-N 3.46Å
207	H	95.4	Very high	94.3	Very high	121 Å²	121	71.3 Å²	71.3	56%	0.56	33%	0.33	S	S	*	.	H	α-helix	trans	-63.8	-39.6	173.3	-66.5	156.5	0	0	0	111.9	A203 P205 R210 Y211	A203-H207 WeakPolarHBondContact O-CB 3.36Å; A203-H207 VanDerWaalsContact O-CG 3.26Å; A203-H207 PolarHBondContact O-N 3.01Å; A203-H207 PolarHBondContact O-ND1 3.21Å; P205-H207 PolarHBondContact O-N 3.34Å; H207-R210 PolarHBondContact O-N 2.84Å; H207-Y211 WeakPolarHBondContact O-CB 3.43Å; H207-Y211 PolarHBondContact O-N 3.49Å
208	L	94.8	Very high	94.1	Very high	61 Å²	61	75.5 Å²	75.5	32%	0.319	35%	0.347	S	S	.	.	H	α-helix	trans	-61.3	-46.3	174.9	177.5	64.3	0	0	0	111.6	I204 P205 T206 Y211 L212 R775	I204-L208 PolarHBondContact O-N 2.88Å; P205-L208 WeakPolarHBondContact O-CB 3.25Å; P205-L208 PolarHBondContact O-N 3.25Å; T206-L208 VanDerWaalsContact C-N 3.35Å; L208-Y211 PolarHBondContact O-N 3.1Å; L208-L212 HydrophobicContact CD1-CD1 4.07Å; L208-L212 HydrophobicContact CD1-CG 4.16Å; L208-L212 HydrophobicContact CG-CD1 3.95Å; L208-L212 HydrophobicContact CG-CG 4.42Å; L208-L212 WeakPolarHBondContact O-CB 3.44Å; L208-L212 VanDerWaalsContact O-CG 3.25Å; L208-L212 WeakPolarHBondContact O-CG 3.32Å; L208-L212 PolarHBondContact O-N 2.69Å; L208-R775 VanDerWaalsContact CD2-NE 3.32Å
209	Y	96.7	Very high	93.9	Very high	13 Å²	13	84.6 Å²	84.6	5%	0.051	38%	0.381	C	S	.	.	H	α-helix	trans	-68.8	-37.2	-179.6	-66.5	-56.1	0	0	0	112.8	P205 T206 L212 S213 W749 C772 H773 R775 F776	P205-Y209 HydrophobicContact CB-CD2 4.28Å; P205-Y209 HydrophobicContact CB-CE2 3.95Å; P205-Y209 WeakPolarHBondContact O-CD2 3.4Å; P205-Y209 PolarHBondContact O-N 3.44Å; T206-Y209 PolarHBondContact O-N 3.41Å; Y209-L212 HydrophobicContact CD1-CD1 4.32Å; Y209-L212 PolarHBondContact O-N 3.07Å; Y209-S213 PolarHBondContact O-N 2.92Å; Y209-W749 CarbonylContact C-O 3.57Å; Y209-C772 WeakPolarHBondContact CE1-O 3.27Å; Y209-H773 AromaticContact CD1-ND1 3.52Å; Y209-H773 AromaticContact CD2-ND1 3.81Å; Y209-H773 HydrophobicContact CE1-CB 4.35Å; Y209-H773 AromaticContact CE1-ND1 3.88Å; Y209-H773 HydrophobicContact CE2-CB 4.1Å; Y209-H773 AromaticContact CG-ND1 3.5Å; Y209-H773 WeakPolarHBondContact OH-CA 3.21Å; Y209-H773 PolarHBondContact OH-O 2.93Å; Y209-R775 HydrophobicContact CE2-CB 4.16Å; Y209-R775 VanDerWaalsContact OH-CB 3.31Å; Y209-R775 WeakPolarHBondContact OH-CB 3.42Å; Y209-R775 WeakPolarHBondContact OH-CG 3.25Å; Y209-R775 PolarHBondContact OH-N 2.83Å; Y209-F776 HydrophobicContact CD2-CD2 4.47Å; Y209-F776 AromaticContact CD2-CE2 3.85Å; Y209-F776 HydrophobicContact CD2-CE2 3.85Å; Y209-F776 HydrophobicContact CE2-CD2 4.02Å; Y209-F776 AromaticContact CE2-CE2 3.76Å; Y209-F776 HydrophobicContact CE2-CE2 3.76Å
210	R	95.5	Very high	93.8	Very high	130 Å²	130	83.7 Å²	83.7	49%	0.491	38%	0.381	S	S	.	.	H	α-helix	trans	-64.5	-36	171.7	-73	179.3	177.2	176.9	-0.4	113	T206 H207 S213 H214	T206-R210 WeakPolarHBondContact O-CG 3.36Å; T206-R210 PolarHBondContact O-N 3.46Å; H207-R210 PolarHBondContact O-N 2.84Å; R210-S213 PolarHBondContact O-OG 3.37Å; R210-H214 PolarHBondContact O-ND1 2.93Å
211	Y	96	Very high	93.6	Very high	131 Å²	131	84.1 Å²	84.1	51%	0.514	39%	0.392	S	S	.	.	H	α-helix	trans	-67	-43.5	171	168.7	-99.2	0	0	0	111.7	H207 L208 S213 R215	H207-Y211 WeakPolarHBondContact O-CB 3.43Å; H207-Y211 PolarHBondContact O-N 3.49Å; L208-Y211 PolarHBondContact O-N 3.1Å; Y211-S213 PolarHBondContact O-N 3.18Å; Y211-R215 WeakPolarHBondContact O-CB 3.4Å; Y211-R215 PolarHBondContact O-N 2.88Å; Y211-R215 PolarHBondContact OH-NH1 2.87Å
212	L	95.1	Very high	93.5	Very high	45 Å²	45	87.5 Å²	87.5	24%	0.236	40%	0.399	C	S	.	.	H	α-helix	trans	-67.2	-32.8	-179.7	-71.6	174.8	0	0	0	112.7	L208 Y209 R215 H216	L208-L212 HydrophobicContact CD1-CD1 4.07Å; L208-L212 HydrophobicContact CD1-CG 4.16Å; L208-L212 HydrophobicContact CG-CD1 3.95Å; L208-L212 HydrophobicContact CG-CG 4.42Å; L208-L212 WeakPolarHBondContact O-CB 3.44Å; L208-L212 VanDerWaalsContact O-CG 3.25Å; L208-L212 WeakPolarHBondContact O-CG 3.32Å; L208-L212 PolarHBondContact O-N 2.69Å; Y209-L212 HydrophobicContact CD1-CD1 4.32Å; Y209-L212 PolarHBondContact O-N 3.07Å; L212-R215 PolarHBondContact O-N 3.06Å; L212-H216 VanDerWaalsContact O-CB 3.25Å; L212-H216 WeakPolarHBondContact O-CB 3.15Å; L212-H216 PolarHBondContact O-N 2.83Å; L212-H216 PolarHBondContact O-ND1 2.9Å
213	S	94.2	Very high	93.3	Very high	19 Å²	19	90.8 Å²	90.8	13%	0.133	42%	0.417	C	S	.	.	H	α-helix	trans	-65	-49.1	178	64.8	0	0	0	0	112.3	Y209 R210 Y211 H216 R217	Y209-S213 PolarHBondContact O-N 2.92Å; R210-S213 PolarHBondContact O-OG 3.37Å; Y211-S213 PolarHBondContact O-N 3.18Å; S213-H216 PolarHBondContact O-N 2.82Å; S213-R217 PolarHBondContact O-N 2.9Å
214	H	93.1	Very high	93	Very high	123 Å²	123	92.2 Å²	92.2	57%	0.569	42%	0.421	S	S	*	.	H	α-helix	trans	-57.2	-51.2	172.1	-68.9	80.8	0	0	0	110.6	R210 H216 R217 D218	R210-H214 PolarHBondContact O-ND1 2.93Å; H214-H216 VanDerWaalsContact C-N 3.3Å; H214-H216 PolarHBondContact O-N 3.33Å; H214-R217 WeakPolarHBondContact O-CB 3.15Å; H214-R217 PolarHBondContact O-N 2.87Å; H214-R217 VanDerWaalsContact O-N 3.16Å; H214-D218 PolarHBondContact O-N 2.85Å
215	R	93.6	Very high	92.7	Very high	124 Å²	124	95.9 Å²	95.9	47%	0.468	43%	0.428	S	S	.	.	H	α-helix	trans	-58.4	-37.5	179	-179.1	-179.3	174.4	126.6	-1.3	113.6	Y211 L212 R219	Y211-R215 WeakPolarHBondContact O-CB 3.4Å; Y211-R215 PolarHBondContact O-N 2.88Å; Y211-R215 PolarHBondContact OH-NH1 2.87Å; L212-R215 PolarHBondContact O-N 3.06Å; R215-R219 WeakPolarHBondContact O-CA 3.5Å; R215-R219 WeakPolarHBondContact O-CB 3.42Å; R215-R219 PolarHBondContact O-N 2.83Å
216	H	92.9	Very high	92.4	Very high	53 Å²	53	99.1 Å²	99.1	25%	0.245	45%	0.448	C	S	.	.	H	α-helix	trans	-82.3	-20.2	-179	-63.9	163.4	0	0	0	113.1	L212 S213 H214 D218 R219 P220 L221	L212-H216 VanDerWaalsContact O-CB 3.25Å; L212-H216 WeakPolarHBondContact O-CB 3.15Å; L212-H216 PolarHBondContact O-N 2.83Å; L212-H216 PolarHBondContact O-ND1 2.9Å; S213-H216 PolarHBondContact O-N 2.82Å; H214-H216 VanDerWaalsContact C-N 3.3Å; H214-H216 PolarHBondContact O-N 3.33Å; H216-D218 VanDerWaalsContact C-N 3.34Å; H216-R219 CarbonylContact O-C 3.49Å; H216-P220 VanDerWaalsContact O-CA 3.23Å; H216-P220 WeakPolarHBondContact O-CA 3.38Å; H216-P220 WeakPolarHBondContact O-CB 3.5Å; H216-P220 WeakPolarHBondContact O-CD 3.17Å; H216-P220 VanDerWaalsContact O-N 3.14Å; H216-L221 WeakPolarHBondContact NE2-CD1 3.42Å
217	R	89.8	Confident	92.1	Very high	215 Å²	215	99.5 Å²	99.5	81%	0.811	45%	0.449	S	S	*	.	H	α-helix	trans	-60.9	-44.7	167.3	-171.6	179.5	-177.5	168.1	0.5	111	S213 H214	S213-R217 PolarHBondContact O-N 2.9Å; H214-R217 WeakPolarHBondContact O-CB 3.15Å; H214-R217 PolarHBondContact O-N 2.87Å; H214-R217 VanDerWaalsContact O-N 3.16Å
218	D	88.9	Confident	91.7	Very high	126 Å²	126	98.5 Å²	98.5	67%	0.674	46%	0.455	S	S	*	.	H	α-helix	trans	-86	-31.6	-179.2	-51.2	-32.3	0	0	0	112.9	H214 H216	H214-D218 PolarHBondContact O-N 2.85Å; H216-D218 VanDerWaalsContact C-N 3.34Å
219	R	90.1	Very high	91.4	Very high	195 Å²	195	97.3 Å²	97.3	74%	0.736	45%	0.447	S	S	*	.	S	Bend	trans	-138.4	73	-174.4	-61.7	-175.2	-177.3	163	6.4	110.8	R215 H216	R215-R219 WeakPolarHBondContact O-CA 3.5Å; R215-R219 WeakPolarHBondContact O-CB 3.42Å; R215-R219 PolarHBondContact O-N 2.83Å; H216-R219 CarbonylContact O-C 3.49Å
220	P	91.8	Very high	91	Very high	75 Å²	75	97 Å²	97	49%	0.487	45%	0.446	S	S	.	.			trans	-62.9	139	-176.8	22.9	-33.4	0	0	0	112.8	H216 Y222 L223	H216-P220 VanDerWaalsContact O-CA 3.23Å; H216-P220 WeakPolarHBondContact O-CA 3.38Å; H216-P220 WeakPolarHBondContact O-CB 3.5Å; H216-P220 WeakPolarHBondContact O-CD 3.17Å; H216-P220 VanDerWaalsContact O-N 3.14Å; P220-Y222 WeakPolarHBondContact CB-O 3.47Å; P220-L223 HydrophobicContact CG-CD2 4.47Å
221	L	89.9	Confident	90.3	Very high	127 Å²	127	95.4 Å²	95.4	67%	0.665	45%	0.445	S	S	*	.	S	Bend	trans	-78.9	-31.6	173	-62	-179.5	0	0	0	112.4	H216	H216-L221 WeakPolarHBondContact NE2-CD1 3.42Å
222	Y	91.4	Very high	88.9	Confident	99 Å²	99	93.5 Å²	93.5	39%	0.388	45%	0.449	S	S	.	.	S	Bend	trans	-150.6	171.1	177	45.4	-104.7	0	0	0	108.1	P220 L227 C772	P220-Y222 WeakPolarHBondContact CB-O 3.47Å; Y222-L227 HydrophobicContact CD2-CD1 4.23Å; Y222-L227 HydrophobicContact CD2-CD2 4.2Å; Y222-L227 HydrophobicContact CD2-CG 4.48Å; Y222-L227 HydrophobicContact CE2-CD1 3.95Å; Y222-L227 HydrophobicContact CE2-CD2 4.49Å; Y222-C772 PolarHBondContact OH-SG 2.82Å
223	L	91	Very high	87.2	Confident	80 Å²	80	96.1 Å²	96.1	42%	0.419	46%	0.463	S	S	.	.			trans	-102.3	121.6	175.5	-56.1	-178.7	0	0	0	109.1	P220 R225 T226	P220-L223 HydrophobicContact CG-CD2 4.47Å; L223-R225 HydrophobicContact CB-CG 4.12Å; L223-R225 PolarHBondContact O-N 2.98Å; L223-R225 VanDerWaalsContact O-N 3.11Å; L223-T226 HydrophobicContact CB-CG2 4.17Å; L223-T226 WeakPolarHBondContact O-CA 3.32Å; L223-T226 WeakPolarHBondContact O-CB 3.36Å; L223-T226 PolarHBondContact O-N 2.76Å; L223-T226 PolarHBondContact O-OG1 3.07Å
224	D	89.2	Confident	85.5	Confident	57 Å²	57	101.4 Å²	101.4	31%	0.305	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-58	-34.4	-173.7	-46.6	-55.5	0	0	0	112.6	T226 L227 L230 L752	D224-T226 PolarHBondContact O-N 2.72Å; D224-L227 HydrophobicContact CB-CD1 4.48Å; D224-L227 WeakPolarHBondContact O-CB 3.4Å; D224-L227 WeakPolarHBondContact O-CG 3.33Å; D224-L227 PolarHBondContact O-N 2.86Å; D224-L230 HydrophobicContact CB-CD1 3.99Å; D224-L752 HydrophobicContact CB-CD1 4Å
225	R	86.3	Confident	83.6	Confident	183 Å²	183	100.6 Å²	100.6	69%	0.691	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-61	-3.4	172.1	68.2	169.6	-176.8	154.5	-0.2	115.4	L223	L223-R225 HydrophobicContact CB-CG 4.12Å; L223-R225 PolarHBondContact O-N 2.98Å; L223-R225 VanDerWaalsContact O-N 3.11Å
226	T	87.8	Confident	81.4	Confident	78 Å²	78	105.9 Å²	105.9	48%	0.479	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-110.8	-0.3	176.1	63.7	0	0	0	0	113	L223 D224 M231	L223-T226 HydrophobicContact CB-CG2 4.17Å; L223-T226 WeakPolarHBondContact O-CA 3.32Å; L223-T226 WeakPolarHBondContact O-CB 3.36Å; L223-T226 PolarHBondContact O-N 2.76Å; L223-T226 PolarHBondContact O-OG1 3.07Å; D224-T226 PolarHBondContact O-N 2.72Å; T226-M231 WeakPolarHBondContact O-CE 3.32Å
227	L	90.1	Very high	79	Confident	35 Å²	35	112.8 Å²	112.8	18%	0.183	55%	0.554	C	S	.	*	S	Bend	trans	-79.6	128.2	173.1	-56.4	177.2	0	0	0	108.9	Y222 D224 Y229 L230 M231	Y222-L227 HydrophobicContact CD2-CD1 4.23Å; Y222-L227 HydrophobicContact CD2-CD2 4.2Å; Y222-L227 HydrophobicContact CD2-CG 4.48Å; Y222-L227 HydrophobicContact CE2-CD1 3.95Å; Y222-L227 HydrophobicContact CE2-CD2 4.49Å; D224-L227 HydrophobicContact CB-CD1 4.48Å; D224-L227 WeakPolarHBondContact O-CB 3.4Å; D224-L227 WeakPolarHBondContact O-CG 3.33Å; D224-L227 PolarHBondContact O-N 2.86Å; L227-Y229 HydrophobicContact CB-CD1 4.28Å; L227-Y229 HydrophobicContact CB-CE1 4.03Å; L227-Y229 HydrophobicContact CD1-CE1 4.27Å; L227-Y229 PolarHBondContact O-N 2.83Å; L227-Y229 VanDerWaalsContact O-N 3.09Å; L227-L230 HydrophobicContact CD1-CD1 4.22Å; L227-L230 PolarHBondContact O-N 3.12Å; L227-M231 PolarHBondContact O-N 2.89Å; L227-M231 VanDerWaalsContact O-N 3.08Å
228	S	87.1	Confident	77	Confident	100 Å²	100	111.3 Å²	111.3	70%	0.699	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	-28.8	-173.3	48.5	0	0	0	0	114.2
229	Y	88.5	Confident	74.9	Confident	36 Å²	36	108.4 Å²	108.4	14%	0.141	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-7.4	178.5	65.4	-99.3	0	0	0	114.7	L227 A757 A764 L767 H768	L227-Y229 HydrophobicContact CB-CD1 4.28Å; L227-Y229 HydrophobicContact CB-CE1 4.03Å; L227-Y229 HydrophobicContact CD1-CE1 4.27Å; L227-Y229 PolarHBondContact O-N 2.83Å; L227-Y229 VanDerWaalsContact O-N 3.09Å; Y229-A757 WeakPolarHBondContact O-CB 3.36Å; Y229-A764 HydrophobicContact CD2-CB 3.95Å; Y229-A764 WeakPolarHBondContact O-CB 3.4Å; Y229-L767 HydrophobicContact CD1-CB 4.48Å; Y229-L767 HydrophobicContact CD1-CD2 3.52Å; Y229-L767 HydrophobicContact CD1-CG 3.83Å; Y229-L767 HydrophobicContact CE1-CD2 4.25Å; Y229-L767 HydrophobicContact CE1-CG 4.08Å; Y229-L767 HydrophobicContact CG-CB 4.42Å; Y229-L767 HydrophobicContact CG-CD2 3.81Å; Y229-L767 HydrophobicContact CG-CG 4.22Å; Y229-H768 HydrophobicContact CE2-CB 3.89Å; Y229-H768 WeakPolarHBondContact OH-CA 3.13Å
230	L	87.6	Confident	73.2	Confident	6 Å²	6	104.6 Å²	104.6	3%	0.031	55%	0.549	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-0	171.6	-63.9	175.1	0	0	0	112.5	D224 L227 L752 C754 A757 A764	D224-L230 HydrophobicContact CB-CD1 3.99Å; L227-L230 HydrophobicContact CD1-CD1 4.22Å; L227-L230 PolarHBondContact O-N 3.12Å; L230-L752 HydrophobicContact CD1-CD1 4.46Å; L230-L752 HydrophobicContact CD1-CD2 3.83Å; L230-L752 HydrophobicContact CD1-CG 4.43Å; L230-C754 HydrophobicContact CD2-CB 4.44Å; L230-A757 HydrophobicContact CD2-CB 4.49Å; L230-A764 HydrophobicContact CD2-CB 3.96Å
231	M	81	Confident	71.3	Confident	97 Å²	97	103.8 Å²	103.8	48%	0.478	56%	0.555	S	S	.	*	S	Bend	trans	-72.7	127.1	165.3	-64.9	-169.4	-158	0	0	108.1	T226 L227	T226-M231 WeakPolarHBondContact O-CE 3.32Å; L227-M231 PolarHBondContact O-N 2.89Å; L227-M231 VanDerWaalsContact O-N 3.08Å
232	P	67.3	Low	69.5	Low	91 Å²	91	103.4 Å²	103.4	59%	0.591	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-59.7	147.1	166.2	27.1	-33.9	0	0	0	109
233	N	60.5	Low	67.8	Low	99 Å²	99	110.1 Å²	110.1	53%	0.529	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-47.7	132.7	171.2	-77.1	-19.5	0	0	0	108.9	S235 K760	N233-S235 PolarHBondContact O-N 3.47Å; N233-K760 PolarHBondContact OD1-NZ 2.86Å
234	P	58	Low	66.5	Low	130 Å²	130	114.9 Å²	114.9	84%	0.844	60%	0.6	S	S	*	*			trans	-66.1	95.6	-171	25.1	-34.4	0	0	0	111.2	R236	P234-R236 VanDerWaalsContact C-N 3.3Å; P234-R236 PolarHBondContact O-N 3Å
235	S	51.9	Low	66	Low	106 Å²	106	115.1 Å²	115.1	74%	0.741	61%	0.606	S	S	*	*			trans	-71.3	82	-175.8	43.4	0	0	0	0	111.6	N233 K237	N233-S235 PolarHBondContact O-N 3.47Å; S235-K237 PolarHBondContact O-N 2.83Å
236	R	47.7	Very low	65.8	Low	235 Å²	235	112.5 Å²	112.5	89%	0.887	60%	0.604	S	S	*	*	S	Bend	trans	44.9	68.5	153.7	-153	-179.9	-159.4	-167.4	5.7	115.5	P234	P234-R236 VanDerWaalsContact C-N 3.3Å; P234-R236 PolarHBondContact O-N 3Å
237	K	42.2	Very low	65.6	Low	198 Å²	198	113.8 Å²	113.8	86%	0.861	61%	0.608	S	S	*	*			trans	60	89.3	167.7	-57	-179.8	178.8	-177.6	0	115.2	S235 S239	S235-K237 PolarHBondContact O-N 2.83Å; K237-S239 PolarHBondContact O-N 2.91Å; K237-S239 VanDerWaalsContact O-N 3.13Å
238	Q	49.5	Very low	65.3	Low	185 Å²	185	120 Å²	120	86%	0.864	63%	0.629	S	S	*	*			trans	-70.8	103.2	146.6	-76.2	-164.7	0.3	0	0	109	S240	Q238-S240 PolarHBondContact O-N 2.79Å
239	S	44.3	Very low	65.1	Low	65 Å²	65	118.7 Å²	118.7	46%	0.455	61%	0.614	S	S	.	*			trans	-63.4	82.9	166.8	37.3	0	0	0	0	109.7	K237 G241 L691	K237-S239 PolarHBondContact O-N 2.91Å; K237-S239 VanDerWaalsContact O-N 3.13Å; S239-G241 PolarHBondContact O-N 2.69Å; S239-L691 WeakPolarHBondContact CB-O 3.36Å
240	S	53.2	Low	64.8	Low	114 Å²	114	120.5 Å²	120.5	80%	0.797	63%	0.628	S	S	*	*			trans	-71.1	70.1	174.3	43.3	0	0	0	0	110.8	Q238 S242	Q238-S240 PolarHBondContact O-N 2.79Å; S240-S242 PolarHBondContact O-N 3.06Å
241	G	52.2	Low	64.6	Low	59 Å²	59	124.3 Å²	124.3	61%	0.608	65%	0.646	S	S	*	*			trans	-54.4	128.3	-170.7	0	0	0	0	0	113	S239	S239-G241 PolarHBondContact O-N 2.69Å
242	S	51.7	Low	64.6	Low	118 Å²	118	124.4 Å²	124.4	83%	0.825	64%	0.641	S	S	*	*	S	Bend	trans	33.2	82.4	174.5	-161.7	0	0	0	0	114.8	S240 R244	S240-S242 PolarHBondContact O-N 3.06Å; S242-R244 PolarHBondContact O-N 2.86Å
243	R	57.2	Low	65.2	Low	241 Å²	241	124.2 Å²	124.2	91%	0.909	64%	0.635	S	S	*	*			trans	-16.2	96	165.8	-171.5	-173.6	-161.3	-179.3	6.7	112	S245	R243-S245 PolarHBondContact O-N 2.6Å
244	R	63.8	Low	66.2	Low	180 Å²	180	123.8 Å²	123.8	68%	0.679	63%	0.631	S	S	*	*			trans	-43.9	111.4	-167.7	-68.2	-179	-179	-179.8	2.5	110.8	S242 I246 I249	S242-R244 PolarHBondContact O-N 2.86Å; R244-I246 PolarHBondContact O-N 2.7Å; R244-I249 HydrophobicContact CB-CD1 4.28Å
245	S	78.5	Confident	67.1	Low	61 Å²	61	122.4 Å²	122.4	43%	0.427	61%	0.613	S	S	.	*			trans	-52.5	136.3	178.5	176.1	0	0	0	0	110.1	R243 N247 R248 I249	R243-S245 PolarHBondContact O-N 2.6Å; S245-N247 PolarHBondContact O-N 3.22Å; S245-N247 PolarHBondContact OG-N 3.27Å; S245-R248 CarbonylContact O-C 3.58Å; S245-R248 WeakPolarHBondContact O-CA 3.16Å; S245-R248 PolarHBondContact O-N 2.9Å; S245-I249 PolarHBondContact O-N 3.49Å
246	I	81	Confident	68.1	Low	129 Å²	129	124.4 Å²	124.4	66%	0.662	61%	0.605	S	S	*	*	S	Bend	trans	-58.4	-37.7	177.6	-62.7	175	0	0	0	109.5	R244 R248 I249 V250	R244-I246 PolarHBondContact O-N 2.7Å; I246-R248 PolarHBondContact O-N 3.13Å; I246-I249 WeakPolarHBondContact O-CA 3.48Å; I246-I249 WeakPolarHBondContact O-CB 3.08Å; I246-I249 PolarHBondContact O-N 2.86Å; I246-V250 HydrophobicContact CG2-CG2 4.45Å; I246-V250 WeakPolarHBondContact O-CG2 3.28Å; I246-V250 PolarHBondContact O-N 2.9Å
247	N	84.9	Confident	68.9	Low	104 Å²	104	121.2 Å²	121.2	56%	0.556	59%	0.593	S	S	*	*	H	α-helix	trans	-59	-48.2	175.3	-53.5	7.1	0	0	0	110.2	S245 I249 V250 E251	S245-N247 PolarHBondContact O-N 3.22Å; S245-N247 PolarHBondContact OG-N 3.27Å; N247-I249 PolarHBondContact O-N 2.93Å; N247-V250 CarbonylContact O-C 3.57Å; N247-V250 WeakPolarHBondContact O-CA 3.47Å; N247-V250 PolarHBondContact O-N 2.98Å; N247-E251 VanDerWaalsContact CB-OE1 3.25Å; N247-E251 WeakPolarHBondContact CB-OE1 3.17Å; N247-E251 WeakPolarHBondContact O-CB 3.44Å; N247-E251 VanDerWaalsContact O-CG 3.26Å; N247-E251 WeakPolarHBondContact O-CG 3.24Å; N247-E251 PolarHBondContact O-N 3.01Å
248	R	83	Confident	69.9	Low	165 Å²	165	118 Å²	118	62%	0.623	58%	0.579	S	S	*	*	H	α-helix	trans	-70.8	5	175	-151.8	-177.5	176.6	-168.9	0.9	114.9	S245 I246 E251 R252	S245-R248 CarbonylContact O-C 3.58Å; S245-R248 WeakPolarHBondContact O-CA 3.16Å; S245-R248 PolarHBondContact O-N 2.9Å; I246-R248 PolarHBondContact O-N 3.13Å; R248-E251 WeakPolarHBondContact CA-OE2 3.41Å; R248-R252 VanDerWaalsContact O-CZ 3.27Å; R248-R252 PolarHBondContact O-NE 3.43Å; R248-R252 PolarHBondContact O-NH2 3.21Å
249	I	82.1	Confident	70.3	Confident	74 Å²	74	113.1 Å²	113.1	38%	0.379	56%	0.558	S	S	.	*	H	α-helix	trans	-102.9	-42.9	164.4	-62.3	170.5	0	0	0	109.1	R244 S245 I246 N247 R252 L253	R244-I249 HydrophobicContact CB-CD1 4.28Å; S245-I249 PolarHBondContact O-N 3.49Å; I246-I249 WeakPolarHBondContact O-CA 3.48Å; I246-I249 WeakPolarHBondContact O-CB 3.08Å; I246-I249 PolarHBondContact O-N 2.86Å; N247-I249 PolarHBondContact O-N 2.93Å; I249-R252 PolarHBondContact O-N 2.72Å; I249-L253 HydrophobicContact CG2-CD1 4.05Å; I249-L253 VanDerWaalsContact O-CG 3.28Å; I249-L253 WeakPolarHBondContact O-CG 3.46Å; I249-L253 PolarHBondContact O-N 3.28Å; I249-L253 VanDerWaalsContact O-N 3.1Å
250	V	83.1	Confident	70.6	Confident	73 Å²	73	112.7 Å²	112.7	44%	0.442	56%	0.555	S	S	.	*	H	α-helix	trans	-61.3	-46.7	174.5	173.4	0	0	0	0	111.9	I246 N247 R252 L253 I254	I246-V250 HydrophobicContact CG2-CG2 4.45Å; I246-V250 WeakPolarHBondContact O-CG2 3.28Å; I246-V250 PolarHBondContact O-N 2.9Å; N247-V250 CarbonylContact O-C 3.57Å; N247-V250 WeakPolarHBondContact O-CA 3.47Å; N247-V250 PolarHBondContact O-N 2.98Å; V250-R252 PolarHBondContact O-N 2.87Å; V250-L253 CarbonylContact O-C 3.45Å; V250-L253 PolarHBondContact O-N 2.84Å; V250-I254 HydrophobicContact CG1-CD1 3.74Å; V250-I254 HydrophobicContact CG1-CG1 4.46Å; V250-I254 WeakPolarHBondContact O-CG1 3.46Å; V250-I254 PolarHBondContact O-N 2.96Å
251	E	82.7	Confident	70.4	Confident	87 Å²	87	116.2 Å²	116.2	41%	0.407	55%	0.551	S	S	.	*	H	α-helix	trans	-50.6	-56.5	174.5	-72	147.9	-150.7	0	0	110.6	N247 R248 L253 I254 E255	N247-E251 VanDerWaalsContact CB-OE1 3.25Å; N247-E251 WeakPolarHBondContact CB-OE1 3.17Å; N247-E251 WeakPolarHBondContact O-CB 3.44Å; N247-E251 VanDerWaalsContact O-CG 3.26Å; N247-E251 WeakPolarHBondContact O-CG 3.24Å; N247-E251 PolarHBondContact O-N 3.01Å; R248-E251 WeakPolarHBondContact CA-OE2 3.41Å; E251-L253 PolarHBondContact O-N 3.19Å; E251-I254 CarbonylContact O-C 3.6Å; E251-I254 WeakPolarHBondContact O-CA 3.44Å; E251-I254 WeakPolarHBondContact O-CB 3.35Å; E251-I254 PolarHBondContact O-N 3.42Å; E251-E255 WeakPolarHBondContact O-CG 3.32Å; E251-E255 PolarHBondContact O-N 3.05Å
252	R	82.5	Confident	70.1	Confident	99 Å²	99	119 Å²	119	37%	0.374	55%	0.548	S	S	.	.	H	α-helix	trans	-64.4	-20.5	178	-81	-177.4	-71.3	-175.7	-7.6	115.3	R248 I249 V250 E255 R256	R248-R252 VanDerWaalsContact O-CZ 3.27Å; R248-R252 PolarHBondContact O-NE 3.43Å; R248-R252 PolarHBondContact O-NH2 3.21Å; I249-R252 PolarHBondContact O-N 2.72Å; V250-R252 PolarHBondContact O-N 2.87Å; R252-E255 VanDerWaalsContact CA-OE2 3.3Å; R252-E255 WeakPolarHBondContact CA-OE2 3.42Å; R252-E255 WeakPolarHBondContact CG-OE2 3.2Å; R252-R256 WeakPolarHBondContact O-CB 3.43Å; R252-R256 VanDerWaalsContact O-CG 3.28Å; R252-R256 WeakPolarHBondContact O-CG 3.13Å; R252-R256 PolarHBondContact O-N 2.83Å
253	L	78.2	Confident	69.9	Low	87 Å²	87	118.4 Å²	118.4	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-85.4	-19.2	172.3	-71.3	169.3	0	0	0	112.6	I249 V250 E251 R257	I249-L253 HydrophobicContact CG2-CD1 4.05Å; I249-L253 VanDerWaalsContact O-CG 3.28Å; I249-L253 WeakPolarHBondContact O-CG 3.46Å; I249-L253 PolarHBondContact O-N 3.28Å; I249-L253 VanDerWaalsContact O-N 3.1Å; V250-L253 CarbonylContact O-C 3.45Å; V250-L253 PolarHBondContact O-N 2.84Å; E251-L253 PolarHBondContact O-N 3.19Å; L253-R257 WeakPolarHBondContact O-CG 3.38Å
254	I	82	Confident	69.4	Low	90 Å²	90	111.3 Å²	111.3	46%	0.462	52%	0.516	S	S	.	.	H	α-helix	trans	-87.8	-43.4	172.9	-67.3	167.8	0	0	0	110.3	V250 E251 R257 K258	V250-I254 HydrophobicContact CG1-CD1 3.74Å; V250-I254 HydrophobicContact CG1-CG1 4.46Å; V250-I254 WeakPolarHBondContact O-CG1 3.46Å; V250-I254 PolarHBondContact O-N 2.96Å; E251-I254 CarbonylContact O-C 3.6Å; E251-I254 WeakPolarHBondContact O-CA 3.44Å; E251-I254 WeakPolarHBondContact O-CB 3.35Å; E251-I254 PolarHBondContact O-N 3.42Å; I254-R257 WeakPolarHBondContact O-CB 3.36Å; I254-R257 PolarHBondContact O-N 3.38Å; I254-K258 PolarHBondContact O-N 3.18Å; I254-K258 VanDerWaalsContact O-N 3.16Å
255	E	77.9	Confident	68.4	Low	100 Å²	100	109.5 Å²	109.5	47%	0.467	52%	0.515	S	S	.	.	H	α-helix	trans	-55.2	-55.2	174.7	-70.2	162.5	166.1	0	0	110.4	E251 R252 R257 K258 D259	E251-E255 WeakPolarHBondContact O-CG 3.32Å; E251-E255 PolarHBondContact O-N 3.05Å; R252-E255 VanDerWaalsContact CA-OE2 3.3Å; R252-E255 WeakPolarHBondContact CA-OE2 3.42Å; R252-E255 WeakPolarHBondContact CG-OE2 3.2Å; E255-R257 PolarHBondContact O-N 2.79Å; E255-K258 WeakPolarHBondContact O-CA 3.48Å; E255-K258 WeakPolarHBondContact O-CB 3.39Å; E255-K258 PolarHBondContact O-N 3.34Å; E255-D259 PolarHBondContact O-N 2.81Å
256	R	71.6	Confident	66.9	Low	149 Å²	149	113.1 Å²	113.1	56%	0.562	53%	0.529	S	S	*	.	H	α-helix	trans	-57.4	-16.6	174.9	-75.4	179.5	170.4	-160.3	-5	115.3	R252 C260	R252-R256 WeakPolarHBondContact O-CB 3.43Å; R252-R256 VanDerWaalsContact O-CG 3.28Å; R252-R256 WeakPolarHBondContact O-CG 3.13Å; R252-R256 PolarHBondContact O-N 2.83Å; R256-C260 PolarHBondContact O-SG 3.47Å
257	R	64.9	Low	65.3	Low	167 Å²	167	114.1 Å²	114.1	63%	0.63	53%	0.528	S	S	*	.	H	α-helix	trans	-91.6	-18.2	173.2	-80.1	178.7	165.7	-166	-4.2	113.5	L253 I254 E255	L253-R257 WeakPolarHBondContact O-CG 3.38Å; I254-R257 WeakPolarHBondContact O-CB 3.36Å; I254-R257 PolarHBondContact O-N 3.38Å; E255-R257 PolarHBondContact O-N 2.79Å
258	K	64	Low	63.2	Low	132 Å²	132	115 Å²	115	57%	0.574	53%	0.533	S	S	*	.	H	α-helix	trans	-85.5	-44	171.2	-68	-177.7	174.4	-172.6	0	110.9	I254 E255 C260 R261 Q262	I254-K258 PolarHBondContact O-N 3.18Å; I254-K258 VanDerWaalsContact O-N 3.16Å; E255-K258 WeakPolarHBondContact O-CA 3.48Å; E255-K258 WeakPolarHBondContact O-CB 3.39Å; E255-K258 PolarHBondContact O-N 3.34Å; K258-C260 VanDerWaalsContact C-N 3.25Å; K258-C260 PolarHBondContact O-N 3.46Å; K258-R261 PolarHBondContact O-N 3.43Å; K258-Q262 PolarHBondContact O-N 3.16Å
259	D	57	Low	61.4	Low	81 Å²	81	112 Å²	112	43%	0.433	54%	0.537	S	S	.	.	H	α-helix	trans	-56.5	-41.4	-179	-52.5	-23.3	0	0	0	111.2	E255 R261 N263	E255-D259 PolarHBondContact O-N 2.81Å; D259-R261 PolarHBondContact O-N 3.19Å; D259-N263 PolarHBondContact O-N 2.97Å; D259-N263 PolarHBondContact O-ND2 3.03Å
260	C	51.9	Low	59.7	Low	57 Å²	57	113.2 Å²	113.2	39%	0.385	55%	0.552	S	S	.	*	H	α-helix	trans	-67.3	-13.1	175.5	-69.2	0	0	0	0	115.1	R256 K258	R256-C260 PolarHBondContact O-SG 3.47Å; K258-C260 VanDerWaalsContact C-N 3.25Å; K258-C260 PolarHBondContact O-N 3.46Å
261	R	47.8	Very low	57.7	Low	188 Å²	188	118.4 Å²	118.4	71%	0.709	57%	0.569	S	S	*	*	H	α-helix	trans	-93.3	-44.4	176.6	-70.2	-176.7	168.2	-147.5	-9.9	112	K258 D259 N263 D264 E265	K258-R261 PolarHBondContact O-N 3.43Å; D259-R261 PolarHBondContact O-N 3.19Å; R261-N263 VanDerWaalsContact C-N 3.29Å; R261-N263 PolarHBondContact O-N 3.08Å; R261-D264 PolarHBondContact O-N 3.43Å; R261-E265 PolarHBondContact O-N 3.47Å
262	Q	46.6	Very low	55.5	Low	117 Å²	117	124.1 Å²	124.1	55%	0.547	59%	0.588	S	S	.	*	H	α-helix	trans	-71.2	-23.6	-177.2	-64.8	-173.5	-54.2	0	0	113.1	K258 D264 L266	K258-Q262 PolarHBondContact O-N 3.16Å; Q262-D264 VanDerWaalsContact C-N 3.31Å; Q262-L266 WeakPolarHBondContact O-CB 3.46Å; Q262-L266 PolarHBondContact O-N 3.06Å
263	N	46.5	Very low	53.4	Low	106 Å²	106	126.9 Å²	126.9	57%	0.567	61%	0.61	S	S	*	*	H	α-helix	trans	-75.1	-16.2	174.9	-81.6	-80	0	0	0	114.2	D259 R261	D259-N263 PolarHBondContact O-N 2.97Å; D259-N263 PolarHBondContact O-ND2 3.03Å; R261-N263 VanDerWaalsContact C-N 3.29Å; R261-N263 PolarHBondContact O-N 3.08Å
264	D	46.7	Very low	51.5	Low	91 Å²	91	131.2 Å²	131.2	49%	0.487	63%	0.627	S	S	.	*	H	α-helix	trans	-87	-51.7	173.2	-66.1	-26.1	0	0	0	109.6	R261 Q262 L266 K267	R261-D264 PolarHBondContact O-N 3.43Å; Q262-D264 VanDerWaalsContact C-N 3.31Å; D264-L266 VanDerWaalsContact C-N 3.28Å; D264-L266 PolarHBondContact O-N 2.95Å; D264-K267 PolarHBondContact O-N 3.23Å
265	E	42.4	Very low	49.2	Very low	143 Å²	143	132.5 Å²	132.5	67%	0.668	64%	0.644	S	S	*	*	H	α-helix	trans	-57.4	-34.9	179.9	-67.6	176.9	139.2	0	0	113.8	R261 K267	R261-E265 PolarHBondContact O-N 3.47Å; E265-K267 VanDerWaalsContact C-N 3.31Å; E265-K267 PolarHBondContact O-N 3.43Å
266	L	47.9	Very low	46.9	Very low	137 Å²	137	134.9 Å²	134.9	72%	0.717	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-7.2	179.6	-83.2	165	0	0	0	114.8	Q262 D264	Q262-L266 WeakPolarHBondContact O-CB 3.46Å; Q262-L266 PolarHBondContact O-N 3.06Å; D264-L266 VanDerWaalsContact C-N 3.28Å; D264-L266 PolarHBondContact O-N 2.95Å
267	K	46.7	Very low	45.1	Very low	150 Å²	150	132.4 Å²	132.4	65%	0.652	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-27.2	178.8	-86.4	-178.4	174.4	175.6	0	114.6	D264 E265 S269	D264-K267 PolarHBondContact O-N 3.23Å; E265-K267 VanDerWaalsContact C-N 3.31Å; E265-K267 PolarHBondContact O-N 3.43Å; K267-S269 VanDerWaalsContact C-N 3.28Å; K267-S269 PolarHBondContact O-N 3.26Å
268	D	41.8	Very low	43.4	Very low	123 Å²	123	130.5 Å²	130.5	66%	0.658	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-76	-16.6	-177.5	-73.7	-18.2	0	0	0	113.4	S270	D268-S270 PolarHBondContact O-N 3.32Å
269	S	45.1	Very low	42.1	Very low	100 Å²	100	129.3 Å²	129.3	70%	0.699	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-80.9	-7.6	-175.1	-62.9	0	0	0	0	115.2	K267	K267-S269 VanDerWaalsContact C-N 3.28Å; K267-S269 PolarHBondContact O-N 3.26Å
270	S	45.8	Very low	41	Very low	101 Å²	101	130.6 Å²	130.6	71%	0.706	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-115.8	16	-171.8	63.5	0	0	0	0	115.4	D268	D268-S270 PolarHBondContact O-N 3.32Å
271	K	41.6	Very low	40.2	Very low	181 Å²	181	133.2 Å²	133.2	79%	0.787	73%	0.727	S	S	*	*			trans	-127.9	18.5	-178.7	-80.5	-162.9	167.6	-163.4	0	115.9	L273	K271-L273 VanDerWaalsContact C-N 3.29Å; K271-L273 PolarHBondContact O-N 2.8Å
272	Y	36.7	Very low	39.7	Very low	208 Å²	208	126.6 Å²	126.6	82%	0.816	71%	0.707	S	S	*	*			trans	-81.8	70.5	172.3	-79.3	-84.7	0	0	0	112.4
273	L	38.7	Very low	39.3	Very low	157 Å²	157	124.8 Å²	124.8	82%	0.822	70%	0.704	S	S	*	*	S	Bend	trans	-162.1	146.7	149	-132	72.5	0	0	0	110.1	K271	K271-L273 VanDerWaalsContact C-N 3.29Å; K271-L273 PolarHBondContact O-N 2.8Å
274	E	37.8	Very low	38.8	Very low	177 Å²	177	126 Å²	126	83%	0.827	72%	0.718	S	S	*	*	S	Bend	trans	69.3	148.7	173.3	-54.5	-170.1	134.7	0	0	119.7
275	S	32.8	Very low	38.9	Very low	117 Å²	117	124.5 Å²	124.5	82%	0.818	72%	0.724	S	S	*	*			trans	70.1	83.2	164.9	-57.3	0	0	0	0	119.4
276	T	29.9	Very low	39.5	Very low	150 Å²	150	124.5 Å²	124.5	92%	0.92	72%	0.724	S	S	*	*			trans	-86.1	103.1	170.7	-52.6	0	0	0	0	113.2
277	S	34.4	Very low	40.3	Very low	97 Å²	97	120.6 Å²	120.6	68%	0.678	70%	0.703	S	S	*	*			trans	-162.8	102.9	157.3	46.1	0	0	0	0	114.3	S279	S277-S279 PolarHBondContact O-N 2.84Å
278	S	28.5	Very low	41.5	Very low	127 Å²	127	113.8 Å²	113.8	89%	0.888	67%	0.674	S	S	*	*			trans	16	92.7	155.4	58.5	0	0	0	0	119.7
279	S	37	Very low	43.1	Very low	108 Å²	108	112 Å²	112	76%	0.755	66%	0.662	S	S	*	*			trans	-148.1	135.6	149.2	56.3	0	0	0	0	111.2	S277 S281	S277-S279 PolarHBondContact O-N 2.84Å; S279-S281 PolarHBondContact O-N 3.15Å
280	S	34.7	Very low	44.9	Very low	108 Å²	108	109.4 Å²	109.4	76%	0.755	64%	0.639	S	S	*	*			trans	-93.1	71.1	-172.1	42.8	0	0	0	0	112.5	T282	S280-T282 VanDerWaalsContact C-N 3.27Å; S280-T282 PolarHBondContact O-N 3.05Å; S280-T282 PolarHBondContact O-OG1 2.91Å
281	S	35.1	Very low	46.9	Very low	112 Å²	112	104.7 Å²	104.7	78%	0.783	61%	0.606	S	S	*	*			trans	-71.8	69	-180	45.2	0	0	0	0	114	S279	S279-S281 PolarHBondContact O-N 3.15Å
282	T	37	Very low	49.2	Very low	48 Å²	48	97.2 Å²	97.2	29%	0.294	57%	0.574	S	S	.	*			trans	-59.5	137.5	168.9	-30.6	0	0	0	0	110.4	S280 N616	S280-T282 VanDerWaalsContact C-N 3.27Å; S280-T282 PolarHBondContact O-N 3.05Å; S280-T282 PolarHBondContact O-OG1 2.91Å; T282-N616 WeakPolarHBondContact CG2-ND2 3.18Å; T282-N616 PolarHBondContact OG1-ND2 3.22Å
283	T	37.4	Very low	51.8	Low	79 Å²	79	87.3 Å²	87.3	49%	0.485	54%	0.535	S	S	.	.			trans	-64.4	137.1	175.8	49.9	0	0	0	0	110.8	G285	T283-G285 VanDerWaalsContact C-N 3.28Å; T283-G285 PolarHBondContact O-N 2.83Å
284	P	36.2	Very low	54.4	Low	133 Å²	133	82.2 Å²	82.2	86%	0.864	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	76.8	-174.1	30.5	-35.9	0	0	0	111.6
285	G	49.5	Very low	56.9	Low	59 Å²	59	73.9 Å²	73.9	61%	0.608	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-171.7	-27.3	-178.2	0	0	0	0	0	115.4	T283	T283-G285 VanDerWaalsContact C-N 3.28Å; T283-G285 PolarHBondContact O-N 2.83Å
286	E	55.5	Low	59.6	Low	143 Å²	143	71.3 Å²	71.3	67%	0.668	44%	0.444	S	S	*	.	S	Bend	trans	-82.6	154	171.3	-70.1	-159.7	121.6	0	0	112.3
287	L	65.1	Low	62.4	Low	55 Å²	55	64.2 Å²	64.2	29%	0.288	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-83.7	131.9	169	-76.6	162.2	0	0	0	107.9	R519 L521	L287-R519 HydrophobicContact CD1-CB 4.4Å; L287-L521 HydrophobicContact CD2-CB 4.07Å
288	P	71.9	Confident	65.2	Low	6 Å²	6	59.6 Å²	59.6	4%	0.039	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-60	146.5	174.6	28	-36	0	0	0	110.3	E290 L291 L521 W614	P288-E290 VanDerWaalsContact C-N 3.33Å; P288-E290 PolarHBondContact O-N 2.69Å; P288-L291 HydrophobicContact CG-CD2 4.21Å; P288-L291 HydrophobicContact CG-CG 4.11Å; P288-L521 HydrophobicContact CG-CD2 3.68Å; P288-W614 HydrophobicContact CB-CB 3.8Å; P288-W614 HydrophobicContact CB-CD2 3.99Å; P288-W614 HydrophobicContact CB-CE3 4.28Å; P288-W614 HydrophobicContact CB-CG 3.79Å; P288-W614 HydrophobicContact CG-CB 4.42Å; P288-W614 HydrophobicContact CG-CD2 3.87Å; P288-W614 HydrophobicContact CG-CE3 4.37Å; P288-W614 HydrophobicContact CG-CG 3.88Å
289	Q	75.2	Confident	68.2	Low	86 Å²	86	55.1 Å²	55.1	40%	0.402	33%	0.332	S	S	.	.	S	Bend	trans	-66.4	-40.7	-176.9	-170.3	169.2	15.7	0	0	110.6	S383 H615	Q289-S383 VanDerWaalsContact O-CB 3.25Å; Q289-S383 WeakPolarHBondContact O-CB 3.49Å; Q289-S383 PolarHBondContact O-OG 3.07Å; Q289-H615 WeakPolarHBondContact CB-O 3.47Å; Q289-H615 PolarHBondContact N-O 3.45Å
290	E	83.3	Confident	70.6	Confident	46 Å²	46	50.6 Å²	50.6	22%	0.215	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	148.2	170	-54.4	-178.1	133.1	0	0	111.3	P288 R381 H615	P288-E290 VanDerWaalsContact C-N 3.33Å; P288-E290 PolarHBondContact O-N 2.69Å; E290-R381 HydrophobicContact CB-CG 4.44Å; E290-R381 IonicContact OE2-CZ 2.68Å; E290-R381 IonicContact OE2-NE 3.78Å; E290-R381 PolarHBondContact OE2-NE 2.88Å; E290-R381 IonicContact OE2-NH2 3.13Å; E290-R381 PolarHBondContact OE2-NH2 3.47Å; E290-H615 HydrophobicContact CB-CB 4.24Å; E290-H615 PolarHBondContact N-O 2.81Å; E290-H615 VanDerWaalsContact N-O 3.1Å; E290-H615 PolarHBondContact O-N 2.82Å
291	L	87.3	Confident	73	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.2	169.1	-82.4	160.8	0	0	0	109	P288 R381 F382 L384 L521 V612 W614	P288-L291 HydrophobicContact CG-CD2 4.21Å; P288-L291 HydrophobicContact CG-CG 4.11Å; L291-R381 CarbonylContact O-C 3.55Å; L291-R381 VanDerWaalsContact O-CA 3.29Å; L291-R381 WeakPolarHBondContact O-CA 3.36Å; L291-F382 HydrophobicContact CB-CD2 4.47Å; L291-F382 HydrophobicContact CB-CE2 4.07Å; L291-F382 HydrophobicContact CB-CZ 4.09Å; L291-F382 HydrophobicContact CD1-CE2 4.13Å; L291-F382 HydrophobicContact CD1-CZ 4.48Å; L291-F382 PolarHBondContact N-O 3.31Å; L291-F382 PolarHBondContact O-N 2.84Å; L291-L384 HydrophobicContact CD1-CB 4.24Å; L291-L384 HydrophobicContact CD1-CD2 4.18Å; L291-L521 HydrophobicContact CD1-CD1 4.48Å; L291-L521 HydrophobicContact CD1-CD2 4.04Å; L291-L521 HydrophobicContact CD2-CD2 4.1Å; L291-L521 HydrophobicContact CG-CD2 4.44Å; L291-V612 HydrophobicContact CD2-CG1 4.02Å; L291-W614 VanDerWaalsContact CD2-CD1 3.41Å; L291-W614 HydrophobicContact CD2-CG 4.45Å
292	E	90	Very high	75.2	Confident	23 Å²	23	45 Å²	45	11%	0.107	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.1	169.7	-176.9	170.2	-170.4	0	0	110.3	I294 C380 R381 V612 I613 H615	E292-I294 HydrophobicContact CG-CD1 4.49Å; E292-I294 HydrophobicContact CG-CG1 3.94Å; E292-C380 CarbonylContact C-O 3.52Å; E292-C380 WeakPolarHBondContact CA-O 3.48Å; E292-R381 HydrophobicContact CB-CB 4.2Å; E292-R381 HydrophobicContact CB-CG 4.14Å; E292-R381 HydrophobicContact CG-CB 4.15Å; E292-R381 IonicContact OE2-NH1 2.72Å; E292-V612 WeakPolarHBondContact O-CA 3.29Å; E292-I613 HydrophobicContact CB-CB 4.33Å; E292-I613 PolarHBondContact N-O 3.45Å; E292-I613 PolarHBondContact O-N 3.43Å; E292-H615 IonicContact OE2-CD2 2.78Å; E292-H615 IonicContact OE2-CE1 2.74Å; E292-H615 IonicContact OE2-NE2 3.2Å; E292-H615 PolarHBondContact OE2-NE2 2.96Å
293	L	91.5	Very high	77	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	114	174.5	-53.2	179.3	0	0	0	107.8	F295 V316 A379 C380 F382 L405 L523 F610 S611 V612	L293-F295 HydrophobicContact CB-CE2 4.27Å; L293-F295 HydrophobicContact CB-CZ 4.26Å; L293-F295 HydrophobicContact CD1-CZ 4.49Å; L293-V316 HydrophobicContact CD1-CG1 4.04Å; L293-A379 CarbonylContact O-C 3.49Å; L293-A379 VanDerWaalsContact O-CA 3.28Å; L293-A379 WeakPolarHBondContact O-CA 3.31Å; L293-C380 HydrophobicContact CB-CB 4.47Å; L293-C380 PolarHBondContact N-O 2.94Å; L293-C380 PolarHBondContact O-N 3.01Å; L293-F382 HydrophobicContact CD1-CE1 3.98Å; L293-F382 HydrophobicContact CD1-CZ 4.34Å; L293-F382 HydrophobicContact CG-CE1 4.11Å; L293-L405 HydrophobicContact CD1-CD1 4.45Å; L293-L405 HydrophobicContact CD1-CD2 4.17Å; L293-L523 HydrophobicContact CD2-CD2 4.17Å; L293-F610 HydrophobicContact CD2-CD2 4.21Å; L293-F610 HydrophobicContact CD2-CE2 4.15Å; L293-S611 WeakPolarHBondContact CA-O 3.45Å; L293-V612 HydrophobicContact CD2-CG1 4.49Å; L293-V612 HydrophobicContact CD2-CG2 3.82Å
294	I	91.7	Very high	78.8	Confident	50 Å²	50	51.3 Å²	51.3	26%	0.256	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	110.8	177.3	-51.4	-178.5	0	0	0	108.3	E292 A379 F610 S611 I613	E292-I294 HydrophobicContact CG-CD1 4.49Å; E292-I294 HydrophobicContact CG-CG1 3.94Å; I294-A379 HydrophobicContact CB-CB 4.5Å; I294-A379 HydrophobicContact CG1-CB 4.04Å; I294-A379 HydrophobicContact CG2-CB 4.49Å; I294-F610 CarbonylContact O-C 3.44Å; I294-F610 WeakPolarHBondContact O-CA 3.36Å; I294-F610 WeakPolarHBondContact O-CB 3.47Å; I294-S611 PolarHBondContact N-O 2.93Å; I294-S611 PolarHBondContact O-N 2.9Å; I294-I613 HydrophobicContact CD1-CD1 3.71Å
295	F	92.2	Very high	80.6	Confident	3 Å²	3	49.4 Å²	49.4	1%	0.013	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	124.2	-179.4	-59.8	-83.3	0	0	0	110.6	L293 V314 V316 I342 I344 T378 C380 L407 L608 F610	L293-F295 HydrophobicContact CB-CE2 4.27Å; L293-F295 HydrophobicContact CB-CZ 4.26Å; L293-F295 HydrophobicContact CD1-CZ 4.49Å; F295-V314 HydrophobicContact CD1-CG2 4.18Å; F295-V314 HydrophobicContact CE1-CB 4.41Å; F295-V314 HydrophobicContact CE1-CG1 3.93Å; F295-V314 HydrophobicContact CE1-CG2 4.32Å; F295-V314 HydrophobicContact CG-CG2 4.48Å; F295-V314 HydrophobicContact CZ-CB 4.41Å; F295-V314 HydrophobicContact CZ-CG1 3.98Å; F295-V316 HydrophobicContact CE2-CG2 4.19Å; F295-V316 HydrophobicContact CZ-CG2 3.88Å; F295-I342 HydrophobicContact CD2-CG2 4.17Å; F295-I342 HydrophobicContact CE2-CD1 4.11Å; F295-I344 HydrophobicContact CB-CG2 3.49Å; F295-I344 VanDerWaalsContact CB-CG2 3.49Å; F295-I344 HydrophobicContact CG-CG2 4.1Å; F295-T378 WeakPolarHBondContact CD2-O 3.32Å; F295-T378 PolarHBondContact N-O 2.96Å; F295-C380 HydrophobicContact CE2-CB 4.41Å; F295-L407 HydrophobicContact CE1-CD1 4.25Å; F295-L407 HydrophobicContact CZ-CD2 4.37Å; F295-L608 HydrophobicContact CD1-CD1 4.09Å; F295-L608 HydrophobicContact CD1-CD2 4.27Å; F295-L608 HydrophobicContact CD1-CG 4.36Å; F295-L608 HydrophobicContact CE1-CD2 4.14Å; F295-F610 HydrophobicContact CB-CB 4.5Å; F295-F610 HydrophobicContact CD1-CB 3.64Å; F295-F610 HydrophobicContact CD1-CG 4.26Å; F295-F610 HydrophobicContact CE1-CB 4.07Å; F295-F610 HydrophobicContact CE1-CD1 4.49Å; F295-F610 HydrophobicContact CE1-CG 4.24Å; F295-F610 HydrophobicContact CG-CB 4.22Å
296	E	88.4	Confident	82.1	Confident	63 Å²	63	48.3 Å²	48.3	29%	0.294	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-43.8	176.5	-60.6	-172.5	148	0	0	110.9	L527 R609	E296-L527 HydrophobicContact CG-CD1 4.39Å; E296-L527 WeakPolarHBondContact OE2-CD1 3.5Å; E296-R609 HydrophobicContact CB-CB 4.09Å; E296-R609 PolarHBondContact N-O 3.03Å; E296-R609 IonicContact OE1-NH2 2.74Å; E296-R609 WeakPolarHBondContact OE2-CB 3.42Å; E296-R609 IonicContact OE2-CZ 3.12Å; E296-R609 IonicContact OE2-NE 3.38Å; E296-R609 PolarHBondContact OE2-NE 3.48Å; E296-R609 IonicContact OE2-NH2 2.7Å; E296-R609 PolarHBondContact OE2-NH2 3.27Å
297	G	89.5	Confident	83.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.5	172.9	177.6	0	0	0	0	0	115.2	Y299 N345 R609	G297-Y299 WeakPolarHBondContact O-CE2 3.43Å; G297-N345 CarbonylContact C-O 3.54Å; G297-N345 WeakPolarHBondContact CA-O 3.37Å; G297-R609 PolarHBondContact N-O 2.89Å; G297-R609 PolarHBondContact O-N 2.94Å
298	F	91.9	Very high	84.5	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	142.7	168.7	-179.5	-89	0	0	0	109.6	T309 A312 I344 N345 C346 Y347 V409 A411 Y498 L532 P606 G607	F298-T309 HydrophobicContact CD1-CG2 4.25Å; F298-T309 HydrophobicContact CE1-CG2 4.27Å; F298-T309 WeakPolarHBondContact CE1-OG1 3.47Å; F298-A312 HydrophobicContact CB-CB 4.23Å; F298-A312 HydrophobicContact CG-CB 4.47Å; F298-I344 HydrophobicContact CB-CD1 3.7Å; F298-I344 HydrophobicContact CB-CG1 4.45Å; F298-N345 PolarHBondContact N-O 2.99Å; F298-C346 CarbonylContact O-C 3.52Å; F298-C346 WeakPolarHBondContact O-CA 3.44Å; F298-Y347 PolarHBondContact O-N 3.18Å; F298-V409 HydrophobicContact CD2-CG1 3.89Å; F298-V409 HydrophobicContact CE2-CG1 4.25Å; F298-A411 HydrophobicContact CZ-CB 4.48Å; F298-Y498 AromaticContact CE2-CD2 3.87Å; F298-Y498 HydrophobicContact CE2-CD2 3.87Å; F298-Y498 AromaticContact CE2-CE2 3.92Å; F298-Y498 HydrophobicContact CE2-CE2 3.92Å; F298-Y498 HydrophobicContact CE2-CG 4.47Å; F298-Y498 AromaticContact CZ-CD2 3.99Å; F298-Y498 HydrophobicContact CZ-CD2 3.99Å; F298-Y498 AromaticContact CZ-CE2 3.54Å; F298-Y498 HydrophobicContact CZ-CE2 3.54Å; F298-L532 HydrophobicContact CD2-CD1 4.04Å; F298-L532 HydrophobicContact CE2-CD1 3.73Å; F298-P606 HydrophobicContact CE1-CB 4.42Å; F298-P606 HydrophobicContact CE2-CB 4.13Å; F298-P606 HydrophobicContact CZ-CB 3.71Å; F298-G607 CarbonylContact C-O 3.57Å; F298-G607 WeakPolarHBondContact CA-O 3.28Å
299	Y	91.2	Very high	85.3	Confident	34 Å²	34	41.7 Å²	41.7	13%	0.133	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	120.3	-176.7	-65.3	-98.8	0	0	0	108.9	G297 Y347 H349 P606 G607 R609	G297-Y299 WeakPolarHBondContact O-CE2 3.43Å; Y299-Y347 CarbonylContact C-O 3.58Å; Y299-Y347 VanDerWaalsContact CA-O 3.32Å; Y299-Y347 WeakPolarHBondContact CA-O 3.22Å; Y299-Y347 HydrophobicContact CD1-CD2 4.22Å; Y299-Y347 HydrophobicContact CD1-CG 4.23Å; Y299-Y347 AromaticContact CE1-CD2 3.68Å; Y299-Y347 HydrophobicContact CE1-CD2 3.68Å; Y299-Y347 AromaticContact CE1-CG 3.81Å; Y299-Y347 HydrophobicContact CE1-CG 3.81Å; Y299-Y347 AromaticContact CE2-CD2 3.97Å; Y299-Y347 HydrophobicContact CE2-CD2 3.97Å; Y299-Y347 AromaticContact CZ-CD2 3.53Å; Y299-H349 AromaticContact CD1-NE2 3.36Å; Y299-H349 WeakPolarHBondContact CD1-NE2 3.44Å; Y299-P606 CarbonylContact O-C 3.57Å; Y299-P606 VanDerWaalsContact O-CA 3.22Å; Y299-P606 WeakPolarHBondContact O-CA 3.48Å; Y299-G607 PolarHBondContact N-O 3.18Å; Y299-G607 PolarHBondContact O-N 2.79Å; Y299-R609 HydrophobicContact CD2-CG 4.33Å; Y299-R609 HydrophobicContact CE2-CB 3.95Å; Y299-R609 HydrophobicContact CE2-CG 3.93Å
300	D	88.3	Confident	85.9	Confident	13 Å²	13	38.4 Å²	38.4	7%	0.07	18%	0.18	C	C	.	.			trans	-60.9	158.6	179.7	-69	-24.7	0	0	0	112	E302 V308 T309 Y347 S348	D300-E302 PolarHBondContact O-N 3.1Å; D300-V308 WeakPolarHBondContact OD2-CA 3.36Å; D300-T309 WeakPolarHBondContact OD1-CB 3.39Å; D300-T309 PolarHBondContact OD1-N 3.34Å; D300-T309 PolarHBondContact OD1-OG1 3.36Å; D300-T309 PolarHBondContact OD2-N 3.09Å; D300-Y347 PolarHBondContact N-O 3.32Å; D300-S348 WeakPolarHBondContact OD2-CB 3.46Å; D300-S348 PolarHBondContact OD2-OG 3.28Å
301	S	84.8	Confident	86.2	Confident	16 Å²	16	39 Å²	39	11%	0.112	18%	0.184	C	C	.	.			trans	-65.3	133.9	171.5	-177.2	0	0	0	0	111.9	K303 E304 R604	S301-K303 PolarHBondContact O-N 3.24Å; S301-K303 WeakPolarHBondContact OG-CB 3.16Å; S301-K303 PolarHBondContact OG-N 2.69Å; S301-K303 VanDerWaalsContact OG-N 3.16Å; S301-E304 PolarHBondContact O-N 3.36Å; S301-R604 WeakPolarHBondContact CA-O 3.28Å; S301-R604 WeakPolarHBondContact CB-O 3.35Å; S301-R604 PolarHBondContact OG-O 3.28Å
302	E	80.5	Confident	86.4	Confident	87 Å²	87	38.9 Å²	38.9	41%	0.407	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.4	171.5	-59.5	-179.5	177	0	0	112.8	D300 R604	D300-E302 PolarHBondContact O-N 3.1Å; E302-R604 HydrophobicContact CB-CB 4.25Å; E302-R604 PolarHBondContact N-O 2.94Å
303	K	75.9	Confident	86.5	Confident	158 Å²	158	38.7 Å²	38.7	69%	0.687	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-29.6	-178.5	-166	178	-173.1	176.7	0	112.7	S301 M305	S301-K303 PolarHBondContact O-N 3.24Å; S301-K303 WeakPolarHBondContact OG-CB 3.16Å; S301-K303 PolarHBondContact OG-N 2.69Å; S301-K303 VanDerWaalsContact OG-N 3.16Å; K303-M305 PolarHBondContact O-N 3.24Å
304	E	75.1	Confident	86.5	Confident	101 Å²	101	38.7 Å²	38.7	47%	0.472	19%	0.186	S	C	.	.			trans	-101.5	65.5	-165.9	-61.5	-135.9	-177.1	0	0	112.7	S301 D306 W307	S301-E304 PolarHBondContact O-N 3.36Å; E304-D306 PolarHBondContact O-N 2.89Å; E304-D306 VanDerWaalsContact O-N 3.09Å; E304-W307 PolarHBondContact O-N 3.24Å; E304-W307 VanDerWaalsContact OE2-CD1 3.25Å
305	M	74.2	Confident	86.4	Confident	92 Å²	92	37.6 Å²	37.6	45%	0.453	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-1.8	-175.9	-47.5	-163.9	88.3	0	0	115.3	K303 S350 R485	K303-M305 PolarHBondContact O-N 3.24Å; M305-S350 VanDerWaalsContact CE-O 3.24Å; M305-S350 WeakPolarHBondContact CE-O 3.39Å; M305-R485 PolarHBondContact O-NH1 3Å; M305-R485 PolarHBondContact O-NH2 3.37Å
306	D	80.9	Confident	86.4	Confident	37 Å²	37	37.5 Å²	37.5	20%	0.198	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-15.8	176.9	-108.7	39.1	0	0	0	112.2	E304 R415 W416 K418	E304-D306 PolarHBondContact O-N 2.89Å; E304-D306 VanDerWaalsContact O-N 3.09Å; D306-R415 WeakPolarHBondContact O-CA 3.47Å; D306-R415 WeakPolarHBondContact O-CG 3.11Å; D306-R415 IonicContact OD2-CZ 3.62Å; D306-R415 IonicContact OD2-NE 3.74Å; D306-R415 PolarHBondContact OD2-NE 3.35Å; D306-R415 VanDerWaalsContact OD2-NE 3.1Å; D306-R415 IonicContact OD2-NH2 3.67Å; D306-R415 PolarHBondContact OD2-NH2 2.92Å; D306-W416 PolarHBondContact O-N 2.82Å; D306-K418 VanDerWaalsContact CG-NZ 3.34Å; D306-K418 WeakPolarHBondContact OD1-CE 3.46Å; D306-K418 IonicContact OD1-NZ 3.17Å; D306-K418 PolarHBondContact OD1-NZ 3.02Å; D306-K418 WeakPolarHBondContact OD2-CE 3.32Å; D306-K418 IonicContact OD2-NZ 3.83Å; D306-K418 PolarHBondContact OD2-NZ 3.08Å
307	W	83.9	Confident	86.4	Confident	62 Å²	62	36.5 Å²	36.5	24%	0.235	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	171.4	-176.3	-62.8	109.8	0	0	0	112.2	E304 E413 R414 R415 Y494	E304-W307 PolarHBondContact O-N 3.24Å; E304-W307 VanDerWaalsContact OE2-CD1 3.25Å; W307-E413 HydrophobicContact CE3-CB 4.46Å; W307-R414 CarbonylContact C-O 3.48Å; W307-R414 WeakPolarHBondContact CA-O 3.28Å; W307-R415 HydrophobicContact CD2-CB 4.4Å; W307-R415 HydrophobicContact CD2-CG 4.25Å; W307-R415 HydrophobicContact CE3-CB 3.75Å; W307-R415 HydrophobicContact CE3-CG 4.1Å; W307-R415 HydrophobicContact CH2-CB 4.19Å; W307-R415 HydrophobicContact CH2-CG 4.4Å; W307-R415 HydrophobicContact CZ3-CB 3.64Å; W307-R415 HydrophobicContact CZ3-CG 4.18Å; W307-Y494 AromaticContact CH2-CD2 3.76Å; W307-Y494 HydrophobicContact CH2-CD2 3.76Å; W307-Y494 AromaticContact CH2-CE2 3.76Å; W307-Y494 HydrophobicContact CH2-CE2 3.76Å; W307-Y494 HydrophobicContact CH2-CG 4.33Å; W307-Y494 AromaticContact CZ3-CD2 3.51Å; W307-Y494 HydrophobicContact CZ3-CD2 3.51Å; W307-Y494 AromaticContact CZ3-CE2 3.79Å; W307-Y494 HydrophobicContact CZ3-CE2 3.79Å; W307-Y494 HydrophobicContact CZ3-CG 4.29Å
308	V	87.1	Confident	86.4	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.1	138.6	172.7	63.6	0	0	0	0	111.1	D300 V310 Y353 E413 R414 L489	D300-V308 WeakPolarHBondContact OD2-CA 3.36Å; V308-V310 HydrophobicContact CG1-CG1 4.38Å; V308-Y353 HydrophobicContact CG2-CD1 3.2Å; V308-Y353 HydrophobicContact CG2-CE1 3.91Å; V308-Y353 HydrophobicContact CG2-CG 3.59Å; V308-E413 CarbonylContact O-C 3.56Å; V308-E413 VanDerWaalsContact O-CA 3.28Å; V308-E413 WeakPolarHBondContact O-CA 3.49Å; V308-R414 PolarHBondContact N-O 3.26Å; V308-R414 PolarHBondContact O-N 2.87Å; V308-L489 HydrophobicContact CG1-CD1 3.98Å; V308-L489 HydrophobicContact CG1-CD2 3.59Å; V308-L489 HydrophobicContact CG1-CG 4.46Å
309	T	89.1	Confident	86.2	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	127.1	175.5	-53.8	0	0	0	0	111.6	F298 D300 A312 C346 A411 T412	F298-T309 HydrophobicContact CD1-CG2 4.25Å; F298-T309 HydrophobicContact CE1-CG2 4.27Å; F298-T309 WeakPolarHBondContact CE1-OG1 3.47Å; D300-T309 WeakPolarHBondContact OD1-CB 3.39Å; D300-T309 PolarHBondContact OD1-N 3.34Å; D300-T309 PolarHBondContact OD1-OG1 3.36Å; D300-T309 PolarHBondContact OD2-N 3.09Å; T309-A312 HydrophobicContact CG2-CB 4.03Å; T309-C346 HydrophobicContact CG2-CB 4.29Å; T309-C346 WeakPolarHBondContact O-CB 3.42Å; T309-A411 HydrophobicContact CG2-CB 3.92Å; T309-T412 CarbonylContact C-O 3.47Å; T309-T412 WeakPolarHBondContact CA-O 3.43Å
310	V	87.2	Confident	85.8	Confident	18 Å²	18	37.7 Å²	37.7	11%	0.109	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-25.3	-175.6	-60.3	0	0	0	0	114.4	V308 Y353 S355 T412 R414 L489	V308-V310 HydrophobicContact CG1-CG1 4.38Å; V310-Y353 HydrophobicContact CG1-CE1 4.14Å; V310-S355 VanDerWaalsContact O-CB 3.28Å; V310-S355 WeakPolarHBondContact O-CB 3.41Å; V310-S355 PolarHBondContact O-OG 3.45Å; V310-T412 WeakPolarHBondContact CG2-O 3.49Å; V310-T412 PolarHBondContact N-O 3.19Å; V310-R414 HydrophobicContact CG1-CB 4.14Å; V310-R414 HydrophobicContact CG1-CG 4.03Å; V310-R414 HydrophobicContact CG2-CG 4.03Å; V310-L489 HydrophobicContact CG1-CD1 3.96Å
311	D	90	Very high	85.4	Confident	57 Å²	57	37.2 Å²	37.2	31%	0.305	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	135.3	171.8	-178	30.8	0	0	0	108	R343 T412	D311-R343 IonicContact OD1-NH1 2.97Å; D311-R343 PolarHBondContact OD1-NH1 2.66Å; D311-R343 IonicContact OD2-CZ 3.74Å; D311-R343 IonicContact OD2-NH1 2.63Å; D311-R343 PolarHBondContact OD2-NH1 3.16Å; D311-T412 WeakPolarHBondContact CB-OG1 3.17Å; D311-T412 PolarHBondContact N-OG1 3.41Å; D311-T412 PolarHBondContact O-N 3.01Å; D311-T412 PolarHBondContact O-OG1 2.88Å
312	A	90.5	Very high	84.9	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	145.3	-177.7	0	0	0	0	0	111	F298 T309 R343 I344 C346 V409 S410	F298-A312 HydrophobicContact CB-CB 4.23Å; F298-A312 HydrophobicContact CG-CB 4.47Å; T309-A312 HydrophobicContact CG2-CB 4.03Å; A312-R343 WeakPolarHBondContact O-CA 3.42Å; A312-I344 HydrophobicContact CB-CD1 4.4Å; A312-I344 HydrophobicContact CB-CG1 4Å; A312-I344 WeakPolarHBondContact O-CG1 3.17Å; A312-I344 PolarHBondContact O-N 2.93Å; A312-C346 VanDerWaalsContact CB-SG 3.55Å; A312-V409 HydrophobicContact CB-CG1 4.39Å; A312-S410 WeakPolarHBondContact CA-O 3.47Å
313	S	91.7	Very high	84.2	Confident	20 Å²	20	34.8 Å²	34.8	14%	0.14	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	146.8	179.6	61.8	0	0	0	0	113.4	P341 I342 V409 S410	S313-P341 WeakPolarHBondContact OG-CB 3.5Å; S313-I342 CarbonylContact C-O 3.57Å; S313-I342 WeakPolarHBondContact CA-O 3.39Å; S313-I342 WeakPolarHBondContact CB-O 3.44Å; S313-V409 CarbonylContact O-C 3.56Å; S313-V409 WeakPolarHBondContact O-CA 3.31Å; S313-S410 PolarHBondContact N-O 2.93Å; S313-S410 PolarHBondContact O-N 3.09Å
314	V	91.5	Very high	83.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.5	-173.5	-166.8	0	0	0	0	111.1	F295 V316 I342 I344 L407 H408 V409 L608	F295-V314 HydrophobicContact CD1-CG2 4.18Å; F295-V314 HydrophobicContact CE1-CB 4.41Å; F295-V314 HydrophobicContact CE1-CG1 3.93Å; F295-V314 HydrophobicContact CE1-CG2 4.32Å; F295-V314 HydrophobicContact CG-CG2 4.48Å; F295-V314 HydrophobicContact CZ-CB 4.41Å; F295-V314 HydrophobicContact CZ-CG1 3.98Å; V314-V316 HydrophobicContact CG1-CG2 4.47Å; V314-I342 PolarHBondContact N-O 2.86Å; V314-I342 PolarHBondContact O-N 3Å; V314-I344 HydrophobicContact CG2-CD1 3.54Å; V314-I344 HydrophobicContact CG2-CG1 4.15Å; V314-I344 HydrophobicContact CG2-CG2 3.95Å; V314-L407 HydrophobicContact CG1-CB 4.29Å; V314-L407 HydrophobicContact CG1-CD2 4.44Å; V314-H408 CarbonylContact C-O 3.49Å; V314-H408 WeakPolarHBondContact CA-O 3.37Å; V314-V409 HydrophobicContact CG1-CG2 4.47Å; V314-V409 HydrophobicContact CG2-CG2 4.21Å; V314-L608 HydrophobicContact CG1-CD2 4.42Å; V314-L608 HydrophobicContact CG2-CD1 4.08Å; V314-L608 HydrophobicContact CG2-CD2 4.46Å
315	N	90.4	Very high	82.4	Confident	27 Å²	27	38.8 Å²	38.8	14%	0.144	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136.6	163.2	-68.4	-63	0	0	0	110.2	T338 P341 H408	N315-T338 WeakPolarHBondContact CA-OG1 3.48Å; N315-P341 WeakPolarHBondContact OD1-CG 3.48Å; N315-H408 PolarHBondContact N-O 3.07Å; N315-H408 PolarHBondContact O-N 2.88Å
316	V	91.4	Very high	81.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	108.9	-173.5	-173.1	0	0	0	0	109.7	L293 F295 V314 N336 I337 T338 C380 L405 L407	L293-V316 HydrophobicContact CD1-CG1 4.04Å; F295-V316 HydrophobicContact CE2-CG2 4.19Å; F295-V316 HydrophobicContact CZ-CG2 3.88Å; V314-V316 HydrophobicContact CG1-CG2 4.47Å; V316-N336 PolarHBondContact O-OD1 3.29Å; V316-I337 HydrophobicContact CB-CB 4.45Å; V316-I337 HydrophobicContact CB-CD1 4.47Å; V316-I337 HydrophobicContact CG1-CD1 3.68Å; V316-I337 HydrophobicContact CG1-CG1 4.23Å; V316-I337 WeakPolarHBondContact O-CG1 3.28Å; V316-I337 PolarHBondContact O-N 2.82Å; V316-T338 HydrophobicContact CB-CG2 3.93Å; V316-T338 HydrophobicContact CG2-CG2 3.77Å; V316-T338 PolarHBondContact N-OG1 2.85Å; V316-C380 HydrophobicContact CG2-CB 4.46Å; V316-L405 HydrophobicContact CG1-CD1 3.63Å; V316-L407 HydrophobicContact CB-CD2 4.23Å; V316-L407 HydrophobicContact CG1-CD2 3.89Å; V316-L407 HydrophobicContact CG2-CD2 4.01Å
317	H	89.7	Confident	80.1	Confident	42 Å²	42	52.4 Å²	52.4	19%	0.194	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	140.1	-176.6	-67.3	-118.2	0	0	0	111.5	I334 L335 L405 E406	H317-I334 HydrophobicContact CB-CG2 4.34Å; H317-L335 CarbonylContact C-O 3.59Å; H317-L335 WeakPolarHBondContact CA-O 3.19Å; H317-L405 WeakPolarHBondContact O-CA 3.45Å; H317-E406 WeakPolarHBondContact CA-O 3.46Å; H317-E406 HydrophobicContact CB-CB 4.12Å; H317-E406 WeakPolarHBondContact CB-O 3.47Å; H317-E406 PolarHBondContact N-O 3.23Å; H317-E406 PolarHBondContact O-N 2.82Å
318	L	89.2	Confident	78.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.5	171.5	-65.9	178.4	0	0	0	110.5	F320 I334 L335 I337 F382 L384 L387 Q404 L405 L505	L318-F320 HydrophobicContact CB-CE2 3.8Å; L318-F320 HydrophobicContact CB-CZ 3.9Å; L318-F320 HydrophobicContact CD1-CE2 4.39Å; L318-F320 HydrophobicContact CD1-CZ 3.92Å; L318-I334 CarbonylContact O-C 3.53Å; L318-I334 VanDerWaalsContact O-CA 3.31Å; L318-I334 WeakPolarHBondContact O-CA 3.21Å; L318-L335 PolarHBondContact N-O 3.08Å; L318-L335 PolarHBondContact O-N 2.88Å; L318-I337 HydrophobicContact CD1-CD1 3.69Å; L318-I337 HydrophobicContact CD1-CG1 4.05Å; L318-I337 HydrophobicContact CD2-CD1 4.33Å; L318-I337 HydrophobicContact CG-CD1 3.73Å; L318-I337 HydrophobicContact CG-CG1 4Å; L318-F382 HydrophobicContact CD1-CD2 4.49Å; L318-F382 HydrophobicContact CD1-CE2 4.21Å; L318-L384 HydrophobicContact CD1-CD1 4.17Å; L318-L387 HydrophobicContact CD1-CD1 3.61Å; L318-Q404 WeakPolarHBondContact CA-O 3.26Å; L318-L405 HydrophobicContact CD2-CB 4.26Å; L318-L405 HydrophobicContact CD2-CD1 3.82Å; L318-L505 HydrophobicContact CD2-CD1 3.54Å
319	R	86.5	Confident	77	Confident	60 Å²	60	61.1 Å²	61.1	23%	0.226	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.4	-180	178.7	178	174.8	175	-1.5	110.5	D332 I334 A403 Q404 E406	R319-D332 HydrophobicContact CG-CB 3.81Å; R319-D332 IonicContact CZ-OD2 3.32Å; R319-D332 IonicContact NE-OD2 3.26Å; R319-D332 PolarHBondContact NE-OD2 2.83Å; R319-D332 IonicContact NH2-OD2 3.62Å; R319-D332 PolarHBondContact NH2-OD2 2.98Å; R319-I334 HydrophobicContact CB-CG1 4.27Å; R319-I334 HydrophobicContact CG-CG1 4.08Å; R319-A403 CarbonylContact O-C 3.54Å; R319-A403 WeakPolarHBondContact O-CA 3.22Å; R319-Q404 HydrophobicContact CB-CB 4.33Å; R319-Q404 PolarHBondContact N-O 3.23Å; R319-Q404 PolarHBondContact O-N 3.39Å; R319-E406 WeakPolarHBondContact CD-OE1 3.48Å; R319-E406 IonicContact CZ-OE1 2.69Å; R319-E406 IonicContact NE-OE1 3.07Å; R319-E406 IonicContact NH1-OE1 3.29Å; R319-E406 PolarHBondContact NH1-OE1 3.47Å
320	F	84.5	Confident	75.4	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.7	-176.4	-59.6	-73.4	0	0	0	111.2	L318 W322 T333 L384 I388 V391 L400 A403	L318-F320 HydrophobicContact CB-CE2 3.8Å; L318-F320 HydrophobicContact CB-CZ 3.9Å; L318-F320 HydrophobicContact CD1-CE2 4.39Å; L318-F320 HydrophobicContact CD1-CZ 3.92Å; F320-W322 HydrophobicContact CB-CZ2 4.08Å; F320-W322 PolarHBondContact O-NE1 2.85Å; F320-W322 VanDerWaalsContact O-NE1 3.12Å; F320-T333 PolarHBondContact N-O 2.8Å; F320-T333 PolarHBondContact O-N 3.31Å; F320-T333 PolarHBondContact O-OG1 3.48Å; F320-L384 HydrophobicContact CE1-CD1 4.13Å; F320-L384 HydrophobicContact CZ-CD1 4.21Å; F320-I388 HydrophobicContact CD1-CG1 4.07Å; F320-I388 HydrophobicContact CE1-CD1 4.1Å; F320-I388 HydrophobicContact CE1-CG1 3.4Å; F320-I388 VanDerWaalsContact CE1-CG1 3.4Å; F320-I388 HydrophobicContact CZ-CG1 3.88Å; F320-V391 HydrophobicContact CD2-CB 4.45Å; F320-V391 HydrophobicContact CD2-CG1 4.3Å; F320-V391 HydrophobicContact CD2-CG2 4.14Å; F320-V391 HydrophobicContact CE2-CG2 4.13Å; F320-L400 HydrophobicContact CB-CD1 3.67Å; F320-L400 HydrophobicContact CD1-CD1 3.89Å; F320-L400 HydrophobicContact CG-CD1 4.2Å; F320-A403 HydrophobicContact CD1-CB 3.67Å; F320-A403 HydrophobicContact CE1-CB 3.81Å
321	G	78.4	Confident	74.4	Confident	2 Å²	2	68.1 Å²	68.1	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	142.5	179	0	0	0	0	0	113.1	D332 L400 T401 S402	G321-D332 VanDerWaalsContact CA-OD1 3.31Å; G321-D332 WeakPolarHBondContact CA-OD1 3.4Å; G321-L400 WeakPolarHBondContact O-CA 3.49Å; G321-T401 PolarHBondContact O-N 3.1Å; G321-T401 PolarHBondContact O-OG1 3.43Å; G321-T401 VanDerWaalsContact O-OG1 3.09Å; G321-S402 PolarHBondContact N-O 2.89Å
322	W	75.7	Confident	73.7	Confident	11 Å²	11	68.5 Å²	68.5	4%	0.042	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.6	-168.3	-57.1	92.3	0	0	0	114.1	F320 P330 T333 V391 K392 T395 L400	F320-W322 HydrophobicContact CB-CZ2 4.08Å; F320-W322 PolarHBondContact O-NE1 2.85Å; F320-W322 VanDerWaalsContact O-NE1 3.12Å; W322-P330 HydrophobicContact CB-CG 3.91Å; W322-P330 HydrophobicContact CG-CG 4.46Å; W322-T333 PolarHBondContact NE1-OG1 2.9Å; W322-V391 HydrophobicContact CZ2-CB 4.43Å; W322-V391 HydrophobicContact CZ2-CG1 3.74Å; W322-K392 HydrophobicContact CH2-CB 3.92Å; W322-K392 HydrophobicContact CH2-CG 4.41Å; W322-K392 HydrophobicContact CZ3-CB 4.41Å; W322-K392 HydrophobicContact CZ3-CG 4.41Å; W322-T395 HydrophobicContact CZ2-CG2 4.43Å; W322-T395 WeakPolarHBondContact CZ2-OG1 3.49Å; W322-L400 HydrophobicContact CD2-CD1 4.41Å; W322-L400 HydrophobicContact CE3-CB 4.23Å; W322-L400 HydrophobicContact CE3-CD1 4.46Å; W322-L400 HydrophobicContact CH2-CB 4.38Å; W322-L400 HydrophobicContact CH2-CD1 4.04Å; W322-L400 HydrophobicContact CZ2-CD1 3.96Å; W322-L400 HydrophobicContact CZ3-CB 3.96Å; W322-L400 HydrophobicContact CZ3-CD1 4.31Å
323	A	65.7	Low	73.1	Confident	41 Å²	41	70.2 Å²	70.2	34%	0.339	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.2	167.7	0	0	0	0	0	112.2	R399 T401	A323-R399 PolarHBondContact N-O 2.85Å; A323-R399 PolarHBondContact O-N 2.92Å; A323-T401 HydrophobicContact CB-CG2 3.44Å; A323-T401 VanDerWaalsContact CB-CG2 3.44Å
324	W	61.1	Low	72.8	Confident	102 Å²	102	73.8 Å²	73.8	39%	0.386	35%	0.349	S	S	.	.			trans	-119.4	137.7	174.1	-93.5	94.8	0	0	0	111.4	R326 S396 S397	W324-R326 VanDerWaalsContact C-N 3.33Å; W324-R326 PolarHBondContact O-N 3.27Å; W324-S396 WeakPolarHBondContact CH2-O 3.32Å; W324-S396 WeakPolarHBondContact CZ2-O 3.39Å; W324-S397 VanDerWaalsContact CZ2-C 3.41Å
325	R	52.1	Low	72.5	Confident	241 Å²	241	75.3 Å²	75.3	91%	0.909	36%	0.357	S	S	*	.	S	Bend	trans	-72	-14	-173.9	-68.6	-166.2	-173.8	-134.7	8.9	115.7
326	R	53.3	Low	72.2	Confident	236 Å²	236	77 Å²	77	89%	0.891	37%	0.366	S	S	*	.	S	Bend	trans	-149.1	-0.9	-165.2	-65.1	-168.9	-175.7	175.1	4.1	118.5	W324	W324-R326 VanDerWaalsContact C-N 3.33Å; W324-R326 PolarHBondContact O-N 3.27Å
327	K	53.7	Low	71.9	Confident	180 Å²	180	78.1 Å²	78.1	78%	0.783	37%	0.371	S	S	*	.	S	Bend	trans	-143.4	169.2	177.8	-75	-168.9	178.7	179.4	0	110.5	C329	K327-C329 PolarHBondContact O-N 2.95Å
328	I	53.6	Low	71.4	Confident	163 Å²	163	76.5 Å²	76.5	84%	0.836	37%	0.365	S	S	*	.			trans	-42.1	131	172.6	-58.7	166.5	0	0	0	108.9
329	C	52.7	Low	70.7	Confident	83 Å²	83	80.3 Å²	80.3	56%	0.561	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-57.3	132.1	174.6	-56.9	0	0	0	0	108.7	K327	K327-C329 PolarHBondContact O-N 2.95Å
330	P	55.3	Low	70.4	Confident	45 Å²	45	83.6 Å²	83.6	29%	0.292	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-61.7	151.2	166.5	31.7	-35.1	0	0	0	108.4	W322	W322-P330 HydrophobicContact CB-CG 3.91Å; W322-P330 HydrophobicContact CG-CG 4.46Å
331	D	64.8	Low	70.4	Confident	121 Å²	121	86.5 Å²	86.5	65%	0.647	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-59	149.9	172.2	-51	-71.9	0	0	0	110	T333	D331-T333 PolarHBondContact O-N 3.31Å
332	D	75.3	Confident	70.9	Confident	64 Å²	64	87.3 Å²	87.3	34%	0.342	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-59.1	130.3	-178.4	-62.6	-36.8	0	0	0	110	R319 G321 I334	R319-D332 HydrophobicContact CG-CB 3.81Å; R319-D332 IonicContact CZ-OD2 3.32Å; R319-D332 IonicContact NE-OD2 3.26Å; R319-D332 PolarHBondContact NE-OD2 2.83Å; R319-D332 IonicContact NH2-OD2 3.62Å; R319-D332 PolarHBondContact NH2-OD2 2.98Å; G321-D332 VanDerWaalsContact CA-OD1 3.31Å; G321-D332 WeakPolarHBondContact CA-OD1 3.4Å; D332-I334 PolarHBondContact O-N 2.59Å
333	T	78.9	Confident	71.5	Confident	36 Å²	36	93.1 Å²	93.1	22%	0.221	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	111.4	-179.7	47.4	0	0	0	0	109.9	F320 W322 D331 V391 T395	F320-T333 PolarHBondContact N-O 2.8Å; F320-T333 PolarHBondContact O-N 3.31Å; F320-T333 PolarHBondContact O-OG1 3.48Å; W322-T333 PolarHBondContact NE1-OG1 2.9Å; D331-T333 PolarHBondContact O-N 3.31Å; T333-V391 HydrophobicContact CG2-CG1 4.08Å; T333-V391 WeakPolarHBondContact OG1-CG1 3.28Å; T333-T395 HydrophobicContact CG2-CG2 3.47Å; T333-T395 VanDerWaalsContact CG2-CG2 3.47Å
334	I	84.2	Confident	72.7	Confident	96 Å²	96	91.3 Å²	91.3	49%	0.492	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.7	174.1	-57.4	169.3	0	0	0	109.2	H317 L318 R319 D332	H317-I334 HydrophobicContact CB-CG2 4.34Å; L318-I334 CarbonylContact O-C 3.53Å; L318-I334 VanDerWaalsContact O-CA 3.31Å; L318-I334 WeakPolarHBondContact O-CA 3.21Å; R319-I334 HydrophobicContact CB-CG1 4.27Å; R319-I334 HydrophobicContact CG-CG1 4.08Å; D332-I334 PolarHBondContact O-N 2.59Å
335	L	85	Confident	74.1	Confident	32 Å²	32	87.8 Å²	87.8	17%	0.168	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.1	177.3	179.9	149.6	0	0	0	108.4	H317 L318 I337 L387 V391	H317-L335 CarbonylContact C-O 3.59Å; H317-L335 WeakPolarHBondContact CA-O 3.19Å; L318-L335 PolarHBondContact N-O 3.08Å; L318-L335 PolarHBondContact O-N 2.88Å; L335-I337 HydrophobicContact CD2-CG1 4.2Å; L335-L387 HydrophobicContact CD1-CD2 4.14Å; L335-L387 HydrophobicContact CD2-CD1 4.32Å; L335-L387 HydrophobicContact CD2-CD2 3.97Å; L335-V391 HydrophobicContact CD1-CG2 3.65Å
336	N	85.6	Confident	75.9	Confident	63 Å²	63	76.3 Å²	76.3	34%	0.337	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	124.5	169.8	-178.5	9.1	0	0	0	108.8	V316 T338	V316-N336 PolarHBondContact O-OD1 3.29Å; N336-T338 PolarHBondContact ND2-O 3.13Å; N336-T338 PolarHBondContact OD1-N 3.23Å; N336-T338 PolarHBondContact OD1-O 3.1Å; N336-T338 VanDerWaalsContact OD1-O 3.07Å; N336-T338 PolarHBondContact OD1-OG1 2.9Å; N336-T338 VanDerWaalsContact OD1-OG1 3.12Å
337	I	84	Confident	77.6	Confident	22 Å²	22	68 Å²	68	11%	0.113	36%	0.355	C	S	.	.	S	Bend	trans	-79.4	-34.1	176.1	-43.3	-179.1	0	0	0	110.5	V316 L318 L335 P339 F382 L387	V316-I337 HydrophobicContact CB-CB 4.45Å; V316-I337 HydrophobicContact CB-CD1 4.47Å; V316-I337 HydrophobicContact CG1-CD1 3.68Å; V316-I337 HydrophobicContact CG1-CG1 4.23Å; V316-I337 WeakPolarHBondContact O-CG1 3.28Å; V316-I337 PolarHBondContact O-N 2.82Å; L318-I337 HydrophobicContact CD1-CD1 3.69Å; L318-I337 HydrophobicContact CD1-CG1 4.05Å; L318-I337 HydrophobicContact CD2-CD1 4.33Å; L318-I337 HydrophobicContact CG-CD1 3.73Å; L318-I337 HydrophobicContact CG-CG1 4Å; L335-I337 HydrophobicContact CD2-CG1 4.2Å; I337-P339 WeakPolarHBondContact O-CD 3.36Å; I337-F382 HydrophobicContact CD1-CD1 3.54Å; I337-F382 HydrophobicContact CD1-CD2 3.89Å; I337-F382 HydrophobicContact CD1-CE1 3.49Å; I337-F382 VanDerWaalsContact CD1-CE1 3.49Å; I337-F382 HydrophobicContact CD1-CE2 3.84Å; I337-F382 HydrophobicContact CD1-CG 3.75Å; I337-F382 HydrophobicContact CD1-CZ 3.64Å; I337-F382 HydrophobicContact CG2-CB 4.01Å; I337-F382 HydrophobicContact CG2-CD1 4.1Å; I337-F382 HydrophobicContact CG2-CG 4.18Å; I337-L387 HydrophobicContact CD1-CD1 4.43Å; I337-L387 HydrophobicContact CG1-CD1 4.43Å
338	T	80.3	Confident	79	Confident	9 Å²	9	59.7 Å²	59.7	6%	0.055	32%	0.319	C	S	.	.			trans	-106.6	90.2	-172.3	52.2	0	0	0	0	110.4	N315 V316 N336 N340 I342 C380	N315-T338 WeakPolarHBondContact CA-OG1 3.48Å; V316-T338 HydrophobicContact CB-CG2 3.93Å; V316-T338 HydrophobicContact CG2-CG2 3.77Å; V316-T338 PolarHBondContact N-OG1 2.85Å; N336-T338 PolarHBondContact ND2-O 3.13Å; N336-T338 PolarHBondContact OD1-N 3.23Å; N336-T338 PolarHBondContact OD1-O 3.1Å; N336-T338 VanDerWaalsContact OD1-O 3.07Å; N336-T338 PolarHBondContact OD1-OG1 2.9Å; N336-T338 VanDerWaalsContact OD1-OG1 3.12Å; T338-N340 PolarHBondContact O-N 3.26Å; T338-I342 HydrophobicContact CG2-CD1 3.58Å; T338-I342 HydrophobicContact CG2-CG1 3.97Å; T338-C380 HydrophobicContact CG2-CB 4.41Å
339	P	73.3	Confident	80	Confident	80 Å²	80	57.8 Å²	57.8	52%	0.519	31%	0.307	S	S	.	.	S	Bend	trans	-64.8	-23.9	-180	26.9	-35.5	0	0	0	112.9	I337	I337-P339 WeakPolarHBondContact O-CD 3.36Å
340	N	81.2	Confident	80.8	Confident	129 Å²	129	54.6 Å²	54.6	69%	0.69	29%	0.285	S	S	*	.	S	Bend	trans	-111.8	134.9	167.6	-62.7	-24.9	0	0	0	108.2	T338	T338-N340 PolarHBondContact O-N 3.26Å
341	P	85.2	Confident	81.3	Confident	61 Å²	61	53 Å²	53	40%	0.396	28%	0.275	S	S	.	.			trans	-60.9	137.4	176.4	-22.5	32.1	0	0	0	112.7	S313 N315 R343	S313-P341 WeakPolarHBondContact OG-CB 3.5Å; N315-P341 WeakPolarHBondContact OD1-CG 3.48Å; P341-R343 PolarHBondContact O-N 3.06Å
342	I	87.6	Confident	81.6	Confident	18 Å²	18	49 Å²	49	9%	0.092	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	113.4	176.9	-65	176.6	0	0	0	108.5	F295 S313 V314 T338 I344 R377 C380	F295-I342 HydrophobicContact CD2-CG2 4.17Å; F295-I342 HydrophobicContact CE2-CD1 4.11Å; S313-I342 CarbonylContact C-O 3.57Å; S313-I342 WeakPolarHBondContact CA-O 3.39Å; S313-I342 WeakPolarHBondContact CB-O 3.44Å; V314-I342 PolarHBondContact N-O 2.86Å; V314-I342 PolarHBondContact O-N 3Å; T338-I342 HydrophobicContact CG2-CD1 3.58Å; T338-I342 HydrophobicContact CG2-CG1 3.97Å; I342-I344 HydrophobicContact CG2-CG2 4.35Å; I342-R377 WeakPolarHBondContact CG2-O 3.1Å; I342-C380 HydrophobicContact CD1-CB 3.58Å
343	R	89.5	Confident	81.7	Confident	134 Å²	134	48 Å²	48	51%	0.506	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	141.1	174.5	-66.2	-172.5	-172.4	-112.2	4.1	110.8	D311 A312 P341 V357	D311-R343 IonicContact OD1-NH1 2.97Å; D311-R343 PolarHBondContact OD1-NH1 2.66Å; D311-R343 IonicContact OD2-CZ 3.74Å; D311-R343 IonicContact OD2-NH1 2.63Å; D311-R343 PolarHBondContact OD2-NH1 3.16Å; A312-R343 WeakPolarHBondContact O-CA 3.42Å; P341-R343 PolarHBondContact O-N 3.06Å; R343-V357 HydrophobicContact CB-CG1 4.06Å; R343-V357 HydrophobicContact CB-CG2 4.07Å
344	I	90.1	Very high	81.8	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	157.7	-177.7	56.7	168.4	0	0	0	110.7	F295 F298 A312 V314 I342 V357 V409 L608	F295-I344 HydrophobicContact CB-CG2 3.49Å; F295-I344 VanDerWaalsContact CB-CG2 3.49Å; F295-I344 HydrophobicContact CG-CG2 4.1Å; F298-I344 HydrophobicContact CB-CD1 3.7Å; F298-I344 HydrophobicContact CB-CG1 4.45Å; A312-I344 HydrophobicContact CB-CD1 4.4Å; A312-I344 HydrophobicContact CB-CG1 4Å; A312-I344 WeakPolarHBondContact O-CG1 3.17Å; A312-I344 PolarHBondContact O-N 2.93Å; V314-I344 HydrophobicContact CG2-CD1 3.54Å; V314-I344 HydrophobicContact CG2-CG1 4.15Å; V314-I344 HydrophobicContact CG2-CG2 3.95Å; I342-I344 HydrophobicContact CG2-CG2 4.35Å; I344-V357 WeakPolarHBondContact O-CG2 3.38Å; I344-V409 HydrophobicContact CD1-CG1 4.38Å; I344-L608 HydrophobicContact CD1-CD1 3.53Å
345	N	90.8	Very high	81.7	Confident	28 Å²	28	44.4 Å²	44.4	15%	0.15	24%	0.237	C	C	.	.			trans	-68.5	147	176.1	-62	-32	0	0	0	110.4	G297 F298 Y347 S355 L356 V357	G297-N345 CarbonylContact C-O 3.54Å; G297-N345 WeakPolarHBondContact CA-O 3.37Å; F298-N345 PolarHBondContact N-O 2.99Å; N345-Y347 HydrophobicContact CB-CD2 4.45Å; N345-Y347 HydrophobicContact CB-CE2 3.59Å; N345-Y347 PolarHBondContact ND2-OH 2.83Å; N345-S355 CarbonylContact C-O 3.57Å; N345-S355 VanDerWaalsContact CA-O 3.32Å; N345-S355 WeakPolarHBondContact CA-O 3.46Å; N345-L356 HydrophobicContact CB-CD2 4Å; N345-L356 WeakPolarHBondContact OD1-CA 3.31Å; N345-V357 PolarHBondContact OD1-N 3.2Å
346	C	89.6	Confident	81.4	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.007	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.9	175.4	-48.4	0	0	0	0	109.9	F298 T309 A312 T354 S355	F298-C346 CarbonylContact O-C 3.52Å; F298-C346 WeakPolarHBondContact O-CA 3.44Å; T309-C346 HydrophobicContact CG2-CB 4.29Å; T309-C346 WeakPolarHBondContact O-CB 3.42Å; A312-C346 VanDerWaalsContact CB-SG 3.55Å; C346-T354 CarbonylContact O-C 3.59Å; C346-T354 VanDerWaalsContact O-CA 3.3Å; C346-T354 WeakPolarHBondContact O-CA 3.19Å; C346-S355 PolarHBondContact N-O 3.25Å; C346-S355 PolarHBondContact O-N 2.79Å
347	Y	89.3	Confident	80.7	Confident	62 Å²	62	44.3 Å²	44.3	24%	0.243	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	132.6	-178.6	-60.9	-78	0	0	0	111	F298 Y299 D300 N345 T354 L356	F298-Y347 PolarHBondContact O-N 3.18Å; Y299-Y347 CarbonylContact C-O 3.58Å; Y299-Y347 VanDerWaalsContact CA-O 3.32Å; Y299-Y347 WeakPolarHBondContact CA-O 3.22Å; Y299-Y347 HydrophobicContact CD1-CD2 4.22Å; Y299-Y347 HydrophobicContact CD1-CG 4.23Å; Y299-Y347 AromaticContact CE1-CD2 3.68Å; Y299-Y347 HydrophobicContact CE1-CD2 3.68Å; Y299-Y347 AromaticContact CE1-CG 3.81Å; Y299-Y347 HydrophobicContact CE1-CG 3.81Å; Y299-Y347 AromaticContact CE2-CD2 3.97Å; Y299-Y347 HydrophobicContact CE2-CD2 3.97Å; Y299-Y347 AromaticContact CZ-CD2 3.53Å; D300-Y347 PolarHBondContact N-O 3.32Å; N345-Y347 HydrophobicContact CB-CD2 4.45Å; N345-Y347 HydrophobicContact CB-CE2 3.59Å; N345-Y347 PolarHBondContact ND2-OH 2.83Å; Y347-T354 HydrophobicContact CD1-CG2 3.77Å; Y347-T354 HydrophobicContact CE1-CG2 4.26Å; Y347-L356 HydrophobicContact CE1-CD2 4.25Å
348	S	82.9	Confident	79.5	Confident	4 Å²	4	49.5 Å²	49.5	3%	0.028	27%	0.266	C	S	.	.			trans	-120.1	91.7	-175.5	-160.7	0	0	0	0	111.6	D300 S350 T351 G352 Y353	D300-S348 WeakPolarHBondContact OD2-CB 3.46Å; D300-S348 PolarHBondContact OD2-OG 3.28Å; S348-S350 PolarHBondContact O-N 2.9Å; S348-T351 WeakPolarHBondContact CB-OG1 3.15Å; S348-T351 PolarHBondContact O-N 3.13Å; S348-T351 VanDerWaalsContact O-N 3.13Å; S348-T351 PolarHBondContact OG-OG1 3.16Å; S348-G352 PolarHBondContact O-N 2.8Å; S348-Y353 WeakPolarHBondContact CB-O 3.37Å; S348-Y353 PolarHBondContact N-O 2.93Å
349	H	74.7	Confident	77.9	Confident	123 Å²	123	52.8 Å²	52.8	57%	0.569	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-36	-178.8	-72.4	-67.9	0	0	0	113.1	Y299 T351	Y299-H349 AromaticContact CD1-NE2 3.36Å; Y299-H349 WeakPolarHBondContact CD1-NE2 3.44Å; H349-T351 VanDerWaalsContact C-N 3.34Å; H349-T351 PolarHBondContact O-N 2.83Å
350	S	68.7	Low	76.1	Confident	16 Å²	16	54 Å²	54	11%	0.112	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-18.5	-177.9	51.8	0	0	0	0	114.1	M305 S348	M305-S350 VanDerWaalsContact CE-O 3.24Å; M305-S350 WeakPolarHBondContact CE-O 3.39Å; S348-S350 PolarHBondContact O-N 2.9Å
351	T	66	Low	74.1	Confident	13 Å²	13	53.5 Å²	53.5	8%	0.08	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-13.6	-171.3	70.7	0	0	0	0	114.9	S348 H349 Y353 W416	S348-T351 WeakPolarHBondContact CB-OG1 3.15Å; S348-T351 PolarHBondContact O-N 3.13Å; S348-T351 VanDerWaalsContact O-N 3.13Å; S348-T351 PolarHBondContact OG-OG1 3.16Å; H349-T351 VanDerWaalsContact C-N 3.34Å; H349-T351 PolarHBondContact O-N 2.83Å; T351-Y353 PolarHBondContact O-N 3.05Å; T351-Y353 WeakPolarHBondContact OG1-CB 3.43Å; T351-Y353 PolarHBondContact OG1-N 2.95Å; T351-W416 HydrophobicContact CG2-CZ2 4.24Å
352	G	71.6	Confident	71.5	Confident	36 Å²	36	57.4 Å²	57.4	37%	0.371	32%	0.323	S	S	.	.			trans	73.9	4.1	-174	0	0	0	0	0	114.2	S348	S348-G352 PolarHBondContact O-N 2.8Å
353	Y	78.1	Confident	69.1	Low	42 Å²	42	60.9 Å²	60.9	17%	0.165	35%	0.35	C	S	.	.			trans	-72.5	142.7	176.9	-174.7	-94.2	0	0	0	111.4	V308 V310 S348 T351 L489	V308-Y353 HydrophobicContact CG2-CD1 3.2Å; V308-Y353 HydrophobicContact CG2-CE1 3.91Å; V308-Y353 HydrophobicContact CG2-CG 3.59Å; V310-Y353 HydrophobicContact CG1-CE1 4.14Å; S348-Y353 WeakPolarHBondContact CB-O 3.37Å; S348-Y353 PolarHBondContact N-O 2.93Å; T351-Y353 PolarHBondContact O-N 3.05Å; T351-Y353 WeakPolarHBondContact OG1-CB 3.43Å; T351-Y353 PolarHBondContact OG1-N 2.95Å; Y353-L489 HydrophobicContact CE2-CD1 4Å
354	T	80.4	Confident	66.4	Low	27 Å²	27	61.9 Å²	61.9	17%	0.166	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	140.7	172.4	65.6	0	0	0	0	109.8	C346 Y347	C346-T354 CarbonylContact O-C 3.59Å; C346-T354 VanDerWaalsContact O-CA 3.3Å; C346-T354 WeakPolarHBondContact O-CA 3.19Å; Y347-T354 HydrophobicContact CD1-CG2 3.77Å; Y347-T354 HydrophobicContact CE1-CG2 4.26Å
355	S	82.2	Confident	63.8	Low	30 Å²	30	68.6 Å²	68.6	21%	0.21	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.2	170.3	-171.1	0	0	0	0	108.6	V310 N345 C346	V310-S355 VanDerWaalsContact O-CB 3.28Å; V310-S355 WeakPolarHBondContact O-CB 3.41Å; V310-S355 PolarHBondContact O-OG 3.45Å; N345-S355 CarbonylContact C-O 3.57Å; N345-S355 VanDerWaalsContact CA-O 3.32Å; N345-S355 WeakPolarHBondContact CA-O 3.46Å; C346-S355 PolarHBondContact N-O 3.25Å; C346-S355 PolarHBondContact O-N 2.79Å
356	L	79.1	Confident	61.3	Low	71 Å²	71	74.7 Å²	74.7	37%	0.372	43%	0.433	S	S	.	.			trans	-115.8	127.3	-172.7	-59.4	179	0	0	0	111.2	N345 Y347 N358 S359	N345-L356 HydrophobicContact CB-CD2 4Å; N345-L356 WeakPolarHBondContact OD1-CA 3.31Å; Y347-L356 HydrophobicContact CE1-CD2 4.25Å; L356-N358 PolarHBondContact O-N 3.02Å; L356-S359 PolarHBondContact O-N 2.76Å; L356-S359 PolarHBondContact O-OG 2.95Å
357	V	70.6	Confident	58.6	Low	23 Å²	23	82.8 Å²	82.8	14%	0.139	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.2	-175.2	178.1	0	0	0	0	113.7	R343 I344 N345 R377	R343-V357 HydrophobicContact CB-CG1 4.06Å; R343-V357 HydrophobicContact CB-CG2 4.07Å; I344-V357 WeakPolarHBondContact O-CG2 3.38Å; N345-V357 PolarHBondContact OD1-N 3.2Å; V357-R377 HydrophobicContact CG1-CB 4.28Å; V357-R377 PolarHBondContact O-NH1 3.12Å
358	N	58.9	Low	56	Low	131 Å²	131	85.3 Å²	85.3	70%	0.701	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	9.9	-178.3	-63.6	-19.8	0	0	0	113.8	L356	L356-N358 PolarHBondContact O-N 3.02Å
359	S	46.7	Very low	53.6	Low	78 Å²	78	92 Å²	92	55%	0.545	54%	0.544	S	S	.	.			trans	-62.2	124.1	170	-51.2	0	0	0	0	109.8	L356	L356-S359 PolarHBondContact O-N 2.76Å; L356-S359 PolarHBondContact O-OG 2.95Å
360	P	35.7	Very low	51.6	Low	106 Å²	106	93 Å²	93	69%	0.688	56%	0.559	S	S	*	*			trans	-69.2	139.2	-178.1	27.4	-34	0	0	0	111.2	T362	P360-T362 PolarHBondContact O-N 3.22Å; P360-T362 VanDerWaalsContact O-N 3.12Å
361	P	37.4	Very low	49.6	Very low	117 Å²	117	97 Å²	97	76%	0.76	59%	0.594	S	S	*	*			trans	-73	105.5	-178.9	29.2	-33.9	0	0	0	111.2	S363	P361-S363 VanDerWaalsContact C-N 3.33Å; P361-S363 PolarHBondContact O-N 3.18Å; P361-S363 VanDerWaalsContact O-N 3.08Å
362	T	31.6	Very low	47.9	Very low	143 Å²	143	103 Å²	103	88%	0.877	63%	0.63	S	S	*	*			trans	-83.1	73.6	175.8	55.1	0	0	0	0	111.7	P360	P360-T362 PolarHBondContact O-N 3.22Å; P360-T362 VanDerWaalsContact O-N 3.12Å
363	S	37.7	Very low	45.9	Very low	92 Å²	92	107 Å²	107	64%	0.643	65%	0.648	S	S	*	*			trans	-147.6	121.5	166.6	57.2	0	0	0	0	110.2	P361	P361-S363 VanDerWaalsContact C-N 3.33Å; P361-S363 PolarHBondContact O-N 3.18Å; P361-S363 VanDerWaalsContact O-N 3.08Å
364	N	32.4	Very low	43.8	Very low	155 Å²	155	111.5 Å²	111.5	83%	0.829	68%	0.675	S	S	*	*			trans	-65.9	157.1	173.3	-65.1	-21.2	0	0	0	110.9
365	N	35.3	Very low	41.6	Very low	143 Å²	143	116.4 Å²	116.4	77%	0.765	70%	0.704	S	S	*	*			trans	80.8	110.9	-173.4	-46	-10.4	0	0	0	111.3
366	D	38.1	Very low	40.2	Very low	155 Å²	155	119.7 Å²	119.7	83%	0.829	72%	0.723	S	S	*	*			cis	-149.9	157.4	43.7	-79.1	-40.1	0	0	0	114.1	S368	D366-S368 PolarHBondContact O-N 3.13Å
367	N	33.1	Very low	39.5	Very low	172 Å²	172	124.8 Å²	124.8	92%	0.92	74%	0.738	S	S	*	*			trans	-81.2	110	178.9	-72.4	-38.5	0	0	0	112.6
368	S	35.7	Very low	40	Very low	115 Å²	115	125.4 Å²	125.4	80%	0.804	74%	0.742	S	S	*	*			trans	-149.1	130	153.5	59.3	0	0	0	0	112	D366	D366-S368 PolarHBondContact O-N 3.13Å
369	T	30.6	Very low	41.3	Very low	145 Å²	145	120 Å²	120	89%	0.89	72%	0.716	S	S	*	*			trans	-103.9	107.7	-171.5	23.7	0	0	0	0	112.5
370	T	33.4	Very low	43.3	Very low	142 Å²	142	116.8 Å²	116.8	87%	0.871	69%	0.693	S	S	*	*			trans	-149.9	121.2	151.9	45.2	0	0	0	0	109.9
371	A	27.9	Very low	45.8	Very low	102 Å²	102	116.5 Å²	116.5	84%	0.843	68%	0.678	S	S	*	*			trans	-108	116.1	175	0	0	0	0	0	110.6
372	T	30.4	Very low	48.1	Very low	137 Å²	137	111.5 Å²	111.5	84%	0.84	64%	0.644	S	S	*	*			trans	-141.4	124	160.4	42.2	0	0	0	0	109.9
373	T	28.3	Very low	50.8	Low	121 Å²	121	105.6 Å²	105.6	74%	0.742	61%	0.609	S	S	*	*			trans	-42.1	135.7	168.6	49.8	0	0	0	0	113.9
374	N	33.7	Very low	52.9	Low	137 Å²	137	101.5 Å²	101.5	73%	0.733	58%	0.58	S	S	*	*				-177.9	146.7	108.9	-88.4	-19.3	0	0	0	114.2
375	T	35.4	Very low	55.1	Low	129 Å²	129	96.9 Å²	96.9	79%	0.791	56%	0.557	S	S	*	*			trans	-60.5	129.8	169.6	6.7	0	0	0	0	112.1
376	T	52.4	Low	57.4	Low	99 Å²	99	94.9 Å²	94.9	61%	0.607	55%	0.547	S	S	*	.			trans	155.9	70.4	141.2	49.6	0	0	0	0	110.5	T378 A379	T376-T378 VanDerWaalsContact C-N 3.29Å; T376-T378 PolarHBondContact O-N 3.16Å; T376-A379 HydrophobicContact CG2-CB 4.1Å
377	R	64.8	Low	59.5	Low	178 Å²	178	88.8 Å²	88.8	67%	0.672	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-15	174.9	-90.8	-172	174.4	178.4	-0.5	114.4	I342 V357	I342-R377 WeakPolarHBondContact CG2-O 3.1Å; V357-R377 HydrophobicContact CG1-CB 4.28Å; V357-R377 PolarHBondContact O-NH1 3.12Å
378	T	80.5	Confident	61.7	Low	36 Å²	36	80.8 Å²	80.8	22%	0.221	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	16.1	-169.4	56.1	0	0	0	0	113.7	F295 T376	F295-T378 WeakPolarHBondContact CD2-O 3.32Å; F295-T378 PolarHBondContact N-O 2.96Å; T376-T378 VanDerWaalsContact C-N 3.29Å; T376-T378 PolarHBondContact O-N 3.16Å
379	A	86.2	Confident	63.7	Low	19 Å²	19	78.3 Å²	78.3	16%	0.157	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	151.5	-175	0	0	0	0	0	113.6	L293 I294 T376	L293-A379 CarbonylContact O-C 3.49Å; L293-A379 VanDerWaalsContact O-CA 3.28Å; L293-A379 WeakPolarHBondContact O-CA 3.31Å; I294-A379 HydrophobicContact CB-CB 4.5Å; I294-A379 HydrophobicContact CG1-CB 4.04Å; I294-A379 HydrophobicContact CG2-CB 4.49Å; T376-A379 HydrophobicContact CG2-CB 4.1Å
380	C	87.9	Confident	65.9	Low	10 Å²	10	76.1 Å²	76.1	7%	0.068	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	118.8	176	-171.8	0	0	0	0	110.2	E292 L293 F295 V316 T338 I342	E292-C380 CarbonylContact C-O 3.52Å; E292-C380 WeakPolarHBondContact CA-O 3.48Å; L293-C380 HydrophobicContact CB-CB 4.47Å; L293-C380 PolarHBondContact N-O 2.94Å; L293-C380 PolarHBondContact O-N 3.01Å; F295-C380 HydrophobicContact CE2-CB 4.41Å; V316-C380 HydrophobicContact CG2-CB 4.46Å; T338-C380 HydrophobicContact CG2-CB 4.41Å; I342-C380 HydrophobicContact CD1-CB 3.58Å
381	R	88.3	Confident	67.9	Low	99 Å²	99	69.8 Å²	69.8	37%	0.374	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	131.3	-177.8	-175.2	168.4	168.9	160	-5.3	111.5	E290 L291 E292 H615	E290-R381 HydrophobicContact CB-CG 4.44Å; E290-R381 IonicContact OE2-CZ 2.68Å; E290-R381 IonicContact OE2-NE 3.78Å; E290-R381 PolarHBondContact OE2-NE 2.88Å; E290-R381 IonicContact OE2-NH2 3.13Å; E290-R381 PolarHBondContact OE2-NH2 3.47Å; L291-R381 CarbonylContact O-C 3.55Å; L291-R381 VanDerWaalsContact O-CA 3.29Å; L291-R381 WeakPolarHBondContact O-CA 3.36Å; E292-R381 HydrophobicContact CB-CB 4.2Å; E292-R381 HydrophobicContact CB-CG 4.14Å; E292-R381 HydrophobicContact CG-CB 4.15Å; E292-R381 IonicContact OE2-NH1 2.72Å; R381-H615 VanDerWaalsContact CZ-CD2 3.5Å; R381-H615 PolarHBondContact NH1-CE1 3.39Å; R381-H615 PolarHBondContact NH1-ND1 3.24Å; R381-H615 PolarHBondContact NH1-NE2 3.37Å
382	F	87.5	Confident	69.9	Low	13 Å²	13	70 Å²	70	6%	0.057	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	146.6	-173.7	57.7	-88.8	0	0	0	114	L291 L293 L318 I337 L387	L291-F382 HydrophobicContact CB-CD2 4.47Å; L291-F382 HydrophobicContact CB-CE2 4.07Å; L291-F382 HydrophobicContact CB-CZ 4.09Å; L291-F382 HydrophobicContact CD1-CE2 4.13Å; L291-F382 HydrophobicContact CD1-CZ 4.48Å; L291-F382 PolarHBondContact N-O 3.31Å; L291-F382 PolarHBondContact O-N 2.84Å; L293-F382 HydrophobicContact CD1-CE1 3.98Å; L293-F382 HydrophobicContact CD1-CZ 4.34Å; L293-F382 HydrophobicContact CG-CE1 4.11Å; L318-F382 HydrophobicContact CD1-CD2 4.49Å; L318-F382 HydrophobicContact CD1-CE2 4.21Å; I337-F382 HydrophobicContact CD1-CD1 3.54Å; I337-F382 HydrophobicContact CD1-CD2 3.89Å; I337-F382 HydrophobicContact CD1-CE1 3.49Å; I337-F382 VanDerWaalsContact CD1-CE1 3.49Å; I337-F382 HydrophobicContact CD1-CE2 3.84Å; I337-F382 HydrophobicContact CD1-CG 3.75Å; I337-F382 HydrophobicContact CD1-CZ 3.64Å; I337-F382 HydrophobicContact CG2-CB 4.01Å; I337-F382 HydrophobicContact CG2-CD1 4.1Å; I337-F382 HydrophobicContact CG2-CG 4.18Å; F382-L387 HydrophobicContact CB-CD1 4.1Å; F382-L387 HydrophobicContact CD2-CD1 3.88Å; F382-L387 HydrophobicContact CG-CD1 4.28Å
383	S	86.5	Confident	71.3	Confident	19 Å²	19	74.2 Å²	74.2	13%	0.133	37%	0.372	C	S	.	.			trans	-85.9	113.5	168.1	-171.3	0	0	0	0	111.9	Q289 T385 D386 L387	Q289-S383 VanDerWaalsContact O-CB 3.25Å; Q289-S383 WeakPolarHBondContact O-CB 3.49Å; Q289-S383 PolarHBondContact O-OG 3.07Å; S383-T385 PolarHBondContact O-N 3.31Å; S383-D386 PolarHBondContact O-N 2.95Å; S383-L387 WeakPolarHBondContact O-CG 3.43Å; S383-L387 PolarHBondContact O-N 3.03Å
384	L	82.1	Confident	72.9	Confident	5 Å²	5	74.7 Å²	74.7	3%	0.026	37%	0.37	C	S	.	.	H	α-helix	trans	-63.5	-29.5	175.4	-175.8	60	0	0	0	112.2	L291 L318 F320 I388 L505 I506 L521	L291-L384 HydrophobicContact CD1-CB 4.24Å; L291-L384 HydrophobicContact CD1-CD2 4.18Å; L318-L384 HydrophobicContact CD1-CD1 4.17Å; F320-L384 HydrophobicContact CE1-CD1 4.13Å; F320-L384 HydrophobicContact CZ-CD1 4.21Å; L384-I388 HydrophobicContact CD1-CD1 4.11Å; L384-I388 HydrophobicContact CD1-CG1 4.36Å; L384-I388 HydrophobicContact CG-CD1 3.92Å; L384-I388 WeakPolarHBondContact O-CB 3.32Å; L384-I388 WeakPolarHBondContact O-CD1 3.35Å; L384-I388 WeakPolarHBondContact O-CG1 3.3Å; L384-I388 PolarHBondContact O-N 3.42Å; L384-L505 HydrophobicContact CD1-CD1 4.26Å; L384-L505 HydrophobicContact CD2-CD1 4.47Å; L384-I506 HydrophobicContact CD2-CD1 4.08Å; L384-L521 HydrophobicContact CD2-CD1 3.95Å
385	T	78.5	Confident	74.1	Confident	58 Å²	58	69 Å²	69	36%	0.356	34%	0.34	S	S	.	.	H	α-helix	trans	-66.5	-46.1	178.1	-67.3	0	0	0	0	111.4	S383 I388 N389	S383-T385 PolarHBondContact O-N 3.31Å; T385-I388 PolarHBondContact O-N 2.95Å; T385-N389 VanDerWaalsContact O-CG 3.3Å; T385-N389 PolarHBondContact O-N 2.93Å; T385-N389 PolarHBondContact O-ND2 3.43Å
386	D	83.2	Confident	75	Confident	102 Å²	102	67 Å²	67	55%	0.545	33%	0.332	S	S	.	.	H	α-helix	trans	-73.5	-37.5	-178.5	-71.3	-27.5	0	0	0	112.7	S383 I388 N389 Q390	S383-D386 PolarHBondContact O-N 2.95Å; D386-I388 PolarHBondContact O-N 3.02Å; D386-N389 PolarHBondContact O-N 3.02Å; D386-N389 VanDerWaalsContact O-N 3.16Å; D386-Q390 WeakPolarHBondContact O-CB 3.45Å; D386-Q390 PolarHBondContact O-N 3.25Å
387	L	83.8	Confident	75.2	Confident	26 Å²	26	67 Å²	67	14%	0.136	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-43.3	171.8	-65.8	177.8	0	0	0	111.5	L318 L335 I337 F382 S383 N389 Q390 V391	L318-L387 HydrophobicContact CD1-CD1 3.61Å; L335-L387 HydrophobicContact CD1-CD2 4.14Å; L335-L387 HydrophobicContact CD2-CD1 4.32Å; L335-L387 HydrophobicContact CD2-CD2 3.97Å; I337-L387 HydrophobicContact CD1-CD1 4.43Å; I337-L387 HydrophobicContact CG1-CD1 4.43Å; F382-L387 HydrophobicContact CB-CD1 4.1Å; F382-L387 HydrophobicContact CD2-CD1 3.88Å; F382-L387 HydrophobicContact CG-CD1 4.28Å; S383-L387 WeakPolarHBondContact O-CG 3.43Å; S383-L387 PolarHBondContact O-N 3.03Å; L387-N389 VanDerWaalsContact C-N 3.33Å; L387-N389 PolarHBondContact O-N 3.38Å; L387-Q390 PolarHBondContact O-N 2.94Å; L387-V391 WeakPolarHBondContact O-CG2 3.38Å; L387-V391 PolarHBondContact O-N 2.8Å
388	I	78.8	Confident	75	Confident	4 Å²	4	59 Å²	59	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-40.1	173.8	-72.7	168.3	0	0	0	111.3	F320 L384 T385 D386 K392 L400 I506	F320-I388 HydrophobicContact CD1-CG1 4.07Å; F320-I388 HydrophobicContact CE1-CD1 4.1Å; F320-I388 HydrophobicContact CE1-CG1 3.4Å; F320-I388 VanDerWaalsContact CE1-CG1 3.4Å; F320-I388 HydrophobicContact CZ-CG1 3.88Å; L384-I388 HydrophobicContact CD1-CD1 4.11Å; L384-I388 HydrophobicContact CD1-CG1 4.36Å; L384-I388 HydrophobicContact CG-CD1 3.92Å; L384-I388 WeakPolarHBondContact O-CB 3.32Å; L384-I388 WeakPolarHBondContact O-CD1 3.35Å; L384-I388 WeakPolarHBondContact O-CG1 3.3Å; L384-I388 PolarHBondContact O-N 3.42Å; T385-I388 PolarHBondContact O-N 2.95Å; D386-I388 PolarHBondContact O-N 3.02Å; I388-K392 WeakPolarHBondContact O-CB 3.41Å; I388-K392 PolarHBondContact O-N 3.42Å; I388-L400 HydrophobicContact CD1-CD2 4.1Å; I388-L400 HydrophobicContact CG1-CD2 4.43Å; I388-L400 HydrophobicContact CG2-CD2 4.37Å; I388-I506 HydrophobicContact CD1-CD1 3.81Å
389	N	77.2	Confident	74.4	Confident	64 Å²	64	64.6 Å²	64.6	34%	0.342	33%	0.326	S	S	.	.	H	α-helix	trans	-66.1	-47.5	177.8	-75	-34.7	0	0	0	111.6	T385 D386 L387 V391 K392 W393	T385-N389 VanDerWaalsContact O-CG 3.3Å; T385-N389 PolarHBondContact O-N 2.93Å; T385-N389 PolarHBondContact O-ND2 3.43Å; D386-N389 PolarHBondContact O-N 3.02Å; D386-N389 VanDerWaalsContact O-N 3.16Å; L387-N389 VanDerWaalsContact C-N 3.33Å; L387-N389 PolarHBondContact O-N 3.38Å; N389-V391 PolarHBondContact O-N 3.26Å; N389-K392 WeakPolarHBondContact O-CB 3.47Å; N389-K392 PolarHBondContact O-N 3.16Å; N389-W393 PolarHBondContact O-N 3.36Å; N389-W393 VanDerWaalsContact O-N 3.08Å
390	Q	77.2	Confident	73.8	Confident	99 Å²	99	63.8 Å²	63.8	46%	0.463	32%	0.319	S	S	.	.	H	α-helix	trans	-56.6	-49.4	178.1	-171.1	-174	36.6	0	0	111.4	D386 L387 K392 W393	D386-Q390 WeakPolarHBondContact O-CB 3.45Å; D386-Q390 PolarHBondContact O-N 3.25Å; L387-Q390 PolarHBondContact O-N 2.94Å; Q390-K392 VanDerWaalsContact C-N 3.35Å; Q390-K392 PolarHBondContact O-N 2.93Å; Q390-W393 PolarHBondContact O-N 3.1Å
391	V	74.9	Confident	73.2	Confident	8 Å²	8	65 Å²	65	5%	0.048	33%	0.326	C	S	.	.	H	α-helix	trans	-67.1	-35.7	178.4	179.8	0	0	0	0	111.7	F320 W322 T333 L335 L387 N389 W393 N394 T395	F320-V391 HydrophobicContact CD2-CB 4.45Å; F320-V391 HydrophobicContact CD2-CG1 4.3Å; F320-V391 HydrophobicContact CD2-CG2 4.14Å; F320-V391 HydrophobicContact CE2-CG2 4.13Å; W322-V391 HydrophobicContact CZ2-CB 4.43Å; W322-V391 HydrophobicContact CZ2-CG1 3.74Å; T333-V391 HydrophobicContact CG2-CG1 4.08Å; T333-V391 WeakPolarHBondContact OG1-CG1 3.28Å; L335-V391 HydrophobicContact CD1-CG2 3.65Å; L387-V391 WeakPolarHBondContact O-CG2 3.38Å; L387-V391 PolarHBondContact O-N 2.8Å; N389-V391 PolarHBondContact O-N 3.26Å; V391-W393 VanDerWaalsContact C-N 3.32Å; V391-W393 PolarHBondContact O-N 3.06Å; V391-N394 WeakPolarHBondContact O-CA 3.13Å; V391-N394 WeakPolarHBondContact O-CB 3.42Å; V391-N394 PolarHBondContact O-N 3.47Å; V391-T395 HydrophobicContact CG1-CG2 4.39Å; V391-T395 PolarHBondContact O-N 3.08Å; V391-T395 PolarHBondContact O-OG1 3.46Å
392	K	69.9	Low	72.8	Confident	108 Å²	108	62.1 Å²	62.1	47%	0.47	32%	0.321	S	S	.	.	H	α-helix	trans	-65.4	-29.5	177.1	-177.8	-174.4	170.2	-159	0	113.7	W322 I388 N389 Q390 N394	W322-K392 HydrophobicContact CH2-CB 3.92Å; W322-K392 HydrophobicContact CH2-CG 4.41Å; W322-K392 HydrophobicContact CZ3-CB 4.41Å; W322-K392 HydrophobicContact CZ3-CG 4.41Å; I388-K392 WeakPolarHBondContact O-CB 3.41Å; I388-K392 PolarHBondContact O-N 3.42Å; N389-K392 WeakPolarHBondContact O-CB 3.47Å; N389-K392 PolarHBondContact O-N 3.16Å; Q390-K392 VanDerWaalsContact C-N 3.35Å; Q390-K392 PolarHBondContact O-N 2.93Å; K392-N394 VanDerWaalsContact C-N 3.33Å
393	W	61.2	Low	72.6	Confident	224 Å²	224	61.5 Å²	61.5	85%	0.848	32%	0.318	S	S	*	.	H	α-helix	trans	-66.9	-36	170.4	-76.1	107.5	0	0	0	111.6	N389 Q390 V391	N389-W393 PolarHBondContact O-N 3.36Å; N389-W393 VanDerWaalsContact O-N 3.08Å; Q390-W393 PolarHBondContact O-N 3.1Å; V391-W393 VanDerWaalsContact C-N 3.32Å; V391-W393 PolarHBondContact O-N 3.06Å
394	N	60.7	Low	72.7	Confident	131 Å²	131	62.8 Å²	62.8	70%	0.701	32%	0.322	S	S	*	.	H	α-helix	trans	-72.9	-37.8	175	-64.3	-27	0	0	0	112.1	V391 K392 S396	V391-N394 WeakPolarHBondContact O-CA 3.13Å; V391-N394 WeakPolarHBondContact O-CB 3.42Å; V391-N394 PolarHBondContact O-N 3.47Å; K392-N394 VanDerWaalsContact C-N 3.33Å; N394-S396 VanDerWaalsContact C-N 3.31Å; N394-S396 PolarHBondContact O-N 2.98Å
395	T	58.9	Low	73.1	Confident	17 Å²	17	62.6 Å²	62.6	10%	0.104	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	40.8	-178.5	59.1	0	0	0	0	114.9	W322 T333 V391 S397 G398	W322-T395 HydrophobicContact CZ2-CG2 4.43Å; W322-T395 WeakPolarHBondContact CZ2-OG1 3.49Å; T333-T395 HydrophobicContact CG2-CG2 3.47Å; T333-T395 VanDerWaalsContact CG2-CG2 3.47Å; V391-T395 HydrophobicContact CG1-CG2 4.39Å; V391-T395 PolarHBondContact O-N 3.08Å; V391-T395 PolarHBondContact O-OG1 3.46Å; T395-S397 VanDerWaalsContact C-N 3.32Å; T395-S397 PolarHBondContact O-N 3.07Å; T395-G398 PolarHBondContact O-N 2.82Å
396	S	54.5	Low	73.6	Confident	89 Å²	89	60.7 Å²	60.7	62%	0.622	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	10	52.1	169.4	62.3	0	0	0	0	120.6	W324 N394	W324-S396 WeakPolarHBondContact CH2-O 3.32Å; W324-S396 WeakPolarHBondContact CZ2-O 3.39Å; N394-S396 VanDerWaalsContact C-N 3.31Å; N394-S396 PolarHBondContact O-N 2.98Å
397	S	55.8	Low	74	Confident	99 Å²	99	55.8 Å²	55.8	69%	0.692	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	98	24.3	176.2	-34	0	0	0	0	118.8	W324 T395	W324-S397 VanDerWaalsContact CZ2-C 3.41Å; T395-S397 VanDerWaalsContact C-N 3.32Å; T395-S397 PolarHBondContact O-N 3.07Å
398	G	61.9	Low	74.3	Confident	10 Å²	10	57.1 Å²	57.1	10%	0.103	29%	0.288	C	S	.	.			trans	-67.4	152.6	168	0	0	0	0	0	114.1	T395	T395-G398 PolarHBondContact O-N 2.82Å
399	R	68	Low	74.9	Confident	152 Å²	152	57 Å²	57	57%	0.574	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	115.3	162.3	177.3	179.3	177.1	173.7	2.9	108.5	A323 T401	A323-R399 PolarHBondContact N-O 2.85Å; A323-R399 PolarHBondContact O-N 2.92Å; R399-T401 PolarHBondContact O-N 3.41Å
400	L	74	Confident	75.6	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.016	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	127.5	169.7	-170.7	77.3	0	0	0	110.1	F320 G321 W322 I388 S402 S508	F320-L400 HydrophobicContact CB-CD1 3.67Å; F320-L400 HydrophobicContact CD1-CD1 3.89Å; F320-L400 HydrophobicContact CG-CD1 4.2Å; G321-L400 WeakPolarHBondContact O-CA 3.49Å; W322-L400 HydrophobicContact CD2-CD1 4.41Å; W322-L400 HydrophobicContact CE3-CB 4.23Å; W322-L400 HydrophobicContact CE3-CD1 4.46Å; W322-L400 HydrophobicContact CH2-CB 4.38Å; W322-L400 HydrophobicContact CH2-CD1 4.04Å; W322-L400 HydrophobicContact CZ2-CD1 3.96Å; W322-L400 HydrophobicContact CZ3-CB 3.96Å; W322-L400 HydrophobicContact CZ3-CD1 4.31Å; I388-L400 HydrophobicContact CD1-CD2 4.1Å; I388-L400 HydrophobicContact CG1-CD2 4.43Å; I388-L400 HydrophobicContact CG2-CD2 4.37Å; L400-S402 WeakPolarHBondContact CD1-O 3.49Å; L400-S508 PolarHBondContact O-OG 3.18Å
401	T	74.3	Confident	76.2	Confident	36 Å²	36	50.6 Å²	50.6	22%	0.221	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-41.9	173.8	42.7	0	0	0	0	112.1	G321 A323 R399 S508	G321-T401 PolarHBondContact O-N 3.1Å; G321-T401 PolarHBondContact O-OG1 3.43Å; G321-T401 VanDerWaalsContact O-OG1 3.09Å; A323-T401 HydrophobicContact CB-CG2 3.44Å; A323-T401 VanDerWaalsContact CB-CG2 3.44Å; R399-T401 PolarHBondContact O-N 3.41Å; T401-S508 WeakPolarHBondContact O-CB 3.45Å; T401-S508 PolarHBondContact O-N 2.9Å; T401-S508 PolarHBondContact O-OG 2.75Å
402	S	79.1	Confident	77	Confident	37 Å²	37	52.3 Å²	52.3	26%	0.259	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	147.5	-171.2	40	0	0	0	0	110.3	G321 L400 I506	G321-S402 PolarHBondContact N-O 2.89Å; L400-S402 WeakPolarHBondContact CD1-O 3.49Å; S402-I506 WeakPolarHBondContact CA-O 3.33Å
403	A	84	Confident	77.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.4	162.8	0	0	0	0	0	108.3	R319 F320 L505 I506	R319-A403 CarbonylContact O-C 3.54Å; R319-A403 WeakPolarHBondContact O-CA 3.22Å; F320-A403 HydrophobicContact CD1-CB 3.67Å; F320-A403 HydrophobicContact CE1-CB 3.81Å; A403-L505 HydrophobicContact CB-CB 4.22Å; A403-L505 PolarHBondContact O-N 2.99Å; A403-I506 HydrophobicContact CB-CB 3.95Å; A403-I506 HydrophobicContact CB-CD1 4.07Å; A403-I506 HydrophobicContact CB-CG1 4.1Å; A403-I506 PolarHBondContact N-O 2.84Å; A403-I506 VanDerWaalsContact N-O 3.13Å; A403-I506 PolarHBondContact O-N 3.22Å; A403-I506 VanDerWaalsContact O-N 3.16Å
404	Q	89.1	Confident	79.1	Confident	47 Å²	47	41.8 Å²	41.8	22%	0.22	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.8	179.8	-67.5	170.1	-76.7	0	0	110.6	L318 R319 P502 L503	L318-Q404 WeakPolarHBondContact CA-O 3.26Å; R319-Q404 HydrophobicContact CB-CB 4.33Å; R319-Q404 PolarHBondContact N-O 3.23Å; R319-Q404 PolarHBondContact O-N 3.39Å; Q404-P502 HydrophobicContact CB-CB 4.27Å; Q404-L503 CarbonylContact C-O 3.55Å; Q404-L503 WeakPolarHBondContact CA-O 3.25Å
405	L	90.1	Very high	80.3	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.2	174.3	173.5	67.9	0	0	0	108.2	L293 V316 H317 L318 L407 L503 L505 L523	L293-L405 HydrophobicContact CD1-CD1 4.45Å; L293-L405 HydrophobicContact CD1-CD2 4.17Å; V316-L405 HydrophobicContact CG1-CD1 3.63Å; H317-L405 WeakPolarHBondContact O-CA 3.45Å; L318-L405 HydrophobicContact CD2-CB 4.26Å; L318-L405 HydrophobicContact CD2-CD1 3.82Å; L405-L407 HydrophobicContact CD1-CD2 3.99Å; L405-L407 HydrophobicContact CG-CD2 4.19Å; L405-L407 HydrophobicContact CG-CG 4.42Å; L405-L503 HydrophobicContact CB-CB 4.21Å; L405-L503 HydrophobicContact CB-CD1 4.46Å; L405-L503 HydrophobicContact CD2-CD1 4.01Å; L405-L503 HydrophobicContact CG-CD1 4.21Å; L405-L503 PolarHBondContact N-O 3.36Å; L405-L503 WeakPolarHBondContact O-CB 3.28Å; L405-L503 PolarHBondContact O-N 2.89Å; L405-L505 HydrophobicContact CB-CD1 4.06Å; L405-L505 HydrophobicContact CB-CD2 3.89Å; L405-L505 HydrophobicContact CB-CG 3.89Å; L405-L505 HydrophobicContact CD2-CD2 4.31Å; L405-L523 HydrophobicContact CD2-CD2 4.25Å
406	E	88.7	Confident	81.2	Confident	17 Å²	17	41 Å²	41	8%	0.079	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.8	-179	-69.4	169.7	164.3	0	0	106.8	H317 R319 P502	H317-E406 WeakPolarHBondContact CA-O 3.46Å; H317-E406 HydrophobicContact CB-CB 4.12Å; H317-E406 WeakPolarHBondContact CB-O 3.47Å; H317-E406 PolarHBondContact N-O 3.23Å; H317-E406 PolarHBondContact O-N 2.82Å; R319-E406 WeakPolarHBondContact CD-OE1 3.48Å; R319-E406 IonicContact CZ-OE1 2.69Å; R319-E406 IonicContact NE-OE1 3.07Å; R319-E406 IonicContact NH1-OE1 3.29Å; R319-E406 PolarHBondContact NH1-OE1 3.47Å; E406-P502 HydrophobicContact CG-CB 3.68Å; E406-P502 HydrophobicContact CG-CG 3.84Å; E406-P502 VanDerWaalsContact OE1-CG 3.32Å; E406-P502 WeakPolarHBondContact OE1-CG 3.43Å
407	L	91.1	Very high	82.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.8	177.8	-54.6	175.7	0	0	0	108.8	F295 V314 V316 L405 S499 T500 L530 L608 F610	F295-L407 HydrophobicContact CE1-CD1 4.25Å; F295-L407 HydrophobicContact CZ-CD2 4.37Å; V314-L407 HydrophobicContact CG1-CB 4.29Å; V314-L407 HydrophobicContact CG1-CD2 4.44Å; V316-L407 HydrophobicContact CB-CD2 4.23Å; V316-L407 HydrophobicContact CG1-CD2 3.89Å; V316-L407 HydrophobicContact CG2-CD2 4.01Å; L405-L407 HydrophobicContact CD1-CD2 3.99Å; L405-L407 HydrophobicContact CG-CD2 4.19Å; L405-L407 HydrophobicContact CG-CG 4.42Å; L407-S499 WeakPolarHBondContact O-CA 3.46Å; L407-T500 HydrophobicContact CB-CG2 3.78Å; L407-T500 HydrophobicContact CD1-CG2 4.26Å; L407-T500 HydrophobicContact CG-CG2 4.36Å; L407-T500 PolarHBondContact N-OG1 2.88Å; L407-T500 PolarHBondContact O-N 2.75Å; L407-T500 PolarHBondContact O-OG1 2.81Å; L407-L530 HydrophobicContact CD1-CD1 4.27Å; L407-L608 HydrophobicContact CB-CD2 4.43Å; L407-L608 HydrophobicContact CD1-CD2 3.92Å; L407-F610 HydrophobicContact CD1-CD1 4.45Å; L407-F610 HydrophobicContact CD1-CE1 3.98Å; L407-F610 HydrophobicContact CD1-CZ 4.22Å
408	H	90.9	Very high	82.4	Confident	54 Å²	54	43.7 Å²	43.7	25%	0.25	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.2	173.2	-66.5	-94.3	0	0	0	109.4	V314 N315 Y498 D535	V314-H408 CarbonylContact C-O 3.49Å; V314-H408 WeakPolarHBondContact CA-O 3.37Å; N315-H408 PolarHBondContact N-O 3.07Å; N315-H408 PolarHBondContact O-N 2.88Å; H408-Y498 CarbonylContact C-O 3.57Å; H408-Y498 VanDerWaalsContact CA-O 3.28Å; H408-Y498 WeakPolarHBondContact CA-O 3.25Å; H408-D535 IonicContact CE1-OD2 2.76Å; H408-D535 PolarHBondContact CE1-OD2 2.83Å; H408-D535 IonicContact ND1-OD2 2.72Å; H408-D535 PolarHBondContact ND1-OD2 3Å
409	V	91.3	Very high	81.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116	177.5	-168	0	0	0	0	109.6	F298 A312 S313 V314 I344 Y498 L532 L608	F298-V409 HydrophobicContact CD2-CG1 3.89Å; F298-V409 HydrophobicContact CE2-CG1 4.25Å; A312-V409 HydrophobicContact CB-CG1 4.39Å; S313-V409 CarbonylContact O-C 3.56Å; S313-V409 WeakPolarHBondContact O-CA 3.31Å; V314-V409 HydrophobicContact CG1-CG2 4.47Å; V314-V409 HydrophobicContact CG2-CG2 4.21Å; I344-V409 HydrophobicContact CD1-CG1 4.38Å; V409-Y498 PolarHBondContact N-O 3.27Å; V409-Y498 PolarHBondContact O-N 2.77Å; V409-L532 HydrophobicContact CB-CD1 4.26Å; V409-L532 HydrophobicContact CG2-CD1 3.75Å; V409-L608 HydrophobicContact CG2-CD1 4.45Å; V409-L608 HydrophobicContact CG2-CD2 3.95Å
410	S	91.8	Very high	80.2	Confident	28 Å²	28	49 Å²	49	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	106.1	167.8	-60.3	0	0	0	0	108.8	A312 S313 Q497	A312-S410 WeakPolarHBondContact CA-O 3.47Å; S313-S410 PolarHBondContact N-O 2.93Å; S313-S410 PolarHBondContact O-N 3.09Å; S410-Q497 VanDerWaalsContact OG-CD 3.31Å; S410-Q497 PolarHBondContact OG-NE2 3.31Å; S410-Q497 PolarHBondContact OG-OE1 2.88Å
411	A	90.5	Very high	78.5	Confident	2 Å²	2	54.6 Å²	54.6	2%	0.017	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	156.8	176.7	0	0	0	0	0	111.2	F298 T309 P495 V496 Y498	F298-A411 HydrophobicContact CZ-CB 4.48Å; T309-A411 HydrophobicContact CG2-CB 3.92Å; A411-P495 WeakPolarHBondContact O-CA 3.43Å; A411-V496 PolarHBondContact N-O 3.4Å; A411-V496 PolarHBondContact O-N 2.81Å; A411-Y498 HydrophobicContact CB-CD2 4.02Å; A411-Y498 HydrophobicContact CB-CE2 3.79Å
412	T	90.4	Very high	76.8	Confident	43 Å²	43	61.2 Å²	61.2	26%	0.264	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	123.7	168.3	58.4	0	0	0	0	110	T309 V310 D311 Y494	T309-T412 CarbonylContact C-O 3.47Å; T309-T412 WeakPolarHBondContact CA-O 3.43Å; V310-T412 WeakPolarHBondContact CG2-O 3.49Å; V310-T412 PolarHBondContact N-O 3.19Å; D311-T412 WeakPolarHBondContact CB-OG1 3.17Å; D311-T412 PolarHBondContact N-OG1 3.41Å; D311-T412 PolarHBondContact O-N 3.01Å; D311-T412 PolarHBondContact O-OG1 2.88Å; T412-Y494 WeakPolarHBondContact CA-O 3.37Å
413	E	89.6	Confident	74.5	Confident	21 Å²	21	64.1 Å²	64.1	10%	0.098	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	147.2	-171.4	-69.8	166.9	-154.7	0	0	111.5	W307 V308 S493 Y494 V496 Y498	W307-E413 HydrophobicContact CE3-CB 4.46Å; V308-E413 CarbonylContact O-C 3.56Å; V308-E413 VanDerWaalsContact O-CA 3.28Å; V308-E413 WeakPolarHBondContact O-CA 3.49Å; E413-S493 CarbonylContact O-C 3.58Å; E413-S493 WeakPolarHBondContact O-CA 3.19Å; E413-Y494 PolarHBondContact N-O 2.98Å; E413-Y494 PolarHBondContact O-N 2.89Å; E413-V496 HydrophobicContact CG-CG2 4.41Å; E413-V496 WeakPolarHBondContact OE1-CB 3.48Å; E413-V496 VanDerWaalsContact OE1-CG2 3.28Å; E413-V496 WeakPolarHBondContact OE1-CG2 3.23Å; E413-Y498 PolarHBondContact OE1-OH 3.41Å
414	R	87.3	Confident	72.2	Confident	91 Å²	91	73.6 Å²	73.6	34%	0.343	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152.8	171.6	-68.4	-171.5	173	159.9	1.6	110.4	W307 V308 V310 L489 S490	W307-R414 CarbonylContact C-O 3.48Å; W307-R414 WeakPolarHBondContact CA-O 3.28Å; V308-R414 PolarHBondContact N-O 3.26Å; V308-R414 PolarHBondContact O-N 2.87Å; V310-R414 HydrophobicContact CG1-CB 4.14Å; V310-R414 HydrophobicContact CG1-CG 4.03Å; V310-R414 HydrophobicContact CG2-CG 4.03Å; R414-L489 HydrophobicContact CB-CB 4.26Å; R414-L489 HydrophobicContact CB-CD1 4.41Å; R414-S490 WeakPolarHBondContact CD-O 3.27Å
415	R	85.1	Confident	69.6	Low	113 Å²	113	75.1 Å²	75.1	43%	0.426	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	146.2	179.4	-155	-179.7	178.8	166.1	3.5	110.9	D306 W307 L489 S490	D306-R415 WeakPolarHBondContact O-CA 3.47Å; D306-R415 WeakPolarHBondContact O-CG 3.11Å; D306-R415 IonicContact OD2-CZ 3.62Å; D306-R415 IonicContact OD2-NE 3.74Å; D306-R415 PolarHBondContact OD2-NE 3.35Å; D306-R415 VanDerWaalsContact OD2-NE 3.1Å; D306-R415 IonicContact OD2-NH2 3.67Å; D306-R415 PolarHBondContact OD2-NH2 2.92Å; W307-R415 HydrophobicContact CD2-CB 4.4Å; W307-R415 HydrophobicContact CD2-CG 4.25Å; W307-R415 HydrophobicContact CE3-CB 3.75Å; W307-R415 HydrophobicContact CE3-CG 4.1Å; W307-R415 HydrophobicContact CH2-CB 4.19Å; W307-R415 HydrophobicContact CH2-CG 4.4Å; W307-R415 HydrophobicContact CZ3-CB 3.64Å; W307-R415 HydrophobicContact CZ3-CG 4.18Å; R415-L489 CarbonylContact O-C 3.54Å; R415-L489 WeakPolarHBondContact O-CA 3.25Å; R415-S490 PolarHBondContact N-OG 3.02Å; R415-S490 PolarHBondContact O-N 3.06Å; R415-S490 PolarHBondContact O-OG 3.41Å
416	W	78.3	Confident	66.9	Low	17 Å²	17	79.3 Å²	79.3	6%	0.064	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132.1	169.3	-69.2	87.8	0	0	0	111.3	D306 T351 K418 F478 L489	D306-W416 PolarHBondContact O-N 2.82Å; T351-W416 HydrophobicContact CG2-CZ2 4.24Å; W416-K418 PolarHBondContact O-N 3.1Å; W416-F478 HydrophobicContact CH2-CE1 4.24Å; W416-L489 HydrophobicContact CD2-CD2 3.68Å; W416-L489 HydrophobicContact CE3-CD2 3.89Å; W416-L489 HydrophobicContact CG-CD2 4.16Å; W416-L489 HydrophobicContact CH2-CD2 4.26Å; W416-L489 HydrophobicContact CZ2-CD2 4.06Å; W416-L489 HydrophobicContact CZ3-CD2 4.18Å
417	L	74.3	Confident	64.4	Low	98 Å²	98	85.6 Å²	85.6	51%	0.513	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-76.7	117.2	172.9	-64	171.2	0	0	0	109.8	G488	L417-G488 VanDerWaalsContact CB-O 3.27Å; L417-G488 WeakPolarHBondContact CB-O 3.46Å; L417-G488 WeakPolarHBondContact CG-O 3.41Å; L417-G488 PolarHBondContact N-O 3.48Å
418	K	60.4	Low	61.7	Low	147 Å²	147	88.7 Å²	88.7	64%	0.639	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-73.5	133.6	172.1	-63	-177.2	-178.4	178.8	0	108.9	D306 W416	D306-K418 VanDerWaalsContact CG-NZ 3.34Å; D306-K418 WeakPolarHBondContact OD1-CE 3.46Å; D306-K418 IonicContact OD1-NZ 3.17Å; D306-K418 PolarHBondContact OD1-NZ 3.02Å; D306-K418 WeakPolarHBondContact OD2-CE 3.32Å; D306-K418 IonicContact OD2-NZ 3.83Å; D306-K418 PolarHBondContact OD2-NZ 3.08Å; W416-K418 PolarHBondContact O-N 3.1Å
419	R	45.1	Very low	59.1	Low	161 Å²	161	94 Å²	94	61%	0.608	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-69	140	175.6	-73.9	-175.8	171.1	-145.7	-7.5	110.2	D421 K486	R419-D421 VanDerWaalsContact C-N 3.28Å; R419-K486 VanDerWaalsContact CZ-O 3.32Å; R419-K486 PolarHBondContact NE-O 3.21Å; R419-K486 PolarHBondContact NH2-O 2.85Å
420	P	39.9	Very low	56.4	Low	113 Å²	113	101.7 Å²	101.7	73%	0.734	57%	0.567	S	S	*	*	S	Bend	trans	-68.5	-28.5	167	-18.8	33	0	0	0	112.9	L422	P420-L422 PolarHBondContact O-N 3.41Å
421	D	36.5	Very low	53.7	Low	120 Å²	120	103.8 Å²	103.8	64%	0.642	59%	0.594	S	S	*	*			trans	-96.1	81.2	-159.7	-35.4	-71.3	0	0	0	112.8	R419	R419-D421 VanDerWaalsContact C-N 3.28Å
422	L	39.3	Very low	51.1	Low	176 Å²	176	112 Å²	112	92%	0.921	64%	0.635	S	S	*	*			trans	-169	75.9	158.4	-109.6	163	0	0	0	111.1	P420	P420-L422 PolarHBondContact O-N 3.41Å
423	S	32	Very low	48.6	Very low	97 Å²	97	115.9 Å²	115.9	68%	0.678	66%	0.659	S	S	*	*			trans	-139.3	141	172.8	59.7	0	0	0	0	111.5
424	H	35	Very low	46.2	Very low	199 Å²	199	119.5 Å²	119.5	92%	0.921	69%	0.685	S	S	*	*			trans	73.6	118.1	-177.5	-68.6	-81	0	0	0	118.5
425	G	33.6	Very low	43.6	Very low	79 Å²	79	122.4 Å²	122.4	81%	0.814	71%	0.707	S	S	*	*			trans	130.8	133.1	158.9	0	0	0	0	0	113.6
426	A	34.3	Very low	41.3	Very low	89 Å²	89	125.1 Å²	125.1	74%	0.736	73%	0.728	S	S	*	*			cis	-163	152.3	-20.1	0	0	0	0	0	109
427	V	36.8	Very low	39.2	Very low	150 Å²	150	129.3 Å²	129.3	91%	0.909	76%	0.76	S	S	*	*			trans	64.2	137.2	170.1	-163.3	0	0	0	0	116
428	G	33.5	Very low	37.1	Very low	64 Å²	64	131.3 Å²	131.3	66%	0.66	77%	0.771	S	S	*	*			cis	139.9	100.7	-12.5	0	0	0	0	0	114.1
429	L	36.5	Very low	35.7	Very low	165 Å²	165	131 Å²	131	86%	0.864	78%	0.777	S	S	*	*			trans	-166.1	96.3	159	-110.8	167.9	0	0	0	113.6
430	N	35.2	Very low	35.2	Very low	162 Å²	162	131.2 Å²	131.2	87%	0.866	79%	0.789	S	S	*	*			trans	19.4	132.5	151.1	-53.9	-14.8	0	0	0	122.3
431	G	34.2	Very low	34.9	Very low	73 Å²	73	131.4 Å²	131.4	75%	0.753	79%	0.788	S	S	*	*			trans	-170.3	38.6	175.8	0	0	0	0	0	119.5
432	I	37	Very low	34.6	Very low	173 Å²	173	133 Å²	133	89%	0.887	80%	0.797	S	S	*	*			trans	76	153.9	171.5	-53.3	177.1	0	0	0	116
433	T	36.7	Very low	34.4	Very low	125 Å²	125	132.9 Å²	132.9	77%	0.767	79%	0.791	S	S	*	*			trans	-136.9	-179.4	-153.3	36.5	0	0	0	0	112
434	P	39.8	Very low	34.6	Very low	98 Å²	98	135.3 Å²	135.3	64%	0.636	80%	0.795	S	S	*	*			cis	-139	-176.3	-30.4	35.2	-15.9	0	0	0	115.2
435	N	31.1	Very low	34.7	Very low	152 Å²	152	132.5 Å²	132.5	81%	0.813	79%	0.787	S	S	*	*			trans	63.8	124.2	145.7	-70.4	-11.3	0	0	0	122.8
436	I	37.2	Very low	34.8	Very low	170 Å²	170	136.6 Å²	136.6	87%	0.872	79%	0.785	S	S	*	*				-155.2	147.2	118.5	-103.7	159.1	0	0	0	109.6
437	S	34.2	Very low	35	Very low	104 Å²	104	138.6 Å²	138.6	73%	0.727	79%	0.787	S	S	*	*			trans	-75.8	146.7	-179.1	46.1	0	0	0	0	113.2
438	N	31.3	Very low	34.9	Very low	141 Å²	141	136.7 Å²	136.7	75%	0.754	77%	0.772	S	S	*	*			cis	86.4	126	44.4	-148.7	22	0	0	0	114.2
439	N	30.3	Very low	35.1	Very low	140 Å²	140	141.8 Å²	141.8	75%	0.749	78%	0.778	S	S	*	*			trans	71.1	148.6	170.7	-61.6	-31.9	0	0	0	121.8
440	L	34	Very low	35	Very low	165 Å²	165	140.7 Å²	140.7	86%	0.864	77%	0.773	S	S	*	*			trans	122.6	125.7	167.6	-72.7	165.3	0	0	0	112.8
441	T	33.8	Very low	35	Very low	117 Å²	117	140.4 Å²	140.4	72%	0.718	77%	0.772	S	S	*	*			cis	-151.5	149.1	-9.7	-35	0	0	0	0	109.9
442	N	30.5	Very low	35	Very low	155 Å²	155	144.2 Å²	144.2	83%	0.829	78%	0.775	S	S	*	*			trans	-141.2	111.9	162.5	-159.1	14.6	0	0	0	108.4
443	H	34.7	Very low	34.9	Very low	172 Å²	172	139.6 Å²	139.6	80%	0.796	77%	0.77	S	S	*	*			trans	-174.7	136.3	170.1	-109.4	-67.2	0	0	0	112.1
444	I	37.1	Very low	34.8	Very low	149 Å²	149	140.4 Å²	140.4	76%	0.764	77%	0.769	S	S	*	*			trans	-170.1	139.8	131.4	-104.2	164.3	0	0	0	109.4
445	N	37.8	Very low	34.6	Very low	140 Å²	140	141.7 Å²	141.7	75%	0.749	77%	0.771	S	S	*	*			trans	70.2	99	170.8	-62.1	-11.5	0	0	0	120.9
446	H	35.9	Very low	34.6	Very low	165 Å²	165	141.9 Å²	141.9	76%	0.764	77%	0.772	S	S	*	*				-9.7	159.5	127.4	-56.5	-87.5	0	0	0	117.7
447	V	37.6	Very low	34.7	Very low	130 Å²	130	139.3 Å²	139.3	79%	0.788	77%	0.767	S	S	*	*			cis	-148.1	158.6	44.3	175	0	0	0	0	113.6
448	N	34.4	Very low	34.7	Very low	110 Å²	110	139.6 Å²	139.6	59%	0.588	77%	0.768	S	S	*	*			trans	-34.7	169.9	166.4	-37.4	-3.7	0	0	0	116.5
449	H	38.4	Very low	35	Very low	171 Å²	171	140.8 Å²	140.8	79%	0.792	77%	0.769	S	S	*	*			cis	-152.1	163.3	26.4	-108.9	-69.1	0	0	0	113.3
450	N	32.9	Very low	35	Very low	142 Å²	142	140.3 Å²	140.3	76%	0.759	77%	0.767	S	S	*	*			trans	-68.2	153.3	168	-64.3	-16.9	0	0	0	112.9
451	N	36.3	Very low	35	Very low	156 Å²	156	137.9 Å²	137.9	83%	0.834	76%	0.763	S	S	*	*				-166.2	158.5	118.5	-105.2	-21.5	0	0	0	115.9
452	N	33.9	Very low	35.1	Very low	154 Å²	154	137.8 Å²	137.8	82%	0.824	77%	0.768	S	S	*	*			trans	-53	159.5	-174.8	-58.2	-34	0	0	0	116.9
453	G	35.7	Very low	35.2	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	77%	0.772	S	S	*	*			trans	-153	-2.9	-177.5	0	0	0	0	0	120.8
454	N	34	Very low	35.1	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	78%	0.775	S	S	*	*			trans	51.4	143.1	158.6	-90.8	11.8	0	0	0	124.5
455	N	36.3	Very low	34.8	Very low	126 Å²	126	135.3 Å²	135.3	67%	0.674	78%	0.775	S	S	*	*			trans	82.3	90	140	-64.1	-4.6	0	0	0	123.2
456	N	31	Very low	34.6	Very low	156 Å²	156	137 Å²	137	83%	0.834	78%	0.778	S	S	*	*				68.1	151.1	111	-79.2	-3.9	0	0	0	124.1
457	P	38.4	Very low	34.3	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	77%	0.771	S	S	*	*			trans	-114.2	172.4	-176	43.5	-34.1	0	0	0	115.5
458	S	35	Very low	34	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	78%	0.775	S	S	*	*			trans	-132	138.4	154.4	44.8	0	0	0	0	108.6
459	Q	36.5	Very low	33.8	Very low	167 Å²	167	133.6 Å²	133.6	78%	0.78	78%	0.781	S	S	*	*			cis	71.5	132.9	49.2	-69.8	-145.3	46.7	0	0	113.4
460	N	31	Very low	33.4	Very low	129 Å²	129	135.7 Å²	135.7	69%	0.69	79%	0.787	S	S	*	*			cis	-167.1	180	-12.3	-132.1	-29.5	0	0	0	111.2
461	S	33.9	Very low	33.3	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	79%	0.786	S	S	*	*			trans	74.5	157.4	165.4	84.5	0	0	0	0	117.3
462	S	36.2	Very low	33.1	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	78%	0.781	S	S	*	*			cis	-133	160.8	4.2	57.9	0	0	0	0	113.5
463	K	31.2	Very low	32.8	Very low	209 Å²	209	133.6 Å²	133.6	91%	0.909	78%	0.775	S	S	*	*			trans	-82.8	145.3	-173.5	-57.9	166.8	179.8	172.5	0	113.1
464	S	33.7	Very low	32.6	Very low	124 Å²	124	134.5 Å²	134.5	87%	0.867	77%	0.769	S	S	*	*			trans	-141	149.7	138.1	59.2	0	0	0	0	108.3
465	A	30.6	Very low	32.7	Very low	91 Å²	91	135.7 Å²	135.7	75%	0.752	77%	0.77	S	S	*	*			trans	-125.7	143.4	-174.6	0	0	0	0	0	110.9
466	H	33.5	Very low	32.8	Very low	176 Å²	176	133.4 Å²	133.4	82%	0.815	76%	0.761	S	S	*	*				-163.6	149.2	129.2	-114.6	-84.3	0	0	0	111.5
467	T	29.6	Very low	33.2	Very low	103 Å²	103	130.5 Å²	130.5	63%	0.632	75%	0.749	S	S	*	*			trans	-4.9	125	159.5	46.4	0	0	0	0	118.9
468	D	31.4	Very low	33.4	Very low	161 Å²	161	130.6 Å²	130.6	86%	0.861	74%	0.737	S	S	*	*				171.2	165.7	99.3	-92.1	-41	0	0	0	115.3
469	G	31.4	Very low	33.7	Very low	69 Å²	69	131.2 Å²	131.2	71%	0.711	73%	0.731	S	S	*	*			trans	77.2	92.7	151.7	0	0	0	0	0	119.3	N471	G469-N471 PolarHBondContact O-N 2.91Å
470	K	29.3	Very low	33.7	Very low	214 Å²	214	128.8 Å²	128.8	93%	0.93	73%	0.732	S	S	*	*			trans	-64.5	117.6	153.2	-71.9	177.5	-178.5	171.8	0	108.5
471	N	30.2	Very low	33.7	Very low	138 Å²	138	126 Å²	126	74%	0.738	73%	0.734	S	S	*	*			trans	-122.2	113.5	175.6	-149.9	-17	0	0	0	111.2	G469 N473	G469-N471 PolarHBondContact O-N 2.91Å; N471-N473 PolarHBondContact OD1-ND2 3.16Å
472	I	32.1	Very low	34	Very low	142 Å²	142	125.5 Å²	125.5	73%	0.728	72%	0.722	S	S	*	*			trans	-98.7	108.5	-176	-61.7	171	0	0	0	107.7
473	N	28.2	Very low	34.4	Very low	128 Å²	128	125.7 Å²	125.7	68%	0.684	72%	0.721	S	S	*	*			trans	-130.6	77.7	178.4	-87.8	-50.5	0	0	0	112.3	N471	N471-N473 PolarHBondContact OD1-ND2 3.16Å
474	S	32	Very low	35.1	Very low	95 Å²	95	123 Å²	123	66%	0.664	72%	0.715	S	S	*	*			trans	-142.3	75.1	163.3	48.7	0	0	0	0	109.3	T476	S474-T476 PolarHBondContact O-N 3.17Å
475	H	35.4	Very low	36	Very low	167 Å²	167	121.2 Å²	121.2	77%	0.773	69%	0.69	S	S	*	*			trans	-72.5	71.7	-178.4	-102.5	-80	0	0	0	112.4	T477	H475-T477 PolarHBondContact O-N 3.04Å
476	T	38.8	Very low	37	Very low	78 Å²	78	125.1 Å²	125.1	48%	0.479	69%	0.69	S	S	.	*			trans	-76	99.4	166.6	-48.3	0	0	0	0	108.6	S474 F478	S474-T476 PolarHBondContact O-N 3.17Å; T476-F478 VanDerWaalsContact C-N 3.31Å; T476-F478 HydrophobicContact CG2-CD2 3.83Å; T476-F478 HydrophobicContact CG2-CE1 4.5Å; T476-F478 HydrophobicContact CG2-CE2 3.37Å; T476-F478 HydrophobicContact CG2-CZ 3.76Å; T476-F478 WeakPolarHBondContact O-CD2 3.45Å; T476-F478 PolarHBondContact O-N 3.04Å
477	T	40.1	Very low	38.1	Very low	95 Å²	95	117.7 Å²	117.7	58%	0.583	66%	0.661	S	S	*	*			trans	-73.3	80.8	179	43.9	0	0	0	0	111.8	H475 I479	H475-T477 PolarHBondContact O-N 3.04Å; T477-I479 PolarHBondContact O-N 3.47Å
478	F	42.6	Very low	40	Very low	118 Å²	118	114.9 Å²	114.9	52%	0.518	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-70.5	118.8	163.6	-67.9	-82.5	0	0	0	109.7	W416 T476	W416-F478 HydrophobicContact CH2-CE1 4.24Å; T476-F478 VanDerWaalsContact C-N 3.31Å; T476-F478 HydrophobicContact CG2-CD2 3.83Å; T476-F478 HydrophobicContact CG2-CE1 4.5Å; T476-F478 HydrophobicContact CG2-CE2 3.37Å; T476-F478 HydrophobicContact CG2-CZ 3.76Å; T476-F478 WeakPolarHBondContact O-CD2 3.45Å; T476-F478 PolarHBondContact O-N 3.04Å
479	I	41.1	Very low	42.2	Very low	121 Å²	121	109.3 Å²	109.3	62%	0.621	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-76.6	144.1	161.9	-61.5	178.5	0	0	0	107.6	T477 G481	T477-I479 PolarHBondContact O-N 3.47Å; I479-G481 PolarHBondContact O-N 2.77Å
480	S	35.1	Very low	44.5	Very low	117 Å²	117	106.9 Å²	106.9	82%	0.818	59%	0.594	S	S	*	*	S	Bend	trans	-46.6	130.5	-172.5	53.4	0	0	0	0	114.2
481	G	32.4	Very low	46.9	Very low	70 Å²	70	101.7 Å²	101.7	72%	0.722	59%	0.585	S	S	*	*			trans	156.2	1.4	160.1	0	0	0	0	0	121.5	I479	I479-G481 PolarHBondContact O-N 2.77Å
482	N	39.9	Very low	49.4	Very low	104 Å²	104	99.4 Å²	99.4	56%	0.556	57%	0.573	S	S	*	*			trans	-153.6	102.6	174	-134.4	-39.6	0	0	0	115.6	L484	N482-L484 PolarHBondContact O-N 2.97Å
483	P	43.3	Very low	51.9	Low	119 Å²	119	95.6 Å²	95.6	77%	0.773	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-14.8	-178.3	-23.3	35	0	0	0	115.9	R485	P483-R485 PolarHBondContact O-N 2.93Å
484	L	47.1	Very low	54.8	Low	152 Å²	152	94.9 Å²	94.9	80%	0.796	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-4	-163.5	-79.4	128	0	0	0	116.2	N482	N482-L484 PolarHBondContact O-N 2.97Å
485	R	52.3	Low	57.5	Low	88 Å²	88	95.3 Å²	95.3	33%	0.332	55%	0.548	S	S	.	.			trans	-126.6	61.7	-174.2	-67.8	-167.7	176.5	-152.2	5.4	115.1	M305 P483 G487	M305-R485 PolarHBondContact O-NH1 3Å; M305-R485 PolarHBondContact O-NH2 3.37Å; P483-R485 PolarHBondContact O-N 2.93Å; R485-G487 PolarHBondContact O-N 3Å
486	K	50.7	Low	60	Low	172 Å²	172	88.6 Å²	88.6	75%	0.748	52%	0.519	S	S	*	.			trans	-79.1	56	164.7	-69.8	-174.1	176.4	179.3	0	112.2	R419	R419-K486 VanDerWaalsContact CZ-O 3.32Å; R419-K486 PolarHBondContact NE-O 3.21Å; R419-K486 PolarHBondContact NH2-O 2.85Å
487	G	56.9	Low	62.4	Low	21 Å²	21	88.8 Å²	88.8	22%	0.216	51%	0.514	C	S	.	.			trans	-127.2	145.3	174.2	0	0	0	0	0	110.3	R485	R485-G487 PolarHBondContact O-N 3Å
488	G	70.5	Confident	64.8	Low	44 Å²	44	85.1 Å²	85.1	45%	0.454	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-73.5	170.1	179.1	0	0	0	0	0	113.2	L417	L417-G488 VanDerWaalsContact CB-O 3.27Å; L417-G488 WeakPolarHBondContact CB-O 3.46Å; L417-G488 WeakPolarHBondContact CG-O 3.41Å; L417-G488 PolarHBondContact N-O 3.48Å
489	L	77.6	Confident	66.8	Low	44 Å²	44	80.7 Å²	80.7	23%	0.23	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	152.4	165.3	-60.9	-179	0	0	0	110.4	V308 V310 Y353 R414 R415 W416	V308-L489 HydrophobicContact CG1-CD1 3.98Å; V308-L489 HydrophobicContact CG1-CD2 3.59Å; V308-L489 HydrophobicContact CG1-CG 4.46Å; V310-L489 HydrophobicContact CG1-CD1 3.96Å; Y353-L489 HydrophobicContact CE2-CD1 4Å; R414-L489 HydrophobicContact CB-CB 4.26Å; R414-L489 HydrophobicContact CB-CD1 4.41Å; R415-L489 CarbonylContact O-C 3.54Å; R415-L489 WeakPolarHBondContact O-CA 3.25Å; W416-L489 HydrophobicContact CD2-CD2 3.68Å; W416-L489 HydrophobicContact CE3-CD2 3.89Å; W416-L489 HydrophobicContact CG-CD2 4.16Å; W416-L489 HydrophobicContact CH2-CD2 4.26Å; W416-L489 HydrophobicContact CZ2-CD2 4.06Å; W416-L489 HydrophobicContact CZ3-CD2 4.18Å
490	S	79	Confident	68.8	Low	17 Å²	17	75.3 Å²	75.3	12%	0.119	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	144.7	173	57.8	0	0	0	0	111.7	R414 R415 N492	R414-S490 WeakPolarHBondContact CD-O 3.27Å; R415-S490 PolarHBondContact N-OG 3.02Å; R415-S490 PolarHBondContact O-N 3.06Å; R415-S490 PolarHBondContact O-OG 3.41Å; S490-N492 PolarHBondContact O-N 2.81Å; S490-N492 PolarHBondContact OG-O 3.25Å
491	S	79.6	Confident	70.9	Confident	106 Å²	106	73.2 Å²	73.2	74%	0.741	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.8	-36.1	166	50.1	0	0	0	0	111.9
492	N	82.9	Confident	73.2	Confident	90 Å²	90	72.3 Å²	72.3	48%	0.481	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	135.3	-179.7	-59.4	12	0	0	0	110.2	S490 Y494	S490-N492 PolarHBondContact O-N 2.81Å; S490-N492 PolarHBondContact OG-O 3.25Å; N492-Y494 HydrophobicContact CB-CE2 3.99Å
493	S	84.7	Confident	75.4	Confident	61 Å²	61	68.3 Å²	68.3	43%	0.427	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.6	171.5	50.9	0	0	0	0	111.2	E413	E413-S493 CarbonylContact O-C 3.58Å; E413-S493 WeakPolarHBondContact O-CA 3.19Å
494	Y	88.1	Confident	77.3	Confident	114 Å²	114	64.5 Å²	64.5	45%	0.447	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.9	-175	-64.3	-99.3	0	0	0	109.2	W307 T412 E413 N492	W307-Y494 AromaticContact CH2-CD2 3.76Å; W307-Y494 HydrophobicContact CH2-CD2 3.76Å; W307-Y494 AromaticContact CH2-CE2 3.76Å; W307-Y494 HydrophobicContact CH2-CE2 3.76Å; W307-Y494 HydrophobicContact CH2-CG 4.33Å; W307-Y494 AromaticContact CZ3-CD2 3.51Å; W307-Y494 HydrophobicContact CZ3-CD2 3.51Å; W307-Y494 AromaticContact CZ3-CE2 3.79Å; W307-Y494 HydrophobicContact CZ3-CE2 3.79Å; W307-Y494 HydrophobicContact CZ3-CG 4.29Å; T412-Y494 WeakPolarHBondContact CA-O 3.37Å; E413-Y494 PolarHBondContact N-O 2.98Å; E413-Y494 PolarHBondContact O-N 2.89Å; N492-Y494 HydrophobicContact CB-CE2 3.99Å
495	P	89.1	Confident	79	Confident	104 Å²	104	57.3 Å²	57.3	68%	0.675	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	130.2	175.3	31.3	-32.1	0	0	0	110.2	A411	A411-P495 WeakPolarHBondContact O-CA 3.43Å
496	V	87.7	Confident	80	Confident	26 Å²	26	53.2 Å²	53.2	16%	0.158	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.8	175.2	-176.9	0	0	0	0	108.8	A411 E413 Y498 V534	A411-V496 PolarHBondContact N-O 3.4Å; A411-V496 PolarHBondContact O-N 2.81Å; E413-V496 HydrophobicContact CG-CG2 4.41Å; E413-V496 WeakPolarHBondContact OE1-CB 3.48Å; E413-V496 VanDerWaalsContact OE1-CG2 3.28Å; E413-V496 WeakPolarHBondContact OE1-CG2 3.23Å; V496-Y498 HydrophobicContact CB-CE2 4Å; V496-Y498 HydrophobicContact CG1-CD2 4.03Å; V496-Y498 HydrophobicContact CG1-CE1 4.12Å; V496-Y498 HydrophobicContact CG1-CE2 3.52Å; V496-V534 HydrophobicContact CG1-CG1 4.33Å; V496-V534 HydrophobicContact CG1-CG2 4.45Å
497	Q	90.6	Very high	80.5	Confident	81 Å²	81	48.1 Å²	48.1	38%	0.379	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	131.2	176.8	-63.4	-65	-22	0	0	108.8	S410 V534 D535	S410-Q497 VanDerWaalsContact OG-CD 3.31Å; S410-Q497 PolarHBondContact OG-NE2 3.31Å; S410-Q497 PolarHBondContact OG-OE1 2.88Å; Q497-V534 WeakPolarHBondContact O-CA 3.45Å; Q497-D535 HydrophobicContact CB-CB 4.1Å; Q497-D535 PolarHBondContact O-N 3.29Å
498	Y	89	Confident	80.4	Confident	18 Å²	18	48.2 Å²	48.2	7%	0.071	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.3	-179.9	-66.9	-81.1	0	0	0	110.7	F298 H408 V409 A411 E413 V496 L532 G533 V534 P606	F298-Y498 AromaticContact CE2-CD2 3.87Å; F298-Y498 HydrophobicContact CE2-CD2 3.87Å; F298-Y498 AromaticContact CE2-CE2 3.92Å; F298-Y498 HydrophobicContact CE2-CE2 3.92Å; F298-Y498 HydrophobicContact CE2-CG 4.47Å; F298-Y498 AromaticContact CZ-CD2 3.99Å; F298-Y498 HydrophobicContact CZ-CD2 3.99Å; F298-Y498 AromaticContact CZ-CE2 3.54Å; F298-Y498 HydrophobicContact CZ-CE2 3.54Å; H408-Y498 CarbonylContact C-O 3.57Å; H408-Y498 VanDerWaalsContact CA-O 3.28Å; H408-Y498 WeakPolarHBondContact CA-O 3.25Å; V409-Y498 PolarHBondContact N-O 3.27Å; V409-Y498 PolarHBondContact O-N 2.77Å; A411-Y498 HydrophobicContact CB-CD2 4.02Å; A411-Y498 HydrophobicContact CB-CE2 3.79Å; E413-Y498 PolarHBondContact OE1-OH 3.41Å; V496-Y498 HydrophobicContact CB-CE2 4Å; V496-Y498 HydrophobicContact CG1-CD2 4.03Å; V496-Y498 HydrophobicContact CG1-CE1 4.12Å; V496-Y498 HydrophobicContact CG1-CE2 3.52Å; Y498-L532 HydrophobicContact CD1-CB 4.17Å; Y498-L532 HydrophobicContact CG-CB 4.39Å; Y498-L532 HydrophobicContact CG-CD1 4.39Å; Y498-G533 CarbonylContact C-O 3.58Å; Y498-G533 WeakPolarHBondContact CA-O 3.49Å; Y498-V534 HydrophobicContact CD1-CG2 3.89Å; Y498-V534 HydrophobicContact CE1-CG2 3.55Å; Y498-P606 HydrophobicContact CE1-CB 4.21Å; Y498-P606 HydrophobicContact CE1-CG 3.8Å
499	S	84.4	Confident	79.4	Confident	26 Å²	26	49.4 Å²	49.4	18%	0.182	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153	170.7	62.8	0	0	0	0	113.7	L407 G533 D535	L407-S499 WeakPolarHBondContact O-CA 3.46Å; S499-G533 PolarHBondContact N-O 3.41Å; S499-G533 PolarHBondContact O-N 3Å; S499-G533 VanDerWaalsContact O-N 3.08Å; S499-D535 WeakPolarHBondContact CB-OD1 3.49Å; S499-D535 WeakPolarHBondContact CB-OD2 3.26Å; S499-D535 PolarHBondContact OG-OD1 3.3Å
500	T	83.4	Confident	77.8	Confident	8 Å²	8	54.2 Å²	54.2	5%	0.049	33%	0.325	C	S	.	.			trans	-82.8	145.6	162.8	57.3	0	0	0	0	111	L407 L530 L532	L407-T500 HydrophobicContact CB-CG2 3.78Å; L407-T500 HydrophobicContact CD1-CG2 4.26Å; L407-T500 HydrophobicContact CG-CG2 4.36Å; L407-T500 PolarHBondContact N-OG1 2.88Å; L407-T500 PolarHBondContact O-N 2.75Å; L407-T500 PolarHBondContact O-OG1 2.81Å; T500-L530 HydrophobicContact CG2-CB 4.2Å; T500-L530 HydrophobicContact CG2-CD1 3.58Å; T500-L532 HydrophobicContact CG2-CD2 3.48Å; T500-L532 VanDerWaalsContact CG2-CD2 3.48Å
501	A	79.1	Confident	75.8	Confident	72 Å²	72	56 Å²	56	60%	0.595	35%	0.346	S	S	*	.			trans	-55.6	135.8	159.7	0	0	0	0	0	110.5	L503	A501-L503 PolarHBondContact O-N 3.41Å
502	P	82	Confident	73.4	Confident	52 Å²	52	60.9 Å²	60.9	34%	0.338	35%	0.354	S	S	.	.			trans	-59.9	108.1	-172.1	-27.2	34.9	0	0	0	114.3	Q404 E406	Q404-P502 HydrophobicContact CB-CB 4.27Å; E406-P502 HydrophobicContact CG-CB 3.68Å; E406-P502 HydrophobicContact CG-CG 3.84Å; E406-P502 VanDerWaalsContact OE1-CG 3.32Å; E406-P502 WeakPolarHBondContact OE1-CG 3.43Å
503	L	86.5	Confident	70.9	Confident	19 Å²	19	64.3 Å²	64.3	10%	0.099	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	121.5	-173.9	-56.2	164.4	0	0	0	110.2	Q404 L405 A501 L505 L530	Q404-L503 CarbonylContact C-O 3.55Å; Q404-L503 WeakPolarHBondContact CA-O 3.25Å; L405-L503 HydrophobicContact CB-CB 4.21Å; L405-L503 HydrophobicContact CB-CD1 4.46Å; L405-L503 HydrophobicContact CD2-CD1 4.01Å; L405-L503 HydrophobicContact CG-CD1 4.21Å; L405-L503 PolarHBondContact N-O 3.36Å; L405-L503 WeakPolarHBondContact O-CB 3.28Å; L405-L503 PolarHBondContact O-N 2.89Å; A501-L503 PolarHBondContact O-N 3.41Å; L503-L505 PolarHBondContact O-N 3.3Å; L503-L530 HydrophobicContact CD1-CD1 3.64Å; L503-L530 HydrophobicContact CD2-CD1 3.94Å; L503-L530 HydrophobicContact CD2-CD2 3.93Å; L503-L530 HydrophobicContact CG-CD1 4.28Å
504	P	83.2	Confident	68.5	Low	40 Å²	40	65.4 Å²	65.4	26%	0.26	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	115.6	-179.5	29.6	-34.1	0	0	0	110.8	V507 L522 W587	P504-V507 HydrophobicContact CB-CG2 4.48Å; P504-L522 HydrophobicContact CB-CD1 4.12Å; P504-L522 HydrophobicContact CG-CD1 4.25Å; P504-L522 WeakPolarHBondContact O-CB 3.42Å; P504-W587 HydrophobicContact CG-CH2 4.21Å; P504-W587 HydrophobicContact CG-CZ3 4.41Å
505	L	81.8	Confident	65.9	Low	1 Å²	1	61.3 Å²	61.3	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-47.6	173.5	-64.9	-176.7	0	0	0	111.7	L318 L384 A403 L405 L503 L521 L522 L523	L318-L505 HydrophobicContact CD2-CD1 3.54Å; L384-L505 HydrophobicContact CD1-CD1 4.26Å; L384-L505 HydrophobicContact CD2-CD1 4.47Å; A403-L505 HydrophobicContact CB-CB 4.22Å; A403-L505 PolarHBondContact O-N 2.99Å; L405-L505 HydrophobicContact CB-CD1 4.06Å; L405-L505 HydrophobicContact CB-CD2 3.89Å; L405-L505 HydrophobicContact CB-CG 3.89Å; L405-L505 HydrophobicContact CD2-CD2 4.31Å; L503-L505 PolarHBondContact O-N 3.3Å; L505-L521 HydrophobicContact CB-CD1 4.13Å; L505-L521 HydrophobicContact CD2-CD1 4.38Å; L505-L521 WeakPolarHBondContact O-CA 3.44Å; L505-L522 PolarHBondContact O-N 3.42Å; L505-L523 HydrophobicContact CD2-CB 3.8Å; L505-L523 HydrophobicContact CD2-CD2 3.86Å; L505-L523 HydrophobicContact CD2-CG 4.36Å
506	I	73.2	Confident	63.5	Low	1 Å²	1	61.2 Å²	61.2	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	123.7	-175.9	-58.4	172.3	0	0	0	108.9	L384 I388 S402 A403 R519	L384-I506 HydrophobicContact CD2-CD1 4.08Å; I388-I506 HydrophobicContact CD1-CD1 3.81Å; S402-I506 WeakPolarHBondContact CA-O 3.33Å; A403-I506 HydrophobicContact CB-CB 3.95Å; A403-I506 HydrophobicContact CB-CD1 4.07Å; A403-I506 HydrophobicContact CB-CG1 4.1Å; A403-I506 PolarHBondContact N-O 2.84Å; A403-I506 VanDerWaalsContact N-O 3.13Å; A403-I506 PolarHBondContact O-N 3.22Å; A403-I506 VanDerWaalsContact O-N 3.16Å; I506-R519 HydrophobicContact CG2-CB 3.91Å; I506-R519 HydrophobicContact CG2-CG 4Å
507	V	60.9	Low	61.2	Low	65 Å²	65	64.3 Å²	64.3	39%	0.394	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.7	167.5	173.1	0	0	0	0	108.6	P504 S509 L522 V585	P504-V507 HydrophobicContact CB-CG2 4.48Å; V507-S509 PolarHBondContact O-N 3.01Å; V507-L522 HydrophobicContact CB-CD1 4.45Å; V507-L522 HydrophobicContact CG2-CD1 3.76Å; V507-V585 HydrophobicContact CG1-CG2 4.47Å; V507-V585 HydrophobicContact CG2-CG2 4.45Å
508	S	56.2	Low	59.1	Low	23 Å²	23	62.7 Å²	62.7	16%	0.161	39%	0.386	C	S	.	.			trans	-71.4	112	166.7	-65.4	0	0	0	0	109.3	L400 T401 I510	L400-S508 PolarHBondContact O-OG 3.18Å; T401-S508 WeakPolarHBondContact O-CB 3.45Å; T401-S508 PolarHBondContact O-N 2.9Å; T401-S508 PolarHBondContact O-OG 2.75Å; S508-I510 PolarHBondContact O-N 3.32Å
509	S	49.3	Very low	57.6	Low	69 Å²	69	66.2 Å²	66.2	48%	0.483	40%	0.399	S	S	.	.			trans	-65.7	92.9	171.4	29	0	0	0	0	110.5	V507 G511	V507-S509 PolarHBondContact O-N 3.01Å; S509-G511 PolarHBondContact O-N 2.89Å
510	I	43.3	Very low	56.6	Low	146 Å²	146	71.3 Å²	71.3	75%	0.749	42%	0.42	S	S	*	.			trans	-81.5	59.6	172.5	-53.1	177.4	0	0	0	108.5	S508	S508-I510 PolarHBondContact O-N 3.32Å
511	G	37.5	Very low	56.2	Low	55 Å²	55	71.5 Å²	71.5	57%	0.567	42%	0.421	S	S	*	.			trans	-116.8	131.3	173.5	0	0	0	0	0	110.2	S509 D513	S509-G511 PolarHBondContact O-N 2.89Å; G511-D513 PolarHBondContact O-N 3.39Å
512	F	29.7	Very low	56.3	Low	208 Å²	208	69 Å²	69	91%	0.912	40%	0.397	S	S	*	.	S	Bend	trans	-76.1	102.3	162.5	-80.7	-103.6	0	0	0	107.6
513	D	30.1	Very low	56.4	Low	161 Å²	161	66.6 Å²	66.6	86%	0.861	38%	0.381	S	S	*	.	S	Bend	trans	151.8	60.5	145	-76.4	-13	0	0	0	114.6	G511	G511-D513 PolarHBondContact O-N 3.39Å
514	S	33.9	Very low	56.3	Low	84 Å²	84	69.1 Å²	69.1	59%	0.587	40%	0.397	S	S	*	.			trans	-157.6	160.1	142.5	88.5	0	0	0	0	111.6	N516	S514-N516 VanDerWaalsContact C-N 3.33Å; S514-N516 PolarHBondContact OG-N 2.9Å
515	S	33	Very low	56.5	Low	29 Å²	29	70.5 Å²	70.5	20%	0.203	41%	0.406	C	S	.	.	S	Bend	trans	-82.6	-6.8	177.1	38.7	0	0	0	0	114	T517	S515-T517 PolarHBondContact O-N 2.75Å
516	N	38.2	Very low	56.8	Low	102 Å²	102	72.1 Å²	72.1	55%	0.545	42%	0.423	S	S	.	.			trans	-101	63.5	-177.1	-73.6	9.5	0	0	0	111.4	S514 G518	S514-N516 VanDerWaalsContact C-N 3.33Å; S514-N516 PolarHBondContact OG-N 2.9Å; N516-G518 PolarHBondContact O-N 3.42Å
517	T	39.8	Very low	57.7	Low	91 Å²	91	76.5 Å²	76.5	56%	0.558	45%	0.446	S	S	*	.			trans	-79.3	52.3	167.9	51.3	0	0	0	0	111.6	S515	S515-T517 PolarHBondContact O-N 2.75Å
518	G	47.4	Very low	59.1	Low	46 Å²	46	75.6 Å²	75.6	47%	0.474	44%	0.436	S	S	.	.			trans	-64.7	149.8	162.9	0	0	0	0	0	109.9	N516 Q520	N516-G518 PolarHBondContact O-N 3.42Å; G518-Q520 PolarHBondContact O-N 3.16Å
519	R	57	Low	60.7	Low	93 Å²	93	79.1 Å²	79.1	35%	0.351	45%	0.45	S	S	.	.			trans	-83.8	89.7	172	-74.3	174.2	173.2	172.9	-4.3	108	L287 I506 L521	L287-R519 HydrophobicContact CD1-CB 4.4Å; I506-R519 HydrophobicContact CG2-CB 3.91Å; I506-R519 HydrophobicContact CG2-CG 4Å; R519-L521 PolarHBondContact O-N 3.26Å
520	Q	63.5	Low	62.5	Low	133 Å²	133	77.4 Å²	77.4	62%	0.621	44%	0.435	S	S	*	.			trans	-61.7	121.5	173.6	-170.8	172.1	13.5	0	0	109.2	G518	G518-Q520 PolarHBondContact O-N 3.16Å
521	L	75.7	Confident	64.6	Low	12 Å²	12	73 Å²	73	6%	0.063	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-76	124	166.6	-179.9	63.9	0	0	0	107.7	L287 P288 L291 L384 L505 R519 L523 W614	L287-L521 HydrophobicContact CD2-CB 4.07Å; P288-L521 HydrophobicContact CG-CD2 3.68Å; L291-L521 HydrophobicContact CD1-CD1 4.48Å; L291-L521 HydrophobicContact CD1-CD2 4.04Å; L291-L521 HydrophobicContact CD2-CD2 4.1Å; L291-L521 HydrophobicContact CG-CD2 4.44Å; L384-L521 HydrophobicContact CD2-CD1 3.95Å; L505-L521 HydrophobicContact CB-CD1 4.13Å; L505-L521 HydrophobicContact CD2-CD1 4.38Å; L505-L521 WeakPolarHBondContact O-CA 3.44Å; R519-L521 PolarHBondContact O-N 3.26Å; L521-L523 HydrophobicContact CD1-CB 4.27Å; L521-L523 HydrophobicContact CG-CB 4.41Å; L521-W614 HydrophobicContact CD2-CZ2 3.76Å; L521-W614 HydrophobicContact CG-CZ2 4.3Å
522	L	80.3	Confident	67	Low	19 Å²	19	70.5 Å²	70.5	10%	0.099	38%	0.383	C	S	.	.			trans	-85.3	-17.6	179.9	-61.6	177	0	0	0	112.9	P504 L505 V507 T524 V585 W587	P504-L522 HydrophobicContact CB-CD1 4.12Å; P504-L522 HydrophobicContact CG-CD1 4.25Å; P504-L522 WeakPolarHBondContact O-CB 3.42Å; L505-L522 PolarHBondContact O-N 3.42Å; V507-L522 HydrophobicContact CB-CD1 4.45Å; V507-L522 HydrophobicContact CG2-CD1 3.76Å; L522-T524 PolarHBondContact O-N 3.3Å; L522-V585 HydrophobicContact CD1-CG1 4.29Å; L522-W587 HydrophobicContact CB-CZ2 3.9Å; L522-W587 WeakPolarHBondContact O-CZ2 3.42Å
523	L	83.2	Confident	69.4	Low	2 Å²	2	61.7 Å²	61.7	1%	0.01	35%	0.351	C	S	.	.			trans	-86.5	86.2	178.4	-167.8	77	0	0	0	110.3	L293 L405 L505 L521 Y528 V612 W614	L293-L523 HydrophobicContact CD2-CD2 4.17Å; L405-L523 HydrophobicContact CD2-CD2 4.25Å; L505-L523 HydrophobicContact CD2-CB 3.8Å; L505-L523 HydrophobicContact CD2-CD2 3.86Å; L505-L523 HydrophobicContact CD2-CG 4.36Å; L521-L523 HydrophobicContact CD1-CB 4.27Å; L521-L523 HydrophobicContact CG-CB 4.41Å; L523-Y528 HydrophobicContact CD1-CE1 4.02Å; L523-Y528 HydrophobicContact CD1-CE2 4.12Å; L523-V612 HydrophobicContact CD1-CG2 4.1Å; L523-V612 HydrophobicContact CD2-CG1 4.06Å; L523-V612 HydrophobicContact CD2-CG2 3.93Å; L523-V612 HydrophobicContact CG-CG1 4.12Å; L523-V612 HydrophobicContact CG-CG2 3.95Å; L523-W614 WeakPolarHBondContact O-CZ2 3.25Å; L523-W614 PolarHBondContact O-NE1 3.32Å
524	T	84.7	Confident	71.8	Confident	71 Å²	71	58.1 Å²	58.1	44%	0.436	34%	0.335	S	S	.	.			trans	-65.9	161.9	174.4	42.1	0	0	0	0	112.6	L522 Y528 V612	L522-T524 PolarHBondContact O-N 3.3Å; T524-Y528 PolarHBondContact N-OH 2.99Å; T524-Y528 WeakPolarHBondContact O-CE2 3.2Å; T524-Y528 PolarHBondContact O-OH 3.08Å; T524-Y528 PolarHBondContact OG1-OH 3.47Å; T524-V612 WeakPolarHBondContact O-CG1 3.45Å
525	P	87.6	Confident	73.7	Confident	69 Å²	69	56.3 Å²	56.3	45%	0.448	32%	0.319	S	S	.	.	S	Bend	trans	-63.7	148.2	166.8	-14.2	29.3	0	0	0	111	V612 W614	P525-V612 VanDerWaalsContact CA-O 3.25Å; P525-V612 WeakPolarHBondContact CA-O 3.48Å; P525-W614 HydrophobicContact CG-CB 4.24Å; P525-W614 HydrophobicContact CG-CD2 3.69Å; P525-W614 HydrophobicContact CG-CE3 4.19Å; P525-W614 HydrophobicContact CG-CG 3.7Å
526	G	89.1	Confident	75.1	Confident	35 Å²	35	61 Å²	61	36%	0.361	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	143.6	178.2	178.7	0	0	0	0	0	113.5	S611 V612	G526-S611 CarbonylContact O-C 3.5Å; G526-S611 VanDerWaalsContact O-CA 3.32Å; G526-S611 WeakPolarHBondContact O-CA 3.39Å; G526-V612 PolarHBondContact N-O 2.88Å; G526-V612 PolarHBondContact O-N 3.01Å
527	L	91.1	Very high	75.9	Confident	94 Å²	94	60.9 Å²	60.9	49%	0.492	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	131.5	173.6	177.9	61.2	0	0	0	110.5	E296	E296-L527 HydrophobicContact CG-CD1 4.39Å; E296-L527 WeakPolarHBondContact OE2-CD1 3.5Å
528	Y	90.7	Very high	75.9	Confident	46 Å²	46	63 Å²	63	18%	0.18	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	139.5	175.4	-72.9	-97.4	0	0	0	110.3	L523 T524 R609 F610 V612	L523-Y528 HydrophobicContact CD1-CE1 4.02Å; L523-Y528 HydrophobicContact CD1-CE2 4.12Å; T524-Y528 PolarHBondContact N-OH 2.99Å; T524-Y528 WeakPolarHBondContact O-CE2 3.2Å; T524-Y528 PolarHBondContact O-OH 3.08Å; T524-Y528 PolarHBondContact OG1-OH 3.47Å; Y528-R609 WeakPolarHBondContact O-CA 3.39Å; Y528-F610 HydrophobicContact CD2-CE2 4.34Å; Y528-F610 HydrophobicContact CG-CE2 4.25Å; Y528-F610 HydrophobicContact CG-CZ 4.1Å; Y528-F610 PolarHBondContact N-O 3.08Å; Y528-F610 PolarHBondContact O-N 3.1Å; Y528-V612 HydrophobicContact CD2-CB 4.31Å; Y528-V612 HydrophobicContact CD2-CG2 3.54Å; Y528-V612 HydrophobicContact CE2-CB 4.07Å; Y528-V612 HydrophobicContact CE2-CG2 3.57Å
529	E	89.3	Confident	75.3	Confident	97 Å²	97	64.6 Å²	64.6	45%	0.453	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127.3	169.6	-175.3	179.3	122.9	0	0	108.4	R531 L608 R609	E529-R531 IonicContact OE1-CZ 3.27Å; E529-R531 VanDerWaalsContact OE1-CZ 3.26Å; E529-R531 IonicContact OE1-NE 2.88Å; E529-R531 PolarHBondContact OE1-NE 3.16Å; E529-R531 VanDerWaalsContact OE1-NE 3.07Å; E529-R531 IonicContact OE1-NH2 3.6Å; E529-R531 PolarHBondContact OE1-NH2 2.85Å; E529-L608 WeakPolarHBondContact CA-O 3.47Å; E529-R609 HydrophobicContact CB-CG 3.91Å; E529-R609 HydrophobicContact CG-CG 3.72Å
530	L	88.4	Confident	74.1	Confident	32 Å²	32	66.2 Å²	66.2	17%	0.168	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.1	179.9	-62.5	177.4	0	0	0	110.1	L407 T500 L503 G607 L608 F610	L407-L530 HydrophobicContact CD1-CD1 4.27Å; T500-L530 HydrophobicContact CG2-CB 4.2Å; T500-L530 HydrophobicContact CG2-CD1 3.58Å; L503-L530 HydrophobicContact CD1-CD1 3.64Å; L503-L530 HydrophobicContact CD2-CD1 3.94Å; L503-L530 HydrophobicContact CD2-CD2 3.93Å; L503-L530 HydrophobicContact CG-CD1 4.28Å; L530-G607 CarbonylContact O-C 3.59Å; L530-G607 WeakPolarHBondContact O-CA 3.29Å; L530-L608 PolarHBondContact N-O 3.08Å; L530-L608 PolarHBondContact O-N 3.09Å; L530-F610 HydrophobicContact CD1-CE1 3.6Å; L530-F610 HydrophobicContact CD1-CZ 4.04Å; L530-F610 HydrophobicContact CG-CE1 3.99Å
531	R	87.6	Confident	72.7	Confident	54 Å²	54	66 Å²	66	20%	0.204	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	133.3	171.7	-58.9	-64.6	169.7	140	5.3	109.4	E529 Y602 S603 W605 P606	E529-R531 IonicContact OE1-CZ 3.27Å; E529-R531 VanDerWaalsContact OE1-CZ 3.26Å; E529-R531 IonicContact OE1-NE 2.88Å; E529-R531 PolarHBondContact OE1-NE 3.16Å; E529-R531 VanDerWaalsContact OE1-NE 3.07Å; E529-R531 IonicContact OE1-NH2 3.6Å; E529-R531 PolarHBondContact OE1-NH2 2.85Å; R531-Y602 HydrophobicContact CB-CD1 4.43Å; R531-Y602 HydrophobicContact CB-CE1 3.84Å; R531-Y602 HydrophobicContact CB-CE2 4.19Å; R531-Y602 HydrophobicContact CG-CE1 4.28Å; R531-Y602 PolarHBondContact O-OH 3.13Å; R531-S603 PolarHBondContact NH1-O 3.29Å; R531-S603 PolarHBondContact NH2-O 2.87Å; R531-W605 HydrophobicContact CB-CB 4.29Å; R531-W605 VanDerWaalsContact CD-O 3.28Å; R531-W605 WeakPolarHBondContact CD-O 3.3Å; R531-W605 PolarHBondContact NH1-O 3.02Å; R531-P606 WeakPolarHBondContact CA-O 3.45Å
532	L	86.4	Confident	70.7	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	43%	0.428	C	S	.	.			trans	-106.4	142.2	-165.4	-55.6	174.9	0	0	0	112.2	F298 V409 Y498 T500 P606 L608	F298-L532 HydrophobicContact CD2-CD1 4.04Å; F298-L532 HydrophobicContact CE2-CD1 3.73Å; V409-L532 HydrophobicContact CB-CD1 4.26Å; V409-L532 HydrophobicContact CG2-CD1 3.75Å; Y498-L532 HydrophobicContact CD1-CB 4.17Å; Y498-L532 HydrophobicContact CG-CB 4.39Å; Y498-L532 HydrophobicContact CG-CD1 4.39Å; T500-L532 HydrophobicContact CG2-CD2 3.48Å; T500-L532 VanDerWaalsContact CG2-CD2 3.48Å; L532-P606 PolarHBondContact N-O 3.23Å; L532-L608 HydrophobicContact CD1-CB 4.13Å; L532-L608 HydrophobicContact CD2-CB 4.24Å; L532-L608 HydrophobicContact CG-CB 4.38Å
533	G	81.6	Confident	68.3	Low	24 Å²	24	77 Å²	77	25%	0.247	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	151.8	168.6	0	0	0	0	0	111.5	Y498 S499	Y498-G533 CarbonylContact C-O 3.58Å; Y498-G533 WeakPolarHBondContact CA-O 3.49Å; S499-G533 PolarHBondContact N-O 3.41Å; S499-G533 PolarHBondContact O-N 3Å; S499-G533 VanDerWaalsContact O-N 3.08Å
534	V	80.3	Confident	65.9	Low	85 Å²	85	81.6 Å²	81.6	52%	0.515	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	128	172.2	178.5	0	0	0	0	109.6	V496 Q497 Y498 T536	V496-V534 HydrophobicContact CG1-CG1 4.33Å; V496-V534 HydrophobicContact CG1-CG2 4.45Å; Q497-V534 WeakPolarHBondContact O-CA 3.45Å; Y498-V534 HydrophobicContact CD1-CG2 3.89Å; Y498-V534 HydrophobicContact CE1-CG2 3.55Å; V534-T536 HydrophobicContact CG1-CG2 4.43Å; V534-T536 PolarHBondContact O-N 3.44Å
535	D	73	Confident	63.1	Low	47 Å²	47	82.5 Å²	82.5	25%	0.251	52%	0.523	S	S	.	.			trans	-75.2	92	175	-84.9	-21.5	0	0	0	110.1	H408 Q497 S499 S537	H408-D535 IonicContact CE1-OD2 2.76Å; H408-D535 PolarHBondContact CE1-OD2 2.83Å; H408-D535 IonicContact ND1-OD2 2.72Å; H408-D535 PolarHBondContact ND1-OD2 3Å; Q497-D535 HydrophobicContact CB-CB 4.1Å; Q497-D535 PolarHBondContact O-N 3.29Å; S499-D535 WeakPolarHBondContact CB-OD1 3.49Å; S499-D535 WeakPolarHBondContact CB-OD2 3.26Å; S499-D535 PolarHBondContact OG-OD1 3.3Å; D535-S537 PolarHBondContact O-N 2.82Å
536	T	62.3	Low	60.4	Low	126 Å²	126	84.2 Å²	84.2	77%	0.773	54%	0.536	S	S	*	.			trans	-76	24	179.2	54.8	0	0	0	0	114.2	V534 D538	V534-T536 HydrophobicContact CG1-CG2 4.43Å; V534-T536 PolarHBondContact O-N 3.44Å; T536-D538 PolarHBondContact O-N 3.06Å; T536-D538 VanDerWaalsContact O-N 3.08Å
537	S	55.9	Low	57.4	Low	100 Å²	100	91.5 Å²	91.5	70%	0.699	57%	0.567	S	S	*	*			trans	-70.5	104.1	177.2	58.6	0	0	0	0	110.7	D535 G539	D535-S537 PolarHBondContact O-N 2.82Å; S537-G539 PolarHBondContact O-N 2.88Å
538	D	39.4	Very low	54.5	Low	137 Å²	137	89.7 Å²	89.7	73%	0.733	57%	0.571	S	S	*	*			trans	-29.8	109.1	-171.6	-77.9	-57.5	0	0	0	115.7	T536 N540	T536-D538 PolarHBondContact O-N 3.06Å; T536-D538 VanDerWaalsContact O-N 3.08Å; D538-N540 HydrophobicContact CB-CB 4.38Å; D538-N540 PolarHBondContact O-N 3.48Å
539	G	35.3	Very low	51.5	Low	78 Å²	78	98.9 Å²	98.9	80%	0.804	61%	0.605	S	S	*	*			trans	-69.2	29.9	169.8	0	0	0	0	0	114.5	S537 V541	S537-G539 PolarHBondContact O-N 2.88Å; G539-V541 PolarHBondContact O-N 2.95Å
540	N	31.2	Very low	48.6	Very low	127 Å²	127	100.3 Å²	100.3	68%	0.679	62%	0.62	S	S	*	*			trans	-75.3	52.6	-178.5	-88.6	-53.5	0	0	0	112.5	D538 S542	D538-N540 HydrophobicContact CB-CB 4.38Å; D538-N540 PolarHBondContact O-N 3.48Å; N540-S542 PolarHBondContact O-N 2.91Å; N540-S542 VanDerWaalsContact O-N 3.13Å
541	V	33.8	Very low	45.8	Very low	129 Å²	129	106.5 Å²	106.5	78%	0.782	65%	0.65	S	S	*	*			trans	-84.3	69	165.7	-172.1	0	0	0	0	108.4	G539 N543	G539-V541 PolarHBondContact O-N 2.95Å; V541-N543 PolarHBondContact O-N 3.4Å
542	S	33.9	Very low	43	Very low	91 Å²	91	110.8 Å²	110.8	64%	0.636	68%	0.677	S	S	*	*			trans	-72.6	117.3	170	48.2	0	0	0	0	109.5	N540 S544	N540-S542 PolarHBondContact O-N 2.91Å; N540-S542 VanDerWaalsContact O-N 3.13Å; S542-S544 PolarHBondContact O-N 2.89Å
543	N	29.2	Very low	40.1	Very low	171 Å²	171	120 Å²	120	91%	0.914	72%	0.717	S	S	*	*			trans	-57.4	102	-176.8	-91.1	-28.7	0	0	0	112	V541	V541-N543 PolarHBondContact O-N 3.4Å
544	S	32.3	Very low	37.6	Very low	98 Å²	98	124.4 Å²	124.4	69%	0.685	74%	0.739	S	S	*	*			trans	-143.6	105.3	166.5	52.9	0	0	0	0	109.5	S542 S546	S542-S544 PolarHBondContact O-N 2.89Å; S544-S546 PolarHBondContact O-N 3.24Å
545	G	25.9	Very low	34.9	Very low	91 Å²	91	125.9 Å²	125.9	94%	0.938	75%	0.748	S	S	*	*			trans	-72.8	111.8	-172.6	0	0	0	0	0	112.7
546	S	31.9	Very low	32.7	Very low	105 Å²	105	127.2 Å²	127.2	73%	0.734	76%	0.759	S	S	*	*			trans	-150.6	131.3	159.1	60	0	0	0	0	111.3	S544 G548	S544-S546 PolarHBondContact O-N 3.24Å; S546-G548 PolarHBondContact O-N 2.81Å
547	N	27	Very low	31	Very low	187 Å²	187	128.3 Å²	128.3	100%	1	76%	0.759	S	S	*	*			trans	-74.6	93.3	-175.7	-76.3	-44.8	0	0	0	111
548	G	28.5	Very low	29.6	Very low	56 Å²	56	131.3 Å²	131.3	58%	0.577	76%	0.76	S	S	*	*			trans	-127.6	23.2	-159.8	0	0	0	0	0	118.4	S546 V550	S546-G548 PolarHBondContact O-N 2.81Å; G548-V550 PolarHBondContact O-N 2.95Å
549	R	28.1	Very low	28.9	Very low	240 Å²	240	130.3 Å²	130.3	91%	0.906	76%	0.762	S	S	*	*			trans	32	60.8	167.8	-161.7	-171.6	-173.5	174.7	4.9	115.7	M551	R549-M551 PolarHBondContact O-N 3.32Å
550	V	28.7	Very low	28.4	Very low	126 Å²	126	131.9 Å²	131.9	76%	0.764	75%	0.751	S	S	*	*			trans	-69.7	117.5	177.3	-179.3	0	0	0	0	109.9	G548	G548-V550 PolarHBondContact O-N 2.95Å
551	M	28.9	Very low	28.2	Very low	163 Å²	163	132.4 Å²	132.4	80%	0.803	75%	0.754	S	S	*	*			trans	-77.6	122.5	160.3	-84.7	-177.2	159.3	0	0	108.5	R549 K553	R549-M551 PolarHBondContact O-N 3.32Å; M551-K553 PolarHBondContact O-N 3.12Å
552	N	28.8	Very low	28	Very low	143 Å²	143	131.6 Å²	131.6	77%	0.765	75%	0.745	S	S	*	*			trans	-59.7	103.9	174.2	-73.8	1	0	0	0	110.2	V554	N552-V554 HydrophobicContact CB-CG2 4.48Å; N552-V554 PolarHBondContact O-N 2.82Å
553	K	26.6	Very low	27.7	Very low	197 Å²	197	134.6 Å²	134.6	86%	0.857	76%	0.755	S	S	*	*			trans	-75.1	72.4	163.5	-80.6	-177.5	173.3	175.5	0	109.1	M551 V555	M551-K553 PolarHBondContact O-N 3.12Å; K553-V555 PolarHBondContact O-N 3.08Å; K553-V555 VanDerWaalsContact O-N 3.08Å
554	V	28	Very low	27.6	Very low	115 Å²	115	131.5 Å²	131.5	70%	0.697	74%	0.742	S	S	*	*			trans	-61	112.2	156.6	-179.1	0	0	0	0	105.7	N552 P556	N552-V554 HydrophobicContact CB-CG2 4.48Å; N552-V554 PolarHBondContact O-N 2.82Å; V554-P556 VanDerWaalsContact O-CD 3.32Å; V554-P556 WeakPolarHBondContact O-CD 3.4Å
555	V	25.2	Very low	27.4	Very low	116 Å²	116	132.2 Å²	132.2	70%	0.703	75%	0.747	S	S	*	*			trans	-67.1	123	175.4	175.2	0	0	0	0	106.7	K553 L557	K553-V555 PolarHBondContact O-N 3.08Å; K553-V555 VanDerWaalsContact O-N 3.08Å; V555-L557 PolarHBondContact O-N 3.38Å
556	P	26.2	Very low	27.6	Very low	75 Å²	75	137.3 Å²	137.3	49%	0.487	75%	0.746	S	S	.	*			trans	-63.2	116.2	173.8	-20.3	32.7	0	0	0	108.4	V554 K558	V554-P556 VanDerWaalsContact O-CD 3.32Å; V554-P556 WeakPolarHBondContact O-CD 3.4Å; P556-K558 PolarHBondContact O-N 2.93Å
557	L	26	Very low	27.3	Very low	150 Å²	150	142.2 Å²	142.2	79%	0.785	75%	0.754	S	S	*	*			trans	-63.4	75.3	156.2	-87.9	140.4	0	0	0	108.1	V555	V555-L557 PolarHBondContact O-N 3.38Å
558	K	25.8	Very low	27.5	Very low	163 Å²	163	138.8 Å²	138.8	71%	0.709	75%	0.745	S	S	*	*			trans	-48.2	144.8	141.4	-67.7	171.3	-179.1	165.3	0	106.5	P556 L560	P556-K558 PolarHBondContact O-N 2.93Å; K558-L560 PolarHBondContact O-N 3.02Å
559	C	25.1	Very low	27.3	Very low	115 Å²	115	146.7 Å²	146.7	78%	0.777	76%	0.759	S	S	*	*			trans	-54.3	107.8	157.8	-49.4	0	0	0	0	106.9	D561	C559-D561 PolarHBondContact O-N 2.84Å
560	L	26.3	Very low	27.4	Very low	111 Å²	111	142 Å²	142	58%	0.581	76%	0.757	S	S	*	*			trans	-74.4	105.6	163.7	-81.3	94.3	0	0	0	105.5	K558 D562	K558-L560 PolarHBondContact O-N 3.02Å; L560-D562 HydrophobicContact CB-CB 4.36Å; L560-D562 WeakPolarHBondContact CB-OD2 3.41Å; L560-D562 VanDerWaalsContact CD2-OD2 3.27Å; L560-D562 WeakPolarHBondContact CD2-OD2 3.37Å; L560-D562 PolarHBondContact O-N 2.85Å
561	D	26.6	Very low	27.2	Very low	138 Å²	138	141 Å²	141	74%	0.738	76%	0.755	S	S	*	*			trans	-69.5	63.6	161.1	-61.8	-47.1	0	0	0	108.2	C559 N563	C559-D561 PolarHBondContact O-N 2.84Å; D561-N563 PolarHBondContact O-N 3.01Å
562	D	28.2	Very low	27.3	Very low	112 Å²	112	137.8 Å²	137.8	60%	0.599	76%	0.755	S	S	*	*			trans	-72.3	61.1	-178.2	-88.6	-21.3	0	0	0	111.3	L560 T564	L560-D562 HydrophobicContact CB-CB 4.36Å; L560-D562 WeakPolarHBondContact CB-OD2 3.41Å; L560-D562 VanDerWaalsContact CD2-OD2 3.27Å; L560-D562 WeakPolarHBondContact CD2-OD2 3.37Å; L560-D562 PolarHBondContact O-N 2.85Å; D562-T564 PolarHBondContact O-N 3.39Å
563	N	27.6	Very low	27.4	Very low	155 Å²	155	138.3 Å²	138.3	83%	0.829	76%	0.758	S	S	*	*			trans	-80.4	55.1	166.1	-77.8	-79.2	0	0	0	110.2	D561	D561-N563 PolarHBondContact O-N 3.01Å
564	T	28.9	Very low	27.4	Very low	105 Å²	105	136.2 Å²	136.2	64%	0.644	76%	0.756	S	S	*	*			trans	-122.6	93.5	171.1	31.2	0	0	0	0	110.4	D562	D562-T564 PolarHBondContact O-N 3.39Å
565	S	27.9	Very low	27.5	Very low	114 Å²	114	138 Å²	138	80%	0.797	76%	0.761	S	S	*	*			trans	50.7	105.1	161.7	58.5	0	0	0	0	118
566	E	29.1	Very low	27.7	Very low	197 Å²	197	141.6 Å²	141.6	92%	0.921	77%	0.768	S	S	*	*				-140.1	160.1	112.6	-127.5	166.7	-149.9	0	0	111.5
567	K	26.5	Very low	27.9	Very low	208 Å²	208	144.1 Å²	144.1	90%	0.904	78%	0.781	S	S	*	*			trans	-119.3	109	-177.1	-78.2	-176.9	178.2	178.6	0	110.1
568	S	29.4	Very low	27.9	Very low	116 Å²	116	144.1 Å²	144.1	81%	0.811	78%	0.782	S	S	*	*			trans	-142	125.5	159.6	52.3	0	0	0	0	109.5
569	Y	24.4	Very low	28.2	Very low	222 Å²	222	142.2 Å²	142.2	87%	0.871	78%	0.78	S	S	*	*			trans	-82.2	125	173.4	-92.6	-111.7	0	0	0	109.6
570	V	30.6	Very low	28.3	Very low	141 Å²	141	140.7 Å²	140.7	86%	0.855	78%	0.775	S	S	*	*			trans	-136.1	120	144.7	-176.6	0	0	0	0	107.2
571	S	25.4	Very low	28.4	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	79%	0.793	S	S	*	*			trans	-83.7	127	177.3	-60.5	0	0	0	0	110.2
572	A	31	Very low	28.5	Very low	97 Å²	97	140.2 Å²	140.2	80%	0.802	79%	0.791	S	S	*	*			trans	-132.8	129.5	164.6	0	0	0	0	0	108.8
573	N	30.6	Very low	28.5	Very low	154 Å²	154	138.3 Å²	138.3	82%	0.824	80%	0.798	S	S	*	*			trans	-61.3	159.8	-160.3	-67.4	-33.9	0	0	0	116
574	N	26.5	Very low	28.6	Very low	152 Å²	152	139.3 Å²	139.3	81%	0.813	80%	0.797	S	S	*	*			trans	-38	144.7	159.7	-50	-56.2	0	0	0	112.9
575	D	30.9	Very low	28.9	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	79%	0.788	S	S	*	*				-152.1	166.4	115.4	-133.2	-33.5	0	0	0	114
576	K	28.5	Very low	28.9	Very low	192 Å²	192	136.8 Å²	136.8	84%	0.835	77%	0.77	S	S	*	*			trans	-90.3	114.2	-171.8	-60.1	162.7	-176.7	163.2	0	111.7
577	V	31	Very low	29.4	Very low	128 Å²	128	133.5 Å²	133.5	78%	0.776	75%	0.75	S	S	*	*			trans	-132.9	117.5	159.5	-175.4	0	0	0	0	110.5	D579	V577-D579 HydrophobicContact CG1-CB 4.5Å
578	N	26.2	Very low	29.8	Very low	150 Å²	150	133.7 Å²	133.7	80%	0.802	75%	0.745	S	S	*	*			trans	-79.5	124.8	157.2	-68	-64.6	0	0	0	107.4
579	D	30.7	Very low	29.9	Very low	124 Å²	124	137 Å²	137	66%	0.663	74%	0.74	S	S	*	*			trans	-145.1	148.6	154.1	-142.3	-21.8	0	0	0	112.7	V577	V577-D579 HydrophobicContact CG1-CB 4.5Å
580	A	28.6	Very low	30.5	Very low	82 Å²	82	131.8 Å²	131.8	68%	0.678	73%	0.725	S	S	*	*			trans	-78.5	133.9	175	0	0	0	0	0	108.9	S582	A580-S582 VanDerWaalsContact C-N 3.28Å; A580-S582 PolarHBondContact O-N 3Å
581	C	26.9	Very low	30.8	Very low	142 Å²	142	136 Å²	136	96%	0.959	73%	0.726	S	S	*	*			trans	-74.6	82.1	-175.7	-154.7	0	0	0	0	111.2
582	S	29.4	Very low	31.4	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	71%	0.708	S	S	*	*			trans	-59.3	133	170	-174	0	0	0	0	109.8	A580 Q584	A580-S582 VanDerWaalsContact C-N 3.28Å; A580-S582 PolarHBondContact O-N 3Å; S582-Q584 PolarHBondContact O-N 2.96Å
583	G	28.5	Very low	31.8	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	70%	0.699	S	S	*	*			trans	-76.7	35.9	-166.1	0	0	0	0	0	116.3	V585	G583-V585 PolarHBondContact O-N 2.64Å
584	Q	29.5	Very low	32.4	Very low	175 Å²	175	135.9 Å²	135.9	82%	0.818	71%	0.705	S	S	*	*			trans	-82.4	110.4	170.1	-95.9	-177.4	-36.7	0	0	110.6	S582 E586	S582-Q584 PolarHBondContact O-N 2.96Å; Q584-E586 VanDerWaalsContact C-N 3.3Å; Q584-E586 PolarHBondContact O-N 3.11Å
585	V	34.7	Very low	33.3	Very low	74 Å²	74	131.1 Å²	131.1	45%	0.448	68%	0.684	S	S	.	*			trans	-77.1	86.1	166.3	-178.7	0	0	0	0	107.9	V507 L522 G583 W587	V507-V585 HydrophobicContact CG1-CG2 4.47Å; V507-V585 HydrophobicContact CG2-CG2 4.45Å; L522-V585 HydrophobicContact CD1-CG1 4.29Å; G583-V585 PolarHBondContact O-N 2.64Å; V585-W587 PolarHBondContact O-N 2.82Å
586	E	29	Very low	34.5	Very low	92 Å²	92	128 Å²	128	43%	0.43	67%	0.674	S	S	.	*			trans	-70.8	119.2	171.8	-170.2	-173.8	-167.2	0	0	109.4	Q584 R588 R589	Q584-E586 VanDerWaalsContact C-N 3.3Å; Q584-E586 PolarHBondContact O-N 3.11Å; E586-R588 HydrophobicContact CG-CB 4.04Å; E586-R588 HydrophobicContact CG-CG 4.33Å; E586-R588 PolarHBondContact O-N 3.1Å; E586-R588 WeakPolarHBondContact OE1-CD 3.25Å; E586-R588 IonicContact OE1-NH1 3.58Å; E586-R589 PolarHBondContact O-N 2.85Å
587	W	38.4	Very low	35.8	Very low	128 Å²	128	123.1 Å²	123.1	49%	0.485	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.5	-12.3	179.6	-78.4	98.3	0	0	0	114.3	P504 L522 V585 R589	P504-W587 HydrophobicContact CG-CH2 4.21Å; P504-W587 HydrophobicContact CG-CZ3 4.41Å; L522-W587 HydrophobicContact CB-CZ2 3.9Å; L522-W587 WeakPolarHBondContact O-CZ2 3.42Å; V585-W587 PolarHBondContact O-N 2.82Å; W587-R589 VanDerWaalsContact C-N 3.28Å; W587-R589 PolarHBondContact O-N 3.48Å
588	R	35.2	Very low	37.1	Very low	212 Å²	212	118.5 Å²	118.5	80%	0.8	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	11.9	179.8	-63.5	179.9	170.4	162.7	-6.9	115.1	E586	E586-R588 HydrophobicContact CG-CB 4.04Å; E586-R588 HydrophobicContact CG-CG 4.33Å; E586-R588 PolarHBondContact O-N 3.1Å; E586-R588 WeakPolarHBondContact OE1-CD 3.25Å; E586-R588 IonicContact OE1-NH1 3.58Å
589	R	32.3	Very low	38.8	Very low	187 Å²	187	116.3 Å²	116.3	71%	0.706	62%	0.623	S	S	*	*			trans	-118.1	45.3	-178.3	-70.2	-170.4	-176.6	161.7	5.3	115.6	E586 W587	E586-R589 PolarHBondContact O-N 2.85Å; W587-R589 VanDerWaalsContact C-N 3.28Å; W587-R589 PolarHBondContact O-N 3.48Å
590	I	37.5	Very low	40.3	Very low	112 Å²	112	114.8 Å²	114.8	57%	0.574	62%	0.615	S	S	*	*			trans	-79.6	109.4	140.8	-59.7	178.3	0	0	0	106.1	F592	I590-F592 HydrophobicContact CB-CD2 4.44Å; I590-F592 HydrophobicContact CB-CE2 3.91Å; I590-F592 HydrophobicContact CB-CZ 4.32Å; I590-F592 HydrophobicContact CG2-CD2 4.06Å; I590-F592 HydrophobicContact CG2-CE1 4.12Å; I590-F592 HydrophobicContact CG2-CE2 3.62Å; I590-F592 HydrophobicContact CG2-CG 4.49Å; I590-F592 HydrophobicContact CG2-CZ 3.65Å; I590-F592 WeakPolarHBondContact O-CD2 3.44Å; I590-F592 PolarHBondContact O-N 3.26Å; I590-F592 VanDerWaalsContact O-N 3.1Å
591	R	36	Very low	42.3	Very low	230 Å²	230	116.3 Å²	116.3	87%	0.868	61%	0.608	S	S	*	*			trans	-79.7	89.2	175.9	-67.2	-165.5	-165.9	-155.7	6.1	109.7
592	F	38	Very low	44.3	Very low	77 Å²	77	113.3 Å²	113.3	34%	0.338	58%	0.577	S	S	.	*			trans	-63.5	155.6	160	-60.9	-80.6	0	0	0	110	I590 L599 Y602	I590-F592 HydrophobicContact CB-CD2 4.44Å; I590-F592 HydrophobicContact CB-CE2 3.91Å; I590-F592 HydrophobicContact CB-CZ 4.32Å; I590-F592 HydrophobicContact CG2-CD2 4.06Å; I590-F592 HydrophobicContact CG2-CE1 4.12Å; I590-F592 HydrophobicContact CG2-CE2 3.62Å; I590-F592 HydrophobicContact CG2-CG 4.49Å; I590-F592 HydrophobicContact CG2-CZ 3.65Å; I590-F592 WeakPolarHBondContact O-CD2 3.44Å; I590-F592 PolarHBondContact O-N 3.26Å; I590-F592 VanDerWaalsContact O-N 3.1Å; F592-L599 HydrophobicContact CD2-CD1 4.29Å; F592-L599 HydrophobicContact CG-CD1 4.47Å; F592-Y602 HydrophobicContact CZ-CD1 4.46Å; F592-Y602 HydrophobicContact CZ-CE1 4.2Å
593	P	39.9	Very low	46.2	Very low	96 Å²	96	111.3 Å²	111.3	62%	0.623	56%	0.564	S	S	*	*			trans	-57.2	146.9	170.7	-23	34.4	0	0	0	111.5	S595	P593-S595 PolarHBondContact O-N 3.29Å
594	N	41.8	Very low	48.5	Very low	179 Å²	179	113.9 Å²	113.9	96%	0.957	55%	0.551	S	S	*	*	S	Bend	trans	-75.8	49.6	-177.6	-72.1	5.5	0	0	0	113.1
595	S	45.8	Very low	51.1	Low	52 Å²	52	110.8 Å²	110.8	36%	0.364	53%	0.532	S	S	.	.			trans	-124.8	113.5	176.8	52	0	0	0	0	108.8	P593 T597 A598	P593-S595 PolarHBondContact O-N 3.29Å; S595-T597 PolarHBondContact O-N 2.96Å; S595-T597 VanDerWaalsContact O-N 3.17Å; S595-A598 WeakPolarHBondContact O-CB 3.42Å; S595-A598 PolarHBondContact O-N 3.25Å
596	S	55.9	Low	53.7	Low	87 Å²	87	107.9 Å²	107.9	61%	0.608	51%	0.514	S	S	*	.	H	α-helix	trans	-56.4	-34.5	-174.9	53.2	0	0	0	0	113.3	A598 L599 D600	S596-A598 PolarHBondContact O-N 3.11Å; S596-A598 VanDerWaalsContact O-N 3.16Å; S596-L599 WeakPolarHBondContact O-CA 3.44Å; S596-L599 WeakPolarHBondContact O-CB 3.44Å; S596-L599 PolarHBondContact O-N 3.35Å; S596-D600 PolarHBondContact O-N 2.9Å; S596-D600 VanDerWaalsContact O-N 3.1Å
597	T	57.4	Low	56.6	Low	88 Å²	88	103.5 Å²	103.5	54%	0.54	49%	0.494	S	S	.	.	H	α-helix	trans	-49.6	-39.4	174.5	51.3	0	0	0	0	113.3	S595 L599 D600 E601	S595-T597 PolarHBondContact O-N 2.96Å; S595-T597 VanDerWaalsContact O-N 3.17Å; T597-L599 VanDerWaalsContact C-N 3.3Å; T597-L599 PolarHBondContact O-N 3.36Å; T597-D600 PolarHBondContact O-N 3.38Å; T597-E601 WeakPolarHBondContact O-CB 3.39Å; T597-E601 WeakPolarHBondContact O-CG 3.44Å; T597-E601 PolarHBondContact O-N 3.49Å
598	A	58	Low	59.1	Low	32 Å²	32	97.4 Å²	97.4	26%	0.264	47%	0.471	S	S	.	.	H	α-helix	trans	-69.4	-27.5	179.4	0	0	0	0	0	112.8	S595 S596 Y602	S595-A598 WeakPolarHBondContact O-CB 3.42Å; S595-A598 PolarHBondContact O-N 3.25Å; S596-A598 PolarHBondContact O-N 3.11Å; S596-A598 VanDerWaalsContact O-N 3.16Å; A598-Y602 VanDerWaalsContact O-CB 3.31Å; A598-Y602 WeakPolarHBondContact O-CB 3.44Å; A598-Y602 PolarHBondContact O-N 2.68Å; A598-Y602 VanDerWaalsContact O-N 3.16Å
599	L	61	Low	61.8	Low	103 Å²	103	90.7 Å²	90.7	54%	0.539	45%	0.446	S	S	.	.	H	α-helix	trans	-77.5	-42.9	175.6	-134	78.9	0	0	0	111	F592 S596 T597 E601 Y602 S603	F592-L599 HydrophobicContact CD2-CD1 4.29Å; F592-L599 HydrophobicContact CG-CD1 4.47Å; S596-L599 WeakPolarHBondContact O-CA 3.44Å; S596-L599 WeakPolarHBondContact O-CB 3.44Å; S596-L599 PolarHBondContact O-N 3.35Å; T597-L599 VanDerWaalsContact C-N 3.3Å; T597-L599 PolarHBondContact O-N 3.36Å; L599-E601 VanDerWaalsContact C-N 3.27Å; L599-E601 PolarHBondContact O-N 2.84Å; L599-Y602 PolarHBondContact O-N 2.74Å; L599-S603 PolarHBondContact O-N 3.31Å; L599-S603 PolarHBondContact O-OG 3.03Å
600	D	63.1	Low	64.7	Low	92 Å²	92	81.8 Å²	81.8	49%	0.492	41%	0.412	S	S	.	.	H	α-helix	trans	-71.1	-19.6	177.7	-66.4	-33.4	0	0	0	113.6	S596 T597 S603 R604	S596-D600 PolarHBondContact O-N 2.9Å; S596-D600 VanDerWaalsContact O-N 3.1Å; T597-D600 PolarHBondContact O-N 3.38Å; D600-S603 PolarHBondContact O-OG 2.85Å; D600-R604 WeakPolarHBondContact O-CD 3.36Å; D600-R604 PolarHBondContact O-NE 3Å
601	E	69.3	Low	67.3	Low	114 Å²	114	77.9 Å²	77.9	53%	0.533	40%	0.395	S	S	.	.	H	α-helix	trans	-79.8	-47.8	166.2	-77.6	-177.6	-170.5	0	0	111.3	T597 L599 S603 R604 W605	T597-E601 WeakPolarHBondContact O-CB 3.39Å; T597-E601 WeakPolarHBondContact O-CG 3.44Å; T597-E601 PolarHBondContact O-N 3.49Å; L599-E601 VanDerWaalsContact C-N 3.27Å; L599-E601 PolarHBondContact O-N 2.84Å; E601-S603 VanDerWaalsContact C-N 3.32Å; E601-S603 PolarHBondContact O-N 3.19Å; E601-R604 WeakPolarHBondContact O-CB 3.42Å; E601-R604 PolarHBondContact O-N 3.5Å; E601-R604 VanDerWaalsContact O-N 3.1Å; E601-W605 PolarHBondContact O-NE1 2.81Å
602	Y	69.2	Low	69.9	Low	79 Å²	79	67 Å²	67	31%	0.31	35%	0.354	S	S	.	.	H	α-helix	trans	-65.5	-31.7	-175.8	-170.2	-109.7	0	0	0	113.4	R531 F592 A598 L599 R604 W605	R531-Y602 HydrophobicContact CB-CD1 4.43Å; R531-Y602 HydrophobicContact CB-CE1 3.84Å; R531-Y602 HydrophobicContact CB-CE2 4.19Å; R531-Y602 HydrophobicContact CG-CE1 4.28Å; R531-Y602 PolarHBondContact O-OH 3.13Å; F592-Y602 HydrophobicContact CZ-CD1 4.46Å; F592-Y602 HydrophobicContact CZ-CE1 4.2Å; A598-Y602 VanDerWaalsContact O-CB 3.31Å; A598-Y602 WeakPolarHBondContact O-CB 3.44Å; A598-Y602 PolarHBondContact O-N 2.68Å; A598-Y602 VanDerWaalsContact O-N 3.16Å; L599-Y602 PolarHBondContact O-N 2.74Å; Y602-R604 PolarHBondContact O-N 2.86Å; Y602-R604 VanDerWaalsContact O-N 3.13Å; Y602-W605 AromaticContact CD2-CD2 3.88Å; Y602-W605 HydrophobicContact CD2-CD2 3.88Å; Y602-W605 HydrophobicContact CD2-CE3 4.03Å; Y602-W605 HydrophobicContact CD2-CG 4.24Å; Y602-W605 HydrophobicContact CD2-CZ3 4.45Å; Y602-W605 HydrophobicContact CE2-CD2 4.27Å; Y602-W605 AromaticContact CE2-CE3 3.97Å; Y602-W605 HydrophobicContact CE2-CE3 3.97Å; Y602-W605 HydrophobicContact CE2-CZ3 4.31Å; Y602-W605 WeakPolarHBondContact O-CB 3.27Å; Y602-W605 PolarHBondContact O-N 3.18Å
603	S	70.2	Confident	72.3	Confident	57 Å²	57	66.4 Å²	66.4	40%	0.399	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.2	173.8	60.1	0	0	0	0	114.3	R531 L599 D600 E601	R531-S603 PolarHBondContact NH1-O 3.29Å; R531-S603 PolarHBondContact NH2-O 2.87Å; L599-S603 PolarHBondContact O-N 3.31Å; L599-S603 PolarHBondContact O-OG 3.03Å; D600-S603 PolarHBondContact O-OG 2.85Å; E601-S603 VanDerWaalsContact C-N 3.32Å; E601-S603 PolarHBondContact O-N 3.19Å
604	R	76.7	Confident	74.7	Confident	126 Å²	126	64 Å²	64	48%	0.475	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-0	-179.6	-54.6	179.5	-165.7	-120	1.5	113.8	S301 E302 D600 E601 Y602	S301-R604 WeakPolarHBondContact CA-O 3.28Å; S301-R604 WeakPolarHBondContact CB-O 3.35Å; S301-R604 PolarHBondContact OG-O 3.28Å; E302-R604 HydrophobicContact CB-CB 4.25Å; E302-R604 PolarHBondContact N-O 2.94Å; D600-R604 WeakPolarHBondContact O-CD 3.36Å; D600-R604 PolarHBondContact O-NE 3Å; E601-R604 WeakPolarHBondContact O-CB 3.42Å; E601-R604 PolarHBondContact O-N 3.5Å; E601-R604 VanDerWaalsContact O-N 3.1Å; Y602-R604 PolarHBondContact O-N 2.86Å; Y602-R604 VanDerWaalsContact O-N 3.13Å
605	W	84.5	Confident	76.7	Confident	110 Å²	110	57.7 Å²	57.7	42%	0.417	30%	0.297	S	S	.	.	S	Bend	trans	-73.9	160.4	-179.6	-73.7	31.9	0	0	0	111.3	R531 E601 Y602 G607	R531-W605 HydrophobicContact CB-CB 4.29Å; R531-W605 VanDerWaalsContact CD-O 3.28Å; R531-W605 WeakPolarHBondContact CD-O 3.3Å; R531-W605 PolarHBondContact NH1-O 3.02Å; E601-W605 PolarHBondContact O-NE1 2.81Å; Y602-W605 AromaticContact CD2-CD2 3.88Å; Y602-W605 HydrophobicContact CD2-CD2 3.88Å; Y602-W605 HydrophobicContact CD2-CE3 4.03Å; Y602-W605 HydrophobicContact CD2-CG 4.24Å; Y602-W605 HydrophobicContact CD2-CZ3 4.45Å; Y602-W605 HydrophobicContact CE2-CD2 4.27Å; Y602-W605 AromaticContact CE2-CE3 3.97Å; Y602-W605 HydrophobicContact CE2-CE3 3.97Å; Y602-W605 HydrophobicContact CE2-CZ3 4.31Å; Y602-W605 WeakPolarHBondContact O-CB 3.27Å; Y602-W605 PolarHBondContact O-N 3.18Å; W605-G607 PolarHBondContact O-N 3.05Å
606	P	88.3	Confident	77.9	Confident	12 Å²	12	58.5 Å²	58.5	8%	0.078	30%	0.297	C	S	.	.			trans	-56.1	138.1	176.9	-24.4	35.5	0	0	0	112.1	F298 Y299 Y498 R531 L532	F298-P606 HydrophobicContact CE1-CB 4.42Å; F298-P606 HydrophobicContact CE2-CB 4.13Å; F298-P606 HydrophobicContact CZ-CB 3.71Å; Y299-P606 CarbonylContact O-C 3.57Å; Y299-P606 VanDerWaalsContact O-CA 3.22Å; Y299-P606 WeakPolarHBondContact O-CA 3.48Å; Y498-P606 HydrophobicContact CE1-CB 4.21Å; Y498-P606 HydrophobicContact CE1-CG 3.8Å; R531-P606 WeakPolarHBondContact CA-O 3.45Å; L532-P606 PolarHBondContact N-O 3.23Å
607	G	89.4	Confident	78	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	144	-173.2	0	0	0	0	0	113.3	F298 Y299 L530 W605	F298-G607 CarbonylContact C-O 3.57Å; F298-G607 WeakPolarHBondContact CA-O 3.28Å; Y299-G607 PolarHBondContact N-O 3.18Å; Y299-G607 PolarHBondContact O-N 2.79Å; L530-G607 CarbonylContact O-C 3.59Å; L530-G607 WeakPolarHBondContact O-CA 3.29Å; W605-G607 PolarHBondContact O-N 3.05Å
608	L	92.3	Very high	77.6	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	123.5	167.1	179.8	66.4	0	0	0	109.1	F295 V314 I344 L407 V409 E529 L530 L532 F610	F295-L608 HydrophobicContact CD1-CD1 4.09Å; F295-L608 HydrophobicContact CD1-CD2 4.27Å; F295-L608 HydrophobicContact CD1-CG 4.36Å; F295-L608 HydrophobicContact CE1-CD2 4.14Å; V314-L608 HydrophobicContact CG1-CD2 4.42Å; V314-L608 HydrophobicContact CG2-CD1 4.08Å; V314-L608 HydrophobicContact CG2-CD2 4.46Å; I344-L608 HydrophobicContact CD1-CD1 3.53Å; L407-L608 HydrophobicContact CB-CD2 4.43Å; L407-L608 HydrophobicContact CD1-CD2 3.92Å; V409-L608 HydrophobicContact CG2-CD1 4.45Å; V409-L608 HydrophobicContact CG2-CD2 3.95Å; E529-L608 WeakPolarHBondContact CA-O 3.47Å; L530-L608 PolarHBondContact N-O 3.08Å; L530-L608 PolarHBondContact O-N 3.09Å; L532-L608 HydrophobicContact CD1-CB 4.13Å; L532-L608 HydrophobicContact CD2-CB 4.24Å; L532-L608 HydrophobicContact CG-CB 4.38Å; L608-F610 HydrophobicContact CG-CD1 4.49Å
609	R	91.8	Very high	76.9	Confident	70 Å²	70	68.8 Å²	68.8	26%	0.264	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134.7	174.2	-74.3	174.3	45.4	155.2	-5.2	111.7	E296 G297 Y299 Y528 E529	E296-R609 HydrophobicContact CB-CB 4.09Å; E296-R609 PolarHBondContact N-O 3.03Å; E296-R609 IonicContact OE1-NH2 2.74Å; E296-R609 WeakPolarHBondContact OE2-CB 3.42Å; E296-R609 IonicContact OE2-CZ 3.12Å; E296-R609 IonicContact OE2-NE 3.38Å; E296-R609 PolarHBondContact OE2-NE 3.48Å; E296-R609 IonicContact OE2-NH2 2.7Å; E296-R609 PolarHBondContact OE2-NH2 3.27Å; G297-R609 PolarHBondContact N-O 2.89Å; G297-R609 PolarHBondContact O-N 2.94Å; Y299-R609 HydrophobicContact CD2-CG 4.33Å; Y299-R609 HydrophobicContact CE2-CB 3.95Å; Y299-R609 HydrophobicContact CE2-CG 3.93Å; Y528-R609 WeakPolarHBondContact O-CA 3.39Å; E529-R609 HydrophobicContact CB-CG 3.91Å; E529-R609 HydrophobicContact CG-CG 3.72Å
610	F	92.3	Very high	75.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	146.6	175.9	65.1	-79.5	0	0	0	111.2	L293 I294 F295 L407 Y528 L530 L608 V612	L293-F610 HydrophobicContact CD2-CD2 4.21Å; L293-F610 HydrophobicContact CD2-CE2 4.15Å; I294-F610 CarbonylContact O-C 3.44Å; I294-F610 WeakPolarHBondContact O-CA 3.36Å; I294-F610 WeakPolarHBondContact O-CB 3.47Å; F295-F610 HydrophobicContact CB-CB 4.5Å; F295-F610 HydrophobicContact CD1-CB 3.64Å; F295-F610 HydrophobicContact CD1-CG 4.26Å; F295-F610 HydrophobicContact CE1-CB 4.07Å; F295-F610 HydrophobicContact CE1-CD1 4.49Å; F295-F610 HydrophobicContact CE1-CG 4.24Å; F295-F610 HydrophobicContact CG-CB 4.22Å; L407-F610 HydrophobicContact CD1-CD1 4.45Å; L407-F610 HydrophobicContact CD1-CE1 3.98Å; L407-F610 HydrophobicContact CD1-CZ 4.22Å; Y528-F610 HydrophobicContact CD2-CE2 4.34Å; Y528-F610 HydrophobicContact CG-CE2 4.25Å; Y528-F610 HydrophobicContact CG-CZ 4.1Å; Y528-F610 PolarHBondContact N-O 3.08Å; Y528-F610 PolarHBondContact O-N 3.1Å; L530-F610 HydrophobicContact CD1-CE1 3.6Å; L530-F610 HydrophobicContact CD1-CZ 4.04Å; L530-F610 HydrophobicContact CG-CE1 3.99Å; L608-F610 HydrophobicContact CG-CD1 4.49Å; F610-V612 HydrophobicContact CD2-CG2 4.05Å; F610-V612 HydrophobicContact CE2-CG2 3.71Å
611	S	92.6	Very high	74.6	Confident	30 Å²	30	72.6 Å²	72.6	21%	0.21	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	147.1	169.3	57.3	0	0	0	0	111.4	L293 I294 G526	L293-S611 WeakPolarHBondContact CA-O 3.45Å; I294-S611 PolarHBondContact N-O 2.93Å; I294-S611 PolarHBondContact O-N 2.9Å; G526-S611 CarbonylContact O-C 3.5Å; G526-S611 VanDerWaalsContact O-CA 3.32Å; G526-S611 WeakPolarHBondContact O-CA 3.39Å
612	V	91.1	Very high	72.9	Confident	3 Å²	3	75 Å²	75	2%	0.018	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.2	174	179	0	0	0	0	108.5	L291 E292 L293 L523 T524 P525 G526 Y528 F610	L291-V612 HydrophobicContact CD2-CG1 4.02Å; E292-V612 WeakPolarHBondContact O-CA 3.29Å; L293-V612 HydrophobicContact CD2-CG1 4.49Å; L293-V612 HydrophobicContact CD2-CG2 3.82Å; L523-V612 HydrophobicContact CD1-CG2 4.1Å; L523-V612 HydrophobicContact CD2-CG1 4.06Å; L523-V612 HydrophobicContact CD2-CG2 3.93Å; L523-V612 HydrophobicContact CG-CG1 4.12Å; L523-V612 HydrophobicContact CG-CG2 3.95Å; T524-V612 WeakPolarHBondContact O-CG1 3.45Å; P525-V612 VanDerWaalsContact CA-O 3.25Å; P525-V612 WeakPolarHBondContact CA-O 3.48Å; G526-V612 PolarHBondContact N-O 2.88Å; G526-V612 PolarHBondContact O-N 3.01Å; Y528-V612 HydrophobicContact CD2-CB 4.31Å; Y528-V612 HydrophobicContact CD2-CG2 3.54Å; Y528-V612 HydrophobicContact CE2-CB 4.07Å; Y528-V612 HydrophobicContact CE2-CG2 3.57Å; F610-V612 HydrophobicContact CD2-CG2 4.05Å; F610-V612 HydrophobicContact CE2-CG2 3.71Å
613	I	88.8	Confident	71.3	Confident	63 Å²	63	78.1 Å²	78.1	32%	0.323	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.7	174.8	-57.2	-179.2	0	0	0	109	E292 I294	E292-I613 HydrophobicContact CB-CB 4.33Å; E292-I613 PolarHBondContact N-O 3.45Å; E292-I613 PolarHBondContact O-N 3.43Å; I294-I613 HydrophobicContact CD1-CD1 3.71Å
614	W	89	Confident	69.6	Low	46 Å²	46	81.2 Å²	81.2	17%	0.174	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	127.1	175.5	-72.9	12.7	0	0	0	109.4	P288 L291 L521 L523 P525	P288-W614 HydrophobicContact CB-CB 3.8Å; P288-W614 HydrophobicContact CB-CD2 3.99Å; P288-W614 HydrophobicContact CB-CE3 4.28Å; P288-W614 HydrophobicContact CB-CG 3.79Å; P288-W614 HydrophobicContact CG-CB 4.42Å; P288-W614 HydrophobicContact CG-CD2 3.87Å; P288-W614 HydrophobicContact CG-CE3 4.37Å; P288-W614 HydrophobicContact CG-CG 3.88Å; L291-W614 VanDerWaalsContact CD2-CD1 3.41Å; L291-W614 HydrophobicContact CD2-CG 4.45Å; L521-W614 HydrophobicContact CD2-CZ2 3.76Å; L521-W614 HydrophobicContact CG-CZ2 4.3Å; L523-W614 WeakPolarHBondContact O-CZ2 3.25Å; L523-W614 PolarHBondContact O-NE1 3.32Å; P525-W614 HydrophobicContact CG-CB 4.24Å; P525-W614 HydrophobicContact CG-CD2 3.69Å; P525-W614 HydrophobicContact CG-CE3 4.19Å; P525-W614 HydrophobicContact CG-CG 3.7Å
615	H	83.8	Confident	67.6	Low	46 Å²	46	78 Å²	78	21%	0.213	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.9	177.3	-66.9	-79.4	0	0	0	110.8	Q289 E290 E292 R381	Q289-H615 WeakPolarHBondContact CB-O 3.47Å; Q289-H615 PolarHBondContact N-O 3.45Å; E290-H615 HydrophobicContact CB-CB 4.24Å; E290-H615 PolarHBondContact N-O 2.81Å; E290-H615 VanDerWaalsContact N-O 3.1Å; E290-H615 PolarHBondContact O-N 2.82Å; E292-H615 IonicContact OE2-CD2 2.78Å; E292-H615 IonicContact OE2-CE1 2.74Å; E292-H615 IonicContact OE2-NE2 3.2Å; E292-H615 PolarHBondContact OE2-NE2 2.96Å; R381-H615 VanDerWaalsContact CZ-CD2 3.5Å; R381-H615 PolarHBondContact NH1-CE1 3.39Å; R381-H615 PolarHBondContact NH1-ND1 3.24Å; R381-H615 PolarHBondContact NH1-NE2 3.37Å
616	N	70.6	Confident	65.2	Low	70 Å²	70	77 Å²	77	37%	0.374	40%	0.398	S	S	.	.			trans	-122.7	12.9	-175	-62.4	-21.7	0	0	0	113.4	T282	T282-N616 WeakPolarHBondContact CG2-ND2 3.18Å; T282-N616 PolarHBondContact OG1-ND2 3.22Å
617	K	58.8	Low	62.6	Low	168 Å²	168	80.9 Å²	80.9	73%	0.73	43%	0.425	S	S	*	.	S	Bend	trans	-132.3	136.4	174.5	-73.5	-174.6	177.5	179.5	0	109.4	E619	K617-E619 PolarHBondContact O-N 3.31Å; K617-E619 VanDerWaalsContact O-N 3.11Å
618	L	48.9	Very low	60	Low	105 Å²	105	91.9 Å²	91.9	55%	0.55	47%	0.466	S	S	.	.			trans	-79.1	87.9	173.5	-153.1	93.8	0	0	0	109.1	N620	L618-N620 PolarHBondContact O-N 3.08Å
619	E	43.3	Very low	57.1	Low	149 Å²	149	96.5 Å²	96.5	70%	0.696	50%	0.498	S	S	*	.			trans	-74.4	118.7	167.1	-69.2	-165.8	159.9	0	0	109.2	K617 N621	K617-E619 PolarHBondContact O-N 3.31Å; K617-E619 VanDerWaalsContact O-N 3.11Å; E619-N621 VanDerWaalsContact C-N 3.28Å; E619-N621 PolarHBondContact O-N 3.12Å
620	N	33.8	Very low	54.2	Low	142 Å²	142	101.5 Å²	101.5	76%	0.759	53%	0.526	S	S	*	.			trans	-74.8	74.2	-175.5	-76.8	-33	0	0	0	111.8	L618	L618-N620 PolarHBondContact O-N 3.08Å
621	N	41.4	Very low	51.4	Low	134 Å²	134	109.8 Å²	109.8	72%	0.717	57%	0.565	S	S	*	*	S	Bend	trans	-137.2	114	171.2	-88.8	-48.9	0	0	0	112.3	E619	E619-N621 VanDerWaalsContact C-N 3.28Å; E619-N621 PolarHBondContact O-N 3.12Å
622	Q	35.1	Very low	48.6	Very low	163 Å²	163	114.4 Å²	114.4	76%	0.762	59%	0.592	S	S	*	*			trans	42.7	73.3	161.1	-56.2	-169.1	15.4	0	0	117.9	T624	Q622-T624 PolarHBondContact O-N 2.97Å
623	I	35.3	Very low	45.9	Very low	145 Å²	145	125.5 Å²	125.5	74%	0.744	63%	0.634	S	S	*	*			trans	-72.5	89	167.6	-54.3	175.8	0	0	0	110.4	S625	I623-S625 VanDerWaalsContact C-N 3.29Å; I623-S625 PolarHBondContact O-N 2.7Å
624	T	34.9	Very low	43.2	Very low	122 Å²	122	133.3 Å²	133.3	75%	0.748	66%	0.659	S	S	*	*			trans	-77	75.8	167.5	39.3	0	0	0	0	110.7	Q622 P626	Q622-T624 PolarHBondContact O-N 2.97Å; T624-P626 WeakPolarHBondContact O-CD 3.49Å; T624-P626 VanDerWaalsContact O-N 3.11Å
625	S	34	Very low	40.5	Very low	60 Å²	60	139 Å²	139	42%	0.42	69%	0.688	S	S	.	*			trans	-57.1	113.6	-178.9	63.9	0	0	0	0	112.2	I623	I623-S625 VanDerWaalsContact C-N 3.29Å; I623-S625 PolarHBondContact O-N 2.7Å
626	P	34.4	Very low	38	Very low	87 Å²	87	143.6 Å²	143.6	57%	0.565	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	148.5	172.9	-17	32.3	0	0	0	109.9	T624	T624-P626 WeakPolarHBondContact O-CD 3.49Å; T624-P626 VanDerWaalsContact O-N 3.11Å
627	C	33.3	Very low	36.3	Very low	95 Å²	95	148.3 Å²	148.3	64%	0.642	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.3	37.2	172.1	-60.9	0	0	0	0	117.7	S629	C627-S629 PolarHBondContact O-N 2.91Å
628	R	33.9	Very low	35.1	Very low	232 Å²	232	146.5 Å²	146.5	88%	0.875	74%	0.742	S	S	*	*			trans	-73.6	58.1	147.3	-81.4	-166.5	176.2	-167.7	1.9	111.2
629	S	32	Very low	34.4	Very low	97 Å²	97	149.2 Å²	149.2	68%	0.678	75%	0.752	S	S	*	*			trans	-146.7	61.6	180	-162.3	0	0	0	0	112.3	C627	C627-S629 PolarHBondContact O-N 2.91Å
630	M	31.9	Very low	34	Very low	174 Å²	174	148.8 Å²	148.8	86%	0.857	75%	0.752	S	S	*	*	S	Bend	trans	-148.5	-7.7	164.2	-117.9	-173.8	-70.6	0	0	114.6	T632	M630-T632 VanDerWaalsContact C-N 3.26Å; M630-T632 PolarHBondContact O-N 3.27Å
631	E	33.3	Very low	34	Very low	175 Å²	175	149.9 Å²	149.9	82%	0.818	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-22.6	179.5	-126.8	71.5	-121.5	0	0	113.7
632	T	34.1	Very low	33.7	Very low	126 Å²	126	147.4 Å²	147.4	77%	0.773	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	17.4	-167	47.3	0	0	0	0	115.6	M630	M630-T632 VanDerWaalsContact C-N 3.26Å; M630-T632 PolarHBondContact O-N 3.27Å
633	R	32.8	Very low	33.6	Very low	237 Å²	237	147.1 Å²	147.1	89%	0.894	75%	0.749	S	S	*	*			trans	-112.3	40.1	171.7	-92.9	-174.4	170.5	176.7	-0.9	113.4
634	R	32	Very low	33.4	Very low	226 Å²	226	143.2 Å²	143.2	85%	0.853	74%	0.744	S	S	*	*	S	Bend	trans	-125.8	22.8	176.3	-74.1	-167.8	175.7	-176	3.7	115.1
635	Q	32.8	Very low	33.4	Very low	165 Å²	165	147.7 Å²	147.7	77%	0.771	75%	0.747	S	S	*	*	S	Bend	trans	-131.8	173.3	155	-97.7	105	-2.7	0	0	109
636	D	32.2	Very low	33.4	Very low	144 Å²	144	149.7 Å²	149.7	77%	0.77	76%	0.761	S	S	*	*			trans	59.2	82.4	170.9	-51.8	-22.9	0	0	0	116.7
637	N	34.9	Very low	33.2	Very low	169 Å²	169	151.3 Å²	151.3	90%	0.904	78%	0.775	S	S	*	*				-171.5	104.7	117.2	-98.6	-63.9	0	0	0	110.4
638	T	33.5	Very low	33	Very low	129 Å²	129	155 Å²	155	79%	0.791	79%	0.787	S	S	*	*			trans	-118.6	162.4	172.6	47.3	0	0	0	0	110.5
639	H	34.7	Very low	32.9	Very low	162 Å²	162	150.3 Å²	150.3	75%	0.75	78%	0.784	S	S	*	*			trans	85.4	148.9	175.6	-85.5	-120.6	0	0	0	118.9
640	M	34	Very low	32.9	Very low	141 Å²	141	156.1 Å²	156.1	70%	0.695	79%	0.791	S	S	*	*			trans	62.6	108.5	-176.4	-55.9	-55.7	114.2	0	0	115.7
641	H	34.5	Very low	32.8	Very low	164 Å²	164	152 Å²	152	76%	0.759	78%	0.78	S	S	*	*				67.6	134.3	51.2	-65.2	-93.3	0	0	0	113.6
642	A	33.7	Very low	32.7	Very low	82 Å²	82	151 Å²	151	68%	0.678	78%	0.777	S	S	*	*			cis	-157.1	153.3	-1.2	0	0	0	0	0	113.9
643	E	32.8	Very low	32.6	Very low	158 Å²	158	150.4 Å²	150.4	74%	0.738	77%	0.773	S	S	*	*			trans	53.5	149	154.7	-60	-159.4	135.4	0	0	121.7	R645	E643-R645 IonicContact OE1-CZ 2.98Å; E643-R645 IonicContact OE1-NE 2.71Å; E643-R645 PolarHBondContact OE1-NE 2.82Å; E643-R645 IonicContact OE1-NH2 2.69Å; E643-R645 PolarHBondContact OE1-NH2 3.35Å
644	G	32.9	Very low	32.6	Very low	62 Å²	62	146.9 Å²	146.9	64%	0.639	77%	0.772	S	S	*	*			cis	-161.9	149.9	3.9	0	0	0	0	0	116.8
645	R	34.4	Very low	32.7	Very low	216 Å²	216	139.6 Å²	139.6	82%	0.815	76%	0.756	S	S	*	*			trans	40	134.3	136.5	-57.5	-179.9	-161.4	-167.2	7.7	119.3	E643	E643-R645 IonicContact OE1-CZ 2.98Å; E643-R645 IonicContact OE1-NE 2.71Å; E643-R645 PolarHBondContact OE1-NE 2.82Å; E643-R645 IonicContact OE1-NH2 2.69Å; E643-R645 PolarHBondContact OE1-NH2 3.35Å
646	S	33.4	Very low	32.9	Very low	102 Å²	102	139.8 Å²	139.8	71%	0.713	76%	0.757	S	S	*	*			cis	-160.8	139.7	6.2	53.1	0	0	0	0	113.9
647	S	30.7	Very low	33.1	Very low	122 Å²	122	140.2 Å²	140.2	85%	0.853	76%	0.759	S	S	*	*			trans	-156.3	99.9	156.8	-81.8	0	0	0	0	108.7	T649	S647-T649 PolarHBondContact O-N 3.12Å
648	L	29.5	Very low	32.9	Very low	172 Å²	172	142.9 Å²	142.9	90%	0.901	76%	0.756	S	S	*	*			trans	-89	104.4	-171.5	-75.3	172.3	0	0	0	112.4
649	T	31.7	Very low	32.9	Very low	134 Å²	134	142.6 Å²	142.6	82%	0.822	75%	0.75	S	S	*	*			trans	-72.5	152.1	144.6	52.9	0	0	0	0	109	S647	S647-T649 PolarHBondContact O-N 3.12Å
650	R	31	Very low	32.9	Very low	219 Å²	219	142 Å²	142	83%	0.826	76%	0.757	S	S	*	*			trans	-144.8	112.4	163.6	-152.1	173.9	-171.4	-168.1	1.8	111.2
651	S	30.3	Very low	33	Very low	88 Å²	88	141.6 Å²	141.6	62%	0.615	76%	0.756	S	S	*	*			trans	-72.2	156	166.7	-175.4	0	0	0	0	110.4
652	M	30.4	Very low	33	Very low	152 Å²	152	142.4 Å²	142.4	75%	0.749	76%	0.758	S	S	*	*			trans	-136.8	111.8	155.9	-82.6	-63.5	159.2	0	0	109.6
653	T	31.9	Very low	33.1	Very low	115 Å²	115	145 Å²	145	71%	0.706	76%	0.76	S	S	*	*			trans	-127.9	112.8	172.2	46.6	0	0	0	0	108.4
654	N	34.1	Very low	33.1	Very low	163 Å²	163	145 Å²	145	87%	0.872	76%	0.76	S	S	*	*			trans	177.4	161.3	175.2	-99.7	-14.3	0	0	0	106.6
655	S	34	Very low	32.9	Very low	73 Å²	73	149 Å²	149	51%	0.51	77%	0.766	S	S	.	*			cis	-168.5	168.6	-12.5	51.2	0	0	0	0	107.5
656	H	37.4	Very low	32.9	Very low	169 Å²	169	146.9 Å²	146.9	78%	0.782	77%	0.766	S	S	*	*			cis	-108.9	-118.4	1.6	-60.3	-104.5	0	0	0	109.5
657	N	34.8	Very low	32.6	Very low	153 Å²	153	147 Å²	147	82%	0.818	77%	0.766	S	S	*	*			cis	-128.2	152.2	2.2	-88.6	40.5	0	0	0	109.8
658	R	32.1	Very low	32.6	Very low	225 Å²	225	147.7 Å²	147.7	85%	0.849	77%	0.765	S	S	*	*			trans	-155.6	173.2	168.7	-137.5	-175.1	-164.3	-172.9	3.1	109.7
659	D	33.6	Very low	32.6	Very low	123 Å²	123	145.4 Å²	145.4	66%	0.658	76%	0.759	S	S	*	*			trans	67.7	112.4	163.3	-42.6	-33.9	0	0	0	118
660	V	34.5	Very low	32.8	Very low	149 Å²	149	144 Å²	144	90%	0.903	75%	0.752	S	S	*	*				-139.6	155.3	110.8	156.1	0	0	0	0	106.9
661	I	35.4	Very low	32.7	Very low	132 Å²	132	142 Å²	142	68%	0.677	75%	0.752	S	S	*	*			trans	-118.5	157.5	-161.9	-75.1	163.1	0	0	0	111.1
662	K	35.1	Very low	32.7	Very low	182 Å²	182	146.3 Å²	146.3	79%	0.791	76%	0.759	S	S	*	*			trans	111.8	128.2	153.9	-93.6	156.2	-179.4	-175.4	0	120.3
663	L	34.6	Very low	32.6	Very low	137 Å²	137	147.1 Å²	147.1	72%	0.717	76%	0.761	S	S	*	*			trans	84.8	126.2	140	-70.6	160.9	0	0	0	122.8
664	Q	33.8	Very low	32.6	Very low	157 Å²	157	149.1 Å²	149.1	73%	0.734	77%	0.766	S	S	*	*			trans	62.8	101.2	144.3	-76	164.8	-55.6	0	0	121.6
665	N	28.9	Very low	32.3	Very low	146 Å²	146	146.5 Å²	146.5	78%	0.781	76%	0.755	S	S	*	*				56.4	149.3	111.4	-69.3	11.5	0	0	0	123
666	Q	34	Very low	32.3	Very low	172 Å²	172	150.4 Å²	150.4	80%	0.804	77%	0.77	S	S	*	*			trans	75.3	82.7	156.6	-75.7	172.9	-3.2	0	0	119.4
667	S	27.3	Very low	32	Very low	104 Å²	104	149.5 Å²	149.5	73%	0.727	76%	0.764	S	S	*	*				72.4	157.7	113.7	64.8	0	0	0	0	122.5
668	V	31.3	Very low	31.7	Very low	136 Å²	136	149.7 Å²	149.7	82%	0.824	76%	0.76	S	S	*	*			trans	83.1	143.4	166.2	-166.7	0	0	0	0	116.7
669	T	28.1	Very low	31.7	Very low	125 Å²	125	144.7 Å²	144.7	77%	0.767	76%	0.759	S	S	*	*			trans	-126.7	-173.7	-174.9	55.7	0	0	0	0	108.7
670	P	35.4	Very low	31.5	Very low	104 Å²	104	144.5 Å²	144.5	68%	0.675	77%	0.766	S	S	*	*			cis	-129.5	-170.9	-27.6	26.9	-4.6	0	0	0	113.5
671	H	29	Very low	31.4	Very low	178 Å²	178	144.9 Å²	144.9	82%	0.824	76%	0.763	S	S	*	*			trans	84.8	155.7	145.1	-104.7	-82.6	0	0	0	122.7
672	K	31	Very low	31.2	Very low	177 Å²	177	143.5 Å²	143.5	77%	0.77	77%	0.765	S	S	*	*			trans	77.9	82.3	164.5	-70	-178.2	178.2	177.2	0	121.4
673	Q	28.2	Very low	31	Very low	169 Å²	169	139.5 Å²	139.5	79%	0.79	76%	0.76	S	S	*	*				44	97.8	105.1	-171	-176.6	1.7	0	0	120.2	V675	Q673-V675 HydrophobicContact CG-CG2 4.47Å
674	I	32.2	Very low	30.9	Very low	157 Å²	157	138.9 Å²	138.9	81%	0.805	76%	0.762	S	S	*	*			trans	-144.9	109.9	155.6	-61.4	-179.4	0	0	0	105
675	V	28.3	Very low	30.8	Very low	108 Å²	108	140.2 Å²	140.2	66%	0.655	76%	0.761	S	S	*	*				68.3	111.5	58.4	-176.4	0	0	0	0	113.5	Q673	Q673-V675 HydrophobicContact CG-CG2 4.47Å
676	L	32.7	Very low	31.1	Very low	155 Å²	155	142.1 Å²	142.1	81%	0.812	76%	0.762	S	S	*	*			trans	146.3	153.5	155.4	-81.4	167.2	0	0	0	109.5
677	K	31.3	Very low	30.8	Very low	151 Å²	151	139.5 Å²	139.5	66%	0.657	75%	0.754	S	S	*	*			cis	-164.5	134.5	-39.5	-178.6	164.3	-179.7	178.9	0	108.5
678	E	28.4	Very low	31.2	Very low	157 Å²	157	139.7 Å²	139.7	73%	0.734	76%	0.755	S	S	*	*			trans	17.5	135.7	156.5	-60.8	144.7	-150.5	0	0	122.2
679	S	33.7	Very low	31	Very low	119 Å²	119	139.8 Å²	139.8	83%	0.832	76%	0.757	S	S	*	*				-157.2	120.3	124.8	65.1	0	0	0	0	110.4
680	C	28.1	Very low	31.2	Very low	119 Å²	119	136.9 Å²	136.9	80%	0.804	75%	0.752	S	S	*	*			trans	-121.4	142.5	176.7	-71.3	0	0	0	0	110.7
681	D	33	Very low	30.9	Very low	157 Å²	157	139.1 Å²	139.1	84%	0.84	76%	0.757	S	S	*	*			trans	-139.5	126.9	154.4	-87.1	-51	0	0	0	107.3
682	S	30.7	Very low	31	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	74%	0.739	S	S	*	*			cis	71.7	134	42.8	-53	0	0	0	0	111.8
683	S	30.9	Very low	31.1	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	74%	0.736	S	S	*	*			cis	-145.2	-176.8	-0.2	53.3	0	0	0	0	107.7
684	V	33.1	Very low	31.2	Very low	124 Å²	124	130.5 Å²	130.5	75%	0.752	73%	0.73	S	S	*	*			cis	-148.6	142.4	32.8	175.8	0	0	0	0	108.3
685	Y	30.9	Very low	31.1	Very low	185 Å²	185	130 Å²	130	73%	0.725	73%	0.728	S	S	*	*			cis	115.7	149.4	16.5	-115	-80	0	0	0	114.6	D687	Y685-D687 WeakPolarHBondContact CD1-OD2 3.49Å; Y685-D687 VanDerWaalsContact CE1-OD2 3.25Å; Y685-D687 WeakPolarHBondContact CE1-OD2 3.31Å
686	K	34.7	Very low	31.2	Very low	185 Å²	185	129.2 Å²	129.2	80%	0.804	73%	0.727	S	S	*	*			trans	90.8	100	-177.8	-56.9	179.9	179.2	-176.8	0	113.7
687	D	28.6	Very low	31.1	Very low	118 Å²	118	129.2 Å²	129.2	63%	0.631	73%	0.728	S	S	*	*				73	139.7	55.4	-52.9	-47.3	0	0	0	112	Y685	Y685-D687 WeakPolarHBondContact CD1-OD2 3.49Å; Y685-D687 VanDerWaalsContact CE1-OD2 3.25Å; Y685-D687 WeakPolarHBondContact CE1-OD2 3.31Å
688	S	34.8	Very low	31.1	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	74%	0.741	S	S	*	*			cis	-140.6	138.2	32.7	-53.7	0	0	0	0	117.1
689	T	28.6	Very low	31.2	Very low	139 Å²	139	131.1 Å²	131.1	85%	0.853	74%	0.736	S	S	*	*			trans	1.3	144.1	143.1	54.6	0	0	0	0	122.1
690	G	31.7	Very low	31.2	Very low	64 Å²	64	132.7 Å²	132.7	66%	0.66	73%	0.73	S	S	*	*			trans	165.2	96.5	152.3	0	0	0	0	0	118.3
691	L	30.1	Very low	31.3	Very low	150 Å²	150	135 Å²	135	79%	0.785	73%	0.729	S	S	*	*			trans	53.6	163	155.1	-69.3	100.5	0	0	0	121.4	S239	S239-L691 WeakPolarHBondContact CB-O 3.36Å
692	D	31.1	Very low	31.2	Very low	85 Å²	85	132.1 Å²	132.1	46%	0.455	72%	0.721	S	S	.	*			cis	-168.8	154.4	-41.1	-163.7	8.9	0	0	0	109.4
693	K	32.3	Very low	31.2	Very low	160 Å²	160	135.8 Å²	135.8	70%	0.696	73%	0.732	S	S	*	*			trans	55.1	163.2	168.8	-68.6	139.9	-175.3	151.3	0	117.7
694	C	30.4	Very low	31.2	Very low	99 Å²	99	136.5 Å²	136.5	67%	0.669	74%	0.737	S	S	*	*			cis	-140.5	148.8	-12.6	-113	0	0	0	0	108.2
695	L	31	Very low	31.2	Very low	147 Å²	147	134.6 Å²	134.6	77%	0.77	73%	0.733	S	S	*	*				40.7	107.9	98.3	-54.9	177.4	0	0	0	113.8
696	S	28.8	Very low	31.5	Very low	91 Å²	91	136.8 Å²	136.8	64%	0.636	74%	0.742	S	S	*	*				69.1	96.3	70.2	-68.3	0	0	0	0	114.8
697	N	32.2	Very low	31.4	Very low	154 Å²	154	133.9 Å²	133.9	82%	0.824	75%	0.745	S	S	*	*				162.1	143.7	125.3	-80.7	-14.4	0	0	0	113.1
698	R	29.9	Very low	32	Very low	245 Å²	245	131.5 Å²	131.5	93%	0.925	75%	0.749	S	S	*	*			trans	62.3	162.7	172.7	-59.1	177.3	174.5	171.3	-3.4	114.2
699	V	31.4	Very low	32.3	Very low	104 Å²	104	132 Å²	132	63%	0.63	75%	0.749	S	S	*	*			cis	-125.9	128.9	6	177.5	0	0	0	0	110.8
700	Q	32.5	Very low	32.9	Very low	151 Å²	151	132.4 Å²	132.4	71%	0.706	75%	0.746	S	S	*	*	S	Bend	trans	-110.3	155.3	135.2	-81.3	177	-95.5	0	0	106.3
701	Q	31.4	Very low	33.7	Very low	169 Å²	169	134.7 Å²	134.7	79%	0.79	75%	0.747	S	S	*	*			trans	58.5	81.5	169.3	-63.2	166.8	-4.2	0	0	116.1
702	S	29.8	Very low	34.2	Very low	96 Å²	96	134.8 Å²	134.8	67%	0.671	75%	0.749	S	S	*	*			trans	-149	70.4	151.2	63.1	0	0	0	0	109
703	L	31.8	Very low	34.4	Very low	180 Å²	180	140 Å²	140	94%	0.942	77%	0.767	S	S	*	*			trans	-114.1	53.3	-176.6	-112.4	173.5	0	0	0	110.9
704	S	30.7	Very low	34.6	Very low	114 Å²	114	138.6 Å²	138.6	80%	0.797	77%	0.774	S	S	*	*			trans	-168.3	161	167.4	52.2	0	0	0	0	111.4
705	A	33.2	Very low	34.8	Very low	83 Å²	83	140 Å²	140	69%	0.686	78%	0.78	S	S	*	*			trans	79.6	130.4	168.5	0	0	0	0	0	119.1
706	Y	37.2	Very low	35	Very low	231 Å²	231	138.6 Å²	138.6	91%	0.906	78%	0.782	S	S	*	*			trans	67.6	110.9	167.4	-65.2	-74.5	0	0	0	120.9
707	S	32.4	Very low	35.2	Very low	125 Å²	125	140.4 Å²	140.4	87%	0.874	79%	0.79	S	S	*	*			trans	-81.8	154.8	165.9	38.8	0	0	0	0	112.3
708	G	42	Very low	35.6	Very low	68 Å²	68	142.5 Å²	142.5	70%	0.701	79%	0.791	S	S	*	*			trans	-177.2	124.4	168.3	0	0	0	0	0	109.9
709	P	40.7	Very low	35.8	Very low	116 Å²	116	136.6 Å²	136.6	75%	0.753	78%	0.783	S	S	*	*			trans	-82.5	144.7	174.3	33.7	-32.6	0	0	0	110.9
710	D	40.1	Very low	36.3	Very low	148 Å²	148	136.7 Å²	136.7	79%	0.791	79%	0.786	S	S	*	*				178	154.3	105.6	-108	-28.2	0	0	0	115.9
711	V	48.3	Very low	37.3	Very low	113 Å²	113	135.1 Å²	135.1	69%	0.685	79%	0.788	S	S	*	*			trans	54	93.4	152.3	-175	0	0	0	0	120.2
712	D	40.5	Very low	38.5	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	78%	0.784	S	S	*	*				48.5	111.4	124.7	-56.8	-35.3	0	0	0	123.1
713	K	35.5	Very low	39.8	Very low	193 Å²	193	135 Å²	135	84%	0.839	78%	0.784	S	S	*	*			trans	-151.2	134.6	136	-151	157.1	-170.1	159.7	0	110.7	T715	K713-T715 PolarHBondContact O-N 2.93Å
714	P	37.6	Very low	41.6	Very low	131 Å²	131	129 Å²	129	85%	0.851	75%	0.751	S	S	*	*			trans	-72.8	103	-166.9	27.1	-35.2	0	0	0	113.1
715	T	34	Very low	44.1	Very low	130 Å²	130	125.1 Å²	125.1	80%	0.798	72%	0.723	S	S	*	*			trans	-77.7	128.7	165.3	39.5	0	0	0	0	111.1	K713 T717	K713-T715 PolarHBondContact O-N 2.93Å; T715-T717 PolarHBondContact O-N 3.3Å
716	S	35.3	Very low	46.8	Very low	116 Å²	116	121.2 Å²	121.2	81%	0.811	69%	0.69	S	S	*	*			trans	-51.9	123.7	168.1	173.8	0	0	0	0	110.5	K718	S716-K718 PolarHBondContact O-N 3.29Å
717	T	32.1	Very low	49.5	Very low	129 Å²	129	111.4 Å²	111.4	79%	0.791	66%	0.655	S	S	*	*			trans	-67.3	101.8	-178.6	34.2	0	0	0	0	110.6	T715 T719	T715-T717 PolarHBondContact O-N 3.3Å; T717-T719 PolarHBondContact O-N 3.03Å
718	K	40.2	Very low	52.5	Low	198 Å²	198	105.7 Å²	105.7	86%	0.861	61%	0.614	S	S	*	*			trans	-65.1	106.9	160.7	-72.5	-173.4	177.9	-177.4	0	107.9	S716	S716-K718 PolarHBondContact O-N 3.29Å
719	T	34.9	Very low	55	Low	121 Å²	121	103 Å²	103	74%	0.742	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-54	144.8	166.8	39.1	0	0	0	0	109.8	T717	T717-T719 PolarHBondContact O-N 3.03Å
720	P	42.2	Very low	57.7	Low	106 Å²	106	99.1 Å²	99.1	69%	0.688	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-58.8	143.8	171.2	27	-34	0	0	0	109	L722	P720-L722 PolarHBondContact O-N 2.94Å; P720-L722 VanDerWaalsContact O-N 3.12Å
721	P	54.1	Low	60.3	Low	118 Å²	118	93 Å²	93	77%	0.766	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-59.4	122.3	178.1	25.5	-33.5	0	0	0	108.8	I723	P721-I723 PolarHBondContact O-N 2.82Å; P721-I723 VanDerWaalsContact O-N 3.1Å
722	L	56.7	Low	62.4	Low	133 Å²	133	90.3 Å²	90.3	70%	0.696	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-53.3	119.4	179.4	-78.4	161.5	0	0	0	109	P720 H724	P720-L722 PolarHBondContact O-N 2.94Å; P720-L722 VanDerWaalsContact O-N 3.12Å; L722-H724 PolarHBondContact O-CE1 3.06Å; L722-H724 PolarHBondContact O-N 2.92Å; L722-H724 VanDerWaalsContact O-N 3.08Å; L722-H724 PolarHBondContact O-ND1 3.05Å
723	I	57.1	Low	64.7	Low	129 Å²	129	86.9 Å²	86.9	66%	0.662	51%	0.506	S	S	*	.			trans	-74.2	103.3	176.6	-60.3	172.8	0	0	0	106.3	P721 P725 T743	P721-I723 PolarHBondContact O-N 2.82Å; P721-I723 VanDerWaalsContact O-N 3.1Å; I723-P725 WeakPolarHBondContact O-CD 3.04Å; I723-T743 HydrophobicContact CG2-CG2 4.17Å
724	H	68.2	Low	67.2	Low	55 Å²	55	80.9 Å²	80.9	26%	0.255	50%	0.498	S	S	.	.			trans	-82.6	108.2	177.7	-66.2	71.5	0	0	0	108.4	L722 I726 H786 T787	L722-H724 PolarHBondContact O-CE1 3.06Å; L722-H724 PolarHBondContact O-N 2.92Å; L722-H724 VanDerWaalsContact O-N 3.08Å; L722-H724 PolarHBondContact O-ND1 3.05Å; H724-I726 WeakPolarHBondContact O-CG1 3.47Å; H724-I726 PolarHBondContact O-N 2.88Å; H724-H786 PolarHBondContact CD2-O 2.91Å; H724-T787 VanDerWaalsContact CA-O 3.28Å; H724-T787 WeakPolarHBondContact CA-O 3.46Å; H724-T787 WeakPolarHBondContact CB-O 3.48Å; H724-T787 PolarHBondContact CD2-O 3.37Å
725	P	83.9	Confident	69.7	Low	33 Å²	33	79.9 Å²	79.9	21%	0.214	49%	0.486	C	S	.	.			trans	-62.5	128.6	173.3	24.3	-32.5	0	0	0	110	I723 Q788 L789	I723-P725 WeakPolarHBondContact O-CD 3.04Å; P725-Q788 HydrophobicContact CG-CB 4.22Å; P725-Q788 HydrophobicContact CG-CG 4.08Å; P725-Q788 WeakPolarHBondContact O-CG 3.14Å; P725-L789 PolarHBondContact O-N 3.41Å; P725-L789 VanDerWaalsContact O-N 3.09Å
726	I	90.8	Very high	72.5	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	119.7	-178.3	-44.9	-177.9	0	0	0	108.5	H724 Y728 Q741 S742 D744 L745 L765 L789 L791	H724-I726 WeakPolarHBondContact O-CG1 3.47Å; H724-I726 PolarHBondContact O-N 2.88Å; I726-Y728 HydrophobicContact CB-CE2 4.15Å; I726-Y728 HydrophobicContact CG2-CD2 4.24Å; I726-Y728 HydrophobicContact CG2-CE2 3.64Å; I726-Q741 CarbonylContact O-C 3.5Å; I726-Q741 VanDerWaalsContact O-CA 3.29Å; I726-Q741 WeakPolarHBondContact O-CA 3.32Å; I726-S742 PolarHBondContact N-O 3.4Å; I726-S742 PolarHBondContact O-N 2.73Å; I726-D744 WeakPolarHBondContact CD1-O 3.49Å; I726-L745 HydrophobicContact CD1-CD2 3.8Å; I726-L745 HydrophobicContact CD1-CG 4.47Å; I726-L765 HydrophobicContact CD1-CD2 3.68Å; I726-L789 CarbonylContact C-O 3.54Å; I726-L789 WeakPolarHBondContact CA-O 3.5Å; I726-L789 HydrophobicContact CG2-CB 4.48Å; I726-L789 HydrophobicContact CG2-CD2 4.21Å; I726-L789 HydrophobicContact CG2-CG 4.29Å; I726-L791 HydrophobicContact CG2-CD1 3.63Å; I726-L791 HydrophobicContact CG2-CG 4.07Å
727	T	93.1	Very high	75.2	Confident	26 Å²	26	76 Å²	76	16%	0.16	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132.5	175.4	63.6	0	0	0	0	110.3	S740 Q741 L789 S790 L791	T727-S740 CarbonylContact C-O 3.53Å; T727-S740 WeakPolarHBondContact CA-O 3.09Å; T727-Q741 HydrophobicContact CG2-CG 4.36Å; T727-L789 PolarHBondContact N-O 3.08Å; T727-S790 WeakPolarHBondContact OG1-CA 3.28Å; T727-S790 PolarHBondContact OG1-OG 3.25Å; T727-S790 VanDerWaalsContact OG1-OG 3.11Å; T727-L791 WeakPolarHBondContact O-CA 3.47Å; T727-L791 WeakPolarHBondContact O-CB 3.36Å; T727-L791 PolarHBondContact O-N 3.12Å
728	Y	95	Very high	78.1	Confident	4 Å²	4	74.7 Å²	74.7	2%	0.016	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	105.6	178	-67.5	-94	0	0	0	109.1	I726 W739 S740 P748 W749 L769 L791 V793	I726-Y728 HydrophobicContact CB-CE2 4.15Å; I726-Y728 HydrophobicContact CG2-CD2 4.24Å; I726-Y728 HydrophobicContact CG2-CE2 3.64Å; Y728-W739 CarbonylContact O-C 3.39Å; Y728-W739 WeakPolarHBondContact O-CA 3.46Å; Y728-S740 PolarHBondContact N-O 3.27Å; Y728-S740 PolarHBondContact O-N 2.87Å; Y728-P748 HydrophobicContact CE1-CG 3.86Å; Y728-P748 HydrophobicContact CE2-CG 4.15Å; Y728-W749 HydrophobicContact CD1-CH2 4.34Å; Y728-W749 HydrophobicContact CE1-CH2 4.47Å; Y728-W749 HydrophobicContact CE1-CZ3 4.28Å; Y728-L769 HydrophobicContact CE1-CD1 4.22Å; Y728-L791 CarbonylContact C-O 3.58Å; Y728-L791 WeakPolarHBondContact CA-O 3.35Å; Y728-L791 HydrophobicContact CD1-CB 4.17Å; Y728-L791 HydrophobicContact CD1-CD1 4.13Å; Y728-L791 HydrophobicContact CE1-CB 4.49Å; Y728-L791 HydrophobicContact CE1-CD1 3.61Å; Y728-V793 HydrophobicContact CD1-CG2 4.32Å
729	G	95.4	Very high	80.6	Confident	13 Å²	13	73 Å²	73	13%	0.134	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	110.3	-179.5	0	0	0	0	0	112.4	L791 Q792 V793	G729-L791 PolarHBondContact N-O 3.13Å; G729-Q792 CarbonylContact O-C 3.6Å; G729-Q792 WeakPolarHBondContact O-CA 3.25Å; G729-V793 PolarHBondContact O-N 3.4Å
730	F	96.5	Very high	83.4	Confident	33 Å²	33	69.7 Å²	69.7	15%	0.145	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	115.2	-177	-64.9	-94.9	0	0	0	111.6	F198 F202 Q737 Q738 W749 V793	F198-F730 HydrophobicContact CE2-CB 4Å; F198-F730 HydrophobicContact CZ-CB 4.05Å; F202-F730 AromaticContact CD1-CD1 3.84Å; F202-F730 HydrophobicContact CD1-CD1 3.84Å; F202-F730 HydrophobicContact CD1-CE1 4.37Å; F202-F730 AromaticContact CE1-CD1 3.74Å; F202-F730 HydrophobicContact CE1-CD1 3.74Å; F202-F730 HydrophobicContact CE1-CE1 4.5Å; F730-Q737 PolarHBondContact O-N 3.49Å; F730-Q738 HydrophobicContact CB-CB 4.4Å; F730-Q738 WeakPolarHBondContact CB-O 3.49Å; F730-Q738 PolarHBondContact N-O 3.4Å; F730-W749 HydrophobicContact CE1-CZ2 4.05Å; F730-W749 HydrophobicContact CZ-CZ2 4.3Å; F730-V793 WeakPolarHBondContact CA-O 3.32Å; F730-V793 HydrophobicContact CD1-CB 4.15Å; F730-V793 HydrophobicContact CD1-CG1 4.32Å; F730-V793 HydrophobicContact CE1-CB 4.34Å; F730-V793 HydrophobicContact CE1-CG1 4.29Å
731	V	94.9	Very high	85.8	Confident	21 Å²	21	69.9 Å²	69.9	13%	0.127	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.6	-175.8	173.2	0	0	0	0	111.6	N735 L736 Q792 V793	V731-N735 WeakPolarHBondContact CA-O 3.11Å; V731-L736 HydrophobicContact CG2-CD1 4.31Å; V731-Q792 HydrophobicContact CB-CG 4.48Å; V731-Q792 HydrophobicContact CG2-CG 3.61Å; V731-V793 PolarHBondContact N-O 2.84Å
732	F	93.5	Very high	87.5	Confident	56 Å²	56	65.5 Å²	65.5	25%	0.246	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	136.2	178.4	-173.2	-108.6	0	0	0	109.9	A197 F198 A201 F202 G734 N735 Q737 L795	A197-F732 HydrophobicContact CB-CE1 4Å; A197-F732 HydrophobicContact CB-CZ 4.18Å; F198-F732 HydrophobicContact CB-CB 4.44Å; F198-F732 HydrophobicContact CB-CD1 3.72Å; F198-F732 HydrophobicContact CB-CE1 4.13Å; F198-F732 HydrophobicContact CB-CG 4.13Å; F198-F732 HydrophobicContact CD2-CB 3.8Å; F198-F732 HydrophobicContact CD2-CG 4.16Å; A201-F732 HydrophobicContact CB-CE2 3.79Å; A201-F732 HydrophobicContact CB-CZ 4.28Å; F202-F732 HydrophobicContact CE2-CB 4.15Å; F202-F732 HydrophobicContact CE2-CD2 4.05Å; F202-F732 HydrophobicContact CE2-CG 4.48Å; F732-G734 PolarHBondContact O-N 3.46Å; F732-N735 PolarHBondContact N-O 2.98Å; F732-N735 PolarHBondContact O-N 3.29Å; F732-N735 VanDerWaalsContact O-O 3.09Å; F732-Q737 HydrophobicContact CB-CG 3.69Å; F732-Q737 PolarHBondContact O-NE2 2.98Å; F732-L795 HydrophobicContact CD2-CD1 3.87Å; F732-L795 HydrophobicContact CE2-CD1 3.82Å
733	G	87.5	Confident	89	Confident	79 Å²	79	64 Å²	64	81%	0.814	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	18.9	-175.8	0	0	0	0	0	114.9
734	G	87.6	Confident	90.5	Very high	67 Å²	67	61.5 Å²	61.5	69%	0.691	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	-22	-175	0	0	0	0	0	114.5	F732	F732-G734 PolarHBondContact O-N 3.46Å
735	N	90.3	Very high	91.6	Very high	110 Å²	110	60.7 Å²	60.7	59%	0.588	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	150.1	-175.9	-63.3	-0.7	0	0	0	111.8	V731 F732 Q737	V731-N735 WeakPolarHBondContact CA-O 3.11Å; F732-N735 PolarHBondContact N-O 2.98Å; F732-N735 PolarHBondContact O-N 3.29Å; F732-N735 VanDerWaalsContact O-O 3.09Å; N735-Q737 PolarHBondContact O-N 2.92Å
736	L	92.6	Very high	92.1	Very high	96 Å²	96	60.8 Å²	60.8	50%	0.503	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	124.7	164.5	-175.4	71.1	0	0	0	108.7	V731 Q738	V731-L736 HydrophobicContact CG2-CD1 4.31Å; L736-Q738 WeakPolarHBondContact CD1-O 3.13Å
737	Q	91.9	Very high	92.3	Very high	68 Å²	68	60.8 Å²	60.8	32%	0.318	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-33.3	178.2	-55.4	-59.7	-31.4	0	0	112.4	F198 F730 F732 N735	F198-Q737 HydrophobicContact CB-CG 4.38Å; F198-Q737 HydrophobicContact CD1-CB 3.93Å; F198-Q737 HydrophobicContact CD1-CG 4.44Å; F198-Q737 HydrophobicContact CD2-CB 4.03Å; F198-Q737 HydrophobicContact CD2-CG 3.99Å; F198-Q737 HydrophobicContact CE1-CB 3.98Å; F198-Q737 HydrophobicContact CE2-CB 4.08Å; F198-Q737 HydrophobicContact CE2-CG 4.43Å; F198-Q737 HydrophobicContact CG-CB 3.97Å; F198-Q737 HydrophobicContact CG-CG 4Å; F198-Q737 HydrophobicContact CZ-CB 4.06Å; F730-Q737 PolarHBondContact O-N 3.49Å; F732-Q737 HydrophobicContact CB-CG 3.69Å; F732-Q737 PolarHBondContact O-NE2 2.98Å; N735-Q737 PolarHBondContact O-N 2.92Å
738	Q	94	Very high	92.3	Very high	102 Å²	102	61.9 Å²	61.9	48%	0.477	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	149	-177.1	-175.7	173.1	6.9	0	0	108.7	F198 F730 L736	F198-Q738 HydrophobicContact CE1-CB 4.06Å; F198-Q738 HydrophobicContact CZ-CB 3.91Å; F730-Q738 HydrophobicContact CB-CB 4.4Å; F730-Q738 WeakPolarHBondContact CB-O 3.49Å; F730-Q738 PolarHBondContact N-O 3.4Å; L736-Q738 WeakPolarHBondContact CD1-O 3.13Å
739	W	93.6	Very high	92.3	Very high	164 Å²	164	62.3 Å²	62.3	62%	0.621	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	162.9	166.5	65.6	-86.2	0	0	0	110.7	Y728 Q741	Y728-W739 CarbonylContact O-C 3.39Å; Y728-W739 WeakPolarHBondContact O-CA 3.46Å; W739-Q741 HydrophobicContact CZ3-CB 4.36Å
740	S	93.5	Very high	92.3	Very high	51 Å²	51	63.3 Å²	63.3	36%	0.357	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	166	170.4	60.6	0	0	0	0	110.2	T727 Y728	T727-S740 CarbonylContact C-O 3.53Å; T727-S740 WeakPolarHBondContact CA-O 3.09Å; Y728-S740 PolarHBondContact N-O 3.27Å; Y728-S740 PolarHBondContact O-N 2.87Å
741	Q	91.7	Very high	92.1	Very high	110 Å²	110	67.6 Å²	67.6	51%	0.514	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	144	178.4	-175.4	174.8	-5.8	0	0	109.9	I726 T727 W739	I726-Q741 CarbonylContact O-C 3.5Å; I726-Q741 VanDerWaalsContact O-CA 3.29Å; I726-Q741 WeakPolarHBondContact O-CA 3.32Å; T727-Q741 HydrophobicContact CG2-CG 4.36Å; W739-Q741 HydrophobicContact CZ3-CB 4.36Å
742	S	90.6	Very high	92.1	Very high	25 Å²	25	67.4 Å²	67.4	18%	0.175	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	163	167.6	89	0	0	0	0	111	I726 D744	I726-S742 PolarHBondContact N-O 3.4Å; I726-S742 PolarHBondContact O-N 2.73Å; S742-D744 WeakPolarHBondContact CB-OD1 3.44Å; S742-D744 PolarHBondContact OG-O 3.12Å; S742-D744 PolarHBondContact OG-OD1 3Å
743	T	87.3	Confident	92	Very high	101 Å²	101	67.6 Å²	67.6	62%	0.62	39%	0.385	S	S	*	.	S	Bend	trans	-115.3	-2.9	177.3	50.1	0	0	0	0	112.3	I723	I723-T743 HydrophobicContact CG2-CG2 4.17Å
744	D	89	Confident	92.3	Very high	77 Å²	77	63.9 Å²	63.9	41%	0.412	35%	0.346	S	S	.	.	S	Bend	trans	-105.9	143.6	-179	63.4	-25.5	0	0	0	112.1	I726 S742 V746	I726-D744 WeakPolarHBondContact CD1-O 3.49Å; S742-D744 WeakPolarHBondContact CB-OD1 3.44Å; S742-D744 PolarHBondContact OG-O 3.12Å; S742-D744 PolarHBondContact OG-OD1 3Å; D744-V746 HydrophobicContact CB-CG2 4.13Å; D744-V746 PolarHBondContact O-N 3.16Å; D744-V746 VanDerWaalsContact O-N 3.08Å; D744-V746 WeakPolarHBondContact OD2-CB 3.44Å
745	L	91.1	Very high	92.3	Very high	38 Å²	38	63 Å²	63	20%	0.199	33%	0.332	C	S	.	.			trans	-84.2	35.3	176.7	-68.6	161.3	0	0	0	111.8	I726 C754 A755 P762 L765	I726-L745 HydrophobicContact CD1-CD2 3.8Å; I726-L745 HydrophobicContact CD1-CG 4.47Å; L745-C754 VanDerWaalsContact O-CB 3.27Å; L745-C754 WeakPolarHBondContact O-CB 3.18Å; L745-C754 PolarHBondContact O-N 3.16Å; L745-A755 HydrophobicContact CB-CB 4.13Å; L745-A755 HydrophobicContact CD1-CB 4.04Å; L745-P762 HydrophobicContact CD2-CB 4.39Å; L745-P762 HydrophobicContact CD2-CG 4.14Å; L745-L765 HydrophobicContact CD2-CB 4.49Å; L745-L765 HydrophobicContact CD2-CD2 4.09Å
746	V	94	Very high	92.1	Very high	35 Å²	35	63.5 Å²	63.5	21%	0.212	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-99	132.1	-177.5	179.2	0	0	0	0	109.5	D744 P748 H751 D753	D744-V746 HydrophobicContact CB-CG2 4.13Å; D744-V746 PolarHBondContact O-N 3.16Å; D744-V746 VanDerWaalsContact O-N 3.08Å; D744-V746 WeakPolarHBondContact OD2-CB 3.44Å; V746-P748 VanDerWaalsContact O-CD 3.25Å; V746-P748 WeakPolarHBondContact O-CD 3.3Å; V746-H751 HydrophobicContact CG1-CB 4.31Å; V746-D753 HydrophobicContact CG2-CB 4.36Å
747	C	94.9	Very high	91.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.306	C	S	.	.			trans	-64.6	119.2	178.2	175.9	0	0	0	0	112.1	W749 C750 H751 L752 L765 H768 H773	C747-W749 PolarHBondContact O-N 3.15Å; C747-C750 PolarHBondContact O-N 3Å; C747-C750 VanDerWaalsContact SG-SG 3.61Å; C747-H751 WeakPolarHBondContact O-CA 3.29Å; C747-H751 PolarHBondContact O-N 3.23Å; C747-L752 HydrophobicContact CB-CB 4.42Å; C747-L752 PolarHBondContact N-O 2.71Å; C747-L765 HydrophobicContact CB-CD1 4.43Å; C747-H768 PolarHBondContact SG-NE2 2.98Å; C747-H768 VanDerWaalsContact SG-NE2 3.37Å; C747-H773 PolarHBondContact SG-NE2 3.01Å
748	P	94	Very high	91.4	Very high	50 Å²	50	58.3 Å²	58.3	33%	0.325	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.3	-177	-26.2	35.8	0	0	0	115.9	Y728 V746	Y728-P748 HydrophobicContact CE1-CG 3.86Å; Y728-P748 HydrophobicContact CE2-CG 4.15Å; V746-P748 VanDerWaalsContact O-CD 3.25Å; V746-P748 WeakPolarHBondContact O-CD 3.3Å
749	W	95	Very high	90.8	Very high	13 Å²	13	61.1 Å²	61.1	5%	0.049	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-23	-175.4	-66.7	-82.6	0	0	0	114.7	Y209 Y728 F730 C747 L769 F776 V793	Y209-W749 CarbonylContact C-O 3.57Å; Y728-W749 HydrophobicContact CD1-CH2 4.34Å; Y728-W749 HydrophobicContact CE1-CH2 4.47Å; Y728-W749 HydrophobicContact CE1-CZ3 4.28Å; F730-W749 HydrophobicContact CE1-CZ2 4.05Å; F730-W749 HydrophobicContact CZ-CZ2 4.3Å; C747-W749 PolarHBondContact O-N 3.15Å; W749-L769 HydrophobicContact CE3-CD2 3.59Å; W749-L769 HydrophobicContact CZ3-CD1 4.38Å; W749-L769 HydrophobicContact CZ3-CD2 3.49Å; W749-L769 VanDerWaalsContact CZ3-CD2 3.49Å; W749-F776 AromaticContact CD1-CE2 3.88Å; W749-F776 HydrophobicContact CD2-CE2 4.26Å; W749-F776 AromaticContact CE2-CE2 3.59Å; W749-F776 HydrophobicContact CG-CE2 4.42Å; W749-F776 HydrophobicContact CZ2-CD2 4.2Å; W749-F776 AromaticContact CZ2-CE2 3.98Å; W749-F776 HydrophobicContact CZ2-CE2 3.98Å; W749-F776 AromaticContact NE1-CE2 3.34Å; W749-F776 VanDerWaalsContact NE1-CE2 3.34Å; W749-F776 AromaticContact NE1-CZ 3.74Å; W749-V793 HydrophobicContact CH2-CG1 4.29Å; W749-V793 HydrophobicContact CH2-CG2 4.17Å; W749-V793 HydrophobicContact CZ2-CG1 4.29Å
750	C	94.5	Very high	90.3	Very high	33 Å²	33	58.3 Å²	58.3	22%	0.223	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.9	-0	-178.7	74.4	0	0	0	0	116.1	C747 L752 H768	C747-C750 PolarHBondContact O-N 3Å; C747-C750 VanDerWaalsContact SG-SG 3.61Å; C750-L752 PolarHBondContact O-N 3.22Å; C750-H768 PolarHBondContact SG-NE2 3.45Å
751	H	93.6	Very high	90	Very high	123 Å²	123	55.9 Å²	55.9	57%	0.569	31%	0.307	S	S	*	.			trans	60.8	24	177.3	-46.1	-71.3	0	0	0	114.8	V746 C747 D753	V746-H751 HydrophobicContact CG1-CB 4.31Å; C747-H751 WeakPolarHBondContact O-CA 3.29Å; C747-H751 PolarHBondContact O-N 3.23Å; H751-D753 PolarHBondContact O-N 3.06Å
752	L	93.5	Very high	89.8	Confident	18 Å²	18	51.1 Å²	51.1	9%	0.094	29%	0.285	C	S	.	.			trans	-71.8	114.5	167.4	-176	62.1	0	0	0	109.8	D224 L230 C747 C750 C754 H768	D224-L752 HydrophobicContact CB-CD1 4Å; L230-L752 HydrophobicContact CD1-CD1 4.46Å; L230-L752 HydrophobicContact CD1-CD2 3.83Å; L230-L752 HydrophobicContact CD1-CG 4.43Å; C747-L752 HydrophobicContact CB-CB 4.42Å; C747-L752 PolarHBondContact N-O 2.71Å; C750-L752 PolarHBondContact O-N 3.22Å; L752-C754 PolarHBondContact O-N 2.79Å; L752-H768 WeakPolarHBondContact CD2-ND1 3.3Å
753	D	92.9	Very high	89.7	Confident	60 Å²	60	54.5 Å²	54.5	32%	0.321	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-69.3	117.2	169.4	171.4	17.6	0	0	0	110.8	V746 H751 A755 R756	V746-D753 HydrophobicContact CG2-CB 4.36Å; H751-D753 PolarHBondContact O-N 3.06Å; D753-A755 VanDerWaalsContact OD1-CB 3.26Å; D753-A755 WeakPolarHBondContact OD1-CB 3.3Å; D753-A755 PolarHBondContact OD1-N 3.25Å; D753-R756 WeakPolarHBondContact O-CD 3.36Å; D753-R756 WeakPolarHBondContact OD2-CD 3.49Å; D753-R756 VanDerWaalsContact OD2-CG 3.29Å; D753-R756 WeakPolarHBondContact OD2-CG 3.12Å
754	C	92	Very high	89.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.269	C	S	.	.			trans	-98.1	-10.1	177.8	-57.9	0	0	0	0	113.1	L230 L745 L752 R756 A757 G761 A764 L765	L230-C754 HydrophobicContact CD2-CB 4.44Å; L745-C754 VanDerWaalsContact O-CB 3.27Å; L745-C754 WeakPolarHBondContact O-CB 3.18Å; L745-C754 PolarHBondContact O-N 3.16Å; L752-C754 PolarHBondContact O-N 2.79Å; C754-R756 PolarHBondContact O-N 3.38Å; C754-R756 VanDerWaalsContact O-N 3.1Å; C754-A757 PolarHBondContact O-N 2.92Å; C754-A757 VanDerWaalsContact O-N 3.1Å; C754-G761 WeakPolarHBondContact O-CA 3.43Å; C754-A764 HydrophobicContact CB-CB 4.12Å; C754-L765 HydrophobicContact CB-CB 3.94Å
755	A	88.2	Confident	90	Very high	48 Å²	48	46 Å²	46	40%	0.397	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-60.9	-20	172.8	0	0	0	0	0	112.2	L745 D753 A757 G758	L745-A755 HydrophobicContact CB-CB 4.13Å; L745-A755 HydrophobicContact CD1-CB 4.04Å; D753-A755 VanDerWaalsContact OD1-CB 3.26Å; D753-A755 WeakPolarHBondContact OD1-CB 3.3Å; D753-A755 PolarHBondContact OD1-N 3.25Å; A755-A757 PolarHBondContact O-N 3.12Å; A755-A757 VanDerWaalsContact O-N 3.08Å; A755-G758 PolarHBondContact O-N 3.1Å
756	R	87	Confident	90	Very high	121 Å²	121	44.9 Å²	44.9	46%	0.457	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-56.7	-16.1	171.7	-68.3	168	60.9	-149.7	-1.9	115	D753 C754 G758	D753-R756 WeakPolarHBondContact O-CD 3.36Å; D753-R756 WeakPolarHBondContact OD2-CD 3.49Å; D753-R756 VanDerWaalsContact OD2-CG 3.29Å; D753-R756 WeakPolarHBondContact OD2-CG 3.12Å; C754-R756 PolarHBondContact O-N 3.38Å; C754-R756 VanDerWaalsContact O-N 3.1Å; R756-G758 PolarHBondContact O-N 3.39Å
757	A	85.5	Confident	89.9	Confident	11 Å²	11	46.7 Å²	46.7	9%	0.091	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-77	-4.6	170.8	0	0	0	0	0	113.6	Y229 L230 C754 A755 K760 A764	Y229-A757 WeakPolarHBondContact O-CB 3.36Å; L230-A757 HydrophobicContact CD2-CB 4.49Å; C754-A757 PolarHBondContact O-N 2.92Å; C754-A757 VanDerWaalsContact O-N 3.1Å; A755-A757 PolarHBondContact O-N 3.12Å; A755-A757 VanDerWaalsContact O-N 3.08Å; A757-K760 HydrophobicContact CB-CB 4.19Å; A757-A764 HydrophobicContact CB-CB 3.7Å
758	G	84.1	Confident	89.9	Confident	45 Å²	45	46.9 Å²	46.9	46%	0.464	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	70.2	-135.1	-171.7	0	0	0	0	0	110.7	A755 R756 K760 G761	A755-G758 PolarHBondContact O-N 3.1Å; R756-G758 PolarHBondContact O-N 3.39Å; G758-K760 PolarHBondContact O-N 2.94Å; G758-G761 PolarHBondContact O-N 3.35Å
759	D	80.6	Confident	89.9	Confident	160 Å²	160	44.8 Å²	44.8	86%	0.856	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-54.6	-26.1	-178.4	-37.8	-42.6	0	0	0	113.2	G761	D759-G761 VanDerWaalsContact C-N 3.27Å; D759-G761 PolarHBondContact O-N 3.42Å
760	K	82.8	Confident	89.8	Confident	106 Å²	106	49.4 Å²	49.4	46%	0.461	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-84.5	12.9	177.7	-64.4	177.4	174	175.8	0	114.5	N233 A757 G758 E763 A764	N233-K760 PolarHBondContact OD1-NZ 2.86Å; A757-K760 HydrophobicContact CB-CB 4.19Å; G758-K760 PolarHBondContact O-N 2.94Å; K760-E763 VanDerWaalsContact C-OE2 3.26Å; K760-E763 VanDerWaalsContact CA-OE2 3.3Å; K760-E763 WeakPolarHBondContact CA-OE2 3.48Å; K760-E763 PolarHBondContact O-N 2.86Å; K760-A764 VanDerWaalsContact O-CB 3.29Å; K760-A764 WeakPolarHBondContact O-CB 3.44Å; K760-A764 PolarHBondContact O-N 3.39Å
761	G	87.2	Confident	89.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-56.6	-44	-176.5	0	0	0	0	0	114.9	C754 G758 D759 A764 L765	C754-G761 WeakPolarHBondContact O-CA 3.43Å; G758-G761 PolarHBondContact O-N 3.35Å; D759-G761 VanDerWaalsContact C-N 3.27Å; D759-G761 PolarHBondContact O-N 3.42Å; G761-A764 PolarHBondContact O-N 2.96Å; G761-L765 PolarHBondContact O-N 3.08Å
762	P	87.9	Confident	89.6	Confident	10 Å²	10	46.9 Å²	46.9	7%	0.065	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-42.9	176.4	-24.8	35.8	0	0	0	113.6	L745 L765 V766 W782 L789	L745-P762 HydrophobicContact CD2-CB 4.39Å; L745-P762 HydrophobicContact CD2-CG 4.14Å; P762-L765 PolarHBondContact O-N 3.46Å; P762-V766 WeakPolarHBondContact O-CG2 3.38Å; P762-V766 PolarHBondContact O-N 3.36Å; P762-W782 HydrophobicContact CB-CH2 3.6Å; P762-W782 HydrophobicContact CB-CZ2 4.11Å; P762-W782 HydrophobicContact CG-CH2 4.23Å; P762-L789 HydrophobicContact CB-CD2 4.29Å
763	E	87.8	Confident	89.7	Confident	95 Å²	95	46.3 Å²	46.3	44%	0.444	25%	0.246	S	C	.	.	H	α-helix	trans	-68.7	-38.2	177.4	-60	89.5	156.6	0	0	111.4	K760 L765 V766 L767	K760-E763 VanDerWaalsContact C-OE2 3.26Å; K760-E763 VanDerWaalsContact CA-OE2 3.3Å; K760-E763 WeakPolarHBondContact CA-OE2 3.48Å; K760-E763 PolarHBondContact O-N 2.86Å; E763-L765 VanDerWaalsContact C-N 3.34Å; E763-V766 PolarHBondContact O-N 3.34Å; E763-L767 VanDerWaalsContact O-CB 3.3Å; E763-L767 WeakPolarHBondContact O-CB 3.46Å; E763-L767 PolarHBondContact O-N 2.77Å
764	A	90.5	Very high	89.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-43.8	172.9	0	0	0	0	0	111.5	Y229 L230 C754 A757 K760 G761 H768	Y229-A764 HydrophobicContact CD2-CB 3.95Å; Y229-A764 WeakPolarHBondContact O-CB 3.4Å; L230-A764 HydrophobicContact CD2-CB 3.96Å; C754-A764 HydrophobicContact CB-CB 4.12Å; A757-A764 HydrophobicContact CB-CB 3.7Å; K760-A764 VanDerWaalsContact O-CB 3.29Å; K760-A764 WeakPolarHBondContact O-CB 3.44Å; K760-A764 PolarHBondContact O-N 3.39Å; G761-A764 PolarHBondContact O-N 2.96Å; A764-H768 WeakPolarHBondContact O-CB 3.36Å; A764-H768 PolarHBondContact O-N 2.93Å
765	L	92.3	Very high	89.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-48.8	174.1	179.6	64.5	0	0	0	111.5	I726 L745 C747 C754 G761 P762 E763 L767 H768 L769	I726-L765 HydrophobicContact CD1-CD2 3.68Å; L745-L765 HydrophobicContact CD2-CB 4.49Å; L745-L765 HydrophobicContact CD2-CD2 4.09Å; C747-L765 HydrophobicContact CB-CD1 4.43Å; C754-L765 HydrophobicContact CB-CB 3.94Å; G761-L765 PolarHBondContact O-N 3.08Å; P762-L765 PolarHBondContact O-N 3.46Å; E763-L765 VanDerWaalsContact C-N 3.34Å; L765-L767 VanDerWaalsContact C-N 3.33Å; L765-L767 PolarHBondContact O-N 2.99Å; L765-H768 PolarHBondContact O-N 2.87Å; L765-L769 HydrophobicContact CD1-CD1 4.17Å; L765-L769 HydrophobicContact CD1-CG 4.14Å; L765-L769 HydrophobicContact CG-CD1 4.13Å; L765-L769 HydrophobicContact CG-CG 4.44Å; L765-L769 WeakPolarHBondContact O-CB 3.27Å; L765-L769 VanDerWaalsContact O-CG 3.27Å; L765-L769 WeakPolarHBondContact O-CG 3.39Å; L765-L769 PolarHBondContact O-N 2.86Å
766	V	92.2	Very high	90.1	Very high	13 Å²	13	47.8 Å²	47.8	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-43.6	178.2	163.5	0	0	0	0	111.8	P762 E763 R770 V780 L789 L791	P762-V766 WeakPolarHBondContact O-CG2 3.38Å; P762-V766 PolarHBondContact O-N 3.36Å; E763-V766 PolarHBondContact O-N 3.34Å; V766-R770 WeakPolarHBondContact O-CB 3.43Å; V766-R770 VanDerWaalsContact O-CG 3.31Å; V766-R770 WeakPolarHBondContact O-CG 3.31Å; V766-R770 PolarHBondContact O-N 3.32Å; V766-V780 HydrophobicContact CG1-CG2 3.78Å; V766-V780 HydrophobicContact CG2-CG1 4.21Å; V766-V780 HydrophobicContact CG2-CG2 3.97Å; V766-L789 HydrophobicContact CG2-CD2 4.46Å; V766-L791 HydrophobicContact CG2-CD2 4.13Å
767	L	92.3	Very high	90.4	Very high	73 Å²	73	50.5 Å²	50.5	38%	0.382	25%	0.253	S	S	.	.	H	α-helix	trans	-73.1	-37.3	-179.9	-174.3	54.7	0	0	0	111.9	Y229 E763 L765 R770 T771	Y229-L767 HydrophobicContact CD1-CB 4.48Å; Y229-L767 HydrophobicContact CD1-CD2 3.52Å; Y229-L767 HydrophobicContact CD1-CG 3.83Å; Y229-L767 HydrophobicContact CE1-CD2 4.25Å; Y229-L767 HydrophobicContact CE1-CG 4.08Å; Y229-L767 HydrophobicContact CG-CB 4.42Å; Y229-L767 HydrophobicContact CG-CD2 3.81Å; Y229-L767 HydrophobicContact CG-CG 4.22Å; E763-L767 VanDerWaalsContact O-CB 3.3Å; E763-L767 WeakPolarHBondContact O-CB 3.46Å; E763-L767 PolarHBondContact O-N 2.77Å; L765-L767 VanDerWaalsContact C-N 3.33Å; L765-L767 PolarHBondContact O-N 2.99Å; L767-R770 PolarHBondContact O-N 3.32Å; L767-T771 HydrophobicContact CD1-CG2 3.84Å; L767-T771 HydrophobicContact CG-CG2 4.44Å; L767-T771 WeakPolarHBondContact O-CB 3.39Å; L767-T771 WeakPolarHBondContact O-CG2 3.35Å; L767-T771 PolarHBondContact O-N 2.87Å; L767-T771 PolarHBondContact O-OG1 2.99Å
768	H	94.3	Very high	90.8	Very high	4 Å²	4	51 Å²	51	2%	0.019	26%	0.255	C	S	.	.	H	α-helix	trans	-58.6	-50.3	169.9	175.2	71.5	0	0	0	111.8	Y229 C747 C750 L752 A764 L765 R770 T771 C772 H773	Y229-H768 HydrophobicContact CE2-CB 3.89Å; Y229-H768 WeakPolarHBondContact OH-CA 3.13Å; C747-H768 PolarHBondContact SG-NE2 2.98Å; C747-H768 VanDerWaalsContact SG-NE2 3.37Å; C750-H768 PolarHBondContact SG-NE2 3.45Å; L752-H768 WeakPolarHBondContact CD2-ND1 3.3Å; A764-H768 WeakPolarHBondContact O-CB 3.36Å; A764-H768 PolarHBondContact O-N 2.93Å; L765-H768 PolarHBondContact O-N 2.87Å; H768-R770 VanDerWaalsContact C-N 3.34Å; H768-R770 PolarHBondContact O-N 2.94Å; H768-T771 PolarHBondContact O-N 3.25Å; H768-T771 PolarHBondContact O-OG1 2.69Å; H768-C772 VanDerWaalsContact CE1-CB 3.48Å; H768-C772 WeakPolarHBondContact CE1-CB 3.49Å; H768-C772 VanDerWaalsContact CE1-SG 3.54Å; H768-C772 PolarHBondContact ND1-SG 2.67Å; H768-C772 VanDerWaalsContact O-CB 3.3Å; H768-C772 WeakPolarHBondContact O-CB 3.29Å; H768-C772 PolarHBondContact O-N 2.88Å; H768-H773 AromaticContact CD2-NE2 3.74Å; H768-H773 AromaticContact CE1-NE2 3.71Å; H768-H773 AromaticContact NE2-CD2 3.65Å; H768-H773 AromaticContact NE2-NE2 2.96Å; H768-H773 PolarHBondContact NE2-NE2 3.04Å
769	L	94.4	Very high	91.2	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-43.2	179.2	-70.4	-179.8	0	0	0	111.8	Y728 W749 L765 H773 L778 L791	Y728-L769 HydrophobicContact CE1-CD1 4.22Å; W749-L769 HydrophobicContact CE3-CD2 3.59Å; W749-L769 HydrophobicContact CZ3-CD1 4.38Å; W749-L769 HydrophobicContact CZ3-CD2 3.49Å; W749-L769 VanDerWaalsContact CZ3-CD2 3.49Å; L765-L769 HydrophobicContact CD1-CD1 4.17Å; L765-L769 HydrophobicContact CD1-CG 4.14Å; L765-L769 HydrophobicContact CG-CD1 4.13Å; L765-L769 HydrophobicContact CG-CG 4.44Å; L765-L769 WeakPolarHBondContact O-CB 3.27Å; L765-L769 VanDerWaalsContact O-CG 3.27Å; L765-L769 WeakPolarHBondContact O-CG 3.39Å; L765-L769 PolarHBondContact O-N 2.86Å; L769-H773 WeakPolarHBondContact O-CB 3.18Å; L769-H773 PolarHBondContact O-N 2.97Å; L769-L778 HydrophobicContact CB-CD2 3.76Å; L769-L778 HydrophobicContact CD1-CD1 4.42Å; L769-L778 HydrophobicContact CD1-CD2 4.14Å; L769-L791 HydrophobicContact CD1-CD1 3.97Å
770	R	92.8	Very high	91.8	Very high	111 Å²	111	48.1 Å²	48.1	42%	0.419	22%	0.224	S	C	.	.	H	α-helix	trans	-67.4	-32.7	177.3	-74.1	172.3	171.6	177.8	-1.8	114.2	V766 L767 H768 L778	V766-R770 WeakPolarHBondContact O-CB 3.43Å; V766-R770 VanDerWaalsContact O-CG 3.31Å; V766-R770 WeakPolarHBondContact O-CG 3.31Å; V766-R770 PolarHBondContact O-N 3.32Å; L767-R770 PolarHBondContact O-N 3.32Å; H768-R770 VanDerWaalsContact C-N 3.34Å; H768-R770 PolarHBondContact O-N 2.94Å; R770-L778 HydrophobicContact CG-CB 4.35Å; R770-L778 HydrophobicContact CG-CD2 4.15Å
771	T	91	Very high	92.2	Very high	76 Å²	76	46.5 Å²	46.5	47%	0.466	22%	0.219	S	C	.	.	H	α-helix	trans	-96	-39.4	-174.2	53.8	0	0	0	0	113.9	L767 H768	L767-T771 HydrophobicContact CD1-CG2 3.84Å; L767-T771 HydrophobicContact CG-CG2 4.44Å; L767-T771 WeakPolarHBondContact O-CB 3.39Å; L767-T771 WeakPolarHBondContact O-CG2 3.35Å; L767-T771 PolarHBondContact O-N 2.87Å; L767-T771 PolarHBondContact O-OG1 2.99Å; H768-T771 PolarHBondContact O-N 3.25Å; H768-T771 PolarHBondContact O-OG1 2.69Å
772	C	93.4	Very high	92.2	Very high	27 Å²	27	50.9 Å²	50.9	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-91.2	-22.2	-175	-60.7	0	0	0	0	113.1	Y209 Y222 H768 P774	Y209-C772 WeakPolarHBondContact CE1-O 3.27Å; Y222-C772 PolarHBondContact OH-SG 2.82Å; H768-C772 VanDerWaalsContact CE1-CB 3.48Å; H768-C772 WeakPolarHBondContact CE1-CB 3.49Å; H768-C772 VanDerWaalsContact CE1-SG 3.54Å; H768-C772 PolarHBondContact ND1-SG 2.67Å; H768-C772 VanDerWaalsContact O-CB 3.3Å; H768-C772 WeakPolarHBondContact O-CB 3.29Å; H768-C772 PolarHBondContact O-N 2.88Å; C772-P774 VanDerWaalsContact O-CD 3.29Å; C772-P774 WeakPolarHBondContact O-CD 3.38Å
773	H	94.3	Very high	92	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.028	25%	0.249	C	C	.	.			trans	-118.7	44.8	-176.9	-51.4	-88.2	0	0	0	114.5	Y209 C747 H768 L769 R775 F776	Y209-H773 AromaticContact CD1-ND1 3.52Å; Y209-H773 AromaticContact CD2-ND1 3.81Å; Y209-H773 HydrophobicContact CE1-CB 4.35Å; Y209-H773 AromaticContact CE1-ND1 3.88Å; Y209-H773 HydrophobicContact CE2-CB 4.1Å; Y209-H773 AromaticContact CG-ND1 3.5Å; Y209-H773 WeakPolarHBondContact OH-CA 3.21Å; Y209-H773 PolarHBondContact OH-O 2.93Å; C747-H773 PolarHBondContact SG-NE2 3.01Å; H768-H773 AromaticContact CD2-NE2 3.74Å; H768-H773 AromaticContact CE1-NE2 3.71Å; H768-H773 AromaticContact NE2-CD2 3.65Å; H768-H773 AromaticContact NE2-NE2 2.96Å; H768-H773 PolarHBondContact NE2-NE2 3.04Å; L769-H773 WeakPolarHBondContact O-CB 3.18Å; L769-H773 PolarHBondContact O-N 2.97Å; H773-R775 PolarHBondContact O-N 3.5Å; H773-F776 HydrophobicContact CB-CD2 4.32Å; H773-F776 PolarHBondContact O-N 2.86Å
774	P	92.7	Very high	91.7	Very high	46 Å²	46	54.6 Å²	54.6	30%	0.299	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-1.5	-167.2	30.4	-39.5	0	0	0	116.4	C772 N796 Y799	C772-P774 VanDerWaalsContact O-CD 3.29Å; C772-P774 WeakPolarHBondContact O-CD 3.38Å; P774-N796 WeakPolarHBondContact O-CB 3.38Å; P774-N796 PolarHBondContact O-ND2 3.41Å; P774-Y799 HydrophobicContact CB-CD2 4.27Å; P774-Y799 HydrophobicContact CB-CE2 4.14Å; P774-Y799 HydrophobicContact CG-CD2 4.44Å; P774-Y799 HydrophobicContact CG-CE2 3.84Å; P774-Y799 WeakPolarHBondContact O-CD2 3.45Å
775	R	94.1	Very high	91.1	Very high	78 Å²	78	57.8 Å²	57.8	29%	0.294	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-15.7	168	-68.4	177.3	173.5	-82.4	4.9	112.4	P205 L208 Y209 H773 N796 Y799	P205-R775 HydrophobicContact CB-CB 4.02Å; P205-R775 HydrophobicContact CG-CB 4.28Å; L208-R775 VanDerWaalsContact CD2-NE 3.32Å; Y209-R775 HydrophobicContact CE2-CB 4.16Å; Y209-R775 VanDerWaalsContact OH-CB 3.31Å; Y209-R775 WeakPolarHBondContact OH-CB 3.42Å; Y209-R775 WeakPolarHBondContact OH-CG 3.25Å; Y209-R775 PolarHBondContact OH-N 2.83Å; H773-R775 PolarHBondContact O-N 3.5Å; R775-N796 WeakPolarHBondContact O-CB 3.39Å; R775-N796 PolarHBondContact O-N 2.84Å; R775-Y799 HydrophobicContact CG-CD1 3.7Å; R775-Y799 HydrophobicContact CG-CD2 4.11Å; R775-Y799 HydrophobicContact CG-CE1 3.7Å; R775-Y799 HydrophobicContact CG-CE2 4.12Å; R775-Y799 HydrophobicContact CG-CG 3.91Å
776	F	95.1	Very high	90.4	Very high	15 Å²	15	63.4 Å²	63.4	7%	0.066	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	145.6	168.2	-57.7	-58.9	0	0	0	110.3	F202 P205 Y209 W749 H773 V793 S794 L795	F202-F776 HydrophobicContact CD1-CD1 4.24Å; F202-F776 AromaticContact CD1-CE1 3.59Å; F202-F776 HydrophobicContact CD1-CE1 3.59Å; F202-F776 HydrophobicContact CD1-CZ 4.4Å; F202-F776 HydrophobicContact CE1-CD1 4.07Å; F202-F776 AromaticContact CE1-CE1 3.9Å; F202-F776 HydrophobicContact CE1-CE1 3.9Å; P205-F776 HydrophobicContact CB-CE1 3.97Å; P205-F776 HydrophobicContact CB-CE2 4.18Å; P205-F776 HydrophobicContact CB-CZ 3.64Å; P205-F776 HydrophobicContact CG-CE1 4.16Å; P205-F776 HydrophobicContact CG-CZ 4.3Å; Y209-F776 HydrophobicContact CD2-CD2 4.47Å; Y209-F776 AromaticContact CD2-CE2 3.85Å; Y209-F776 HydrophobicContact CD2-CE2 3.85Å; Y209-F776 HydrophobicContact CE2-CD2 4.02Å; Y209-F776 AromaticContact CE2-CE2 3.76Å; Y209-F776 HydrophobicContact CE2-CE2 3.76Å; W749-F776 AromaticContact CD1-CE2 3.88Å; W749-F776 HydrophobicContact CD2-CE2 4.26Å; W749-F776 AromaticContact CE2-CE2 3.59Å; W749-F776 HydrophobicContact CG-CE2 4.42Å; W749-F776 HydrophobicContact CZ2-CD2 4.2Å; W749-F776 AromaticContact CZ2-CE2 3.98Å; W749-F776 HydrophobicContact CZ2-CE2 3.98Å; W749-F776 AromaticContact NE1-CE2 3.34Å; W749-F776 VanDerWaalsContact NE1-CE2 3.34Å; W749-F776 AromaticContact NE1-CZ 3.74Å; H773-F776 HydrophobicContact CB-CD2 4.32Å; H773-F776 PolarHBondContact O-N 2.86Å; F776-V793 HydrophobicContact CB-CG1 3.99Å; F776-V793 HydrophobicContact CD1-CG1 4.11Å; F776-V793 HydrophobicContact CG-CG1 4.03Å; F776-S794 CarbonylContact C-O 3.58Å; F776-S794 VanDerWaalsContact CA-O 3.26Å; F776-S794 WeakPolarHBondContact CA-O 3.21Å; F776-L795 HydrophobicContact CD1-CD2 4.22Å; F776-L795 HydrophobicContact CE1-CD2 4.1Å
777	R	93.8	Very high	89.7	Confident	177 Å²	177	65.8 Å²	65.8	67%	0.668	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	115.9	169.9	178.8	-178.9	-174.5	-174.3	1.6	108.3	S794 N796	R777-S794 WeakPolarHBondContact CB-OG 3.49Å; R777-S794 PolarHBondContact N-O 3.46Å; R777-S794 PolarHBondContact O-N 3.16Å; R777-S794 PolarHBondContact O-OG 3Å; R777-N796 HydrophobicContact CB-CB 4.3Å
778	L	93.1	Very high	89.3	Confident	23 Å²	23	65.6 Å²	65.6	12%	0.12	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	108.8	-175.7	-170.6	78.4	0	0	0	111.3	L769 R770 V780 L791 V793	L769-L778 HydrophobicContact CB-CD2 3.76Å; L769-L778 HydrophobicContact CD1-CD1 4.42Å; L769-L778 HydrophobicContact CD1-CD2 4.14Å; R770-L778 HydrophobicContact CG-CB 4.35Å; R770-L778 HydrophobicContact CG-CD2 4.15Å; L778-V780 HydrophobicContact CD2-CG2 3.97Å; L778-V780 HydrophobicContact CG-CG2 4.16Å; L778-L791 HydrophobicContact CD1-CB 4.06Å; L778-L791 HydrophobicContact CD1-CD2 4.39Å; L778-L791 HydrophobicContact CD2-CD2 4.36Å; L778-V793 HydrophobicContact CD1-CG2 4.11Å
779	K	93.1	Very high	89	Confident	110 Å²	110	65.4 Å²	65.4	48%	0.478	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.7	163.9	-177.1	-161.3	-176.9	-163.8	0	108	M781 Q792	K779-M781 HydrophobicContact CD-CG 4.31Å; K779-M781 HydrophobicContact CD-SD 4.06Å; K779-M781 HydrophobicContact CG-CG 4.42Å; K779-M781 PolarHBondContact NZ-SD 2.96Å; K779-Q792 HydrophobicContact CB-CB 4.2Å; K779-Q792 PolarHBondContact N-O 2.8Å; K779-Q792 PolarHBondContact O-N 3.36Å
780	V	92.3	Very high	88.8	Confident	33 Å²	33	66.5 Å²	66.5	20%	0.2	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136	-179.3	-179	0	0	0	0	107.9	V766 L778 L789 L791	V766-V780 HydrophobicContact CG1-CG2 3.78Å; V766-V780 HydrophobicContact CG2-CG1 4.21Å; V766-V780 HydrophobicContact CG2-CG2 3.97Å; L778-V780 HydrophobicContact CD2-CG2 3.97Å; L778-V780 HydrophobicContact CG-CG2 4.16Å; V780-L789 HydrophobicContact CG1-CD1 3.75Å; V780-L791 HydrophobicContact CB-CD2 4.37Å; V780-L791 HydrophobicContact CG1-CD2 4.12Å; V780-L791 HydrophobicContact CG2-CD2 3.89Å
781	M	90.8	Very high	88.8	Confident	72 Å²	72	61.3 Å²	61.3	36%	0.355	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	126.9	177.2	-54.8	179.4	-54.6	0	0	106.9	K779 S790	K779-M781 HydrophobicContact CD-CG 4.31Å; K779-M781 HydrophobicContact CD-SD 4.06Å; K779-M781 HydrophobicContact CG-CG 4.42Å; K779-M781 PolarHBondContact NZ-SD 2.96Å; M781-S790 PolarHBondContact N-O 2.87Å; M781-S790 WeakPolarHBondContact O-CA 3.26Å; M781-S790 WeakPolarHBondContact O-CB 3.34Å; M781-S790 PolarHBondContact O-N 3.02Å
782	W	87.4	Confident	89	Confident	93 Å²	93	60.8 Å²	60.8	35%	0.352	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	146.7	171.4	-71	101.5	0	0	0	108.8	P762 H786 L789	P762-W782 HydrophobicContact CB-CH2 3.6Å; P762-W782 HydrophobicContact CB-CZ2 4.11Å; P762-W782 HydrophobicContact CG-CH2 4.23Å; W782-H786 AromaticContact CG-ND1 3.95Å; W782-H786 WeakPolarHBondContact CZ3-O 3.39Å; W782-L789 HydrophobicContact CD2-CD1 3.96Å; W782-L789 HydrophobicContact CE3-CB 4.28Å; W782-L789 HydrophobicContact CE3-CD1 4.1Å; W782-L789 HydrophobicContact CH2-CB 4.45Å; W782-L789 HydrophobicContact CH2-CD1 4.1Å; W782-L789 HydrophobicContact CZ2-CD1 3.91Å; W782-L789 HydrophobicContact CZ3-CB 4.02Å; W782-L789 HydrophobicContact CZ3-CD1 4.17Å
783	D	84.4	Confident	89.1	Confident	63 Å²	63	59.5 Å²	59.5	34%	0.337	30%	0.299	S	S	.	.			trans	-65.7	157.9	162.6	170.8	52.6	0	0	0	111.2	S785 H786 Q788	D783-S785 PolarHBondContact O-N 3.16Å; D783-S785 VanDerWaalsContact OD2-CB 3.23Å; D783-S785 WeakPolarHBondContact OD2-CB 3.5Å; D783-S785 PolarHBondContact OD2-N 3.2Å; D783-S785 PolarHBondContact OD2-OG 3.05Å; D783-H786 WeakPolarHBondContact O-CA 3.25Å; D783-H786 PolarHBondContact O-N 2.84Å; D783-Q788 HydrophobicContact CB-CB 4.04Å; D783-Q788 PolarHBondContact N-O 2.84Å; D783-Q788 VanDerWaalsContact N-O 3.11Å
784	S	81.2	Confident	89.2	Confident	120 Å²	120	60.7 Å²	60.7	84%	0.839	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-32.2	176.2	-52.9	0	0	0	0	113.4	H786	S784-H786 VanDerWaalsContact C-N 3.28Å
785	S	78.6	Confident	89.3	Confident	68 Å²	68	59.9 Å²	59.9	48%	0.476	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.1	174.6	73.7	0	0	0	0	113.7	D783 T787	D783-S785 PolarHBondContact O-N 3.16Å; D783-S785 VanDerWaalsContact OD2-CB 3.23Å; D783-S785 WeakPolarHBondContact OD2-CB 3.5Å; D783-S785 PolarHBondContact OD2-N 3.2Å; D783-S785 PolarHBondContact OD2-OG 3.05Å; S785-T787 PolarHBondContact O-N 2.9Å; S785-T787 WeakPolarHBondContact OG-CG2 3.49Å; S785-T787 PolarHBondContact OG-N 2.99Å; S785-T787 PolarHBondContact OG-OG1 2.84Å
786	H	77.2	Confident	89.2	Confident	117 Å²	117	58.5 Å²	58.5	54%	0.542	30%	0.3	S	S	.	.	S	Bend	trans	57.9	1.7	-168.5	-77.5	-99.9	0	0	0	116.1	H724 W782 D783 S784	H724-H786 PolarHBondContact CD2-O 2.91Å; W782-H786 AromaticContact CG-ND1 3.95Å; W782-H786 WeakPolarHBondContact CZ3-O 3.39Å; D783-H786 WeakPolarHBondContact O-CA 3.25Å; D783-H786 PolarHBondContact O-N 2.84Å; S784-H786 VanDerWaalsContact C-N 3.28Å
787	T	76.7	Confident	88.9	Confident	64 Å²	64	65.6 Å²	65.6	39%	0.393	33%	0.333	S	S	.	.			trans	-73.2	-32.8	-178	61.3	0	0	0	0	113.9	H724 S785	H724-T787 VanDerWaalsContact CA-O 3.28Å; H724-T787 WeakPolarHBondContact CA-O 3.46Å; H724-T787 WeakPolarHBondContact CB-O 3.48Å; H724-T787 PolarHBondContact CD2-O 3.37Å; S785-T787 PolarHBondContact O-N 2.9Å; S785-T787 WeakPolarHBondContact OG-CG2 3.49Å; S785-T787 PolarHBondContact OG-N 2.99Å; S785-T787 PolarHBondContact OG-OG1 2.84Å
788	Q	83.8	Confident	88.6	Confident	69 Å²	69	61.3 Å²	61.3	32%	0.322	34%	0.335	S	S	.	.			trans	-106.3	131.8	-178.8	-173.7	170.3	33.9	0	0	112.1	P725 D783	P725-Q788 HydrophobicContact CG-CB 4.22Å; P725-Q788 HydrophobicContact CG-CG 4.08Å; P725-Q788 WeakPolarHBondContact O-CG 3.14Å; D783-Q788 HydrophobicContact CB-CB 4.04Å; D783-Q788 PolarHBondContact N-O 2.84Å; D783-Q788 VanDerWaalsContact N-O 3.11Å
789	L	88.3	Confident	88.3	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	111.1	179	177.3	60.1	0	0	0	110.5	P725 I726 T727 P762 V766 V780 W782 L791	P725-L789 PolarHBondContact O-N 3.41Å; P725-L789 VanDerWaalsContact O-N 3.09Å; I726-L789 CarbonylContact C-O 3.54Å; I726-L789 WeakPolarHBondContact CA-O 3.5Å; I726-L789 HydrophobicContact CG2-CB 4.48Å; I726-L789 HydrophobicContact CG2-CD2 4.21Å; I726-L789 HydrophobicContact CG2-CG 4.29Å; T727-L789 PolarHBondContact N-O 3.08Å; P762-L789 HydrophobicContact CB-CD2 4.29Å; V766-L789 HydrophobicContact CG2-CD2 4.46Å; V780-L789 HydrophobicContact CG1-CD1 3.75Å; W782-L789 HydrophobicContact CD2-CD1 3.96Å; W782-L789 HydrophobicContact CE3-CB 4.28Å; W782-L789 HydrophobicContact CE3-CD1 4.1Å; W782-L789 HydrophobicContact CH2-CB 4.45Å; W782-L789 HydrophobicContact CH2-CD1 4.1Å; W782-L789 HydrophobicContact CZ2-CD1 3.91Å; W782-L789 HydrophobicContact CZ3-CB 4.02Å; W782-L789 HydrophobicContact CZ3-CD1 4.17Å; L789-L791 HydrophobicContact CD1-CD2 3.91Å; L789-L791 HydrophobicContact CD2-CD1 4.42Å; L789-L791 HydrophobicContact CD2-CD2 4.3Å; L789-L791 HydrophobicContact CD2-CG 4.43Å; L789-L791 HydrophobicContact CG-CD2 3.97Å; L789-L791 HydrophobicContact CG-CG 4.08Å
790	S	91.5	Very high	87.6	Confident	28 Å²	28	64.6 Å²	64.6	20%	0.196	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	117.3	179	-67	0	0	0	0	112.1	T727 M781	T727-S790 WeakPolarHBondContact OG1-CA 3.28Å; T727-S790 PolarHBondContact OG1-OG 3.25Å; T727-S790 VanDerWaalsContact OG1-OG 3.11Å; M781-S790 PolarHBondContact N-O 2.87Å; M781-S790 WeakPolarHBondContact O-CA 3.26Å; M781-S790 WeakPolarHBondContact O-CB 3.34Å; M781-S790 PolarHBondContact O-N 3.02Å
791	L	93.1	Very high	86.5	Confident	2 Å²	2	65 Å²	65	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	100.5	-174.3	-62.8	-175.3	0	0	0	110.7	I726 T727 Y728 G729 V766 L769 L778 V780 L789 V793	I726-L791 HydrophobicContact CG2-CD1 3.63Å; I726-L791 HydrophobicContact CG2-CG 4.07Å; T727-L791 WeakPolarHBondContact O-CA 3.47Å; T727-L791 WeakPolarHBondContact O-CB 3.36Å; T727-L791 PolarHBondContact O-N 3.12Å; Y728-L791 CarbonylContact C-O 3.58Å; Y728-L791 WeakPolarHBondContact CA-O 3.35Å; Y728-L791 HydrophobicContact CD1-CB 4.17Å; Y728-L791 HydrophobicContact CD1-CD1 4.13Å; Y728-L791 HydrophobicContact CE1-CB 4.49Å; Y728-L791 HydrophobicContact CE1-CD1 3.61Å; G729-L791 PolarHBondContact N-O 3.13Å; V766-L791 HydrophobicContact CG2-CD2 4.13Å; L769-L791 HydrophobicContact CD1-CD1 3.97Å; L778-L791 HydrophobicContact CD1-CB 4.06Å; L778-L791 HydrophobicContact CD1-CD2 4.39Å; L778-L791 HydrophobicContact CD2-CD2 4.36Å; V780-L791 HydrophobicContact CB-CD2 4.37Å; V780-L791 HydrophobicContact CG1-CD2 4.12Å; V780-L791 HydrophobicContact CG2-CD2 3.89Å; L789-L791 HydrophobicContact CD1-CD2 3.91Å; L789-L791 HydrophobicContact CD2-CD1 4.42Å; L789-L791 HydrophobicContact CD2-CD2 4.3Å; L789-L791 HydrophobicContact CD2-CG 4.43Å; L789-L791 HydrophobicContact CG-CD2 3.97Å; L789-L791 HydrophobicContact CG-CG 4.08Å; L791-V793 PolarHBondContact O-N 3.29Å
792	Q	95.1	Very high	85.1	Confident	65 Å²	65	63.7 Å²	63.7	30%	0.304	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.4	176.9	-177.2	176.3	69	0	0	109.9	G729 V731 K779	G729-Q792 CarbonylContact O-C 3.6Å; G729-Q792 WeakPolarHBondContact O-CA 3.25Å; V731-Q792 HydrophobicContact CB-CG 4.48Å; V731-Q792 HydrophobicContact CG2-CG 3.61Å; K779-Q792 HydrophobicContact CB-CB 4.2Å; K779-Q792 PolarHBondContact N-O 2.8Å; K779-Q792 PolarHBondContact O-N 3.36Å
793	V	95.5	Very high	83.5	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.1	-174.4	-169.2	0	0	0	0	109.4	F202 Y728 G729 F730 V731 W749 F776 L778 L791	F202-V793 HydrophobicContact CE1-CG1 4.27Å; Y728-V793 HydrophobicContact CD1-CG2 4.32Å; G729-V793 PolarHBondContact O-N 3.4Å; F730-V793 WeakPolarHBondContact CA-O 3.32Å; F730-V793 HydrophobicContact CD1-CB 4.15Å; F730-V793 HydrophobicContact CD1-CG1 4.32Å; F730-V793 HydrophobicContact CE1-CB 4.34Å; F730-V793 HydrophobicContact CE1-CG1 4.29Å; V731-V793 PolarHBondContact N-O 2.84Å; W749-V793 HydrophobicContact CH2-CG1 4.29Å; W749-V793 HydrophobicContact CH2-CG2 4.17Å; W749-V793 HydrophobicContact CZ2-CG1 4.29Å; F776-V793 HydrophobicContact CB-CG1 3.99Å; F776-V793 HydrophobicContact CD1-CG1 4.11Å; F776-V793 HydrophobicContact CG-CG1 4.03Å; L778-V793 HydrophobicContact CD1-CG2 4.11Å; L791-V793 PolarHBondContact O-N 3.29Å
794	S	95.4	Very high	81.9	Confident	30 Å²	30	65.6 Å²	65.6	21%	0.21	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	164.6	176.8	55.2	0	0	0	0	110.7	F776 R777	F776-S794 CarbonylContact C-O 3.58Å; F776-S794 VanDerWaalsContact CA-O 3.26Å; F776-S794 WeakPolarHBondContact CA-O 3.21Å; R777-S794 WeakPolarHBondContact CB-OG 3.49Å; R777-S794 PolarHBondContact N-O 3.46Å; R777-S794 PolarHBondContact O-N 3.16Å; R777-S794 PolarHBondContact O-OG 3Å
795	L	94.3	Very high	80.3	Confident	30 Å²	30	64.2 Å²	64.2	16%	0.157	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	139.5	173.8	-62.5	171.9	0	0	0	110.4	A201 F202 F732 F776 E797	A201-L795 HydrophobicContact CB-CD1 3.62Å; F202-L795 HydrophobicContact CD1-CD2 4.15Å; F202-L795 HydrophobicContact CD2-CD1 4.25Å; F202-L795 HydrophobicContact CD2-CD2 4.04Å; F202-L795 HydrophobicContact CD2-CG 4.15Å; F202-L795 HydrophobicContact CE1-CD2 4.08Å; F202-L795 HydrophobicContact CE1-CG 4.39Å; F202-L795 HydrophobicContact CE2-CD1 4.01Å; F202-L795 HydrophobicContact CE2-CD2 3.99Å; F202-L795 HydrophobicContact CE2-CG 3.68Å; F202-L795 HydrophobicContact CG-CD2 4.14Å; F202-L795 HydrophobicContact CZ-CD2 4.02Å; F202-L795 HydrophobicContact CZ-CG 3.83Å; F732-L795 HydrophobicContact CD2-CD1 3.87Å; F732-L795 HydrophobicContact CE2-CD1 3.82Å; F776-L795 HydrophobicContact CD1-CD2 4.22Å; F776-L795 HydrophobicContact CE1-CD2 4.1Å; L795-E797 WeakPolarHBondContact CB-OE1 3.42Å; L795-E797 PolarHBondContact O-N 3.16Å
796	N	93.4	Very high	78.9	Confident	49 Å²	49	62.5 Å²	62.5	26%	0.262	36%	0.361	S	S	.	.			trans	-89.6	86	175.1	-173.6	10.2	0	0	0	110.4	P774 R775 R777 A798 Y799	P774-N796 WeakPolarHBondContact O-CB 3.38Å; P774-N796 PolarHBondContact O-ND2 3.41Å; R775-N796 WeakPolarHBondContact O-CB 3.39Å; R775-N796 PolarHBondContact O-N 2.84Å; R777-N796 HydrophobicContact CB-CB 4.3Å; N796-A798 PolarHBondContact O-N 3.43Å; N796-A798 VanDerWaalsContact O-N 3.08Å; N796-A798 PolarHBondContact OD1-N 3.02Å; N796-Y799 WeakPolarHBondContact O-CB 3.48Å; N796-Y799 PolarHBondContact O-N 3.36Å
797	E	89.1	Confident	77.6	Confident	164 Å²	164	62 Å²	62	77%	0.766	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-17.2	176.2	-56.5	-54.9	138.1	0	0	113.7	L795 Y799	L795-E797 WeakPolarHBondContact CB-OE1 3.42Å; L795-E797 PolarHBondContact O-N 3.16Å; E797-Y799 VanDerWaalsContact C-N 3.34Å
798	A	86.5	Confident	76.2	Confident	87 Å²	87	62.9 Å²	62.9	72%	0.719	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	0.6	173.7	0	0	0	0	0	113.5	N796 D800	N796-A798 PolarHBondContact O-N 3.43Å; N796-A798 VanDerWaalsContact O-N 3.08Å; N796-A798 PolarHBondContact OD1-N 3.02Å; A798-D800 PolarHBondContact O-N 3.23Å
799	Y	88	Confident	74.5	Confident	87 Å²	87	67.1 Å²	67.1	34%	0.341	37%	0.37	S	S	.	.			trans	-76.5	91.7	176.8	-170.2	-88	0	0	0	110.9	P774 R775 N796 E797 G801	P774-Y799 HydrophobicContact CB-CD2 4.27Å; P774-Y799 HydrophobicContact CB-CE2 4.14Å; P774-Y799 HydrophobicContact CG-CD2 4.44Å; P774-Y799 HydrophobicContact CG-CE2 3.84Å; P774-Y799 WeakPolarHBondContact O-CD2 3.45Å; R775-Y799 HydrophobicContact CG-CD1 3.7Å; R775-Y799 HydrophobicContact CG-CD2 4.11Å; R775-Y799 HydrophobicContact CG-CE1 3.7Å; R775-Y799 HydrophobicContact CG-CE2 4.12Å; R775-Y799 HydrophobicContact CG-CG 3.91Å; N796-Y799 WeakPolarHBondContact O-CB 3.48Å; N796-Y799 PolarHBondContact O-N 3.36Å; E797-Y799 VanDerWaalsContact C-N 3.34Å; Y799-G801 VanDerWaalsContact CE1-CA 3.46Å; Y799-G801 PolarHBondContact O-N 3Å
800	D	78.4	Confident	72.2	Confident	115 Å²	115	71.3 Å²	71.3	62%	0.615	39%	0.386	S	S	*	.			trans	-70	-10.1	-176.6	73.6	-6	0	0	0	114.9	A798 S802	A798-D800 PolarHBondContact O-N 3.23Å; D800-S802 WeakPolarHBondContact O-CB 3.48Å; D800-S802 PolarHBondContact O-N 3.5Å; D800-S802 VanDerWaalsContact O-N 3.16Å; D800-S802 PolarHBondContact O-OG 3.41Å; D800-S802 VanDerWaalsContact O-OG 3.08Å; D800-S802 WeakPolarHBondContact OD1-CB 3.47Å; D800-S802 PolarHBondContact OD1-N 2.96Å; D800-S802 WeakPolarHBondContact OD2-CB 3.19Å
801	G	68.5	Low	69.9	Low	41 Å²	41	73.6 Å²	73.6	42%	0.423	40%	0.401	S	S	.	.			trans	59.4	20.8	-177.8	0	0	0	0	0	114.2	Y799	Y799-G801 VanDerWaalsContact CE1-CA 3.46Å; Y799-G801 PolarHBondContact O-N 3Å
802	S	60.9	Low	67.3	Low	45 Å²	45	79.2 Å²	79.2	32%	0.315	44%	0.438	S	S	.	.			trans	-119.1	91.6	-147.7	-109	0	0	0	0	111.9	D800 D804 R808	D800-S802 WeakPolarHBondContact O-CB 3.48Å; D800-S802 PolarHBondContact O-N 3.5Å; D800-S802 VanDerWaalsContact O-N 3.16Å; D800-S802 PolarHBondContact O-OG 3.41Å; D800-S802 VanDerWaalsContact O-OG 3.08Å; D800-S802 WeakPolarHBondContact OD1-CB 3.47Å; D800-S802 PolarHBondContact OD1-N 2.96Å; D800-S802 WeakPolarHBondContact OD2-CB 3.19Å; S802-D804 PolarHBondContact O-N 2.97Å; S802-R808 PolarHBondContact O-NH2 3.44Å; S802-R808 PolarHBondContact OG-NH1 3.21Å
803	N	54.6	Low	64.6	Low	129 Å²	129	81.9 Å²	81.9	69%	0.69	46%	0.464	S	S	*	.			trans	-54.6	101.4	179.1	-70.3	-20.8	0	0	0	112.9	C805	N803-C805 PolarHBondContact O-N 2.92Å; N803-C805 VanDerWaalsContact O-N 3.12Å
804	D	51.1	Low	61.7	Low	66 Å²	66	84.5 Å²	84.5	35%	0.353	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-8.2	179.7	-107.8	5.6	0	0	0	114.4	S802 G806 R808 N907	S802-D804 PolarHBondContact O-N 2.97Å; D804-G806 PolarHBondContact O-N 2.87Å; D804-R808 IonicContact OD1-CZ 3.07Å; D804-R808 IonicContact OD1-NE 2.73Å; D804-R808 IonicContact OD1-NH2 3.79Å; D804-R808 PolarHBondContact OD1-NH2 3.12Å; D804-N907 PolarHBondContact OD2-ND2 3.13Å
805	C	47.7	Very low	58.8	Low	92 Å²	92	94.5 Å²	94.5	62%	0.622	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	42.5	174.4	49.2	0	0	0	0	114.7	N803 I807 R873	N803-C805 PolarHBondContact O-N 2.92Å; N803-C805 VanDerWaalsContact O-N 3.12Å; C805-I807 PolarHBondContact O-N 3.19Å; C805-R873 PolarHBondContact O-NH1 3.19Å
806	G	48.6	Very low	55.8	Low	32 Å²	32	100.5 Å²	100.5	33%	0.33	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	74	22.4	151.5	0	0	0	0	0	118	D804 R873	D804-G806 PolarHBondContact O-N 2.87Å; G806-R873 VanDerWaalsContact O-CZ 3.22Å; G806-R873 PolarHBondContact O-NH1 3.22Å; G806-R873 VanDerWaalsContact O-NH1 3.11Å
807	I	49.1	Very low	52.9	Low	107 Å²	107	105.9 Å²	105.9	55%	0.549	58%	0.583	S	S	.	*			trans	-108.4	32.5	174.4	-36.2	-173.5	0	0	0	111.5	C805 R809	C805-I807 PolarHBondContact O-N 3.19Å; I807-R809 PolarHBondContact O-N 3.04Å
808	R	48.5	Very low	50	Low	82 Å²	82	107.3 Å²	107.3	31%	0.309	59%	0.587	S	S	.	*	S	Bend	trans	-84.5	101.5	176.3	-57.9	-172.9	-170	-79.1	5.1	110.2	S802 D804 I909	S802-R808 PolarHBondContact O-NH2 3.44Å; S802-R808 PolarHBondContact OG-NH1 3.21Å; D804-R808 IonicContact OD1-CZ 3.07Å; D804-R808 IonicContact OD1-NE 2.73Å; D804-R808 IonicContact OD1-NH2 3.79Å; D804-R808 PolarHBondContact OD1-NH2 3.12Å; R808-I909 HydrophobicContact CB-CD1 3.97Å; R808-I909 HydrophobicContact CB-CG1 4.39Å; R808-I909 WeakPolarHBondContact O-CD1 3.09Å
809	R	47.8	Very low	47.4	Very low	158 Å²	158	110.4 Å²	110.4	60%	0.596	59%	0.59	S	S	*	*			trans	47.7	86	169.5	-65.4	-173.5	179	177.9	1.5	116.8	I807 I909	I807-R809 PolarHBondContact O-N 3.04Å; R809-I909 HydrophobicContact CB-CD1 4.44Å
810	W	39.5	Very low	44.9	Very low	87 Å²	87	113.3 Å²	113.3	33%	0.33	61%	0.61	S	S	.	*			trans	-118.6	91.9	157	-70.2	112.7	0	0	0	111	P918 V919 R920	W810-P918 HydrophobicContact CH2-CB 4.19Å; W810-P918 HydrophobicContact CZ3-CB 4.08Å; W810-V919 WeakPolarHBondContact CH2-O 3.37Å; W810-R920 HydrophobicContact CE3-CG 4.43Å; W810-R920 HydrophobicContact CH2-CG 4.41Å; W810-R920 HydrophobicContact CZ3-CB 4.34Å; W810-R920 HydrophobicContact CZ3-CG 3.76Å
811	C	42.3	Very low	42.6	Very low	77 Å²	77	118.9 Å²	118.9	52%	0.52	62%	0.623	S	S	.	*			trans	-79.2	133	162	-65.1	0	0	0	0	108.7	S813	C811-S813 PolarHBondContact O-N 3.36Å
812	P	39.5	Very low	40.6	Very low	120 Å²	120	125.4 Å²	125.4	78%	0.779	64%	0.642	S	S	*	*			trans	-78.1	60.7	178.2	33.1	-35.9	0	0	0	111.7	G814	P812-G814 PolarHBondContact O-N 2.87Å
813	S	37.3	Very low	39.2	Very low	121 Å²	121	132.3 Å²	132.3	85%	0.846	67%	0.669	S	S	*	*			trans	-72.6	67.6	176	-56.7	0	0	0	0	111.1	C811	C811-S813 PolarHBondContact O-N 3.36Å
814	G	35.7	Very low	38	Very low	55 Å²	55	132.2 Å²	132.2	57%	0.567	67%	0.673	S	S	*	*	S	Bend	trans	-179.4	81.4	-174.6	0	0	0	0	0	115.6	P812	P812-G814 PolarHBondContact O-N 2.87Å
815	R	33.8	Very low	37.1	Very low	240 Å²	240	136.2 Å²	136.2	91%	0.906	69%	0.693	S	S	*	*	S	Bend	trans	55.9	85.5	155.5	-55.2	174.3	-177.2	161.5	-0.1	116.6
816	N	31.3	Very low	36.2	Very low	156 Å²	156	136.5 Å²	136.5	83%	0.834	69%	0.693	S	S	*	*			trans	177.2	46.9	137.6	-92.1	-19.9	0	0	0	114.2
817	I	33.9	Very low	35.3	Very low	163 Å²	163	141.4 Å²	141.4	84%	0.836	72%	0.722	S	S	*	*			trans	-133.2	101.5	157.7	-58.7	-179	0	0	0	107.2
818	F	27.9	Very low	34.3	Very low	193 Å²	193	140.5 Å²	140.5	85%	0.846	73%	0.726	S	S	*	*			trans	-80.5	168.5	155.7	-85.6	-96.2	0	0	0	108.7
819	I	32.2	Very low	33.5	Very low	153 Å²	153	142.6 Å²	142.6	79%	0.785	75%	0.753	S	S	*	*			trans	84.7	124.9	177.3	-54.8	169.5	0	0	0	114.1
820	L	34.1	Very low	32.5	Very low	147 Å²	147	138.3 Å²	138.3	77%	0.77	76%	0.758	S	S	*	*	S	Bend	trans	77.2	91.7	171.5	-69.4	164.7	0	0	0	120.2
821	R	30.9	Very low	32	Very low	232 Å²	232	143.2 Å²	143.2	88%	0.875	78%	0.784	S	S	*	*			trans	69.4	116.6	138.6	-70.8	-176	171.3	170.5	-2.3	120.4
822	H	26.9	Very low	31.6	Very low	179 Å²	179	146.2 Å²	146.2	83%	0.829	80%	0.795	S	S	*	*			trans	-35.9	131.9	158	-64.3	-121.1	0	0	0	114.2
823	H	31.5	Very low	31.1	Very low	189 Å²	189	147 Å²	147	88%	0.875	80%	0.796	S	S	*	*				-145.2	137.8	127.9	-101.3	-75.9	0	0	0	109.3
824	V	28.6	Very low	30.6	Very low	127 Å²	127	144.6 Å²	144.6	77%	0.77	79%	0.791	S	S	*	*			trans	-80.3	132.3	177.6	177.9	0	0	0	0	109.1
825	I	31.6	Very low	30.2	Very low	151 Å²	151	146.6 Å²	146.6	77%	0.774	80%	0.797	S	S	*	*			trans	-121.1	121.1	166.3	-60.1	-178.3	0	0	0	107.7
826	P	30.3	Very low	29.9	Very low	97 Å²	97	141.9 Å²	141.9	63%	0.63	80%	0.799	S	S	*	*			trans	-65.5	144	-176.7	-23.3	34.2	0	0	0	113.8	S828	P826-S828 PolarHBondContact O-N 3.32Å
827	S	28.7	Very low	29.8	Very low	135 Å²	135	138.1 Å²	138.1	94%	0.944	79%	0.789	S	S	*	*			trans	-87.2	75.8	171.4	-65.5	0	0	0	0	111.1
828	S	28.4	Very low	29.6	Very low	89 Å²	89	134.9 Å²	134.9	62%	0.622	79%	0.787	S	S	*	*			trans	-151	147	175.4	56.4	0	0	0	0	111.8	P826	P826-S828 PolarHBondContact O-N 3.32Å
829	S	31.7	Very low	29.8	Very low	126 Å²	126	134 Å²	134	88%	0.881	79%	0.79	S	S	*	*			trans	66.4	133	-169.6	-53	0	0	0	0	113.1
830	G	27.7	Very low	29.5	Very low	67 Å²	67	130.1 Å²	130.1	69%	0.691	79%	0.788	S	S	*	*			cis	107	120.2	15.2	0	0	0	0	0	109.6
831	Q	28.6	Very low	29.4	Very low	191 Å²	191	127.6 Å²	127.6	89%	0.893	78%	0.779	S	S	*	*			trans	57	88.4	179.8	-61.5	177.6	-43	0	0	116.3
832	L	32.5	Very low	29.4	Very low	140 Å²	140	124 Å²	124	73%	0.733	78%	0.777	S	S	*	*			trans	-134.9	79	146.4	-82.7	-175.6	0	0	0	110.5
833	V	29.3	Very low	29.6	Very low	135 Å²	135	120.1 Å²	120.1	82%	0.818	77%	0.77	S	S	*	*			trans	-63.8	161	154.5	176.5	0	0	0	0	108.3	S835	V833-S835 PolarHBondContact O-N 3.43Å; V833-S835 VanDerWaalsContact O-N 3.16Å
834	G	26.7	Very low	29.6	Very low	71 Å²	71	118.4 Å²	118.4	73%	0.732	77%	0.767	S	S	*	*	S	Bend	trans	-55.3	116.7	-167	0	0	0	0	0	115
835	S	28.5	Very low	29.7	Very low	98 Å²	98	118.1 Å²	118.1	69%	0.685	77%	0.768	S	S	*	*			trans	-158.5	106.8	157.5	-87.3	0	0	0	0	110.9	V833	V833-S835 PolarHBondContact O-N 3.43Å; V833-S835 VanDerWaalsContact O-N 3.16Å
836	C	26.8	Very low	29.8	Very low	140 Å²	140	120.6 Å²	120.6	95%	0.946	77%	0.773	S	S	*	*			trans	-117.4	41.1	153.8	-64.4	0	0	0	0	109.1
837	A	29.8	Very low	30.3	Very low	77 Å²	77	124.7 Å²	124.7	64%	0.636	78%	0.784	S	S	*	*	S	Bend	trans	-80.5	137.2	161.8	0	0	0	0	0	108.3	L839	A837-L839 PolarHBondContact O-N 3.18Å
838	A	28.6	Very low	30.6	Very low	96 Å²	96	123.8 Å²	123.8	79%	0.793	78%	0.778	S	S	*	*			trans	-74.6	110.3	-179.1	0	0	0	0	0	110.5
839	L	31.6	Very low	30.6	Very low	173 Å²	173	123.1 Å²	123.1	91%	0.906	78%	0.784	S	S	*	*			trans	-99.4	91.8	168	-79.8	170	0	0	0	109.5	A837	A837-L839 PolarHBondContact O-N 3.18Å
840	G	26.7	Very low	30.8	Very low	72 Å²	72	125.1 Å²	125.1	74%	0.742	79%	0.785	S	S	*	*			trans	-106.9	105	164.9	0	0	0	0	0	110.3
841	T	32.4	Very low	31.1	Very low	94 Å²	94	131.5 Å²	131.5	58%	0.577	80%	0.797	S	S	*	*			trans	-153.9	128.9	161.3	45.2	0	0	0	0	109.6
842	N	30.5	Very low	31.2	Very low	158 Å²	158	125.5 Å²	125.5	85%	0.845	79%	0.787	S	S	*	*			trans	18.7	138.9	141.8	-48	-7.4	0	0	0	117.9
843	S	31.4	Very low	31.2	Very low	97 Å²	97	130.7 Å²	130.7	68%	0.678	80%	0.797	S	S	*	*			cis	-166.8	143.6	36.5	52.2	0	0	0	0	113.8
844	N	31.6	Very low	31.4	Very low	153 Å²	153	133.2 Å²	133.2	82%	0.818	80%	0.799	S	S	*	*				160.6	114.9	128.5	-85.4	-5.7	0	0	0	111.4
845	P	31	Very low	32	Very low	120 Å²	120	135.1 Å²	135.1	78%	0.779	80%	0.801	S	S	*	*			trans	-93.8	124.9	171.2	33.7	-28.8	0	0	0	111.8
846	K	33.8	Very low	32.5	Very low	203 Å²	203	138.2 Å²	138.2	88%	0.883	81%	0.81	S	S	*	*			trans	-178.1	153.3	144.3	-103.9	157.3	-172.9	-178.4	0	113.3
847	Q	39.1	Very low	33	Very low	183 Å²	183	136.3 Å²	136.3	86%	0.855	80%	0.798	S	S	*	*			trans	78.9	125.4	163.7	-70.8	173.3	-13.4	0	0	121
848	S	35.6	Very low	33.4	Very low	117 Å²	117	137.7 Å²	137.7	82%	0.818	80%	0.801	S	S	*	*			trans	56.2	81.5	149.9	58.9	0	0	0	0	120.2
849	G	28.8	Very low	33.9	Very low	74 Å²	74	137.5 Å²	137.5	76%	0.763	79%	0.79	S	S	*	*				6.3	129.1	129.6	0	0	0	0	0	121.1
850	N	35.9	Very low	34.5	Very low	169 Å²	169	135.9 Å²	135.9	90%	0.904	78%	0.781	S	S	*	*				-150.5	146.2	122.8	-128.1	-33	0	0	0	110.4
851	Q	33.2	Very low	35.1	Very low	200 Å²	200	137.9 Å²	137.9	94%	0.935	77%	0.773	S	S	*	*			trans	-83.4	121.9	178.9	-63.2	-174.2	11.3	0	0	110
852	G	32.3	Very low	35.4	Very low	65 Å²	65	137.3 Å²	137.3	67%	0.67	77%	0.766	S	S	*	*			trans	-157.4	87.5	-171.4	0	0	0	0	0	115	H854	G852-H854 PolarHBondContact O-N 2.7Å
853	R	32	Very low	36	Very low	250 Å²	250	133.2 Å²	133.2	94%	0.943	76%	0.755	S	S	*	*			trans	6.7	98.2	165	-66.3	-179.3	176.3	-177.7	-1.2	115.8	S855	R853-S855 PolarHBondContact O-N 3.25Å
854	H	34.3	Very low	36.8	Very low	188 Å²	188	130.7 Å²	130.7	87%	0.87	74%	0.735	S	S	*	*			trans	-63.1	97.5	170.4	-69.9	-66.4	0	0	0	111.4	G852	G852-H854 PolarHBondContact O-N 2.7Å
855	S	38.5	Very low	37.6	Very low	111 Å²	111	128.4 Å²	128.4	78%	0.776	73%	0.727	S	S	*	*			trans	-78.4	123.1	165.8	51.8	0	0	0	0	109	R853 S857	R853-S855 PolarHBondContact O-N 3.25Å; S855-S857 PolarHBondContact O-N 3.14Å
856	N	37.9	Very low	38.4	Very low	163 Å²	163	130.5 Å²	130.5	87%	0.872	72%	0.719	S	S	*	*			trans	-68.7	89.2	-178.6	-76.2	-30.4	0	0	0	110.8
857	S	37.4	Very low	39.3	Very low	100 Å²	100	124.3 Å²	124.3	70%	0.699	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-63.6	129.4	167.3	72.6	0	0	0	0	109	S855 T859	S855-S857 PolarHBondContact O-N 3.14Å; S857-T859 PolarHBondContact O-N 3.26Å; S857-T859 VanDerWaalsContact O-N 3.16Å
858	P	38.6	Very low	40.1	Very low	106 Å²	106	126.5 Å²	126.5	69%	0.688	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-68	117	-179	26.7	-33	0	0	0	109.3
859	T	39.6	Very low	41.5	Very low	92 Å²	92	124.9 Å²	124.9	56%	0.564	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-59.9	152.6	173.3	59.8	0	0	0	0	110	S857 I861 D862	S857-T859 PolarHBondContact O-N 3.26Å; S857-T859 VanDerWaalsContact O-N 3.16Å; T859-I861 PolarHBondContact O-N 3.21Å; T859-D862 PolarHBondContact O-N 3.09Å
860	I	44.2	Very low	43.9	Very low	139 Å²	139	127.8 Å²	127.8	71%	0.713	69%	0.688	S	S	*	*	H	α-helix	trans	-54.1	-18.6	-175.2	-65.6	165.4	0	0	0	113.1	T864	I860-T864 WeakPolarHBondContact O-CG2 3.21Å; I860-T864 PolarHBondContact O-OG1 3Å
861	I	39.9	Very low	45.6	Very low	114 Å²	114	123.3 Å²	123.3	59%	0.585	67%	0.667	S	S	*	*	H	α-helix	trans	-60.9	-44.7	173.4	-57.4	171	0	0	0	112.2	T859 A863 T864 V865	T859-I861 PolarHBondContact O-N 3.21Å; I861-A863 VanDerWaalsContact C-N 3.33Å; I861-A863 PolarHBondContact O-N 2.97Å; I861-T864 WeakPolarHBondContact CA-OG1 3.47Å; I861-T864 PolarHBondContact O-N 3.11Å; I861-T864 VanDerWaalsContact O-N 3.08Å; I861-T864 PolarHBondContact O-OG1 3.1Å; I861-V865 HydrophobicContact CG2-CG2 4.1Å; I861-V865 WeakPolarHBondContact O-CG2 3.46Å; I861-V865 PolarHBondContact O-N 3.18Å; I861-V865 VanDerWaalsContact O-N 3.12Å
862	D	37.5	Very low	47.8	Very low	81 Å²	81	120.3 Å²	120.3	43%	0.433	65%	0.647	S	S	.	*	H	α-helix	trans	-73.3	-29	-169.9	-151.8	30.4	0	0	0	112	T859 T864 R866	T859-D862 PolarHBondContact O-N 3.09Å; D862-T864 VanDerWaalsContact C-N 3.34Å; D862-R866 IonicContact OD1-CZ 3.1Å; D862-R866 IonicContact OD1-NE 2.89Å; D862-R866 PolarHBondContact OD1-NE 3.41Å; D862-R866 VanDerWaalsContact OD1-NE 3.08Å; D862-R866 IonicContact OD1-NH2 2.94Å
863	A	43	Very low	50.1	Low	73 Å²	73	122.1 Å²	122.1	60%	0.603	63%	0.634	S	S	*	*	H	α-helix	trans	-73.4	-21.2	171.4	0	0	0	0	0	113.9	I861	I861-A863 VanDerWaalsContact C-N 3.33Å; I861-A863 PolarHBondContact O-N 2.97Å
864	T	48.8	Very low	52.5	Low	43 Å²	43	112 Å²	112	26%	0.264	60%	0.598	S	S	.	*	H	α-helix	trans	-102	-22	-172.7	47.1	0	0	0	0	114.4	I860 I861 D862	I860-T864 WeakPolarHBondContact O-CG2 3.21Å; I860-T864 PolarHBondContact O-OG1 3Å; I861-T864 WeakPolarHBondContact CA-OG1 3.47Å; I861-T864 PolarHBondContact O-N 3.11Å; I861-T864 VanDerWaalsContact O-N 3.08Å; I861-T864 PolarHBondContact O-OG1 3.1Å; D862-T864 VanDerWaalsContact C-N 3.34Å
865	V	48.5	Very low	55	Low	106 Å²	106	107.8 Å²	107.8	64%	0.642	59%	0.587	S	S	*	*	H	α-helix	trans	-95.5	-33.4	-177.3	179.2	0	0	0	0	113.3	I861 I867	I861-V865 HydrophobicContact CG2-CG2 4.1Å; I861-V865 WeakPolarHBondContact O-CG2 3.46Å; I861-V865 PolarHBondContact O-N 3.18Å; I861-V865 VanDerWaalsContact O-N 3.12Å; V865-I867 PolarHBondContact O-N 2.82Å
866	R	48.1	Very low	57.1	Low	164 Å²	164	105.5 Å²	105.5	62%	0.619	56%	0.562	S	S	*	*			trans	-100.5	63.2	-171.9	-59.9	-171.5	-163.9	-143.1	-1.1	114	D862 R868	D862-R866 IonicContact OD1-CZ 3.1Å; D862-R866 IonicContact OD1-NE 2.89Å; D862-R866 PolarHBondContact OD1-NE 3.41Å; D862-R866 VanDerWaalsContact OD1-NE 3.08Å; D862-R866 IonicContact OD1-NH2 2.94Å; R866-R868 WeakPolarHBondContact O-CG 3.49Å; R866-R868 PolarHBondContact O-N 2.93Å
867	I	52.4	Low	59.3	Low	73 Å²	73	102 Å²	102	37%	0.374	55%	0.547	S	S	.	.			trans	-66.7	101.6	169.2	-48.7	-179.6	0	0	0	108.9	V865 C869 V871	V865-I867 PolarHBondContact O-N 2.82Å; I867-C869 VanDerWaalsContact CG2-O 3.28Å; I867-C869 WeakPolarHBondContact CG2-O 3.36Å; I867-C869 PolarHBondContact O-N 3.09Å; I867-V871 HydrophobicContact CG2-CG2 3.57Å
868	R	56.7	Low	61.4	Low	229 Å²	229	100.9 Å²	100.9	86%	0.864	53%	0.53	S	S	*	.			trans	-81.2	8.1	-176.2	-55.4	-170.2	-170.7	-174.5	3.8	114.4	R866	R866-R868 WeakPolarHBondContact O-CG 3.49Å; R866-R868 PolarHBondContact O-N 2.93Å
869	C	64.8	Low	63.4	Low	83 Å²	83	99.5 Å²	99.5	56%	0.561	52%	0.517	S	S	*	.	S	Bend	trans	-147.7	162.8	-172	57.2	0	0	0	0	112.5	I867	I867-C869 VanDerWaalsContact CG2-O 3.28Å; I867-C869 WeakPolarHBondContact CG2-O 3.36Å; I867-C869 PolarHBondContact O-N 3.09Å
870	P	78.7	Confident	65.1	Low	134 Å²	134	102 Å²	102	87%	0.87	53%	0.525	S	S	*	.			trans	-64.4	140.4	171.6	-20.4	33.6	0	0	0	112.3
871	V	71.5	Confident	66.6	Low	76 Å²	76	101.4 Å²	101.4	46%	0.461	52%	0.518	S	S	.	.			trans	-134.5	129.6	-179.9	170.9	0	0	0	0	110.4	I867	I867-V871 HydrophobicContact CG2-CG2 3.57Å
872	R	79	Confident	68.4	Low	137 Å²	137	103.8 Å²	103.8	52%	0.517	52%	0.519	S	S	.	.			trans	-63.4	133.3	173.6	179	176.7	170.9	-173.3	-9.3	110	A921 D925	R872-A921 HydrophobicContact CG-CB 4.32Å; R872-A921 PolarHBondContact NE-O 3.35Å; R872-A921 PolarHBondContact NH2-O 2.88Å; R872-D925 IonicContact CZ-OD2 3.45Å; R872-D925 IonicContact NH1-OD2 2.67Å; R872-D925 PolarHBondContact NH1-OD2 2.65Å; R872-D925 VanDerWaalsContact NH1-OD2 3.12Å; R872-D925 IonicContact NH2-OD1 3.91Å; R872-D925 PolarHBondContact NH2-OD1 3.27Å; R872-D925 IonicContact NH2-OD2 2.7Å; R872-D925 PolarHBondContact NH2-OD2 2.83Å
873	R	80.4	Confident	70	Confident	103 Å²	103	108.8 Å²	108.8	39%	0.389	53%	0.532	S	S	.	.			trans	-127.1	165.3	172.1	-62.2	-175.3	-176.7	-177.5	-1	109.5	C805 G806	C805-R873 PolarHBondContact O-NH1 3.19Å; G806-R873 VanDerWaalsContact O-CZ 3.22Å; G806-R873 PolarHBondContact O-NH1 3.22Å; G806-R873 VanDerWaalsContact O-NH1 3.11Å
874	L	82.7	Confident	71.1	Confident	38 Å²	38	106.2 Å²	106.2	20%	0.199	51%	0.513	C	S	.	.			trans	-71.6	147.1	168.3	-60.9	-179.6	0	0	0	109.7	H906 Y910 A921 F924	L874-H906 HydrophobicContact CB-CB 3.94Å; L874-H906 HydrophobicContact CD1-CB 3.78Å; L874-Y910 HydrophobicContact CD1-CD2 4.38Å; L874-Y910 HydrophobicContact CD1-CE2 4.43Å; L874-A921 HydrophobicContact CD2-CB 4.08Å; L874-A921 HydrophobicContact CG-CB 4.14Å; L874-F924 HydrophobicContact CD1-CD1 4.23Å; L874-F924 HydrophobicContact CD1-CD2 3.82Å; L874-F924 HydrophobicContact CD1-CE1 4.33Å; L874-F924 HydrophobicContact CD1-CE2 3.94Å; L874-F924 HydrophobicContact CD1-CG 3.97Å; L874-F924 HydrophobicContact CD1-CZ 4.19Å; L874-F924 HydrophobicContact CD2-CB 3.82Å; L874-F924 HydrophobicContact CD2-CD1 3.72Å; L874-F924 HydrophobicContact CD2-CD2 4.42Å; L874-F924 HydrophobicContact CD2-CE1 4.39Å; L874-F924 HydrophobicContact CD2-CG 3.73Å
875	P	85.9	Confident	71.6	Confident	98 Å²	98	105.6 Å²	105.6	64%	0.636	51%	0.512	S	S	*	.			trans	-68.1	136.5	176.7	28.1	-34.1	0	0	0	110.9	G905 H906	P875-G905 WeakPolarHBondContact O-CA 3.18Å; P875-H906 PolarHBondContact O-N 2.87Å
876	Y	83.3	Confident	71.9	Confident	63 Å²	63	106.4 Å²	106.4	25%	0.247	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	136.3	177	177.9	-117.2	0	0	0	109	H878 V903 T904 N907	Y876-H878 HydrophobicContact CE1-CB 3.88Å; Y876-V903 HydrophobicContact CD2-CG1 4.49Å; Y876-V903 HydrophobicContact CE2-CG1 3.55Å; Y876-T904 WeakPolarHBondContact CA-O 3.46Å; Y876-T904 WeakPolarHBondContact CD2-O 3.39Å; Y876-N907 HydrophobicContact CD2-CB 3.84Å; Y876-N907 HydrophobicContact CE2-CB 3.43Å; Y876-N907 VanDerWaalsContact CE2-CB 3.43Å; Y876-N907 PolarHBondContact OH-ND2 3.49Å
877	T	84.6	Confident	72	Confident	91 Å²	91	106.3 Å²	106.3	56%	0.558	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	136.5	176.1	-57.3	0	0	0	0	109.3	V903 T904	T877-V903 WeakPolarHBondContact O-CA 3.35Å; T877-T904 PolarHBondContact N-O 2.92Å; T877-T904 PolarHBondContact O-N 2.87Å
878	H	80.7	Confident	71.8	Confident	75 Å²	75	107.4 Å²	107.4	35%	0.347	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	113.4	-175	179.8	-157.7	0	0	0	109.2	Y876 I880 P901 V903	Y876-H878 HydrophobicContact CE1-CB 3.88Å; H878-I880 PolarHBondContact O-N 2.77Å; H878-P901 WeakPolarHBondContact NE2-CB 3.32Å; H878-V903 HydrophobicContact CB-CG2 4.45Å
879	L	80.8	Confident	71.1	Confident	78 Å²	78	99 Å²	99	41%	0.408	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	103.5	173.7	-177.1	63.9	0	0	0	109.5	W882 M902	L879-W882 HydrophobicContact CD2-CB 4.39Å; L879-M902 HydrophobicContact CB-CB 4Å; L879-M902 HydrophobicContact CD2-CB 4.24Å; L879-M902 HydrophobicContact CD2-CG 4.35Å; L879-M902 HydrophobicContact CD2-SD 4.21Å; L879-M902 PolarHBondContact N-O 2.81Å
880	I	76.5	Confident	70.4	Confident	143 Å²	143	103.4 Å²	103.4	73%	0.733	53%	0.526	S	S	*	.			trans	-84.1	-31.2	-177.4	-62.4	168.9	0	0	0	111.9	H878	H878-I880 PolarHBondContact O-N 2.77Å
881	F	75	Confident	68.9	Low	127 Å²	127	103.6 Å²	103.6	56%	0.557	52%	0.515	S	S	*	.			trans	-155.8	143.3	-176.6	176.1	-104.3	0	0	0	112.2	R883 E886	F881-R883 HydrophobicContact CE1-CG 3.62Å; F881-R883 HydrophobicContact CZ-CG 3.74Å; F881-E886 VanDerWaalsContact CZ-OE1 3.3Å; F881-E886 WeakPolarHBondContact CZ-OE1 3.38Å
882	W	77.2	Confident	67.9	Low	165 Å²	165	107.4 Å²	107.4	63%	0.625	53%	0.532	S	S	*	.			trans	-152.2	124.7	171.9	172.7	70	0	0	0	110.5	L879 G884 A885	L879-W882 HydrophobicContact CD2-CB 4.39Å; W882-G884 VanDerWaalsContact C-N 3.26Å; W882-G884 VanDerWaalsContact CZ3-C 3.47Å; W882-G884 PolarHBondContact O-N 3.11Å; W882-G884 VanDerWaalsContact O-N 3.16Å; W882-A885 WeakPolarHBondContact O-CB 3.34Å; W882-A885 PolarHBondContact O-N 2.9Å
883	R	71.8	Confident	66.5	Low	186 Å²	186	107.3 Å²	107.3	70%	0.702	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-61	-25	-172.5	-69.2	-171.8	179.7	103	2.2	115.3	F881 A885 E886	F881-R883 HydrophobicContact CE1-CG 3.62Å; F881-R883 HydrophobicContact CZ-CG 3.74Å; R883-A885 PolarHBondContact O-N 3.25Å; R883-A885 VanDerWaalsContact O-N 3.09Å; R883-E886 WeakPolarHBondContact O-CB 3.28Å; R883-E886 PolarHBondContact O-N 2.78Å
884	G	66.1	Low	64.8	Low	19 Å²	19	105.8 Å²	105.8	20%	0.196	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-63.3	-16.6	179.9	0	0	0	0	0	114	W882 E886	W882-G884 VanDerWaalsContact C-N 3.26Å; W882-G884 VanDerWaalsContact CZ3-C 3.47Å; W882-G884 PolarHBondContact O-N 3.11Å; W882-G884 VanDerWaalsContact O-N 3.16Å; G884-E886 VanDerWaalsContact C-N 3.32Å
885	A	59.4	Low	63.2	Low	29 Å²	29	109 Å²	109	24%	0.24	56%	0.564	C	S	.	*	G	3₁₀ helix	trans	-66.1	-32	171.4	0	0	0	0	0	113	W882 R883 L887 S888 V899	W882-A885 WeakPolarHBondContact O-CB 3.34Å; W882-A885 PolarHBondContact O-N 2.9Å; R883-A885 PolarHBondContact O-N 3.25Å; R883-A885 VanDerWaalsContact O-N 3.09Å; A885-L887 PolarHBondContact O-N 2.99Å; A885-S888 WeakPolarHBondContact O-CB 3.49Å; A885-S888 PolarHBondContact O-N 3.08Å; A885-S888 VanDerWaalsContact O-N 3.1Å; A885-V899 HydrophobicContact CB-CG2 3.6Å
886	E	53.8	Low	61.2	Low	124 Å²	124	109.5 Å²	109.5	58%	0.579	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-66.4	-21.3	-177.1	-59.8	170.3	165.2	0	0	112.3	F881 R883 G884 S888	F881-E886 VanDerWaalsContact CZ-OE1 3.3Å; F881-E886 WeakPolarHBondContact CZ-OE1 3.38Å; R883-E886 WeakPolarHBondContact O-CB 3.28Å; R883-E886 PolarHBondContact O-N 2.78Å; G884-E886 VanDerWaalsContact C-N 3.32Å; E886-S888 VanDerWaalsContact C-N 3.35Å
887	L	51.8	Low	59.3	Low	162 Å²	162	111 Å²	111	85%	0.848	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-86.2	-1.1	177.3	-67.4	168.8	0	0	0	113.9	A885	A885-L887 PolarHBondContact O-N 2.99Å
888	S	47.2	Very low	57.7	Low	96 Å²	96	110.6 Å²	110.6	67%	0.671	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-104.9	-1.7	-174.1	-54.8	0	0	0	0	113.6	A885 E886	A885-S888 WeakPolarHBondContact O-CB 3.49Å; A885-S888 PolarHBondContact O-N 3.08Å; A885-S888 VanDerWaalsContact O-N 3.1Å; E886-S888 VanDerWaalsContact C-N 3.35Å
889	T	41.7	Very low	56.4	Low	53 Å²	53	111.3 Å²	111.3	33%	0.325	59%	0.588	S	S	.	*			trans	-153.5	93.6	-164.7	-49	0	0	0	0	111.8	Q891 L897	T889-Q891 HydrophobicContact CG2-CB 4.07Å; T889-Q891 WeakPolarHBondContact CG2-O 3.39Å; T889-Q891 PolarHBondContact O-N 2.85Å; T889-L897 HydrophobicContact CG2-CD1 3.53Å
890	D	49.9	Very low	55.2	Low	174 Å²	174	118.4 Å²	118.4	93%	0.93	61%	0.609	S	S	*	*	S	Bend	trans	-65.6	-14	170.4	-69.4	-51.7	0	0	0	113	L892	D890-L892 PolarHBondContact O-N 2.91Å
891	Q	48.4	Very low	54.5	Low	139 Å²	139	114.9 Å²	114.9	65%	0.65	60%	0.595	S	S	*	*			trans	-84.9	86.8	171.8	-68.8	-178.8	-9	0	0	111.6	T889	T889-Q891 HydrophobicContact CG2-CB 4.07Å; T889-Q891 WeakPolarHBondContact CG2-O 3.39Å; T889-Q891 PolarHBondContact O-N 2.85Å
892	L	49.3	Very low	54.2	Low	155 Å²	155	114.9 Å²	114.9	81%	0.812	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	142.3	150.9	-84.9	83.3	0	0	0	108.8	D890	D890-L892 PolarHBondContact O-N 2.91Å
893	L	50.6	Low	54.3	Low	136 Å²	136	110.3 Å²	110.3	71%	0.712	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	102.6	-6.7	167.8	-56.8	164.3	0	0	0	119.5	P895	L893-P895 WeakPolarHBondContact O-CD 3.4Å
894	D	44.1	Very low	54.8	Low	70 Å²	70	105.8 Å²	105.8	37%	0.374	58%	0.582	S	S	.	*			trans	-88.1	108.9	171.9	-166.1	-17.4	0	0	0	112.8	T896 L897	D894-T896 PolarHBondContact O-N 2.8Å; D894-T896 VanDerWaalsContact OD1-CB 3.3Å; D894-T896 WeakPolarHBondContact OD1-CB 3.44Å; D894-T896 WeakPolarHBondContact OD1-CG2 3.46Å; D894-T896 PolarHBondContact OD1-N 2.8Å; D894-T896 PolarHBondContact OD1-OG1 3.5Å; D894-T896 PolarHBondContact OD2-OG1 3.05Å; D894-L897 HydrophobicContact CB-CD1 4.32Å; D894-L897 HydrophobicContact CB-CG 4.33Å; D894-L897 PolarHBondContact O-N 3.44Å
895	P	49.6	Very low	55.7	Low	107 Å²	107	107.2 Å²	107.2	70%	0.695	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-72	-11.2	177	32.7	-37.4	0	0	0	114.1	L893 L897 S898	L893-P895 WeakPolarHBondContact O-CD 3.4Å; P895-L897 VanDerWaalsContact C-N 3.27Å; P895-S898 PolarHBondContact O-N 2.94Å
896	T	42.8	Very low	56.9	Low	107 Å²	107	109.1 Å²	109.1	66%	0.656	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-70.3	-26.3	174	71.8	0	0	0	0	112	D894 S898	D894-T896 PolarHBondContact O-N 2.8Å; D894-T896 VanDerWaalsContact OD1-CB 3.3Å; D894-T896 WeakPolarHBondContact OD1-CB 3.44Å; D894-T896 WeakPolarHBondContact OD1-CG2 3.46Å; D894-T896 PolarHBondContact OD1-N 2.8Å; D894-T896 PolarHBondContact OD1-OG1 3.5Å; D894-T896 PolarHBondContact OD2-OG1 3.05Å; T896-S898 PolarHBondContact O-N 3.34Å; T896-S898 VanDerWaalsContact O-N 3.1Å
897	L	44.2	Very low	58.1	Low	94 Å²	94	106 Å²	106	49%	0.492	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-79.6	22.5	176	-61.7	-179.5	0	0	0	113.5	T889 D894 P895 V899	T889-L897 HydrophobicContact CG2-CD1 3.53Å; D894-L897 HydrophobicContact CB-CD1 4.32Å; D894-L897 HydrophobicContact CB-CG 4.33Å; D894-L897 PolarHBondContact O-N 3.44Å; P895-L897 VanDerWaalsContact C-N 3.27Å; L897-V899 PolarHBondContact O-N 3.41Å; L897-V899 VanDerWaalsContact O-N 3.12Å
898	S	51.5	Low	59.4	Low	83 Å²	83	107.1 Å²	107.1	58%	0.58	58%	0.58	S	S	*	*			trans	-56.3	119.2	162.9	71	0	0	0	0	109.2	P895 T896 R900	P895-S898 PolarHBondContact O-N 2.94Å; T896-S898 PolarHBondContact O-N 3.34Å; T896-S898 VanDerWaalsContact O-N 3.1Å; S898-R900 PolarHBondContact O-N 2.73Å
899	V	52.6	Low	61	Low	91 Å²	91	104.6 Å²	104.6	55%	0.552	56%	0.559	S	S	*	*			trans	-56.7	108.3	172.3	175.9	0	0	0	0	107.3	A885 L897 P901	A885-V899 HydrophobicContact CB-CG2 3.6Å; L897-V899 PolarHBondContact O-N 3.41Å; L897-V899 VanDerWaalsContact O-N 3.12Å; V899-P901 WeakPolarHBondContact O-CD 3.49Å
900	R	55.5	Low	63	Low	227 Å²	227	105.9 Å²	105.9	86%	0.857	56%	0.558	S	S	*	*			trans	-49.9	113.1	-170.1	-174.4	178.9	-174	174	3.9	108.9	S898 M902	S898-R900 PolarHBondContact O-N 2.73Å; R900-M902 PolarHBondContact O-N 2.82Å; R900-M902 VanDerWaalsContact O-N 3.11Å
901	P	63	Low	64.7	Low	68 Å²	68	103.5 Å²	103.5	44%	0.442	54%	0.537	S	S	.	.			trans	-55.5	121.3	-159.7	-30.7	34.4	0	0	0	112.2	H878 V899 V903	H878-P901 WeakPolarHBondContact NE2-CB 3.32Å; V899-P901 WeakPolarHBondContact O-CD 3.49Å; P901-V903 HydrophobicContact CB-CG2 4.38Å; P901-V903 PolarHBondContact O-N 2.73Å
902	M	68.4	Low	66.3	Low	128 Å²	128	98.5 Å²	98.5	63%	0.631	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	103.2	-176.9	-61.4	-168.9	78.3	0	0	108.4	L879 R900	L879-M902 HydrophobicContact CB-CB 4Å; L879-M902 HydrophobicContact CD2-CB 4.24Å; L879-M902 HydrophobicContact CD2-CG 4.35Å; L879-M902 HydrophobicContact CD2-SD 4.21Å; L879-M902 PolarHBondContact N-O 2.81Å; R900-M902 PolarHBondContact O-N 2.82Å; R900-M902 VanDerWaalsContact O-N 3.11Å
903	V	77.6	Confident	67.9	Low	69 Å²	69	95.5 Å²	95.5	42%	0.418	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.4	-173.2	162.9	0	0	0	0	109.6	Y876 T877 H878 P901	Y876-V903 HydrophobicContact CD2-CG1 4.49Å; Y876-V903 HydrophobicContact CE2-CG1 3.55Å; T877-V903 WeakPolarHBondContact O-CA 3.35Å; H878-V903 HydrophobicContact CB-CG2 4.45Å; P901-V903 HydrophobicContact CB-CG2 4.38Å; P901-V903 PolarHBondContact O-N 2.73Å
904	T	84.1	Confident	69.1	Low	91 Å²	91	97.9 Å²	97.9	56%	0.558	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	148.3	174.1	62.3	0	0	0	0	111.3	Y876 T877	Y876-T904 WeakPolarHBondContact CA-O 3.46Å; Y876-T904 WeakPolarHBondContact CD2-O 3.39Å; T877-T904 PolarHBondContact N-O 2.92Å; T877-T904 PolarHBondContact O-N 2.87Å
905	G	84.6	Confident	71	Confident	48 Å²	48	98.1 Å²	98.1	50%	0.495	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	87.5	-157.9	-176.1	0	0	0	0	0	114.2	P875	P875-G905 WeakPolarHBondContact O-CA 3.18Å
906	H	84	Confident	72.7	Confident	69 Å²	69	97.6 Å²	97.6	32%	0.319	50%	0.504	S	S	.	.			trans	-110.7	98.5	-160.2	-58.7	100.6	0	0	0	113	L874 P875 Y910 F924	L874-H906 HydrophobicContact CB-CB 3.94Å; L874-H906 HydrophobicContact CD1-CB 3.78Å; P875-H906 PolarHBondContact O-N 2.87Å; H906-Y910 HydrophobicContact CB-CE2 4.25Å; H906-F924 AromaticContact CD2-CZ 3.69Å; H906-F924 AromaticContact CE1-CE1 3.84Å; H906-F924 AromaticContact NE2-CE1 3.66Å; H906-F924 AromaticContact NE2-CZ 3.63Å
907	N	78.5	Confident	74.5	Confident	60 Å²	60	98.2 Å²	98.2	32%	0.321	50%	0.5	S	S	.	.			trans	-99.7	31.1	-178.2	-157.7	24.1	0	0	0	115.2	D804 Y876	D804-N907 PolarHBondContact OD2-ND2 3.13Å; Y876-N907 HydrophobicContact CD2-CB 3.84Å; Y876-N907 HydrophobicContact CE2-CB 3.43Å; Y876-N907 VanDerWaalsContact CE2-CB 3.43Å; Y876-N907 PolarHBondContact OH-ND2 3.49Å
908	R	79.8	Confident	76.2	Confident	185 Å²	185	96.3 Å²	96.3	70%	0.698	49%	0.493	S	S	*	.	S	Bend	trans	-143.3	155.5	178.3	67	179.8	65.5	-172.3	-0.3	112.2	Y910	R908-Y910 HydrophobicContact CG-CD2 4.05Å; R908-Y910 HydrophobicContact CG-CE1 4.16Å; R908-Y910 HydrophobicContact CG-CE2 3.45Å; R908-Y910 VanDerWaalsContact CG-CE2 3.45Å; R908-Y910 VanDerWaalsContact O-CD2 3.27Å; R908-Y910 WeakPolarHBondContact O-CD2 3.28Å; R908-Y910 WeakPolarHBondContact O-CE2 3.32Å
909	I	80.8	Confident	77.6	Confident	42 Å²	42	93.3 Å²	93.3	22%	0.215	47%	0.471	C	S	.	.			trans	-73.5	129.7	164.8	-57.4	178.1	0	0	0	107.4	R808 R809 Y911 P918	R808-I909 HydrophobicContact CB-CD1 3.97Å; R808-I909 HydrophobicContact CB-CG1 4.39Å; R808-I909 WeakPolarHBondContact O-CD1 3.09Å; R809-I909 HydrophobicContact CB-CD1 4.44Å; I909-Y911 HydrophobicContact CB-CE2 4.04Å; I909-Y911 HydrophobicContact CG2-CD2 4.28Å; I909-Y911 HydrophobicContact CG2-CE1 4.04Å; I909-Y911 HydrophobicContact CG2-CE2 3.71Å; I909-P918 HydrophobicContact CG2-CB 3.95Å; I909-P918 HydrophobicContact CG2-CG 4.44Å
910	Y	84	Confident	78.9	Confident	80 Å²	80	94.9 Å²	94.9	31%	0.314	47%	0.467	S	S	.	.			trans	-99.4	152.4	170.2	-66.4	-97.5	0	0	0	108.9	L874 H906 R908 P918 V919 F924	L874-Y910 HydrophobicContact CD1-CD2 4.38Å; L874-Y910 HydrophobicContact CD1-CE2 4.43Å; H906-Y910 HydrophobicContact CB-CE2 4.25Å; R908-Y910 HydrophobicContact CG-CD2 4.05Å; R908-Y910 HydrophobicContact CG-CE1 4.16Å; R908-Y910 HydrophobicContact CG-CE2 3.45Å; R908-Y910 VanDerWaalsContact CG-CE2 3.45Å; R908-Y910 VanDerWaalsContact O-CD2 3.27Å; R908-Y910 WeakPolarHBondContact O-CD2 3.28Å; R908-Y910 WeakPolarHBondContact O-CE2 3.32Å; Y910-P918 CarbonylContact O-C 3.54Å; Y910-P918 WeakPolarHBondContact O-CA 3.04Å; Y910-V919 PolarHBondContact O-N 2.84Å; Y910-F924 AromaticContact CD1-CE2 3.99Å; Y910-F924 HydrophobicContact CD1-CE2 3.99Å; Y910-F924 HydrophobicContact CD2-CD2 4.27Å; Y910-F924 AromaticContact CD2-CE2 3.6Å; Y910-F924 HydrophobicContact CD2-CE2 3.6Å; Y910-F924 HydrophobicContact CD2-CZ 4.47Å; Y910-F924 HydrophobicContact CE1-CE2 4.19Å; Y910-F924 AromaticContact CE2-CE2 3.83Å; Y910-F924 HydrophobicContact CE2-CE2 3.83Å; Y910-F924 HydrophobicContact CE2-CZ 4.27Å; Y910-F924 HydrophobicContact CG-CD2 4.35Å; Y910-F924 AromaticContact CG-CE2 3.7Å; Y910-F924 HydrophobicContact CG-CE2 3.7Å
911	Y	85.4	Confident	80.2	Confident	124 Å²	124	84.5 Å²	84.5	49%	0.486	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-128.2	137.7	-176.6	-63.1	-92.9	0	0	0	110.1	I909 T913 S916 Q917 P918	I909-Y911 HydrophobicContact CB-CE2 4.04Å; I909-Y911 HydrophobicContact CG2-CD2 4.28Å; I909-Y911 HydrophobicContact CG2-CE1 4.04Å; I909-Y911 HydrophobicContact CG2-CE2 3.71Å; Y911-T913 PolarHBondContact O-N 3.36Å; Y911-S916 WeakPolarHBondContact CD1-O 3.44Å; Y911-Q917 CarbonylContact C-O 3.59Å; Y911-Q917 VanDerWaalsContact CA-O 3.28Å; Y911-Q917 WeakPolarHBondContact CA-O 3.37Å; Y911-P918 HydrophobicContact CD1-CG 4.24Å; Y911-P918 HydrophobicContact CE1-CG 3.93Å
912	H	82.5	Confident	81.1	Confident	34 Å²	34	84.4 Å²	84.4	16%	0.157	43%	0.43	C	S	.	.			trans	-64.3	117	176.1	-74.4	-76.3	0	0	0	109.5	R914 T915 S916 Q917 V919 E923	H912-R914 PolarHBondContact O-N 3.31Å; H912-R914 VanDerWaalsContact O-N 3.11Å; H912-T915 WeakPolarHBondContact CB-OG1 3.46Å; H912-T915 PolarHBondContact O-N 2.88Å; H912-S916 PolarHBondContact O-N 2.9Å; H912-Q917 PolarHBondContact CD2-O 3.36Å; H912-Q917 PolarHBondContact N-O 3.48Å; H912-V919 HydrophobicContact CB-CG2 4.45Å; H912-E923 IonicContact CE1-OE2 3.74Å; H912-E923 IonicContact NE2-OE2 3.25Å; H912-E923 PolarHBondContact NE2-OE2 2.93Å
913	T	81.7	Confident	81.7	Confident	93 Å²	93	80.5 Å²	80.5	57%	0.571	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-36.8	-170.4	-48.5	0	0	0	0	113.2	Y911 E929	Y911-T913 PolarHBondContact O-N 3.36Å; T913-E929 WeakPolarHBondContact CB-OE1 3.42Å; T913-E929 WeakPolarHBondContact CG2-OE1 3.39Å; T913-E929 PolarHBondContact OG1-OE1 2.87Å
914	R	75.8	Confident	82	Confident	185 Å²	185	80.3 Å²	80.3	70%	0.698	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-21.8	-179.5	-72.3	176.9	52.6	63.1	-1.1	114.8	H912	H912-R914 PolarHBondContact O-N 3.31Å; H912-R914 VanDerWaalsContact O-N 3.11Å
915	T	84	Confident	81.7	Confident	76 Å²	76	81.1 Å²	81.1	47%	0.466	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	-10.5	-171.8	65.7	0	0	0	0	114.5	H912 Q917	H912-T915 WeakPolarHBondContact CB-OG1 3.46Å; H912-T915 PolarHBondContact O-N 2.88Å; T915-Q917 PolarHBondContact O-N 2.94Å; T915-Q917 VanDerWaalsContact O-N 3.16Å; T915-Q917 WeakPolarHBondContact OG1-CB 3.49Å; T915-Q917 PolarHBondContact OG1-N 3.3Å
916	S	85.2	Confident	81.1	Confident	95 Å²	95	84.1 Å²	84.1	66%	0.664	41%	0.413	S	S	*	.			trans	53.9	22.1	-169.3	-56.9	0	0	0	0	114.5	Y911 H912	Y911-S916 WeakPolarHBondContact CD1-O 3.44Å; H912-S916 PolarHBondContact O-N 2.9Å
917	Q	80.5	Confident	80.4	Confident	121 Å²	121	85.9 Å²	85.9	57%	0.565	43%	0.425	S	S	*	.			trans	-91.7	147.4	177.6	-65.9	178.2	-7.7	0	0	111.5	Y911 H912 T915 V919	Y911-Q917 CarbonylContact C-O 3.59Å; Y911-Q917 VanDerWaalsContact CA-O 3.28Å; Y911-Q917 WeakPolarHBondContact CA-O 3.37Å; H912-Q917 PolarHBondContact CD2-O 3.36Å; H912-Q917 PolarHBondContact N-O 3.48Å; T915-Q917 PolarHBondContact O-N 2.94Å; T915-Q917 VanDerWaalsContact O-N 3.16Å; T915-Q917 WeakPolarHBondContact OG1-CB 3.49Å; T915-Q917 PolarHBondContact OG1-N 3.3Å; Q917-V919 PolarHBondContact O-N 3.23Å
918	P	81.6	Confident	79.8	Confident	54 Å²	54	84.8 Å²	84.8	35%	0.351	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-60	129	179	-24.9	34.7	0	0	0	113.7	W810 I909 Y910 Y911 R920	W810-P918 HydrophobicContact CH2-CB 4.19Å; W810-P918 HydrophobicContact CZ3-CB 4.08Å; I909-P918 HydrophobicContact CG2-CB 3.95Å; I909-P918 HydrophobicContact CG2-CG 4.44Å; Y910-P918 CarbonylContact O-C 3.54Å; Y910-P918 WeakPolarHBondContact O-CA 3.04Å; Y911-P918 HydrophobicContact CD1-CG 4.24Å; Y911-P918 HydrophobicContact CE1-CG 3.93Å; P918-R920 PolarHBondContact O-N 2.93Å
919	V	80.3	Confident	79.1	Confident	20 Å²	20	81.8 Å²	81.8	12%	0.121	42%	0.416	C	S	.	.			trans	-75.4	114.6	177.4	-177.8	0	0	0	0	109.7	W810 Y910 H912 Q917 E923 F924	W810-V919 WeakPolarHBondContact CH2-O 3.37Å; Y910-V919 PolarHBondContact O-N 2.84Å; H912-V919 HydrophobicContact CB-CG2 4.45Å; Q917-V919 PolarHBondContact O-N 3.23Å; V919-E923 HydrophobicContact CG1-CB 3.98Å; V919-F924 HydrophobicContact CG1-CB 4.24Å; V919-F924 HydrophobicContact CG1-CD2 4.33Å
920	R	79.9	Confident	78.4	Confident	124 Å²	124	82.1 Å²	82.1	47%	0.468	43%	0.425	S	S	.	.			trans	-64.5	150.6	-179.3	-65	-174.3	-69	159.3	2	111	W810 P918 C922 E923 F924	W810-R920 HydrophobicContact CE3-CG 4.43Å; W810-R920 HydrophobicContact CH2-CG 4.41Å; W810-R920 HydrophobicContact CZ3-CB 4.34Å; W810-R920 HydrophobicContact CZ3-CG 3.76Å; P918-R920 PolarHBondContact O-N 2.93Å; R920-C922 PolarHBondContact O-N 3.41Å; R920-E923 HydrophobicContact CB-CB 4.36Å; R920-E923 HydrophobicContact CB-CG 4.03Å; R920-E923 WeakPolarHBondContact CB-OE2 3.39Å; R920-E923 IonicContact CZ-OE1 2.9Å; R920-E923 PolarHBondContact N-OE2 2.97Å; R920-E923 VanDerWaalsContact NE-CD 3.34Å; R920-E923 IonicContact NE-OE1 3.95Å; R920-E923 PolarHBondContact NE-OE1 3.29Å; R920-E923 IonicContact NE-OE2 2.95Å; R920-E923 IonicContact NH2-OE1 3.48Å; R920-E923 PolarHBondContact NH2-OE1 3.35Å; R920-E923 WeakPolarHBondContact O-CA 3.2Å; R920-E923 WeakPolarHBondContact O-CB 3.34Å; R920-E923 PolarHBondContact O-N 2.92Å; R920-F924 PolarHBondContact O-N 3.47Å
921	A	82.9	Confident	77.4	Confident	8 Å²	8	83.8 Å²	83.8	7%	0.066	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-8	177.9	0	0	0	0	0	114.6	R872 L874	R872-A921 HydrophobicContact CG-CB 4.32Å; R872-A921 PolarHBondContact NE-O 3.35Å; R872-A921 PolarHBondContact NH2-O 2.88Å; L874-A921 HydrophobicContact CD2-CB 4.08Å; L874-A921 HydrophobicContact CG-CB 4.14Å
922	C	80.7	Confident	76.2	Confident	66 Å²	66	80.6 Å²	80.6	45%	0.446	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-8.8	170	55.2	0	0	0	0	114.5	R920	R920-C922 PolarHBondContact O-N 3.41Å
923	E	82.1	Confident	75.4	Confident	47 Å²	47	79.6 Å²	79.6	22%	0.22	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-25.6	173.7	-68.6	166.6	173.4	0	0	111.5	H912 V919 R920 D925 V926	H912-E923 IonicContact CE1-OE2 3.74Å; H912-E923 IonicContact NE2-OE2 3.25Å; H912-E923 PolarHBondContact NE2-OE2 2.93Å; V919-E923 HydrophobicContact CG1-CB 3.98Å; R920-E923 HydrophobicContact CB-CB 4.36Å; R920-E923 HydrophobicContact CB-CG 4.03Å; R920-E923 WeakPolarHBondContact CB-OE2 3.39Å; R920-E923 IonicContact CZ-OE1 2.9Å; R920-E923 PolarHBondContact N-OE2 2.97Å; R920-E923 VanDerWaalsContact NE-CD 3.34Å; R920-E923 IonicContact NE-OE1 3.95Å; R920-E923 PolarHBondContact NE-OE1 3.29Å; R920-E923 IonicContact NE-OE2 2.95Å; R920-E923 IonicContact NH2-OE1 3.48Å; R920-E923 PolarHBondContact NH2-OE1 3.35Å; R920-E923 WeakPolarHBondContact O-CA 3.2Å; R920-E923 WeakPolarHBondContact O-CB 3.34Å; R920-E923 PolarHBondContact O-N 2.92Å; E923-D925 PolarHBondContact O-N 2.86Å; E923-V926 WeakPolarHBondContact O-CA 3.3Å; E923-V926 PolarHBondContact O-N 3.11Å; E923-V926 VanDerWaalsContact O-O 3.06Å
924	F	83.1	Confident	75	Confident	64 Å²	64	76.8 Å²	76.8	28%	0.281	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-21.9	-176.6	-167.7	-95.8	0	0	0	115.1	L874 H906 Y910 V919 R920 V926	L874-F924 HydrophobicContact CD1-CD1 4.23Å; L874-F924 HydrophobicContact CD1-CD2 3.82Å; L874-F924 HydrophobicContact CD1-CE1 4.33Å; L874-F924 HydrophobicContact CD1-CE2 3.94Å; L874-F924 HydrophobicContact CD1-CG 3.97Å; L874-F924 HydrophobicContact CD1-CZ 4.19Å; L874-F924 HydrophobicContact CD2-CB 3.82Å; L874-F924 HydrophobicContact CD2-CD1 3.72Å; L874-F924 HydrophobicContact CD2-CD2 4.42Å; L874-F924 HydrophobicContact CD2-CE1 4.39Å; L874-F924 HydrophobicContact CD2-CG 3.73Å; H906-F924 AromaticContact CD2-CZ 3.69Å; H906-F924 AromaticContact CE1-CE1 3.84Å; H906-F924 AromaticContact NE2-CE1 3.66Å; H906-F924 AromaticContact NE2-CZ 3.63Å; Y910-F924 AromaticContact CD1-CE2 3.99Å; Y910-F924 HydrophobicContact CD1-CE2 3.99Å; Y910-F924 HydrophobicContact CD2-CD2 4.27Å; Y910-F924 AromaticContact CD2-CE2 3.6Å; Y910-F924 HydrophobicContact CD2-CE2 3.6Å; Y910-F924 HydrophobicContact CD2-CZ 4.47Å; Y910-F924 HydrophobicContact CE1-CE2 4.19Å; Y910-F924 AromaticContact CE2-CE2 3.83Å; Y910-F924 HydrophobicContact CE2-CE2 3.83Å; Y910-F924 HydrophobicContact CE2-CZ 4.27Å; Y910-F924 HydrophobicContact CG-CD2 4.35Å; Y910-F924 AromaticContact CG-CE2 3.7Å; Y910-F924 HydrophobicContact CG-CE2 3.7Å; V919-F924 HydrophobicContact CG1-CB 4.24Å; V919-F924 HydrophobicContact CG1-CD2 4.33Å; R920-F924 PolarHBondContact O-N 3.47Å; F924-V926 PolarHBondContact O-N 3.03Å
925	D	78.7	Confident	75.3	Confident	109 Å²	109	71.8 Å²	71.8	58%	0.583	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-4.5	175.8	-46.3	-42.4	0	0	0	112.7	R872 E923	R872-D925 IonicContact CZ-OD2 3.45Å; R872-D925 IonicContact NH1-OD2 2.67Å; R872-D925 PolarHBondContact NH1-OD2 2.65Å; R872-D925 VanDerWaalsContact NH1-OD2 3.12Å; R872-D925 IonicContact NH2-OD1 3.91Å; R872-D925 PolarHBondContact NH2-OD1 3.27Å; R872-D925 IonicContact NH2-OD2 2.7Å; R872-D925 PolarHBondContact NH2-OD2 2.83Å; E923-D925 PolarHBondContact O-N 2.86Å
926	V	71.9	Confident	75.3	Confident	110 Å²	110	75.5 Å²	75.5	67%	0.667	40%	0.404	S	S	*	.	S	Bend	trans	-130.1	110.4	-176.3	-177.4	0	0	0	0	109.6	E923 F924 S928	E923-V926 WeakPolarHBondContact O-CA 3.3Å; E923-V926 PolarHBondContact O-N 3.11Å; E923-V926 VanDerWaalsContact O-O 3.06Å; F924-V926 PolarHBondContact O-N 3.03Å; V926-S928 PolarHBondContact O-N 2.69Å
927	D	69.3	Low	75.2	Confident	106 Å²	106	73 Å²	73	57%	0.567	38%	0.383	S	S	*	.			trans	-69.2	125.5	-179.5	-170.8	-6.4	0	0	0	112.1	E929 A930	D927-E929 PolarHBondContact O-N 2.78Å; D927-E929 PolarHBondContact OD1-N 3.4Å; D927-A930 HydrophobicContact CB-CB 4.18Å; D927-A930 PolarHBondContact O-N 3.33Å
928	S	65.4	Low	75.4	Confident	38 Å²	38	71.2 Å²	71.2	27%	0.266	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-14.9	176.5	69.6	0	0	0	0	114.2	V926	V926-S928 PolarHBondContact O-N 2.69Å
929	E	65.7	Low	75.7	Confident	121 Å²	121	73.2 Å²	73.2	57%	0.565	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-11.4	177.3	-62.5	-173.3	-169.6	0	0	113	T913 D927 E931	T913-E929 WeakPolarHBondContact CB-OE1 3.42Å; T913-E929 WeakPolarHBondContact CG2-OE1 3.39Å; T913-E929 PolarHBondContact OG1-OE1 2.87Å; D927-E929 PolarHBondContact O-N 2.78Å; D927-E929 PolarHBondContact OD1-N 3.4Å; E929-E931 PolarHBondContact O-N 2.95Å
930	A	64.9	Low	76.1	Confident	50 Å²	50	76 Å²	76	41%	0.413	39%	0.387	S	S	.	.			trans	-76.6	28.4	-176.6	0	0	0	0	0	115.1	D927 D932 R970	D927-A930 HydrophobicContact CB-CB 4.18Å; D927-A930 PolarHBondContact O-N 3.33Å; A930-D932 VanDerWaalsContact C-N 3.33Å; A930-D932 PolarHBondContact O-N 3.16Å; A930-D932 VanDerWaalsContact O-N 3.13Å; A930-R970 PolarHBondContact O-NH2 2.84Å
931	E	64.5	Low	76.5	Confident	115 Å²	115	75.1 Å²	75.1	54%	0.537	39%	0.385	S	S	.	.			trans	-80.8	75.8	169.3	-68.9	-164.4	152.4	0	0	110.6	E929 A933 P934	E929-E931 PolarHBondContact O-N 2.95Å; E931-A933 PolarHBondContact O-N 2.88Å; E931-P934 WeakPolarHBondContact O-CD 3.48Å
932	D	60.2	Low	76.9	Confident	56 Å²	56	77.8 Å²	77.8	30%	0.299	40%	0.396	S	S	.	.	S	Bend	trans	-50.5	131.4	167.6	-64.6	-26.3	0	0	0	109.8	A930 R970	A930-D932 VanDerWaalsContact C-N 3.33Å; A930-D932 PolarHBondContact O-N 3.16Å; A930-D932 VanDerWaalsContact O-N 3.13Å; D932-R970 HydrophobicContact CB-CG 4.16Å; D932-R970 IonicContact OD1-NH2 3.98Å; D932-R970 IonicContact OD2-CZ 2.82Å; D932-R970 IonicContact OD2-NE 3.08Å; D932-R970 PolarHBondContact OD2-NE 3.48Å; D932-R970 IonicContact OD2-NH2 3.84Å; D932-R970 PolarHBondContact OD2-NH2 3.12Å
933	A	65.3	Low	77.4	Confident	13 Å²	13	80.3 Å²	80.3	11%	0.107	40%	0.396	C	S	.	.	S	Bend	trans	51.5	71.3	-172.5	0	0	0	0	0	114.9	E931 L967	E931-A933 PolarHBondContact O-N 2.88Å; A933-L967 HydrophobicContact CB-CB 4.03Å; A933-L967 WeakPolarHBondContact CB-O 3.33Å
934	P	74.1	Confident	77.8	Confident	35 Å²	35	82.9 Å²	82.9	23%	0.227	41%	0.406	C	S	.	.			trans	-63	149.6	179.5	28.8	-36.6	0	0	0	111.8	E931 W936 L937	E931-P934 WeakPolarHBondContact O-CD 3.48Å; P934-W936 HydrophobicContact CG-CZ2 4.5Å; P934-W936 VanDerWaalsContact CG-NE1 3.32Å; P934-W936 PolarHBondContact O-N 3.25Å; P934-W936 VanDerWaalsContact O-N 3.07Å; P934-L937 HydrophobicContact CG-CB 4.26Å; P934-L937 WeakPolarHBondContact O-CB 3.5Å; P934-L937 PolarHBondContact O-N 2.95Å
935	V	80.3	Confident	78.2	Confident	80 Å²	80	80.2 Å²	80.2	49%	0.485	40%	0.395	S	S	.	.	H	α-helix	trans	-53	-37.8	-171.6	-179.5	0	0	0	0	113.3	L937 R938 Q939	V935-L937 VanDerWaalsContact C-N 3.26Å; V935-L937 PolarHBondContact O-N 3.45Å; V935-R938 PolarHBondContact O-N 3.19Å; V935-Q939 HydrophobicContact CG1-CG 4.31Å; V935-Q939 WeakPolarHBondContact O-CG 3.4Å; V935-Q939 PolarHBondContact O-N 2.98Å
936	W	84.1	Confident	78.8	Confident	153 Å²	153	80 Å²	80	58%	0.58	39%	0.39	S	S	*	.	H	α-helix	trans	-61.5	-32.8	179.1	74.9	-99.7	0	0	0	112.9	P934 H940	P934-W936 HydrophobicContact CG-CZ2 4.5Å; P934-W936 VanDerWaalsContact CG-NE1 3.32Å; P934-W936 PolarHBondContact O-N 3.25Å; P934-W936 VanDerWaalsContact O-N 3.07Å; W936-H940 HydrophobicContact CE3-CB 4.46Å; W936-H940 WeakPolarHBondContact O-CB 3.22Å; W936-H940 PolarHBondContact O-N 3.08Å
937	L	84.3	Confident	79.8	Confident	42 Å²	42	80.8 Å²	80.8	22%	0.22	39%	0.387	C	S	.	.	H	α-helix	trans	-72.7	-43.2	-178.7	-176.3	62.5	0	0	0	110.4	P934 V935 Q939 H940 Y941 L967	P934-L937 HydrophobicContact CG-CB 4.26Å; P934-L937 WeakPolarHBondContact O-CB 3.5Å; P934-L937 PolarHBondContact O-N 2.95Å; V935-L937 VanDerWaalsContact C-N 3.26Å; V935-L937 PolarHBondContact O-N 3.45Å; L937-Q939 VanDerWaalsContact C-N 3.35Å; L937-Q939 PolarHBondContact O-N 2.87Å; L937-H940 WeakPolarHBondContact O-CB 3.45Å; L937-H940 PolarHBondContact O-N 3.18Å; L937-H940 VanDerWaalsContact O-N 3.12Å; L937-Y941 HydrophobicContact CD1-CD2 4.07Å; L937-Y941 HydrophobicContact CD1-CE2 3.74Å; L937-Y941 HydrophobicContact CG-CD2 4.17Å; L937-Y941 HydrophobicContact CG-CE2 4.07Å; L937-Y941 WeakPolarHBondContact O-CD2 3.34Å; L937-Y941 PolarHBondContact O-N 2.92Å; L937-L967 HydrophobicContact CD2-CD2 3.91Å; L937-L967 HydrophobicContact CG-CD2 4.3Å
938	R	84.9	Confident	80.9	Confident	85 Å²	85	80.6 Å²	80.6	32%	0.321	38%	0.381	S	S	.	.	H	α-helix	trans	-59.4	-46.9	172.2	-169.5	-177	-62.4	147.8	6.1	110.9	V935 H940 Y941 Q942 A964 L967	V935-R938 PolarHBondContact O-N 3.19Å; R938-H940 PolarHBondContact O-N 3.43Å; R938-Y941 PolarHBondContact O-N 3.15Å; R938-Q942 VanDerWaalsContact O-CG 3.31Å; R938-Q942 WeakPolarHBondContact O-CG 3.45Å; R938-Q942 PolarHBondContact O-N 3.43Å; R938-Q942 PolarHBondContact O-OE1 3.32Å; R938-A964 HydrophobicContact CG-CB 4.34Å; R938-L967 HydrophobicContact CB-CD1 4.44Å
939	Q	87.4	Confident	82.1	Confident	96 Å²	96	85.9 Å²	85.9	45%	0.449	41%	0.412	S	S	.	.	H	α-helix	trans	-64.5	-24.8	175.6	-71	173.5	-30.4	0	0	113.7	V935 L937 R943	V935-Q939 HydrophobicContact CG1-CG 4.31Å; V935-Q939 WeakPolarHBondContact O-CG 3.4Å; V935-Q939 PolarHBondContact O-N 2.98Å; L937-Q939 VanDerWaalsContact C-N 3.35Å; L937-Q939 PolarHBondContact O-N 2.87Å; Q939-R943 PolarHBondContact O-N 3.03Å; Q939-R943 PolarHBondContact O-NE 3.42Å; Q939-R943 PolarHBondContact O-NH2 3.14Å
940	H	88.5	Confident	83.5	Confident	78 Å²	78	86.2 Å²	86.2	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-75.4	-47.7	175	179.2	64.4	0	0	0	111	W936 L937 R938 Q942 R943 K944	W936-H940 HydrophobicContact CE3-CB 4.46Å; W936-H940 WeakPolarHBondContact O-CB 3.22Å; W936-H940 PolarHBondContact O-N 3.08Å; L937-H940 WeakPolarHBondContact O-CB 3.45Å; L937-H940 PolarHBondContact O-N 3.18Å; L937-H940 VanDerWaalsContact O-N 3.12Å; R938-H940 PolarHBondContact O-N 3.43Å; H940-Q942 VanDerWaalsContact C-N 3.32Å; H940-Q942 PolarHBondContact O-N 3.39Å; H940-R943 PolarHBondContact O-N 3.38Å; H940-K944 VanDerWaalsContact NE2-CE 3.32Å; H940-K944 WeakPolarHBondContact NE2-CE 3.19Å; H940-K944 PolarHBondContact O-N 3.25Å
941	Y	88.8	Confident	84.7	Confident	106 Å²	106	85.2 Å²	85.2	42%	0.416	41%	0.406	S	S	.	.	H	α-helix	trans	-63	-36.3	173.9	-81.7	-76.9	0	0	0	112.7	L937 R938 K944 V945 L967	L937-Y941 HydrophobicContact CD1-CD2 4.07Å; L937-Y941 HydrophobicContact CD1-CE2 3.74Å; L937-Y941 HydrophobicContact CG-CD2 4.17Å; L937-Y941 HydrophobicContact CG-CE2 4.07Å; L937-Y941 WeakPolarHBondContact O-CD2 3.34Å; L937-Y941 PolarHBondContact O-N 2.92Å; R938-Y941 PolarHBondContact O-N 3.15Å; Y941-K944 PolarHBondContact O-N 2.96Å; Y941-V945 VanDerWaalsContact O-CG2 3.32Å; Y941-V945 WeakPolarHBondContact O-CG2 3.39Å; Y941-V945 PolarHBondContact O-N 3.13Å; Y941-L967 HydrophobicContact CD2-CD1 3.81Å; Y941-L967 HydrophobicContact CE2-CD1 4.4Å; Y941-L967 HydrophobicContact CE2-CD2 4.31Å; Y941-L967 HydrophobicContact CG-CD1 4.46Å
942	Q	90.1	Very high	86	Confident	64 Å²	64	82.5 Å²	82.5	30%	0.299	40%	0.396	S	S	.	.	H	α-helix	trans	-61.4	-48.9	175.9	-74.4	174.2	-65.2	0	0	112	R938 H940 V945 E946 Q960	R938-Q942 VanDerWaalsContact O-CG 3.31Å; R938-Q942 WeakPolarHBondContact O-CG 3.45Å; R938-Q942 PolarHBondContact O-N 3.43Å; R938-Q942 PolarHBondContact O-OE1 3.32Å; H940-Q942 VanDerWaalsContact C-N 3.32Å; H940-Q942 PolarHBondContact O-N 3.39Å; Q942-V945 PolarHBondContact O-N 3.22Å; Q942-V945 VanDerWaalsContact O-N 3.17Å; Q942-E946 PolarHBondContact O-N 3.12Å; Q942-Q960 HydrophobicContact CG-CG 4.25Å; Q942-Q960 PolarHBondContact O-NE2 3.47Å
943	R	91.2	Very high	87.5	Confident	119 Å²	119	84.6 Å²	84.6	45%	0.449	41%	0.412	S	S	.	.	H	α-helix	trans	-63.1	-42.1	176	-78.1	174.6	-71.6	150.2	-4.4	113	Q939 H940 V945 E946 E947	Q939-R943 PolarHBondContact O-N 3.03Å; Q939-R943 PolarHBondContact O-NE 3.42Å; Q939-R943 PolarHBondContact O-NH2 3.14Å; H940-R943 PolarHBondContact O-N 3.38Å; R943-V945 PolarHBondContact O-N 3.27Å; R943-E946 CarbonylContact O-C 3.52Å; R943-E946 WeakPolarHBondContact O-CA 3.43Å; R943-E946 WeakPolarHBondContact O-CB 3.23Å; R943-E946 PolarHBondContact O-N 2.88Å; R943-E947 VanDerWaalsContact O-CG 3.31Å; R943-E947 WeakPolarHBondContact O-CG 3.33Å; R943-E947 PolarHBondContact O-N 3.12Å
944	K	91.1	Very high	88.8	Confident	100 Å²	100	84.3 Å²	84.3	44%	0.435	41%	0.41	S	S	.	.	H	α-helix	trans	-60.2	-30.7	173.7	-80	-157.9	163	-156.2	0	113.9	H940 Y941 F948	H940-K944 VanDerWaalsContact NE2-CE 3.32Å; H940-K944 WeakPolarHBondContact NE2-CE 3.19Å; H940-K944 PolarHBondContact O-N 3.25Å; Y941-K944 PolarHBondContact O-N 2.96Å; K944-F948 WeakPolarHBondContact O-CD2 3.43Å; K944-F948 VanDerWaalsContact O-CE2 3.24Å; K944-F948 WeakPolarHBondContact O-CE2 3.37Å
945	V	91.6	Very high	89.7	Confident	8 Å²	8	85.9 Å²	85.9	5%	0.048	42%	0.415	C	S	.	.	H	α-helix	trans	-78.4	-28.6	173.3	176.1	0	0	0	0	111.5	Y941 Q942 R943 K956 M959 Q960	Y941-V945 VanDerWaalsContact O-CG2 3.32Å; Y941-V945 WeakPolarHBondContact O-CG2 3.39Å; Y941-V945 PolarHBondContact O-N 3.13Å; Q942-V945 PolarHBondContact O-N 3.22Å; Q942-V945 VanDerWaalsContact O-N 3.17Å; R943-V945 PolarHBondContact O-N 3.27Å; V945-K956 HydrophobicContact CG1-CB 3.89Å; V945-K956 HydrophobicContact CG1-CG 4.01Å; V945-K956 WeakPolarHBondContact CG1-O 3.19Å; V945-K956 VanDerWaalsContact O-CD 3.31Å; V945-K956 WeakPolarHBondContact O-CD 3.39Å; V945-K956 VanDerWaalsContact O-CE 3.23Å; V945-K956 WeakPolarHBondContact O-CE 3.48Å; V945-M959 HydrophobicContact CG1-CB 3.97Å; V945-M959 HydrophobicContact CG1-SD 4.36Å; V945-M959 HydrophobicContact CG2-CB 4.42Å; V945-Q960 HydrophobicContact CB-CG 3.86Å; V945-Q960 HydrophobicContact CG1-CG 3.76Å; V945-Q960 HydrophobicContact CG2-CG 4.41Å
946	E	91.1	Very high	90.3	Very high	104 Å²	104	84 Å²	84	49%	0.486	40%	0.4	S	S	.	.	H	α-helix	trans	-71	-34.1	173.3	-74.6	150.4	-167.1	0	0	112.5	Q942 R943 F948 K956 Q960	Q942-E946 PolarHBondContact O-N 3.12Å; R943-E946 CarbonylContact O-C 3.52Å; R943-E946 WeakPolarHBondContact O-CA 3.43Å; R943-E946 WeakPolarHBondContact O-CB 3.23Å; R943-E946 PolarHBondContact O-N 2.88Å; E946-F948 VanDerWaalsContact C-N 3.34Å; E946-F948 PolarHBondContact O-N 3.1Å; E946-K956 PolarHBondContact O-NZ 3.27Å; E946-Q960 PolarHBondContact OE1-NE2 3.46Å
947	E	93.2	Very high	90.8	Very high	127 Å²	127	78.5 Å²	78.5	59%	0.593	38%	0.381	S	S	*	.	S	Bend	trans	-61.8	-27	-178.5	-77	159.2	-157.1	0	0	115	R943 T949	R943-E947 VanDerWaalsContact O-CG 3.31Å; R943-E947 WeakPolarHBondContact O-CG 3.33Å; R943-E947 PolarHBondContact O-N 3.12Å; E947-T949 PolarHBondContact O-N 3.49Å
948	F	91.6	Very high	91.2	Very high	103 Å²	103	76.8 Å²	76.8	45%	0.452	37%	0.372	S	S	.	.			trans	-65.5	115.1	178.6	-73.3	-77.8	0	0	0	112.5	K944 E946 D950 V951 K956	K944-F948 WeakPolarHBondContact O-CD2 3.43Å; K944-F948 VanDerWaalsContact O-CE2 3.24Å; K944-F948 WeakPolarHBondContact O-CE2 3.37Å; E946-F948 VanDerWaalsContact C-N 3.34Å; E946-F948 PolarHBondContact O-N 3.1Å; F948-D950 VanDerWaalsContact C-N 3.31Å; F948-D950 WeakPolarHBondContact CB-OD1 3.45Å; F948-D950 PolarHBondContact O-N 3.36Å; F948-V951 HydrophobicContact CB-CB 4.05Å; F948-V951 HydrophobicContact CB-CG2 3.79Å; F948-V951 HydrophobicContact CD1-CG2 4.36Å; F948-V951 HydrophobicContact CG-CG2 4.07Å; F948-K956 WeakPolarHBondContact O-CE 3.49Å; F948-K956 PolarHBondContact O-NZ 2.93Å
949	T	91.5	Very high	91.6	Very high	148 Å²	148	76.2 Å²	76.2	91%	0.908	37%	0.374	S	S	*	.	S	Bend	trans	-79.4	-13.9	178.9	45.7	0	0	0	0	114.1	E947	E947-T949 PolarHBondContact O-N 3.49Å
950	D	94	Very high	91.9	Very high	129 Å²	129	73.1 Å²	73.1	69%	0.69	36%	0.359	S	S	*	.	S	Bend	trans	-98.7	-18.3	-172.4	56.6	-32.4	0	0	0	114.6	F948	F948-D950 VanDerWaalsContact C-N 3.31Å; F948-D950 WeakPolarHBondContact CB-OD1 3.45Å; F948-D950 PolarHBondContact O-N 3.36Å
951	V	91.8	Very high	92	Very high	28 Å²	28	70.6 Å²	70.6	17%	0.17	35%	0.348	C	S	.	.	S	Bend	trans	-93.1	135.7	-176.7	-179.4	0	0	0	0	111.9	F948 E955 K956 M959	F948-V951 HydrophobicContact CB-CB 4.05Å; F948-V951 HydrophobicContact CB-CG2 3.79Å; F948-V951 HydrophobicContact CD1-CG2 4.36Å; F948-V951 HydrophobicContact CG-CG2 4.07Å; V951-E955 HydrophobicContact CG1-CB 3.61Å; V951-K956 HydrophobicContact CB-CG 4.18Å; V951-K956 HydrophobicContact CG1-CG 3.81Å; V951-K956 WeakPolarHBondContact O-CE 3.37Å; V951-M959 HydrophobicContact CG1-CE 3.74Å; V951-M959 HydrophobicContact CG1-SD 3.97Å
952	N	90.4	Very high	92.2	Very high	59 Å²	59	67.1 Å²	67.1	32%	0.316	33%	0.334	S	S	.	.			trans	-71.8	152.4	-172.8	98.3	46.5	0	0	0	112.6	G954 E955 K956	N952-G954 PolarHBondContact O-N 3.33Å; N952-G954 VanDerWaalsContact O-N 3.13Å; N952-G954 VanDerWaalsContact OD1-CA 3.29Å; N952-G954 WeakPolarHBondContact OD1-CA 3.3Å; N952-G954 PolarHBondContact OD1-N 3.03Å; N952-E955 WeakPolarHBondContact CB-OE2 3.47Å; N952-E955 VanDerWaalsContact CG-CD 3.44Å; N952-E955 PolarHBondContact N-OE2 3.11Å; N952-E955 WeakPolarHBondContact ND2-CG 3.32Å; N952-E955 PolarHBondContact ND2-OE1 2.78Å; N952-E955 PolarHBondContact ND2-OE2 2.75Å; N952-E955 PolarHBondContact O-N 2.87Å; N952-E955 PolarHBondContact OD1-N 2.52Å; N952-K956 WeakPolarHBondContact O-CG 3.44Å; N952-K956 PolarHBondContact O-N 3.33Å
953	P	91.4	Very high	92.1	Very high	99 Å²	99	66.2 Å²	66.2	64%	0.643	33%	0.332	S	S	*	.	H	α-helix	trans	-61	-26	-175.4	-26	35.5	0	0	0	115	Q957	P953-Q957 VanDerWaalsContact O-CG 3.27Å; P953-Q957 WeakPolarHBondContact O-CG 3.33Å; P953-Q957 PolarHBondContact O-N 2.91Å; P953-Q957 PolarHBondContact O-NE2 2.84Å
954	G	92.4	Very high	91.9	Very high	7 Å²	7	61.4 Å²	61.4	7%	0.072	32%	0.318	C	S	.	.	H	α-helix	trans	-77.4	-42.8	175.3	0	0	0	0	0	113	N952 Q957 I958	N952-G954 PolarHBondContact O-N 3.33Å; N952-G954 VanDerWaalsContact O-N 3.13Å; N952-G954 VanDerWaalsContact OD1-CA 3.29Å; N952-G954 WeakPolarHBondContact OD1-CA 3.3Å; N952-G954 PolarHBondContact OD1-N 3.03Å; G954-Q957 PolarHBondContact O-N 2.96Å; G954-I958 PolarHBondContact O-N 3.4Å
955	E	93.5	Very high	91.8	Very high	69 Å²	69	56.7 Å²	56.7	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-58.6	-50.4	171.1	-76.8	156.8	-176.4	0	0	111.2	V951 N952 Q957 I958 M959	V951-E955 HydrophobicContact CG1-CB 3.61Å; N952-E955 WeakPolarHBondContact CB-OE2 3.47Å; N952-E955 VanDerWaalsContact CG-CD 3.44Å; N952-E955 PolarHBondContact N-OE2 3.11Å; N952-E955 WeakPolarHBondContact ND2-CG 3.32Å; N952-E955 PolarHBondContact ND2-OE1 2.78Å; N952-E955 PolarHBondContact ND2-OE2 2.75Å; N952-E955 PolarHBondContact O-N 2.87Å; N952-E955 PolarHBondContact OD1-N 2.52Å; E955-Q957 PolarHBondContact O-N 2.86Å; E955-I958 PolarHBondContact O-N 3.26Å; E955-M959 HydrophobicContact CB-CE 4.32Å; E955-M959 WeakPolarHBondContact O-CB 3.33Å; E955-M959 WeakPolarHBondContact O-CG 3.46Å; E955-M959 PolarHBondContact O-N 3.19Å
956	K	94.1	Very high	91.5	Very high	40 Å²	40	59 Å²	59	17%	0.174	31%	0.309	C	S	.	.	H	α-helix	trans	-50.7	-43	175.1	-73.9	-172.6	177.1	-177.8	0	111.8	V945 E946 F948 V951 N952 Q960	V945-K956 HydrophobicContact CG1-CB 3.89Å; V945-K956 HydrophobicContact CG1-CG 4.01Å; V945-K956 WeakPolarHBondContact CG1-O 3.19Å; V945-K956 VanDerWaalsContact O-CD 3.31Å; V945-K956 WeakPolarHBondContact O-CD 3.39Å; V945-K956 VanDerWaalsContact O-CE 3.23Å; V945-K956 WeakPolarHBondContact O-CE 3.48Å; E946-K956 PolarHBondContact O-NZ 3.27Å; F948-K956 WeakPolarHBondContact O-CE 3.49Å; F948-K956 PolarHBondContact O-NZ 2.93Å; V951-K956 HydrophobicContact CB-CG 4.18Å; V951-K956 HydrophobicContact CG1-CG 3.81Å; V951-K956 WeakPolarHBondContact O-CE 3.37Å; N952-K956 WeakPolarHBondContact O-CG 3.44Å; N952-K956 PolarHBondContact O-N 3.33Å; K956-Q960 WeakPolarHBondContact O-CB 3.41Å; K956-Q960 VanDerWaalsContact O-CG 3.27Å; K956-Q960 WeakPolarHBondContact O-CG 3.42Å; K956-Q960 PolarHBondContact O-N 2.95Å
957	Q	93	Very high	91	Very high	37 Å²	37	55.5 Å²	55.5	17%	0.173	29%	0.293	C	S	.	.	H	α-helix	trans	-67.8	-40.6	178.5	-75.2	172.9	88.8	0	0	112.9	P953 G954 E955 L961 W995 L1001	P953-Q957 VanDerWaalsContact O-CG 3.27Å; P953-Q957 WeakPolarHBondContact O-CG 3.33Å; P953-Q957 PolarHBondContact O-N 2.91Å; P953-Q957 PolarHBondContact O-NE2 2.84Å; G954-Q957 PolarHBondContact O-N 2.96Å; E955-Q957 PolarHBondContact O-N 2.86Å; Q957-L961 WeakPolarHBondContact O-CG 3.46Å; Q957-L961 PolarHBondContact O-N 3.02Å; Q957-L961 VanDerWaalsContact O-N 3.1Å; Q957-W995 HydrophobicContact CB-CH2 3.91Å; Q957-W995 HydrophobicContact CB-CZ3 4.04Å; Q957-W995 HydrophobicContact CG-CH2 3.94Å; Q957-W995 HydrophobicContact CG-CZ3 4.5Å; Q957-W995 VanDerWaalsContact OE1-CH2 3.27Å; Q957-L1001 HydrophobicContact CB-CD1 3.8Å
958	I	94.4	Very high	90.4	Very high	6 Å²	6	51.5 Å²	51.5	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-46.6	174.2	-64.9	-63	0	0	0	110.6	G954 E955 Q960 L961 W962 F988 I996 L1001 N1004 L1005 H1008	G954-I958 PolarHBondContact O-N 3.4Å; E955-I958 PolarHBondContact O-N 3.26Å; I958-Q960 PolarHBondContact O-N 3.49Å; I958-L961 PolarHBondContact O-N 2.95Å; I958-W962 WeakPolarHBondContact O-CB 3.14Å; I958-W962 PolarHBondContact O-N 2.85Å; I958-F988 HydrophobicContact CG2-CZ 4.39Å; I958-I996 HydrophobicContact CD1-CD1 4.18Å; I958-I996 HydrophobicContact CD1-CG1 4.11Å; I958-L1001 HydrophobicContact CD1-CB 4.28Å; I958-L1001 HydrophobicContact CD1-CD1 4.43Å; I958-N1004 HydrophobicContact CG1-CB 3.78Å; I958-L1005 HydrophobicContact CD1-CB 4.37Å; I958-H1008 HydrophobicContact CG2-CB 3.92Å
959	M	92.9	Very high	89.6	Confident	74 Å²	74	47.9 Å²	47.9	37%	0.365	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-46	175.9	-68.7	175.8	-175.8	0	0	112.2	V945 V951 E955 L961 W962 N963	V945-M959 HydrophobicContact CG1-CB 3.97Å; V945-M959 HydrophobicContact CG1-SD 4.36Å; V945-M959 HydrophobicContact CG2-CB 4.42Å; V951-M959 HydrophobicContact CG1-CE 3.74Å; V951-M959 HydrophobicContact CG1-SD 3.97Å; E955-M959 HydrophobicContact CB-CE 4.32Å; E955-M959 WeakPolarHBondContact O-CB 3.33Å; E955-M959 WeakPolarHBondContact O-CG 3.46Å; E955-M959 PolarHBondContact O-N 3.19Å; M959-L961 PolarHBondContact O-N 3.03Å; M959-W962 PolarHBondContact O-N 2.79Å; M959-N963 VanDerWaalsContact O-CB 3.28Å; M959-N963 WeakPolarHBondContact O-CB 3.34Å; M959-N963 PolarHBondContact O-N 3.33Å; M959-N963 PolarHBondContact O-ND2 3.29Å
960	Q	92.6	Very high	88.5	Confident	31 Å²	31	48.1 Å²	48.1	15%	0.145	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-43.2	177.1	-79.6	-170.6	-11.8	0	0	112.4	Q942 V945 E946 K956 I958 A964	Q942-Q960 HydrophobicContact CG-CG 4.25Å; Q942-Q960 PolarHBondContact O-NE2 3.47Å; V945-Q960 HydrophobicContact CB-CG 3.86Å; V945-Q960 HydrophobicContact CG1-CG 3.76Å; V945-Q960 HydrophobicContact CG2-CG 4.41Å; E946-Q960 PolarHBondContact OE1-NE2 3.46Å; K956-Q960 WeakPolarHBondContact O-CB 3.41Å; K956-Q960 VanDerWaalsContact O-CG 3.27Å; K956-Q960 WeakPolarHBondContact O-CG 3.42Å; K956-Q960 PolarHBondContact O-N 2.95Å; I958-Q960 PolarHBondContact O-N 3.49Å; Q960-A964 WeakPolarHBondContact O-CB 3.46Å; Q960-A964 PolarHBondContact O-N 3.33Å
961	L	92	Very high	87.1	Confident	25 Å²	25	45.6 Å²	45.6	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-68.3	-42.5	177.2	-69.7	-176.2	0	0	0	111.9	Q957 I958 M959 A964 L965 F988 H992 W995 I996	Q957-L961 WeakPolarHBondContact O-CG 3.46Å; Q957-L961 PolarHBondContact O-N 3.02Å; Q957-L961 VanDerWaalsContact O-N 3.1Å; I958-L961 PolarHBondContact O-N 2.95Å; M959-L961 PolarHBondContact O-N 3.03Å; L961-A964 PolarHBondContact O-N 3.49Å; L961-L965 PolarHBondContact O-N 3.48Å; L961-F988 HydrophobicContact CB-CE2 3.66Å; L961-F988 HydrophobicContact CB-CZ 4.01Å; L961-H992 HydrophobicContact CD1-CB 4.13Å; L961-W995 HydrophobicContact CD1-CD2 4.16Å; L961-W995 HydrophobicContact CD1-CE3 3.49Å; L961-W995 VanDerWaalsContact CD1-CE3 3.49Å; L961-W995 HydrophobicContact CD1-CH2 4.33Å; L961-W995 HydrophobicContact CD1-CZ3 3.58Å; L961-W995 HydrophobicContact CG-CE3 4.49Å; L961-W995 HydrophobicContact CG-CZ3 4.24Å; L961-I996 HydrophobicContact CD1-CG1 4.36Å
962	W	91.5	Very high	85.3	Confident	32 Å²	32	47.5 Å²	47.5	12%	0.121	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-48.6	179.2	-179.1	-110.8	0	0	0	111	I958 M959 A964 L965 L966 L984 V985 F988 H1008	I958-W962 WeakPolarHBondContact O-CB 3.14Å; I958-W962 PolarHBondContact O-N 2.85Å; M959-W962 PolarHBondContact O-N 2.79Å; W962-A964 VanDerWaalsContact C-N 3.31Å; W962-A964 PolarHBondContact O-N 3.07Å; W962-L965 HydrophobicContact CE3-CD2 4.42Å; W962-L965 HydrophobicContact CZ3-CD2 4.28Å; W962-L965 WeakPolarHBondContact O-CB 2.95Å; W962-L965 PolarHBondContact O-N 3.37Å; W962-L965 VanDerWaalsContact O-N 3.12Å; W962-L966 HydrophobicContact CZ2-CD2 4.3Å; W962-L966 WeakPolarHBondContact O-CG 3.41Å; W962-L966 PolarHBondContact O-N 2.93Å; W962-L984 HydrophobicContact CH2-CB 4.15Å; W962-V985 HydrophobicContact CH2-CG2 3.62Å; W962-V985 HydrophobicContact CZ3-CG2 3.86Å; W962-F988 HydrophobicContact CB-CE2 4.2Å; W962-F988 HydrophobicContact CB-CZ 4.35Å; W962-F988 HydrophobicContact CE3-CB 4.16Å; W962-F988 HydrophobicContact CE3-CD1 4.15Å; W962-F988 AromaticContact CE3-CD2 3.87Å; W962-F988 HydrophobicContact CE3-CD2 3.87Å; W962-F988 HydrophobicContact CE3-CE2 4.26Å; W962-F988 AromaticContact CE3-CG 3.82Å; W962-F988 HydrophobicContact CE3-CG 3.82Å; W962-F988 HydrophobicContact CZ3-CB 3.94Å; W962-F988 HydrophobicContact CZ3-CD1 4.49Å; W962-F988 HydrophobicContact CZ3-CG 4.1Å; W962-H1008 AromaticContact CD2-NE2 3.54Å; W962-H1008 AromaticContact CE2-NE2 3.88Å; W962-H1008 AromaticContact CE3-NE2 3.84Å; W962-H1008 AromaticContact CG-NE2 3.75Å
963	N	89	Confident	83.7	Confident	46 Å²	46	47.9 Å²	47.9	25%	0.246	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-37.6	174.6	-68.7	-20.4	0	0	0	112	M959 L966 L967	M959-N963 VanDerWaalsContact O-CB 3.28Å; M959-N963 WeakPolarHBondContact O-CB 3.34Å; M959-N963 PolarHBondContact O-N 3.33Å; M959-N963 PolarHBondContact O-ND2 3.29Å; N963-L966 PolarHBondContact O-N 3.46Å; N963-L967 WeakPolarHBondContact O-CB 3.44Å; N963-L967 VanDerWaalsContact O-CG 3.25Å; N963-L967 WeakPolarHBondContact O-CG 3.2Å; N963-L967 PolarHBondContact O-N 3.49Å
964	A	87.2	Confident	82.5	Confident	18 Å²	18	47.2 Å²	47.2	15%	0.149	26%	0.262	C	S	.	.	H	α-helix	trans	-67.4	-33.5	174.9	0	0	0	0	0	113	R938 Q960 L961 W962 S968	R938-A964 HydrophobicContact CG-CB 4.34Å; Q960-A964 WeakPolarHBondContact O-CB 3.46Å; Q960-A964 PolarHBondContact O-N 3.33Å; L961-A964 PolarHBondContact O-N 3.49Å; W962-A964 VanDerWaalsContact C-N 3.31Å; W962-A964 PolarHBondContact O-N 3.07Å; A964-S968 PolarHBondContact O-N 3.41Å
965	L	87.7	Confident	80.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68	-50.7	171.8	178.8	71.5	0	0	0	111	L961 W962 L967 S968 I969 Q987 F988	L961-L965 PolarHBondContact O-N 3.48Å; W962-L965 HydrophobicContact CE3-CD2 4.42Å; W962-L965 HydrophobicContact CZ3-CD2 4.28Å; W962-L965 WeakPolarHBondContact O-CB 2.95Å; W962-L965 PolarHBondContact O-N 3.37Å; W962-L965 VanDerWaalsContact O-N 3.12Å; L965-L967 VanDerWaalsContact C-N 3.28Å; L965-L967 PolarHBondContact O-N 3Å; L965-S968 WeakPolarHBondContact O-CA 3.42Å; L965-S968 WeakPolarHBondContact O-CB 3.38Å; L965-S968 PolarHBondContact O-N 2.58Å; L965-S968 PolarHBondContact O-OG 3.33Å; L965-I969 PolarHBondContact O-N 3.04Å; L965-Q987 HydrophobicContact CD1-CG 4.15Å; L965-F988 HydrophobicContact CB-CD2 4.36Å; L965-F988 HydrophobicContact CD2-CB 3.6Å; L965-F988 HydrophobicContact CD2-CD2 3.9Å; L965-F988 HydrophobicContact CD2-CG 4.22Å
966	L	85.9	Confident	79.8	Confident	58 Å²	58	51.6 Å²	51.6	30%	0.304	29%	0.292	S	S	.	.	H	α-helix	trans	-55.7	-44.7	179.8	-70.6	178	0	0	0	111.4	W962 N963 S968 I969 L984	W962-L966 HydrophobicContact CZ2-CD2 4.3Å; W962-L966 WeakPolarHBondContact O-CG 3.41Å; W962-L966 PolarHBondContact O-N 2.93Å; N963-L966 PolarHBondContact O-N 3.46Å; L966-S968 VanDerWaalsContact C-N 3.25Å; L966-S968 PolarHBondContact O-N 3.09Å; L966-I969 HydrophobicContact CD2-CD1 4.1Å; L966-I969 WeakPolarHBondContact O-CB 3.38Å; L966-I969 WeakPolarHBondContact O-CG1 3.35Å; L966-I969 PolarHBondContact O-N 3.32Å; L966-L984 HydrophobicContact CD2-CD1 4.05Å
967	L	81.7	Confident	79.3	Confident	29 Å²	29	53 Å²	53	15%	0.152	31%	0.306	C	S	.	.	H	α-helix	trans	-63.4	-27.2	173.5	-70.6	170.6	0	0	0	113.1	A933 L937 R938 Y941 N963 L965 I969	A933-L967 HydrophobicContact CB-CB 4.03Å; A933-L967 WeakPolarHBondContact CB-O 3.33Å; L937-L967 HydrophobicContact CD2-CD2 3.91Å; L937-L967 HydrophobicContact CG-CD2 4.3Å; R938-L967 HydrophobicContact CB-CD1 4.44Å; Y941-L967 HydrophobicContact CD2-CD1 3.81Å; Y941-L967 HydrophobicContact CE2-CD1 4.4Å; Y941-L967 HydrophobicContact CE2-CD2 4.31Å; Y941-L967 HydrophobicContact CG-CD1 4.46Å; N963-L967 WeakPolarHBondContact O-CB 3.44Å; N963-L967 VanDerWaalsContact O-CG 3.25Å; N963-L967 WeakPolarHBondContact O-CG 3.2Å; N963-L967 PolarHBondContact O-N 3.49Å; L965-L967 VanDerWaalsContact C-N 3.28Å; L965-L967 PolarHBondContact O-N 3Å; L967-I969 VanDerWaalsContact C-N 3.31Å; L967-I969 PolarHBondContact O-N 2.91Å
968	S	79.3	Confident	79	Confident	44 Å²	44	56.7 Å²	56.7	31%	0.308	33%	0.327	S	S	.	.	H	α-helix	trans	-78.1	-11.9	-179.6	76.6	0	0	0	0	114.6	A964 L965 L966 R970	A964-S968 PolarHBondContact O-N 3.41Å; L965-S968 WeakPolarHBondContact O-CA 3.42Å; L965-S968 WeakPolarHBondContact O-CB 3.38Å; L965-S968 PolarHBondContact O-N 2.58Å; L965-S968 PolarHBondContact O-OG 3.33Å; L966-S968 VanDerWaalsContact C-N 3.25Å; L966-S968 PolarHBondContact O-N 3.09Å; S968-R970 PolarHBondContact O-N 3.26Å
969	I	75.9	Confident	78.6	Confident	26 Å²	26	60 Å²	60	13%	0.133	36%	0.363	C	S	.	.	S	Bend	trans	-66.2	126.2	176.7	-57.5	168.5	0	0	0	108.8	L965 L966 L967 P971 S972 L974 V976 L984	L965-I969 PolarHBondContact O-N 3.04Å; L966-I969 HydrophobicContact CD2-CD1 4.1Å; L966-I969 WeakPolarHBondContact O-CB 3.38Å; L966-I969 WeakPolarHBondContact O-CG1 3.35Å; L966-I969 PolarHBondContact O-N 3.32Å; L967-I969 VanDerWaalsContact C-N 3.31Å; L967-I969 PolarHBondContact O-N 2.91Å; I969-P971 CarbonylContact O-C 3.58Å; I969-S972 WeakPolarHBondContact O-CA 3.33Å; I969-S972 PolarHBondContact O-N 3.37Å; I969-L974 HydrophobicContact CG2-CB 4.39Å; I969-L974 HydrophobicContact CG2-CD2 3.78Å; I969-V976 HydrophobicContact CD1-CG2 4.14Å; I969-L984 HydrophobicContact CD1-CD1 3.82Å; I969-L984 HydrophobicContact CD1-CD2 3.58Å; I969-L984 HydrophobicContact CD1-CG 4.37Å; I969-L984 HydrophobicContact CG1-CD2 4.22Å
970	R	67.7	Low	78.3	Confident	153 Å²	153	59.7 Å²	59.7	58%	0.577	36%	0.361	S	S	*	.	S	Bend	trans	-110.9	136.4	178.8	-64.5	-165.3	70.5	146.7	2.5	111.6	A930 D932 S968	A930-R970 PolarHBondContact O-NH2 2.84Å; D932-R970 HydrophobicContact CB-CG 4.16Å; D932-R970 IonicContact OD1-NH2 3.98Å; D932-R970 IonicContact OD2-CZ 2.82Å; D932-R970 IonicContact OD2-NE 3.08Å; D932-R970 PolarHBondContact OD2-NE 3.48Å; D932-R970 IonicContact OD2-NH2 3.84Å; D932-R970 PolarHBondContact OD2-NH2 3.12Å; S968-R970 PolarHBondContact O-N 3.26Å
971	P	63.8	Low	78.2	Confident	76 Å²	76	58.8 Å²	58.8	49%	0.494	36%	0.357	S	S	.	.	S	Bend	cis	-68.7	149	-6.9	31.5	-35.6	0	0	0	111	I969 G973 L974	I969-P971 CarbonylContact O-C 3.58Å; P971-G973 PolarHBondContact O-N 2.88Å; P971-L974 VanDerWaalsContact O-CB 3.3Å; P971-L974 WeakPolarHBondContact O-CB 3.27Å; P971-L974 PolarHBondContact O-N 3.24Å
972	S	55.6	Low	78.2	Confident	68 Å²	68	59.2 Å²	59.2	48%	0.476	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	5.9	-177.5	61.4	0	0	0	0	114.5	I969	I969-S972 WeakPolarHBondContact O-CA 3.33Å; I969-S972 PolarHBondContact O-N 3.37Å
973	G	56.2	Low	78.1	Confident	68 Å²	68	60.9 Å²	60.9	70%	0.701	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	14.1	166.7	0	0	0	0	0	113.5	P971 V975	P971-G973 PolarHBondContact O-N 2.88Å; G973-V975 PolarHBondContact O-N 3.34Å
974	L	65.4	Low	78.2	Confident	84 Å²	84	59.3 Å²	59.3	44%	0.44	36%	0.364	S	S	.	.			trans	-68.6	114.2	170.8	-171.6	77.2	0	0	0	108.9	I969 P971 V976	I969-L974 HydrophobicContact CG2-CB 4.39Å; I969-L974 HydrophobicContact CG2-CD2 3.78Å; P971-L974 VanDerWaalsContact O-CB 3.3Å; P971-L974 WeakPolarHBondContact O-CB 3.27Å; P971-L974 PolarHBondContact O-N 3.24Å; L974-V976 PolarHBondContact O-N 3.22Å; L974-V976 VanDerWaalsContact O-N 3.16Å
975	V	59.5	Low	78.5	Confident	119 Å²	119	58.4 Å²	58.4	72%	0.721	36%	0.357	S	S	*	.			trans	-65.9	113.7	168.5	179.2	0	0	0	0	107.7	G973 C977	G973-V975 PolarHBondContact O-N 3.34Å; V975-C977 PolarHBondContact O-N 2.9Å
976	V	71.4	Confident	78.7	Confident	50 Å²	50	58.8 Å²	58.8	30%	0.303	36%	0.36	S	S	.	.			trans	-65.6	119	170.7	175.7	0	0	0	0	107.7	I969 L974 Q980 V981 L984	I969-V976 HydrophobicContact CD1-CG2 4.14Å; L974-V976 PolarHBondContact O-N 3.22Å; L974-V976 VanDerWaalsContact O-N 3.16Å; V976-Q980 HydrophobicContact CG1-CB 4.34Å; V976-V981 HydrophobicContact CG1-CG2 4.22Å; V976-L984 HydrophobicContact CB-CD1 4.32Å; V976-L984 HydrophobicContact CG1-CD1 3.51Å; V976-L984 HydrophobicContact CG2-CD1 3.77Å
977	C	82.4	Confident	78.9	Confident	69 Å²	69	59.6 Å²	59.6	47%	0.466	36%	0.362	S	S	.	.			trans	-85.3	152.7	171.5	-42.8	0	0	0	0	109.5	V975 G979 Q980	V975-C977 PolarHBondContact O-N 2.9Å; C977-G979 VanDerWaalsContact C-N 3.29Å; C977-G979 PolarHBondContact O-N 2.85Å; C977-Q980 HydrophobicContact CB-CG 4.18Å; C977-Q980 WeakPolarHBondContact O-CA 3.34Å; C977-Q980 VanDerWaalsContact O-CB 3.24Å; C977-Q980 WeakPolarHBondContact O-CB 3.49Å; C977-Q980 PolarHBondContact O-N 3.4Å
978	D	87.4	Confident	79.5	Confident	115 Å²	115	58.2 Å²	58.2	62%	0.615	36%	0.355	S	S	*	.	H	α-helix	trans	-58	-41.6	-176.3	-46.5	-46.8	0	0	0	112.1	Q980 V981 L1017	D978-Q980 PolarHBondContact O-N 3.26Å; D978-V981 VanDerWaalsContact O-CB 3.32Å; D978-V981 WeakPolarHBondContact O-CB 3.33Å; D978-V981 WeakPolarHBondContact O-CG2 3.31Å; D978-V981 PolarHBondContact O-N 3.21Å; D978-L1017 HydrophobicContact CB-CD2 3.97Å
979	G	85.4	Confident	80.2	Confident	75 Å²	75	56.1 Å²	56.1	77%	0.773	34%	0.34	S	S	*	.	H	α-helix	trans	-63.1	-7.5	172.9	0	0	0	0	0	115.7	C977	C977-G979 VanDerWaalsContact C-N 3.29Å; C977-G979 PolarHBondContact O-N 2.85Å
980	Q	87.8	Confident	80.9	Confident	68 Å²	68	58.8 Å²	58.8	32%	0.318	35%	0.352	S	S	.	.	H	α-helix	trans	-92.1	-18.8	170.4	-60.3	174.8	-10.6	0	0	112.5	V976 C977 D978 L982 T983 L984	V976-Q980 HydrophobicContact CG1-CB 4.34Å; C977-Q980 HydrophobicContact CB-CG 4.18Å; C977-Q980 WeakPolarHBondContact O-CA 3.34Å; C977-Q980 VanDerWaalsContact O-CB 3.24Å; C977-Q980 WeakPolarHBondContact O-CB 3.49Å; C977-Q980 PolarHBondContact O-N 3.4Å; D978-Q980 PolarHBondContact O-N 3.26Å; Q980-L982 VanDerWaalsContact C-N 3.33Å; Q980-L982 PolarHBondContact O-N 3.46Å; Q980-T983 WeakPolarHBondContact O-CA 3.29Å; Q980-T983 WeakPolarHBondContact O-CB 3.27Å; Q980-T983 PolarHBondContact O-N 2.98Å; Q980-L984 PolarHBondContact O-N 3.26Å
981	V	89.9	Confident	82	Confident	11 Å²	11	55.9 Å²	55.9	7%	0.067	35%	0.345	C	S	.	.	H	α-helix	trans	-57.7	-44.6	-175.6	176.9	0	0	0	0	111.1	V976 D978 T983 L984 V985 L1012 L1017	V976-V981 HydrophobicContact CG1-CG2 4.22Å; D978-V981 VanDerWaalsContact O-CB 3.32Å; D978-V981 WeakPolarHBondContact O-CB 3.33Å; D978-V981 WeakPolarHBondContact O-CG2 3.31Å; D978-V981 PolarHBondContact O-N 3.21Å; V981-T983 VanDerWaalsContact C-N 3.27Å; V981-T983 PolarHBondContact O-N 3.34Å; V981-L984 PolarHBondContact O-N 3.3Å; V981-V985 HydrophobicContact CG1-CG2 4.12Å; V981-V985 WeakPolarHBondContact O-CG2 3.48Å; V981-V985 PolarHBondContact O-N 3.07Å; V981-L1012 HydrophobicContact CG1-CD2 4.5Å; V981-L1017 HydrophobicContact CB-CB 4.45Å; V981-L1017 HydrophobicContact CG1-CB 4.13Å; V981-L1017 HydrophobicContact CG2-CB 4.47Å
982	L	90.8	Very high	83.4	Confident	34 Å²	34	53.4 Å²	53.4	18%	0.178	33%	0.327	C	S	.	.	H	α-helix	trans	-53.5	-42.5	173.2	178.7	60.3	0	0	0	112.7	Q980 V985 C986 L1018 H1022 L1026	Q980-L982 VanDerWaalsContact C-N 3.33Å; Q980-L982 PolarHBondContact O-N 3.46Å; L982-V985 PolarHBondContact O-N 3.03Å; L982-C986 PolarHBondContact O-N 3.45Å; L982-C986 PolarHBondContact O-SG 3.16Å; L982-C986 VanDerWaalsContact O-SG 3.33Å; L982-L1018 HydrophobicContact CB-CD2 4.09Å; L982-L1018 HydrophobicContact CD1-CD2 4.02Å; L982-H1022 HydrophobicContact CD1-CB 3.95Å; L982-L1026 HydrophobicContact CD1-CD1 4.04Å; L982-L1026 HydrophobicContact CD1-CD2 4.19Å; L982-L1026 HydrophobicContact CD1-CG 4.23Å
983	T	90.1	Very high	85.2	Confident	67 Å²	67	50.3 Å²	50.3	41%	0.411	31%	0.305	S	S	.	.	H	α-helix	trans	-69.1	-38.9	178.2	-59.2	0	0	0	0	111.6	Q980 V981 C986 Q987	Q980-T983 WeakPolarHBondContact O-CA 3.29Å; Q980-T983 WeakPolarHBondContact O-CB 3.27Å; Q980-T983 PolarHBondContact O-N 2.98Å; V981-T983 VanDerWaalsContact C-N 3.27Å; V981-T983 PolarHBondContact O-N 3.34Å; T983-C986 PolarHBondContact O-N 2.93Å; T983-Q987 PolarHBondContact O-N 3.1Å
984	L	91.1	Very high	86.8	Confident	13 Å²	13	55 Å²	55	7%	0.068	30%	0.302	C	S	.	.	H	α-helix	trans	-67.8	-37.2	176.5	-64.9	-178.6	0	0	0	112.4	W962 L966 I969 V976 Q980 V981 Q987 F988	W962-L984 HydrophobicContact CH2-CB 4.15Å; L966-L984 HydrophobicContact CD2-CD1 4.05Å; I969-L984 HydrophobicContact CD1-CD1 3.82Å; I969-L984 HydrophobicContact CD1-CD2 3.58Å; I969-L984 HydrophobicContact CD1-CG 4.37Å; I969-L984 HydrophobicContact CG1-CD2 4.22Å; V976-L984 HydrophobicContact CB-CD1 4.32Å; V976-L984 HydrophobicContact CG1-CD1 3.51Å; V976-L984 HydrophobicContact CG2-CD1 3.77Å; Q980-L984 PolarHBondContact O-N 3.26Å; V981-L984 PolarHBondContact O-N 3.3Å; L984-Q987 CarbonylContact O-C 3.55Å; L984-Q987 PolarHBondContact O-N 3.01Å; L984-F988 WeakPolarHBondContact O-CB 3.35Å; L984-F988 PolarHBondContact O-N 2.91Å
985	V	93.4	Very high	88.1	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-70.8	-38.3	175.7	-177.4	0	0	0	0	111.2	W962 V981 L982 Q987 F988 I989 L1009 L1012 L1026	W962-V985 HydrophobicContact CH2-CG2 3.62Å; W962-V985 HydrophobicContact CZ3-CG2 3.86Å; V981-V985 HydrophobicContact CG1-CG2 4.12Å; V981-V985 WeakPolarHBondContact O-CG2 3.48Å; V981-V985 PolarHBondContact O-N 3.07Å; L982-V985 PolarHBondContact O-N 3.03Å; V985-Q987 VanDerWaalsContact C-N 3.34Å; V985-Q987 PolarHBondContact O-N 3.06Å; V985-F988 WeakPolarHBondContact O-CB 3.41Å; V985-F988 PolarHBondContact O-N 3.42Å; V985-I989 HydrophobicContact CG1-CD1 4.22Å; V985-I989 WeakPolarHBondContact O-CG1 3.32Å; V985-I989 PolarHBondContact O-N 3.43Å; V985-L1009 HydrophobicContact CG1-CD2 3.42Å; V985-L1009 VanDerWaalsContact CG1-CD2 3.42Å; V985-L1012 HydrophobicContact CG2-CD1 3.75Å; V985-L1026 HydrophobicContact CB-CD1 4.27Å; V985-L1026 HydrophobicContact CB-CD2 4.32Å; V985-L1026 HydrophobicContact CG1-CD1 3.75Å; V985-L1026 HydrophobicContact CG1-CD2 3.95Å; V985-L1026 HydrophobicContact CG1-CG 4.39Å
986	C	92.1	Very high	89.8	Confident	8 Å²	8	49.7 Å²	49.7	5%	0.054	26%	0.263	C	S	.	.	H	α-helix	trans	-56.3	-48	167.2	-73.3	0	0	0	0	111.3	L982 T983 F988 I989 H990 L1026	L982-C986 PolarHBondContact O-N 3.45Å; L982-C986 PolarHBondContact O-SG 3.16Å; L982-C986 VanDerWaalsContact O-SG 3.33Å; T983-C986 PolarHBondContact O-N 2.93Å; C986-F988 VanDerWaalsContact C-N 3.34Å; C986-F988 PolarHBondContact O-N 3.47Å; C986-I989 PolarHBondContact O-N 3.31Å; C986-H990 PolarHBondContact O-CD2 3.31Å; C986-H990 PolarHBondContact O-N 3.13Å; C986-L1026 WeakPolarHBondContact SG-CD2 3.39Å
987	Q	90.7	Very high	90.8	Very high	74 Å²	74	50.4 Å²	50.4	35%	0.346	26%	0.263	S	S	.	.	H	α-helix	trans	-62.4	-39.2	177	-174.5	178.6	-22.6	0	0	112.2	L965 T983 L984 V985 H990 Q991	L965-Q987 HydrophobicContact CD1-CG 4.15Å; T983-Q987 PolarHBondContact O-N 3.1Å; L984-Q987 CarbonylContact O-C 3.55Å; L984-Q987 PolarHBondContact O-N 3.01Å; V985-Q987 VanDerWaalsContact C-N 3.34Å; V985-Q987 PolarHBondContact O-N 3.06Å; Q987-H990 PolarHBondContact O-N 3.34Å; Q987-Q991 WeakPolarHBondContact O-CB 3.49Å; Q987-Q991 PolarHBondContact O-N 3.13Å
988	F	94.1	Very high	91.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.1	-48.5	175.7	-175.1	-117.8	0	0	0	111.6	I958 L961 W962 L965 L984 V985 C986 Q991 H992 I996 L1005	I958-F988 HydrophobicContact CG2-CZ 4.39Å; L961-F988 HydrophobicContact CB-CE2 3.66Å; L961-F988 HydrophobicContact CB-CZ 4.01Å; W962-F988 HydrophobicContact CB-CE2 4.2Å; W962-F988 HydrophobicContact CB-CZ 4.35Å; W962-F988 HydrophobicContact CE3-CB 4.16Å; W962-F988 HydrophobicContact CE3-CD1 4.15Å; W962-F988 AromaticContact CE3-CD2 3.87Å; W962-F988 HydrophobicContact CE3-CD2 3.87Å; W962-F988 HydrophobicContact CE3-CE2 4.26Å; W962-F988 AromaticContact CE3-CG 3.82Å; W962-F988 HydrophobicContact CE3-CG 3.82Å; W962-F988 HydrophobicContact CZ3-CB 3.94Å; W962-F988 HydrophobicContact CZ3-CD1 4.49Å; W962-F988 HydrophobicContact CZ3-CG 4.1Å; L965-F988 HydrophobicContact CB-CD2 4.36Å; L965-F988 HydrophobicContact CD2-CB 3.6Å; L965-F988 HydrophobicContact CD2-CD2 3.9Å; L965-F988 HydrophobicContact CD2-CG 4.22Å; L984-F988 WeakPolarHBondContact O-CB 3.35Å; L984-F988 PolarHBondContact O-N 2.91Å; V985-F988 WeakPolarHBondContact O-CB 3.41Å; V985-F988 PolarHBondContact O-N 3.42Å; C986-F988 VanDerWaalsContact C-N 3.34Å; C986-F988 PolarHBondContact O-N 3.47Å; F988-Q991 PolarHBondContact O-N 2.85Å; F988-H992 AromaticContact CD2-CD2 3.61Å; F988-H992 AromaticContact CE2-CD2 3.86Å; F988-H992 WeakPolarHBondContact O-CB 3.38Å; F988-H992 PolarHBondContact O-N 3.36Å; F988-I996 HydrophobicContact CE1-CD1 4.07Å; F988-I996 HydrophobicContact CZ-CD1 4.3Å; F988-L1005 HydrophobicContact CD1-CD1 4.13Å; F988-L1005 HydrophobicContact CE1-CD1 3.83Å
989	I	94.6	Very high	91.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-46.9	177.8	-68.8	172.8	0	0	0	110.7	V985 C986 Q991 S993 L1005 L1026 I1029 Y1030	V985-I989 HydrophobicContact CG1-CD1 4.22Å; V985-I989 WeakPolarHBondContact O-CG1 3.32Å; V985-I989 PolarHBondContact O-N 3.43Å; C986-I989 PolarHBondContact O-N 3.31Å; I989-Q991 VanDerWaalsContact C-N 3.31Å; I989-Q991 PolarHBondContact O-N 3.48Å; I989-S993 WeakPolarHBondContact O-CA 3.37Å; I989-S993 WeakPolarHBondContact O-CB 3.3Å; I989-S993 PolarHBondContact O-N 2.85Å; I989-S993 PolarHBondContact O-OG 2.94Å; I989-L1005 HydrophobicContact CG1-CD2 4.49Å; I989-L1026 HydrophobicContact CD1-CB 3.92Å; I989-L1026 HydrophobicContact CD1-CD2 4.06Å; I989-L1026 WeakPolarHBondContact CD1-O 3.23Å; I989-I1029 HydrophobicContact CG2-CG2 4.1Å; I989-Y1030 HydrophobicContact CG2-CD2 4.33Å
990	H	90.9	Very high	91.9	Very high	83 Å²	83	66 Å²	66	38%	0.384	28%	0.28	S	S	.	.	H	α-helix	trans	-59.1	-39.4	176	-71.8	-52.6	0	0	0	112.9	C986 Q987 H1033	C986-H990 PolarHBondContact O-CD2 3.31Å; C986-H990 PolarHBondContact O-N 3.13Å; Q987-H990 PolarHBondContact O-N 3.34Å; H990-H1033 AromaticContact CE1-NE2 3.37Å; H990-H1033 PolarHBondContact CE1-NE2 2.91Å; H990-H1033 AromaticContact ND1-CD2 3.5Å; H990-H1033 PolarHBondContact ND1-CD2 2.88Å; H990-H1033 AromaticContact ND1-CE1 3.94Å; H990-H1033 AromaticContact ND1-NE2 2.84Å; H990-H1033 PolarHBondContact ND1-NE2 3.23Å
991	Q	90.3	Very high	92.2	Very high	91 Å²	91	63.2 Å²	63.2	43%	0.425	27%	0.267	S	S	.	.	H	α-helix	trans	-82.2	-32	-176.1	-170	171.2	-70.1	0	0	113.4	Q987 F988 I989	Q987-Q991 WeakPolarHBondContact O-CB 3.49Å; Q987-Q991 PolarHBondContact O-N 3.13Å; F988-Q991 PolarHBondContact O-N 2.85Å; I989-Q991 VanDerWaalsContact C-N 3.31Å; I989-Q991 PolarHBondContact O-N 3.48Å
992	H	93.2	Very high	92.4	Very high	25 Å²	25	67.5 Å²	67.5	12%	0.116	28%	0.282	C	S	.	.	H	α-helix	trans	-120.4	-8.2	-168.6	-63.2	-73.5	0	0	0	115.9	L961 F988 R994 W995 I996	L961-H992 HydrophobicContact CD1-CB 4.13Å; F988-H992 AromaticContact CD2-CD2 3.61Å; F988-H992 AromaticContact CE2-CD2 3.86Å; F988-H992 WeakPolarHBondContact O-CB 3.38Å; F988-H992 PolarHBondContact O-N 3.36Å; H992-R994 VanDerWaalsContact C-N 3.3Å; H992-R994 PolarHBondContact O-N 2.95Å; H992-W995 PolarHBondContact O-N 3.13Å; H992-I996 HydrophobicContact CB-CD1 3.93Å; H992-I996 HydrophobicContact CB-CG1 4.3Å; H992-I996 WeakPolarHBondContact O-CG1 3.42Å; H992-I996 PolarHBondContact O-N 2.78Å
993	S	91.9	Very high	92.6	Very high	3 Å²	3	70.2 Å²	70.2	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-44	-51.1	176.5	48	0	0	0	0	113.5	I989 W995 I996 H997	I989-S993 WeakPolarHBondContact O-CA 3.37Å; I989-S993 WeakPolarHBondContact O-CB 3.3Å; I989-S993 PolarHBondContact O-N 2.85Å; I989-S993 PolarHBondContact O-OG 2.94Å; S993-W995 PolarHBondContact O-N 3.41Å; S993-W995 VanDerWaalsContact O-N 3.16Å; S993-I996 PolarHBondContact O-N 3.27Å; S993-H997 VanDerWaalsContact O-CB 3.3Å; S993-H997 WeakPolarHBondContact O-CB 3.24Å; S993-H997 PolarHBondContact O-N 2.75Å
994	R	91.8	Very high	92.8	Very high	167 Å²	167	68.4 Å²	68.4	63%	0.63	29%	0.288	S	S	*	.	H	α-helix	trans	-50.8	-37.6	176.3	-71.3	177.9	179.7	-134.5	-14	113.7	H992 R998 L1037	H992-R994 VanDerWaalsContact C-N 3.3Å; H992-R994 PolarHBondContact O-N 2.95Å; R994-R998 WeakPolarHBondContact O-CB 3.37Å; R994-R998 WeakPolarHBondContact O-CD 3.44Å; R994-R998 WeakPolarHBondContact O-CG 3.46Å; R994-R998 PolarHBondContact O-N 3.31Å; R994-L1037 HydrophobicContact CB-CD1 4.24Å; R994-L1037 HydrophobicContact CG-CD1 3.51Å; R994-L1037 HydrophobicContact CG-CD2 3.63Å; R994-L1037 HydrophobicContact CG-CG 4.22Å
995	W	92	Very high	93	Very high	90 Å²	90	67.8 Å²	67.8	34%	0.341	29%	0.285	S	S	.	.	H	α-helix	trans	-87.6	-43.7	-175.8	-168.1	101.9	0	0	0	111.3	Q957 L961 H992 S993 H997 R998 R999 L1001	Q957-W995 HydrophobicContact CB-CH2 3.91Å; Q957-W995 HydrophobicContact CB-CZ3 4.04Å; Q957-W995 HydrophobicContact CG-CH2 3.94Å; Q957-W995 HydrophobicContact CG-CZ3 4.5Å; Q957-W995 VanDerWaalsContact OE1-CH2 3.27Å; L961-W995 HydrophobicContact CD1-CD2 4.16Å; L961-W995 HydrophobicContact CD1-CE3 3.49Å; L961-W995 VanDerWaalsContact CD1-CE3 3.49Å; L961-W995 HydrophobicContact CD1-CH2 4.33Å; L961-W995 HydrophobicContact CD1-CZ3 3.58Å; L961-W995 HydrophobicContact CG-CE3 4.49Å; L961-W995 HydrophobicContact CG-CZ3 4.24Å; H992-W995 PolarHBondContact O-N 3.13Å; S993-W995 PolarHBondContact O-N 3.41Å; S993-W995 VanDerWaalsContact O-N 3.16Å; W995-H997 VanDerWaalsContact C-N 3.32Å; W995-H997 PolarHBondContact O-N 3.44Å; W995-R998 PolarHBondContact O-N 3.13Å; W995-R999 HydrophobicContact CE3-CG 4.49Å; W995-R999 PolarHBondContact O-N 3.17Å; W995-L1001 HydrophobicContact CE3-CD1 4.22Å; W995-L1001 HydrophobicContact CH2-CD1 4.49Å; W995-L1001 HydrophobicContact CZ3-CD1 3.59Å
996	I	94.8	Very high	93.1	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-57.1	-45.8	174.8	-66.6	169.9	0	0	0	110	I958 L961 F988 H992 S993 R999 R1000 L1001 L1005 Y1030	I958-I996 HydrophobicContact CD1-CD1 4.18Å; I958-I996 HydrophobicContact CD1-CG1 4.11Å; L961-I996 HydrophobicContact CD1-CG1 4.36Å; F988-I996 HydrophobicContact CE1-CD1 4.07Å; F988-I996 HydrophobicContact CZ-CD1 4.3Å; H992-I996 HydrophobicContact CB-CD1 3.93Å; H992-I996 HydrophobicContact CB-CG1 4.3Å; H992-I996 WeakPolarHBondContact O-CG1 3.42Å; H992-I996 PolarHBondContact O-N 2.78Å; S993-I996 PolarHBondContact O-N 3.27Å; I996-R999 CarbonylContact O-C 3.52Å; I996-R999 PolarHBondContact O-N 3Å; I996-R1000 PolarHBondContact O-N 2.89Å; I996-R1000 VanDerWaalsContact O-N 3.15Å; I996-L1001 HydrophobicContact CG2-CB 3.93Å; I996-L1001 PolarHBondContact O-N 2.99Å; I996-L1005 HydrophobicContact CD1-CD1 4.42Å; I996-L1005 HydrophobicContact CD1-CD2 4.37Å; I996-L1005 HydrophobicContact CG2-CB 4.18Å; I996-L1005 HydrophobicContact CG2-CD2 4.25Å; I996-Y1030 HydrophobicContact CB-CE2 4.09Å; I996-Y1030 HydrophobicContact CG2-CE2 3.69Å
997	H	93.1	Very high	93.2	Very high	66 Å²	66	73.9 Å²	73.9	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-62.9	-50.9	176.4	177.7	59.9	0	0	0	112.5	S993 W995 R999 R1000 Y1030 V1034	S993-H997 VanDerWaalsContact O-CB 3.3Å; S993-H997 WeakPolarHBondContact O-CB 3.24Å; S993-H997 PolarHBondContact O-N 2.75Å; W995-H997 VanDerWaalsContact C-N 3.32Å; W995-H997 PolarHBondContact O-N 3.44Å; H997-R999 PolarHBondContact O-N 2.93Å; H997-R1000 PolarHBondContact O-N 2.8Å; H997-Y1030 WeakPolarHBondContact CA-OH 3.44Å; H997-Y1030 PolarHBondContact N-OH 3.33Å; H997-V1034 HydrophobicContact CB-CG2 3.87Å; H997-V1034 VanDerWaalsContact CE1-CG1 3.45Å; H997-V1034 WeakPolarHBondContact CE1-CG1 3.36Å; H997-V1034 WeakPolarHBondContact ND1-CG1 3.36Å
998	R	92	Very high	93.4	Very high	215 Å²	215	72 Å²	72	81%	0.811	31%	0.307	S	S	*	.	H	α-helix	trans	-59.3	-29.4	179.1	-78.1	175	178.2	-172.8	-2.4	113.6	R994 W995	R994-R998 WeakPolarHBondContact O-CB 3.37Å; R994-R998 WeakPolarHBondContact O-CD 3.44Å; R994-R998 WeakPolarHBondContact O-CG 3.46Å; R994-R998 PolarHBondContact O-N 3.31Å; W995-R998 PolarHBondContact O-N 3.13Å
999	R	92.3	Very high	93.5	Very high	144 Å²	144	72 Å²	72	54%	0.543	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	10.7	174.9	-66.5	-160.1	169.3	-154.6	-7.2	114.2	W995 I996 H997 L1001	W995-R999 HydrophobicContact CE3-CG 4.49Å; W995-R999 PolarHBondContact O-N 3.17Å; I996-R999 CarbonylContact O-C 3.52Å; I996-R999 PolarHBondContact O-N 3Å; H997-R999 PolarHBondContact O-N 2.93Å; R999-L1001 HydrophobicContact CB-CD1 3.98Å; R999-L1001 HydrophobicContact CB-CG 3.86Å; R999-L1001 PolarHBondContact O-N 2.79Å
1000	R	93.2	Very high	93.5	Very high	228 Å²	228	74.6 Å²	74.6	86%	0.86	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	25.6	179.9	-57.4	-176.4	177.3	-173.2	-1.7	114.3	I996 H997 R1002	I996-R1000 PolarHBondContact O-N 2.89Å; I996-R1000 VanDerWaalsContact O-N 3.15Å; H997-R1000 PolarHBondContact O-N 2.8Å; R1000-R1002 PolarHBondContact O-N 2.89Å; R1000-R1002 VanDerWaalsContact O-N 3.13Å
1001	L	94.5	Very high	93.7	Very high	9 Å²	9	74.5 Å²	74.5	5%	0.047	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	18.9	-173.8	-61.6	177.3	0	0	0	114.4	Q957 I958 W995 I996 R999 T1003 N1004 L1005	Q957-L1001 HydrophobicContact CB-CD1 3.8Å; I958-L1001 HydrophobicContact CD1-CB 4.28Å; I958-L1001 HydrophobicContact CD1-CD1 4.43Å; W995-L1001 HydrophobicContact CE3-CD1 4.22Å; W995-L1001 HydrophobicContact CH2-CD1 4.49Å; W995-L1001 HydrophobicContact CZ3-CD1 3.59Å; I996-L1001 HydrophobicContact CG2-CB 3.93Å; I996-L1001 PolarHBondContact O-N 2.99Å; R999-L1001 HydrophobicContact CB-CD1 3.98Å; R999-L1001 HydrophobicContact CB-CG 3.86Å; R999-L1001 PolarHBondContact O-N 2.79Å; L1001-T1003 VanDerWaalsContact C-N 3.31Å; L1001-T1003 PolarHBondContact O-N 2.9Å; L1001-N1004 PolarHBondContact O-N 3.26Å; L1001-N1004 VanDerWaalsContact O-N 3.16Å; L1001-L1005 PolarHBondContact O-N 3.37Å
1002	R	94.7	Very high	93.9	Very high	100 Å²	100	70.9 Å²	70.9	38%	0.377	31%	0.309	S	S	.	.	H	α-helix	trans	-57.8	-40.3	-177.1	-173.9	-179.7	-178.3	-82	3.8	112.5	R1000 L1005 L1006 M1027 Y1030 D1031	R1000-R1002 PolarHBondContact O-N 2.89Å; R1000-R1002 VanDerWaalsContact O-N 3.13Å; R1002-L1005 PolarHBondContact O-N 3.31Å; R1002-L1006 WeakPolarHBondContact O-CB 3.47Å; R1002-L1006 PolarHBondContact O-N 3.49Å; R1002-M1027 HydrophobicContact CG-CE 3.98Å; R1002-Y1030 HydrophobicContact CB-CE1 4.2Å; R1002-Y1030 HydrophobicContact CG-CD1 4.34Å; R1002-Y1030 HydrophobicContact CG-CE1 3.66Å; R1002-D1031 IonicContact CZ-OD1 3.51Å; R1002-D1031 IonicContact CZ-OD2 3.58Å; R1002-D1031 IonicContact NE-OD1 2.78Å; R1002-D1031 PolarHBondContact NE-OD1 2.64Å; R1002-D1031 IonicContact NE-OD2 3.65Å; R1002-D1031 IonicContact NH2-OD1 3.4Å; R1002-D1031 PolarHBondContact NH2-OD1 2.93Å; R1002-D1031 IonicContact NH2-OD2 2.69Å; R1002-D1031 PolarHBondContact NH2-OD2 3.13Å
1003	T	94.8	Very high	93.9	Very high	91 Å²	91	71.1 Å²	71.1	56%	0.558	31%	0.312	S	S	*	.	H	α-helix	trans	-66.9	-42.4	177.6	-41	0	0	0	0	111.6	L1001 L1005 L1006 L1007	L1001-T1003 VanDerWaalsContact C-N 3.31Å; L1001-T1003 PolarHBondContact O-N 2.9Å; T1003-L1005 VanDerWaalsContact C-N 3.34Å; T1003-L1005 PolarHBondContact O-N 3.37Å; T1003-L1006 PolarHBondContact O-N 3.29Å; T1003-L1007 HydrophobicContact CG2-CD1 4.34Å; T1003-L1007 WeakPolarHBondContact O-CG 3.34Å; T1003-L1007 PolarHBondContact O-N 2.94Å
1004	N	94.5	Very high	94.1	Very high	29 Å²	29	76.6 Å²	76.6	16%	0.155	34%	0.341	C	S	.	.	H	α-helix	trans	-67.5	-34	177.5	-60.9	-64.3	0	0	0	112.1	I958 L1001 H1008	I958-N1004 HydrophobicContact CG1-CB 3.78Å; L1001-N1004 PolarHBondContact O-N 3.26Å; L1001-N1004 VanDerWaalsContact O-N 3.16Å; N1004-H1008 WeakPolarHBondContact O-CB 3.49Å; N1004-H1008 PolarHBondContact O-N 2.95Å; N1004-H1008 VanDerWaalsContact O-N 3.09Å
1005	L	95.1	Very high	94.2	Very high	0 Å²	0	77.4 Å²	77.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-62.2	-50.4	168.5	173.4	64.6	0	0	0	110.6	I958 F988 I989 I996 L1001 R1002 T1003 L1007 H1008 L1009 M1027 Y1030	I958-L1005 HydrophobicContact CD1-CB 4.37Å; F988-L1005 HydrophobicContact CD1-CD1 4.13Å; F988-L1005 HydrophobicContact CE1-CD1 3.83Å; I989-L1005 HydrophobicContact CG1-CD2 4.49Å; I996-L1005 HydrophobicContact CD1-CD1 4.42Å; I996-L1005 HydrophobicContact CD1-CD2 4.37Å; I996-L1005 HydrophobicContact CG2-CB 4.18Å; I996-L1005 HydrophobicContact CG2-CD2 4.25Å; L1001-L1005 PolarHBondContact O-N 3.37Å; R1002-L1005 PolarHBondContact O-N 3.31Å; T1003-L1005 VanDerWaalsContact C-N 3.34Å; T1003-L1005 PolarHBondContact O-N 3.37Å; L1005-L1007 PolarHBondContact O-N 3.32Å; L1005-H1008 WeakPolarHBondContact O-CB 3.41Å; L1005-H1008 PolarHBondContact O-N 2.8Å; L1005-L1009 HydrophobicContact CD1-CD2 4.43Å; L1005-L1009 HydrophobicContact CD1-CG 4.39Å; L1005-L1009 WeakPolarHBondContact O-CG 3.49Å; L1005-L1009 PolarHBondContact O-N 3.29Å; L1005-M1027 HydrophobicContact CD2-SD 4.45Å; L1005-Y1030 HydrophobicContact CD2-CD1 4.45Å; L1005-Y1030 HydrophobicContact CD2-CD2 3.43Å; L1005-Y1030 VanDerWaalsContact CD2-CD2 3.43Å; L1005-Y1030 HydrophobicContact CD2-CE2 3.78Å; L1005-Y1030 HydrophobicContact CD2-CG 3.81Å
1006	L	95.6	Very high	94.2	Very high	55 Å²	55	76.2 Å²	76.2	29%	0.288	36%	0.361	S	S	.	.	H	α-helix	trans	-58.7	-46	179.9	176.8	60.6	0	0	0	112	R1002 T1003 H1008 L1009 V1010 L1023 M1027	R1002-L1006 WeakPolarHBondContact O-CB 3.47Å; R1002-L1006 PolarHBondContact O-N 3.49Å; T1003-L1006 PolarHBondContact O-N 3.29Å; L1006-H1008 VanDerWaalsContact C-N 3.35Å; L1006-H1008 PolarHBondContact O-N 3.02Å; L1006-L1009 WeakPolarHBondContact O-CB 3.44Å; L1006-L1009 PolarHBondContact O-N 3.49Å; L1006-L1009 VanDerWaalsContact O-N 3.08Å; L1006-V1010 WeakPolarHBondContact O-CG2 3.25Å; L1006-V1010 PolarHBondContact O-N 3.25Å; L1006-L1023 HydrophobicContact CD1-CD2 3.89Å; L1006-M1027 HydrophobicContact CB-SD 4.37Å; L1006-M1027 HydrophobicContact CD1-CG 3.97Å; L1006-M1027 HydrophobicContact CD1-SD 4.2Å
1007	L	94.3	Very high	94.1	Very high	82 Å²	82	78.9 Å²	78.9	43%	0.429	38%	0.375	S	S	.	.	H	α-helix	trans	-58.9	-44.2	175.4	-71.3	166.7	0	0	0	111.5	T1003 L1005 L1009 V1010 N1011	T1003-L1007 HydrophobicContact CG2-CD1 4.34Å; T1003-L1007 WeakPolarHBondContact O-CG 3.34Å; T1003-L1007 PolarHBondContact O-N 2.94Å; L1005-L1007 PolarHBondContact O-N 3.32Å; L1007-L1009 VanDerWaalsContact C-N 3.29Å; L1007-L1009 PolarHBondContact O-N 2.97Å; L1007-V1010 PolarHBondContact O-N 3.37Å; L1007-V1010 VanDerWaalsContact O-N 3.17Å; L1007-N1011 PolarHBondContact O-N 3.05Å; L1007-N1011 PolarHBondContact O-OD1 3.31Å
1008	H	94.3	Very high	94.1	Very high	35 Å²	35	76.2 Å²	76.2	16%	0.162	36%	0.363	C	S	.	.	H	α-helix	trans	-61.1	-36.8	173.9	177.4	37.7	0	0	0	112.7	I958 W962 N1004 L1005 L1006 L1012	I958-H1008 HydrophobicContact CG2-CB 3.92Å; W962-H1008 AromaticContact CD2-NE2 3.54Å; W962-H1008 AromaticContact CE2-NE2 3.88Å; W962-H1008 AromaticContact CE3-NE2 3.84Å; W962-H1008 AromaticContact CG-NE2 3.75Å; N1004-H1008 WeakPolarHBondContact O-CB 3.49Å; N1004-H1008 PolarHBondContact O-N 2.95Å; N1004-H1008 VanDerWaalsContact O-N 3.09Å; L1005-H1008 WeakPolarHBondContact O-CB 3.41Å; L1005-H1008 PolarHBondContact O-N 2.8Å; L1006-H1008 VanDerWaalsContact C-N 3.35Å; L1006-H1008 PolarHBondContact O-N 3.02Å; H1008-L1012 WeakPolarHBondContact O-CG 3.28Å; H1008-L1012 PolarHBondContact O-N 3.37Å; H1008-L1012 VanDerWaalsContact O-N 3.17Å
1009	L	95.1	Very high	94.2	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-69.5	-35.7	174.3	-60.9	-167.8	0	0	0	112.9	V985 L1005 L1006 L1007 L1012 V1013 L1018 L1023 L1026 M1027	V985-L1009 HydrophobicContact CG1-CD2 3.42Å; V985-L1009 VanDerWaalsContact CG1-CD2 3.42Å; L1005-L1009 HydrophobicContact CD1-CD2 4.43Å; L1005-L1009 HydrophobicContact CD1-CG 4.39Å; L1005-L1009 WeakPolarHBondContact O-CG 3.49Å; L1005-L1009 PolarHBondContact O-N 3.29Å; L1006-L1009 WeakPolarHBondContact O-CB 3.44Å; L1006-L1009 PolarHBondContact O-N 3.49Å; L1006-L1009 VanDerWaalsContact O-N 3.08Å; L1007-L1009 VanDerWaalsContact C-N 3.29Å; L1007-L1009 PolarHBondContact O-N 2.97Å; L1009-L1012 HydrophobicContact CD2-CD1 4.37Å; L1009-L1012 PolarHBondContact O-N 3.08Å; L1009-V1013 PolarHBondContact O-N 3.35Å; L1009-V1013 VanDerWaalsContact O-N 3.16Å; L1009-L1018 HydrophobicContact CD2-CD1 4.44Å; L1009-L1023 HydrophobicContact CB-CD1 4.03Å; L1009-L1023 HydrophobicContact CB-CG 4.03Å; L1009-L1026 HydrophobicContact CD1-CB 3.94Å; L1009-L1026 HydrophobicContact CD1-CD1 4.47Å; L1009-M1027 HydrophobicContact CD1-CG 4.15Å; L1009-M1027 HydrophobicContact CD1-SD 3.85Å
1010	V	96.1	Very high	94.2	Very high	54 Å²	54	65.2 Å²	65.2	33%	0.327	34%	0.341	S	S	.	.	H	α-helix	trans	-61.5	-51.1	173.2	172.2	0	0	0	0	109.6	L1006 L1007 L1012 V1013 D1014 L1023	L1006-V1010 WeakPolarHBondContact O-CG2 3.25Å; L1006-V1010 PolarHBondContact O-N 3.25Å; L1007-V1010 PolarHBondContact O-N 3.37Å; L1007-V1010 VanDerWaalsContact O-N 3.17Å; V1010-L1012 PolarHBondContact O-N 2.97Å; V1010-L1012 VanDerWaalsContact O-N 3.12Å; V1010-V1013 CarbonylContact O-C 3.48Å; V1010-V1013 WeakPolarHBondContact O-CA 3.38Å; V1010-V1013 WeakPolarHBondContact O-CB 3.44Å; V1010-V1013 PolarHBondContact O-N 3.46Å; V1010-D1014 WeakPolarHBondContact CG1-OD2 3.47Å; V1010-D1014 VanDerWaalsContact O-CG 3.3Å; V1010-D1014 PolarHBondContact O-N 3.1Å; V1010-L1023 HydrophobicContact CB-CD1 4.42Å; V1010-L1023 HydrophobicContact CG2-CD1 3.76Å
1011	N	94.3	Very high	94.3	Very high	81 Å²	81	57.5 Å²	57.5	43%	0.433	32%	0.322	S	S	.	.	H	α-helix	trans	-56.1	-35.5	177	-62	12.5	0	0	0	112.3	L1007 V1013 D1014 Y1015	L1007-N1011 PolarHBondContact O-N 3.05Å; L1007-N1011 PolarHBondContact O-OD1 3.31Å; N1011-V1013 VanDerWaalsContact C-N 3.34Å; N1011-D1014 PolarHBondContact O-N 3.19Å; N1011-Y1015 WeakPolarHBondContact O-CD2 3.35Å; N1011-Y1015 PolarHBondContact O-N 3.09Å
1012	L	93.9	Very high	94.3	Very high	14 Å²	14	59.8 Å²	59.8	7%	0.073	33%	0.332	C	S	.	.	H	α-helix	trans	-71.2	-24.3	175	-72.1	175.7	0	0	0	113.7	V981 V985 H1008 L1009 V1010 L1017 L1018	V981-L1012 HydrophobicContact CG1-CD2 4.5Å; V985-L1012 HydrophobicContact CG2-CD1 3.75Å; H1008-L1012 WeakPolarHBondContact O-CG 3.28Å; H1008-L1012 PolarHBondContact O-N 3.37Å; H1008-L1012 VanDerWaalsContact O-N 3.17Å; L1009-L1012 HydrophobicContact CD2-CD1 4.37Å; L1009-L1012 PolarHBondContact O-N 3.08Å; V1010-L1012 PolarHBondContact O-N 2.97Å; V1010-L1012 VanDerWaalsContact O-N 3.12Å; L1012-L1017 HydrophobicContact CD2-CD1 3.91Å; L1012-L1017 CarbonylContact O-C 3.58Å; L1012-L1017 WeakPolarHBondContact O-CA 3.49Å; L1012-L1017 WeakPolarHBondContact O-CB 3.45Å; L1012-L1017 PolarHBondContact O-N 3.19Å; L1012-L1018 HydrophobicContact CB-CD1 3.72Å; L1012-L1018 HydrophobicContact CB-CG 4.04Å; L1012-L1018 HydrophobicContact CD1-CD1 4.09Å; L1012-L1018 PolarHBondContact O-N 3.49Å
1013	V	94.7	Very high	94.3	Very high	30 Å²	30	56.5 Å²	56.5	18%	0.182	32%	0.322	C	S	.	.	H	α-helix	trans	-75.9	-41.5	167.9	176	0	0	0	0	110.5	L1009 V1010 N1011 Y1015 G1016 L1018 L1023	L1009-V1013 PolarHBondContact O-N 3.35Å; L1009-V1013 VanDerWaalsContact O-N 3.16Å; V1010-V1013 CarbonylContact O-C 3.48Å; V1010-V1013 WeakPolarHBondContact O-CA 3.38Å; V1010-V1013 WeakPolarHBondContact O-CB 3.44Å; V1010-V1013 PolarHBondContact O-N 3.46Å; N1011-V1013 VanDerWaalsContact C-N 3.34Å; V1013-Y1015 VanDerWaalsContact C-N 3.3Å; V1013-Y1015 PolarHBondContact O-N 3.45Å; V1013-G1016 WeakPolarHBondContact O-CA 3.33Å; V1013-G1016 PolarHBondContact O-N 2.87Å; V1013-L1018 WeakPolarHBondContact CA-O 3.32Å; V1013-L1018 HydrophobicContact CG2-CB 3.73Å; V1013-L1023 HydrophobicContact CG2-CB 3.99Å; V1013-L1023 HydrophobicContact CG2-CD1 3.86Å
1014	D	95.4	Very high	94.2	Very high	118 Å²	118	61 Å²	61	63%	0.631	33%	0.329	S	S	*	.	H	α-helix	trans	-63.9	-34.7	179.7	-56.2	-31.9	0	0	0	112.3	V1010 N1011 G1016	V1010-D1014 WeakPolarHBondContact CG1-OD2 3.47Å; V1010-D1014 VanDerWaalsContact O-CG 3.3Å; V1010-D1014 PolarHBondContact O-N 3.1Å; N1011-D1014 PolarHBondContact O-N 3.19Å; D1014-G1016 PolarHBondContact O-N 2.89Å
1015	Y	93.3	Very high	94.2	Very high	184 Å²	184	63 Å²	63	72%	0.722	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	4.8	170	-71.8	-59.4	0	0	0	114.4	N1011 V1013 L1017	N1011-Y1015 WeakPolarHBondContact O-CD2 3.35Å; N1011-Y1015 PolarHBondContact O-N 3.09Å; V1013-Y1015 VanDerWaalsContact C-N 3.3Å; V1013-Y1015 PolarHBondContact O-N 3.45Å; Y1015-L1017 PolarHBondContact O-N 2.96Å
1016	G	92.7	Very high	94.2	Very high	65 Å²	65	63 Å²	63	67%	0.67	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	8.3	178.1	0	0	0	0	0	115.6	V1013 D1014	V1013-G1016 WeakPolarHBondContact O-CA 3.33Å; V1013-G1016 PolarHBondContact O-N 2.87Å; D1014-G1016 PolarHBondContact O-N 2.89Å
1017	L	92.3	Very high	94.2	Very high	56 Å²	56	61 Å²	61	29%	0.293	33%	0.327	S	S	.	.	S	Bend	trans	-83.1	-17	-178.4	-58.7	176	0	0	0	112.9	D978 V981 L1012 Y1015	D978-L1017 HydrophobicContact CB-CD2 3.97Å; V981-L1017 HydrophobicContact CB-CB 4.45Å; V981-L1017 HydrophobicContact CG1-CB 4.13Å; V981-L1017 HydrophobicContact CG2-CB 4.47Å; L1012-L1017 HydrophobicContact CD2-CD1 3.91Å; L1012-L1017 CarbonylContact O-C 3.58Å; L1012-L1017 WeakPolarHBondContact O-CA 3.49Å; L1012-L1017 WeakPolarHBondContact O-CB 3.45Å; L1012-L1017 PolarHBondContact O-N 3.19Å; Y1015-L1017 PolarHBondContact O-N 2.96Å
1018	L	93.6	Very high	94.3	Very high	11 Å²	11	62.4 Å²	62.4	6%	0.058	33%	0.334	C	S	.	.	S	Bend	trans	-133.7	160.2	172.9	-65.8	179	0	0	0	110	L982 L1009 L1012 V1013 H1022 L1026	L982-L1018 HydrophobicContact CB-CD2 4.09Å; L982-L1018 HydrophobicContact CD1-CD2 4.02Å; L1009-L1018 HydrophobicContact CD2-CD1 4.44Å; L1012-L1018 HydrophobicContact CB-CD1 3.72Å; L1012-L1018 HydrophobicContact CB-CG 4.04Å; L1012-L1018 HydrophobicContact CD1-CD1 4.09Å; L1012-L1018 PolarHBondContact O-N 3.49Å; V1013-L1018 WeakPolarHBondContact CA-O 3.32Å; V1013-L1018 HydrophobicContact CG2-CB 3.73Å; L1018-H1022 HydrophobicContact CB-CB 4.41Å; L1018-H1022 HydrophobicContact CD2-CB 4.25Å; L1018-L1026 HydrophobicContact CD1-CD1 3.79Å; L1018-L1026 HydrophobicContact CD2-CD1 4.22Å
1019	S	93.6	Very high	94.2	Very high	39 Å²	39	62.9 Å²	62.9	27%	0.273	34%	0.337	S	S	.	.			trans	-100.8	162	168.2	69	0	0	0	0	110.7	S1021 H1022 L1023	S1019-S1021 PolarHBondContact O-N 2.9Å; S1019-S1021 PolarHBondContact OG-OG 3.02Å; S1019-H1022 PolarHBondContact N-ND1 3.44Å; S1019-H1022 WeakPolarHBondContact O-CB 3.38Å; S1019-H1022 PolarHBondContact O-N 3.49Å; S1019-H1022 PolarHBondContact OG-CD2 3.17Å; S1019-H1022 PolarHBondContact OG-N 2.86Å; S1019-H1022 VanDerWaalsContact OG-N 3.1Å; S1019-H1022 PolarHBondContact OG-ND1 3.46Å; S1019-L1023 PolarHBondContact O-N 3.06Å
1020	S	93.1	Very high	94.2	Very high	89 Å²	89	63 Å²	63	62%	0.622	34%	0.337	S	S	*	.	H	α-helix	trans	-60.7	-25	174.4	-39.7	0	0	0	0	113	R1024	S1020-R1024 PolarHBondContact O-N 3.28Å
1021	S	94.2	Very high	94	Very high	66 Å²	66	62.3 Å²	62.3	46%	0.462	33%	0.332	S	S	.	.	H	α-helix	trans	-75	-41.7	171.9	60	0	0	0	0	111.9	S1019 L1023 R1024 Q1025	S1019-S1021 PolarHBondContact O-N 2.9Å; S1019-S1021 PolarHBondContact OG-OG 3.02Å; S1021-L1023 PolarHBondContact O-N 2.98Å; S1021-R1024 PolarHBondContact O-N 3.12Å; S1021-Q1025 VanDerWaalsContact O-CG 3.32Å; S1021-Q1025 WeakPolarHBondContact O-CG 3.01Å; S1021-Q1025 PolarHBondContact O-N 3.39Å
1022	H	93.9	Very high	93.9	Very high	57 Å²	57	64.5 Å²	64.5	26%	0.264	34%	0.338	S	S	.	.	H	α-helix	trans	-60	-45.1	173.4	-63	162.4	0	0	0	111.4	L982 L1018 S1019 R1024 Q1025 L1026	L982-H1022 HydrophobicContact CD1-CB 3.95Å; L1018-H1022 HydrophobicContact CB-CB 4.41Å; L1018-H1022 HydrophobicContact CD2-CB 4.25Å; S1019-H1022 PolarHBondContact N-ND1 3.44Å; S1019-H1022 WeakPolarHBondContact O-CB 3.38Å; S1019-H1022 PolarHBondContact O-N 3.49Å; S1019-H1022 PolarHBondContact OG-CD2 3.17Å; S1019-H1022 PolarHBondContact OG-N 2.86Å; S1019-H1022 VanDerWaalsContact OG-N 3.1Å; S1019-H1022 PolarHBondContact OG-ND1 3.46Å; H1022-R1024 VanDerWaalsContact C-N 3.32Å; H1022-R1024 PolarHBondContact O-N 2.81Å; H1022-Q1025 PolarHBondContact O-N 3.01Å; H1022-L1026 WeakPolarHBondContact O-CB 3.5Å; H1022-L1026 WeakPolarHBondContact O-CD1 3.33Å; H1022-L1026 WeakPolarHBondContact O-CG 3.31Å; H1022-L1026 PolarHBondContact O-N 3.2Å
1023	L	95.1	Very high	93.6	Very high	31 Å²	31	66 Å²	66	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-56.3	-46	177.1	-177.7	158.1	0	0	0	111.7	L1006 L1009 V1010 V1013 S1019 S1021 L1026 M1027	L1006-L1023 HydrophobicContact CD1-CD2 3.89Å; L1009-L1023 HydrophobicContact CB-CD1 4.03Å; L1009-L1023 HydrophobicContact CB-CG 4.03Å; V1010-L1023 HydrophobicContact CB-CD1 4.42Å; V1010-L1023 HydrophobicContact CG2-CD1 3.76Å; V1013-L1023 HydrophobicContact CG2-CB 3.99Å; V1013-L1023 HydrophobicContact CG2-CD1 3.86Å; S1019-L1023 PolarHBondContact O-N 3.06Å; S1021-L1023 PolarHBondContact O-N 2.98Å; L1023-L1026 PolarHBondContact O-N 2.9Å; L1023-M1027 HydrophobicContact CD2-CG 4.42Å; L1023-M1027 PolarHBondContact O-N 2.94Å
1024	R	94	Very high	93.3	Very high	186 Å²	186	65.5 Å²	65.5	70%	0.702	34%	0.341	S	S	*	.	H	α-helix	trans	-61.7	-44.5	177.2	-171.5	-178.2	-64.1	-98.4	1.7	111.8	S1020 S1021 H1022 M1027 L1028	S1020-R1024 PolarHBondContact O-N 3.28Å; S1021-R1024 PolarHBondContact O-N 3.12Å; H1022-R1024 VanDerWaalsContact C-N 3.32Å; H1022-R1024 PolarHBondContact O-N 2.81Å; R1024-M1027 PolarHBondContact O-N 2.91Å; R1024-L1028 HydrophobicContact CG-CD1 4.44Å; R1024-L1028 WeakPolarHBondContact O-CG 3.43Å; R1024-L1028 PolarHBondContact O-N 3.03Å; R1024-L1028 VanDerWaalsContact O-N 3.09Å
1025	Q	94.2	Very high	92.8	Very high	70 Å²	70	66.7 Å²	66.7	33%	0.327	34%	0.343	S	S	.	.	H	α-helix	trans	-63.7	-44.4	177.5	-70.1	165.4	-19.2	0	0	112	S1021 H1022 M1027 L1028 I1029	S1021-Q1025 VanDerWaalsContact O-CG 3.32Å; S1021-Q1025 WeakPolarHBondContact O-CG 3.01Å; S1021-Q1025 PolarHBondContact O-N 3.39Å; H1022-Q1025 PolarHBondContact O-N 3.01Å; Q1025-M1027 PolarHBondContact O-N 3.18Å; Q1025-L1028 PolarHBondContact O-N 2.76Å; Q1025-I1029 VanDerWaalsContact O-CG1 3.32Å; Q1025-I1029 WeakPolarHBondContact O-CG1 3.31Å; Q1025-I1029 PolarHBondContact O-N 3.13Å
1026	L	95.6	Very high	92.2	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-62.3	-42	178.2	-71.9	165.6	0	0	0	112	L982 V985 C986 I989 L1009 L1018 H1022 L1023 I1029 Y1030	L982-L1026 HydrophobicContact CD1-CD1 4.04Å; L982-L1026 HydrophobicContact CD1-CD2 4.19Å; L982-L1026 HydrophobicContact CD1-CG 4.23Å; V985-L1026 HydrophobicContact CB-CD1 4.27Å; V985-L1026 HydrophobicContact CB-CD2 4.32Å; V985-L1026 HydrophobicContact CG1-CD1 3.75Å; V985-L1026 HydrophobicContact CG1-CD2 3.95Å; V985-L1026 HydrophobicContact CG1-CG 4.39Å; C986-L1026 WeakPolarHBondContact SG-CD2 3.39Å; I989-L1026 HydrophobicContact CD1-CB 3.92Å; I989-L1026 HydrophobicContact CD1-CD2 4.06Å; I989-L1026 WeakPolarHBondContact CD1-O 3.23Å; L1009-L1026 HydrophobicContact CD1-CB 3.94Å; L1009-L1026 HydrophobicContact CD1-CD1 4.47Å; L1018-L1026 HydrophobicContact CD1-CD1 3.79Å; L1018-L1026 HydrophobicContact CD2-CD1 4.22Å; H1022-L1026 WeakPolarHBondContact O-CB 3.5Å; H1022-L1026 WeakPolarHBondContact O-CD1 3.33Å; H1022-L1026 WeakPolarHBondContact O-CG 3.31Å; H1022-L1026 PolarHBondContact O-N 3.2Å; L1023-L1026 PolarHBondContact O-N 2.9Å; L1026-I1029 PolarHBondContact O-N 2.97Å; L1026-Y1030 PolarHBondContact O-N 3.25Å
1027	M	95.5	Very high	91.2	Very high	12 Å²	12	62.3 Å²	62.3	6%	0.059	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-38.6	175	-73.7	-54	-49.1	0	0	112.8	R1002 L1005 L1006 L1009 L1023 R1024 Q1025 I1029 Y1030 D1031	R1002-M1027 HydrophobicContact CG-CE 3.98Å; L1005-M1027 HydrophobicContact CD2-SD 4.45Å; L1006-M1027 HydrophobicContact CB-SD 4.37Å; L1006-M1027 HydrophobicContact CD1-CG 3.97Å; L1006-M1027 HydrophobicContact CD1-SD 4.2Å; L1009-M1027 HydrophobicContact CD1-CG 4.15Å; L1009-M1027 HydrophobicContact CD1-SD 3.85Å; L1023-M1027 HydrophobicContact CD2-CG 4.42Å; L1023-M1027 PolarHBondContact O-N 2.94Å; R1024-M1027 PolarHBondContact O-N 2.91Å; Q1025-M1027 PolarHBondContact O-N 3.18Å; M1027-I1029 VanDerWaalsContact C-N 3.33Å; M1027-I1029 PolarHBondContact O-N 3.17Å; M1027-Y1030 HydrophobicContact CE-CD1 3.9Å; M1027-Y1030 HydrophobicContact CE-CG 4.46Å; M1027-Y1030 PolarHBondContact O-N 3.08Å; M1027-D1031 PolarHBondContact O-N 2.81Å
1028	L	94.6	Very high	90	Very high	112 Å²	112	64 Å²	64	59%	0.586	32%	0.322	S	S	*	.	H	α-helix	trans	-63.4	-37.5	172.8	-71.1	168.5	0	0	0	112.1	R1024 Q1025 K1032	R1024-L1028 HydrophobicContact CG-CD1 4.44Å; R1024-L1028 WeakPolarHBondContact O-CG 3.43Å; R1024-L1028 PolarHBondContact O-N 3.03Å; R1024-L1028 VanDerWaalsContact O-N 3.09Å; Q1025-L1028 PolarHBondContact O-N 2.76Å; L1028-K1032 VanDerWaalsContact O-CB 3.25Å; L1028-K1032 WeakPolarHBondContact O-CB 3.27Å; L1028-K1032 PolarHBondContact O-N 3.05Å
1029	I	92.6	Very high	88	Confident	44 Å²	44	69 Å²	69	23%	0.226	36%	0.356	C	S	.	.	H	α-helix	trans	-64.9	-41.8	173.3	-68.1	162.8	0	0	0	110.8	I989 Q1025 L1026 M1027 H1033	I989-I1029 HydrophobicContact CG2-CG2 4.1Å; Q1025-I1029 VanDerWaalsContact O-CG1 3.32Å; Q1025-I1029 WeakPolarHBondContact O-CG1 3.31Å; Q1025-I1029 PolarHBondContact O-N 3.13Å; L1026-I1029 PolarHBondContact O-N 2.97Å; M1027-I1029 VanDerWaalsContact C-N 3.33Å; M1027-I1029 PolarHBondContact O-N 3.17Å; I1029-H1033 PolarHBondContact O-N 3.14Å; I1029-H1033 WeakPolarHBondContact O-CB 3.45Å
1030	Y	95.2	Very high	85.8	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.008	38%	0.38	C	S	.	.	H	α-helix	trans	-63.4	-49.8	174.9	170.6	-88.9	0	0	0	111.9	I989 I996 H997 R1002 L1005 L1026 M1027 K1032 H1033 V1034	I989-Y1030 HydrophobicContact CG2-CD2 4.33Å; I996-Y1030 HydrophobicContact CB-CE2 4.09Å; I996-Y1030 HydrophobicContact CG2-CE2 3.69Å; H997-Y1030 WeakPolarHBondContact CA-OH 3.44Å; H997-Y1030 PolarHBondContact N-OH 3.33Å; R1002-Y1030 HydrophobicContact CB-CE1 4.2Å; R1002-Y1030 HydrophobicContact CG-CD1 4.34Å; R1002-Y1030 HydrophobicContact CG-CE1 3.66Å; L1005-Y1030 HydrophobicContact CD2-CD1 4.45Å; L1005-Y1030 HydrophobicContact CD2-CD2 3.43Å; L1005-Y1030 VanDerWaalsContact CD2-CD2 3.43Å; L1005-Y1030 HydrophobicContact CD2-CE2 3.78Å; L1005-Y1030 HydrophobicContact CD2-CG 3.81Å; L1026-Y1030 PolarHBondContact O-N 3.25Å; M1027-Y1030 HydrophobicContact CE-CD1 3.9Å; M1027-Y1030 HydrophobicContact CE-CG 4.46Å; M1027-Y1030 PolarHBondContact O-N 3.08Å; Y1030-K1032 PolarHBondContact O-N 3.26Å; Y1030-H1033 CarbonylContact O-C 3.53Å; Y1030-H1033 WeakPolarHBondContact O-CA 3.39Å; Y1030-H1033 WeakPolarHBondContact O-CB 3.46Å; Y1030-H1033 PolarHBondContact O-N 2.9Å; Y1030-H1033 VanDerWaalsContact O-N 3.12Å; Y1030-V1034 HydrophobicContact CD1-CG2 4.27Å; Y1030-V1034 HydrophobicContact CE1-CG2 3.71Å; Y1030-V1034 HydrophobicContact CE2-CG2 4.24Å; Y1030-V1034 WeakPolarHBondContact O-CG2 3.4Å; Y1030-V1034 PolarHBondContact O-N 3.29Å
1031	D	93.2	Very high	83.1	Confident	41 Å²	41	77.7 Å²	77.7	22%	0.219	39%	0.39	C	S	.	.	H	α-helix	trans	-67.7	-36.6	-176.9	-69.5	-35.6	0	0	0	111.6	R1002 M1027 V1034 Q1035	R1002-D1031 IonicContact CZ-OD1 3.51Å; R1002-D1031 IonicContact CZ-OD2 3.58Å; R1002-D1031 IonicContact NE-OD1 2.78Å; R1002-D1031 PolarHBondContact NE-OD1 2.64Å; R1002-D1031 IonicContact NE-OD2 3.65Å; R1002-D1031 IonicContact NH2-OD1 3.4Å; R1002-D1031 PolarHBondContact NH2-OD1 2.93Å; R1002-D1031 IonicContact NH2-OD2 2.69Å; R1002-D1031 PolarHBondContact NH2-OD2 3.13Å; M1027-D1031 PolarHBondContact O-N 2.81Å; D1031-V1034 WeakPolarHBondContact O-CB 3.47Å; D1031-V1034 PolarHBondContact O-N 3.16Å; D1031-V1034 VanDerWaalsContact O-N 3.12Å; D1031-Q1035 WeakPolarHBondContact O-CG 3.5Å; D1031-Q1035 PolarHBondContact O-N 3.19Å
1032	K	91	Very high	80.2	Confident	127 Å²	127	81.2 Å²	81.2	55%	0.552	40%	0.404	S	S	*	.	H	α-helix	trans	-59.9	-45.5	168.8	-179.5	176.4	175.6	179.6	0	111.5	L1028 Y1030 V1034 Q1035 E1036	L1028-K1032 VanDerWaalsContact O-CB 3.25Å; L1028-K1032 WeakPolarHBondContact O-CB 3.27Å; L1028-K1032 PolarHBondContact O-N 3.05Å; Y1030-K1032 PolarHBondContact O-N 3.26Å; K1032-V1034 PolarHBondContact O-N 3.11Å; K1032-Q1035 WeakPolarHBondContact O-CB 3.32Å; K1032-Q1035 PolarHBondContact O-N 2.9Å; K1032-Q1035 VanDerWaalsContact O-N 3.13Å; K1032-E1036 WeakPolarHBondContact CE-OE1 3.4Å; K1032-E1036 WeakPolarHBondContact O-CG 3.32Å; K1032-E1036 PolarHBondContact O-N 3.01Å
1033	H	88.2	Confident	77.5	Confident	45 Å²	45	85.4 Å²	85.4	21%	0.208	43%	0.434	C	S	.	.	H	α-helix	trans	-63.8	-25.8	174.7	-95.7	-48.2	0	0	0	113.5	H990 I1029 Y1030 E1036 L1037	H990-H1033 AromaticContact CE1-NE2 3.37Å; H990-H1033 PolarHBondContact CE1-NE2 2.91Å; H990-H1033 AromaticContact ND1-CD2 3.5Å; H990-H1033 PolarHBondContact ND1-CD2 2.88Å; H990-H1033 AromaticContact ND1-CE1 3.94Å; H990-H1033 AromaticContact ND1-NE2 2.84Å; H990-H1033 PolarHBondContact ND1-NE2 3.23Å; I1029-H1033 PolarHBondContact O-N 3.14Å; I1029-H1033 WeakPolarHBondContact O-CB 3.45Å; Y1030-H1033 CarbonylContact O-C 3.53Å; Y1030-H1033 WeakPolarHBondContact O-CA 3.39Å; Y1030-H1033 WeakPolarHBondContact O-CB 3.46Å; Y1030-H1033 PolarHBondContact O-N 2.9Å; Y1030-H1033 VanDerWaalsContact O-N 3.12Å; H1033-E1036 IonicContact CE1-OE2 3.69Å; H1033-E1036 PolarHBondContact CE1-OE2 3.16Å; H1033-E1036 VanDerWaalsContact CE1-OE2 3.29Å; H1033-E1036 IonicContact ND1-OE2 3.14Å; H1033-E1036 PolarHBondContact ND1-OE2 2.82Å; H1033-L1037 WeakPolarHBondContact O-CG 3.18Å; H1033-L1037 WeakPolarHBondContact O-CD1 3.41Å
1034	V	88.2	Confident	74.8	Confident	19 Å²	19	89 Å²	89	12%	0.115	46%	0.461	C	S	.	.	H	α-helix	trans	-73.5	-39.6	171.6	170.7	0	0	0	0	111.5	H997 Y1030 D1031 K1032 L1037	H997-V1034 HydrophobicContact CB-CG2 3.87Å; H997-V1034 VanDerWaalsContact CE1-CG1 3.45Å; H997-V1034 WeakPolarHBondContact CE1-CG1 3.36Å; H997-V1034 WeakPolarHBondContact ND1-CG1 3.36Å; Y1030-V1034 HydrophobicContact CD1-CG2 4.27Å; Y1030-V1034 HydrophobicContact CE1-CG2 3.71Å; Y1030-V1034 HydrophobicContact CE2-CG2 4.24Å; Y1030-V1034 WeakPolarHBondContact O-CG2 3.4Å; Y1030-V1034 PolarHBondContact O-N 3.29Å; D1031-V1034 WeakPolarHBondContact O-CB 3.47Å; D1031-V1034 PolarHBondContact O-N 3.16Å; D1031-V1034 VanDerWaalsContact O-N 3.12Å; K1032-V1034 PolarHBondContact O-N 3.11Å; V1034-L1037 WeakPolarHBondContact O-CB 3.24Å; V1034-L1037 PolarHBondContact O-N 3.12Å; V1034-L1037 VanDerWaalsContact O-N 3.16Å
1035	Q	84.8	Confident	72.1	Confident	143 Å²	143	85.4 Å²	85.4	67%	0.668	46%	0.46	S	S	*	.	H	α-helix	trans	-62.5	-43.4	174.9	-68.1	168.5	4.2	0	0	111.7	D1031 K1032 L1037 N1038	D1031-Q1035 WeakPolarHBondContact O-CG 3.5Å; D1031-Q1035 PolarHBondContact O-N 3.19Å; K1032-Q1035 WeakPolarHBondContact O-CB 3.32Å; K1032-Q1035 PolarHBondContact O-N 2.9Å; K1032-Q1035 VanDerWaalsContact O-N 3.13Å; Q1035-L1037 PolarHBondContact O-N 3.33Å; Q1035-N1038 PolarHBondContact O-N 3.17Å; Q1035-N1038 VanDerWaalsContact O-N 3.12Å
1036	E	79.8	Confident	69.3	Low	112 Å²	112	88.9 Å²	88.9	52%	0.523	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-9	174.8	-70.9	174.3	-176.5	0	0	114.4	K1032 H1033	K1032-E1036 WeakPolarHBondContact CE-OE1 3.4Å; K1032-E1036 WeakPolarHBondContact O-CG 3.32Å; K1032-E1036 PolarHBondContact O-N 3.01Å; H1033-E1036 IonicContact CE1-OE2 3.69Å; H1033-E1036 PolarHBondContact CE1-OE2 3.16Å; H1033-E1036 VanDerWaalsContact CE1-OE2 3.29Å; H1033-E1036 IonicContact ND1-OE2 3.14Å; H1033-E1036 PolarHBondContact ND1-OE2 2.82Å
1037	L	73.5	Confident	66.4	Low	45 Å²	45	94.9 Å²	94.9	24%	0.236	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-6.1	178.9	-64.6	167.4	0	0	0	114.2	R994 H1033 V1034 Q1035 P1039	R994-L1037 HydrophobicContact CB-CD1 4.24Å; R994-L1037 HydrophobicContact CG-CD1 3.51Å; R994-L1037 HydrophobicContact CG-CD2 3.63Å; R994-L1037 HydrophobicContact CG-CG 4.22Å; H1033-L1037 WeakPolarHBondContact O-CG 3.18Å; H1033-L1037 WeakPolarHBondContact O-CD1 3.41Å; V1034-L1037 WeakPolarHBondContact O-CB 3.24Å; V1034-L1037 PolarHBondContact O-N 3.12Å; V1034-L1037 VanDerWaalsContact O-N 3.16Å; Q1035-L1037 PolarHBondContact O-N 3.33Å; L1037-P1039 WeakPolarHBondContact O-CD 3.41Å
1038	N	65.8	Low	63.6	Low	92 Å²	92	100.8 Å²	100.8	49%	0.492	55%	0.545	S	S	.	.	S	Bend	trans	-116.6	83.7	177.8	-67.4	-32.1	0	0	0	109.3	Q1035 I1040	Q1035-N1038 PolarHBondContact O-N 3.17Å; Q1035-N1038 VanDerWaalsContact O-N 3.12Å; N1038-I1040 PolarHBondContact O-N 3.01Å
1039	P	52.3	Low	60.9	Low	117 Å²	117	102.9 Å²	102.9	76%	0.76	55%	0.551	S	S	*	*			trans	-57.2	127.5	174.1	-21.6	33	0	0	0	110.2	L1037 N1041	L1037-P1039 WeakPolarHBondContact O-CD 3.41Å; P1039-N1041 PolarHBondContact O-N 2.91Å
1040	I	46.3	Very low	58.3	Low	154 Å²	154	107.1 Å²	107.1	79%	0.79	57%	0.573	S	S	*	*			trans	-73.7	110.7	-174.9	-62.6	172.2	0	0	0	109.4	N1038 N1042	N1038-I1040 PolarHBondContact O-N 3.01Å; I1040-N1042 VanDerWaalsContact C-N 3.3Å; I1040-N1042 HydrophobicContact CG2-CB 4.22Å; I1040-N1042 PolarHBondContact O-N 2.97Å
1041	N	37	Very low	55.4	Low	156 Å²	156	112 Å²	112	83%	0.834	60%	0.603	S	S	*	*			trans	-68.1	91.2	157.1	-82.1	-8.7	0	0	0	108.2	P1039	P1039-N1041 PolarHBondContact O-N 2.91Å
1042	N	34.3	Very low	52.7	Low	139 Å²	139	116.5 Å²	116.5	74%	0.743	63%	0.627	S	S	*	*			trans	178.7	103.8	155.4	-96.1	-19.3	0	0	0	111.1	I1040	I1040-N1042 VanDerWaalsContact C-N 3.3Å; I1040-N1042 HydrophobicContact CG2-CB 4.22Å; I1040-N1042 PolarHBondContact O-N 2.97Å
1043	T	37	Very low	50.1	Low	146 Å²	146	116.1 Å²	116.1	90%	0.896	64%	0.635	S	S	*	*			trans	-174.4	143.7	137.6	12.8	0	0	0	0	112.4	V1045	T1043-V1045 PolarHBondContact O-N 3.17Å
1044	S	37.8	Very low	47.4	Very low	105 Å²	105	122.7 Å²	122.7	73%	0.734	67%	0.666	S	S	*	*			trans	-17.2	117.5	165.7	-160.4	0	0	0	0	115.4
1045	V	36.9	Very low	44.9	Very low	112 Å²	112	127 Å²	127	68%	0.679	70%	0.695	S	S	*	*				51.8	98.4	80	-178.1	0	0	0	0	112.8	T1043	T1043-V1045 PolarHBondContact O-N 3.17Å
1046	N	35.1	Very low	42.4	Very low	143 Å²	143	128 Å²	128	77%	0.765	70%	0.703	S	S	*	*				-166.4	95	123.1	-110.2	-26.5	0	0	0	113.5
1047	N	34.6	Very low	40.2	Very low	127 Å²	127	127.4 Å²	127.4	68%	0.679	71%	0.712	S	S	*	*			trans	40	143.1	134.2	-66	-8.8	0	0	0	124.3
1048	N	36.8	Very low	38.1	Very low	135 Å²	135	130.3 Å²	130.3	72%	0.722	74%	0.736	S	S	*	*			trans	73.3	123.5	156.8	-54.4	-21.1	0	0	0	116.1
1049	H	38.3	Very low	36.6	Very low	156 Å²	156	131.2 Å²	131.2	72%	0.722	75%	0.747	S	S	*	*			cis	-156.4	147.1	36.8	-103.9	-50.9	0	0	0	113.8
1050	I	38.1	Very low	35.6	Very low	134 Å²	134	130.1 Å²	130.1	69%	0.687	74%	0.742	S	S	*	*				51.1	127.4	130	-67.6	176.9	0	0	0	118.6
1051	T	35.5	Very low	34.7	Very low	103 Å²	103	129.8 Å²	129.8	63%	0.632	74%	0.742	S	S	*	*			cis	-163.9	162.1	3.3	17.7	0	0	0	0	112
1052	N	35	Very low	34.5	Very low	136 Å²	136	127.3 Å²	127.3	73%	0.727	74%	0.743	S	S	*	*			trans	21.7	142.8	131.2	-56.3	1.6	0	0	0	120
1053	T	36.3	Very low	34.2	Very low	119 Å²	119	125 Å²	125	73%	0.73	74%	0.737	S	S	*	*			cis	-165.6	140.5	7.6	7.7	0	0	0	0	112.4
1054	Q	33	Very low	33.9	Very low	184 Å²	184	124.4 Å²	124.4	86%	0.86	73%	0.734	S	S	*	*			trans	51.2	161.7	139	-74.7	-156.2	7	0	0	123.9
1055	P	35	Very low	33.5	Very low	110 Å²	110	125.2 Å²	125.2	71%	0.714	74%	0.735	S	S	*	*			trans	-117.1	173.4	-162.6	42.8	-31.5	0	0	0	115
1056	L	31.7	Very low	33.2	Very low	162 Å²	162	125.3 Å²	125.3	85%	0.848	74%	0.74	S	S	*	*			trans	-150.2	134.1	163.2	-141.7	75.9	0	0	0	114.8
1057	S	33.5	Very low	33	Very low	100 Å²	100	125.5 Å²	125.5	70%	0.699	74%	0.741	S	S	*	*			trans	37.6	127.5	148.1	61.6	0	0	0	0	122.9
1058	S	28.9	Very low	32.8	Very low	106 Å²	106	126.8 Å²	126.8	74%	0.741	75%	0.747	S	S	*	*			trans	-81.4	163.1	150.5	54.9	0	0	0	0	112.1
1059	P	36.2	Very low	32.6	Very low	111 Å²	111	125.6 Å²	125.6	72%	0.721	75%	0.746	S	S	*	*				-124.1	151.3	107.2	0.8	20.8	0	0	0	111.1
1060	S	30	Very low	32	Very low	94 Å²	94	123.5 Å²	123.5	66%	0.657	74%	0.74	S	S	*	*			cis	68.7	147.5	45.9	103.7	0	0	0	0	113.8
1061	N	28.6	Very low	31.5	Very low	148 Å²	148	123 Å²	123	79%	0.791	75%	0.749	S	S	*	*			cis	-171.7	137.8	-23.5	-106.4	-11.5	0	0	0	107.8
1062	A	31.9	Very low	31.1	Very low	103 Å²	103	126.4 Å²	126.4	85%	0.851	76%	0.755	S	S	*	*			trans	179.4	101.5	162.7	0	0	0	0	0	109.3
1063	S	28	Very low	30.7	Very low	90 Å²	90	128.2 Å²	128.2	63%	0.629	76%	0.763	S	S	*	*			cis	92.4	79.6	22.7	-48.3	0	0	0	0	115.6
1064	T	30.6	Very low	30.3	Very low	135 Å²	135	128.4 Å²	128.4	83%	0.828	76%	0.764	S	S	*	*			trans	-164.1	87.3	151.2	-6.8	0	0	0	0	108.8
1065	T	28.6	Very low	30.1	Very low	121 Å²	121	126.4 Å²	126.4	74%	0.742	76%	0.759	S	S	*	*				69.1	90.6	68.8	69.8	0	0	0	0	116.2
1066	S	30.9	Very low	29.6	Very low	114 Å²	114	125.8 Å²	125.8	80%	0.797	76%	0.757	S	S	*	*			trans	173.9	149.4	139.7	39.7	0	0	0	0	111.4
1067	L	31	Very low	29.4	Very low	148 Å²	148	126.9 Å²	126.9	78%	0.775	76%	0.757	S	S	*	*			cis	-159.4	121.6	-21.5	-107	171.2	0	0	0	108.3
1068	L	31.7	Very low	29.2	Very low	153 Å²	153	129.1 Å²	129.1	80%	0.801	76%	0.76	S	S	*	*			trans	59.5	163.5	154.2	-60.9	169.3	0	0	0	120.3
1069	P	31.4	Very low	29.2	Very low	110 Å²	110	130.8 Å²	130.8	71%	0.714	76%	0.76	S	S	*	*			cis	-132	176	-43.8	37.7	-22.8	0	0	0	115.1
1070	D	25.4	Very low	28.8	Very low	112 Å²	112	135.9 Å²	135.9	60%	0.599	77%	0.771	S	S	*	*			trans	-46.3	145.9	-172.8	-62.6	-96	0	0	0	121.1	K1072	D1070-K1072 IonicContact OD1-NZ 3.34Å; D1070-K1072 PolarHBondContact OD1-NZ 2.88Å; D1070-K1072 WeakPolarHBondContact OD1-CE 3.09Å
1071	S	28.3	Very low	28.8	Very low	123 Å²	123	136.4 Å²	136.4	86%	0.86	78%	0.775	S	S	*	*				-151.6	107.9	121	42	0	0	0	0	110.5
1072	K	27	Very low	28.8	Very low	175 Å²	175	137.5 Å²	137.5	76%	0.761	78%	0.775	S	S	*	*			trans	-95.1	113.4	-174.3	-68.7	174	-179.8	116.4	0	111.7	D1070	D1070-K1072 IonicContact OD1-NZ 3.34Å; D1070-K1072 PolarHBondContact OD1-NZ 2.88Å; D1070-K1072 WeakPolarHBondContact OD1-CE 3.09Å
1073	L	27.4	Very low	28.9	Very low	174 Å²	174	138 Å²	138	91%	0.911	77%	0.77	S	S	*	*			trans	-121.6	124.9	153.9	-99.4	170.2	0	0	0	109.5	N1075	L1073-N1075 PolarHBondContact O-N 3.34Å
1074	V	28.3	Very low	29.1	Very low	124 Å²	124	140.7 Å²	140.7	75%	0.752	78%	0.776	S	S	*	*			trans	-78.7	105.7	-166.3	-177.3	0	0	0	0	110.7	C1076	V1074-C1076 VanDerWaalsContact C-N 3.32Å; V1074-C1076 PolarHBondContact O-N 3.5Å
1075	N	26.9	Very low	29.4	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	77%	0.769	S	S	*	*			trans	-77	81.6	172.2	-119.8	-10.5	0	0	0	109.9	L1073 H1077	L1073-N1075 PolarHBondContact O-N 3.34Å; N1075-H1077 PolarHBondContact O-N 3.29Å; N1075-H1077 VanDerWaalsContact O-N 3.15Å
1076	C	26.2	Very low	29.6	Very low	97 Å²	97	140.5 Å²	140.5	66%	0.655	77%	0.77	S	S	*	*			trans	-63.4	112.9	171.1	-70.2	0	0	0	0	110	V1074 I1078	V1074-C1076 VanDerWaalsContact C-N 3.32Å; V1074-C1076 PolarHBondContact O-N 3.5Å; C1076-I1078 PolarHBondContact O-N 3.39Å
1077	H	26	Very low	29.8	Very low	185 Å²	185	144.6 Å²	144.6	86%	0.856	77%	0.768	S	S	*	*			trans	-64.3	96.8	171.3	-84.1	-64.1	0	0	0	110.6	N1075 N1079	N1075-H1077 PolarHBondContact O-N 3.29Å; N1075-H1077 VanDerWaalsContact O-N 3.15Å; H1077-N1079 PolarHBondContact O-N 3.49Å
1078	I	30.7	Very low	30.1	Very low	148 Å²	148	141.9 Å²	141.9	76%	0.759	75%	0.754	S	S	*	*			trans	-74	122.3	165.4	-64	177.1	0	0	0	107.8	C1076	C1076-I1078 PolarHBondContact O-N 3.39Å
1079	N	28.3	Very low	30.3	Very low	141 Å²	141	141 Å²	141	75%	0.754	75%	0.749	S	S	*	*			trans	-66.2	152	-176.6	-79.9	-54.8	0	0	0	112.2	H1077 S1081	H1077-N1079 PolarHBondContact O-N 3.49Å; N1079-S1081 PolarHBondContact O-N 3.38Å
1080	K	28.2	Very low	30.8	Very low	217 Å²	217	143.2 Å²	143.2	94%	0.943	75%	0.75	S	S	*	*			trans	-67.1	89.8	171.9	-67.9	179.4	177.2	-179.9	0	110.8
1081	S	29.9	Very low	31.4	Very low	106 Å²	106	145 Å²	145	74%	0.741	76%	0.757	S	S	*	*			trans	-89	153.4	162.6	46.7	0	0	0	0	110.6	N1079	N1079-S1081 PolarHBondContact O-N 3.38Å
1082	Q	29.3	Very low	32.2	Very low	171 Å²	171	143.2 Å²	143.2	80%	0.799	73%	0.734	S	S	*	*			trans	-81	156.9	-176.3	-68	-168.4	2.1	0	0	112	I1084	Q1082-I1084 PolarHBondContact O-N 3.25Å
1083	P	32.5	Very low	32.5	Very low	113 Å²	113	139.6 Å²	139.6	73%	0.734	73%	0.73	S	S	*	*			trans	-67.6	101.7	179.3	27.2	-35.2	0	0	0	111.8	I1085	P1083-I1085 PolarHBondContact O-N 2.87Å
1084	I	32.2	Very low	32.7	Very low	147 Å²	147	135.9 Å²	135.9	75%	0.754	72%	0.719	S	S	*	*			trans	-81.6	71.5	174	-50.9	-179.6	0	0	0	109.2	Q1082	Q1082-I1084 PolarHBondContact O-N 3.25Å
1085	I	36.6	Very low	32.8	Very low	135 Å²	135	137.1 Å²	137.1	69%	0.692	73%	0.727	S	S	*	*			trans	-126	80.8	176.3	-51.5	176.8	0	0	0	107	P1083	P1083-I1085 PolarHBondContact O-N 2.87Å
1086	P	33.1	Very low	32.9	Very low	117 Å²	117	135 Å²	135	76%	0.76	72%	0.723	S	S	*	*	S	Bend		-154	56.4	109.4	40.1	-20.7	0	0	0	113.8
1087	R	35.6	Very low	33.1	Very low	200 Å²	200	138.6 Å²	138.6	76%	0.755	74%	0.736	S	S	*	*	S	Bend	trans	-121.5	-15.4	-178.7	-111.6	-174.6	-180	-172.7	-0.7	118
1088	L	38	Very low	33.1	Very low	90 Å²	90	138.2 Å²	138.2	47%	0.471	75%	0.754	S	S	.	*	S	Bend	trans	-83.6	-29.1	-177.2	-87.1	163.3	0	0	0	114.5	Q1090 M1091	L1088-Q1090 PolarHBondContact O-N 2.98Å; L1088-M1091 PolarHBondContact O-N 3.38Å
1089	L	35.7	Very low	33.2	Very low	135 Å²	135	137.7 Å²	137.7	71%	0.707	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-63.4	-24.3	179.5	-87.9	162.2	0	0	0	113.8	M1091 F1092	L1089-M1091 PolarHBondContact O-N 3.01Å; L1089-F1092 PolarHBondContact O-N 3.35Å
1090	Q	41.2	Very low	33.4	Very low	156 Å²	156	137.5 Å²	137.5	73%	0.729	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-66.8	-13.4	178.3	-81.2	-172	-57.5	0	0	114.3	L1088	L1088-Q1090 PolarHBondContact O-N 2.98Å
1091	M	37.2	Very low	33.7	Very low	151 Å²	151	133.1 Å²	133.1	74%	0.744	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-86	-4.3	177.1	-65.7	-159.4	72.2	0	0	114.3	L1088 L1089	L1088-M1091 PolarHBondContact O-N 3.38Å; L1089-M1091 PolarHBondContact O-N 3.01Å
1092	F	45.4	Very low	34	Very low	85 Å²	85	134.7 Å²	134.7	37%	0.373	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-124.3	25.9	-175.4	-60.4	-73.6	0	0	0	112.9	L1089	L1089-F1092 PolarHBondContact O-N 3.35Å
1093	S	33.2	Very low	34.3	Very low	99 Å²	99	132.4 Å²	132.4	69%	0.692	74%	0.739	S	S	*	*			trans	-147.3	63.8	-173.7	-60.6	0	0	0	0	112.8
1094	S	31.4	Very low	34.4	Very low	96 Å²	96	133.7 Å²	133.7	67%	0.671	74%	0.74	S	S	*	*			trans	-154.2	125.8	171.6	55.9	0	0	0	0	110.2
1095	T	31.7	Very low	34.5	Very low	150 Å²	150	132.8 Å²	132.8	92%	0.92	74%	0.739	S	S	*	*			trans	59.6	133.5	-177.5	61.1	0	0	0	0	114.6
1096	S	29.6	Very low	34.4	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	74%	0.742	S	S	*	*			cis	-118	148.6	29.7	47.5	0	0	0	0	115.9
1097	N	28.6	Very low	34.5	Very low	174 Å²	174	133.9 Å²	133.9	93%	0.93	74%	0.741	S	S	*	*			trans	-108.3	95.6	152.9	-98.4	4.1	0	0	0	106.6
1098	S	26.1	Very low	34.4	Very low	176 Å²	176	127.9 Å²	127.9	100%	1.231	74%	0.739	S	S	*	*			trans	-177.7	0	167.8	58.6	0	0	0	0	108.3

Retrieved 1,098 of 1,098 residues in 1471.8 ms (Link to these results)

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