A0A087XR75_POEFO Loading...

DENN domain containing 2B

AlphaFold DB , UniProt , Accession A0A087XR75, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 940 aa.

						>A0A087XR75_POEFO|A0A087XR75
MSLCLDKRGGEIVGGSEGCPSLLSSPCSEKTFDFKGVRRMSTAFSECSYTGTEDDEGVSDKDGLGRFQKRKSKTESSGGFVRTLSARKETSAVLNRIQKIEQALKENPSPPPPRYLSNCYAPDKARQKSFVIGDDLDSTCASKRSSICSVATEPDTILVSDKLSRLRQRFSVSSTRSESPEPQSQQTSVGTQVNPLPKPKRTFEYDAKRDQKDVLSANGLPPDRTSESPPPLPSTPAPSTTRTTKHEGSKPVRIPDRELCESEDAASLPSSYPSSPTENGALTADPKSRPSSKSTLEENAYEDIVEKENPYEDVDLKRRSLSRKSGLSENSRSWAAMDRKLNSPPQLPSKPSSQSLRLPGPSDRKSHRMSQLSKRYSHDEMLLIPQVGMSSSPCGLLDDSLCGTSDSLPSRRHWRIPKLVQRINSIYCTKRGKKRLKKLSMSNLETASLRDDNSESESDSDDRFKAHTQRLLKLQSILRRAPSYRTLELQLIEWQERELFEYFVVVSLKKKPGKNSYAPEVSYQFPKLERLTKQMREAEQRLKAIPQFCFPDAKDWSPVSEYTSETFSFMLTGEDGSRRFGYCRRLLPTGKGPRLPEVYCVISRLGCFDLFSTILDEVERRRGVSAALVYPFMRSLMESPFPAPGKIIKVKTFLPGAGNEVIELRRPNDSRLEHVDFDSLFRCLSVRQVLRVFASLLLERRVIFVADKLSTLSSCMHAVVALLYPFSWQHTFIPVLPASMLDIVCCPTPFLVGLLSSSLPKLKELPVEEALMVDLGTDRFIRQMDDEASLLPRKLQAALEQALEQRNEIINQDSDSESDEEYNSLNSLVSEAFIRFFLETMGHYSLFITQNERGERVFQREAFRKSVASKSIRRFLGVFMESQMFAGFIQDRELRKTRAKGLFEQRVDQYLEELPDTEQSGVNKFLKGLGNKMKFLHKKN
					

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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	33.8	Very low	30.3	Very low	229 Å²	229	144.3 Å²	144.3	100%	1.128	80%	0.803	S	S	*	*				0	110.9	0	-61.5	-174.6	-77.7	0	0	105.9
2	S	26.9	Very low	30.3	Very low	110 Å²	110	146.9 Å²	146.9	77%	0.769	81%	0.811	S	S	*	*				71.7	125.4	58.2	-52.8	0	0	0	0	110.7
3	L	29.4	Very low	30.2	Very low	158 Å²	158	146.8 Å²	146.8	83%	0.827	82%	0.816	S	S	*	*			cis	-151	177.7	-8.3	-95.3	-179.9	0	0	0	106.8
4	C	30	Very low	30.1	Very low	99 Å²	99	141.6 Å²	141.6	67%	0.669	81%	0.813	S	S	*	*			cis	-153.6	-167.4	17.6	-146.7	0	0	0	0	114.1
5	L	34.4	Very low	29.9	Very low	141 Å²	141	137.5 Å²	137.5	74%	0.738	81%	0.813	S	S	*	*			trans	-57.6	168.1	166.6	-60.3	162.3	0	0	0	113.7
6	D	32.2	Very low	29.8	Very low	106 Å²	106	136.2 Å²	136.2	57%	0.567	81%	0.814	S	S	*	*			cis	-160	177.9	30.4	-130.3	-32.6	0	0	0	108.1
7	K	31.9	Very low	30	Very low	158 Å²	158	139.4 Å²	139.4	69%	0.687	82%	0.818	S	S	*	*			cis	-145.8	-98.4	6.5	-163.6	124.4	-134.2	152.3	0	114.3
8	R	30.5	Very low	29.9	Very low	235 Å²	235	136.2 Å²	136.2	89%	0.887	82%	0.819	S	S	*	*			trans	-159.8	159.8	-166.2	-64.3	175.2	-175.2	171.2	-2.4	108.5
9	G	27	Very low	29.7	Very low	80 Å²	80	135.7 Å²	135.7	83%	0.825	82%	0.822	S	S	*	*			cis	142.6	160.3	-2.4	0	0	0	0	0	111.7
10	G	28	Very low	30.6	Very low	83 Å²	83	134.9 Å²	134.9	86%	0.856	82%	0.819	S	S	*	*			trans	148.9	106.3	174.1	0	0	0	0	0	114
11	E	28.9	Very low	30.4	Very low	188 Å²	188	134.8 Å²	134.8	88%	0.879	82%	0.824	S	S	*	*			trans	-82.8	152.8	161	-59.8	171.1	111.5	0	0	109.4
12	I	30.6	Very low	30.2	Very low	176 Å²	176	131.2 Å²	131.2	90%	0.903	81%	0.809	S	S	*	*			trans	-163.2	148.2	140.5	-108.1	156.3	0	0	0	112
13	V	29.6	Very low	30.1	Very low	145 Å²	145	133.6 Å²	133.6	88%	0.879	81%	0.812	S	S	*	*			trans	-73.6	149.3	-178	175.6	0	0	0	0	112.2
14	G	28.3	Very low	29.9	Very low	75 Å²	75	130.6 Å²	130.6	77%	0.773	81%	0.805	S	S	*	*			trans	148.3	128.4	157.1	0	0	0	0	0	113.7
15	G	26.8	Very low	29.7	Very low	79 Å²	79	131.5 Å²	131.5	81%	0.814	81%	0.812	S	S	*	*			trans	-133.8	157.4	172.9	0	0	0	0	0	111.5
16	S	29.2	Very low	29.6	Very low	117 Å²	117	130 Å²	130	82%	0.818	81%	0.811	S	S	*	*			trans	-159.2	174.3	157.7	-156.4	0	0	0	0	111.4
17	E	31.9	Very low	29.3	Very low	191 Å²	191	131.2 Å²	131.2	89%	0.893	83%	0.826	S	S	*	*			trans	-72.6	156.8	-166.9	-55	163	124.8	0	0	114.3
18	G	28.3	Very low	29.1	Very low	81 Å²	81	128.5 Å²	128.5	84%	0.835	83%	0.827	S	S	*	*			trans	164.8	91	170.2	0	0	0	0	0	116.9
19	C	27.1	Very low	28.9	Very low	128 Å²	128	126 Å²	126	87%	0.865	83%	0.825	S	S	*	*			trans	-93.3	172.9	166	-70.1	0	0	0	0	110.9
20	P	47.8	Very low	28.9	Very low	119 Å²	119	130.8 Å²	130.8	77%	0.773	82%	0.823	S	S	*	*			cis	-132.6	159.3	-32.4	36	-20.8	0	0	0	113.7
21	S	26.6	Very low	28.8	Very low	132 Å²	132	133 Å²	133	92%	0.923	82%	0.82	S	S	*	*			trans	-148.4	144.8	166.3	-67	0	0	0	0	115.9
22	L	29	Very low	28.8	Very low	155 Å²	155	132.5 Å²	132.5	81%	0.812	82%	0.816	S	S	*	*			trans	-65.6	146.3	-179.9	-66.1	158.5	0	0	0	116.3
23	L	24.5	Very low	28.5	Very low	159 Å²	159	130 Å²	130	83%	0.832	80%	0.804	S	S	*	*			trans	66.9	153.4	149.6	-60.1	165.2	0	0	0	118.6
24	S	25	Very low	28.6	Very low	96 Å²	96	131.1 Å²	131.1	67%	0.671	80%	0.797	S	S	*	*			cis	-172.3	151.8	-22.6	53.9	0	0	0	0	112.1
25	S	27.2	Very low	28.6	Very low	117 Å²	117	135.7 Å²	135.7	82%	0.818	80%	0.796	S	S	*	*			trans	68.3	168.8	165.1	-116.8	0	0	0	0	116.9
26	P	30.9	Very low	28.8	Very low	110 Å²	110	134.9 Å²	134.9	71%	0.714	79%	0.788	S	S	*	*			cis	-127.4	153.8	-4.1	39.3	-24.3	0	0	0	115.8
27	C	26.1	Very low	28.9	Very low	132 Å²	132	134.7 Å²	134.7	89%	0.892	78%	0.781	S	S	*	*			trans	-152.5	84.1	161.4	-117.4	0	0	0	0	112.8
28	S	28.3	Very low	28.7	Very low	100 Å²	100	137 Å²	137	70%	0.699	78%	0.782	S	S	*	*			trans	35	90.3	156.5	-179.7	0	0	0	0	118.5	K30	S28-K30 PolarHBondContact O-N 2.83Å
29	E	25.6	Very low	28.8	Very low	182 Å²	182	143.1 Å²	143.1	85%	0.85	78%	0.78	S	S	*	*			trans	-61.7	131.5	155.6	-64.9	-178	119.3	0	0	110.5
30	K	28.1	Very low	28.9	Very low	181 Å²	181	145.3 Å²	145.3	79%	0.787	78%	0.779	S	S	*	*			trans	-116.8	91.8	158.4	-79.7	-168.9	175.6	-177.4	0	108.8	S28 F32	S28-K30 PolarHBondContact O-N 2.83Å; K30-F32 PolarHBondContact O-N 2.8Å
31	T	25.1	Very low	28.1	Very low	130 Å²	130	145.2 Å²	145.2	80%	0.798	78%	0.782	S	S	*	*			trans	-66	112.4	177.2	17.3	0	0	0	0	111
32	F	29	Very low	28.2	Very low	177 Å²	177	144.1 Å²	144.1	78%	0.776	77%	0.769	S	S	*	*			trans	-84.1	135	164.6	-89.8	-94.2	0	0	0	110	K30 F34	K30-F32 PolarHBondContact O-N 2.8Å; F32-F34 PolarHBondContact O-N 3.09Å
33	D	24.4	Very low	28.2	Very low	124 Å²	124	140.7 Å²	140.7	66%	0.663	76%	0.763	S	S	*	*			trans	-71.3	110.2	-176.6	-174	8.8	0	0	0	112	K35	D33-K35 VanDerWaalsContact C-N 3.32Å; D33-K35 PolarHBondContact O-N 3.21Å; D33-K35 IonicContact OD2-NZ 3.77Å
34	F	31.7	Very low	28.7	Very low	168 Å²	168	140.5 Å²	140.5	74%	0.737	76%	0.756	S	S	*	*			trans	-83.8	65.7	-176.8	-103.4	-97.7	0	0	0	112.9	F32 V37	F32-F34 PolarHBondContact O-N 3.09Å; F34-V37 HydrophobicContact CD1-CB 4.49Å; F34-V37 HydrophobicContact CD1-CG2 3.75Å; F34-V37 HydrophobicContact CE1-CG2 3.68Å
35	K	27.3	Very low	28.9	Very low	172 Å²	172	140.9 Å²	140.9	75%	0.748	76%	0.759	S	S	*	*			trans	-103.6	-7.1	169.4	-79.9	175.2	-175.5	151.1	0	115.6	D33	D33-K35 VanDerWaalsContact C-N 3.32Å; D33-K35 PolarHBondContact O-N 3.21Å; D33-K35 IonicContact OD2-NZ 3.77Å
36	G	31.5	Very low	28.9	Very low	62 Å²	62	144.2 Å²	144.2	64%	0.639	76%	0.761	S	S	*	*	S	Bend	trans	-81.3	-25.3	-177	0	0	0	0	0	116.5	R38	G36-R38 VanDerWaalsContact C-N 3.27Å; G36-R38 PolarHBondContact O-N 2.65Å
37	V	31.4	Very low	28.7	Very low	113 Å²	113	145.4 Å²	145.4	69%	0.685	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	49.1	-161.3	-163.9	0	0	0	0	113.2	F34	F34-V37 HydrophobicContact CD1-CB 4.49Å; F34-V37 HydrophobicContact CD1-CG2 3.75Å; F34-V37 HydrophobicContact CE1-CG2 3.68Å
38	R	28.4	Very low	28.7	Very low	240 Å²	240	145 Å²	145	91%	0.906	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.6	19.2	174.7	-136	-177.9	-165.7	-162.2	3.8	115.7	G36	G36-R38 VanDerWaalsContact C-N 3.27Å; G36-R38 PolarHBondContact O-N 2.65Å
39	R	29.8	Very low	28.7	Very low	209 Å²	209	150.8 Å²	150.8	79%	0.789	78%	0.777	S	S	*	*	S	Bend	trans	-120.3	-6	179.1	-77.6	-173.7	173	176.1	-3.3	116.3	S41 T42	R39-S41 VanDerWaalsContact C-N 3.27Å; R39-S41 PolarHBondContact O-N 3.28Å; R39-T42 PolarHBondContact O-OG1 2.78Å
40	M	29.8	Very low	28.9	Very low	174 Å²	174	147.9 Å²	147.9	86%	0.857	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	28.1	-177	-58.4	-157.9	-58.5	0	0	114.8
41	S	30.1	Very low	28.8	Very low	117 Å²	117	142.3 Å²	142.3	82%	0.818	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.9	17.2	170.4	-51.1	0	0	0	0	112.4	R39	R39-S41 VanDerWaalsContact C-N 3.27Å; R39-S41 PolarHBondContact O-N 3.28Å
42	T	29.8	Very low	28.9	Very low	108 Å²	108	143 Å²	143	66%	0.663	77%	0.77	S	S	*	*			trans	-135.7	22.5	178.2	54	0	0	0	0	112	R39 F44	R39-T42 PolarHBondContact O-OG1 2.78Å; T42-F44 PolarHBondContact O-N 3.37Å
43	A	29.4	Very low	28.9	Very low	83 Å²	83	143.6 Å²	143.6	69%	0.686	78%	0.776	S	S	*	*			trans	-80.8	36	-176	0	0	0	0	0	114.2
44	F	33.2	Very low	29	Very low	156 Å²	156	145.8 Å²	145.8	68%	0.684	79%	0.787	S	S	*	*	S	Bend	trans	-141.1	50.3	178.4	-76.6	-66.3	0	0	0	112.1	T42 Q540	T42-F44 PolarHBondContact O-N 3.37Å; F44-Q540 PolarHBondContact O-NE2 2.84Å
45	S	30.1	Very low	28.9	Very low	104 Å²	104	145.3 Å²	145.3	73%	0.727	79%	0.793	S	S	*	*	S	Bend	trans	-149.8	-17.2	173	-160.1	0	0	0	0	116.7
46	E	27.7	Very low	28.9	Very low	186 Å²	186	146.2 Å²	146.2	87%	0.869	80%	0.8	S	S	*	*			trans	-122.8	86.9	-170	-69.4	175.8	170	0	0	112.3
47	C	25.4	Very low	28.7	Very low	135 Å²	135	146.8 Å²	146.8	91%	0.912	81%	0.805	S	S	*	*			trans	-154.7	64.7	160	-98.8	0	0	0	0	109.9
48	S	27.4	Very low	28.5	Very low	123 Å²	123	148.3 Å²	148.3	86%	0.86	81%	0.814	S	S	*	*			trans	-110.1	152.4	166.5	-65	0	0	0	0	108.9
49	Y	28.6	Very low	28.4	Very low	222 Å²	222	142.6 Å²	142.6	87%	0.871	81%	0.811	S	S	*	*			trans	-84.1	162.1	-166.7	-152	-110.9	0	0	0	113.5
50	T	29.1	Very low	28.4	Very low	122 Å²	122	139.5 Å²	139.5	75%	0.748	81%	0.81	S	S	*	*			trans	-66.6	136.9	174.3	48.5	0	0	0	0	112
51	G	26.3	Very low	28.4	Very low	64 Å²	64	140.2 Å²	140.2	66%	0.66	81%	0.809	S	S	*	*			trans	-167.2	114	170.6	0	0	0	0	0	112
52	T	27.7	Very low	28.3	Very low	143 Å²	143	141.7 Å²	141.7	88%	0.877	81%	0.807	S	S	*	*			trans	34	122.3	157.6	49.3	0	0	0	0	120.1
53	E	27.6	Very low	28.2	Very low	190 Å²	190	140.3 Å²	140.3	89%	0.888	82%	0.815	S	S	*	*			trans	-69	146.4	163.5	-59.6	158.1	139.2	0	0	111
54	D	27.6	Very low	28.1	Very low	170 Å²	170	145 Å²	145	91%	0.909	83%	0.827	S	S	*	*			trans	-151.1	151	155.3	-93.6	-45.8	0	0	0	107.1
55	D	28.4	Very low	27.9	Very low	159 Å²	159	141 Å²	141	85%	0.85	83%	0.83	S	S	*	*			trans	-112.9	-171.1	-165.1	-165.1	10.9	0	0	0	112.8
56	E	27.8	Very low	27.8	Very low	191 Å²	191	146.1 Å²	146.1	89%	0.893	83%	0.833	S	S	*	*			trans	89.2	132.4	-171	-56.4	-161.4	133.7	0	0	115.1
57	G	26.8	Very low	27.8	Very low	73 Å²	73	145.4 Å²	145.4	75%	0.753	83%	0.828	S	S	*	*			cis	-164.7	169	0.1	0	0	0	0	0	113.9
58	V	27.1	Very low	28	Very low	145 Å²	145	146.6 Å²	146.6	88%	0.879	82%	0.82	S	S	*	*			trans	-87.8	142.1	-163	169.1	0	0	0	0	114.5
59	S	27.6	Very low	28.1	Very low	120 Å²	120	149.8 Å²	149.8	84%	0.839	82%	0.818	S	S	*	*			trans	-164.1	130.7	135.9	-158.1	0	0	0	0	113.4
60	D	28.8	Very low	28	Very low	145 Å²	145	150.9 Å²	150.9	78%	0.775	82%	0.821	S	S	*	*			trans	-85.4	156.4	175.5	-94.6	-56.7	0	0	0	113.4
61	K	29.4	Very low	27.9	Very low	189 Å²	189	154.5 Å²	154.5	82%	0.822	83%	0.826	S	S	*	*			trans	-167.8	121.7	130.1	-113.8	176	177.1	176.5	0	117.2
62	D	28.6	Very low	28.1	Very low	148 Å²	148	156.4 Å²	156.4	79%	0.791	83%	0.829	S	S	*	*			trans	36.1	127.7	141.9	-60.8	-41.2	0	0	0	122.5
63	G	27.1	Very low	28.1	Very low	79 Å²	79	158.9 Å²	158.9	81%	0.814	83%	0.828	S	S	*	*			trans	175.7	104.4	161.2	0	0	0	0	0	116.6
64	L	28.6	Very low	28.2	Very low	182 Å²	182	154.5 Å²	154.5	95%	0.953	82%	0.815	S	S	*	*			trans	-78.5	160.1	173	-67.3	78.7	0	0	0	111.6
65	G	27.8	Very low	28.4	Very low	72 Å²	72	154.3 Å²	154.3	74%	0.742	81%	0.808	S	S	*	*			cis	173.1	178.6	-2.4	0	0	0	0	0	114.3
66	R	28.6	Very low	28.5	Very low	211 Å²	211	152.2 Å²	152.2	80%	0.796	81%	0.806	S	S	*	*			trans	-43.1	155.3	170.7	-82.2	172.4	166	-179.2	-2.2	114.1
67	F	28.3	Very low	28.6	Very low	171 Å²	171	148.7 Å²	148.7	75%	0.75	80%	0.802	S	S	*	*				-157.5	-145.8	64.6	-100.4	-70.7	0	0	0	115.1
68	Q	27.9	Very low	28.7	Very low	160 Å²	160	149.2 Å²	149.2	75%	0.748	81%	0.808	S	S	*	*			trans	-158.5	116.2	-135.3	-174.8	176.3	15.3	0	0	117.2
69	K	30.8	Very low	28.8	Very low	190 Å²	190	145.8 Å²	145.8	83%	0.826	80%	0.802	S	S	*	*			trans	37.7	114.7	143.5	-177.4	-174.1	-177.2	176.8	0	120.7
70	R	27.1	Very low	28.8	Very low	244 Å²	244	150 Å²	150	92%	0.921	81%	0.806	S	S	*	*			trans	168.4	167.8	151.7	-98.5	163.7	-173.1	-160.3	4.3	110.2
71	K	26.7	Very low	28.8	Very low	199 Å²	199	148.3 Å²	148.3	87%	0.865	80%	0.8	S	S	*	*			cis	-158.5	-172.2	-32.6	-144.5	-172.3	178.2	-169.3	0	108.2
72	S	30.2	Very low	28.9	Very low	104 Å²	104	150.3 Å²	150.3	73%	0.727	80%	0.802	S	S	*	*			trans	-105.7	160.1	-161	53.6	0	0	0	0	118.7
73	K	27.5	Very low	28.8	Very low	194 Å²	194	150 Å²	150	84%	0.843	81%	0.806	S	S	*	*			trans	-149.6	163.6	157	-91.2	-158.1	172.3	-173.3	0	108.7
74	T	29.6	Very low	29.1	Very low	99 Å²	99	154.5 Å²	154.5	61%	0.607	81%	0.81	S	S	*	*			cis	92.3	117.9	16.7	-70.1	0	0	0	0	115.7
75	E	31.2	Very low	29.2	Very low	166 Å²	166	151.4 Å²	151.4	78%	0.776	80%	0.804	S	S	*	*			cis	-133.5	-136.1	0.7	-140	82.6	-71.7	0	0	111
76	S	30.6	Very low	29.4	Very low	115 Å²	115	152.8 Å²	152.8	80%	0.804	81%	0.809	S	S	*	*			cis	-150.7	-121.3	10.3	63.9	0	0	0	0	114.1
77	S	31.3	Very low	29.6	Very low	117 Å²	117	154.3 Å²	154.3	82%	0.818	81%	0.814	S	S	*	*			trans	-148.4	150.4	-164.7	61	0	0	0	0	116.2
78	G	27	Very low	30.1	Very low	84 Å²	84	155.3 Å²	155.3	87%	0.866	82%	0.818	S	S	*	*			trans	146.1	146.8	163.6	0	0	0	0	0	114.1
79	G	29.8	Very low	30.5	Very low	73 Å²	73	157.2 Å²	157.2	75%	0.753	83%	0.827	S	S	*	*			trans	-170.4	164.8	179.1	0	0	0	0	0	116.2
80	F	27	Very low	31	Very low	209 Å²	209	153 Å²	153	92%	0.917	82%	0.818	S	S	*	*			trans	-156.6	-166.6	164.5	-126.8	-90.4	0	0	0	111
81	V	28.9	Very low	32.3	Very low	108 Å²	108	145 Å²	145	66%	0.655	80%	0.799	S	S	*	*			trans	-101.1	138.4	-148.8	174	0	0	0	0	115.9
82	R	32.8	Very low	33.7	Very low	231 Å²	231	139.4 Å²	139.4	87%	0.872	79%	0.79	S	S	*	*			trans	44.2	130.3	159.3	-69.9	171.6	177.8	175.6	-0.6	120.2
83	T	26	Very low	34.8	Very low	143 Å²	143	139 Å²	139	88%	0.877	78%	0.783	S	S	*	*				-168	158.3	112.3	-76.4	0	0	0	0	110.3
84	L	33.5	Very low	36.2	Very low	172 Å²	172	134.2 Å²	134.2	90%	0.901	77%	0.766	S	S	*	*			trans	-77	130.7	-175.8	-69.9	157.2	0	0	0	113.6
85	S	30.5	Very low	37.8	Very low	118 Å²	118	134.1 Å²	134.1	83%	0.825	76%	0.762	S	S	*	*			trans	-167.3	125.7	141.8	-171.2	0	0	0	0	111.3
86	A	31.4	Very low	39.2	Very low	101 Å²	101	135.2 Å²	135.2	84%	0.835	76%	0.759	S	S	*	*			trans	-95.1	96.7	179.6	0	0	0	0	0	111.2	K88	A86-K88 PolarHBondContact O-N 3.25Å
87	R	33.5	Very low	41.2	Very low	243 Å²	243	133.4 Å²	133.4	92%	0.917	74%	0.739	S	S	*	*			trans	-84.2	109.1	178.5	-152	175.1	-164.1	172.7	4.7	110.2	E89	R87-E89 PolarHBondContact O-N 3.32Å
88	K	38.7	Very low	42.8	Very low	191 Å²	191	134 Å²	134	83%	0.83	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-70.1	124.9	175.9	-69.3	179.3	178.2	176.5	0	110.6	A86 T90	A86-K88 PolarHBondContact O-N 3.25Å; K88-T90 PolarHBondContact O-N 3.03Å
89	E	37.3	Very low	44.8	Very low	200 Å²	200	137.2 Å²	137.2	94%	0.935	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-72.6	118	160.9	-66.2	-172.1	130.9	0	0	109.1	R87	R87-E89 PolarHBondContact O-N 3.32Å
90	T	41.6	Very low	46.5	Very low	103 Å²	103	138.3 Å²	138.3	63%	0.632	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-90.1	117.7	178.5	39.8	0	0	0	0	110.6	K88 L94	K88-T90 PolarHBondContact O-N 3.03Å; T90-L94 HydrophobicContact CG2-CD1 4.01Å
91	S	54.2	Low	48.5	Very low	74 Å²	74	134.1 Å²	134.1	52%	0.517	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-49.6	139.4	176.3	173.1	0	0	0	0	112.2	V93 L94	S91-V93 PolarHBondContact O-N 3.27Å; S91-V93 PolarHBondContact OG-N 3.27Å; S91-L94 PolarHBondContact O-N 2.93Å
92	A	54.8	Low	50.2	Low	82 Å²	82	134.5 Å²	134.5	68%	0.678	69%	0.685	S	S	*	*	H	α-helix	trans	-54.4	-19.3	178.4	0	0	0	0	0	114	N95 R96	A92-N95 PolarHBondContact O-N 3.17Å; A92-R96 PolarHBondContact O-N 3.2Å; A92-R96 VanDerWaalsContact O-N 3.12Å
93	V	53.9	Low	51.6	Low	95 Å²	95	126.3 Å²	126.3	58%	0.576	67%	0.666	S	S	*	*	H	α-helix	trans	-59.3	-43	171.5	179.6	0	0	0	0	111.8	S91 R96 I97	S91-V93 PolarHBondContact O-N 3.27Å; S91-V93 PolarHBondContact OG-N 3.27Å; V93-R96 PolarHBondContact O-N 2.77Å; V93-I97 HydrophobicContact CG1-CD1 3.95Å; V93-I97 WeakPolarHBondContact O-CG1 3.43Å; V93-I97 PolarHBondContact O-N 3.43Å
94	L	56.2	Low	52.9	Low	95 Å²	95	125.2 Å²	125.2	50%	0.497	66%	0.655	S	S	.	*	H	α-helix	trans	-65	-42.4	179.4	-72	170	0	0	0	111.5	T90 S91 R96 I97 Q98	T90-L94 HydrophobicContact CG2-CD1 4.01Å; S91-L94 PolarHBondContact O-N 2.93Å; L94-R96 PolarHBondContact O-N 3.28Å; L94-I97 PolarHBondContact O-N 3.49Å; L94-Q98 WeakPolarHBondContact O-CB 3.39Å; L94-Q98 PolarHBondContact O-N 3.24Å
95	N	64.4	Low	54.2	Low	96 Å²	96	125.8 Å²	125.8	51%	0.513	65%	0.65	S	S	.	*	H	α-helix	trans	-62.9	-32.7	177.1	-142.8	-64.9	0	0	0	111.6	A92 K99	A92-N95 PolarHBondContact O-N 3.17Å; N95-K99 PolarHBondContact O-N 2.65Å
96	R	59.2	Low	55.6	Low	190 Å²	190	126.2 Å²	126.2	72%	0.717	64%	0.639	S	S	*	*	H	α-helix	trans	-74.2	-39.1	174.4	-165.7	172.7	-173.6	164.1	2.1	112.9	A92 V93 L94 I100	A92-R96 PolarHBondContact O-N 3.2Å; A92-R96 VanDerWaalsContact O-N 3.12Å; V93-R96 PolarHBondContact O-N 2.77Å; L94-R96 PolarHBondContact O-N 3.28Å; R96-I100 HydrophobicContact CG-CD1 4.47Å; R96-I100 WeakPolarHBondContact O-CD1 3.49Å; R96-I100 WeakPolarHBondContact O-CG1 3.36Å; R96-I100 PolarHBondContact O-N 3.29Å
97	I	72.5	Confident	56.3	Low	76 Å²	76	127.4 Å²	127.4	39%	0.39	63%	0.631	S	S	.	*	H	α-helix	trans	-61.9	-48.8	173.4	-69.1	165.1	0	0	0	109.9	V93 L94 K99 I100 E101	V93-I97 HydrophobicContact CG1-CD1 3.95Å; V93-I97 WeakPolarHBondContact O-CG1 3.43Å; V93-I97 PolarHBondContact O-N 3.43Å; L94-I97 PolarHBondContact O-N 3.49Å; I97-K99 VanDerWaalsContact C-N 3.29Å; I97-K99 PolarHBondContact O-N 3.23Å; I97-I100 WeakPolarHBondContact O-CA 3.14Å; I97-I100 WeakPolarHBondContact O-CB 3.31Å; I97-I100 PolarHBondContact O-N 3.36Å; I97-E101 HydrophobicContact CG2-CG 4.29Å; I97-E101 PolarHBondContact O-N 2.73Å
98	Q	66.5	Low	56.8	Low	129 Å²	129	121.8 Å²	121.8	60%	0.603	63%	0.626	S	S	*	*	H	α-helix	trans	-62.2	-34.8	-177.7	-159	168.4	19.6	0	0	112.6	L94 Q102	L94-Q98 WeakPolarHBondContact O-CB 3.39Å; L94-Q98 PolarHBondContact O-N 3.24Å; Q98-Q102 WeakPolarHBondContact O-CB 3.39Å; Q98-Q102 PolarHBondContact O-N 3.26Å
99	K	68.2	Low	57.3	Low	152 Å²	152	117.5 Å²	117.5	66%	0.661	62%	0.62	S	S	*	*	H	α-helix	trans	-67.1	-33.8	170.3	-78.6	-170	175.1	-169.8	0	113.9	N95 I97 A103	N95-K99 PolarHBondContact O-N 2.65Å; I97-K99 VanDerWaalsContact C-N 3.29Å; I97-K99 PolarHBondContact O-N 3.23Å; K99-A103 WeakPolarHBondContact O-CB 3.35Å; K99-A103 PolarHBondContact O-N 3.46Å
100	I	66.2	Low	57.6	Low	96 Å²	96	113.5 Å²	113.5	49%	0.492	61%	0.611	S	S	.	*	H	α-helix	trans	-71.1	-44.7	175.8	-68	163.2	0	0	0	110	R96 I97 Q102 A103 L104	R96-I100 HydrophobicContact CG-CD1 4.47Å; R96-I100 WeakPolarHBondContact O-CD1 3.49Å; R96-I100 WeakPolarHBondContact O-CG1 3.36Å; R96-I100 PolarHBondContact O-N 3.29Å; I97-I100 WeakPolarHBondContact O-CA 3.14Å; I97-I100 WeakPolarHBondContact O-CB 3.31Å; I97-I100 PolarHBondContact O-N 3.36Å; I100-Q102 VanDerWaalsContact C-N 3.31Å; I100-Q102 PolarHBondContact O-N 3.02Å; I100-A103 PolarHBondContact O-N 2.86Å; I100-L104 HydrophobicContact CG2-CD1 3.96Å; I100-L104 WeakPolarHBondContact O-CB 3.43Å; I100-L104 VanDerWaalsContact O-CG 3.3Å; I100-L104 WeakPolarHBondContact O-CG 3.24Å; I100-L104 PolarHBondContact O-N 2.76Å
101	E	69.3	Low	57.4	Low	122 Å²	122	114.3 Å²	114.3	57%	0.57	62%	0.618	S	S	*	*	H	α-helix	trans	-61	-39.1	176.1	-69.1	177.8	155.8	0	0	112.1	I97 K105	I97-E101 HydrophobicContact CG2-CG 4.29Å; I97-E101 PolarHBondContact O-N 2.73Å; E101-K105 WeakPolarHBondContact O-CB 3.45Å; E101-K105 PolarHBondContact O-N 2.82Å
102	Q	63.7	Low	56.6	Low	115 Å²	115	116 Å²	116	54%	0.537	63%	0.627	S	S	.	*	H	α-helix	trans	-70.3	-42.6	175.8	-175.2	155.8	-8.5	0	0	112.6	Q98 I100 L104 K105 E106	Q98-Q102 WeakPolarHBondContact O-CB 3.39Å; Q98-Q102 PolarHBondContact O-N 3.26Å; I100-Q102 VanDerWaalsContact C-N 3.31Å; I100-Q102 PolarHBondContact O-N 3.02Å; Q102-L104 VanDerWaalsContact C-N 3.28Å; Q102-L104 PolarHBondContact O-N 3.17Å; Q102-K105 WeakPolarHBondContact O-CA 3.35Å; Q102-K105 WeakPolarHBondContact O-CB 3.36Å; Q102-K105 PolarHBondContact O-N 3.38Å; Q102-E106 VanDerWaalsContact CG-OE1 3.26Å; Q102-E106 WeakPolarHBondContact CG-OE1 3.46Å; Q102-E106 PolarHBondContact NE2-OE1 3.28Å; Q102-E106 PolarHBondContact O-N 2.7Å; Q102-E106 VanDerWaalsContact O-N 3.15Å
103	A	61.1	Low	55.5	Low	59 Å²	59	117.8 Å²	117.8	49%	0.488	63%	0.633	S	S	.	*	H	α-helix	trans	-60.9	-36.4	174.8	0	0	0	0	0	112.8	K99 I100 K105 E106 N107	K99-A103 WeakPolarHBondContact O-CB 3.35Å; K99-A103 PolarHBondContact O-N 3.46Å; I100-A103 PolarHBondContact O-N 2.86Å; A103-K105 VanDerWaalsContact C-N 3.26Å; A103-K105 PolarHBondContact O-N 2.86Å; A103-E106 PolarHBondContact O-N 3.37Å; A103-N107 PolarHBondContact O-N 2.8Å
104	L	53.9	Low	54.3	Low	121 Å²	121	124.9 Å²	124.9	63%	0.634	65%	0.649	S	S	*	*	H	α-helix	trans	-69.7	-21.2	173.3	-72.1	169.3	0	0	0	113.4	I100 Q102	I100-L104 HydrophobicContact CG2-CD1 3.96Å; I100-L104 WeakPolarHBondContact O-CB 3.43Å; I100-L104 VanDerWaalsContact O-CG 3.3Å; I100-L104 WeakPolarHBondContact O-CG 3.24Å; I100-L104 PolarHBondContact O-N 2.76Å; Q102-L104 VanDerWaalsContact C-N 3.28Å; Q102-L104 PolarHBondContact O-N 3.17Å
105	K	61.7	Low	52.9	Low	184 Å²	184	131.5 Å²	131.5	80%	0.8	67%	0.669	S	S	*	*	H	α-helix	trans	-86	-23.5	178.4	-158	171.9	-173.8	177.8	0	112.9	E101 Q102 A103	E101-K105 WeakPolarHBondContact O-CB 3.45Å; E101-K105 PolarHBondContact O-N 2.82Å; Q102-K105 WeakPolarHBondContact O-CA 3.35Å; Q102-K105 WeakPolarHBondContact O-CB 3.36Å; Q102-K105 PolarHBondContact O-N 3.38Å; A103-K105 VanDerWaalsContact C-N 3.26Å; A103-K105 PolarHBondContact O-N 2.86Å
106	E	59	Low	51.1	Low	127 Å²	127	135.3 Å²	135.3	59%	0.593	69%	0.688	S	S	*	*	H	α-helix	trans	-91.3	-11.9	-179.2	-70.3	169.1	-166.1	0	0	113.2	Q102 A103	Q102-E106 VanDerWaalsContact CG-OE1 3.26Å; Q102-E106 WeakPolarHBondContact CG-OE1 3.46Å; Q102-E106 PolarHBondContact NE2-OE1 3.28Å; Q102-E106 PolarHBondContact O-N 2.7Å; Q102-E106 VanDerWaalsContact O-N 3.15Å; A103-E106 PolarHBondContact O-N 3.37Å
107	N	47.4	Very low	49.6	Very low	126 Å²	126	131.4 Å²	131.4	67%	0.674	69%	0.69	S	S	*	*			trans	-138.4	93.2	175.6	-86.6	-88.8	0	0	0	112.9	A103 S109	A103-N107 PolarHBondContact O-N 2.8Å; N107-S109 PolarHBondContact O-N 2.78Å; N107-S109 VanDerWaalsContact O-N 3.13Å
108	P	44	Very low	47.6	Very low	124 Å²	124	135.2 Å²	135.2	81%	0.805	71%	0.711	S	S	*	*			trans	-78.4	95	178.6	31	-34	0	0	0	112.1
109	S	47.3	Very low	45.6	Very low	102 Å²	102	134.1 Å²	134.1	71%	0.713	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-75.1	149.8	172	57.1	0	0	0	0	112.5	N107	N107-S109 PolarHBondContact O-N 2.78Å; N107-S109 VanDerWaalsContact O-N 3.13Å
110	P	43.7	Very low	43.6	Very low	115 Å²	115	138 Å²	138	75%	0.747	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-69.1	154.6	-176.5	28	-35.4	0	0	0	113.1
111	P	37.6	Very low	41.6	Very low	120 Å²	120	137.6 Å²	137.6	78%	0.779	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-72.3	146.3	-170.3	28.7	-36	0	0	0	113.8
112	P	37.6	Very low	40.1	Very low	109 Å²	109	137.2 Å²	137.2	71%	0.708	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-70.6	159.6	173.8	30.8	-35.7	0	0	0	112.4
113	P	31.2	Very low	38.2	Very low	121 Å²	121	137.8 Å²	137.8	79%	0.786	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-64	139.1	-179.6	26.5	-34.9	0	0	0	112.3
114	R	29.2	Very low	36.5	Very low	244 Å²	244	143 Å²	143	92%	0.921	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-75.8	130.1	178.2	-72.3	-179.6	171.4	174.1	-3.5	111.3
115	Y	28.1	Very low	35.2	Very low	233 Å²	233	141.6 Å²	141.6	91%	0.914	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-70.4	143.1	163	-75.2	-95.1	0	0	0	110.4
116	L	25.2	Very low	33.6	Very low	177 Å²	177	144.8 Å²	144.8	93%	0.927	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-81.4	129.9	173.6	-76.9	164.9	0	0	0	110.2
117	S	28.3	Very low	32	Very low	107 Å²	107	146.1 Å²	146.1	75%	0.748	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-89.5	153.6	172.2	179.8	0	0	0	0	111.1
118	N	30.1	Very low	31	Very low	157 Å²	157	148.3 Å²	148.3	84%	0.84	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-56.8	150.8	177.3	-58.5	-29.7	0	0	0	112.8
119	C	25.3	Very low	30	Very low	106 Å²	106	146.5 Å²	146.5	72%	0.716	78%	0.779	S	S	*	*			trans	-112.7	171.6	173.9	-72	0	0	0	0	111.7
120	Y	26.2	Very low	28.9	Very low	232 Å²	232	150 Å²	150	91%	0.91	78%	0.782	S	S	*	*			trans	75.9	124.3	-171.3	-57.1	-74.9	0	0	0	113.7
121	A	23.6	Very low	28	Very low	88 Å²	88	150 Å²	150	73%	0.727	78%	0.78	S	S	*	*			cis	-143.5	-154.4	0.7	0	0	0	0	0	111.7
122	P	37.6	Very low	27.3	Very low	115 Å²	115	151.5 Å²	151.5	75%	0.747	78%	0.78	S	S	*	*				-124.8	165.4	-109.9	38.6	-22	0	0	0	115.1
123	D	23.6	Very low	26.8	Very low	126 Å²	126	149.6 Å²	149.6	67%	0.674	78%	0.779	S	S	*	*				-157.7	173.5	125.7	-132.3	-17.6	0	0	0	117.4
124	K	26.9	Very low	26.6	Very low	168 Å²	168	150.7 Å²	150.7	73%	0.73	78%	0.779	S	S	*	*			trans	-73.2	153.4	-170.6	-42.2	119.5	-166.4	129.5	0	114
125	A	26.1	Very low	26.5	Very low	92 Å²	92	145.8 Å²	145.8	76%	0.76	77%	0.771	S	S	*	*				160	129.8	95.3	0	0	0	0	0	114.9
126	R	27.9	Very low	26.6	Very low	252 Å²	252	139.2 Å²	139.2	95%	0.951	75%	0.751	S	S	*	*				-169.1	140.9	120.4	-109.6	176	179.4	-175.2	-1	114
127	Q	25.8	Very low	26.8	Very low	155 Å²	155	135.8 Å²	135.8	72%	0.724	73%	0.734	S	S	*	*			trans	-75.1	175.1	161.6	-58.1	174.3	-7.9	0	0	108.9
128	K	25.8	Very low	26.9	Very low	172 Å²	172	133.4 Å²	133.4	75%	0.748	72%	0.717	S	S	*	*			cis	-169.3	160.5	16.9	-133.2	150.5	-173.9	159.6	0	105.7
129	S	23.6	Very low	27	Very low	85 Å²	85	131.8 Å²	131.8	59%	0.594	71%	0.713	S	S	*	*			cis	-159.9	175.7	-16.9	38	0	0	0	0	106.8
130	F	23.6	Very low	27.1	Very low	176 Å²	176	133 Å²	133	77%	0.772	72%	0.721	S	S	*	*				-178.3	129.3	94.4	-107.1	-101.6	0	0	0	107
131	V	25	Very low	27.1	Very low	115 Å²	115	126.2 Å²	126.2	70%	0.697	71%	0.713	S	S	*	*				67	131	108.6	165.1	0	0	0	0	114.5
132	I	23.6	Very low	27.3	Very low	152 Å²	152	127 Å²	127	78%	0.779	71%	0.713	S	S	*	*			cis	-168.9	157.7	-5	-101.2	173.4	0	0	0	103.6
133	G	26.2	Very low	26.8	Very low	68 Å²	68	130.6 Å²	130.6	70%	0.701	72%	0.717	S	S	*	*			trans	155.9	127.6	170.2	0	0	0	0	0	113.4
134	D	26.8	Very low	26.9	Very low	144 Å²	144	135.6 Å²	135.6	77%	0.77	73%	0.726	S	S	*	*			trans	-115.1	177	-155.6	-59.6	-76.3	0	0	0	116.6
135	D	28.2	Very low	26.8	Very low	142 Å²	142	131.8 Å²	131.8	76%	0.759	72%	0.721	S	S	*	*			trans	81.9	100.9	154.1	-73.6	-21	0	0	0	124.7
136	L	30	Very low	26.9	Very low	94 Å²	94	132.6 Å²	132.6	49%	0.492	72%	0.721	S	S	.	*				45.6	126	119.7	-87.7	73.8	0	0	0	123.9
137	D	28.6	Very low	26.9	Very low	106 Å²	106	128.1 Å²	128.1	57%	0.567	71%	0.714	S	S	*	*				59.9	164.6	128.1	-59.3	-12.3	0	0	0	121.3	S352	D137-S352 WeakPolarHBondContact O-CA 3.48Å
138	S	31.5	Very low	26.8	Very low	56 Å²	56	125.9 Å²	125.9	39%	0.392	72%	0.715	S	S	.	*			cis	-146	164.2	4.5	100.5	0	0	0	0	115.3	P351	S138-P351 VanDerWaalsContact CB-O 3.31Å; S138-P351 WeakPolarHBondContact CB-O 3.42Å; S138-P351 PolarHBondContact N-O 3.25Å; S138-P351 PolarHBondContact OG-O 2.94Å
139	T	30.9	Very low	26.9	Very low	123 Å²	123	123.1 Å²	123.1	76%	0.755	72%	0.717	S	S	*	*			trans	7.4	142.6	148.4	5.5	0	0	0	0	124.3
140	C	27.1	Very low	26.9	Very low	133 Å²	133	126 Å²	126	90%	0.899	73%	0.73	S	S	*	*				-151.3	175.8	117.5	-156	0	0	0	0	110.9
141	A	27	Very low	27.1	Very low	89 Å²	89	121.5 Å²	121.5	74%	0.736	73%	0.726	S	S	*	*			trans	-142.1	168	-162.9	0	0	0	0	0	115
142	S	27.7	Very low	27.2	Very low	104 Å²	104	122.5 Å²	122.5	73%	0.727	73%	0.732	S	S	*	*			trans	-166.4	123.4	140.1	-147.3	0	0	0	0	117.5
143	K	27.1	Very low	27.5	Very low	190 Å²	190	123.1 Å²	123.1	83%	0.826	73%	0.732	S	S	*	*			trans	36.2	118.7	133.7	-60.6	173.8	-175.8	172.7	0	123.9
144	R	25.3	Very low	28.5	Very low	231 Å²	231	124.6 Å²	124.6	87%	0.872	73%	0.73	S	S	*	*				51.4	111.5	108.9	-108.2	-167.1	-179.4	175.6	-0.3	122.6
145	S	24.8	Very low	28.6	Very low	88 Å²	88	124.2 Å²	124.2	62%	0.615	73%	0.727	S	S	*	*				58.3	130.2	119.1	66.3	0	0	0	0	125.4
146	S	27.9	Very low	28.7	Very low	109 Å²	109	122.6 Å²	122.6	76%	0.762	72%	0.723	S	S	*	*			trans	68.4	172.3	146.1	59.6	0	0	0	0	117.5
147	I	28	Very low	28.8	Very low	159 Å²	159	125.5 Å²	125.5	82%	0.815	74%	0.737	S	S	*	*			cis	-142.9	178.7	21.3	-53.5	163.6	0	0	0	111.1
148	C	23.8	Very low	28.9	Very low	108 Å²	108	127.7 Å²	127.7	73%	0.73	75%	0.748	S	S	*	*			trans	-87	170.3	-174.8	-49.6	0	0	0	0	117.7
149	S	27.4	Very low	28.7	Very low	113 Å²	113	131 Å²	131	79%	0.79	77%	0.765	S	S	*	*			trans	81	134.2	141.9	-58	0	0	0	0	122.5
150	V	24.8	Very low	28.6	Very low	145 Å²	145	130.1 Å²	130.1	88%	0.879	77%	0.765	S	S	*	*				163.6	164.3	118.6	162.6	0	0	0	0	110.6
151	A	26.7	Very low	28.6	Very low	83 Å²	83	129.3 Å²	129.3	69%	0.686	75%	0.751	S	S	*	*			trans	-76	-179.5	-172	0	0	0	0	0	114.6
152	T	28.5	Very low	28.8	Very low	135 Å²	135	132.6 Å²	132.6	83%	0.828	75%	0.749	S	S	*	*				-167.5	165.4	58.6	-38.3	0	0	0	0	113.4
153	E	29.1	Very low	29	Very low	165 Å²	165	134.2 Å²	134.2	77%	0.771	75%	0.749	S	S	*	*			trans	-55.3	174.8	170.7	-72.8	-65.4	143.2	0	0	115.6
154	P	46.6	Very low	29	Very low	100 Å²	100	130.7 Å²	130.7	65%	0.649	75%	0.748	S	S	*	*			cis	-147.8	172.1	25	44.8	-24.8	0	0	0	121.7
155	D	28.9	Very low	29.3	Very low	136 Å²	136	130.8 Å²	130.8	73%	0.727	75%	0.748	S	S	*	*			trans	63.3	147.8	145.3	-71.9	-33.9	0	0	0	121.7
156	T	31.2	Very low	29.4	Very low	107 Å²	107	133.1 Å²	133.1	66%	0.656	75%	0.753	S	S	*	*			cis	-156.1	156.9	-0	6.2	0	0	0	0	113
157	I	31.6	Very low	29.5	Very low	155 Å²	155	138.3 Å²	138.3	80%	0.795	76%	0.756	S	S	*	*			trans	66	136	148.2	-70.4	164.2	0	0	0	119.4
158	L	30.5	Very low	29.5	Very low	152 Å²	152	137.9 Å²	137.9	80%	0.796	75%	0.751	S	S	*	*			cis	-170.5	152.1	-14.9	179.8	70.3	0	0	0	110.8
159	V	27.5	Very low	29.6	Very low	125 Å²	125	143.3 Å²	143.3	76%	0.758	76%	0.756	S	S	*	*			trans	141.9	126.6	140.7	170.9	0	0	0	0	114.1
160	S	28.6	Very low	29.6	Very low	106 Å²	106	147.7 Å²	147.7	74%	0.741	76%	0.761	S	S	*	*			trans	4.1	126.5	170.1	-64	0	0	0	0	120.2
161	D	28.5	Very low	29.6	Very low	116 Å²	116	146.7 Å²	146.7	62%	0.62	76%	0.761	S	S	*	*			cis	70.1	138.5	33.4	-121.7	-1.9	0	0	0	113.5
162	K	31	Very low	29.8	Very low	158 Å²	158	149.8 Å²	149.8	69%	0.687	77%	0.771	S	S	*	*			cis	-156	129	14.3	-155.8	142.7	-144.7	152.1	0	114.9
163	L	32.1	Very low	29.6	Very low	138 Å²	138	149 Å²	149	72%	0.723	77%	0.771	S	S	*	*			trans	35.3	146.7	137.2	-76.7	163.7	0	0	0	123.3
164	S	27.5	Very low	29.6	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	77%	0.77	S	S	*	*				-168.2	163.2	78	52.2	0	0	0	0	117.1
165	R	31.5	Very low	28.6	Very low	233 Å²	233	147.5 Å²	147.5	88%	0.879	78%	0.776	S	S	*	*			trans	-160.3	159.5	-171.1	-75.9	-173.8	-178.6	168.2	0.6	109.1
166	L	26.6	Very low	28.5	Very low	137 Å²	137	151.8 Å²	151.8	72%	0.717	78%	0.782	S	S	*	*			cis	-177.2	140.4	-15	167.2	62.6	0	0	0	109.1
167	R	28.8	Very low	28.3	Very low	218 Å²	218	150.9 Å²	150.9	82%	0.823	78%	0.779	S	S	*	*			trans	66.7	169.9	176.8	-70.1	170.4	171.3	-179.2	-2.3	114.3
168	Q	28.6	Very low	27.9	Very low	151 Å²	151	152.4 Å²	152.4	71%	0.706	78%	0.783	S	S	*	*			cis	-156.2	170.4	8.1	-148	177.9	1.7	0	0	113.3
169	R	26.4	Very low	27.8	Very low	221 Å²	221	150.7 Å²	150.7	83%	0.834	78%	0.784	S	S	*	*			trans	93.2	156.2	153.6	-72.5	-179.6	179.1	-175.9	-1.3	120.1
170	F	27.4	Very low	28.2	Very low	205 Å²	205	150.8 Å²	150.8	90%	0.899	79%	0.787	S	S	*	*			trans	-96.8	156.8	-171.9	-57.4	-107.9	0	0	0	112.3
171	S	23.7	Very low	27.9	Very low	125 Å²	125	154.3 Å²	154.3	87%	0.874	79%	0.792	S	S	*	*			trans	-168.4	165.1	130.1	-83.9	0	0	0	0	111.1
172	V	31.4	Very low	28.6	Very low	148 Å²	148	154 Å²	154	90%	0.897	80%	0.796	S	S	*	*			trans	-116.9	133.7	-175.7	-179	0	0	0	0	110.4
173	S	25.2	Very low	28.3	Very low	119 Å²	119	154.8 Å²	154.8	83%	0.832	80%	0.802	S	S	*	*			trans	-152.2	172.2	162.7	60.3	0	0	0	0	110.4
174	S	27.7	Very low	28	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	80%	0.799	S	S	*	*			trans	-132.6	-174.7	-167.9	-170.8	0	0	0	0	111.9
175	T	26.5	Very low	28	Very low	126 Å²	126	156.7 Å²	156.7	77%	0.773	81%	0.805	S	S	*	*			trans	79	101	169	64.7	0	0	0	0	119.7
176	R	26.8	Very low	27.9	Very low	226 Å²	226	154.5 Å²	154.5	85%	0.853	81%	0.805	S	S	*	*				54.9	135.9	109.9	-157.8	-164.9	179.2	160.7	0.4	120.4
177	S	27.1	Very low	27.8	Very low	87 Å²	87	154.1 Å²	154.1	61%	0.608	81%	0.808	S	S	*	*			trans	64.8	149.9	157.7	35.4	0	0	0	0	117
178	E	23.7	Very low	27.8	Very low	188 Å²	188	148.5 Å²	148.5	88%	0.879	80%	0.802	S	S	*	*			cis	-154.1	173.4	-12.6	-117.2	160.6	132.6	0	0	108.8
179	S	28	Very low	27.8	Very low	115 Å²	115	148 Å²	148	80%	0.804	81%	0.81	S	S	*	*			trans	-72.6	162.9	179.4	-48.2	0	0	0	0	112.7
180	P	34.3	Very low	27.9	Very low	127 Å²	127	140.5 Å²	140.5	83%	0.825	80%	0.801	S	S	*	*				-148	162.7	85	40.3	-23.3	0	0	0	117.5
181	E	24.1	Very low	28	Very low	181 Å²	181	136.6 Å²	136.6	85%	0.846	79%	0.794	S	S	*	*			trans	-78	-176	158.5	-87.2	-173.8	162	0	0	111.2
182	P	41.7	Very low	28.1	Very low	108 Å²	108	139.1 Å²	139.1	70%	0.701	79%	0.792	S	S	*	*			cis	-119.5	-160.1	7.6	26.7	-0.4	0	0	0	111.5
183	Q	24.4	Very low	27.9	Very low	176 Å²	176	137.8 Å²	137.8	82%	0.822	78%	0.784	S	S	*	*			cis	-152.2	178.7	25.8	-79.7	-174	-6.7	0	0	110.7
184	S	26.2	Very low	28.1	Very low	93 Å²	93	139.3 Å²	139.3	65%	0.65	78%	0.782	S	S	*	*			cis	159.2	121.6	-43.8	66.5	0	0	0	0	109
185	Q	28.5	Very low	28.4	Very low	200 Å²	200	139.5 Å²	139.5	94%	0.935	78%	0.781	S	S	*	*			trans	-153.6	150.3	156.7	-113.1	175.9	12.3	0	0	109.7
186	Q	28.8	Very low	28.6	Very low	186 Å²	186	141.7 Å²	141.7	87%	0.869	79%	0.787	S	S	*	*			trans	-142.4	152.8	-166.8	-77	-175.9	-22.5	0	0	112.5
187	T	24.7	Very low	28.9	Very low	130 Å²	130	136.4 Å²	136.4	80%	0.798	78%	0.782	S	S	*	*			trans	-153.8	106.7	141.7	25.8	0	0	0	0	106.5
188	S	29.3	Very low	29.2	Very low	100 Å²	100	141.4 Å²	141.4	70%	0.699	79%	0.793	S	S	*	*				60.7	125.5	84.8	72.2	0	0	0	0	112.6
189	V	28.2	Very low	29.5	Very low	141 Å²	141	138.8 Å²	138.8	86%	0.855	79%	0.793	S	S	*	*			cis	-139.4	150.6	28.3	179	0	0	0	0	108.1
190	G	28.8	Very low	29.7	Very low	63 Å²	63	142.6 Å²	142.6	65%	0.649	80%	0.795	S	S	*	*			cis	120.7	134.3	15.9	0	0	0	0	0	109.1
191	T	28.5	Very low	29.7	Very low	123 Å²	123	147.2 Å²	147.2	76%	0.755	80%	0.796	S	S	*	*			cis	-157.7	114.4	4.3	-61.7	0	0	0	0	105.7
192	Q	25.9	Very low	29.9	Very low	177 Å²	177	145.1 Å²	145.1	83%	0.827	80%	0.795	S	S	*	*				62.8	131.6	83.3	-162.6	-170	76.5	0	0	115.2
193	V	28.5	Very low	29.1	Very low	120 Å²	120	147.5 Å²	147.5	73%	0.727	80%	0.795	S	S	*	*			trans	170.5	119.4	130.8	155.2	0	0	0	0	112.9
194	N	28.1	Very low	29.2	Very low	151 Å²	151	147.4 Å²	147.4	81%	0.807	79%	0.794	S	S	*	*			trans	43.9	149.9	155.5	-77.5	-19.9	0	0	0	126.2
195	P	34.5	Very low	29.1	Very low	112 Å²	112	153.9 Å²	153.9	73%	0.727	81%	0.806	S	S	*	*			trans	-95.8	170.7	177.3	40.3	-37	0	0	0	114.3
196	L	30	Very low	29	Very low	172 Å²	172	150.8 Å²	150.8	90%	0.901	80%	0.796	S	S	*	*			trans	-110.3	156.7	168.5	-76.6	171.9	0	0	0	112.4
197	P	34.1	Very low	29	Very low	114 Å²	114	145.6 Å²	145.6	74%	0.74	79%	0.785	S	S	*	*			trans	-96.6	169.5	-156.9	37.4	-37.6	0	0	0	115.8
198	K	32.8	Very low	29.1	Very low	192 Å²	192	147 Å²	147	84%	0.835	78%	0.78	S	S	*	*			trans	-60.2	135.9	170.6	-62.4	175.9	-179.6	176.9	0	111.2	K200	K198-K200 PolarHBondContact O-N 3.02Å
199	P	30.9	Very low	29.1	Very low	134 Å²	134	152 Å²	152	87%	0.87	78%	0.783	S	S	*	*			trans	-69.3	115	171.6	28.1	-33.1	0	0	0	110.6
200	K	31.3	Very low	29.1	Very low	195 Å²	195	151 Å²	151	85%	0.848	77%	0.773	S	S	*	*			trans	-103.6	113.7	164.9	-98	-169.8	175.1	-176.2	0	109.8	K198 T202	K198-K200 PolarHBondContact O-N 3.02Å; K200-T202 PolarHBondContact O-N 3.14Å; K200-T202 VanDerWaalsContact O-N 3.09Å
201	R	33.5	Very low	29.1	Very low	224 Å²	224	157.3 Å²	157.3	85%	0.845	79%	0.786	S	S	*	*			trans	-5.4	97.7	143.3	-174.5	-178	-168	167.8	3.5	113.8
202	T	28.4	Very low	29	Very low	137 Å²	137	159.2 Å²	159.2	84%	0.84	78%	0.783	S	S	*	*			trans	-74.1	168.4	159.6	39.7	0	0	0	0	110.1	K200	K200-T202 PolarHBondContact O-N 3.14Å; K200-T202 VanDerWaalsContact O-N 3.09Å
203	F	26.6	Very low	29.1	Very low	157 Å²	157	156.2 Å²	156.2	69%	0.689	77%	0.773	S	S	*	*			trans	-121.4	146.7	-151.7	-101	-107.9	0	0	0	113.5
204	E	24.6	Very low	29.1	Very low	174 Å²	174	156.1 Å²	156.1	81%	0.813	77%	0.773	S	S	*	*			trans	73.1	142.8	131.6	-154.1	145	-122.6	0	0	120.4
205	Y	25.3	Very low	29.1	Very low	230 Å²	230	156.2 Å²	156.2	90%	0.902	77%	0.772	S	S	*	*			trans	-88.2	137.6	167.3	-100.9	-114.2	0	0	0	108.7
206	D	26.3	Very low	28.7	Very low	135 Å²	135	155.9 Å²	155.9	72%	0.722	77%	0.773	S	S	*	*			trans	-125	149.5	153.3	-172.2	10.6	0	0	0	108.4	K208	D206-K208 IonicContact OD1-NZ 2.83Å; D206-K208 PolarHBondContact OD1-NZ 3.01Å; D206-K208 IonicContact OD2-NZ 2.8Å; D206-K208 PolarHBondContact OD2-NZ 3.1Å
207	A	28.9	Very low	28.6	Very low	76 Å²	76	151.6 Å²	151.6	63%	0.628	76%	0.762	S	S	*	*			trans	-133.2	129.9	-166.6	0	0	0	0	0	112.5
208	K	27.4	Very low	28.3	Very low	159 Å²	159	154.1 Å²	154.1	69%	0.691	77%	0.769	S	S	*	*			trans	-155.3	144.7	164	-79.7	103.9	-165.1	158.4	0	106.9	D206	D206-K208 IonicContact OD1-NZ 2.83Å; D206-K208 PolarHBondContact OD1-NZ 3.01Å; D206-K208 IonicContact OD2-NZ 2.8Å; D206-K208 PolarHBondContact OD2-NZ 3.1Å
209	R	29	Very low	27.9	Very low	207 Å²	207	148 Å²	148	78%	0.781	76%	0.761	S	S	*	*			cis	-159.6	158.9	0.4	-126.8	-176.5	157.3	146.6	1.8	111.3
210	D	27.9	Very low	27.9	Very low	119 Å²	119	150 Å²	150	64%	0.636	76%	0.763	S	S	*	*			trans	34.7	113.7	148	-49	-26.2	0	0	0	119.8
211	Q	27.8	Very low	29	Very low	195 Å²	195	146 Å²	146	91%	0.911	76%	0.757	S	S	*	*				-163.7	143.4	98.4	-102.8	177.7	41.2	0	0	116.1
212	K	28.2	Very low	29.4	Very low	163 Å²	163	141 Å²	141	71%	0.709	75%	0.754	S	S	*	*			trans	-23.4	151.5	165.4	-89.6	172.6	141.4	-67	0	122.8
213	D	27.4	Very low	29.4	Very low	115 Å²	115	140 Å²	140	62%	0.615	74%	0.743	S	S	*	*			trans	80.4	120.4	131.7	-64.5	-9.9	0	0	0	123.3
214	V	28.2	Very low	29.5	Very low	118 Å²	118	142.7 Å²	142.7	72%	0.715	75%	0.749	S	S	*	*				83.1	109	121.9	174	0	0	0	0	121.6
215	L	27.4	Very low	29.6	Very low	153 Å²	153	139.5 Å²	139.5	80%	0.801	74%	0.741	S	S	*	*			trans	74	145.1	139.2	-74.8	176.2	0	0	0	124.7
216	S	26	Very low	30	Very low	105 Å²	105	134 Å²	134	73%	0.734	74%	0.737	S	S	*	*			trans	70.2	110.4	140.6	-66.4	0	0	0	0	123
217	A	27.8	Very low	30	Very low	82 Å²	82	137.1 Å²	137.1	68%	0.678	75%	0.747	S	S	*	*			trans	-20	143.6	143.3	0	0	0	0	0	118.6
218	N	27.9	Very low	30.4	Very low	167 Å²	167	138.6 Å²	138.6	89%	0.893	75%	0.752	S	S	*	*				-174.6	149.8	104.9	-95.2	-38.3	0	0	0	114.5
219	G	26.1	Very low	31.1	Very low	63 Å²	63	136.7 Å²	136.7	65%	0.649	76%	0.757	S	S	*	*				82.2	84.6	121.6	0	0	0	0	0	122.4
220	L	30.2	Very low	31.6	Very low	176 Å²	176	132.8 Å²	132.8	92%	0.921	76%	0.758	S	S	*	*			trans	74.7	163.2	132.2	-65.9	172.1	0	0	0	120.4
221	P	54.3	Low	32.6	Very low	110 Å²	110	133 Å²	133	71%	0.714	77%	0.766	S	S	*	*			trans	-111.6	-172.8	-159.5	44.1	-34.8	0	0	0	114.2
222	P	42.5	Very low	33.2	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	77%	0.765	S	S	*	*				-149.4	155.4	93.9	39.2	-22.3	0	0	0	118.4
223	D	27.8	Very low	33.9	Very low	116 Å²	116	129.5 Å²	129.5	62%	0.62	77%	0.767	S	S	*	*			trans	9.4	124.6	136.1	-170.2	38.1	0	0	0	119.7
224	R	28.8	Very low	34.1	Very low	212 Å²	212	129.3 Å²	129.3	80%	0.8	77%	0.774	S	S	*	*				177.6	130.9	105	-92.2	-172.2	-175.3	-171.6	1.6	118.7
225	T	26.7	Very low	34.8	Very low	107 Å²	107	130.2 Å²	130.2	66%	0.656	78%	0.78	S	S	*	*			trans	18.6	124.9	144.8	59	0	0	0	0	123.8
226	S	33.7	Very low	35.8	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	78%	0.778	S	S	*	*			trans	64.5	118.7	130.4	67.7	0	0	0	0	122.8
227	E	26.8	Very low	36.2	Very low	200 Å²	200	127.7 Å²	127.7	94%	0.935	78%	0.778	S	S	*	*			trans	-150.6	165.7	142	-143	169	-159.4	0	0	111.2
228	S	36.7	Very low	37.3	Very low	107 Å²	107	130.1 Å²	130.1	75%	0.748	79%	0.787	S	S	*	*			trans	-118	158.4	-170.3	53.4	0	0	0	0	113.3
229	P	41.9	Very low	37.4	Very low	120 Å²	120	127.7 Å²	127.7	78%	0.779	78%	0.783	S	S	*	*			trans	-79.3	157.6	-168.1	31.9	-37.1	0	0	0	115.5
230	P	39.5	Very low	37.7	Very low	124 Å²	124	130.9 Å²	130.9	81%	0.805	79%	0.79	S	S	*	*			trans	-78.4	168.4	177.3	32.9	-36.2	0	0	0	114.3
231	P	48.2	Very low	37.8	Very low	125 Å²	125	128.4 Å²	128.4	81%	0.812	78%	0.782	S	S	*	*			trans	-106.3	175.4	-153.7	40.7	-37.7	0	0	0	117.3
232	L	41.1	Very low	36.7	Very low	170 Å²	170	132.8 Å²	132.8	89%	0.89	78%	0.784	S	S	*	*			trans	-96	150.6	167.8	-69.7	168.3	0	0	0	112.4
233	P	42.7	Very low	36.1	Very low	114 Å²	114	131.2 Å²	131.2	74%	0.74	77%	0.773	S	S	*	*			trans	-111.5	168.7	158.2	38.3	-29.9	0	0	0	112.6
234	S	32.6	Very low	36.2	Very low	111 Å²	111	130.9 Å²	130.9	78%	0.776	78%	0.775	S	S	*	*				-174.8	133.4	-57.3	46.3	0	0	0	0	109.4
235	T	42.3	Very low	36.2	Very low	137 Å²	137	128.9 Å²	128.9	84%	0.84	77%	0.772	S	S	*	*			trans	-99.9	160.2	175.8	48.9	0	0	0	0	112.9
236	P	49.3	Very low	36.3	Very low	117 Å²	117	129.5 Å²	129.5	76%	0.76	77%	0.767	S	S	*	*			trans	-133.5	156.6	130.3	14.1	7.9	0	0	0	112.4
237	A	33.4	Very low	36	Very low	88 Å²	88	132.5 Å²	132.5	73%	0.727	77%	0.768	S	S	*	*			cis	78.4	175.9	31.3	0	0	0	0	0	113
238	P	51.1	Low	35.9	Very low	133 Å²	133	126.1 Å²	126.1	86%	0.864	76%	0.756	S	S	*	*			cis	-86.2	-159.8	12.1	38.6	-39.4	0	0	0	114.4
239	S	30.9	Very low	35.5	Very low	116 Å²	116	127 Å²	127	81%	0.811	76%	0.763	S	S	*	*			trans	-153.2	166.8	178.2	62.7	0	0	0	0	113.9
240	T	30.9	Very low	35	Very low	130 Å²	130	130.8 Å²	130.8	80%	0.798	77%	0.767	S	S	*	*			trans	-154.8	166.3	-171.7	52.4	0	0	0	0	109.2
241	T	33.7	Very low	35.1	Very low	123 Å²	123	130.4 Å²	130.4	76%	0.755	76%	0.764	S	S	*	*			cis	-168.7	162	-24.2	32.1	0	0	0	0	106.1
242	R	30.8	Very low	34	Very low	202 Å²	202	131.1 Å²	131.1	76%	0.762	77%	0.766	S	S	*	*			cis	-162.1	141.4	3.6	-131.6	-160.9	60.9	-178	-5.4	109.8
243	T	29.5	Very low	33.5	Very low	88 Å²	88	133.9 Å²	133.9	54%	0.54	77%	0.765	S	S	.	*			trans	54.3	141.9	146.1	56.2	0	0	0	0	122.5
244	T	29.1	Very low	32.8	Very low	109 Å²	109	135.8 Å²	135.8	67%	0.669	77%	0.767	S	S	*	*			cis	-175.7	142.7	-3.4	24.8	0	0	0	0	113.6
245	K	30.4	Very low	33.7	Very low	170 Å²	170	135.1 Å²	135.1	74%	0.739	76%	0.76	S	S	*	*			trans	64.6	159	140.8	-65	-167.7	161.5	-132.4	0	120.4
246	H	28.3	Very low	32.9	Very low	120 Å²	120	135.3 Å²	135.3	56%	0.556	76%	0.756	S	S	*	*			cis	-156.3	160.5	-0.7	-134.8	-138.6	0	0	0	114.2
247	E	26.5	Very low	31.8	Very low	178 Å²	178	139.8 Å²	139.8	83%	0.832	76%	0.758	S	S	*	*			trans	49	164.9	147.6	-83.4	169.7	159.9	0	0	124.6
248	G	26.3	Very low	31.6	Very low	66 Å²	66	142.7 Å²	142.7	68%	0.68	76%	0.756	S	S	*	*			trans	-178.6	-33.1	168.7	0	0	0	0	0	124.9
249	S	26.5	Very low	30.4	Very low	126 Å²	126	143.3 Å²	143.3	88%	0.881	75%	0.751	S	S	*	*			trans	65.3	-174.1	-179.5	85.1	0	0	0	0	119
250	K	33.1	Very low	30.3	Very low	200 Å²	200	142.4 Å²	142.4	87%	0.87	74%	0.744	S	S	*	*			trans	-136	150.6	175.6	-67.1	-178.2	179.6	178.4	0	109.4
251	P	40.1	Very low	30.2	Very low	115 Å²	115	143.9 Å²	143.9	75%	0.747	74%	0.742	S	S	*	*				-152.6	156.1	114.8	36.9	-19.7	0	0	0	117.7
252	V	25.7	Very low	30	Very low	140 Å²	140	143.2 Å²	143.2	85%	0.848	74%	0.742	S	S	*	*			trans	48.2	156.7	134.9	-171.1	0	0	0	0	122.2
253	R	30.4	Very low	30	Very low	228 Å²	228	141.5 Å²	141.5	86%	0.86	74%	0.743	S	S	*	*			trans	-95.2	-174.2	-178	-63.6	172.1	167.5	171.4	-6.1	113
254	I	29	Very low	30.2	Very low	154 Å²	154	144.3 Å²	144.3	79%	0.79	76%	0.755	S	S	*	*			trans	94.2	135.9	158.6	-57.3	162.2	0	0	0	113.7
255	P	50.2	Low	30.3	Very low	97 Å²	97	142.7 Å²	142.7	63%	0.63	75%	0.752	S	S	*	*			cis	-135.4	-155.1	-20.5	39.7	-19.5	0	0	0	113.7
256	D	25.7	Very low	30.3	Very low	141 Å²	141	139 Å²	139	75%	0.754	75%	0.754	S	S	*	*			trans	67.2	105.9	148.6	-65.4	-20.8	0	0	0	123.2
257	R	27.4	Very low	30.3	Very low	212 Å²	212	139 Å²	139	80%	0.8	77%	0.767	S	S	*	*				62.5	137.6	104.1	-159.3	171.5	-170.1	178	-1.1	121.7
258	E	27.3	Very low	30.4	Very low	148 Å²	148	138.5 Å²	138.5	69%	0.692	77%	0.769	S	S	*	*			trans	-35.3	143.3	166.2	-50.6	148.6	136.3	0	0	116.9
259	L	26	Very low	31.2	Very low	146 Å²	146	140.9 Å²	140.9	76%	0.764	77%	0.772	S	S	*	*				-156.1	135.4	109.9	-120.6	74.1	0	0	0	108
260	C	28.6	Very low	31.2	Very low	98 Å²	98	139.7 Å²	139.7	66%	0.662	76%	0.764	S	S	*	*				63.6	147.9	102.6	-75.8	0	0	0	0	116
261	E	29.4	Very low	30.8	Very low	160 Å²	160	135.2 Å²	135.2	75%	0.748	76%	0.758	S	S	*	*			cis	-146.7	172.9	9	-123.7	134.2	-125.7	0	0	107.9
262	S	30.6	Very low	30.1	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	77%	0.765	S	S	*	*			cis	-152	172	25.5	60	0	0	0	0	114.1
263	E	30	Very low	31.4	Very low	167 Å²	167	139.2 Å²	139.2	78%	0.78	76%	0.759	S	S	*	*			trans	-81.9	-177.9	-179.3	-46.1	149.2	115.1	0	0	111.8
264	D	32.8	Very low	31.1	Very low	147 Å²	147	134 Å²	134	79%	0.786	76%	0.757	S	S	*	*			cis	-159	174.1	2.9	-152.8	2	0	0	0	114.8
265	A	33	Very low	31.4	Very low	74 Å²	74	131.8 Å²	131.8	61%	0.612	76%	0.756	S	S	*	*			trans	72.4	100	137.9	0	0	0	0	0	123.4
266	A	29.3	Very low	31.3	Very low	94 Å²	94	132 Å²	132	78%	0.777	76%	0.757	S	S	*	*				60.6	128.4	120	0	0	0	0	0	123.2
267	S	28	Very low	31.6	Very low	119 Å²	119	131.3 Å²	131.3	83%	0.832	76%	0.758	S	S	*	*				172.7	154.2	112	-75.9	0	0	0	0	114.6
268	L	29.9	Very low	32	Very low	168 Å²	168	128.5 Å²	128.5	88%	0.88	75%	0.754	S	S	*	*			trans	-95.6	178.5	157.8	-62.4	170.6	0	0	0	108.2
269	P	42.2	Very low	32.3	Very low	115 Å²	115	128.2 Å²	128.2	75%	0.747	76%	0.758	S	S	*	*			cis	-142.9	-171.7	6.2	42.9	-23	0	0	0	116.6
270	S	26.7	Very low	32.5	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	76%	0.757	S	S	*	*			trans	85.2	140.2	135.6	-162.3	0	0	0	0	124.1
271	S	25.3	Very low	32.5	Very low	106 Å²	106	124.9 Å²	124.9	74%	0.741	77%	0.765	S	S	*	*			trans	73.6	118.8	140.6	45.4	0	0	0	0	124.3
272	Y	25.2	Very low	32.7	Very low	228 Å²	228	125 Å²	125	89%	0.894	77%	0.77	S	S	*	*			trans	-52.4	179.9	144.2	-70.1	-77.6	0	0	0	114.6
273	P	51.5	Low	32.7	Very low	111 Å²	111	126.2 Å²	126.2	72%	0.721	77%	0.773	S	S	*	*			cis	-134.1	-170.3	-20.1	26	-2.5	0	0	0	114.3
274	S	25.6	Very low	32.7	Very low	117 Å²	117	122.8 Å²	122.8	82%	0.818	77%	0.773	S	S	*	*			trans	116.7	155.5	146.3	-45.4	0	0	0	0	118.4
275	S	35.5	Very low	32.7	Very low	109 Å²	109	122.9 Å²	122.9	76%	0.762	77%	0.773	S	S	*	*			trans	-97.5	-165.7	-173.1	57.8	0	0	0	0	111.8
276	P	46.5	Very low	33.6	Very low	100 Å²	100	123.4 Å²	123.4	65%	0.649	77%	0.771	S	S	*	*			cis	-147.3	177.7	7.4	40.5	-18.2	0	0	0	119.5
277	T	32.9	Very low	33.6	Very low	128 Å²	128	128.4 Å²	128.4	79%	0.785	78%	0.775	S	S	*	*			trans	62.4	164.8	149	43.3	0	0	0	0	120.1
278	E	34.7	Very low	33.7	Very low	153 Å²	153	127.4 Å²	127.4	72%	0.715	77%	0.768	S	S	*	*			cis	-158	174.5	7.4	-141.6	-175.9	-172.5	0	0	114.6
279	N	33.8	Very low	33.8	Very low	142 Å²	142	130.8 Å²	130.8	76%	0.759	77%	0.769	S	S	*	*			trans	86.3	138.6	145.1	-74.7	-39.8	0	0	0	124.6
280	G	30.3	Very low	34.1	Very low	73 Å²	73	130.5 Å²	130.5	75%	0.753	77%	0.767	S	S	*	*			trans	173.4	42.5	173.5	0	0	0	0	0	121.5
281	A	30.3	Very low	34.1	Very low	100 Å²	100	131.6 Å²	131.6	83%	0.826	78%	0.775	S	S	*	*			trans	68.2	165	161.9	0	0	0	0	0	120.7
282	L	32.7	Very low	34.7	Very low	162 Å²	162	131.8 Å²	131.8	85%	0.848	78%	0.776	S	S	*	*				-174.7	128.5	-53.9	-112.6	169.6	0	0	0	111.9
283	T	31	Very low	35	Very low	136 Å²	136	131 Å²	131	83%	0.834	78%	0.777	S	S	*	*			trans	165.6	110.3	149.8	37.1	0	0	0	0	107.7
284	A	30.2	Very low	34.1	Very low	94 Å²	94	129.9 Å²	129.9	78%	0.777	77%	0.772	S	S	*	*				78.6	136.6	65.4	0	0	0	0	0	114.6
285	D	31.7	Very low	34.7	Very low	149 Å²	149	130 Å²	130	80%	0.797	77%	0.768	S	S	*	*			cis	-164.1	-161.6	-21.1	-153.7	23.1	0	0	0	110.2
286	P	52.5	Low	34.6	Very low	86 Å²	86	131.8 Å²	131.8	56%	0.558	77%	0.768	S	S	*	*				-120.3	170.9	-106.1	38.7	-22.7	0	0	0	117.4
287	K	28.4	Very low	34.2	Very low	198 Å²	198	134.8 Å²	134.8	86%	0.861	77%	0.774	S	S	*	*				170.4	131.9	122.3	-92.4	158.9	-174.4	173.2	0	116.5
288	S	29.9	Very low	34	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	78%	0.776	S	S	*	*			trans	-51.6	150.1	172.5	56.9	0	0	0	0	119.1
289	R	32.6	Very low	34.2	Very low	239 Å²	239	136.7 Å²	136.7	90%	0.902	78%	0.779	S	S	*	*				-178.4	170	103.4	-96.7	-165.6	171.9	-176	-2.4	113.1
290	P	48.7	Very low	34.3	Very low	109 Å²	109	134.3 Å²	134.3	71%	0.708	78%	0.779	S	S	*	*			trans	-124	-174.7	-154.2	45.3	-35.4	0	0	0	117.3
291	S	26.9	Very low	34.7	Very low	125 Å²	125	140.5 Å²	140.5	87%	0.874	78%	0.78	S	S	*	*			trans	91.8	166.8	157.6	79.5	0	0	0	0	119.1
292	S	37.5	Very low	35	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	78%	0.776	S	S	*	*			trans	-119.5	149	-147.7	51.2	0	0	0	0	116.1
293	K	32.3	Very low	35.4	Very low	211 Å²	211	141.6 Å²	141.6	92%	0.917	77%	0.768	S	S	*	*			trans	161.1	163.7	160.9	-93.4	160.7	-178.1	-175	0	107.7
294	S	32.2	Very low	35.9	Very low	88 Å²	88	142 Å²	142	62%	0.615	76%	0.764	S	S	*	*			cis	-175.8	148.2	-21.5	-177.5	0	0	0	0	108.4
295	T	38.3	Very low	36.1	Very low	119 Å²	119	143.1 Å²	143.1	73%	0.73	76%	0.761	S	S	*	*			trans	41.5	128.3	149.2	50.7	0	0	0	0	123.1
296	L	33.6	Very low	36	Very low	146 Å²	146	142.7 Å²	142.7	76%	0.764	75%	0.754	S	S	*	*			trans	165	154.2	132	-108.5	78.2	0	0	0	109.1
297	E	38.1	Very low	35	Very low	164 Å²	164	145 Å²	145	77%	0.766	76%	0.755	S	S	*	*			cis	-164.4	-177.4	-20.5	-140.2	168.6	-154.6	0	0	112.3
298	E	29.1	Very low	35	Very low	179 Å²	179	143.2 Å²	143.2	84%	0.836	75%	0.75	S	S	*	*			trans	102.8	151.3	153.6	-136.5	168.3	-162.7	0	0	119.9
299	N	38.1	Very low	35.5	Very low	142 Å²	142	145.6 Å²	145.6	76%	0.759	76%	0.755	S	S	*	*			trans	-139.5	158.2	-148.6	-51.8	-84.4	0	0	0	113.9
300	A	35.4	Very low	35.9	Very low	92 Å²	92	138.9 Å²	138.9	76%	0.76	74%	0.743	S	S	*	*			trans	174.9	107.4	133.7	0	0	0	0	0	115.2
301	Y	38.8	Very low	35.1	Very low	202 Å²	202	143.8 Å²	143.8	79%	0.792	75%	0.748	S	S	*	*				40.1	139	125.7	-78.7	-112.2	0	0	0	121.3
302	E	37.9	Very low	35.3	Very low	158 Å²	158	146.5 Å²	146.5	74%	0.738	75%	0.747	S	S	*	*			cis	-175.1	157.1	-2.8	-127.7	-175.6	177	0	0	108.1
303	D	40.6	Very low	35.1	Very low	127 Å²	127	148.4 Å²	148.4	68%	0.679	75%	0.749	S	S	*	*			cis	-126.4	-92.8	-36.8	173.6	37.5	0	0	0	109.6
304	I	41	Very low	35.1	Very low	145 Å²	145	145.6 Å²	145.6	74%	0.744	75%	0.749	S	S	*	*			cis	-170.4	145.8	-13.1	-144.3	152.3	0	0	0	105.7
305	V	33.9	Very low	34.8	Very low	118 Å²	118	147.9 Å²	147.9	72%	0.715	75%	0.754	S	S	*	*			cis	-170.7	150.6	-18.2	112.1	0	0	0	0	105.3
306	E	30.8	Very low	34.3	Very low	140 Å²	140	148 Å²	148	65%	0.654	75%	0.75	S	S	*	*			cis	-164.1	173.1	-12.8	-152.2	-153.2	159.3	0	0	108.6
307	K	30.1	Very low	34	Very low	135 Å²	135	149.4 Å²	149.4	59%	0.587	75%	0.75	S	S	*	*			trans	65.6	155.3	151.7	-90	-177.3	-179.6	77.5	0	121.3
308	E	29.2	Very low	33.3	Very low	159 Å²	159	152 Å²	152	74%	0.743	75%	0.753	S	S	*	*			cis	-157.7	166.2	-14.7	-154.8	152.6	-146.2	0	0	109.8
309	N	40.6	Very low	33.2	Very low	149 Å²	149	154 Å²	154	80%	0.797	75%	0.752	S	S	*	*			trans	-158.7	118.9	174.5	175.4	55.3	0	0	0	113.2
310	P	41.8	Very low	32.6	Very low	99 Å²	99	151.3 Å²	151.3	64%	0.643	75%	0.745	S	S	*	*			trans	-146.3	151.1	144.4	36.3	-19.8	0	0	0	116.5
311	Y	31	Very low	32.2	Very low	211 Å²	211	154.1 Å²	154.1	83%	0.827	75%	0.746	S	S	*	*			trans	25.3	157.5	135.3	-69.9	-91.3	0	0	0	122.3
312	E	31.8	Very low	31.5	Very low	183 Å²	183	149 Å²	149	86%	0.855	74%	0.74	S	S	*	*			cis	-138.8	179.9	23.2	-75.9	-172.3	129.6	0	0	113.9
313	D	32.3	Very low	31	Very low	149 Å²	149	152.3 Å²	152.3	80%	0.797	75%	0.746	S	S	*	*			trans	-67.1	168.4	168.9	-60.9	-82.6	0	0	0	115.1
314	V	31.7	Very low	30.4	Very low	152 Å²	152	155.1 Å²	155.1	92%	0.921	75%	0.752	S	S	*	*				-178.7	156	127.4	146.2	0	0	0	0	111.2
315	D	26.8	Very low	29.8	Very low	136 Å²	136	154 Å²	154	73%	0.727	76%	0.756	S	S	*	*			trans	-103.8	172.3	-162.6	-174	21.1	0	0	0	115
316	L	28.2	Very low	29.3	Very low	122 Å²	122	151.6 Å²	151.6	64%	0.639	76%	0.756	S	S	*	*			trans	94.7	137.7	154.9	-59.7	177.9	0	0	0	122.4
317	K	26.6	Very low	29.1	Very low	176 Å²	176	152.9 Å²	152.9	77%	0.765	77%	0.767	S	S	*	*			trans	81.7	102.7	144.5	-76.2	158.4	-174.9	165	0	121.5
318	R	24	Very low	28.8	Very low	218 Å²	218	150.3 Å²	150.3	82%	0.823	77%	0.766	S	S	*	*				63.2	139.7	105.3	176	-170.9	-91.9	-140.9	0.6	119.4
319	R	27	Very low	28.7	Very low	220 Å²	220	150 Å²	150	83%	0.83	76%	0.764	S	S	*	*			trans	72.4	159.3	169.4	-84.7	177.2	172.9	173.7	-4.4	114.8
320	S	24.8	Very low	28.1	Very low	86 Å²	86	148.9 Å²	148.9	60%	0.601	76%	0.758	S	S	*	*			cis	-175.8	160.9	-34.4	54	0	0	0	0	110.8
321	L	27.3	Very low	27.4	Very low	151 Å²	151	148.5 Å²	148.5	79%	0.791	76%	0.758	S	S	*	*			trans	69.6	108.4	157.4	-68.7	165.7	0	0	0	119.1
322	S	24.4	Very low	27.4	Very low	94 Å²	94	149.4 Å²	149.4	66%	0.657	76%	0.76	S	S	*	*				65.8	124.3	114.2	-60.5	0	0	0	0	123.1
323	R	27.4	Very low	27.2	Very low	228 Å²	228	145.3 Å²	145.3	86%	0.86	75%	0.751	S	S	*	*			trans	77	106.6	135.9	-71.5	-178.2	178.9	-171.8	0.9	120.6
324	K	27.5	Very low	26.8	Very low	187 Å²	187	150.1 Å²	150.1	81%	0.813	76%	0.759	S	S	*	*				63.1	116.6	117	-72.5	-164.2	171.5	-165.9	0	120.7
325	S	28.3	Very low	26.6	Very low	120 Å²	120	146.4 Å²	146.4	84%	0.839	74%	0.744	S	S	*	*			trans	63.2	119.1	131	65.4	0	0	0	0	120.8
326	G	23.8	Very low	26.6	Very low	69 Å²	69	144.4 Å²	144.4	71%	0.711	75%	0.746	S	S	*	*			trans	-175.1	112.7	159.6	0	0	0	0	0	114.4
327	L	26.8	Very low	26.5	Very low	167 Å²	167	145.5 Å²	145.5	87%	0.874	75%	0.75	S	S	*	*			trans	61.7	114.5	136.9	-67.7	166.1	0	0	0	122.6
328	S	24.6	Very low	26.5	Very low	81 Å²	81	143.3 Å²	143.3	57%	0.566	75%	0.746	S	S	*	*				66.1	129	115.5	-89.7	0	0	0	0	124.4
329	E	25.4	Very low	26.8	Very low	152 Å²	152	141.4 Å²	141.4	71%	0.71	74%	0.739	S	S	*	*				72.3	159.8	127.2	-71.4	173.9	97	0	0	120
330	N	27.9	Very low	26.9	Very low	126 Å²	126	138.6 Å²	138.6	67%	0.674	73%	0.733	S	S	*	*			cis	-155.2	151	5.5	-134.4	-32.3	0	0	0	116.6
331	S	28.8	Very low	27	Very low	91 Å²	91	140.8 Å²	140.8	64%	0.636	74%	0.737	S	S	*	*			trans	76.4	157.6	131.1	-148	0	0	0	0	124.6
332	R	31	Very low	26.9	Very low	229 Å²	229	140.7 Å²	140.7	86%	0.864	74%	0.738	S	S	*	*			trans	88.5	132.4	161.6	-52.6	-177.2	-159.7	-146.5	2.5	116.7
333	S	25.9	Very low	27.1	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	74%	0.743	S	S	*	*			cis	-163.1	138.3	-0.3	39.6	0	0	0	0	115.5
334	W	24	Very low	28.1	Very low	250 Å²	250	135.8 Å²	135.8	95%	0.947	74%	0.736	S	S	*	*			trans	42.6	147.6	139	-63.3	76.1	0	0	0	122.7
335	A	27.5	Very low	28.4	Very low	74 Å²	74	132.5 Å²	132.5	61%	0.612	73%	0.733	S	S	*	*			cis	-177.9	173.4	-17.1	0	0	0	0	0	112.4
336	A	27.8	Very low	28.3	Very low	94 Å²	94	136 Å²	136	78%	0.777	74%	0.737	S	S	*	*			trans	76.5	153.1	148.5	0	0	0	0	0	120
337	M	26.7	Very low	28.7	Very low	145 Å²	145	140.7 Å²	140.7	71%	0.714	74%	0.744	S	S	*	*			cis	-165.5	137.1	-17.4	-108.4	-77.7	-173.6	0	0	110.2	R339	M337-R339 HydrophobicContact SD-CG 4.11Å
338	D	26.4	Very low	28.9	Very low	130 Å²	130	138.7 Å²	138.7	70%	0.695	74%	0.741	S	S	*	*				174.6	119	118.4	-100.2	-11.4	0	0	0	109.5
339	R	30.6	Very low	28.9	Very low	178 Å²	178	140 Å²	140	67%	0.672	75%	0.75	S	S	*	*				82.1	138.3	74	-78.2	-167	170.4	160.5	-4.8	112.8	M337	M337-R339 HydrophobicContact SD-CG 4.11Å
340	K	27.6	Very low	29.1	Very low	161 Å²	161	141.4 Å²	141.4	70%	0.7	75%	0.754	S	S	*	*			cis	-162	171.9	17	-133.7	172.9	179.7	179.2	0	113.9
341	L	26.7	Very low	29.4	Very low	132 Å²	132	139.6 Å²	139.6	69%	0.691	75%	0.749	S	S	*	*			trans	87.7	104	155.8	-100	75.1	0	0	0	122.2
342	N	25.4	Very low	29.3	Very low	149 Å²	149	138.4 Å²	138.4	80%	0.797	74%	0.741	S	S	*	*				84.8	165.4	122.6	-69.3	14.3	0	0	0	123.1
343	S	29	Very low	29.2	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	72%	0.716	S	S	*	*			trans	-137.9	-154.3	-151.3	53.9	0	0	0	0	112.3
344	P	48.1	Very low	29.4	Very low	110 Å²	110	133.8 Å²	133.8	71%	0.714	72%	0.724	S	S	*	*				-125.9	162.4	-105.9	39.4	-22.1	0	0	0	117.2
345	P	33.4	Very low	29.5	Very low	118 Å²	118	126.1 Å²	126.1	77%	0.766	71%	0.709	S	S	*	*			trans	-119.5	153.5	149.5	15.7	5.5	0	0	0	111.3
346	Q	26.6	Very low	29.4	Very low	194 Å²	194	129.6 Å²	129.6	91%	0.907	72%	0.716	S	S	*	*			cis	82.2	138.3	40.6	-68.3	-159.8	-2	0	0	116.4
347	L	32.5	Very low	29.3	Very low	167 Å²	167	136.5 Å²	136.5	87%	0.874	72%	0.722	S	S	*	*			trans	-89.8	161.9	-178.1	-76.1	160.2	0	0	0	112.4
348	P	30.4	Very low	29.5	Very low	125 Å²	125	137.1 Å²	137.1	81%	0.812	73%	0.728	S	S	*	*				-136.1	-167	126	38.7	-27.6	0	0	0	113.5
349	S	25.8	Very low	29.6	Very low	108 Å²	108	136.9 Å²	136.9	76%	0.755	73%	0.733	S	S	*	*			trans	-153.6	163.7	-156.8	58.3	0	0	0	0	116.4
350	K	30.1	Very low	29.4	Very low	183 Å²	183	131.3 Å²	131.3	80%	0.796	73%	0.731	S	S	*	*			trans	70.8	161.5	160	-86.8	-173.6	178.9	-165	0	116.4
351	P	32.8	Very low	30.6	Very low	87 Å²	87	129.6 Å²	129.6	57%	0.565	74%	0.737	S	S	*	*			cis	-135.4	169.6	34.4	42.4	-23.5	0	0	0	121.1	S138	S138-P351 VanDerWaalsContact CB-O 3.31Å; S138-P351 WeakPolarHBondContact CB-O 3.42Å; S138-P351 PolarHBondContact N-O 3.25Å; S138-P351 PolarHBondContact OG-O 2.94Å
352	S	28	Very low	30.6	Very low	66 Å²	66	129 Å²	129	46%	0.462	74%	0.743	S	S	.	*			trans	-60.1	150.4	-178.4	49.3	0	0	0	0	120.4	D137	D137-S352 WeakPolarHBondContact O-CA 3.48Å
353	S	28.7	Very low	30.6	Very low	49 Å²	49	128 Å²	128	34%	0.343	74%	0.738	S	S	.	*			trans	55.9	131	136.5	-47.3	0	0	0	0	122.6
354	Q	28.8	Very low	30.6	Very low	181 Å²	181	132.3 Å²	132.3	85%	0.846	74%	0.737	S	S	*	*				-177.5	117.5	101.2	-97	-174.5	14.7	0	0	115.7
355	S	26.5	Very low	29.7	Very low	89 Å²	89	136.3 Å²	136.3	62%	0.622	74%	0.744	S	S	*	*				49.6	118.7	129	-146	0	0	0	0	123.6
356	L	25.1	Very low	29.4	Very low	147 Å²	147	135.8 Å²	135.8	77%	0.77	74%	0.743	S	S	*	*			trans	35.6	120.2	131.8	-53.6	172.3	0	0	0	120.6
357	R	25.3	Very low	29.6	Very low	238 Å²	238	134.7 Å²	134.7	90%	0.898	74%	0.737	S	S	*	*				176.8	160.5	97.6	-93	179.5	-164.6	-164.6	4	114.6
358	L	30.9	Very low	29.5	Very low	159 Å²	159	137 Å²	137	83%	0.832	73%	0.734	S	S	*	*			trans	-43.6	155.9	155.7	-80	125.2	0	0	0	112.8
359	P	28.6	Very low	29.4	Very low	124 Å²	124	136.9 Å²	136.9	81%	0.805	72%	0.724	S	S	*	*				-151	-179.4	51.6	43.9	-24.3	0	0	0	118.4
360	G	26	Very low	29.4	Very low	62 Å²	62	137.2 Å²	137.2	64%	0.639	73%	0.727	S	S	*	*			trans	-129.9	-167.7	142.1	0	0	0	0	0	108.4
361	P	54.3	Low	29.6	Very low	125 Å²	125	135.3 Å²	135.3	81%	0.812	72%	0.721	S	S	*	*			cis	-124.9	166.5	-10.5	40.5	-27.9	0	0	0	113
362	S	26	Very low	29.6	Very low	119 Å²	119	138.1 Å²	138.1	83%	0.832	73%	0.73	S	S	*	*			trans	-161.3	99.7	159.9	20	0	0	0	0	115.4
363	D	25.7	Very low	29.7	Very low	127 Å²	127	138.7 Å²	138.7	68%	0.679	73%	0.734	S	S	*	*				57.7	151.8	123.4	-148.4	13.1	0	0	0	123.7
364	R	29.5	Very low	29.8	Very low	201 Å²	201	144.7 Å²	144.7	76%	0.758	75%	0.754	S	S	*	*			trans	73.5	99.2	160.4	-72.5	155.3	-157.8	-130.9	-0.8	122.7
365	K	28.7	Very low	30	Very low	194 Å²	194	145.7 Å²	145.7	84%	0.843	75%	0.75	S	S	*	*				40.3	130.1	117.7	-59.5	174.2	-178.9	177.8	0	118.6
366	S	28.1	Very low	30.1	Very low	107 Å²	107	151.6 Å²	151.6	75%	0.748	76%	0.76	S	S	*	*				-177	158.2	85.9	42.9	0	0	0	0	116.8
367	H	29.8	Very low	30.4	Very low	170 Å²	170	148.7 Å²	148.7	79%	0.787	75%	0.752	S	S	*	*			trans	16.1	120.2	159.2	-53.2	-54.9	0	0	0	122.3
368	R	30.3	Very low	30.7	Very low	215 Å²	215	144.9 Å²	144.9	81%	0.811	74%	0.744	S	S	*	*				67.9	120	65.7	-170.4	-160.1	-155.9	-167.7	10.9	114.6
369	M	28.8	Very low	30.6	Very low	123 Å²	123	143.2 Å²	143.2	61%	0.606	74%	0.736	S	S	*	*				179.8	128.9	127.6	-94.7	-89.7	72.8	0	0	115.1	Q371	M369-Q371 HydrophobicContact CE-CG 3.74Å; M369-Q371 HydrophobicContact SD-CG 3.95Å; M369-Q371 PolarHBondContact SD-NE2 2.87Å
370	S	26	Very low	30.7	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	73%	0.732	S	S	*	*			trans	-153.4	165.4	143.6	62.3	0	0	0	0	108.6
371	Q	33.9	Very low	31	Very low	143 Å²	143	148.5 Å²	148.5	67%	0.668	74%	0.735	S	S	*	*			trans	-142.9	158	-156.3	-69.2	-169.4	21.6	0	0	112.4	M369	M369-Q371 HydrophobicContact CE-CG 3.74Å; M369-Q371 HydrophobicContact SD-CG 3.95Å; M369-Q371 PolarHBondContact SD-NE2 2.87Å
372	L	32.6	Very low	29.9	Very low	146 Å²	146	149.4 Å²	149.4	76%	0.764	73%	0.732	S	S	*	*			cis	-141	-128.8	-5.9	-124.3	174.1	0	0	0	108.7
373	S	29.5	Very low	30	Very low	79 Å²	79	150.5 Å²	150.5	55%	0.552	73%	0.728	S	S	*	*			cis	-162.5	134	-3.7	-148	0	0	0	0	112.2
374	K	32.4	Very low	30.3	Very low	174 Å²	174	151.5 Å²	151.5	76%	0.757	73%	0.732	S	S	*	*			trans	64.7	139.9	158.5	-60.9	174.8	-175.3	173.2	0	118.1
375	R	31.4	Very low	30.8	Very low	202 Å²	202	147.1 Å²	147.1	76%	0.762	73%	0.73	S	S	*	*			cis	-163.9	138.4	-7.8	-103.8	-175	-179.9	173.3	-1.5	110.5
376	Y	29	Very low	31	Very low	214 Å²	214	147.1 Å²	147.1	84%	0.839	73%	0.733	S	S	*	*			trans	55.5	151.4	143.4	-72.6	-111.8	0	0	0	121.6
377	S	30.8	Very low	31	Very low	85 Å²	85	149 Å²	149	59%	0.594	74%	0.739	S	S	*	*			cis	-175	152.4	-22.9	-151.2	0	0	0	0	113.1
378	H	32.6	Very low	30.7	Very low	159 Å²	159	144.1 Å²	144.1	74%	0.736	74%	0.735	S	S	*	*			trans	58	158.3	163.9	-79	-80.2	0	0	0	119.4
379	D	28.2	Very low	30.6	Very low	124 Å²	124	143.2 Å²	143.2	66%	0.663	74%	0.743	S	S	*	*			cis	-151.1	163.2	2.8	-132.4	-23.5	0	0	0	118
380	E	32	Very low	30.5	Very low	151 Å²	151	143 Å²	143	71%	0.706	75%	0.753	S	S	*	*			trans	42	154.4	148.5	-101.3	-167.7	159.9	0	0	130.7
381	M	31.1	Very low	30.5	Very low	146 Å²	146	143.5 Å²	143.5	72%	0.719	76%	0.756	S	S	*	*			trans	84.8	91.5	146.9	-82	-168.6	-81.1	0	0	126.5
382	L	30.8	Very low	30.1	Very low	143 Å²	143	142 Å²	142	75%	0.749	76%	0.762	S	S	*	*				52	104.9	115.4	-58.4	177.5	0	0	0	125.4
383	L	29.2	Very low	30.9	Very low	143 Å²	143	140.1 Å²	140.1	75%	0.749	76%	0.759	S	S	*	*				65.1	139.6	114.9	-66.8	-175.8	0	0	0	127
384	I	31	Very low	30.7	Very low	147 Å²	147	142.6 Å²	142.6	75%	0.754	77%	0.774	S	S	*	*			trans	79.2	151.3	138.4	-78.4	168.4	0	0	0	119.5
385	P	40.5	Very low	30.3	Very low	110 Å²	110	137.8 Å²	137.8	71%	0.714	77%	0.774	S	S	*	*			cis	-117.8	175.2	-8.8	16.9	6.5	0	0	0	115.6
386	Q	32.1	Very low	30.2	Very low	193 Å²	193	135.1 Å²	135.1	90%	0.902	77%	0.774	S	S	*	*			trans	-99	154.3	149.8	-74.4	-172.1	-7.2	0	0	110.7
387	V	28.6	Very low	30.2	Very low	146 Å²	146	133.1 Å²	133.1	89%	0.885	78%	0.777	S	S	*	*			trans	-138.2	139.3	158.4	-178.4	0	0	0	0	108.4
388	G	24.9	Very low	30.2	Very low	68 Å²	68	135 Å²	135	70%	0.701	78%	0.78	S	S	*	*			trans	-154.6	149.4	169.3	0	0	0	0	0	110.5
389	M	27.3	Very low	30	Very low	197 Å²	197	133.4 Å²	133.4	97%	0.97	78%	0.778	S	S	*	*			trans	-159.8	154.1	169.8	-105.5	165.3	76.5	0	0	108.9
390	S	26.5	Very low	29.9	Very low	119 Å²	119	131.9 Å²	131.9	83%	0.832	78%	0.777	S	S	*	*			trans	-126.9	154.2	-175.1	56.5	0	0	0	0	112.1
391	S	25.4	Very low	29.7	Very low	124 Å²	124	132.3 Å²	132.3	87%	0.867	78%	0.783	S	S	*	*			trans	-148.6	161.5	164	56.5	0	0	0	0	110.8
392	S	26.4	Very low	29.5	Very low	113 Å²	113	131.9 Å²	131.9	79%	0.79	79%	0.793	S	S	*	*			trans	-158.4	-179.8	-169.2	-148.1	0	0	0	0	106.7
393	P	49.6	Very low	29.2	Very low	106 Å²	106	128.5 Å²	128.5	69%	0.688	79%	0.793	S	S	*	*			cis	-138.9	-155.2	1.7	39.2	-16.5	0	0	0	114.2
394	C	24.4	Very low	29.1	Very low	131 Å²	131	128 Å²	128	89%	0.885	80%	0.795	S	S	*	*			trans	82.3	134.5	166.4	-62.8	0	0	0	0	118.3
395	G	25.5	Very low	29.2	Very low	73 Å²	73	126.9 Å²	126.9	75%	0.753	80%	0.801	S	S	*	*			cis	-173.2	164.2	-5	0	0	0	0	0	116.2
396	L	28.8	Very low	28.5	Very low	146 Å²	146	128.9 Å²	128.9	76%	0.764	81%	0.805	S	S	*	*			trans	-6.1	146.2	163.5	-73.3	157.3	0	0	0	119
397	L	29.4	Very low	28.3	Very low	171 Å²	171	124.7 Å²	124.7	90%	0.895	80%	0.797	S	S	*	*				-132.9	162.2	55.5	-77	164.8	0	0	0	117
398	D	30.1	Very low	28.4	Very low	124 Å²	124	125.6 Å²	125.6	66%	0.663	80%	0.796	S	S	*	*			trans	-76.4	-178.8	176.1	-113.5	-47.1	0	0	0	112.3
399	D	27.6	Very low	28.8	Very low	127 Å²	127	128 Å²	128	68%	0.679	80%	0.8	S	S	*	*			cis	-157.1	166.4	37.6	-151.2	-49	0	0	0	115
400	S	26.9	Very low	28.9	Very low	92 Å²	92	123.9 Å²	123.9	64%	0.643	79%	0.791	S	S	*	*			trans	86.3	56.1	148	-72.9	0	0	0	0	119.5
401	L	28.3	Very low	29.5	Very low	159 Å²	159	126.2 Å²	126.2	83%	0.832	78%	0.781	S	S	*	*				45.2	115.8	110.6	-60.3	169	0	0	0	119.5
402	C	26.3	Very low	30.1	Very low	137 Å²	137	131.4 Å²	131.4	93%	0.926	78%	0.782	S	S	*	*				-145.6	126.2	128.2	-167.4	0	0	0	0	109.6
403	G	25.3	Very low	31	Very low	73 Å²	73	132 Å²	132	75%	0.753	77%	0.772	S	S	*	*			trans	-148.6	117.6	-177.4	0	0	0	0	0	112.8
404	T	26.8	Very low	31.3	Very low	131 Å²	131	133.1 Å²	133.1	80%	0.804	76%	0.762	S	S	*	*			trans	-138.3	132.1	159.4	43.9	0	0	0	0	108.3	D406	T404-D406 PolarHBondContact O-N 3.23Å
405	S	32.3	Very low	33.5	Very low	125 Å²	125	138 Å²	138	87%	0.874	76%	0.762	S	S	*	*			trans	-84.5	91.8	-177.3	55	0	0	0	0	111.5
406	D	26.5	Very low	36.1	Very low	151 Å²	151	136.5 Å²	136.5	81%	0.807	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-84.2	135.5	170.1	-101.6	-36.2	0	0	0	111.8	T404 L408	T404-D406 PolarHBondContact O-N 3.23Å; D406-L408 PolarHBondContact O-N 3.35Å
407	S	28.7	Very low	38.7	Very low	105 Å²	105	130.3 Å²	130.3	73%	0.734	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-66.5	124.1	-179.6	57.7	0	0	0	0	111.3	P409	S407-P409 WeakPolarHBondContact O-CD 3.37Å; S407-P409 VanDerWaalsContact O-N 3.16Å
408	L	29.1	Very low	41.4	Very low	165 Å²	165	125.8 Å²	125.8	86%	0.864	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-52.1	119.9	170.7	-72.6	169.6	0	0	0	110	D406 S410	D406-L408 PolarHBondContact O-N 3.35Å; L408-S410 PolarHBondContact O-N 2.93Å
409	P	33.3	Very low	44.2	Very low	119 Å²	119	120 Å²	120	77%	0.773	65%	0.647	S	S	*	*			trans	-65.6	113.2	174.5	26.4	-32.5	0	0	0	108.1	S407 R411	S407-P409 WeakPolarHBondContact O-CD 3.37Å; S407-P409 VanDerWaalsContact O-N 3.16Å; P409-R411 PolarHBondContact O-N 3.41Å; P409-R411 VanDerWaalsContact O-N 3.1Å
410	S	30.3	Very low	47.2	Very low	111 Å²	111	114.2 Å²	114.2	78%	0.776	62%	0.617	S	S	*	*			trans	-49.5	120.6	-175.7	-177	0	0	0	0	110.6	L408 R412	L408-S410 PolarHBondContact O-N 2.93Å; S410-R412 VanDerWaalsContact C-N 3.28Å; S410-R412 PolarHBondContact O-N 3.03Å
411	R	37.9	Very low	50.2	Low	168 Å²	168	115.1 Å²	115.1	63%	0.634	61%	0.61	S	S	*	*			trans	-64.4	87.2	-174.5	-166.1	-169.4	-160.4	-130.2	10.1	108.2	P409 H413 E912	P409-R411 PolarHBondContact O-N 3.41Å; P409-R411 VanDerWaalsContact O-N 3.1Å; R411-H413 VanDerWaalsContact C-N 3.28Å; R411-H413 PolarHBondContact NH1-CE1 3.38Å; R411-H413 PolarHBondContact NH1-NE2 3.08Å; R411-H413 PolarHBondContact O-N 2.73Å; R411-E912 IonicContact CZ-OE1 2.76Å; R411-E912 IonicContact NH1-OE1 2.84Å; R411-E912 PolarHBondContact NH1-OE1 3.21Å; R411-E912 IonicContact NH1-OE2 2.66Å; R411-E912 IonicContact NH2-OE1 2.77Å; R411-E912 PolarHBondContact NH2-OE1 3.05Å
412	R	38.2	Very low	53.2	Low	233 Å²	233	110.7 Å²	110.7	88%	0.879	58%	0.583	S	S	*	*			trans	-58.4	93.7	173.3	-82.8	-163	-86.7	-174.9	-6.7	107.9	S410 W414	S410-R412 VanDerWaalsContact C-N 3.28Å; S410-R412 PolarHBondContact O-N 3.03Å; R412-W414 PolarHBondContact O-N 3.33Å
413	H	46.6	Very low	56.4	Low	124 Å²	124	104.2 Å²	104.2	57%	0.574	54%	0.539	S	S	*	.			trans	-59	107.4	173.6	-107.7	-88.6	0	0	0	107.2	R411 R415 E912	R411-H413 VanDerWaalsContact C-N 3.28Å; R411-H413 PolarHBondContact NH1-CE1 3.38Å; R411-H413 PolarHBondContact NH1-NE2 3.08Å; R411-H413 PolarHBondContact O-N 2.73Å; H413-R415 PolarHBondContact O-N 2.83Å; H413-E912 IonicContact CE1-OE2 3.41Å
414	W	55	Low	59.6	Low	130 Å²	130	101.5 Å²	101.5	49%	0.492	51%	0.507	S	S	.	.			trans	-66.3	108.1	179.9	-140	83.4	0	0	0	106.6	R412 I416	R412-W414 PolarHBondContact O-N 3.33Å; W414-I416 PolarHBondContact O-N 2.98Å
415	R	70.3	Confident	62.8	Low	233 Å²	233	98.7 Å²	98.7	88%	0.879	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-64.2	122.8	-177.5	-86.2	-170.7	-93	-171	-4.5	108.2	H413	H413-R415 PolarHBondContact O-N 2.83Å
416	I	79.9	Confident	65.8	Low	42 Å²	42	93.5 Å²	93.5	22%	0.215	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-60.9	124.6	175.6	-58.6	179.2	0	0	0	107.4	W414 V420 Q421 Q909	W414-I416 PolarHBondContact O-N 2.98Å; I416-V420 HydrophobicContact CG2-CB 3.72Å; I416-V420 HydrophobicContact CG2-CG1 3.59Å; I416-Q421 HydrophobicContact CB-CG 4.18Å; I416-Q421 HydrophobicContact CG2-CG 3.83Å; I416-Q421 PolarHBondContact O-NE2 2.95Å; I416-Q909 HydrophobicContact CD1-CB 4.43Å; I416-Q909 HydrophobicContact CD1-CG 4.39Å
417	P	85.3	Confident	68.9	Low	17 Å²	17	86.3 Å²	86.3	11%	0.11	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-56.4	146.4	-179.5	-25.9	34.2	0	0	0	112.2	L419 V420 Q421 Y822	P417-L419 VanDerWaalsContact C-N 3.31Å; P417-L419 PolarHBondContact O-N 2.7Å; P417-V420 HydrophobicContact CB-CG2 4.13Å; P417-V420 HydrophobicContact CG-CG2 4.22Å; P417-V420 WeakPolarHBondContact O-CA 3.32Å; P417-V420 WeakPolarHBondContact O-CB 3.32Å; P417-V420 PolarHBondContact O-N 2.68Å; P417-Q421 PolarHBondContact O-N 3.08Å; P417-Q421 VanDerWaalsContact O-N 3.08Å; P417-Y822 HydrophobicContact CB-CD1 4.48Å; P417-Y822 HydrophobicContact CG-CD1 4.06Å; P417-Y822 HydrophobicContact CG-CE1 4.3Å
418	K	85.3	Confident	71.8	Confident	76 Å²	76	83.8 Å²	83.8	33%	0.33	40%	0.398	S	S	.	.	H	α-helix	trans	-54.3	-46.6	-176.9	-60.3	176	-166.7	167	0	111.9	V420 Q421 R422 D813 S816	K418-V420 VanDerWaalsContact C-N 3.31Å; K418-V420 PolarHBondContact O-N 2.85Å; K418-Q421 WeakPolarHBondContact O-CA 3.3Å; K418-Q421 WeakPolarHBondContact O-CB 3.49Å; K418-Q421 PolarHBondContact O-N 3.48Å; K418-R422 PolarHBondContact O-N 3.48Å; K418-D813 WeakPolarHBondContact CB-OD1 3.42Å; K418-D813 VanDerWaalsContact CB-OD2 3.25Å; K418-D813 WeakPolarHBondContact CB-OD2 3.44Å; K418-D813 WeakPolarHBondContact CD-OD1 3.44Å; K418-D813 IonicContact NZ-OD1 3.18Å; K418-S816 PolarHBondContact NZ-OG 2.89Å
419	L	88.5	Confident	74.8	Confident	3 Å²	3	81 Å²	81	2%	0.016	39%	0.388	C	S	.	.	H	α-helix	trans	-42.7	-51.5	168.3	170.8	59.3	0	0	0	113.3	P417 R422 I423 I809 D813 Y822 S827 L828	P417-L419 VanDerWaalsContact C-N 3.31Å; P417-L419 PolarHBondContact O-N 2.7Å; L419-R422 WeakPolarHBondContact O-CB 3.32Å; L419-R422 PolarHBondContact O-N 3.33Å; L419-I423 HydrophobicContact CD1-CD1 3.86Å; L419-I423 HydrophobicContact CD1-CG1 4.49Å; L419-I423 HydrophobicContact CG-CD1 4.17Å; L419-I423 WeakPolarHBondContact O-CG1 3.36Å; L419-I423 PolarHBondContact O-N 2.98Å; L419-I809 HydrophobicContact CD1-CG2 3.48Å; L419-I809 VanDerWaalsContact CD1-CG2 3.48Å; L419-D813 PolarHBondContact N-OD2 3.4Å; L419-Y822 WeakPolarHBondContact CD2-O 3.27Å; L419-S827 WeakPolarHBondContact CD2-OG 3.17Å; L419-L828 HydrophobicContact CD1-CB 3.87Å; L419-L828 HydrophobicContact CD1-CD1 3.74Å; L419-L828 HydrophobicContact CD1-CG 3.8Å; L419-L828 HydrophobicContact CD2-CB 4.25Å
420	V	90.6	Very high	77.4	Confident	5 Å²	5	78.8 Å²	78.8	3%	0.03	37%	0.367	C	S	.	.	H	α-helix	trans	-68.7	-36.4	-179.1	179.7	0	0	0	0	111.1	I416 P417 K418 I423 N424 E831	I416-V420 HydrophobicContact CG2-CB 3.72Å; I416-V420 HydrophobicContact CG2-CG1 3.59Å; P417-V420 HydrophobicContact CB-CG2 4.13Å; P417-V420 HydrophobicContact CG-CG2 4.22Å; P417-V420 WeakPolarHBondContact O-CA 3.32Å; P417-V420 WeakPolarHBondContact O-CB 3.32Å; P417-V420 PolarHBondContact O-N 2.68Å; K418-V420 VanDerWaalsContact C-N 3.31Å; K418-V420 PolarHBondContact O-N 2.85Å; V420-I423 PolarHBondContact O-N 3.05Å; V420-N424 WeakPolarHBondContact O-CB 3.25Å; V420-N424 PolarHBondContact O-N 2.94Å; V420-N424 PolarHBondContact O-OD1 3.12Å; V420-E831 HydrophobicContact CG2-CB 4.35Å; V420-E831 VanDerWaalsContact CG2-CD 3.46Å; V420-E831 HydrophobicContact CG2-CG 3.82Å
421	Q	89.9	Confident	79.8	Confident	110 Å²	110	74.8 Å²	74.8	51%	0.514	33%	0.334	S	S	.	.	H	α-helix	trans	-64.4	-40.1	174.1	-57.9	179.9	30.7	0	0	111.8	I416 P417 K418 N424 S425	I416-Q421 HydrophobicContact CB-CG 4.18Å; I416-Q421 HydrophobicContact CG2-CG 3.83Å; I416-Q421 PolarHBondContact O-NE2 2.95Å; P417-Q421 PolarHBondContact O-N 3.08Å; P417-Q421 VanDerWaalsContact O-N 3.08Å; K418-Q421 WeakPolarHBondContact O-CA 3.3Å; K418-Q421 WeakPolarHBondContact O-CB 3.49Å; K418-Q421 PolarHBondContact O-N 3.48Å; Q421-N424 PolarHBondContact O-N 3.1Å; Q421-S425 PolarHBondContact O-N 3.28Å
422	R	91.5	Very high	81.4	Confident	67 Å²	67	68.2 Å²	68.2	25%	0.253	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-47	174.3	-68.8	175.6	179.2	170.6	4.2	111.3	K418 L419 N424 S425 I426 I809 Q812 D813	K418-R422 PolarHBondContact O-N 3.48Å; L419-R422 WeakPolarHBondContact O-CB 3.32Å; L419-R422 PolarHBondContact O-N 3.33Å; R422-N424 PolarHBondContact O-N 2.93Å; R422-S425 WeakPolarHBondContact O-CB 3.15Å; R422-S425 PolarHBondContact O-N 3.47Å; R422-I426 PolarHBondContact O-N 2.88Å; R422-I426 VanDerWaalsContact O-N 3.12Å; R422-I809 HydrophobicContact CB-CG2 4.31Å; R422-I809 PolarHBondContact NH1-O 3.28Å; R422-Q812 PolarHBondContact NH1-O 3.19Å; R422-Q812 PolarHBondContact NH2-O 2.82Å; R422-D813 IonicContact CZ-OD1 2.99Å; R422-D813 IonicContact CZ-OD2 3.28Å; R422-D813 IonicContact NE-OD1 2.58Å; R422-D813 IonicContact NE-OD2 3.21Å; R422-D813 IonicContact NH1-OD1 2.98Å; R422-D813 PolarHBondContact NH1-OD1 3.22Å; R422-D813 IonicContact NH1-OD2 3.96Å; R422-D813 PolarHBondContact NH1-OD2 3Å; R422-D813 VanDerWaalsContact NH2-CG 3.31Å; R422-D813 IonicContact NH2-OD1 3.49Å; R422-D813 PolarHBondContact NH2-OD1 3.29Å; R422-D813 IonicContact NH2-OD2 2.75Å
423	I	93.9	Very high	82.7	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-59.3	-47.8	175.1	-68.3	165.8	0	0	0	110.9	L419 V420 S425 I426 Y427 L828 E831 R835	L419-I423 HydrophobicContact CD1-CD1 3.86Å; L419-I423 HydrophobicContact CD1-CG1 4.49Å; L419-I423 HydrophobicContact CG-CD1 4.17Å; L419-I423 WeakPolarHBondContact O-CG1 3.36Å; L419-I423 PolarHBondContact O-N 2.98Å; V420-I423 PolarHBondContact O-N 3.05Å; I423-S425 PolarHBondContact O-N 3.26Å; I423-I426 PolarHBondContact O-N 2.89Å; I423-Y427 HydrophobicContact CG2-CD2 4.01Å; I423-Y427 HydrophobicContact CG2-CE2 4.05Å; I423-Y427 WeakPolarHBondContact O-CD2 3.43Å; I423-Y427 PolarHBondContact O-N 3.16Å; I423-Y427 VanDerWaalsContact O-N 3.14Å; I423-L828 HydrophobicContact CD1-CG 4.5Å; I423-E831 HydrophobicContact CD1-CB 3.53Å; I423-R835 HydrophobicContact CG2-CB 3.95Å; I423-R835 HydrophobicContact CG2-CG 4.34Å
424	N	92.7	Very high	83.5	Confident	16 Å²	16	69.3 Å²	69.3	9%	0.086	33%	0.329	C	S	.	.	H	α-helix	trans	-57.8	-36.8	176.8	-70.4	-4.9	0	0	0	112	V420 Q421 R422 C428 R835 E913	V420-N424 WeakPolarHBondContact O-CB 3.25Å; V420-N424 PolarHBondContact O-N 2.94Å; V420-N424 PolarHBondContact O-OD1 3.12Å; Q421-N424 PolarHBondContact O-N 3.1Å; R422-N424 PolarHBondContact O-N 2.93Å; N424-C428 WeakPolarHBondContact O-CB 3.5Å; N424-C428 PolarHBondContact O-N 2.96Å; N424-C428 PolarHBondContact O-SG 3.02Å; N424-R835 PolarHBondContact ND2-NH1 2.98Å; N424-R835 VanDerWaalsContact ND2-NH1 3.11Å; N424-R835 WeakPolarHBondContact OD1-CD 3.5Å; N424-R835 PolarHBondContact OD1-NH1 2.71Å; N424-E913 PolarHBondContact ND2-OE1 2.78Å
425	S	92.7	Very high	84	Confident	71 Å²	71	66.5 Å²	66.5	50%	0.497	32%	0.318	S	S	.	.	H	α-helix	trans	-66.3	-44.3	177.3	-170.7	0	0	0	0	113	Q421 R422 I423 Y427 C428 T429	Q421-S425 PolarHBondContact O-N 3.28Å; R422-S425 WeakPolarHBondContact O-CB 3.15Å; R422-S425 PolarHBondContact O-N 3.47Å; I423-S425 PolarHBondContact O-N 3.26Å; S425-Y427 PolarHBondContact O-N 3.13Å; S425-C428 PolarHBondContact O-N 3.37Å; S425-T429 WeakPolarHBondContact O-CB 3.32Å; S425-T429 PolarHBondContact O-N 2.88Å; S425-T429 PolarHBondContact O-OG1 3.44Å
426	I	94.8	Very high	83.8	Confident	17 Å²	17	55.9 Å²	55.9	9%	0.087	28%	0.279	C	S	.	.	H	α-helix	trans	-58.4	-48.6	175.5	-66.1	169.4	0	0	0	110.2	R422 I423 T429 K430 A798 Q801 A802 I809	R422-I426 PolarHBondContact O-N 2.88Å; R422-I426 VanDerWaalsContact O-N 3.12Å; I423-I426 PolarHBondContact O-N 2.89Å; I426-T429 PolarHBondContact O-N 3.45Å; I426-K430 PolarHBondContact O-N 3.32Å; I426-K430 VanDerWaalsContact O-N 3.07Å; I426-A798 HydrophobicContact CG2-CB 4.45Å; I426-A798 WeakPolarHBondContact CG2-O 3.04Å; I426-Q801 HydrophobicContact CG2-CB 4.07Å; I426-Q801 HydrophobicContact CG2-CG 4.02Å; I426-A802 HydrophobicContact CD1-CB 4.18Å; I426-I809 HydrophobicContact CD1-CD1 3.9Å
427	Y	93.3	Very high	83.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-45.5	177.1	-88.7	-88.6	0	0	0	113.1	I423 S425 T429 K430 R431 L795 A798 L799 A832 R835 F836 E839	I423-Y427 HydrophobicContact CG2-CD2 4.01Å; I423-Y427 HydrophobicContact CG2-CE2 4.05Å; I423-Y427 WeakPolarHBondContact O-CD2 3.43Å; I423-Y427 PolarHBondContact O-N 3.16Å; I423-Y427 VanDerWaalsContact O-N 3.14Å; S425-Y427 PolarHBondContact O-N 3.13Å; Y427-T429 VanDerWaalsContact C-N 3.3Å; Y427-T429 PolarHBondContact O-N 3.07Å; Y427-K430 PolarHBondContact O-N 2.99Å; Y427-R431 WeakPolarHBondContact O-CB 3.44Å; Y427-R431 PolarHBondContact O-N 2.91Å; Y427-L795 HydrophobicContact CD1-CD2 4.07Å; Y427-L795 HydrophobicContact CE1-CB 4.44Å; Y427-L795 HydrophobicContact CE1-CD2 4.25Å; Y427-A798 HydrophobicContact CD1-CB 3.58Å; Y427-A798 HydrophobicContact CD2-CB 4.22Å; Y427-A798 HydrophobicContact CE1-CB 3.81Å; Y427-A798 HydrophobicContact CE2-CB 4.43Å; Y427-A798 HydrophobicContact CG-CB 3.83Å; Y427-L799 WeakPolarHBondContact OH-CB 3.46Å; Y427-A832 PolarHBondContact OH-O 3.26Å; Y427-R835 HydrophobicContact CD1-CG 4.09Å; Y427-R835 HydrophobicContact CD2-CB 3.91Å; Y427-R835 HydrophobicContact CD2-CG 3.37Å; Y427-R835 HydrophobicContact CE1-CG 4.36Å; Y427-R835 HydrophobicContact CE2-CB 3.69Å; Y427-R835 HydrophobicContact CE2-CG 3.69Å; Y427-R835 HydrophobicContact CG-CB 4.48Å; Y427-R835 HydrophobicContact CG-CG 3.56Å; Y427-F836 WeakPolarHBondContact OH-CA 3.21Å; Y427-F836 WeakPolarHBondContact OH-CB 3.41Å; Y427-F836 PolarHBondContact OH-N 3.01Å; Y427-E839 HydrophobicContact CD1-CG 3.85Å; Y427-E839 HydrophobicContact CE1-CG 4.35Å; Y427-E839 HydrophobicContact CG-CG 4.46Å
428	C	89.4	Confident	82.3	Confident	52 Å²	52	63.2 Å²	63.2	35%	0.351	31%	0.307	S	S	.	.	H	α-helix	trans	-59.5	-41.9	177	-73	0	0	0	0	111.9	N424 S425 G432	N424-C428 WeakPolarHBondContact O-CB 3.5Å; N424-C428 PolarHBondContact O-N 2.96Å; N424-C428 PolarHBondContact O-SG 3.02Å; S425-C428 PolarHBondContact O-N 3.37Å; C428-G432 PolarHBondContact O-N 2.97Å
429	T	90.7	Very high	81	Confident	106 Å²	106	62.1 Å²	62.1	65%	0.65	31%	0.305	S	S	*	.	H	α-helix	trans	-63.3	-49.8	179.7	-57.8	0	0	0	0	111.8	S425 I426 Y427	S425-T429 WeakPolarHBondContact O-CB 3.32Å; S425-T429 PolarHBondContact O-N 2.88Å; S425-T429 PolarHBondContact O-OG1 3.44Å; I426-T429 PolarHBondContact O-N 3.45Å; Y427-T429 VanDerWaalsContact C-N 3.3Å; Y427-T429 PolarHBondContact O-N 3.07Å
430	K	88.8	Confident	79	Confident	73 Å²	73	64.7 Å²	64.7	32%	0.317	32%	0.323	S	S	.	.	H	α-helix	trans	-73.2	-36.5	-178.6	-67.5	-88.1	-179.8	139.6	0	113.3	I426 Y427 K794 A797 A798	I426-K430 PolarHBondContact O-N 3.32Å; I426-K430 VanDerWaalsContact O-N 3.07Å; Y427-K430 PolarHBondContact O-N 2.99Å; K430-K794 PolarHBondContact O-NZ 2.76Å; K430-A797 HydrophobicContact CD-CB 4.37Å; K430-A797 WeakPolarHBondContact CD-O 3.49Å; K430-A797 VanDerWaalsContact CE-O 3.3Å; K430-A797 WeakPolarHBondContact CE-O 3.31Å; K430-A797 PolarHBondContact NZ-O 3.1Å; K430-A798 HydrophobicContact CB-CB 3.82Å; K430-A798 HydrophobicContact CG-CB 4.04Å
431	R	79.5	Confident	76.8	Confident	26 Å²	26	70.8 Å²	70.8	10%	0.098	35%	0.353	C	S	.	.	H	α-helix	trans	-63	-51	174.3	-177	179.8	-176.7	170.6	14.5	110.6	Y427 K434 K794 E839 Y910	Y427-R431 WeakPolarHBondContact O-CB 3.44Å; Y427-R431 PolarHBondContact O-N 2.91Å; R431-K434 PolarHBondContact NE-O 3.28Å; R431-K434 PolarHBondContact NH2-O 2.88Å; R431-K794 PolarHBondContact O-NZ 2.75Å; R431-E839 WeakPolarHBondContact CD-OE2 3.22Å; R431-E839 IonicContact CZ-OE2 2.85Å; R431-E839 IonicContact NE-OE2 2.62Å; R431-E839 PolarHBondContact NE-OE2 2.71Å; R431-E839 IonicContact NH1-OE1 2.7Å; R431-E839 IonicContact NH1-OE2 3.09Å; R431-E839 PolarHBondContact NH1-OE2 2.89Å; R431-Y910 PolarHBondContact NH1-OH 3.39Å; R431-Y910 VanDerWaalsContact NH1-OH 3.08Å
432	G	71.9	Confident	74.5	Confident	31 Å²	31	70.3 Å²	70.3	32%	0.32	36%	0.362	S	S	.	.			trans	72.9	-170.9	-172.4	0	0	0	0	0	113.2	C428 K434	C428-G432 PolarHBondContact O-N 2.97Å; G432-K434 PolarHBondContact O-N 3.2Å
433	K	65.6	Low	72.1	Confident	218 Å²	218	71.2 Å²	71.2	95%	0.948	37%	0.371	S	S	*	.	S	Bend	trans	-60.1	-9.6	-163.9	-60.5	-177.1	-179.1	179.5	0	116.9	R435	K433-R435 PolarHBondContact O-N 2.73Å
434	K	64.4	Low	69.8	Low	162 Å²	162	74.1 Å²	74.1	70%	0.704	39%	0.387	S	S	*	.			trans	-80.1	63.9	176.3	-67.2	-170.1	178.7	-176.1	0	111.6	R431 G432	R431-K434 PolarHBondContact NE-O 3.28Å; R431-K434 PolarHBondContact NH2-O 2.88Å; G432-K434 PolarHBondContact O-N 3.2Å
435	R	65.6	Low	67.4	Low	70 Å²	70	82 Å²	82	26%	0.264	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-74.8	154	168.8	-65.3	-169.3	76.3	-159.2	-2.1	111	K433 E913 P915	K433-R435 PolarHBondContact O-N 2.73Å; R435-E913 VanDerWaalsContact CZ-O 3.24Å; R435-E913 PolarHBondContact NH1-O 2.83Å; R435-E913 PolarHBondContact NH2-O 2.69Å; R435-E913 IonicContact NH2-OE2 3.75Å; R435-P915 HydrophobicContact CB-CG 4.19Å
436	L	66.3	Low	64.9	Low	11 Å²	11	83.7 Å²	83.7	6%	0.058	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-64.7	134.5	162.1	-177.9	66	0	0	0	107.1	H843 S866 L914 P915	L436-H843 HydrophobicContact CD2-CB 3.45Å; L436-H843 VanDerWaalsContact CD2-CB 3.45Å; L436-H843 VanDerWaalsContact CD2-CG 3.5Å; L436-S866 VanDerWaalsContact CD1-O 3.31Å; L436-S866 WeakPolarHBondContact CD1-O 3.38Å; L436-L914 HydrophobicContact CB-CD1 4.38Å; L436-L914 HydrophobicContact CB-CD2 4.4Å; L436-L914 HydrophobicContact CD2-CD1 3.99Å; L436-L914 HydrophobicContact CG-CD1 4.17Å; L436-P915 WeakPolarHBondContact O-CD 3.37Å
437	K	69.7	Low	62.2	Low	133 Å²	133	86.8 Å²	86.8	58%	0.578	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-85.1	141.9	172.3	-60	-173.2	-179.2	-177.1	0	108.7	L439 T917	K437-L439 PolarHBondContact O-N 2.64Å; K437-L439 VanDerWaalsContact O-N 3.12Å; K437-T917 HydrophobicContact CB-CG2 3.72Å; K437-T917 HydrophobicContact CD-CG2 4.12Å
438	K	63.3	Low	59.5	Low	80 Å²	80	90.4 Å²	90.4	35%	0.348	48%	0.484	S	S	.	.	B	Isolated β-bridge	trans	-60	112.8	176.3	-168	-171	-167.3	171	0	109.2	S440 L914 P915 D916 T917	K438-S440 PolarHBondContact O-N 2.7Å; K438-L914 HydrophobicContact CB-CB 3.95Å; K438-L914 HydrophobicContact CG-CB 4.47Å; K438-P915 WeakPolarHBondContact CB-O 3.42Å; K438-P915 PolarHBondContact N-O 3.44Å; K438-D916 WeakPolarHBondContact CD-OD1 3.45Å; K438-D916 WeakPolarHBondContact CE-OD1 3.44Å; K438-D916 IonicContact NZ-OD1 3.81Å; K438-D916 PolarHBondContact NZ-OD1 3.31Å; K438-D916 IonicContact NZ-OD2 2.64Å; K438-T917 WeakPolarHBondContact O-CG2 3.27Å; K438-T917 PolarHBondContact O-OG1 3.36Å
439	L	58	Low	56.8	Low	53 Å²	53	95.5 Å²	95.5	28%	0.277	51%	0.507	S	S	.	.			trans	-76	116.2	-175.5	-60.2	174.7	0	0	0	109.7	K437 L846 F847	K437-L439 PolarHBondContact O-N 2.64Å; K437-L439 VanDerWaalsContact O-N 3.12Å; L439-L846 HydrophobicContact CB-CD1 4.42Å; L439-L846 HydrophobicContact CD1-CD1 4.49Å; L439-F847 HydrophobicContact CD1-CE2 3.95Å; L439-F847 HydrophobicContact CD1-CZ 3.53Å
440	S	45.5	Very low	54.2	Low	56 Å²	56	101.6 Å²	101.6	39%	0.392	52%	0.518	S	S	.	.			trans	-73	130.9	163.5	-180	0	0	0	0	109.2	K438 S442 N443	K438-S440 PolarHBondContact O-N 2.7Å; S440-S442 PolarHBondContact O-N 2.88Å; S440-S442 PolarHBondContact OG-OG 2.87Å; S440-N443 PolarHBondContact O-N 3.14Å
441	M	44.5	Very low	51.6	Low	134 Å²	134	104.5 Å²	104.5	66%	0.66	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-54	-27.6	-174.4	-64.7	-61.8	-67.9	0	0	113.6	N443	M441-N443 VanDerWaalsContact C-N 3.29Å; M441-N443 PolarHBondContact O-N 3.28Å
442	S	41.7	Very low	49.5	Very low	100 Å²	100	109.3 Å²	109.3	70%	0.699	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-78.5	1.2	178.3	56.8	0	0	0	0	115.6	S440	S440-S442 PolarHBondContact O-N 2.88Å; S440-S442 PolarHBondContact OG-OG 2.87Å
443	N	41.7	Very low	47.8	Very low	85 Å²	85	113.7 Å²	113.7	46%	0.455	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-116.7	9.4	-178.6	-68.4	-100.4	0	0	0	113.2	S440 M441 E445 T446	S440-N443 PolarHBondContact O-N 3.14Å; M441-N443 VanDerWaalsContact C-N 3.29Å; M441-N443 PolarHBondContact O-N 3.28Å; N443-E445 VanDerWaalsContact C-N 3.31Å; N443-E445 PolarHBondContact O-N 3.4Å; N443-T446 PolarHBondContact O-OG1 3.43Å
444	L	45.5	Very low	46.6	Very low	63 Å²	63	108.1 Å²	108.1	33%	0.33	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.1	-33.1	-175.9	-165.6	63.5	0	0	0	112.5	F847	L444-F847 HydrophobicContact CD1-CE1 3.78Å; L444-F847 HydrophobicContact CD1-CZ 4.27Å
445	E	41.5	Very low	45.3	Very low	181 Å²	181	109 Å²	109	85%	0.846	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-30.1	-176.7	-59.4	179.4	150.8	0	0	113.2	N443	N443-E445 VanDerWaalsContact C-N 3.31Å; N443-E445 PolarHBondContact O-N 3.4Å
446	T	41.4	Very low	44.1	Very low	106 Å²	106	111.8 Å²	111.8	65%	0.65	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-92.3	-10.1	-172.7	52.4	0	0	0	0	114.2	N443 S448	N443-T446 PolarHBondContact O-OG1 3.43Å; T446-S448 PolarHBondContact O-N 2.96Å
447	A	37.1	Very low	43	Very low	82 Å²	82	115.9 Å²	115.9	68%	0.678	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-75.9	-2.3	-177.3	0	0	0	0	0	114.9
448	S	36.7	Very low	42.2	Very low	77 Å²	77	113.8 Å²	113.8	54%	0.538	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-86.1	-2.7	-168.5	-166.6	0	0	0	0	116.2	T446	T446-S448 PolarHBondContact O-N 2.96Å
449	L	33.9	Very low	41.5	Very low	158 Å²	158	115.7 Å²	115.7	83%	0.827	64%	0.641	S	S	*	*			trans	-125.8	63.2	-164.7	-65.7	177	0	0	0	115
450	R	36.1	Very low	41.3	Very low	234 Å²	234	114.4 Å²	114.4	88%	0.883	64%	0.637	S	S	*	*			trans	-146.6	110	148	-72.3	-158.6	176.7	-128.2	-8.5	110.1
451	D	34	Very low	42.1	Very low	135 Å²	135	114.8 Å²	114.8	72%	0.722	63%	0.634	S	S	*	*			trans	-103.1	96.4	174.6	-170.6	42.7	0	0	0	110	N453	D451-N453 PolarHBondContact O-N 3.42Å
452	D	35.4	Very low	43	Very low	126 Å²	126	112.3 Å²	112.3	67%	0.674	62%	0.623	S	S	*	*			trans	-87.7	94.5	173	-76.3	-57.6	0	0	0	109.3	K870	D452-K870 WeakPolarHBondContact O-CE 3.37Å; D452-K870 PolarHBondContact O-NZ 2.9Å
453	N	36.3	Very low	44.1	Very low	123 Å²	123	112.9 Å²	112.9	66%	0.658	61%	0.61	S	S	*	*			trans	-78.7	-174.8	-171.2	-146.9	-26.3	0	0	0	113.1	D451	D451-N453 PolarHBondContact O-N 3.42Å
454	S	39.8	Very low	45.3	Very low	101 Å²	101	109.8 Å²	109.8	71%	0.706	59%	0.593	S	S	*	*			trans	60	85.3	165.7	-57.6	0	0	0	0	118.9
455	E	36.8	Very low	46.6	Very low	180 Å²	180	111.7 Å²	111.7	84%	0.841	60%	0.598	S	S	*	*			trans	-141.3	135	136.2	-76.6	-171.2	121.2	0	0	108.1
456	S	41.8	Very low	48.1	Very low	129 Å²	129	105.7 Å²	105.7	90%	0.902	58%	0.58	S	S	*	*			trans	-96.2	98.5	-166.1	-53.7	0	0	0	0	113.6
457	E	42.4	Very low	49.5	Very low	97 Å²	97	101.5 Å²	101.5	45%	0.453	55%	0.553	S	S	.	*			trans	-115.8	59.8	172.4	-72.3	-167.8	138.7	0	0	112.4	D459 S460 R874	E457-D459 PolarHBondContact O-N 3.36Å; E457-S460 PolarHBondContact O-N 2.77Å; E457-S460 PolarHBondContact O-OG 2.94Å; E457-R874 IonicContact OE2-CZ 2.65Å; E457-R874 IonicContact OE2-NH1 2.65Å; E457-R874 PolarHBondContact OE2-NH1 2.77Å; E457-R874 IonicContact OE2-NH2 3.5Å; E457-R874 PolarHBondContact OE2-NH2 2.96Å
458	S	51.8	Low	51.3	Low	89 Å²	89	98.9 Å²	98.9	62%	0.622	53%	0.529	S	S	*	.	H	α-helix	trans	-54.3	-45.2	-172.3	-159	0	0	0	0	114.1	S460 D461 D462	S458-S460 VanDerWaalsContact C-N 3.29Å; S458-S460 PolarHBondContact O-N 2.99Å; S458-D461 PolarHBondContact O-N 2.96Å; S458-D462 PolarHBondContact O-N 2.86Å
459	D	48.8	Very low	53.3	Low	120 Å²	120	101.6 Å²	101.6	64%	0.642	53%	0.533	S	S	*	.	H	α-helix	trans	-72.1	-19.2	-170.3	-170	47.7	0	0	0	113.8	E457 R463	E457-D459 PolarHBondContact O-N 3.36Å; D459-R463 PolarHBondContact O-NE 3.41Å; D459-R463 PolarHBondContact O-NH2 3.41Å; D459-R463 IonicContact OD1-NH2 3.25Å; D459-R463 IonicContact OD2-CZ 3.17Å; D459-R463 IonicContact OD2-NH2 3.4Å; D459-R463 PolarHBondContact OD2-NH2 2.87Å
460	S	54.5	Low	55.4	Low	27 Å²	27	96 Å²	96	19%	0.189	50%	0.501	C	S	.	.	H	α-helix	trans	-81.3	-39.9	172.9	68.4	0	0	0	0	112	E457 S458 D462 R463 F464 R874	E457-S460 PolarHBondContact O-N 2.77Å; E457-S460 PolarHBondContact O-OG 2.94Å; S458-S460 VanDerWaalsContact C-N 3.29Å; S458-S460 PolarHBondContact O-N 2.99Å; S460-D462 PolarHBondContact O-N 3.34Å; S460-R463 PolarHBondContact O-N 3.3Å; S460-F464 WeakPolarHBondContact O-CD2 3.43Å; S460-F464 PolarHBondContact O-N 2.82Å; S460-R874 PolarHBondContact OG-NH2 3.01Å; S460-R874 VanDerWaalsContact OG-NH2 3.17Å
461	D	61.5	Low	57	Low	63 Å²	63	85 Å²	85	34%	0.337	46%	0.46	S	S	.	.	H	α-helix	trans	-68.9	-33.4	-172.3	-96.9	24.9	0	0	0	112.3	S458 F464 K465 R874	S458-D461 PolarHBondContact O-N 2.96Å; D461-F464 PolarHBondContact O-N 3.12Å; D461-K465 VanDerWaalsContact O-CG 3.24Å; D461-K465 WeakPolarHBondContact O-CG 3.43Å; D461-K465 PolarHBondContact O-N 3.34Å; D461-R874 IonicContact OD1-CZ 2.85Å; D461-R874 IonicContact OD1-NE 2.85Å; D461-R874 PolarHBondContact OD1-NE 3.09Å; D461-R874 IonicContact OD1-NH2 3.79Å; D461-R874 PolarHBondContact OD1-NH2 3.06Å
462	D	63.7	Low	59	Low	82 Å²	82	82.4 Å²	82.4	44%	0.439	45%	0.445	S	S	.	.	H	α-helix	trans	-71.5	-35.2	179.7	-69.3	-33.5	0	0	0	113.3	S458 S460 K465 A466	S458-D462 PolarHBondContact O-N 2.86Å; S460-D462 PolarHBondContact O-N 3.34Å; D462-K465 PolarHBondContact O-N 3.08Å; D462-K465 WeakPolarHBondContact OD1-CD 3.13Å; D462-K465 WeakPolarHBondContact OD1-CE 3.23Å; D462-K465 IonicContact OD1-NZ 3.76Å; D462-K465 PolarHBondContact OD1-NZ 2.98Å; D462-A466 WeakPolarHBondContact O-CB 3.18Å; D462-A466 PolarHBondContact O-N 3.46Å
463	R	65.5	Low	61	Low	113 Å²	113	83.7 Å²	83.7	43%	0.426	45%	0.445	S	S	.	.	H	α-helix	trans	-63.2	-43.7	168.5	-87.9	173.7	-72.2	-144.2	-10.3	111.8	D459 S460 A466 H467	D459-R463 PolarHBondContact O-NE 3.41Å; D459-R463 PolarHBondContact O-NH2 3.41Å; D459-R463 IonicContact OD1-NH2 3.25Å; D459-R463 IonicContact OD2-CZ 3.17Å; D459-R463 IonicContact OD2-NH2 3.4Å; D459-R463 PolarHBondContact OD2-NH2 2.87Å; S460-R463 PolarHBondContact O-N 3.3Å; R463-A466 PolarHBondContact O-N 2.85Å; R463-H467 WeakPolarHBondContact O-CB 3.46Å; R463-H467 PolarHBondContact O-N 3.25Å
464	F	66.5	Low	62.5	Low	19 Å²	19	78.5 Å²	78.5	8%	0.083	42%	0.417	C	S	.	.	H	α-helix	trans	-64.2	-40.2	175.2	-74.5	-61.1	0	0	0	112.2	S460 D461 H467 T468 L790 R874 V878	S460-F464 WeakPolarHBondContact O-CD2 3.43Å; S460-F464 PolarHBondContact O-N 2.82Å; D461-F464 PolarHBondContact O-N 3.12Å; F464-H467 PolarHBondContact O-N 2.9Å; F464-T468 WeakPolarHBondContact O-CB 3.37Å; F464-T468 PolarHBondContact O-N 3.34Å; F464-T468 PolarHBondContact O-OG1 3.14Å; F464-L790 HydrophobicContact CE1-CD2 3.84Å; F464-L790 HydrophobicContact CZ-CD2 4.24Å; F464-R874 HydrophobicContact CD2-CG 4.26Å; F464-R874 HydrophobicContact CE2-CG 4.36Å; F464-V878 HydrophobicContact CB-CG2 4.16Å; F464-V878 HydrophobicContact CD1-CG2 3.85Å; F464-V878 HydrophobicContact CG-CG2 4.31Å
465	K	72.6	Confident	63.8	Low	103 Å²	103	74.9 Å²	74.9	45%	0.448	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-49.5	173.6	-71.8	166.6	-151.4	162.6	0	111.6	D461 D462 H467 T468 Q469	D461-K465 VanDerWaalsContact O-CG 3.24Å; D461-K465 WeakPolarHBondContact O-CG 3.43Å; D461-K465 PolarHBondContact O-N 3.34Å; D462-K465 PolarHBondContact O-N 3.08Å; D462-K465 WeakPolarHBondContact OD1-CD 3.13Å; D462-K465 WeakPolarHBondContact OD1-CE 3.23Å; D462-K465 IonicContact OD1-NZ 3.76Å; D462-K465 PolarHBondContact OD1-NZ 2.98Å; K465-H467 VanDerWaalsContact C-N 3.31Å; K465-H467 PolarHBondContact O-N 3.11Å; K465-T468 PolarHBondContact O-N 2.93Å; K465-Q469 VanDerWaalsContact O-CG 3.32Å; K465-Q469 WeakPolarHBondContact O-CG 3.32Å; K465-Q469 PolarHBondContact O-N 2.83Å
466	A	73.8	Confident	65.4	Low	56 Å²	56	69.5 Å²	69.5	46%	0.463	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-42.1	178.7	0	0	0	0	0	111.6	D462 R463 Q469 R470	D462-A466 WeakPolarHBondContact O-CB 3.18Å; D462-A466 PolarHBondContact O-N 3.46Å; R463-A466 PolarHBondContact O-N 2.85Å; A466-Q469 PolarHBondContact O-N 2.62Å; A466-R470 PolarHBondContact O-N 2.92Å
467	H	70.4	Confident	66.7	Low	17 Å²	17	67.3 Å²	67.3	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-66.7	-43.6	176	-172.5	77.9	0	0	0	112.7	R463 F464 K465 Q469 R470 L471 L698	R463-H467 WeakPolarHBondContact O-CB 3.46Å; R463-H467 PolarHBondContact O-N 3.25Å; F464-H467 PolarHBondContact O-N 2.9Å; K465-H467 VanDerWaalsContact C-N 3.31Å; K465-H467 PolarHBondContact O-N 3.11Å; H467-Q469 VanDerWaalsContact C-N 3.32Å; H467-Q469 PolarHBondContact O-N 3.49Å; H467-R470 WeakPolarHBondContact O-CB 3.25Å; H467-R470 PolarHBondContact O-N 3.27Å; H467-R470 VanDerWaalsContact O-N 3.14Å; H467-L471 WeakPolarHBondContact NE2-CD1 3.29Å; H467-L471 WeakPolarHBondContact NE2-CG 3.29Å; H467-L471 PolarHBondContact O-N 2.94Å; H467-L698 PolarHBondContact CE1-O 2.92Å; H467-L698 WeakPolarHBondContact NE2-CB 3.45Å; H467-L698 PolarHBondContact NE2-O 3.16Å; H467-L698 VanDerWaalsContact NE2-O 3.15Å
468	T	74.5	Confident	67.6	Low	28 Å²	28	65.2 Å²	65.2	17%	0.172	34%	0.34	C	S	.	.	H	α-helix	trans	-59.1	-41.8	172.5	-74.7	0	0	0	0	111.7	F464 K465 R470 L471 L472 E881	F464-T468 WeakPolarHBondContact O-CB 3.37Å; F464-T468 PolarHBondContact O-N 3.34Å; F464-T468 PolarHBondContact O-OG1 3.14Å; K465-T468 PolarHBondContact O-N 2.93Å; T468-R470 VanDerWaalsContact C-N 3.35Å; T468-R470 PolarHBondContact O-N 2.98Å; T468-L471 PolarHBondContact O-N 3.35Å; T468-L472 HydrophobicContact CG2-CD1 3.85Å; T468-L472 HydrophobicContact CG2-CG 4.37Å; T468-L472 WeakPolarHBondContact O-CB 3.15Å; T468-L472 VanDerWaalsContact O-CG 3.3Å; T468-L472 WeakPolarHBondContact O-CG 3.25Å; T468-L472 PolarHBondContact O-N 3.33Å; T468-E881 HydrophobicContact CG2-CG 4.29Å
469	Q	78.4	Confident	68	Low	134 Å²	134	69.9 Å²	69.9	63%	0.626	34%	0.344	S	S	*	.	H	α-helix	trans	-62.8	-39.6	174.4	-71.7	173.6	10.3	0	0	112	K465 A466 H467 L472 K473	K465-Q469 VanDerWaalsContact O-CG 3.32Å; K465-Q469 WeakPolarHBondContact O-CG 3.32Å; K465-Q469 PolarHBondContact O-N 2.83Å; A466-Q469 PolarHBondContact O-N 2.62Å; H467-Q469 VanDerWaalsContact C-N 3.32Å; H467-Q469 PolarHBondContact O-N 3.49Å; Q469-L472 PolarHBondContact O-N 3.38Å; Q469-K473 VanDerWaalsContact O-CB 3.31Å; Q469-K473 WeakPolarHBondContact O-CB 3.27Å; Q469-K473 PolarHBondContact O-N 3.23Å
470	R	79.6	Confident	68.1	Low	40 Å²	40	73.9 Å²	73.9	15%	0.151	35%	0.35	C	S	.	.	H	α-helix	trans	-61.9	-46.6	172.3	175.8	174.5	163.4	-175.9	-8.2	111.6	A466 H467 T468 K473 L474 E769	A466-R470 PolarHBondContact O-N 2.92Å; H467-R470 WeakPolarHBondContact O-CB 3.25Å; H467-R470 PolarHBondContact O-N 3.27Å; H467-R470 VanDerWaalsContact O-N 3.14Å; T468-R470 VanDerWaalsContact C-N 3.35Å; T468-R470 PolarHBondContact O-N 2.98Å; R470-K473 PolarHBondContact O-N 2.77Å; R470-L474 HydrophobicContact CG-CD1 3.97Å; R470-L474 WeakPolarHBondContact O-CB 3.38Å; R470-L474 VanDerWaalsContact O-CG 3.28Å; R470-L474 WeakPolarHBondContact O-CG 3.5Å; R470-L474 PolarHBondContact O-N 3.12Å; R470-E769 IonicContact CZ-OE2 3.35Å; R470-E769 IonicContact NE-OE2 3.91Å; R470-E769 IonicContact NH1-OE2 2.74Å; R470-E769 PolarHBondContact NH1-OE2 2.96Å
471	L	69.6	Low	67.7	Low	4 Å²	4	75.7 Å²	75.7	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-61.6	-44.9	176.4	-71.3	-179.5	0	0	0	112	H467 T468 K473 L474 Q475 E699 V878 E881	H467-L471 WeakPolarHBondContact NE2-CD1 3.29Å; H467-L471 WeakPolarHBondContact NE2-CG 3.29Å; H467-L471 PolarHBondContact O-N 2.94Å; T468-L471 PolarHBondContact O-N 3.35Å; L471-K473 PolarHBondContact O-N 3.03Å; L471-L474 PolarHBondContact O-N 3.39Å; L471-Q475 WeakPolarHBondContact O-CB 3.29Å; L471-Q475 PolarHBondContact O-N 3.11Å; L471-E699 HydrophobicContact CD2-CB 4.13Å; L471-V878 HydrophobicContact CD1-CG1 4.29Å; L471-E881 HydrophobicContact CB-CB 4.23Å; L471-E881 HydrophobicContact CD1-CB 4.11Å
472	L	75.7	Confident	66.7	Low	79 Å²	79	79 Å²	79	41%	0.414	39%	0.391	S	S	.	.	H	α-helix	trans	-63.4	-39.5	177	-70.1	169.8	0	0	0	112.3	T468 Q469 Q475 S476	T468-L472 HydrophobicContact CG2-CD1 3.85Å; T468-L472 HydrophobicContact CG2-CG 4.37Å; T468-L472 WeakPolarHBondContact O-CB 3.15Å; T468-L472 VanDerWaalsContact O-CG 3.3Å; T468-L472 WeakPolarHBondContact O-CG 3.25Å; T468-L472 PolarHBondContact O-N 3.33Å; Q469-L472 PolarHBondContact O-N 3.38Å; L472-Q475 PolarHBondContact O-N 2.67Å; L472-S476 WeakPolarHBondContact O-CB 3.46Å; L472-S476 PolarHBondContact O-N 2.93Å
473	K	77.2	Confident	66	Low	154 Å²	154	79 Å²	79	67%	0.67	40%	0.398	S	S	*	.	H	α-helix	trans	-62.3	-44.4	172.8	-177.3	179.4	178.9	-178	0	111.4	Q469 R470 L471 S476 I477	Q469-K473 VanDerWaalsContact O-CB 3.31Å; Q469-K473 WeakPolarHBondContact O-CB 3.27Å; Q469-K473 PolarHBondContact O-N 3.23Å; R470-K473 PolarHBondContact O-N 2.77Å; L471-K473 PolarHBondContact O-N 3.03Å; K473-S476 WeakPolarHBondContact O-CB 3.45Å; K473-S476 PolarHBondContact O-N 3.28Å; K473-I477 HydrophobicContact CG-CD1 4.42Å; K473-I477 WeakPolarHBondContact O-CG1 3.48Å; K473-I477 PolarHBondContact O-N 2.92Å; K473-I477 VanDerWaalsContact O-N 3.11Å
474	L	67.8	Low	64.9	Low	13 Å²	13	76.7 Å²	76.7	7%	0.068	39%	0.39	C	S	.	.	H	α-helix	trans	-64.6	-43.7	176	-72.8	170	0	0	0	112	R470 L471 S476 I477 L478 P749	R470-L474 HydrophobicContact CG-CD1 3.97Å; R470-L474 WeakPolarHBondContact O-CB 3.38Å; R470-L474 VanDerWaalsContact O-CG 3.28Å; R470-L474 WeakPolarHBondContact O-CG 3.5Å; R470-L474 PolarHBondContact O-N 3.12Å; L471-L474 PolarHBondContact O-N 3.39Å; L474-S476 VanDerWaalsContact C-N 3.29Å; L474-S476 PolarHBondContact O-N 3.36Å; L474-I477 WeakPolarHBondContact O-CB 3.33Å; L474-I477 PolarHBondContact O-N 3.31Å; L474-I477 VanDerWaalsContact O-N 3.12Å; L474-L478 WeakPolarHBondContact O-CB 3.31Å; L474-L478 WeakPolarHBondContact O-CG 3.48Å; L474-L478 PolarHBondContact O-N 2.81Å; L474-P749 HydrophobicContact CD1-CG 3.89Å
475	Q	66.9	Low	64.1	Low	25 Å²	25	83.5 Å²	83.5	12%	0.117	42%	0.415	C	S	.	.	H	α-helix	trans	-63.8	-34.9	176.2	-155.8	-167.2	92.7	0	0	111.5	L471 L472 I477 L478 R479 E881	L471-Q475 WeakPolarHBondContact O-CB 3.29Å; L471-Q475 PolarHBondContact O-N 3.11Å; L472-Q475 PolarHBondContact O-N 2.67Å; Q475-I477 VanDerWaalsContact C-N 3.35Å; Q475-L478 PolarHBondContact O-N 3.25Å; Q475-R479 HydrophobicContact CG-CG 4.4Å; Q475-R479 VanDerWaalsContact O-CB 3.29Å; Q475-R479 WeakPolarHBondContact O-CB 3.5Å; Q475-R479 VanDerWaalsContact O-CG 3.26Å; Q475-R479 WeakPolarHBondContact O-CG 3.46Å; Q475-R479 PolarHBondContact O-N 3.02Å; Q475-R479 VanDerWaalsContact OE1-CZ 3.25Å; Q475-E881 PolarHBondContact NE2-O 3.39Å; Q475-E881 VanDerWaalsContact NE2-O 3.17Å
476	S	70.3	Confident	62.8	Low	68 Å²	68	79 Å²	79	48%	0.476	40%	0.396	S	S	.	.	H	α-helix	trans	-65.6	-34.1	172.8	-168.9	0	0	0	0	113.3	L472 K473 L474	L472-S476 WeakPolarHBondContact O-CB 3.46Å; L472-S476 PolarHBondContact O-N 2.93Å; K473-S476 WeakPolarHBondContact O-CB 3.45Å; K473-S476 PolarHBondContact O-N 3.28Å; L474-S476 VanDerWaalsContact C-N 3.29Å; L474-S476 PolarHBondContact O-N 3.36Å
477	I	68.4	Low	61.5	Low	82 Å²	82	77.8 Å²	77.8	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-70.8	-49.3	172.7	-67	161.9	0	0	0	110	K473 L474 Q475 R480	K473-I477 HydrophobicContact CG-CD1 4.42Å; K473-I477 WeakPolarHBondContact O-CG1 3.48Å; K473-I477 PolarHBondContact O-N 2.92Å; K473-I477 VanDerWaalsContact O-N 3.11Å; L474-I477 WeakPolarHBondContact O-CB 3.33Å; L474-I477 PolarHBondContact O-N 3.31Å; L474-I477 VanDerWaalsContact O-N 3.12Å; Q475-I477 VanDerWaalsContact C-N 3.35Å; I477-R480 WeakPolarHBondContact O-CB 3.31Å; I477-R480 PolarHBondContact O-N 3.43Å
478	L	62	Low	60.5	Low	53 Å²	53	79.1 Å²	79.1	28%	0.277	39%	0.388	S	S	.	.	H	α-helix	trans	-72.9	-32.2	-173.4	-67.5	170.8	0	0	0	113.9	L474 Q475 R480 A481 H730	L474-L478 WeakPolarHBondContact O-CB 3.31Å; L474-L478 WeakPolarHBondContact O-CG 3.48Å; L474-L478 PolarHBondContact O-N 2.81Å; Q475-L478 PolarHBondContact O-N 3.25Å; L478-R480 PolarHBondContact O-N 3.17Å; L478-A481 WeakPolarHBondContact O-CB 3.45Å; L478-A481 PolarHBondContact O-N 2.94Å; L478-H730 VanDerWaalsContact CD1-CE1 3.41Å; L478-H730 WeakPolarHBondContact CD1-CE1 3.21Å
479	R	59.8	Low	59	Low	187 Å²	187	80.9 Å²	80.9	71%	0.706	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-6.8	172.9	-79.3	-178.8	-172	-128.1	9.3	114	Q475 A481	Q475-R479 HydrophobicContact CG-CG 4.4Å; Q475-R479 VanDerWaalsContact O-CB 3.29Å; Q475-R479 WeakPolarHBondContact O-CB 3.5Å; Q475-R479 VanDerWaalsContact O-CG 3.26Å; Q475-R479 WeakPolarHBondContact O-CG 3.46Å; Q475-R479 PolarHBondContact O-N 3.02Å; Q475-R479 VanDerWaalsContact OE1-CZ 3.25Å; R479-A481 VanDerWaalsContact C-N 3.35Å
480	R	50.4	Low	57.4	Low	205 Å²	205	76.5 Å²	76.5	77%	0.774	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.5	172.1	-57.7	178.5	-176.6	-169.6	-3.6	113.1	I477 L478 P482	I477-R480 WeakPolarHBondContact O-CB 3.31Å; I477-R480 PolarHBondContact O-N 3.43Å; L478-R480 PolarHBondContact O-N 3.17Å; R480-P482 WeakPolarHBondContact O-CD 3.4Å
481	A	47.3	Very low	55.8	Low	64 Å²	64	78.9 Å²	78.9	53%	0.529	39%	0.39	S	S	.	.			trans	-93.2	111	169.7	0	0	0	0	0	109.8	L478 R479 S483	L478-A481 WeakPolarHBondContact O-CB 3.45Å; L478-A481 PolarHBondContact O-N 2.94Å; R479-A481 VanDerWaalsContact C-N 3.35Å; A481-S483 PolarHBondContact O-N 2.58Å
482	P	40.9	Very low	54.7	Low	132 Å²	132	84.5 Å²	84.5	86%	0.857	42%	0.419	S	S	*	.			trans	-76.4	-18.8	-170.7	-19.2	33.8	0	0	0	115.4	R480 Y484	R480-P482 WeakPolarHBondContact O-CD 3.4Å; P482-Y484 VanDerWaalsContact C-N 3.34Å; P482-Y484 PolarHBondContact O-N 3.49Å; P482-Y484 VanDerWaalsContact O-N 3.15Å
483	S	47.1	Very low	53.2	Low	82 Å²	82	87.6 Å²	87.6	57%	0.573	43%	0.432	S	S	*	.			trans	-90.7	57	-169.7	54.6	0	0	0	0	113.1	A481 R485	A481-S483 PolarHBondContact O-N 2.58Å; S483-R485 PolarHBondContact O-N 3.08Å
484	Y	43.6	Very low	51.8	Low	66 Å²	66	87.6 Å²	87.6	26%	0.259	43%	0.427	S	S	.	.			trans	-74.9	109.8	171.4	-168.5	-101.2	0	0	0	110.5	P482 T486 Q729 Q883 G887 Q890	P482-Y484 VanDerWaalsContact C-N 3.34Å; P482-Y484 PolarHBondContact O-N 3.49Å; P482-Y484 VanDerWaalsContact O-N 3.15Å; Y484-T486 HydrophobicContact CE1-CG2 3.63Å; Y484-T486 WeakPolarHBondContact OH-CG2 3.16Å; Y484-Q729 PolarHBondContact OH-NE2 3.23Å; Y484-Q729 PolarHBondContact OH-OE1 3.15Å; Y484-Q883 HydrophobicContact CE2-CG 4.27Å; Y484-Q883 VanDerWaalsContact CE2-NE2 3.35Å; Y484-G887 WeakPolarHBondContact OH-CA 3.46Å; Y484-Q890 VanDerWaalsContact CD1-OE1 3.23Å
485	R	48.9	Very low	51	Low	162 Å²	162	91.4 Å²	91.4	61%	0.611	45%	0.445	S	S	*	.			trans	-126.4	131.2	167.3	-71.4	-171.7	-179.2	-122.3	4.4	109.5	S483	S483-R485 PolarHBondContact O-N 3.08Å
486	T	47	Very low	50.4	Low	9 Å²	9	93.1 Å²	93.1	6%	0.055	45%	0.453	C	S	.	.			trans	-79.5	134	172.8	47.5	0	0	0	0	110.4	Y484 E488 L489 D891	Y484-T486 HydrophobicContact CE1-CG2 3.63Å; Y484-T486 WeakPolarHBondContact OH-CG2 3.16Å; T486-E488 PolarHBondContact O-N 2.94Å; T486-L489 PolarHBondContact O-N 3.12Å; T486-D891 WeakPolarHBondContact CB-OD1 3.22Å; T486-D891 WeakPolarHBondContact CB-OD2 3.18Å; T486-D891 VanDerWaalsContact CG2-OD1 3.25Å; T486-D891 WeakPolarHBondContact CG2-OD1 3.29Å; T486-D891 WeakPolarHBondContact CG2-OD2 3.37Å; T486-D891 VanDerWaalsContact OG1-CG 3.26Å; T486-D891 PolarHBondContact OG1-OD1 2.93Å; T486-D891 PolarHBondContact OG1-OD2 3.4Å
487	L	46.3	Very low	49.8	Very low	30 Å²	30	100.5 Å²	100.5	16%	0.157	47%	0.47	C	S	.	.	H	α-helix	trans	-60.2	-31.6	-179.9	-66.6	156.1	0	0	0	111.8	L489 Q490 L491 R578	L487-L489 PolarHBondContact O-N 2.92Å; L487-Q490 PolarHBondContact O-N 3.16Å; L487-L491 HydrophobicContact CB-CD1 4.21Å; L487-L491 VanDerWaalsContact O-CB 3.25Å; L487-L491 WeakPolarHBondContact O-CB 3.45Å; L487-L491 WeakPolarHBondContact O-CD1 3.42Å; L487-L491 VanDerWaalsContact O-CG 3.23Å; L487-L491 WeakPolarHBondContact O-CG 3.45Å; L487-L491 PolarHBondContact O-N 2.85Å; L487-R578 VanDerWaalsContact CD1-NH1 3.28Å; L487-R578 HydrophobicContact CD2-CB 4.4Å; L487-R578 HydrophobicContact CD2-CG 4.48Å
488	E	47.7	Very low	50.1	Low	45 Å²	45	102.1 Å²	102.1	21%	0.21	48%	0.476	C	S	.	.	H	α-helix	trans	-58.1	-42	178.8	-174.8	171.1	-117.2	0	0	112.3	T486 I492 R892 R895	T486-E488 PolarHBondContact O-N 2.94Å; E488-I492 HydrophobicContact CG-CD1 4.31Å; E488-I492 WeakPolarHBondContact O-CD1 3.38Å; E488-I492 VanDerWaalsContact O-CG1 3.29Å; E488-I492 WeakPolarHBondContact O-CG1 3.46Å; E488-R892 IonicContact OE1-NH2 3.83Å; E488-R892 IonicContact OE2-CZ 3.4Å; E488-R892 IonicContact OE2-NH1 3.01Å; E488-R892 PolarHBondContact OE2-NH1 2.91Å; E488-R892 VanDerWaalsContact OE2-NH1 3.17Å; E488-R892 IonicContact OE2-NH2 2.7Å; E488-R892 PolarHBondContact OE2-NH2 3.43Å; E488-R895 IonicContact OE2-NH2 2.84Å; E488-R895 PolarHBondContact OE2-NH2 3.36Å; E488-R895 VanDerWaalsContact OE2-NH2 3.15Å
489	L	43	Very low	51.2	Low	65 Å²	65	99.7 Å²	99.7	34%	0.34	46%	0.464	S	S	.	.	H	α-helix	trans	-72.7	-42	177.9	-78.9	168.4	0	0	0	112.3	T486 L487 I492 E493	T486-L489 PolarHBondContact O-N 3.12Å; L487-L489 PolarHBondContact O-N 2.92Å; L489-I492 PolarHBondContact O-N 3.17Å; L489-E493 PolarHBondContact O-N 2.99Å
490	Q	45.8	Very low	52.6	Low	41 Å²	41	91 Å²	91	19%	0.192	43%	0.431	C	S	.	.	H	α-helix	trans	-68.8	-37.2	177.5	-75.9	-179.2	-85.3	0	0	112.7	L487 I492 W494	L487-Q490 PolarHBondContact O-N 3.16Å; Q490-I492 PolarHBondContact O-N 3.36Å; Q490-W494 WeakPolarHBondContact O-CA 3.3Å; Q490-W494 VanDerWaalsContact O-CB 3.28Å; Q490-W494 WeakPolarHBondContact O-CB 3.47Å; Q490-W494 PolarHBondContact O-N 3.35Å
491	L	45.6	Very low	54.4	Low	90 Å²	90	82.5 Å²	82.5	47%	0.471	40%	0.4	S	S	.	.	H	α-helix	trans	-66.5	-15.3	176.7	-75.9	165.4	0	0	0	113.9	L487 Q495	L487-L491 HydrophobicContact CB-CD1 4.21Å; L487-L491 VanDerWaalsContact O-CB 3.25Å; L487-L491 WeakPolarHBondContact O-CB 3.45Å; L487-L491 WeakPolarHBondContact O-CD1 3.42Å; L487-L491 VanDerWaalsContact O-CG 3.23Å; L487-L491 WeakPolarHBondContact O-CG 3.45Å; L487-L491 PolarHBondContact O-N 2.85Å; L491-Q495 PolarHBondContact O-NE2 3.14Å
492	I	47.6	Very low	56.4	Low	123 Å²	123	81 Å²	81	63%	0.631	38%	0.381	S	S	*	.	H	α-helix	trans	-101.5	-43.6	177.9	-64.5	171.2	0	0	0	111.2	E488 L489 Q490	E488-I492 HydrophobicContact CG-CD1 4.31Å; E488-I492 WeakPolarHBondContact O-CD1 3.38Å; E488-I492 VanDerWaalsContact O-CG1 3.29Å; E488-I492 WeakPolarHBondContact O-CG1 3.46Å; L489-I492 PolarHBondContact O-N 3.17Å; Q490-I492 PolarHBondContact O-N 3.36Å
493	E	44.4	Very low	58.9	Low	143 Å²	143	74.8 Å²	74.8	67%	0.668	34%	0.34	S	S	*	.	H	α-helix	trans	-77.5	-28	177.2	-69.5	-171	151	0	0	113.5	L489	L489-E493 PolarHBondContact O-N 2.99Å
494	W	46.1	Very low	61.2	Low	154 Å²	154	70.9 Å²	70.9	58%	0.583	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	47.6	-178.5	-64.9	71.4	0	0	0	111.9	Q490 E496	Q490-W494 WeakPolarHBondContact O-CA 3.3Å; Q490-W494 VanDerWaalsContact O-CB 3.28Å; Q490-W494 WeakPolarHBondContact O-CB 3.47Å; Q490-W494 PolarHBondContact O-N 3.35Å; W494-E496 PolarHBondContact O-N 3.48Å
495	Q	51.9	Low	63.7	Low	94 Å²	94	68 Å²	68	44%	0.439	30%	0.302	S	S	.	.			trans	-70	86.3	155.5	-106.3	167.9	62.5	0	0	108.6	L491 F641	L491-Q495 PolarHBondContact O-NE2 3.14Å; Q495-F641 HydrophobicContact CB-CE1 4.48Å; Q495-F641 HydrophobicContact CG-CE1 3.95Å; Q495-F641 HydrophobicContact CG-CZ 3.86Å
496	E	54	Low	66	Low	60 Å²	60	60.3 Å²	60.3	28%	0.28	27%	0.273	S	S	.	.			trans	-57.5	150.8	172.9	-72.8	166.9	158.3	0	0	110.4	W494 E498 R604	W494-E496 PolarHBondContact O-N 3.48Å; E496-E498 PolarHBondContact O-N 3.47Å; E496-E498 VanDerWaalsContact O-N 3.15Å; E496-R604 VanDerWaalsContact CD-NH2 3.3Å; E496-R604 IonicContact OE1-CZ 3.96Å; E496-R604 IonicContact OE1-NH1 3.28Å; E496-R604 PolarHBondContact OE1-NH1 3.34Å; E496-R604 IonicContact OE1-NH2 3.87Å; E496-R604 PolarHBondContact OE1-NH2 3.01Å; E496-R604 IonicContact OE2-CZ 3.65Å; E496-R604 IonicContact OE2-NE 3.63Å; E496-R604 PolarHBondContact OE2-NE 3.33Å; E496-R604 IonicContact OE2-NH1 3.26Å; E496-R604 PolarHBondContact OE2-NH1 2.85Å; E496-R604 IonicContact OE2-NH2 3.64Å; E496-R604 PolarHBondContact OE2-NH2 2.94Å
497	R	58	Low	68.4	Low	224 Å²	224	61 Å²	61	85%	0.845	28%	0.278	S	S	*	.	S	Bend	trans	-77.8	3	-170.2	-65	-176.8	175	-171.2	-1.5	114.2
498	E	75.1	Confident	70.7	Confident	115 Å²	115	60.1 Å²	60.1	54%	0.537	27%	0.274	S	S	.	.			trans	-113.8	142.1	-167.5	-64.1	175	160.6	0	0	109.9	E496	E496-E498 PolarHBondContact O-N 3.47Å; E496-E498 VanDerWaalsContact O-N 3.15Å
499	L	84.3	Confident	72.8	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.016	28%	0.283	C	S	.	.	S	Bend	trans	-74	-31.4	-175.2	-164.8	65.5	0	0	0	112.3	S603 L605 L610 F611 I614 L636 P642 L664	L499-S603 WeakPolarHBondContact O-CB 3.39Å; L499-S603 PolarHBondContact O-OG 3.48Å; L499-L605 HydrophobicContact CD1-CD2 3.8Å; L499-L610 HydrophobicContact CD1-CD1 4.39Å; L499-L610 HydrophobicContact CD1-CD2 4.03Å; L499-L610 HydrophobicContact CD2-CD2 4.35Å; L499-L610 HydrophobicContact CG-CD2 4.35Å; L499-F611 HydrophobicContact CG-CE1 4.27Å; L499-F611 HydrophobicContact CG-CZ 4.5Å; L499-F611 VanDerWaalsContact O-CZ 3.31Å; L499-F611 WeakPolarHBondContact O-CZ 3.36Å; L499-I614 HydrophobicContact CD2-CD1 3.82Å; L499-L636 HydrophobicContact CD2-CB 4.43Å; L499-L636 HydrophobicContact CD2-CD2 4.34Å; L499-P642 HydrophobicContact CD1-CG 4.15Å; L499-L664 HydrophobicContact CD2-CD1 4.25Å
500	F	89.4	Confident	75.1	Confident	3 Å²	3	65 Å²	65	1%	0.013	29%	0.292	C	S	.	.			trans	-154.7	154.1	179.4	59.5	-96.7	0	0	0	110.3	F503 F525 V601 I602 F611 M633 L636 M637	F500-F503 HydrophobicContact CD2-CB 4.48Å; F500-F503 HydrophobicContact CE2-CB 4.07Å; F500-F525 AromaticContact CE2-CD1 4Å; F500-F525 HydrophobicContact CE2-CD1 4Å; F500-F525 HydrophobicContact CE2-CE1 4.19Å; F500-F525 HydrophobicContact CZ-CD1 4.21Å; F500-F525 HydrophobicContact CZ-CE1 4.13Å; F500-V601 HydrophobicContact CB-CG1 3.51Å; F500-V601 HydrophobicContact CD1-CG1 4.24Å; F500-V601 HydrophobicContact CG-CG1 3.87Å; F500-I602 CarbonylContact C-O 3.51Å; F500-I602 WeakPolarHBondContact CB-O 3.35Å; F500-F611 HydrophobicContact CB-CE1 4.47Å; F500-M633 HydrophobicContact CZ-CB 4.43Å; F500-M633 HydrophobicContact CZ-SD 4.2Å; F500-L636 HydrophobicContact CE1-CB 3.89Å; F500-L636 HydrophobicContact CE1-CD1 4.3Å; F500-M637 HydrophobicContact CZ-CB 4.22Å
501	E	88.1	Confident	77	Confident	27 Å²	27	67.7 Å²	67.7	13%	0.126	30%	0.303	C	S	.	.	S	Bend	trans	-82.6	-41.6	176.4	-63.5	-174.3	169.5	0	0	111.7	R579 I602 R604	E501-R579 IonicContact OE1-CZ 3.1Å; E501-R579 IonicContact OE1-NE 2.75Å; E501-R579 PolarHBondContact OE1-NE 3.31Å; E501-R579 IonicContact OE1-NH2 3.81Å; E501-R579 PolarHBondContact OE1-NH2 3.43Å; E501-R579 WeakPolarHBondContact OE2-CD 3.46Å; E501-R579 IonicContact OE2-CZ 3.92Å; E501-R579 IonicContact OE2-NE 2.68Å; E501-R579 PolarHBondContact OE2-NE 2.72Å; E501-R579 IonicContact OE2-NH2 3.85Å; E501-I602 PolarHBondContact N-O 2.97Å; E501-R604 IonicContact OE1-CZ 2.71Å; E501-R604 IonicContact OE1-NE 2.71Å; E501-R604 PolarHBondContact OE1-NE 3.22Å; E501-R604 IonicContact OE1-NH2 3.51Å; E501-R604 PolarHBondContact OE1-NH2 3.26Å
502	Y	89.1	Confident	78.8	Confident	34 Å²	34	69.4 Å²	69.4	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	151.6	-177.9	-52	-73.5	0	0	0	111.6	A538 I602	Y502-A538 VanDerWaalsContact OH-CB 3.22Å; Y502-A538 WeakPolarHBondContact OH-CB 3.46Å; Y502-I602 HydrophobicContact CD2-CB 4.24Å; Y502-I602 HydrophobicContact CD2-CG2 4.26Å; Y502-I602 PolarHBondContact N-O 3.35Å; Y502-I602 PolarHBondContact O-N 2.75Å
503	F	94.7	Very high	80.2	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.2	161.1	167.7	-99.5	0	0	0	108.5	F500 V505 Y523 Q524 F525 Y599 C600 V601 V618 V629 M633	F500-F503 HydrophobicContact CD2-CB 4.48Å; F500-F503 HydrophobicContact CE2-CB 4.07Å; F503-V505 HydrophobicContact CE1-CG2 4.42Å; F503-V505 HydrophobicContact CZ-CG2 4.5Å; F503-Y523 HydrophobicContact CD1-CD1 4.42Å; F503-Y523 AromaticContact CD1-CE1 3.8Å; F503-Y523 HydrophobicContact CD1-CE1 3.8Å; F503-Y523 HydrophobicContact CE1-CD1 4.25Å; F503-Y523 AromaticContact CE1-CE1 3.74Å; F503-Y523 HydrophobicContact CE1-CE1 3.74Å; F503-Q524 CarbonylContact O-C 3.59Å; F503-F525 HydrophobicContact CB-CB 4.49Å; F503-F525 HydrophobicContact CD1-CB 4.24Å; F503-F525 PolarHBondContact N-O 2.76Å; F503-F525 PolarHBondContact O-N 2.89Å; F503-Y599 HydrophobicContact CE2-CD1 4.23Å; F503-Y599 AromaticContact CZ-CD1 3.77Å; F503-Y599 HydrophobicContact CZ-CD1 3.77Å; F503-Y599 HydrophobicContact CZ-CE1 4.47Å; F503-C600 CarbonylContact C-O 3.54Å; F503-C600 VanDerWaalsContact CA-O 3.3Å; F503-C600 WeakPolarHBondContact CA-O 3.41Å; F503-V601 HydrophobicContact CD2-CG2 3.75Å; F503-V601 HydrophobicContact CE2-CG2 4.42Å; F503-V618 HydrophobicContact CE2-CG1 4.29Å; F503-V618 HydrophobicContact CE2-CG2 4.11Å; F503-V618 HydrophobicContact CZ-CG1 4Å; F503-V618 HydrophobicContact CZ-CG2 4.17Å; F503-V629 HydrophobicContact CE1-CG1 3.54Å; F503-V629 HydrophobicContact CZ-CG1 3.55Å; F503-M633 HydrophobicContact CB-CG 4.43Å; F503-M633 HydrophobicContact CB-SD 3.93Å; F503-M633 HydrophobicContact CD1-CG 3.56Å; F503-M633 HydrophobicContact CD1-SD 3.77Å; F503-M633 HydrophobicContact CD2-SD 3.66Å; F503-M633 HydrophobicContact CE1-CG 3.76Å; F503-M633 HydrophobicContact CE1-SD 4.08Å; F503-M633 HydrophobicContact CE2-SD 3.96Å; F503-M633 HydrophobicContact CG-CG 3.95Å; F503-M633 HydrophobicContact CG-SD 3.51Å; F503-M633 VanDerWaalsContact CG-SD 3.51Å; F503-M633 HydrophobicContact CZ-CG 4.29Å; F503-M633 HydrophobicContact CZ-SD 4.13Å
504	V	95.4	Very high	81.7	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	149.2	-179.7	-62.6	0	0	0	0	111.3	V506 V521 Y523 Q524 L542 I545 C600	V504-V506 HydrophobicContact CG2-CG2 4.18Å; V504-V521 HydrophobicContact CB-CG1 4.21Å; V504-V521 HydrophobicContact CG1-CG1 4.25Å; V504-Y523 CarbonylContact C-O 3.57Å; V504-Y523 VanDerWaalsContact CA-O 3.31Å; V504-Y523 WeakPolarHBondContact CA-O 3.46Å; V504-Q524 HydrophobicContact CG1-CB 4.11Å; V504-Q524 HydrophobicContact CG1-CG 3.97Å; V504-L542 HydrophobicContact CG1-CD2 4.01Å; V504-I545 HydrophobicContact CG2-CG2 3.77Å; V504-C600 HydrophobicContact CG2-CB 3.83Å; V504-C600 PolarHBondContact N-O 3.35Å; V504-C600 PolarHBondContact O-N 3.38Å
505	V	96.1	Very high	83.3	Confident	7 Å²	7	67.7 Å²	67.7	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	129.1	162.6	-171	0	0	0	0	107.6	F503 V521 S522 Y523 E597 V598 Y599	F503-V505 HydrophobicContact CE1-CG2 4.42Å; F503-V505 HydrophobicContact CZ-CG2 4.5Å; V505-V521 WeakPolarHBondContact O-CA 3.3Å; V505-S522 PolarHBondContact O-N 3.18Å; V505-S522 PolarHBondContact O-OG 2.82Å; V505-Y523 HydrophobicContact CG2-CD1 3.95Å; V505-Y523 HydrophobicContact CG2-CG 4.43Å; V505-Y523 PolarHBondContact N-O 3.39Å; V505-Y523 PolarHBondContact O-N 3.33Å; V505-E597 HydrophobicContact CG1-CB 4.14Å; V505-E597 HydrophobicContact CG1-CG 4.34Å; V505-V598 CarbonylContact C-O 3.57Å; V505-V598 WeakPolarHBondContact CA-O 3.46Å; V505-Y599 HydrophobicContact CB-CE1 4.5Å; V505-Y599 HydrophobicContact CG1-CD1 4.46Å; V505-Y599 HydrophobicContact CG1-CE1 4.17Å; V505-Y599 HydrophobicContact CG1-CE2 4.35Å; V505-Y599 HydrophobicContact CG2-CD1 3.62Å; V505-Y599 HydrophobicContact CG2-CE1 3.48Å; V505-Y599 VanDerWaalsContact CG2-CE1 3.48Å; V505-Y599 HydrophobicContact CG2-CG 4.49Å
506	V	97.1	Very high	85	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.2	176.2	-177.5	0	0	0	0	108.6	V504 P519 E520 I545 P546 C549 F550 E597 V598	V504-V506 HydrophobicContact CG2-CG2 4.18Å; V506-P519 HydrophobicContact CG1-CB 3.82Å; V506-E520 CarbonylContact C-O 3.57Å; V506-E520 WeakPolarHBondContact CA-O 3.42Å; V506-I545 HydrophobicContact CG2-CG2 4.48Å; V506-P546 HydrophobicContact CG1-CB 3.82Å; V506-P546 HydrophobicContact CG1-CG 4.42Å; V506-P546 HydrophobicContact CG2-CB 4.48Å; V506-P546 HydrophobicContact CG2-CG 4.37Å; V506-C549 HydrophobicContact CB-CB 4Å; V506-C549 HydrophobicContact CG1-CB 4.12Å; V506-C549 HydrophobicContact CG2-CB 4Å; V506-F550 HydrophobicContact CB-CE2 4.26Å; V506-F550 HydrophobicContact CG1-CD2 3.77Å; V506-F550 HydrophobicContact CG1-CE2 3.87Å; V506-E597 WeakPolarHBondContact O-CA 3.41Å; V506-V598 HydrophobicContact CB-CB 4.48Å; V506-V598 PolarHBondContact N-O 2.94Å; V506-V598 PolarHBondContact O-N 2.87Å
507	S	96	Very high	86.8	Confident	23 Å²	23	64.1 Å²	64.1	16%	0.161	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	154.2	177.1	65.7	0	0	0	0	111.7	P519 E520	S507-P519 WeakPolarHBondContact O-CA 3.45Å; S507-E520 PolarHBondContact N-O 3.47Å; S507-E520 PolarHBondContact O-N 3Å
508	L	95.4	Very high	88.4	Confident	11 Å²	11	54 Å²	54	6%	0.058	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	110.3	175.9	-70.5	173.7	0	0	0	110.6	Y517 A518 P519 F550 A553 W556 L595 P596	L508-Y517 HydrophobicContact CB-CD1 4.38Å; L508-Y517 HydrophobicContact CB-CG 4.38Å; L508-A518 CarbonylContact C-O 3.59Å; L508-A518 WeakPolarHBondContact CA-O 3.43Å; L508-P519 HydrophobicContact CD2-CB 4.13Å; L508-F550 HydrophobicContact CD1-CD1 3.93Å; L508-F550 HydrophobicContact CD1-CE1 3.74Å; L508-F550 HydrophobicContact CD1-CZ 4.2Å; L508-F550 HydrophobicContact CD2-CB 4.16Å; L508-F550 HydrophobicContact CD2-CD1 3.99Å; L508-F550 HydrophobicContact CD2-CD2 4.05Å; L508-F550 HydrophobicContact CD2-CE1 4.37Å; L508-F550 HydrophobicContact CD2-CE2 4.41Å; L508-F550 HydrophobicContact CD2-CG 3.81Å; L508-F550 HydrophobicContact CG-CD1 4.02Å; L508-F550 HydrophobicContact CG-CD2 4.26Å; L508-F550 HydrophobicContact CG-CE1 3.89Å; L508-F550 HydrophobicContact CG-CE2 4.12Å; L508-F550 HydrophobicContact CG-CG 4.19Å; L508-F550 HydrophobicContact CG-CZ 3.91Å; L508-A553 HydrophobicContact CD2-CB 4Å; L508-W556 HydrophobicContact CD1-CB 3.67Å; L508-W556 HydrophobicContact CD1-CD2 4.17Å; L508-W556 HydrophobicContact CD1-CG 3.62Å; L508-L595 HydrophobicContact CB-CB 4.31Å; L508-L595 HydrophobicContact CB-CD1 4.07Å; L508-L595 HydrophobicContact CD1-CD2 4.25Å; L508-L595 WeakPolarHBondContact O-CD1 3.35Å; L508-P596 HydrophobicContact CD1-CG 4.32Å
509	K	92	Very high	89.4	Confident	92 Å²	92	49.1 Å²	49.1	40%	0.4	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	143.1	172.2	-59.8	-166.5	-162	160	0	110.9	Y517 A518 E520	K509-Y517 CarbonylContact O-C 3.59Å; K509-Y517 VanDerWaalsContact O-CA 3.28Å; K509-Y517 WeakPolarHBondContact O-CA 3.42Å; K509-A518 PolarHBondContact N-O 2.75Å; K509-A518 PolarHBondContact O-N 3.17Å; K509-E520 HydrophobicContact CD-CB 4.39Å; K509-E520 WeakPolarHBondContact CD-OE2 3.28Å; K509-E520 VanDerWaalsContact CE-OE2 3.26Å; K509-E520 WeakPolarHBondContact CE-OE2 3.46Å; K509-E520 IonicContact NZ-OE2 2.8Å; K509-E520 PolarHBondContact NZ-OE2 3.49Å
510	K	90.4	Very high	89.9	Confident	122 Å²	122	52.7 Å²	52.7	53%	0.53	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	128.8	176.4	-171.1	177.3	-177.6	177.6	0	109.5	N515 Y517	K510-N515 VanDerWaalsContact CE-OD1 3.26Å; K510-N515 WeakPolarHBondContact CE-OD1 3.36Å; K510-N515 PolarHBondContact NZ-OD1 3.12Å; K510-Y517 HydrophobicContact CB-CD1 4.13Å; K510-Y517 HydrophobicContact CB-CE1 3.85Å; K510-Y517 HydrophobicContact CG-CE1 4.28Å
511	K	87	Confident	90.1	Very high	97 Å²	97	54.9 Å²	54.9	42%	0.422	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-70.6	137	176.1	-66.9	-174	177.7	-174.9	0	110.8	K514 S516 A518	K511-K514 HydrophobicContact CB-CB 4.41Å; K511-K514 PolarHBondContact O-N 2.82Å; K511-S516 PolarHBondContact N-O 3.17Å; K511-A518 HydrophobicContact CD-CB 4.37Å; K511-A518 VanDerWaalsContact CE-CB 3.42Å; K511-A518 HydrophobicContact CG-CB 3.97Å
512	P	82.7	Confident	90.4	Very high	126 Å²	126	56.7 Å²	56.7	82%	0.818	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	141.4	170.5	26.4	-33.6	0	0	0	109.9	K514	P512-K514 PolarHBondContact O-N 3.28Å; P512-K514 VanDerWaalsContact O-N 3.12Å
513	G	76.4	Confident	90.5	Very high	90 Å²	90	58.6 Å²	58.6	93%	0.928	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	1	179.6	0	0	0	0	0	116.8
514	K	76.9	Confident	90.5	Very high	144 Å²	144	60.8 Å²	60.8	63%	0.626	33%	0.333	S	S	*	.	S	Bend	trans	-138.9	136.1	179.5	-62.8	-174	179.2	-178.9	0	112.3	K511 P512 S516	K511-K514 HydrophobicContact CB-CB 4.41Å; K511-K514 PolarHBondContact O-N 2.82Å; P512-K514 PolarHBondContact O-N 3.28Å; P512-K514 VanDerWaalsContact O-N 3.12Å; K514-S516 WeakPolarHBondContact CB-OG 3.47Å; K514-S516 PolarHBondContact O-N 3.5Å
515	N	79.4	Confident	90.2	Very high	150 Å²	150	61 Å²	61	80%	0.802	33%	0.334	S	S	*	.	S	Bend	trans	-77.3	60.3	169.4	-75.9	-22	0	0	0	110.7	K510	K510-N515 VanDerWaalsContact CE-OD1 3.26Å; K510-N515 WeakPolarHBondContact CE-OD1 3.36Å; K510-N515 PolarHBondContact NZ-OD1 3.12Å
516	S	86.9	Confident	89.8	Confident	33 Å²	33	62.7 Å²	62.7	23%	0.231	35%	0.345	C	S	.	.			trans	-148.2	148.8	179.5	60.7	0	0	0	0	109.7	K511 K514	K511-S516 PolarHBondContact N-O 3.17Å; K514-S516 WeakPolarHBondContact CB-OG 3.47Å; K514-S516 PolarHBondContact O-N 3.5Å
517	Y	91.8	Very high	89.1	Confident	45 Å²	45	70.5 Å²	70.5	18%	0.176	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	161.1	-178.7	-62.4	-81.1	0	0	0	112.6	L508 K509 K510 W556 L595	L508-Y517 HydrophobicContact CB-CD1 4.38Å; L508-Y517 HydrophobicContact CB-CG 4.38Å; K509-Y517 CarbonylContact O-C 3.59Å; K509-Y517 VanDerWaalsContact O-CA 3.28Å; K509-Y517 WeakPolarHBondContact O-CA 3.42Å; K510-Y517 HydrophobicContact CB-CD1 4.13Å; K510-Y517 HydrophobicContact CB-CE1 3.85Å; K510-Y517 HydrophobicContact CG-CE1 4.28Å; Y517-W556 VanDerWaalsContact CD2-O 3.29Å; Y517-W556 WeakPolarHBondContact CD2-O 3.35Å; Y517-W556 WeakPolarHBondContact CE2-O 3.41Å; Y517-L595 HydrophobicContact CD1-CD1 3.68Å; Y517-L595 HydrophobicContact CE1-CD1 3.37Å; Y517-L595 HydrophobicContact CE1-CD2 4.31Å; Y517-L595 HydrophobicContact CE1-CG 4.45Å; Y517-L595 HydrophobicContact CE2-CD2 4.25Å; Y517-L595 HydrophobicContact CG-CD1 4.49Å
518	A	92.8	Very high	87.8	Confident	13 Å²	13	72.8 Å²	72.8	11%	0.107	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.6	171.3	0	0	0	0	0	108	L508 K509 K511	L508-A518 CarbonylContact C-O 3.59Å; L508-A518 WeakPolarHBondContact CA-O 3.43Å; K509-A518 PolarHBondContact N-O 2.75Å; K509-A518 PolarHBondContact O-N 3.17Å; K511-A518 HydrophobicContact CD-CB 4.37Å; K511-A518 VanDerWaalsContact CE-CB 3.42Å; K511-A518 HydrophobicContact CG-CB 3.97Å
519	P	95.7	Very high	85.9	Confident	12 Å²	12	80.4 Å²	80.4	8%	0.078	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.3	168.8	33.2	-31	0	0	0	109.2	V506 S507 L508 P546 F550 A553	V506-P519 HydrophobicContact CG1-CB 3.82Å; S507-P519 WeakPolarHBondContact O-CA 3.45Å; L508-P519 HydrophobicContact CD2-CB 4.13Å; P519-P546 HydrophobicContact CB-CB 3.88Å; P519-P546 VanDerWaalsContact CB-O 3.24Å; P519-P546 WeakPolarHBondContact CB-O 3.45Å; P519-P546 HydrophobicContact CG-CB 4.09Å; P519-P546 VanDerWaalsContact CG-O 3.26Å; P519-P546 WeakPolarHBondContact CG-O 3.42Å; P519-P546 WeakPolarHBondContact O-CB 3.31Å; P519-F550 HydrophobicContact CB-CB 3.84Å; P519-F550 HydrophobicContact CB-CD2 3.67Å; P519-F550 HydrophobicContact CB-CG 4.13Å; P519-F550 HydrophobicContact CG-CB 4.19Å; P519-A553 HydrophobicContact CG-CB 4.09Å
520	E	94.4	Very high	84.2	Confident	77 Å²	77	86.8 Å²	86.8	36%	0.36	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	147.3	-180	-71.7	179.4	-134.6	0	0	110.5	V506 S507 K509 S522	V506-E520 CarbonylContact C-O 3.57Å; V506-E520 WeakPolarHBondContact CA-O 3.42Å; S507-E520 PolarHBondContact N-O 3.47Å; S507-E520 PolarHBondContact O-N 3Å; K509-E520 HydrophobicContact CD-CB 4.39Å; K509-E520 WeakPolarHBondContact CD-OE2 3.28Å; K509-E520 VanDerWaalsContact CE-OE2 3.26Å; K509-E520 WeakPolarHBondContact CE-OE2 3.46Å; K509-E520 IonicContact NZ-OE2 2.8Å; K509-E520 PolarHBondContact NZ-OE2 3.49Å; E520-S522 PolarHBondContact O-N 3.29Å
521	V	94.7	Very high	82.5	Confident	50 Å²	50	88 Å²	88	30%	0.303	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	117.9	172.6	-177.6	0	0	0	0	108.8	V504 V505 Y523 Q524 P546	V504-V521 HydrophobicContact CB-CG1 4.21Å; V504-V521 HydrophobicContact CG1-CG1 4.25Å; V505-V521 WeakPolarHBondContact O-CA 3.3Å; V521-Y523 VanDerWaalsContact CG1-O 3.25Å; V521-Y523 WeakPolarHBondContact CG1-O 3.28Å; V521-Q524 HydrophobicContact CG1-CB 4.27Å; V521-P546 HydrophobicContact CG2-CG 3.72Å
522	S	93	Very high	81.3	Confident	64 Å²	64	87.3 Å²	87.3	45%	0.448	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-24.2	174.4	57.9	0	0	0	0	112.5	V505 E520	V505-S522 PolarHBondContact O-N 3.18Å; V505-S522 PolarHBondContact O-OG 2.82Å; E520-S522 PolarHBondContact O-N 3.29Å
523	Y	92.7	Very high	80.2	Confident	75 Å²	75	89 Å²	89	29%	0.294	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	146.6	178.5	167.9	-81.4	0	0	0	110.6	F503 V504 V505 V521 F525 Y630	F503-Y523 HydrophobicContact CD1-CD1 4.42Å; F503-Y523 AromaticContact CD1-CE1 3.8Å; F503-Y523 HydrophobicContact CD1-CE1 3.8Å; F503-Y523 HydrophobicContact CE1-CD1 4.25Å; F503-Y523 AromaticContact CE1-CE1 3.74Å; F503-Y523 HydrophobicContact CE1-CE1 3.74Å; V504-Y523 CarbonylContact C-O 3.57Å; V504-Y523 VanDerWaalsContact CA-O 3.31Å; V504-Y523 WeakPolarHBondContact CA-O 3.46Å; V505-Y523 HydrophobicContact CG2-CD1 3.95Å; V505-Y523 HydrophobicContact CG2-CG 4.43Å; V505-Y523 PolarHBondContact N-O 3.39Å; V505-Y523 PolarHBondContact O-N 3.33Å; V521-Y523 VanDerWaalsContact CG1-O 3.25Å; V521-Y523 WeakPolarHBondContact CG1-O 3.28Å; Y523-F525 HydrophobicContact CE1-CB 3.95Å; Y523-Y630 WeakPolarHBondContact OH-CB 3.42Å; Y523-Y630 VanDerWaalsContact OH-CD2 3.29Å; Y523-Y630 WeakPolarHBondContact OH-CD2 3.29Å
524	Q	92.8	Very high	79.4	Confident	45 Å²	45	92 Å²	92	21%	0.21	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	141.7	177	177	-177.5	-32.2	0	0	111.1	F503 V504 V521 P526	F503-Q524 CarbonylContact O-C 3.59Å; V504-Q524 HydrophobicContact CG1-CB 4.11Å; V504-Q524 HydrophobicContact CG1-CG 3.97Å; V521-Q524 HydrophobicContact CG1-CB 4.27Å; Q524-P526 PolarHBondContact NE2-O 3.45Å
525	F	90.2	Very high	78.8	Confident	6 Å²	6	86.3 Å²	86.3	3%	0.026	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	139.1	169.2	-179.8	-87.8	0	0	0	110.2	F500 F503 Y523 Y630 M633 R634 M637	F500-F525 AromaticContact CE2-CD1 4Å; F500-F525 HydrophobicContact CE2-CD1 4Å; F500-F525 HydrophobicContact CE2-CE1 4.19Å; F500-F525 HydrophobicContact CZ-CD1 4.21Å; F500-F525 HydrophobicContact CZ-CE1 4.13Å; F503-F525 HydrophobicContact CB-CB 4.49Å; F503-F525 HydrophobicContact CD1-CB 4.24Å; F503-F525 PolarHBondContact N-O 2.76Å; F503-F525 PolarHBondContact O-N 2.89Å; Y523-F525 HydrophobicContact CE1-CB 3.95Å; F525-Y630 AromaticContact CD2-CD2 3.85Å; F525-Y630 HydrophobicContact CD2-CD2 3.85Å; F525-Y630 AromaticContact CD2-CE2 3.62Å; F525-Y630 HydrophobicContact CD2-CE2 3.62Å; F525-Y630 HydrophobicContact CE2-CD2 4.27Å; F525-Y630 AromaticContact CE2-CE2 3.78Å; F525-Y630 HydrophobicContact CE2-CE2 3.78Å; F525-M633 HydrophobicContact CD1-CB 3.68Å; F525-M633 HydrophobicContact CD2-CB 4.45Å; F525-M633 HydrophobicContact CE1-CB 3.85Å; F525-M633 HydrophobicContact CG-CB 4.01Å; F525-M633 HydrophobicContact CZ-CB 4.33Å; F525-R634 HydrophobicContact CE2-CB 4.28Å; F525-R634 HydrophobicContact CZ-CB 4.03Å; F525-M637 HydrophobicContact CE1-CB 4.25Å; F525-M637 HydrophobicContact CE1-CE 3.93Å; F525-M637 HydrophobicContact CE1-SD 3.65Å; F525-M637 HydrophobicContact CZ-CE 3.83Å; F525-M637 HydrophobicContact CZ-SD 4.19Å
526	P	87.9	Confident	78.3	Confident	42 Å²	42	86.7 Å²	86.7	27%	0.273	41%	0.412	S	S	.	.	S	Bend	cis	-62.9	160.7	-15	29.3	-35.5	0	0	0	111.6	Q524 M637	Q524-P526 PolarHBondContact NE2-O 3.45Å; P526-M637 HydrophobicContact CB-CE 4.46Å; P526-M637 HydrophobicContact CG-SD 4.43Å
527	K	81.4	Confident	77.4	Confident	164 Å²	164	88.7 Å²	88.7	71%	0.713	42%	0.418	S	S	*	.			trans	-66.5	136.7	169.7	-71.7	-172.4	176.9	-176.2	0	108.9	E529	K527-E529 PolarHBondContact O-N 3.35Å; K527-E529 VanDerWaalsContact O-N 3.14Å
528	L	68.4	Low	76.4	Confident	70 Å²	70	86.8 Å²	86.8	37%	0.366	41%	0.411	S	S	.	.			trans	-83.2	90.9	-173.2	-163.7	65.6	0	0	0	110.6	M535 L542	L528-M535 HydrophobicContact CD1-CG 3.95Å; L528-M535 HydrophobicContact CD2-CE 4.4Å; L528-M535 HydrophobicContact CD2-CG 3.64Å; L528-M535 HydrophobicContact CD2-SD 3.99Å; L528-M535 HydrophobicContact CG-CG 3.73Å; L528-M535 HydrophobicContact CG-SD 3.94Å; L528-L542 HydrophobicContact CD2-CD1 4.11Å
529	E	56.1	Low	75.5	Confident	171 Å²	171	89.5 Å²	89.5	80%	0.799	42%	0.422	S	S	*	.			trans	-89.7	110.8	-176.2	-69.7	-170.6	-172.8	0	0	113.4	K527	K527-E529 PolarHBondContact O-N 3.35Å; K527-E529 VanDerWaalsContact O-N 3.14Å
530	R	57.5	Low	74.5	Confident	227 Å²	227	93 Å²	93	86%	0.857	44%	0.437	S	S	*	.	S	Bend	trans	67.7	145.6	168.7	-68.8	-177.3	170.6	169	-1.8	118.1	T532 M535	R530-T532 PolarHBondContact O-N 2.93Å; R530-M535 VanDerWaalsContact O-SD 3.41Å
531	L	52.8	Low	73.7	Confident	146 Å²	146	91.5 Å²	91.5	76%	0.764	43%	0.428	S	S	*	.			trans	-72.4	111.9	-169.6	-69	126.7	0	0	0	113.1	M535	L531-M535 HydrophobicContact CD2-CE 3.66Å; L531-M535 HydrophobicContact CG-CE 3.91Å; L531-M535 HydrophobicContact CG-SD 4.3Å
532	T	61.9	Low	73.1	Confident	84 Å²	84	89.9 Å²	89.9	52%	0.515	42%	0.418	S	S	.	.			trans	-117.3	167.9	162.7	67.9	0	0	0	0	110.3	R530 Q534 M535	R530-T532 PolarHBondContact O-N 2.93Å; T532-Q534 VanDerWaalsContact C-N 3.29Å; T532-Q534 PolarHBondContact O-N 3.36Å; T532-M535 WeakPolarHBondContact O-CB 3.33Å; T532-M535 PolarHBondContact O-N 3.05Å; T532-M535 PolarHBondContact OG1-N 3.32Å
533	K	59.6	Low	72.7	Confident	161 Å²	161	93.3 Å²	93.3	70%	0.7	42%	0.424	S	S	*	.	H	α-helix	trans	-60	-39.7	177.4	-173.5	-177.2	173	-171.2	0	112.1	M535 R536	K533-M535 PolarHBondContact O-N 3.29Å; K533-R536 PolarHBondContact O-N 3.33Å
534	Q	60.4	Low	72.7	Confident	153 Å²	153	90.7 Å²	90.7	72%	0.715	42%	0.418	S	S	*	.	H	α-helix	trans	-63.3	-29.6	176	-69.4	169.3	-60.9	0	0	112	T532 R536 E537 A538	T532-Q534 VanDerWaalsContact C-N 3.29Å; T532-Q534 PolarHBondContact O-N 3.36Å; Q534-R536 VanDerWaalsContact C-N 3.31Å; Q534-R536 PolarHBondContact O-N 2.66Å; Q534-E537 PolarHBondContact O-N 3.08Å; Q534-A538 PolarHBondContact O-N 3.12Å; Q534-A538 VanDerWaalsContact O-N 3.17Å
535	M	64.3	Low	72.7	Confident	24 Å²	24	88.6 Å²	88.6	12%	0.118	41%	0.408	C	S	.	.	H	α-helix	trans	-62.2	-33.8	178.1	-157.9	-161.5	86.7	0	0	112.9	L528 R530 L531 T532 K533 A538 E539	L528-M535 HydrophobicContact CD1-CG 3.95Å; L528-M535 HydrophobicContact CD2-CE 4.4Å; L528-M535 HydrophobicContact CD2-CG 3.64Å; L528-M535 HydrophobicContact CD2-SD 3.99Å; L528-M535 HydrophobicContact CG-CG 3.73Å; L528-M535 HydrophobicContact CG-SD 3.94Å; R530-M535 VanDerWaalsContact O-SD 3.41Å; L531-M535 HydrophobicContact CD2-CE 3.66Å; L531-M535 HydrophobicContact CG-CE 3.91Å; L531-M535 HydrophobicContact CG-SD 4.3Å; T532-M535 WeakPolarHBondContact O-CB 3.33Å; T532-M535 PolarHBondContact O-N 3.05Å; T532-M535 PolarHBondContact OG1-N 3.32Å; K533-M535 PolarHBondContact O-N 3.29Å; M535-A538 WeakPolarHBondContact O-CB 3.32Å; M535-A538 PolarHBondContact O-N 3.43Å; M535-E539 WeakPolarHBondContact O-CB 3.47Å; M535-E539 PolarHBondContact O-N 3.16Å
536	R	68.3	Low	73	Confident	158 Å²	158	88.7 Å²	88.7	60%	0.596	41%	0.41	S	S	*	.	H	α-helix	trans	-67	-40.7	-179.4	-69.5	-163.2	-64.4	-134.9	4.5	112.7	K533 Q534 A538 E539 Q540	K533-R536 PolarHBondContact O-N 3.33Å; Q534-R536 VanDerWaalsContact C-N 3.31Å; Q534-R536 PolarHBondContact O-N 2.66Å; R536-A538 VanDerWaalsContact C-N 3.34Å; R536-E539 PolarHBondContact O-N 3.25Å; R536-Q540 WeakPolarHBondContact O-CG 3.44Å; R536-Q540 PolarHBondContact O-N 2.91Å
537	E	68.9	Low	73.4	Confident	76 Å²	76	89.5 Å²	89.5	36%	0.355	41%	0.41	S	S	.	.	H	α-helix	trans	-66.9	-38.1	173.8	-56.3	171.2	-153	0	0	111.3	Q534 Q540 R541	Q534-E537 PolarHBondContact O-N 3.08Å; E537-Q540 PolarHBondContact O-N 3.48Å; E537-R541 WeakPolarHBondContact O-CD 3.43Å; E537-R541 WeakPolarHBondContact O-CG 3.47Å; E537-R541 PolarHBondContact O-N 2.85Å; E537-R541 IonicContact OE2-CZ 3.69Å; E537-R541 IonicContact OE2-NH1 2.87Å; E537-R541 PolarHBondContact OE2-NH1 3.05Å; E537-R541 IonicContact OE2-NH2 2.68Å; E537-R541 PolarHBondContact OE2-NH2 3.11Å
538	A	69.7	Low	74.1	Confident	4 Å²	4	82.4 Å²	82.4	3%	0.033	38%	0.379	C	S	.	.	H	α-helix	trans	-62.4	-41.6	173.5	0	0	0	0	0	112	Y502 Q534 M535 R536 R541 L542	Y502-A538 VanDerWaalsContact OH-CB 3.22Å; Y502-A538 WeakPolarHBondContact OH-CB 3.46Å; Q534-A538 PolarHBondContact O-N 3.12Å; Q534-A538 VanDerWaalsContact O-N 3.17Å; M535-A538 WeakPolarHBondContact O-CB 3.32Å; M535-A538 PolarHBondContact O-N 3.43Å; R536-A538 VanDerWaalsContact C-N 3.34Å; A538-R541 WeakPolarHBondContact O-CB 3.45Å; A538-R541 PolarHBondContact O-N 2.94Å; A538-L542 WeakPolarHBondContact O-CB 3.45Å; A538-L542 VanDerWaalsContact O-CG 3.3Å; A538-L542 WeakPolarHBondContact O-CG 3.35Å; A538-L542 PolarHBondContact O-N 3.15Å
539	E	73.9	Confident	75.5	Confident	71 Å²	71	79 Å²	79	33%	0.332	36%	0.361	S	S	.	.	H	α-helix	trans	-65.1	-40.3	176.8	-164.5	-162	128.7	0	0	111.9	M535 R536 L542 K543	M535-E539 WeakPolarHBondContact O-CB 3.47Å; M535-E539 PolarHBondContact O-N 3.16Å; R536-E539 PolarHBondContact O-N 3.25Å; E539-L542 PolarHBondContact O-N 3.06Å; E539-K543 WeakPolarHBondContact O-CG 3.29Å; E539-K543 PolarHBondContact O-N 3.29Å; E539-K543 WeakPolarHBondContact OE1-CE 3.06Å; E539-K543 IonicContact OE1-NZ 3.94Å; E539-K543 PolarHBondContact OE1-NZ 3.22Å
540	Q	76.6	Confident	77.4	Confident	84 Å²	84	71 Å²	71	39%	0.393	32%	0.324	S	S	.	.	H	α-helix	trans	-62.7	-42	171.2	-73.6	171.8	-53.3	0	0	111.9	F44 R536 E537 K543 A544	F44-Q540 PolarHBondContact O-NE2 2.84Å; R536-Q540 WeakPolarHBondContact O-CG 3.44Å; R536-Q540 PolarHBondContact O-N 2.91Å; E537-Q540 PolarHBondContact O-N 3.48Å; Q540-K543 PolarHBondContact O-N 3.49Å; Q540-A544 PolarHBondContact O-N 2.89Å
541	R	76.4	Confident	79.2	Confident	47 Å²	47	60.7 Å²	60.7	18%	0.177	29%	0.286	C	S	.	.	H	α-helix	trans	-62.2	-43.7	174.2	-68.6	160.9	-171.3	132.5	8.8	111.4	E537 A538 K543 A544 I545	E537-R541 WeakPolarHBondContact O-CD 3.43Å; E537-R541 WeakPolarHBondContact O-CG 3.47Å; E537-R541 PolarHBondContact O-N 2.85Å; E537-R541 IonicContact OE2-CZ 3.69Å; E537-R541 IonicContact OE2-NH1 2.87Å; E537-R541 PolarHBondContact OE2-NH1 3.05Å; E537-R541 IonicContact OE2-NH2 2.68Å; E537-R541 PolarHBondContact OE2-NH2 3.11Å; A538-R541 WeakPolarHBondContact O-CB 3.45Å; A538-R541 PolarHBondContact O-N 2.94Å; R541-K543 VanDerWaalsContact C-N 3.32Å; R541-K543 PolarHBondContact O-N 3.08Å; R541-A544 WeakPolarHBondContact O-CB 3.17Å; R541-A544 PolarHBondContact O-N 3.01Å; R541-A544 VanDerWaalsContact O-N 3.1Å; R541-I545 WeakPolarHBondContact O-CG1 3.38Å; R541-I545 PolarHBondContact O-N 3.1Å; R541-I545 VanDerWaalsContact O-N 3.15Å
542	L	81.6	Confident	81.1	Confident	16 Å²	16	54.6 Å²	54.6	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-33.9	176.1	-73.8	163.6	0	0	0	113	V504 L528 A538 E539 A544 I545 P546	V504-L542 HydrophobicContact CG1-CD2 4.01Å; L528-L542 HydrophobicContact CD2-CD1 4.11Å; A538-L542 WeakPolarHBondContact O-CB 3.45Å; A538-L542 VanDerWaalsContact O-CG 3.3Å; A538-L542 WeakPolarHBondContact O-CG 3.35Å; A538-L542 PolarHBondContact O-N 3.15Å; E539-L542 PolarHBondContact O-N 3.06Å; L542-A544 VanDerWaalsContact C-N 3.33Å; L542-I545 HydrophobicContact CD2-CD1 4.34Å; L542-P546 WeakPolarHBondContact O-CD 3.47Å
543	K	86.4	Confident	82.5	Confident	136 Å²	136	51.1 Å²	51.1	59%	0.591	23%	0.234	S	C	*	.	H	α-helix	trans	-68.8	-28.4	173.1	-74.1	163.8	175.3	172.3	0	113.2	E539 Q540 R541	E539-K543 WeakPolarHBondContact O-CG 3.29Å; E539-K543 PolarHBondContact O-N 3.29Å; E539-K543 WeakPolarHBondContact OE1-CE 3.06Å; E539-K543 IonicContact OE1-NZ 3.94Å; E539-K543 PolarHBondContact OE1-NZ 3.22Å; Q540-K543 PolarHBondContact O-N 3.49Å; R541-K543 VanDerWaalsContact C-N 3.32Å; R541-K543 PolarHBondContact O-N 3.08Å
544	A	90.7	Very high	83.8	Confident	19 Å²	19	50 Å²	50	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-79.3	-42.1	177.9	0	0	0	0	0	113.1	Q540 R541 L542 P546 Q547 F548	Q540-A544 PolarHBondContact O-N 2.89Å; R541-A544 WeakPolarHBondContact O-CB 3.17Å; R541-A544 PolarHBondContact O-N 3.01Å; R541-A544 VanDerWaalsContact O-N 3.1Å; L542-A544 VanDerWaalsContact C-N 3.33Å; A544-P546 VanDerWaalsContact O-N 3.16Å; A544-Q547 WeakPolarHBondContact O-CB 3.42Å; A544-Q547 PolarHBondContact O-N 2.81Å; A544-F548 HydrophobicContact CB-CE2 4.34Å; A544-F548 WeakPolarHBondContact O-CD2 3.2Å
545	I	94.8	Very high	85.2	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-47.6	-45.7	-171.8	-73.5	160.8	0	0	0	114.3	V504 V506 R541 L542 Q547 F548 C549 F569 L571 I602	V504-I545 HydrophobicContact CG2-CG2 3.77Å; V506-I545 HydrophobicContact CG2-CG2 4.48Å; R541-I545 WeakPolarHBondContact O-CG1 3.38Å; R541-I545 PolarHBondContact O-N 3.1Å; R541-I545 VanDerWaalsContact O-N 3.15Å; L542-I545 HydrophobicContact CD2-CD1 4.34Å; I545-Q547 PolarHBondContact O-N 3.36Å; I545-Q547 VanDerWaalsContact O-N 3.16Å; I545-F548 WeakPolarHBondContact O-CA 3.37Å; I545-F548 PolarHBondContact O-N 2.94Å; I545-C549 PolarHBondContact O-N 2.89Å; I545-F569 HydrophobicContact CB-CZ 4.48Å; I545-F569 HydrophobicContact CG1-CE2 4.43Å; I545-F569 HydrophobicContact CG1-CZ 4.19Å; I545-F569 HydrophobicContact CG2-CZ 4.05Å; I545-L571 HydrophobicContact CD1-CD1 4.32Å; I545-L571 HydrophobicContact CG1-CD1 3.83Å; I545-I602 HydrophobicContact CD1-CD1 3.59Å; I545-I602 HydrophobicContact CD1-CG1 3.65Å; I545-I602 HydrophobicContact CG1-CD1 3.9Å
546	P	96	Very high	86.4	Confident	9 Å²	9	47.2 Å²	47.2	6%	0.058	22%	0.217	C	C	.	.	H	α-helix	trans	-56.8	-33.4	179.8	-28.8	36.7	0	0	0	114.8	V506 P519 V521 L542 A544 F548 C549 F550	V506-P546 HydrophobicContact CG1-CB 3.82Å; V506-P546 HydrophobicContact CG1-CG 4.42Å; V506-P546 HydrophobicContact CG2-CB 4.48Å; V506-P546 HydrophobicContact CG2-CG 4.37Å; P519-P546 HydrophobicContact CB-CB 3.88Å; P519-P546 VanDerWaalsContact CB-O 3.24Å; P519-P546 WeakPolarHBondContact CB-O 3.45Å; P519-P546 HydrophobicContact CG-CB 4.09Å; P519-P546 VanDerWaalsContact CG-O 3.26Å; P519-P546 WeakPolarHBondContact CG-O 3.42Å; P519-P546 WeakPolarHBondContact O-CB 3.31Å; V521-P546 HydrophobicContact CG2-CG 3.72Å; L542-P546 WeakPolarHBondContact O-CD 3.47Å; A544-P546 VanDerWaalsContact O-N 3.16Å; P546-F548 VanDerWaalsContact C-N 3.31Å; P546-F548 PolarHBondContact O-N 2.68Å; P546-C549 PolarHBondContact O-N 2.85Å; P546-F550 PolarHBondContact O-N 2.84Å; P546-F550 VanDerWaalsContact O-N 3.1Å
547	Q	95.2	Very high	87.5	Confident	58 Å²	58	43.1 Å²	43.1	27%	0.271	21%	0.213	S	C	.	.	H	α-helix	trans	-68.4	-32.1	176.3	-56.7	-62.4	-63.7	0	0	111.9	A544 I545 F550 P551 P737 S739 M740	A544-Q547 WeakPolarHBondContact O-CB 3.42Å; A544-Q547 PolarHBondContact O-N 2.81Å; I545-Q547 PolarHBondContact O-N 3.36Å; I545-Q547 VanDerWaalsContact O-N 3.16Å; Q547-F550 CarbonylContact O-C 3.47Å; Q547-P551 VanDerWaalsContact O-CA 3.31Å; Q547-P551 WeakPolarHBondContact O-CA 3.38Å; Q547-P551 VanDerWaalsContact O-N 3.15Å; Q547-P737 HydrophobicContact CB-CB 4.15Å; Q547-P737 HydrophobicContact CB-CG 4.01Å; Q547-P737 WeakPolarHBondContact O-CB 3.31Å; Q547-P737 VanDerWaalsContact O-CG 3.25Å; Q547-P737 WeakPolarHBondContact O-CG 3.25Å; Q547-S739 PolarHBondContact OE1-OG 3.17Å; Q547-M740 HydrophobicContact CB-CE 4.08Å; Q547-M740 HydrophobicContact CG-CE 4.22Å
548	F	96.4	Very high	88.7	Confident	15 Å²	15	42.1 Å²	42.1	7%	0.066	21%	0.213	C	C	.	.	H	α-helix	trans	-82.5	-27.2	177	-70.9	-86.2	0	0	0	113.2	A544 I545 P546 F569 L571 I733 V735 P737 M740	A544-F548 HydrophobicContact CB-CE2 4.34Å; A544-F548 WeakPolarHBondContact O-CD2 3.2Å; I545-F548 WeakPolarHBondContact O-CA 3.37Å; I545-F548 PolarHBondContact O-N 2.94Å; P546-F548 VanDerWaalsContact C-N 3.31Å; P546-F548 PolarHBondContact O-N 2.68Å; F548-F569 HydrophobicContact CB-CB 4.16Å; F548-F569 HydrophobicContact CB-CD1 3.58Å; F548-F569 HydrophobicContact CB-CD2 3.71Å; F548-F569 HydrophobicContact CB-CE1 3.72Å; F548-F569 HydrophobicContact CB-CE2 3.89Å; F548-F569 HydrophobicContact CB-CG 3.57Å; F548-F569 HydrophobicContact CB-CZ 3.89Å; F548-F569 HydrophobicContact CD1-CB 4.03Å; F548-F569 HydrophobicContact CD1-CD2 4.17Å; F548-F569 HydrophobicContact CD1-CG 4.18Å; F548-F569 HydrophobicContact CG-CB 4.47Å; F548-F569 AromaticContact CG-CD2 3.96Å; F548-F569 HydrophobicContact CG-CD2 3.96Å; F548-F569 HydrophobicContact CG-CE2 4.32Å; F548-F569 HydrophobicContact CG-CG 4.14Å; F548-L571 HydrophobicContact CD2-CD2 3.75Å; F548-L571 HydrophobicContact CE2-CD2 3.68Å; F548-L571 HydrophobicContact CG-CD2 4.31Å; F548-L571 HydrophobicContact CZ-CD2 4.17Å; F548-I733 HydrophobicContact CE1-CG2 3.88Å; F548-V735 VanDerWaalsContact CD1-O 3.25Å; F548-V735 WeakPolarHBondContact CD1-O 3.36Å; F548-V735 WeakPolarHBondContact CE1-O 3.35Å; F548-P737 HydrophobicContact CD1-CG 3.85Å; F548-P737 HydrophobicContact CD2-CG 4.29Å; F548-P737 HydrophobicContact CE1-CG 3.94Å; F548-P737 HydrophobicContact CE2-CG 4.37Å; F548-P737 HydrophobicContact CG-CG 4.03Å; F548-P737 HydrophobicContact CZ-CG 4.2Å; F548-M740 HydrophobicContact CE2-CE 4.09Å; F548-M740 HydrophobicContact CE2-SD 4.06Å; F548-M740 HydrophobicContact CZ-SD 3.91Å
549	C	97.2	Very high	89.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-69.9	-33.1	169.7	-68.4	0	0	0	0	112.5	V506 I545 P546 V598	V506-C549 HydrophobicContact CB-CB 4Å; V506-C549 HydrophobicContact CG1-CB 4.12Å; V506-C549 HydrophobicContact CG2-CB 4Å; I545-C549 PolarHBondContact O-N 2.89Å; P546-C549 PolarHBondContact O-N 2.85Å; C549-V598 HydrophobicContact CB-CB 3.93Å; C549-V598 HydrophobicContact CB-CG1 3.68Å; C549-V598 HydrophobicContact CB-CG2 4.32Å
550	F	96.4	Very high	90.7	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.009	23%	0.23	C	C	.	.			trans	-131	73.3	176.1	-70	-80.2	0	0	0	111.1	V506 L508 P519 P546 Q547 D552 A553 W556 P596 V598	V506-F550 HydrophobicContact CB-CE2 4.26Å; V506-F550 HydrophobicContact CG1-CD2 3.77Å; V506-F550 HydrophobicContact CG1-CE2 3.87Å; L508-F550 HydrophobicContact CD1-CD1 3.93Å; L508-F550 HydrophobicContact CD1-CE1 3.74Å; L508-F550 HydrophobicContact CD1-CZ 4.2Å; L508-F550 HydrophobicContact CD2-CB 4.16Å; L508-F550 HydrophobicContact CD2-CD1 3.99Å; L508-F550 HydrophobicContact CD2-CD2 4.05Å; L508-F550 HydrophobicContact CD2-CE1 4.37Å; L508-F550 HydrophobicContact CD2-CE2 4.41Å; L508-F550 HydrophobicContact CD2-CG 3.81Å; L508-F550 HydrophobicContact CG-CD1 4.02Å; L508-F550 HydrophobicContact CG-CD2 4.26Å; L508-F550 HydrophobicContact CG-CE1 3.89Å; L508-F550 HydrophobicContact CG-CE2 4.12Å; L508-F550 HydrophobicContact CG-CG 4.19Å; L508-F550 HydrophobicContact CG-CZ 3.91Å; P519-F550 HydrophobicContact CB-CB 3.84Å; P519-F550 HydrophobicContact CB-CD2 3.67Å; P519-F550 HydrophobicContact CB-CG 4.13Å; P519-F550 HydrophobicContact CG-CB 4.19Å; P546-F550 PolarHBondContact O-N 2.84Å; P546-F550 VanDerWaalsContact O-N 3.1Å; Q547-F550 CarbonylContact O-C 3.47Å; F550-D552 PolarHBondContact O-N 3.13Å; F550-D552 VanDerWaalsContact O-N 3.15Å; F550-A553 HydrophobicContact CB-CB 3.86Å; F550-A553 WeakPolarHBondContact O-CB 3.47Å; F550-A553 PolarHBondContact O-N 2.89Å; F550-A553 VanDerWaalsContact O-N 3.14Å; F550-W556 AromaticContact CD1-NE1 3.89Å; F550-P596 HydrophobicContact CE1-CB 4.43Å; F550-P596 HydrophobicContact CE1-CG 3.77Å; F550-P596 HydrophobicContact CZ-CG 4.18Å; F550-V598 HydrophobicContact CD2-CG2 4.2Å; F550-V598 HydrophobicContact CE1-CG2 3.91Å; F550-V598 HydrophobicContact CE2-CB 4.02Å; F550-V598 HydrophobicContact CE2-CG2 3.59Å; F550-V598 HydrophobicContact CZ-CB 4.26Å; F550-V598 HydrophobicContact CZ-CG2 3.44Å; F550-V598 VanDerWaalsContact CZ-CG2 3.44Å
551	P	95.2	Very high	91.4	Very high	10 Å²	10	48 Å²	48	7%	0.065	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.2	177.1	30.3	-37.4	0	0	0	112.5	Q547 L709 V735 P737 A738 L755	Q547-P551 VanDerWaalsContact O-CA 3.31Å; Q547-P551 WeakPolarHBondContact O-CA 3.38Å; Q547-P551 VanDerWaalsContact O-N 3.15Å; P551-L709 HydrophobicContact CG-CD1 3.9Å; P551-L709 HydrophobicContact CG-CD2 3.73Å; P551-L709 HydrophobicContact CG-CG 4.45Å; P551-V735 HydrophobicContact CB-CG1 3.82Å; P551-V735 HydrophobicContact CG-CG1 3.62Å; P551-P737 HydrophobicContact CB-CB 4.34Å; P551-A738 WeakPolarHBondContact O-CB 3.37Å; P551-A738 PolarHBondContact O-N 2.72Å; P551-A738 VanDerWaalsContact O-N 3.09Å; P551-L755 HydrophobicContact CG-CD1 4.09Å
552	D	93.4	Very high	92.1	Very high	18 Å²	18	48.8 Å²	48.8	10%	0.096	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	15.3	-179.3	53.1	5.6	0	0	0	113.3	F550 K554 D555 W556 R585 L755	F550-D552 PolarHBondContact O-N 3.13Å; F550-D552 VanDerWaalsContact O-N 3.15Å; D552-K554 PolarHBondContact O-N 3.45Å; D552-D555 WeakPolarHBondContact O-CB 3.45Å; D552-D555 PolarHBondContact O-N 3.33Å; D552-W556 PolarHBondContact OD1-NE1 3Å; D552-W556 PolarHBondContact OD2-NE1 3.07Å; D552-R585 IonicContact OD1-NH1 2.68Å; D552-R585 PolarHBondContact OD1-NH1 3.49Å; D552-R585 IonicContact OD2-CZ 3.1Å; D552-R585 IonicContact OD2-NH1 3.67Å; D552-R585 PolarHBondContact OD2-NH1 2.93Å; D552-R585 IonicContact OD2-NH2 2.96Å; D552-L755 HydrophobicContact CB-CD1 3.73Å
553	A	91.6	Very high	92.6	Very high	11 Å²	11	54 Å²	54	9%	0.091	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-18.1	-173.3	0	0	0	0	0	116.8	L508 P519 F550	L508-A553 HydrophobicContact CD2-CB 4Å; P519-A553 HydrophobicContact CG-CB 4.09Å; F550-A553 HydrophobicContact CB-CB 3.86Å; F550-A553 WeakPolarHBondContact O-CB 3.47Å; F550-A553 PolarHBondContact O-N 2.89Å; F550-A553 VanDerWaalsContact O-N 3.14Å
554	K	87.4	Confident	93	Very high	137 Å²	137	49.5 Å²	49.5	60%	0.596	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-23.6	175.4	-66.6	177.1	-178.9	171.5	0	113.3	D552	D552-K554 PolarHBondContact O-N 3.45Å
555	D	88.2	Confident	93.2	Very high	83 Å²	83	49.6 Å²	49.6	44%	0.444	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-6.2	-170.5	-50.7	-16.4	0	0	0	111.2	D552 S757	D552-D555 WeakPolarHBondContact O-CB 3.45Å; D552-D555 PolarHBondContact O-N 3.33Å; D555-S757 WeakPolarHBondContact OD2-CB 3.16Å; D555-S757 PolarHBondContact OD2-OG 2.7Å
556	W	91.1	Very high	93.3	Very high	36 Å²	36	51.1 Å²	51.1	14%	0.136	28%	0.278	C	S	.	.			trans	-82.5	138.7	-177.8	-84.7	96.8	0	0	0	114.7	L508 Y517 F550 D552 V559 Y562 P596	L508-W556 HydrophobicContact CD1-CB 3.67Å; L508-W556 HydrophobicContact CD1-CD2 4.17Å; L508-W556 HydrophobicContact CD1-CG 3.62Å; Y517-W556 VanDerWaalsContact CD2-O 3.29Å; Y517-W556 WeakPolarHBondContact CD2-O 3.35Å; Y517-W556 WeakPolarHBondContact CE2-O 3.41Å; F550-W556 AromaticContact CD1-NE1 3.89Å; D552-W556 PolarHBondContact OD1-NE1 3Å; D552-W556 PolarHBondContact OD2-NE1 3.07Å; W556-V559 HydrophobicContact CZ3-CG2 4.31Å; W556-Y562 AromaticContact CH2-CD2 3.91Å; W556-Y562 HydrophobicContact CH2-CD2 3.91Å; W556-Y562 AromaticContact CH2-CE2 3.79Å; W556-Y562 HydrophobicContact CH2-CE2 3.79Å; W556-Y562 HydrophobicContact CZ2-CE2 4.43Å; W556-P596 HydrophobicContact CD2-CG 4.06Å; W556-P596 HydrophobicContact CE3-CG 3.78Å; W556-P596 HydrophobicContact CH2-CG 3.77Å; W556-P596 HydrophobicContact CZ2-CG 4.03Å; W556-P596 HydrophobicContact CZ3-CG 3.63Å
557	S	91.3	Very high	93.3	Very high	72 Å²	72	50.7 Å²	50.7	50%	0.503	28%	0.275	S	S	.	.			trans	-130.9	164.4	164.8	62.8	0	0	0	0	110.2	V559	S557-V559 PolarHBondContact O-N 3.29Å
558	P	92.9	Very high	93.3	Very high	55 Å²	55	48 Å²	48	36%	0.357	26%	0.263	S	S	.	.			trans	-65.3	131.8	176.4	-21.5	34.1	0	0	0	112.1	P593 R594 L595	P558-P593 HydrophobicContact CB-CB 3.81Å; P558-R594 CarbonylContact C-O 3.56Å; P558-R594 WeakPolarHBondContact CA-O 3.01Å; P558-L595 HydrophobicContact CB-CD2 4.46Å; P558-L595 HydrophobicContact CG-CD2 4.07Å; P558-L595 HydrophobicContact CG-CG 4.23Å
559	V	93.7	Very high	93.3	Very high	42 Å²	42	47.3 Å²	47.3	26%	0.255	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-122.9	147.2	-178.2	-66.2	0	0	0	0	111.2	W556 S557 L587 R594	W556-V559 HydrophobicContact CZ3-CG2 4.31Å; S557-V559 PolarHBondContact O-N 3.29Å; V559-L587 HydrophobicContact CG2-CD1 4.04Å; V559-R594 PolarHBondContact N-O 3Å; V559-R594 PolarHBondContact O-N 2.95Å; V559-R594 VanDerWaalsContact O-O 3.13Å
560	S	92.6	Very high	93.1	Very high	69 Å²	69	47.7 Å²	47.7	48%	0.483	26%	0.262	S	S	.	.	S	Bend	trans	-79.2	-30.7	177.9	-61.4	0	0	0	0	112.8	L587	S560-L587 VanDerWaalsContact O-CD2 3.31Å; S560-L587 WeakPolarHBondContact O-CD2 3.38Å
561	E	90.7	Very high	92.8	Very high	172 Å²	172	48.5 Å²	48.5	80%	0.804	27%	0.267	S	S	*	.			trans	-137.4	144.8	-176.4	-65.7	178.4	-167	0	0	109.6
562	Y	92.1	Very high	92.4	Very high	63 Å²	63	51.5 Å²	51.5	25%	0.247	28%	0.284	C	S	.	.			trans	-161.5	131.2	173.9	170.7	-99.6	0	0	0	109.2	W556 E565 R585	W556-Y562 AromaticContact CH2-CD2 3.91Å; W556-Y562 HydrophobicContact CH2-CD2 3.91Å; W556-Y562 AromaticContact CH2-CE2 3.79Å; W556-Y562 HydrophobicContact CH2-CE2 3.79Å; W556-Y562 HydrophobicContact CZ2-CE2 4.43Å; Y562-E565 VanDerWaalsContact OH-CB 3.31Å; Y562-E565 WeakPolarHBondContact OH-CB 3.4Å; Y562-E565 PolarHBondContact OH-OE2 2.67Å; Y562-R585 HydrophobicContact CE1-CB 4.36Å; Y562-R585 HydrophobicContact CE1-CG 3.89Å; Y562-R585 WeakPolarHBondContact CE1-O 3.16Å; Y562-R585 PolarHBondContact OH-NE 3.48Å
563	T	92.3	Very high	91.8	Very high	125 Å²	125	51.4 Å²	51.4	77%	0.767	29%	0.288	S	S	*	.			trans	-76.3	127.5	177.2	-50.2	0	0	0	0	110.3	E565	T563-E565 PolarHBondContact O-N 3.22Å
564	S	94.1	Very high	91	Very high	43 Å²	43	59.2 Å²	59.2	30%	0.301	32%	0.322	S	S	.	.			trans	-55.5	133.8	179.6	-154.6	0	0	0	0	112.3	R584 R585 L586 E619	S564-R584 VanDerWaalsContact OG-CD 3.23Å; S564-R584 WeakPolarHBondContact OG-CD 3.31Å; S564-R585 CarbonylContact C-O 3.59Å; S564-R585 WeakPolarHBondContact CA-O 3.26Å; S564-R585 PolarHBondContact OG-O 3.44Å; S564-L586 WeakPolarHBondContact OG-CB 3.48Å; S564-E619 WeakPolarHBondContact CB-OE1 3.17Å; S564-E619 PolarHBondContact OG-OE1 3.21Å; S564-E619 PolarHBondContact OG-OE2 2.99Å
565	E	95.2	Very high	90.1	Very high	21 Å²	21	56.3 Å²	56.3	10%	0.098	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.9	-174.5	-175.6	174.9	-157	0	0	111.8	Y562 T563 R584 R585 L709 S710	Y562-E565 VanDerWaalsContact OH-CB 3.31Å; Y562-E565 WeakPolarHBondContact OH-CB 3.4Å; Y562-E565 PolarHBondContact OH-OE2 2.67Å; T563-E565 PolarHBondContact O-N 3.22Å; E565-R584 WeakPolarHBondContact O-CA 3.42Å; E565-R585 HydrophobicContact CB-CB 4.5Å; E565-R585 PolarHBondContact N-O 3.21Å; E565-R585 PolarHBondContact O-N 3.11Å; E565-R585 IonicContact OE2-CZ 3.94Å; E565-R585 IonicContact OE2-NE 3.41Å; E565-R585 IonicContact OE2-NH2 3.73Å; E565-R585 PolarHBondContact OE2-NH2 2.93Å; E565-L709 PolarHBondContact OE1-N 3.48Å; E565-S710 WeakPolarHBondContact OE1-CB 3.42Å; E565-S710 PolarHBondContact OE1-N 3.29Å; E565-S710 PolarHBondContact OE1-OG 3.11Å
566	T	95.7	Very high	89.5	Confident	32 Å²	32	54.1 Å²	54.1	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	129.7	170.7	-48.1	0	0	0	0	110.6	C583 R584 F608 S710	T566-C583 CarbonylContact C-O 3.2Å; T566-C583 VanDerWaalsContact CA-O 3.27Å; T566-C583 WeakPolarHBondContact CA-O 3.37Å; T566-R584 VanDerWaalsContact OG1-CZ 3.3Å; T566-R584 PolarHBondContact OG1-NE 3.12Å; T566-R584 PolarHBondContact OG1-NH2 3.45Å; T566-R584 VanDerWaalsContact OG1-NH2 3.12Å; T566-F608 HydrophobicContact CG2-CE2 4.18Å; T566-F608 HydrophobicContact CG2-CZ 3.69Å; T566-S710 VanDerWaalsContact O-CA 3.29Å; T566-S710 WeakPolarHBondContact O-CA 3.27Å; T566-S710 WeakPolarHBondContact O-CB 3.34Å
567	F	96.3	Very high	88.9	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	169.2	172.1	69.2	-88.3	0	0	0	111.5	F569 C583 R585 L709 V735	F567-F569 HydrophobicContact CE2-CD1 4.36Å; F567-C583 HydrophobicContact CD1-CB 3.73Å; F567-C583 HydrophobicContact CD2-CB 4.01Å; F567-C583 HydrophobicContact CE1-CB 3.4Å; F567-C583 VanDerWaalsContact CE1-CB 3.4Å; F567-C583 HydrophobicContact CE2-CB 3.7Å; F567-C583 HydrophobicContact CG-CB 4.02Å; F567-C583 HydrophobicContact CZ-CB 3.39Å; F567-C583 PolarHBondContact N-O 3.22Å; F567-C583 PolarHBondContact O-N 3.38Å; F567-R585 HydrophobicContact CE1-CB 4.26Å; F567-L709 HydrophobicContact CB-CB 3.69Å; F567-L709 HydrophobicContact CD1-CB 3.85Å; F567-L709 HydrophobicContact CD1-CD1 3.89Å; F567-L709 HydrophobicContact CD2-CB 4.05Å; F567-L709 HydrophobicContact CD2-CD1 4.2Å; F567-L709 HydrophobicContact CE1-CB 4.46Å; F567-L709 HydrophobicContact CE1-CD1 3.63Å; F567-L709 HydrophobicContact CE2-CD1 3.97Å; F567-L709 HydrophobicContact CG-CB 3.61Å; F567-L709 HydrophobicContact CG-CD1 4.16Å; F567-L709 HydrophobicContact CG-CG 4.49Å; F567-L709 HydrophobicContact CZ-CD1 3.67Å; F567-V735 HydrophobicContact CD2-CG2 4.21Å
568	S	95.9	Very high	88.6	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.014	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	138.5	175.8	53.4	0	0	0	0	113	G581 S713 H717	S568-G581 WeakPolarHBondContact CA-O 3.37Å; S568-S713 PolarHBondContact N-OG 3.36Å; S568-S713 WeakPolarHBondContact O-CB 3.45Å; S568-H717 PolarHBondContact OG-CD2 2.98Å; S568-H717 PolarHBondContact OG-NE2 3.12Å
569	F	95.8	Very high	88.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	173.2	167.7	65.7	-102.7	0	0	0	111	I545 F548 F567 L571 F580 G581 C583 C600 I602 V735	I545-F569 HydrophobicContact CB-CZ 4.48Å; I545-F569 HydrophobicContact CG1-CE2 4.43Å; I545-F569 HydrophobicContact CG1-CZ 4.19Å; I545-F569 HydrophobicContact CG2-CZ 4.05Å; F548-F569 HydrophobicContact CB-CB 4.16Å; F548-F569 HydrophobicContact CB-CD1 3.58Å; F548-F569 HydrophobicContact CB-CD2 3.71Å; F548-F569 HydrophobicContact CB-CE1 3.72Å; F548-F569 HydrophobicContact CB-CE2 3.89Å; F548-F569 HydrophobicContact CB-CG 3.57Å; F548-F569 HydrophobicContact CB-CZ 3.89Å; F548-F569 HydrophobicContact CD1-CB 4.03Å; F548-F569 HydrophobicContact CD1-CD2 4.17Å; F548-F569 HydrophobicContact CD1-CG 4.18Å; F548-F569 HydrophobicContact CG-CB 4.47Å; F548-F569 AromaticContact CG-CD2 3.96Å; F548-F569 HydrophobicContact CG-CD2 3.96Å; F548-F569 HydrophobicContact CG-CE2 4.32Å; F548-F569 HydrophobicContact CG-CG 4.14Å; F567-F569 HydrophobicContact CE2-CD1 4.36Å; F569-L571 HydrophobicContact CD2-CD2 4.08Å; F569-L571 HydrophobicContact CD2-CG 4.14Å; F569-L571 HydrophobicContact CE2-CD1 4.13Å; F569-L571 HydrophobicContact CE2-CD2 3.88Å; F569-L571 HydrophobicContact CE2-CG 3.78Å; F569-F580 WeakPolarHBondContact O-CA 3.35Å; F569-G581 WeakPolarHBondContact CD1-O 3.32Å; F569-G581 PolarHBondContact N-O 3.45Å; F569-G581 PolarHBondContact O-N 3.18Å; F569-C583 WeakPolarHBondContact CE1-SG 3.48Å; F569-C600 VanDerWaalsContact CE1-SG 3.58Å; F569-I602 HydrophobicContact CE2-CD1 4.13Å; F569-I602 HydrophobicContact CZ-CD1 3.81Å; F569-V735 HydrophobicContact CB-CB 4.26Å
570	M	93.1	Very high	88.4	Confident	8 Å²	8	49 Å²	49	4%	0.039	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	132	175.6	-175.4	164.5	-77.5	0	0	111.5	R578 R579 F580 F732 P734	M570-R578 HydrophobicContact CE-CB 4.22Å; M570-R578 HydrophobicContact CG-CB 4.28Å; M570-R578 HydrophobicContact CG-CG 4.31Å; M570-R578 HydrophobicContact SD-CB 3.77Å; M570-R578 WeakPolarHBondContact SD-CD 3.37Å; M570-R578 HydrophobicContact SD-CG 3.63Å; M570-R579 CarbonylContact C-O 3.53Å; M570-R579 WeakPolarHBondContact CA-O 3.16Å; M570-F580 HydrophobicContact CE-CD1 3.42Å; M570-F580 VanDerWaalsContact CE-CD1 3.42Å; M570-F580 HydrophobicContact CE-CD2 4.41Å; M570-F580 HydrophobicContact CE-CE1 3.07Å; M570-F580 HydrophobicContact CE-CE2 4.13Å; M570-F580 HydrophobicContact CE-CG 4.08Å; M570-F580 HydrophobicContact CE-CZ 3.46Å; M570-F580 VanDerWaalsContact CE-CZ 3.46Å; M570-F732 HydrophobicContact CE-CD1 4.36Å; M570-F732 HydrophobicContact CE-CE1 4.24Å; M570-F732 HydrophobicContact SD-CD1 3.56Å; M570-F732 VanDerWaalsContact SD-CD1 3.56Å; M570-F732 HydrophobicContact SD-CE1 4.01Å; M570-P734 HydrophobicContact CB-CG 4.04Å
571	L	90.6	Very high	88.5	Confident	20 Å²	20	45.7 Å²	45.7	11%	0.105	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	134.6	167.9	-54.4	177.6	0	0	0	108.7	I545 F548 F569 R578 R579	I545-L571 HydrophobicContact CD1-CD1 4.32Å; I545-L571 HydrophobicContact CG1-CD1 3.83Å; F548-L571 HydrophobicContact CD2-CD2 3.75Å; F548-L571 HydrophobicContact CE2-CD2 3.68Å; F548-L571 HydrophobicContact CG-CD2 4.31Å; F548-L571 HydrophobicContact CZ-CD2 4.17Å; F569-L571 HydrophobicContact CD2-CD2 4.08Å; F569-L571 HydrophobicContact CD2-CG 4.14Å; F569-L571 HydrophobicContact CE2-CD1 4.13Å; F569-L571 HydrophobicContact CE2-CD2 3.88Å; F569-L571 HydrophobicContact CE2-CG 3.78Å; L571-R578 WeakPolarHBondContact O-CA 3.49Å; L571-R579 HydrophobicContact CB-CB 4.48Å; L571-R579 PolarHBondContact N-O 3.17Å; L571-R579 PolarHBondContact O-N 3.43Å
572	T	87.1	Confident	88.8	Confident	72 Å²	72	37.6 Å²	37.6	44%	0.442	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.3	171.8	-56.5	0	0	0	0	108.6	S577 R578	T572-S577 CarbonylContact C-O 3.57Å; T572-S577 WeakPolarHBondContact CA-O 3.17Å; T572-R578 HydrophobicContact CG2-CG 4.48Å
573	G	79.3	Confident	89.1	Confident	16 Å²	16	34.6 Å²	34.6	17%	0.165	20%	0.198	C	C	.	.			trans	-78.9	167.9	175.5	0	0	0	0	0	113	D575 G576 S577	G573-D575 PolarHBondContact O-N 3.05Å; G573-G576 PolarHBondContact O-N 2.82Å; G573-S577 PolarHBondContact N-O 2.95Å
574	E	74.8	Confident	89.4	Confident	175 Å²	175	29.1 Å²	29.1	82%	0.818	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.4	176.1	-59.3	-177.9	173.8	0	0	113.1	G576	E574-G576 VanDerWaalsContact C-N 3.31Å
575	D	70.4	Confident	89.5	Confident	77 Å²	77	27.6 Å²	27.6	41%	0.412	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	0	175.3	71.2	-32.9	0	0	0	113.8	G573 S577	G573-D575 PolarHBondContact O-N 3.05Å; D575-S577 VanDerWaalsContact C-N 3.31Å; D575-S577 VanDerWaalsContact CG-OG 3.29Å; D575-S577 VanDerWaalsContact OD1-CB 3.22Å; D575-S577 WeakPolarHBondContact OD1-CB 3.19Å; D575-S577 PolarHBondContact OD1-N 3.47Å; D575-S577 PolarHBondContact OD1-OG 2.94Å; D575-S577 VanDerWaalsContact OD2-CB 3.29Å; D575-S577 WeakPolarHBondContact OD2-CB 3.47Å; D575-S577 PolarHBondContact OD2-OG 2.9Å
576	G	75.3	Confident	89.5	Confident	37 Å²	37	27 Å²	27	38%	0.381	15%	0.149	S	C	.	.			trans	81.7	-0.2	-172.4	0	0	0	0	0	114.7	G573 E574 R578	G573-G576 PolarHBondContact O-N 2.82Å; E574-G576 VanDerWaalsContact C-N 3.31Å; G576-R578 PolarHBondContact O-N 3.4Å
577	S	78.6	Confident	89.4	Confident	12 Å²	12	26.8 Å²	26.8	8%	0.084	15%	0.146	C	C	.	.			trans	-65.4	131.8	179.2	63.7	0	0	0	0	111.4	T572 G573 D575 R579	T572-S577 CarbonylContact C-O 3.57Å; T572-S577 WeakPolarHBondContact CA-O 3.17Å; G573-S577 PolarHBondContact N-O 2.95Å; D575-S577 VanDerWaalsContact C-N 3.31Å; D575-S577 VanDerWaalsContact CG-OG 3.29Å; D575-S577 VanDerWaalsContact OD1-CB 3.22Å; D575-S577 WeakPolarHBondContact OD1-CB 3.19Å; D575-S577 PolarHBondContact OD1-N 3.47Å; D575-S577 PolarHBondContact OD1-OG 2.94Å; D575-S577 VanDerWaalsContact OD2-CB 3.29Å; D575-S577 WeakPolarHBondContact OD2-CB 3.47Å; D575-S577 PolarHBondContact OD2-OG 2.9Å; S577-R579 PolarHBondContact OG-NH1 3.35Å
578	R	85.2	Confident	89.1	Confident	38 Å²	38	27.4 Å²	27.4	14%	0.143	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	136.6	-178.6	-74.8	171.9	176.7	159.6	4.6	111.1	L487 M570 L571 T572 G576 W728 H730	L487-R578 VanDerWaalsContact CD1-NH1 3.28Å; L487-R578 HydrophobicContact CD2-CB 4.4Å; L487-R578 HydrophobicContact CD2-CG 4.48Å; M570-R578 HydrophobicContact CE-CB 4.22Å; M570-R578 HydrophobicContact CG-CB 4.28Å; M570-R578 HydrophobicContact CG-CG 4.31Å; M570-R578 HydrophobicContact SD-CB 3.77Å; M570-R578 WeakPolarHBondContact SD-CD 3.37Å; M570-R578 HydrophobicContact SD-CG 3.63Å; L571-R578 WeakPolarHBondContact O-CA 3.49Å; T572-R578 HydrophobicContact CG2-CG 4.48Å; G576-R578 PolarHBondContact O-N 3.4Å; R578-W728 VanDerWaalsContact CZ-O 3.3Å; R578-W728 PolarHBondContact NH1-O 3.39Å; R578-W728 PolarHBondContact NH2-O 3.08Å; R578-H730 PolarHBondContact NH2-O 2.66Å
579	R	88.5	Confident	88.7	Confident	16 Å²	16	32 Å²	32	6%	0.06	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.5	173.5	-70.4	163.4	176.4	71.9	9.4	108.9	E501 M570 L571 S577 I602 S603 R604	E501-R579 IonicContact OE1-CZ 3.1Å; E501-R579 IonicContact OE1-NE 2.75Å; E501-R579 PolarHBondContact OE1-NE 3.31Å; E501-R579 IonicContact OE1-NH2 3.81Å; E501-R579 PolarHBondContact OE1-NH2 3.43Å; E501-R579 WeakPolarHBondContact OE2-CD 3.46Å; E501-R579 IonicContact OE2-CZ 3.92Å; E501-R579 IonicContact OE2-NE 2.68Å; E501-R579 PolarHBondContact OE2-NE 2.72Å; E501-R579 IonicContact OE2-NH2 3.85Å; M570-R579 CarbonylContact C-O 3.53Å; M570-R579 WeakPolarHBondContact CA-O 3.16Å; L571-R579 HydrophobicContact CB-CB 4.48Å; L571-R579 PolarHBondContact N-O 3.17Å; L571-R579 PolarHBondContact O-N 3.43Å; S577-R579 PolarHBondContact OG-NH1 3.35Å; R579-I602 HydrophobicContact CB-CG2 4.23Å; R579-S603 WeakPolarHBondContact CA-O 3.32Å; R579-R604 HydrophobicContact CG-CG 4.08Å
580	F	92.6	Very high	88.1	Confident	30 Å²	30	34.4 Å²	34.4	13%	0.132	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	143.6	173.6	-57.3	-92.9	0	0	0	109.5	F569 M570 Y582 I602 S603 H674 H717	F569-F580 WeakPolarHBondContact O-CA 3.35Å; M570-F580 HydrophobicContact CE-CD1 3.42Å; M570-F580 VanDerWaalsContact CE-CD1 3.42Å; M570-F580 HydrophobicContact CE-CD2 4.41Å; M570-F580 HydrophobicContact CE-CE1 3.07Å; M570-F580 HydrophobicContact CE-CE2 4.13Å; M570-F580 HydrophobicContact CE-CG 4.08Å; M570-F580 HydrophobicContact CE-CZ 3.46Å; M570-F580 VanDerWaalsContact CE-CZ 3.46Å; F580-Y582 HydrophobicContact CB-CE1 3.69Å; F580-Y582 HydrophobicContact CB-CE2 3.82Å; F580-Y582 WeakPolarHBondContact CB-OH 3.39Å; F580-Y582 WeakPolarHBondContact CD2-OH 3.35Å; F580-Y582 HydrophobicContact CG-CE1 4.28Å; F580-Y582 AromaticContact CG-CZ 3.91Å; F580-Y582 VanDerWaalsContact CG-OH 3.26Å; F580-Y582 WeakPolarHBondContact CG-OH 3.05Å; F580-I602 WeakPolarHBondContact O-CA 3.33Å; F580-S603 PolarHBondContact N-O 2.87Å; F580-S603 PolarHBondContact O-N 2.92Å; F580-H674 AromaticContact CD1-CD2 3.59Å; F580-H674 AromaticContact CE1-CD2 3.14Å; F580-H674 WeakPolarHBondContact CE1-CD2 3.45Å; F580-H674 AromaticContact CE2-CD2 3.9Å; F580-H674 AromaticContact CZ-CD2 3.34Å; F580-H674 WeakPolarHBondContact CZ-CD2 3.3Å; F580-H717 AromaticContact CD1-CE1 3.93Å; F580-H717 AromaticContact CE1-CE1 3.85Å
581	G	95.8	Very high	87.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	103	169.1	0	0	0	0	0	110.5	S568 F569 V601	S568-G581 WeakPolarHBondContact CA-O 3.37Å; F569-G581 WeakPolarHBondContact CD1-O 3.32Å; F569-G581 PolarHBondContact N-O 3.45Å; F569-G581 PolarHBondContact O-N 3.18Å; G581-V601 CarbonylContact C-O 3.54Å; G581-V601 WeakPolarHBondContact CA-O 3.41Å
582	Y	97	Very high	87.7	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.9	178.5	-44.6	-74.3	0	0	0	109.2	F580 C600 V601 L605 F608 F611 H674	F580-Y582 HydrophobicContact CB-CE1 3.69Å; F580-Y582 HydrophobicContact CB-CE2 3.82Å; F580-Y582 WeakPolarHBondContact CB-OH 3.39Å; F580-Y582 WeakPolarHBondContact CD2-OH 3.35Å; F580-Y582 HydrophobicContact CG-CE1 4.28Å; F580-Y582 AromaticContact CG-CZ 3.91Å; F580-Y582 VanDerWaalsContact CG-OH 3.26Å; F580-Y582 WeakPolarHBondContact CG-OH 3.05Å; Y582-C600 CarbonylContact O-C 3.58Å; Y582-C600 WeakPolarHBondContact O-CA 3.17Å; Y582-V601 HydrophobicContact CD2-CB 4.16Å; Y582-V601 HydrophobicContact CD2-CG1 4.35Å; Y582-V601 VanDerWaalsContact CD2-O 3.31Å; Y582-V601 WeakPolarHBondContact CD2-O 3.34Å; Y582-V601 PolarHBondContact N-O 3.25Å; Y582-V601 PolarHBondContact O-N 2.93Å; Y582-L605 PolarHBondContact OH-O 2.89Å; Y582-F608 HydrophobicContact CD1-CD2 4.35Å; Y582-F611 HydrophobicContact CD1-CB 4.17Å; Y582-F611 HydrophobicContact CD1-CD2 4.38Å; Y582-F611 HydrophobicContact CD2-CB 3.6Å; Y582-F611 HydrophobicContact CD2-CD1 4.03Å; Y582-F611 AromaticContact CD2-CD2 3.45Å; Y582-F611 HydrophobicContact CD2-CD2 3.45Å; Y582-F611 VanDerWaalsContact CD2-CD2 3.45Å; Y582-F611 HydrophobicContact CD2-CE2 4.13Å; Y582-F611 AromaticContact CD2-CG 3.41Å; Y582-F611 HydrophobicContact CD2-CG 3.41Å; Y582-F611 VanDerWaalsContact CD2-CG 3.41Å; Y582-F611 HydrophobicContact CE1-CD2 4.06Å; Y582-F611 HydrophobicContact CE2-CB 4.11Å; Y582-F611 HydrophobicContact CE2-CD1 4.22Å; Y582-F611 AromaticContact CE2-CD2 3.02Å; Y582-F611 HydrophobicContact CE2-CD2 3.02Å; Y582-F611 HydrophobicContact CE2-CE1 4.49Å; Y582-F611 AromaticContact CE2-CE2 3.37Å; Y582-F611 HydrophobicContact CE2-CE2 3.37Å; Y582-F611 AromaticContact CE2-CG 3.53Å; Y582-F611 HydrophobicContact CE2-CG 3.53Å; Y582-F611 HydrophobicContact CE2-CZ 4.12Å; Y582-F611 HydrophobicContact CG-CB 3.62Å; Y582-F611 HydrophobicContact CG-CD2 4.09Å; Y582-F611 AromaticContact CG-CG 3.97Å; Y582-F611 HydrophobicContact CG-CG 3.97Å; Y582-F611 AromaticContact CZ-CD2 3.35Å; Y582-F611 AromaticContact CZ-CE2 3.77Å; Y582-H674 AromaticContact CD1-NE2 3.71Å; Y582-H674 AromaticContact CE1-NE2 2.6Å; Y582-H674 WeakPolarHBondContact CE1-NE2 3.25Å; Y582-H674 AromaticContact CE2-NE2 3.94Å; Y582-H674 AromaticContact CZ-NE2 2.75Å; Y582-H674 PolarHBondContact OH-NE2 2.87Å
583	C	97.6	Very high	88	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.6	-175.1	-66.8	0	0	0	0	110.8	T566 F567 F569 V598 Y599 C600	T566-C583 CarbonylContact C-O 3.2Å; T566-C583 VanDerWaalsContact CA-O 3.27Å; T566-C583 WeakPolarHBondContact CA-O 3.37Å; F567-C583 HydrophobicContact CD1-CB 3.73Å; F567-C583 HydrophobicContact CD2-CB 4.01Å; F567-C583 HydrophobicContact CE1-CB 3.4Å; F567-C583 VanDerWaalsContact CE1-CB 3.4Å; F567-C583 HydrophobicContact CE2-CB 3.7Å; F567-C583 HydrophobicContact CG-CB 4.02Å; F567-C583 HydrophobicContact CZ-CB 3.39Å; F567-C583 PolarHBondContact N-O 3.22Å; F567-C583 PolarHBondContact O-N 3.38Å; F569-C583 WeakPolarHBondContact CE1-SG 3.48Å; C583-V598 HydrophobicContact CB-CG1 3.74Å; C583-Y599 CarbonylContact C-O 3.58Å; C583-Y599 VanDerWaalsContact CA-O 3.31Å; C583-Y599 WeakPolarHBondContact CA-O 3.37Å; C583-C600 VanDerWaalsContact SG-SG 3.62Å
584	R	97.6	Very high	88.6	Confident	10 Å²	10	47.5 Å²	47.5	4%	0.038	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	108.4	158.3	-176	64.5	60.4	90.7	-4.6	108.1	S564 E565 T566 L586 V598 Y599 S612 L615 D616 E619	S564-R584 VanDerWaalsContact OG-CD 3.23Å; S564-R584 WeakPolarHBondContact OG-CD 3.31Å; E565-R584 WeakPolarHBondContact O-CA 3.42Å; T566-R584 VanDerWaalsContact OG1-CZ 3.3Å; T566-R584 PolarHBondContact OG1-NE 3.12Å; T566-R584 PolarHBondContact OG1-NH2 3.45Å; T566-R584 VanDerWaalsContact OG1-NH2 3.12Å; R584-L586 HydrophobicContact CG-CD2 4.27Å; R584-V598 WeakPolarHBondContact O-CA 3.4Å; R584-Y599 PolarHBondContact N-O 3.12Å; R584-Y599 PolarHBondContact O-N 3.25Å; R584-S612 PolarHBondContact NH2-OG 3.3Å; R584-L615 HydrophobicContact CB-CB 4.01Å; R584-L615 HydrophobicContact CB-CD1 4.2Å; R584-L615 HydrophobicContact CB-CD2 3.98Å; R584-L615 HydrophobicContact CB-CG 4.29Å; R584-D616 IonicContact CZ-OD1 3.48Å; R584-D616 IonicContact NH1-OD1 2.67Å; R584-D616 PolarHBondContact NH1-OD1 3.02Å; R584-D616 IonicContact NH2-OD1 3.3Å; R584-D616 PolarHBondContact NH2-OD1 2.84Å; R584-D616 IonicContact NH2-OD2 3.57Å; R584-D616 PolarHBondContact NH2-OD2 2.85Å; R584-E619 VanDerWaalsContact CD-OE2 3.31Å; R584-E619 WeakPolarHBondContact CD-OE2 3.47Å; R584-E619 WeakPolarHBondContact CG-OE2 3.49Å; R584-E619 IonicContact CZ-OE2 3.34Å; R584-E619 IonicContact NE-OE2 2.72Å; R584-E619 IonicContact NH1-OE2 3.89Å; R584-E619 PolarHBondContact NH1-OE2 3.46Å
585	R	97	Very high	89.6	Confident	11 Å²	11	40.9 Å²	40.9	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	120.6	173.3	-172.9	158.4	61.6	171.8	4.7	108	D552 Y562 S564 E565 F567 P596 E597 V598	D552-R585 IonicContact OD1-NH1 2.68Å; D552-R585 PolarHBondContact OD1-NH1 3.49Å; D552-R585 IonicContact OD2-CZ 3.1Å; D552-R585 IonicContact OD2-NH1 3.67Å; D552-R585 PolarHBondContact OD2-NH1 2.93Å; D552-R585 IonicContact OD2-NH2 2.96Å; Y562-R585 HydrophobicContact CE1-CB 4.36Å; Y562-R585 HydrophobicContact CE1-CG 3.89Å; Y562-R585 WeakPolarHBondContact CE1-O 3.16Å; Y562-R585 PolarHBondContact OH-NE 3.48Å; S564-R585 CarbonylContact C-O 3.59Å; S564-R585 WeakPolarHBondContact CA-O 3.26Å; S564-R585 PolarHBondContact OG-O 3.44Å; E565-R585 HydrophobicContact CB-CB 4.5Å; E565-R585 PolarHBondContact N-O 3.21Å; E565-R585 PolarHBondContact O-N 3.11Å; E565-R585 IonicContact OE2-CZ 3.94Å; E565-R585 IonicContact OE2-NE 3.41Å; E565-R585 IonicContact OE2-NH2 3.73Å; E565-R585 PolarHBondContact OE2-NH2 2.93Å; F567-R585 HydrophobicContact CE1-CB 4.26Å; R585-P596 HydrophobicContact CG-CB 4.13Å; R585-E597 WeakPolarHBondContact CA-O 3.33Å; R585-V598 HydrophobicContact CB-CG2 3.77Å; R585-V598 HydrophobicContact CG-CG2 3.67Å
586	L	94.8	Very high	90.8	Very high	9 Å²	9	37.3 Å²	37.3	5%	0.047	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	159.7	-177	66	77.7	0	0	0	111.6	S564 R584 P596 E597 Y599 E619	S564-L586 WeakPolarHBondContact OG-CB 3.48Å; R584-L586 HydrophobicContact CG-CD2 4.27Å; L586-P596 CarbonylContact O-C 3.59Å; L586-P596 VanDerWaalsContact O-CA 3.24Å; L586-P596 WeakPolarHBondContact O-CA 3.37Å; L586-P596 WeakPolarHBondContact O-CB 3.45Å; L586-E597 PolarHBondContact N-O 3.21Å; L586-E597 PolarHBondContact O-N 2.87Å; L586-Y599 HydrophobicContact CD1-CD2 4.44Å; L586-Y599 HydrophobicContact CD1-CE2 3.83Å; L586-Y599 HydrophobicContact CD2-CD2 3.8Å; L586-Y599 HydrophobicContact CD2-CE2 3.81Å; L586-Y599 HydrophobicContact CG-CD2 3.91Å; L586-Y599 HydrophobicContact CG-CE2 3.82Å; L586-E619 HydrophobicContact CD2-CB 3.95Å; L586-E619 HydrophobicContact CD2-CG 3.77Å
587	L	93.7	Very high	91.8	Very high	27 Å²	27	36.9 Å²	36.9	14%	0.141	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-89.9	123.7	173.4	-164	65.2	0	0	0	109.7	V559 S560 R594	V559-L587 HydrophobicContact CG2-CD1 4.04Å; S560-L587 VanDerWaalsContact O-CD2 3.31Å; S560-L587 WeakPolarHBondContact O-CD2 3.38Å; L587-R594 HydrophobicContact CD1-CB 3.97Å; L587-R594 HydrophobicContact CG-CB 4.46Å
588	P	90.4	Very high	92.7	Very high	14 Å²	14	36.3 Å²	36.3	9%	0.091	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-55.8	150	176.2	-28.7	37.6	0	0	0	112.5	R594 L595 E597	P588-R594 PolarHBondContact O-NE 3.33Å; P588-R594 PolarHBondContact O-NH2 3.47Å; P588-L595 WeakPolarHBondContact CD-O 3.3Å; P588-E597 HydrophobicContact CG-CB 4.18Å; P588-E597 HydrophobicContact CG-CG 3.62Å
589	T	86.8	Confident	93.3	Very high	97 Å²	97	34.6 Å²	34.6	60%	0.595	20%	0.197	S	C	*	.	S	Bend	trans	-61.3	141	172.8	43	0	0	0	0	111.4
590	G	84.6	Confident	93.7	Very high	52 Å²	52	33.9 Å²	33.9	54%	0.536	19%	0.194	S	C	.	.	S	Bend	trans	158	-171.3	-176.6	0	0	0	0	0	113.1
591	K	84.5	Confident	93.9	Very high	205 Å²	205	32.4 Å²	32.4	89%	0.891	19%	0.188	S	C	*	.	S	Bend	trans	-118.3	156.2	174	-65.2	-176.1	179	-178.5	0	110.3
592	G	90.1	Very high	93.8	Very high	41 Å²	41	32.5 Å²	32.5	42%	0.423	19%	0.188	S	C	.	.	S	Bend	trans	70.2	-175.9	178	0	0	0	0	0	114.7	R594	G592-R594 PolarHBondContact O-NH1 3.36Å
593	P	92.8	Very high	93.5	Very high	90 Å²	90	32.6 Å²	32.6	58%	0.584	19%	0.189	S	C	*	.	S	Bend	trans	-66.1	131.2	-179.5	-21.6	34.2	0	0	0	112.7	P558	P558-P593 HydrophobicContact CB-CB 3.81Å
594	R	93.6	Very high	92.9	Very high	54 Å²	54	35.9 Å²	35.9	20%	0.204	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-136.5	161.5	-177.5	-60.8	-178	-51.7	-69	6.7	110.2	P558 V559 L587 P588 G592	P558-R594 CarbonylContact C-O 3.56Å; P558-R594 WeakPolarHBondContact CA-O 3.01Å; V559-R594 PolarHBondContact N-O 3Å; V559-R594 PolarHBondContact O-N 2.95Å; V559-R594 VanDerWaalsContact O-O 3.13Å; L587-R594 HydrophobicContact CD1-CB 3.97Å; L587-R594 HydrophobicContact CG-CB 4.46Å; P588-R594 PolarHBondContact O-NE 3.33Å; P588-R594 PolarHBondContact O-NH2 3.47Å; G592-R594 PolarHBondContact O-NH1 3.36Å
595	L	94.6	Very high	92.2	Very high	37 Å²	37	36 Å²	36	19%	0.194	20%	0.203	C	C	.	.			trans	-94.4	145.9	172	-66.7	162.2	0	0	0	109.4	L508 Y517 P558 P588	L508-L595 HydrophobicContact CB-CB 4.31Å; L508-L595 HydrophobicContact CB-CD1 4.07Å; L508-L595 HydrophobicContact CD1-CD2 4.25Å; L508-L595 WeakPolarHBondContact O-CD1 3.35Å; Y517-L595 HydrophobicContact CD1-CD1 3.68Å; Y517-L595 HydrophobicContact CE1-CD1 3.37Å; Y517-L595 HydrophobicContact CE1-CD2 4.31Å; Y517-L595 HydrophobicContact CE1-CG 4.45Å; Y517-L595 HydrophobicContact CE2-CD2 4.25Å; Y517-L595 HydrophobicContact CG-CD1 4.49Å; P558-L595 HydrophobicContact CB-CD2 4.46Å; P558-L595 HydrophobicContact CG-CD2 4.07Å; P558-L595 HydrophobicContact CG-CG 4.23Å; P588-L595 WeakPolarHBondContact CD-O 3.3Å
596	P	95.6	Very high	91.5	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	21%	0.209	C	C	.	.			trans	-65.2	155.7	173.6	30	-38.8	0	0	0	112.6	L508 F550 W556 R585 L586	L508-P596 HydrophobicContact CD1-CG 4.32Å; F550-P596 HydrophobicContact CE1-CB 4.43Å; F550-P596 HydrophobicContact CE1-CG 3.77Å; F550-P596 HydrophobicContact CZ-CG 4.18Å; W556-P596 HydrophobicContact CD2-CG 4.06Å; W556-P596 HydrophobicContact CE3-CG 3.78Å; W556-P596 HydrophobicContact CH2-CG 3.77Å; W556-P596 HydrophobicContact CZ2-CG 4.03Å; W556-P596 HydrophobicContact CZ3-CG 3.63Å; R585-P596 HydrophobicContact CG-CB 4.13Å; L586-P596 CarbonylContact O-C 3.59Å; L586-P596 VanDerWaalsContact O-CA 3.24Å; L586-P596 WeakPolarHBondContact O-CA 3.37Å; L586-P596 WeakPolarHBondContact O-CB 3.45Å
597	E	96.3	Very high	91.1	Very high	28 Å²	28	35.9 Å²	35.9	13%	0.131	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	152.5	163.2	-74.8	174.4	-163.9	0	0	109	V505 V506 R585 L586 P588 Y599 R622	V505-E597 HydrophobicContact CG1-CB 4.14Å; V505-E597 HydrophobicContact CG1-CG 4.34Å; V506-E597 WeakPolarHBondContact O-CA 3.41Å; R585-E597 WeakPolarHBondContact CA-O 3.33Å; L586-E597 PolarHBondContact N-O 3.21Å; L586-E597 PolarHBondContact O-N 2.87Å; P588-E597 HydrophobicContact CG-CB 4.18Å; P588-E597 HydrophobicContact CG-CG 3.62Å; E597-Y599 HydrophobicContact CB-CE2 4.01Å; E597-Y599 PolarHBondContact OE2-OH 3.3Å; E597-R622 IonicContact OE1-CZ 3.89Å; E597-R622 IonicContact OE1-NH1 3.14Å; E597-R622 PolarHBondContact OE1-NH1 3.44Å; E597-R622 IonicContact OE1-NH2 2.67Å; E597-R622 PolarHBondContact OE1-NH2 3.31Å; E597-R622 IonicContact OE2-CZ 2.7Å; E597-R622 VanDerWaalsContact OE2-CZ 3.22Å; E597-R622 IonicContact OE2-NH1 2.66Å; E597-R622 PolarHBondContact OE2-NH1 3.39Å; E597-R622 IonicContact OE2-NH2 3.73Å; E597-R622 PolarHBondContact OE2-NH2 2.96Å
598	V	97.9	Very high	90.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123.2	171.8	173.7	0	0	0	0	109.8	V505 V506 C549 F550 C583 R584 R585	V505-V598 CarbonylContact C-O 3.57Å; V505-V598 WeakPolarHBondContact CA-O 3.46Å; V506-V598 HydrophobicContact CB-CB 4.48Å; V506-V598 PolarHBondContact N-O 2.94Å; V506-V598 PolarHBondContact O-N 2.87Å; C549-V598 HydrophobicContact CB-CB 3.93Å; C549-V598 HydrophobicContact CB-CG1 3.68Å; C549-V598 HydrophobicContact CB-CG2 4.32Å; F550-V598 HydrophobicContact CD2-CG2 4.2Å; F550-V598 HydrophobicContact CE1-CG2 3.91Å; F550-V598 HydrophobicContact CE2-CB 4.02Å; F550-V598 HydrophobicContact CE2-CG2 3.59Å; F550-V598 HydrophobicContact CZ-CB 4.26Å; F550-V598 HydrophobicContact CZ-CG2 3.44Å; F550-V598 VanDerWaalsContact CZ-CG2 3.44Å; C583-V598 HydrophobicContact CB-CG1 3.74Å; R584-V598 WeakPolarHBondContact O-CA 3.4Å; R585-V598 HydrophobicContact CB-CG2 3.77Å; R585-V598 HydrophobicContact CG-CG2 3.67Å
599	Y	97.4	Very high	90.3	Very high	3 Å²	3	41.2 Å²	41.2	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114.6	174.4	-70.3	-94	0	0	0	108.6	F503 V505 C583 R584 L586 E597 V618 R622	F503-Y599 HydrophobicContact CE2-CD1 4.23Å; F503-Y599 AromaticContact CZ-CD1 3.77Å; F503-Y599 HydrophobicContact CZ-CD1 3.77Å; F503-Y599 HydrophobicContact CZ-CE1 4.47Å; V505-Y599 HydrophobicContact CB-CE1 4.5Å; V505-Y599 HydrophobicContact CG1-CD1 4.46Å; V505-Y599 HydrophobicContact CG1-CE1 4.17Å; V505-Y599 HydrophobicContact CG1-CE2 4.35Å; V505-Y599 HydrophobicContact CG2-CD1 3.62Å; V505-Y599 HydrophobicContact CG2-CE1 3.48Å; V505-Y599 VanDerWaalsContact CG2-CE1 3.48Å; V505-Y599 HydrophobicContact CG2-CG 4.49Å; C583-Y599 CarbonylContact C-O 3.58Å; C583-Y599 VanDerWaalsContact CA-O 3.31Å; C583-Y599 WeakPolarHBondContact CA-O 3.37Å; R584-Y599 PolarHBondContact N-O 3.12Å; R584-Y599 PolarHBondContact O-N 3.25Å; L586-Y599 HydrophobicContact CD1-CD2 4.44Å; L586-Y599 HydrophobicContact CD1-CE2 3.83Å; L586-Y599 HydrophobicContact CD2-CD2 3.8Å; L586-Y599 HydrophobicContact CD2-CE2 3.81Å; L586-Y599 HydrophobicContact CG-CD2 3.91Å; L586-Y599 HydrophobicContact CG-CE2 3.82Å; E597-Y599 HydrophobicContact CB-CE2 4.01Å; E597-Y599 PolarHBondContact OE2-OH 3.3Å; Y599-V618 HydrophobicContact CD1-CG1 3.34Å; Y599-V618 HydrophobicContact CE1-CG1 3.8Å; Y599-V618 HydrophobicContact CG-CG1 3.87Å; Y599-R622 WeakPolarHBondContact OH-CD 3.4Å; Y599-R622 VanDerWaalsContact OH-CG 3.22Å; Y599-R622 WeakPolarHBondContact OH-CG 3.26Å; Y599-R622 PolarHBondContact OH-NE 2.93Å; Y599-R622 PolarHBondContact OH-NH1 3.44Å
600	C	97.4	Very high	90.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.9	-172.1	-171.6	0	0	0	0	112.3	F503 V504 F569 Y582 C583 I602	F503-C600 CarbonylContact C-O 3.54Å; F503-C600 VanDerWaalsContact CA-O 3.3Å; F503-C600 WeakPolarHBondContact CA-O 3.41Å; V504-C600 HydrophobicContact CG2-CB 3.83Å; V504-C600 PolarHBondContact N-O 3.35Å; V504-C600 PolarHBondContact O-N 3.38Å; F569-C600 VanDerWaalsContact CE1-SG 3.58Å; Y582-C600 CarbonylContact O-C 3.58Å; Y582-C600 WeakPolarHBondContact O-CA 3.17Å; C583-C600 VanDerWaalsContact SG-SG 3.62Å; C600-I602 VanDerWaalsContact SG-CD1 3.6Å
601	V	96.3	Very high	90.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.6	169.1	179.5	0	0	0	0	109	F500 F503 G581 Y582 F611 I614 L615	F500-V601 HydrophobicContact CB-CG1 3.51Å; F500-V601 HydrophobicContact CD1-CG1 4.24Å; F500-V601 HydrophobicContact CG-CG1 3.87Å; F503-V601 HydrophobicContact CD2-CG2 3.75Å; F503-V601 HydrophobicContact CE2-CG2 4.42Å; G581-V601 CarbonylContact C-O 3.54Å; G581-V601 WeakPolarHBondContact CA-O 3.41Å; Y582-V601 HydrophobicContact CD2-CB 4.16Å; Y582-V601 HydrophobicContact CD2-CG1 4.35Å; Y582-V601 VanDerWaalsContact CD2-O 3.31Å; Y582-V601 WeakPolarHBondContact CD2-O 3.34Å; Y582-V601 PolarHBondContact N-O 3.25Å; Y582-V601 PolarHBondContact O-N 2.93Å; V601-F611 HydrophobicContact CB-CD1 4.35Å; V601-F611 HydrophobicContact CG1-CD1 3.72Å; V601-F611 HydrophobicContact CG1-CE1 3.75Å; V601-I614 HydrophobicContact CG2-CG2 4.43Å; V601-L615 HydrophobicContact CG2-CD2 4.23Å
602	I	93.6	Very high	91.1	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.3	176.1	-52.1	-62.7	0	0	0	109.4	F500 E501 Y502 I545 F569 R579 F580 C600	F500-I602 CarbonylContact C-O 3.51Å; F500-I602 WeakPolarHBondContact CB-O 3.35Å; E501-I602 PolarHBondContact N-O 2.97Å; Y502-I602 HydrophobicContact CD2-CB 4.24Å; Y502-I602 HydrophobicContact CD2-CG2 4.26Å; Y502-I602 PolarHBondContact N-O 3.35Å; Y502-I602 PolarHBondContact O-N 2.75Å; I545-I602 HydrophobicContact CD1-CD1 3.59Å; I545-I602 HydrophobicContact CD1-CG1 3.65Å; I545-I602 HydrophobicContact CG1-CD1 3.9Å; F569-I602 HydrophobicContact CE2-CD1 4.13Å; F569-I602 HydrophobicContact CZ-CD1 3.81Å; R579-I602 HydrophobicContact CB-CG2 4.23Å; F580-I602 WeakPolarHBondContact O-CA 3.33Å; C600-I602 VanDerWaalsContact SG-CD1 3.6Å
603	S	90.3	Very high	91.2	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.028	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	162.4	177.6	-167.8	0	0	0	0	113.3	L499 R579 F580 L605	L499-S603 WeakPolarHBondContact O-CB 3.39Å; L499-S603 PolarHBondContact O-OG 3.48Å; R579-S603 WeakPolarHBondContact CA-O 3.32Å; F580-S603 PolarHBondContact N-O 2.87Å; F580-S603 PolarHBondContact O-N 2.92Å; S603-L605 PolarHBondContact OG-N 3.11Å; S603-L605 VanDerWaalsContact OG-N 3.07Å
604	R	85.4	Confident	91.2	Very high	69 Å²	69	22.1 Å²	22.1	26%	0.26	11%	0.114	S	C	.	.	S	Bend	trans	-92.7	-15.5	165.2	-56.4	-172.5	-158.8	154.4	28.1	112.6	E496 E501 R579	E496-R604 VanDerWaalsContact CD-NH2 3.3Å; E496-R604 IonicContact OE1-CZ 3.96Å; E496-R604 IonicContact OE1-NH1 3.28Å; E496-R604 PolarHBondContact OE1-NH1 3.34Å; E496-R604 IonicContact OE1-NH2 3.87Å; E496-R604 PolarHBondContact OE1-NH2 3.01Å; E496-R604 IonicContact OE2-CZ 3.65Å; E496-R604 IonicContact OE2-NE 3.63Å; E496-R604 PolarHBondContact OE2-NE 3.33Å; E496-R604 IonicContact OE2-NH1 3.26Å; E496-R604 PolarHBondContact OE2-NH1 2.85Å; E496-R604 IonicContact OE2-NH2 3.64Å; E496-R604 PolarHBondContact OE2-NH2 2.94Å; E501-R604 IonicContact OE1-CZ 2.71Å; E501-R604 IonicContact OE1-NE 2.71Å; E501-R604 PolarHBondContact OE1-NE 3.22Å; E501-R604 IonicContact OE1-NH2 3.51Å; E501-R604 PolarHBondContact OE1-NH2 3.26Å; R579-R604 HydrophobicContact CG-CG 4.08Å
605	L	83.2	Confident	91.3	Very high	11 Å²	11	19.6 Å²	19.6	6%	0.058	10%	0.104	C	C	.	.	S	Bend	trans	-67.6	135.5	178.2	172.9	61.6	0	0	0	110.6	L499 Y582 S603 C607 L610 F611 F641 P642	L499-L605 HydrophobicContact CD1-CD2 3.8Å; Y582-L605 PolarHBondContact OH-O 2.89Å; S603-L605 PolarHBondContact OG-N 3.11Å; S603-L605 VanDerWaalsContact OG-N 3.07Å; L605-C607 HydrophobicContact CD1-CB 4.47Å; L605-C607 HydrophobicContact CD2-CB 4.29Å; L605-C607 HydrophobicContact CG-CB 4.09Å; L605-C607 PolarHBondContact O-N 2.84Å; L605-L610 HydrophobicContact CD2-CD1 4.44Å; L605-L610 HydrophobicContact CD2-CD2 4.32Å; L605-F611 HydrophobicContact CB-CE2 4.09Å; L605-F611 HydrophobicContact CB-CZ 4.17Å; L605-F611 HydrophobicContact CD2-CE2 4.18Å; L605-F611 HydrophobicContact CD2-CZ 4.08Å; L605-F611 HydrophobicContact CG-CE2 4.18Å; L605-F611 HydrophobicContact CG-CZ 4.43Å; L605-F641 HydrophobicContact CB-CE2 4.41Å; L605-F641 HydrophobicContact CD1-CE2 4.17Å; L605-F641 HydrophobicContact CD1-CZ 3.93Å; L605-F641 HydrophobicContact CD2-CE2 4.28Å; L605-P642 HydrophobicContact CD2-CG 4.28Å
606	G	83.3	Confident	91.2	Very high	18 Å²	18	21.5 Å²	21.5	19%	0.186	12%	0.115	C	C	.	.			trans	-85.8	31.6	-173.3	0	0	0	0	0	117.2	E673 H674	G606-E673 CarbonylContact O-C 3.57Å; G606-E673 WeakPolarHBondContact O-CB 3.33Å; G606-H674 VanDerWaalsContact C-CG 3.45Å; G606-H674 VanDerWaalsContact CA-CD2 3.44Å; G606-H674 WeakPolarHBondContact CA-CD2 3.41Å; G606-H674 WeakPolarHBondContact O-CB 3.31Å; G606-H674 PolarHBondContact O-CD2 3.26Å; G606-H674 VanDerWaalsContact O-CD2 3.24Å; G606-H674 PolarHBondContact O-CE1 3.07Å; G606-H674 PolarHBondContact O-N 3.4Å; G606-H674 PolarHBondContact O-ND1 2.89Å; G606-H674 VanDerWaalsContact O-ND1 3.16Å
607	C	84.9	Confident	91.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.118	C	C	.	.			trans	-119	99.9	-166.4	-161	0	0	0	0	116.9	L605 L610 F611 E673 H674	L605-C607 HydrophobicContact CD1-CB 4.47Å; L605-C607 HydrophobicContact CD2-CB 4.29Å; L605-C607 HydrophobicContact CG-CB 4.09Å; L605-C607 PolarHBondContact O-N 2.84Å; C607-L610 HydrophobicContact CB-CB 3.97Å; C607-L610 VanDerWaalsContact SG-CB 3.53Å; C607-F611 WeakPolarHBondContact O-CD2 3.4Å; C607-F611 PolarHBondContact O-N 3.32Å; C607-E673 CarbonylContact C-O 3.51Å; C607-E673 WeakPolarHBondContact CA-O 3.46Å; C607-E673 HydrophobicContact CB-CB 4.14Å; C607-E673 HydrophobicContact CB-CG 4.41Å; C607-H674 WeakPolarHBondContact CA-NE2 3.43Å; C607-H674 PolarHBondContact N-NE2 2.84Å; C607-H674 PolarHBondContact O-NE2 3.23Å
608	F	84.3	Confident	91	Very high	58 Å²	58	21 Å²	21	25%	0.254	11%	0.112	S	C	.	.	H	α-helix	trans	-70.6	-47.3	-174.7	-173.8	-93.6	0	0	0	111.8	T566 Y582 L610 F611 S612 E673 H674	T566-F608 HydrophobicContact CG2-CE2 4.18Å; T566-F608 HydrophobicContact CG2-CZ 3.69Å; Y582-F608 HydrophobicContact CD1-CD2 4.35Å; F608-L610 VanDerWaalsContact C-N 3.25Å; F608-L610 PolarHBondContact O-N 3.44Å; F608-F611 CarbonylContact O-C 3.58Å; F608-F611 PolarHBondContact O-N 3.31Å; F608-F611 VanDerWaalsContact O-N 3.09Å; F608-S612 PolarHBondContact O-N 2.82Å; F608-E673 PolarHBondContact N-O 3.39Å; F608-H674 WeakPolarHBondContact CA-CE1 3.43Å; F608-H674 WeakPolarHBondContact CA-NE2 3.01Å; F608-H674 WeakPolarHBondContact CB-CE1 3.49Å; F608-H674 WeakPolarHBondContact CB-ND1 3.12Å; F608-H674 AromaticContact CG-CE1 3.83Å; F608-H674 PolarHBondContact N-CE1 2.68Å; F608-H674 PolarHBondContact N-ND1 3.31Å; F608-H674 PolarHBondContact N-NE2 3.36Å
609	D	84.4	Confident	90.8	Very high	95 Å²	95	23.7 Å²	23.7	51%	0.508	13%	0.125	S	C	.	.	H	α-helix	trans	-57.6	-40.7	-179	-56.3	-25.4	0	0	0	111.9	T613	D609-T613 WeakPolarHBondContact O-CB 3.47Å; D609-T613 PolarHBondContact O-N 2.99Å; D609-T613 PolarHBondContact O-OG1 3.48Å
610	L	88.7	Confident	90.5	Very high	2 Å²	2	28 Å²	28	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-64.6	-45.1	177	179.2	149.4	0	0	0	111.4	L499 L605 C607 F608 T613 I614 P642 L664	L499-L610 HydrophobicContact CD1-CD1 4.39Å; L499-L610 HydrophobicContact CD1-CD2 4.03Å; L499-L610 HydrophobicContact CD2-CD2 4.35Å; L499-L610 HydrophobicContact CG-CD2 4.35Å; L605-L610 HydrophobicContact CD2-CD1 4.44Å; L605-L610 HydrophobicContact CD2-CD2 4.32Å; C607-L610 HydrophobicContact CB-CB 3.97Å; C607-L610 VanDerWaalsContact SG-CB 3.53Å; F608-L610 VanDerWaalsContact C-N 3.25Å; F608-L610 PolarHBondContact O-N 3.44Å; L610-T613 PolarHBondContact O-N 3.17Å; L610-I614 HydrophobicContact CD2-CD1 3.68Å; L610-I614 HydrophobicContact CG-CD1 4.46Å; L610-I614 WeakPolarHBondContact O-CG1 3.4Å; L610-I614 PolarHBondContact O-N 3.09Å; L610-I614 VanDerWaalsContact O-N 3.08Å; L610-P642 HydrophobicContact CD1-CG 4.08Å; L610-L664 HydrophobicContact CD1-CB 4.03Å; L610-L664 HydrophobicContact CG-CB 4.2Å; L610-L664 HydrophobicContact CG-CD2 4.47Å
611	F	92	Very high	90.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-76.9	-28.8	178.7	-67.6	-62.1	0	0	0	113.4	L499 F500 Y582 V601 L605 C607 F608 I614 L615 H674	L499-F611 HydrophobicContact CG-CE1 4.27Å; L499-F611 HydrophobicContact CG-CZ 4.5Å; L499-F611 VanDerWaalsContact O-CZ 3.31Å; L499-F611 WeakPolarHBondContact O-CZ 3.36Å; F500-F611 HydrophobicContact CB-CE1 4.47Å; Y582-F611 HydrophobicContact CD1-CB 4.17Å; Y582-F611 HydrophobicContact CD1-CD2 4.38Å; Y582-F611 HydrophobicContact CD2-CB 3.6Å; Y582-F611 HydrophobicContact CD2-CD1 4.03Å; Y582-F611 AromaticContact CD2-CD2 3.45Å; Y582-F611 HydrophobicContact CD2-CD2 3.45Å; Y582-F611 VanDerWaalsContact CD2-CD2 3.45Å; Y582-F611 HydrophobicContact CD2-CE2 4.13Å; Y582-F611 AromaticContact CD2-CG 3.41Å; Y582-F611 HydrophobicContact CD2-CG 3.41Å; Y582-F611 VanDerWaalsContact CD2-CG 3.41Å; Y582-F611 HydrophobicContact CE1-CD2 4.06Å; Y582-F611 HydrophobicContact CE2-CB 4.11Å; Y582-F611 HydrophobicContact CE2-CD1 4.22Å; Y582-F611 AromaticContact CE2-CD2 3.02Å; Y582-F611 HydrophobicContact CE2-CD2 3.02Å; Y582-F611 HydrophobicContact CE2-CE1 4.49Å; Y582-F611 AromaticContact CE2-CE2 3.37Å; Y582-F611 HydrophobicContact CE2-CE2 3.37Å; Y582-F611 AromaticContact CE2-CG 3.53Å; Y582-F611 HydrophobicContact CE2-CG 3.53Å; Y582-F611 HydrophobicContact CE2-CZ 4.12Å; Y582-F611 HydrophobicContact CG-CB 3.62Å; Y582-F611 HydrophobicContact CG-CD2 4.09Å; Y582-F611 AromaticContact CG-CG 3.97Å; Y582-F611 HydrophobicContact CG-CG 3.97Å; Y582-F611 AromaticContact CZ-CD2 3.35Å; Y582-F611 AromaticContact CZ-CE2 3.77Å; V601-F611 HydrophobicContact CB-CD1 4.35Å; V601-F611 HydrophobicContact CG1-CD1 3.72Å; V601-F611 HydrophobicContact CG1-CE1 3.75Å; L605-F611 HydrophobicContact CB-CE2 4.09Å; L605-F611 HydrophobicContact CB-CZ 4.17Å; L605-F611 HydrophobicContact CD2-CE2 4.18Å; L605-F611 HydrophobicContact CD2-CZ 4.08Å; L605-F611 HydrophobicContact CG-CE2 4.18Å; L605-F611 HydrophobicContact CG-CZ 4.43Å; C607-F611 WeakPolarHBondContact O-CD2 3.4Å; C607-F611 PolarHBondContact O-N 3.32Å; F608-F611 CarbonylContact O-C 3.58Å; F608-F611 PolarHBondContact O-N 3.31Å; F608-F611 VanDerWaalsContact O-N 3.09Å; F611-I614 HydrophobicContact CD1-CD1 3.87Å; F611-I614 HydrophobicContact CE1-CD1 4.19Å; F611-I614 PolarHBondContact O-N 3.44Å; F611-L615 WeakPolarHBondContact O-CB 3.16Å; F611-L615 VanDerWaalsContact O-CG 3.25Å; F611-L615 WeakPolarHBondContact O-CG 3.33Å; F611-L615 PolarHBondContact O-N 3.4Å; F611-H674 AromaticContact CD2-NE2 3.83Å
612	S	90.9	Very high	90	Very high	24 Å²	24	30.6 Å²	30.6	17%	0.168	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-50.7	167.6	-168.6	0	0	0	0	109.7	R584 F608 I614 L615 D616	R584-S612 PolarHBondContact NH2-OG 3.3Å; F608-S612 PolarHBondContact O-N 2.82Å; S612-I614 PolarHBondContact O-N 3.01Å; S612-I614 VanDerWaalsContact O-N 3.16Å; S612-L615 CarbonylContact O-C 3.55Å; S612-L615 WeakPolarHBondContact O-CA 3.14Å; S612-L615 PolarHBondContact O-N 2.88Å; S612-D616 PolarHBondContact O-N 3.29Å; S612-D616 PolarHBondContact OG-OD2 2.7Å
613	T	91.7	Very high	89.8	Confident	59 Å²	59	32.9 Å²	32.9	36%	0.362	18%	0.175	S	C	.	.	H	α-helix	trans	-54.5	-38.6	177.7	-54.3	0	0	0	0	112.1	D609 L610 E617 I662 L664	D609-T613 WeakPolarHBondContact O-CB 3.47Å; D609-T613 PolarHBondContact O-N 2.99Å; D609-T613 PolarHBondContact O-OG1 3.48Å; L610-T613 PolarHBondContact O-N 3.17Å; T613-E617 PolarHBondContact O-N 3.36Å; T613-I662 HydrophobicContact CG2-CG2 4.26Å; T613-L664 HydrophobicContact CG2-CD2 3.85Å
614	I	93.4	Very high	89.8	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66	-43.8	172.7	-72.2	164.9	0	0	0	111.9	L499 V601 L610 F611 S612 E617 V618 F632 M633 L636 L664	L499-I614 HydrophobicContact CD2-CD1 3.82Å; V601-I614 HydrophobicContact CG2-CG2 4.43Å; L610-I614 HydrophobicContact CD2-CD1 3.68Å; L610-I614 HydrophobicContact CG-CD1 4.46Å; L610-I614 WeakPolarHBondContact O-CG1 3.4Å; L610-I614 PolarHBondContact O-N 3.09Å; L610-I614 VanDerWaalsContact O-N 3.08Å; F611-I614 HydrophobicContact CD1-CD1 3.87Å; F611-I614 HydrophobicContact CE1-CD1 4.19Å; F611-I614 PolarHBondContact O-N 3.44Å; S612-I614 PolarHBondContact O-N 3.01Å; S612-I614 VanDerWaalsContact O-N 3.16Å; I614-E617 PolarHBondContact O-N 3.07Å; I614-V618 WeakPolarHBondContact O-CG2 3.45Å; I614-V618 PolarHBondContact O-N 3.48Å; I614-F632 HydrophobicContact CG2-CE1 4.31Å; I614-F632 HydrophobicContact CG2-CZ 4.45Å; I614-M633 HydrophobicContact CG2-CE 4.07Å; I614-L636 HydrophobicContact CB-CD1 4.43Å; I614-L636 HydrophobicContact CD1-CD1 4.08Å; I614-L636 HydrophobicContact CD1-CD2 4.21Å; I614-L636 HydrophobicContact CG1-CD1 3.97Å; I614-L636 HydrophobicContact CG1-CD2 4.13Å; I614-L636 HydrophobicContact CG2-CD1 3.61Å; I614-L664 HydrophobicContact CD1-CD1 3.99Å; I614-L664 HydrophobicContact CG1-CD1 4.07Å; I614-L664 HydrophobicContact CG1-CD2 3.96Å
615	L	95.1	Very high	90	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-71.5	-35	-179.2	-73.3	168.8	0	0	0	113.2	R584 V601 F611 S612 E617 V618 E619	R584-L615 HydrophobicContact CB-CB 4.01Å; R584-L615 HydrophobicContact CB-CD1 4.2Å; R584-L615 HydrophobicContact CB-CD2 3.98Å; R584-L615 HydrophobicContact CB-CG 4.29Å; V601-L615 HydrophobicContact CG2-CD2 4.23Å; F611-L615 WeakPolarHBondContact O-CB 3.16Å; F611-L615 VanDerWaalsContact O-CG 3.25Å; F611-L615 WeakPolarHBondContact O-CG 3.33Å; F611-L615 PolarHBondContact O-N 3.4Å; S612-L615 CarbonylContact O-C 3.55Å; S612-L615 WeakPolarHBondContact O-CA 3.14Å; S612-L615 PolarHBondContact O-N 2.88Å; L615-E617 VanDerWaalsContact C-N 3.28Å; L615-E617 PolarHBondContact O-N 3.2Å; L615-V618 WeakPolarHBondContact O-CB 3.1Å; L615-V618 PolarHBondContact O-N 3.41Å; L615-E619 WeakPolarHBondContact O-CB 3.11Å; L615-E619 PolarHBondContact O-N 3.02Å
616	D	93.8	Very high	90.2	Very high	76 Å²	76	37.9 Å²	37.9	41%	0.406	22%	0.221	S	C	.	.	H	α-helix	trans	-58.2	-43.1	169.9	-70.2	-52.2	0	0	0	110.6	R584 S612 E619 R620	R584-D616 IonicContact CZ-OD1 3.48Å; R584-D616 IonicContact NH1-OD1 2.67Å; R584-D616 PolarHBondContact NH1-OD1 3.02Å; R584-D616 IonicContact NH2-OD1 3.3Å; R584-D616 PolarHBondContact NH2-OD1 2.84Å; R584-D616 IonicContact NH2-OD2 3.57Å; R584-D616 PolarHBondContact NH2-OD2 2.85Å; S612-D616 PolarHBondContact O-N 3.29Å; S612-D616 PolarHBondContact OG-OD2 2.7Å; D616-E619 PolarHBondContact O-N 2.93Å; D616-R620 WeakPolarHBondContact O-CB 3.32Å; D616-R620 PolarHBondContact O-N 3.08Å
617	E	93.3	Very high	90.5	Very high	17 Å²	17	40.4 Å²	40.4	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-71.4	-34.2	175.4	178.5	65.7	179.1	0	0	113.3	T613 I614 L615 R620 R621 F632 I662	T613-E617 PolarHBondContact O-N 3.36Å; I614-E617 PolarHBondContact O-N 3.07Å; L615-E617 VanDerWaalsContact C-N 3.28Å; L615-E617 PolarHBondContact O-N 3.2Å; E617-R620 VanDerWaalsContact CD-NH2 3.28Å; E617-R620 IonicContact OE1-CZ 3.16Å; E617-R620 IonicContact OE1-NE 3.61Å; E617-R620 IonicContact OE1-NH2 2.7Å; E617-R620 PolarHBondContact OE1-NH2 3.33Å; E617-R620 IonicContact OE2-CZ 2.66Å; E617-R620 IonicContact OE2-NE 3.68Å; E617-R620 PolarHBondContact OE2-NE 2.8Å; E617-R620 IonicContact OE2-NH2 2.95Å; E617-R620 PolarHBondContact OE2-NH2 3.49Å; E617-R621 WeakPolarHBondContact O-CB 3.44Å; E617-R621 VanDerWaalsContact O-CG 3.26Å; E617-R621 WeakPolarHBondContact O-CG 3.38Å; E617-R621 PolarHBondContact O-N 2.79Å; E617-R621 IonicContact OE1-CZ 2.74Å; E617-R621 IonicContact OE1-NE 2.76Å; E617-R621 PolarHBondContact OE1-NE 3.04Å; E617-R621 IonicContact OE1-NH2 3.16Å; E617-R621 PolarHBondContact OE1-NH2 3.5Å; E617-F632 HydrophobicContact CB-CE1 3.72Å; E617-F632 HydrophobicContact CB-CZ 3.8Å; E617-F632 HydrophobicContact CG-CD1 3.93Å; E617-F632 HydrophobicContact CG-CE1 3.34Å; E617-F632 HydrophobicContact CG-CE2 4Å; E617-F632 HydrophobicContact CG-CG 4.49Å; E617-F632 HydrophobicContact CG-CZ 3.38Å; E617-I662 HydrophobicContact CG-CD1 3.67Å
618	V	94	Very high	90.8	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-62.4	-44.2	171.7	166.6	0	0	0	0	110.9	F503 Y599 I614 L615 R621 R622 V629 F632 M633	F503-V618 HydrophobicContact CE2-CG1 4.29Å; F503-V618 HydrophobicContact CE2-CG2 4.11Å; F503-V618 HydrophobicContact CZ-CG1 4Å; F503-V618 HydrophobicContact CZ-CG2 4.17Å; Y599-V618 HydrophobicContact CD1-CG1 3.34Å; Y599-V618 HydrophobicContact CE1-CG1 3.8Å; Y599-V618 HydrophobicContact CG-CG1 3.87Å; I614-V618 WeakPolarHBondContact O-CG2 3.45Å; I614-V618 PolarHBondContact O-N 3.48Å; L615-V618 WeakPolarHBondContact O-CB 3.1Å; L615-V618 PolarHBondContact O-N 3.41Å; V618-R621 PolarHBondContact O-N 2.72Å; V618-R622 WeakPolarHBondContact O-CB 3.34Å; V618-R622 PolarHBondContact O-N 3.11Å; V618-V629 HydrophobicContact CG1-CG1 4.2Å; V618-V629 HydrophobicContact CG1-CG2 4.4Å; V618-V629 HydrophobicContact CG2-CG1 4.29Å; V618-F632 HydrophobicContact CG2-CD1 4.13Å; V618-F632 HydrophobicContact CG2-CE1 4.01Å; V618-M633 HydrophobicContact CG2-CE 3.42Å; V618-M633 VanDerWaalsContact CG2-CE 3.42Å
619	E	93.5	Very high	91.1	Very high	58 Å²	58	39.3 Å²	39.3	27%	0.271	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-47.1	177	178.5	155.3	-154.8	0	0	111.2	S564 R584 L586 L615 D616 R621 R622 G623	S564-E619 WeakPolarHBondContact CB-OE1 3.17Å; S564-E619 PolarHBondContact OG-OE1 3.21Å; S564-E619 PolarHBondContact OG-OE2 2.99Å; R584-E619 VanDerWaalsContact CD-OE2 3.31Å; R584-E619 WeakPolarHBondContact CD-OE2 3.47Å; R584-E619 WeakPolarHBondContact CG-OE2 3.49Å; R584-E619 IonicContact CZ-OE2 3.34Å; R584-E619 IonicContact NE-OE2 2.72Å; R584-E619 IonicContact NH1-OE2 3.89Å; R584-E619 PolarHBondContact NH1-OE2 3.46Å; L586-E619 HydrophobicContact CD2-CB 3.95Å; L586-E619 HydrophobicContact CD2-CG 3.77Å; L615-E619 WeakPolarHBondContact O-CB 3.11Å; L615-E619 PolarHBondContact O-N 3.02Å; D616-E619 PolarHBondContact O-N 2.93Å; E619-R621 VanDerWaalsContact C-N 3.33Å; E619-R621 PolarHBondContact O-N 3.31Å; E619-R622 PolarHBondContact O-N 3.34Å; E619-G623 PolarHBondContact O-N 3.2Å
620	R	92	Very high	91.4	Very high	92 Å²	92	38.8 Å²	38.8	35%	0.347	23%	0.228	S	C	.	.	H	α-helix	trans	-56.3	-45	173.4	-166.7	-179	71.6	116.7	5.8	112	D616 E617 G623 E660	D616-R620 WeakPolarHBondContact O-CB 3.32Å; D616-R620 PolarHBondContact O-N 3.08Å; E617-R620 VanDerWaalsContact CD-NH2 3.28Å; E617-R620 IonicContact OE1-CZ 3.16Å; E617-R620 IonicContact OE1-NE 3.61Å; E617-R620 IonicContact OE1-NH2 2.7Å; E617-R620 PolarHBondContact OE1-NH2 3.33Å; E617-R620 IonicContact OE2-CZ 2.66Å; E617-R620 IonicContact OE2-NE 3.68Å; E617-R620 PolarHBondContact OE2-NE 2.8Å; E617-R620 IonicContact OE2-NH2 2.95Å; E617-R620 PolarHBondContact OE2-NH2 3.49Å; R620-G623 PolarHBondContact O-N 3.49Å; R620-E660 IonicContact CZ-OE1 2.9Å; R620-E660 IonicContact CZ-OE2 3.44Å; R620-E660 IonicContact NH1-OE1 3.69Å; R620-E660 PolarHBondContact NH1-OE1 3Å; R620-E660 IonicContact NH1-OE2 2.76Å; R620-E660 PolarHBondContact NH1-OE2 3.34Å; R620-E660 VanDerWaalsContact NH1-OE2 3.16Å; R620-E660 IonicContact NH2-OE1 3.63Å; R620-E660 IonicContact NH2-OE2 3.2Å; R620-E660 PolarHBondContact NH2-OE2 3.33Å
621	R	91.6	Very high	91.6	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.015	25%	0.248	C	C	.	.	H	α-helix	trans	-65.9	-44.2	177.4	-76.9	171.9	-175.9	-79.1	-23.7	112.7	E617 V618 E619 G623 V624 S625 L628 V629 T652 F653 L654	E617-R621 WeakPolarHBondContact O-CB 3.44Å; E617-R621 VanDerWaalsContact O-CG 3.26Å; E617-R621 WeakPolarHBondContact O-CG 3.38Å; E617-R621 PolarHBondContact O-N 2.79Å; E617-R621 IonicContact OE1-CZ 2.74Å; E617-R621 IonicContact OE1-NE 2.76Å; E617-R621 PolarHBondContact OE1-NE 3.04Å; E617-R621 IonicContact OE1-NH2 3.16Å; E617-R621 PolarHBondContact OE1-NH2 3.5Å; V618-R621 PolarHBondContact O-N 2.72Å; E619-R621 VanDerWaalsContact C-N 3.33Å; E619-R621 PolarHBondContact O-N 3.31Å; R621-G623 PolarHBondContact O-N 2.79Å; R621-V624 PolarHBondContact O-N 3.22Å; R621-V624 VanDerWaalsContact O-N 3.07Å; R621-S625 CarbonylContact O-C 3.54Å; R621-S625 PolarHBondContact O-N 2.89Å; R621-S625 VanDerWaalsContact O-O 3.07Å; R621-L628 HydrophobicContact CB-CB 4.29Å; R621-L628 HydrophobicContact CG-CB 4.49Å; R621-V629 HydrophobicContact CB-CG2 4.14Å; R621-T652 VanDerWaalsContact NH2-CB 3.33Å; R621-T652 PolarHBondContact NH2-OG1 3.07Å; R621-F653 PolarHBondContact NH1-O 3.22Å; R621-F653 PolarHBondContact NH2-O 3.4Å; R621-L654 HydrophobicContact CG-CD1 3.78Å
622	R	90.4	Very high	91.5	Very high	51 Å²	51	41.9 Å²	41.9	19%	0.192	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-32.4	176.9	176.4	62.4	-176.9	-115.7	-0.8	111.8	E597 Y599 V618 E619 V624	E597-R622 IonicContact OE1-CZ 3.89Å; E597-R622 IonicContact OE1-NH1 3.14Å; E597-R622 PolarHBondContact OE1-NH1 3.44Å; E597-R622 IonicContact OE1-NH2 2.67Å; E597-R622 PolarHBondContact OE1-NH2 3.31Å; E597-R622 IonicContact OE2-CZ 2.7Å; E597-R622 VanDerWaalsContact OE2-CZ 3.22Å; E597-R622 IonicContact OE2-NH1 2.66Å; E597-R622 PolarHBondContact OE2-NH1 3.39Å; E597-R622 IonicContact OE2-NH2 3.73Å; E597-R622 PolarHBondContact OE2-NH2 2.96Å; Y599-R622 WeakPolarHBondContact OH-CD 3.4Å; Y599-R622 VanDerWaalsContact OH-CG 3.22Å; Y599-R622 WeakPolarHBondContact OH-CG 3.26Å; Y599-R622 PolarHBondContact OH-NE 2.93Å; Y599-R622 PolarHBondContact OH-NH1 3.44Å; V618-R622 WeakPolarHBondContact O-CB 3.34Å; V618-R622 PolarHBondContact O-N 3.11Å; E619-R622 PolarHBondContact O-N 3.34Å; R622-V624 PolarHBondContact O-N 3.13Å
623	G	89.2	Confident	91.6	Very high	50 Å²	50	40.7 Å²	40.7	52%	0.515	24%	0.24	S	C	.	.	H	α-helix	trans	-59.3	-30.4	172.6	0	0	0	0	0	114	E619 R620 R621	E619-G623 PolarHBondContact O-N 3.2Å; R620-G623 PolarHBondContact O-N 3.49Å; R621-G623 PolarHBondContact O-N 2.79Å
624	V	90.4	Very high	91.6	Very high	84 Å²	84	43.2 Å²	43.2	51%	0.509	24%	0.243	S	C	.	.	H	α-helix	trans	-90	-54.6	174.3	-178.1	0	0	0	0	111.3	R621 R622 L628	R621-V624 PolarHBondContact O-N 3.22Å; R621-V624 VanDerWaalsContact O-N 3.07Å; R622-V624 PolarHBondContact O-N 3.13Å; V624-L628 HydrophobicContact CB-CD1 3.87Å; V624-L628 HydrophobicContact CG1-CD1 3.65Å
625	S	89.6	Confident	91.4	Very high	53 Å²	53	45 Å²	45	37%	0.371	26%	0.255	S	S	.	.			trans	-167.1	136.1	173.9	174.7	0	0	0	0	111.7	R621 A627 L628	R621-S625 CarbonylContact O-C 3.54Å; R621-S625 PolarHBondContact O-N 2.89Å; R621-S625 VanDerWaalsContact O-O 3.07Å; S625-A627 PolarHBondContact O-N 2.93Å; S625-A627 VanDerWaalsContact O-N 3.12Å; S625-A627 PolarHBondContact OG-N 2.99Å; S625-L628 WeakPolarHBondContact O-CB 3.36Å; S625-L628 PolarHBondContact O-N 3Å
626	A	87.6	Confident	91.2	Very high	52 Å²	52	45 Å²	45	43%	0.43	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-55.4	-29.9	175.4	0	0	0	0	0	113.5	L628 V629	A626-L628 PolarHBondContact O-N 3.02Å; A626-V629 WeakPolarHBondContact O-CB 3.43Å; A626-V629 PolarHBondContact O-N 2.88Å
627	A	89.4	Confident	90.8	Very high	71 Å²	71	44.2 Å²	44.2	59%	0.587	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-64.3	-25	179	0	0	0	0	0	113.3	S625 V629 P631	S625-A627 PolarHBondContact O-N 2.93Å; S625-A627 VanDerWaalsContact O-N 3.12Å; S625-A627 PolarHBondContact OG-N 2.99Å; A627-V629 PolarHBondContact O-N 2.86Å; A627-P631 WeakPolarHBondContact O-CD 3.31Å
628	L	91	Very high	90.5	Very high	30 Å²	30	49.9 Å²	49.9	16%	0.157	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-75.8	-11	-178.1	-61.4	171	0	0	0	113.5	R621 V624 S625 A626 L654 P655	R621-L628 HydrophobicContact CB-CB 4.29Å; R621-L628 HydrophobicContact CG-CB 4.49Å; V624-L628 HydrophobicContact CB-CD1 3.87Å; V624-L628 HydrophobicContact CG1-CD1 3.65Å; S625-L628 WeakPolarHBondContact O-CB 3.36Å; S625-L628 PolarHBondContact O-N 3Å; A626-L628 PolarHBondContact O-N 3.02Å; L628-L654 HydrophobicContact CD1-CD1 4.03Å; L628-P655 HydrophobicContact CD1-CG 4.12Å; L628-P655 HydrophobicContact CD2-CG 3.85Å
629	V	92.1	Very high	90.1	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.036	28%	0.283	C	S	.	.	H	α-helix	trans	-75.4	-37.1	176.9	-178.6	0	0	0	0	111.3	F503 V618 R621 A626 A627 F632 M633	F503-V629 HydrophobicContact CE1-CG1 3.54Å; F503-V629 HydrophobicContact CZ-CG1 3.55Å; V618-V629 HydrophobicContact CG1-CG1 4.2Å; V618-V629 HydrophobicContact CG1-CG2 4.4Å; V618-V629 HydrophobicContact CG2-CG1 4.29Å; R621-V629 HydrophobicContact CB-CG2 4.14Å; A626-V629 WeakPolarHBondContact O-CB 3.43Å; A626-V629 PolarHBondContact O-N 2.88Å; A627-V629 PolarHBondContact O-N 2.86Å; V629-F632 PolarHBondContact O-N 3.08Å; V629-M633 HydrophobicContact CG1-CG 4.15Å; V629-M633 WeakPolarHBondContact O-CG 3.37Å; V629-M633 PolarHBondContact O-N 3.22Å
630	Y	90.8	Very high	89.5	Confident	84 Å²	84	52.7 Å²	52.7	33%	0.329	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-49.8	-178.9	175.7	-78.5	0	0	0	113	Y523 F525 F632 M633 R634	Y523-Y630 WeakPolarHBondContact OH-CB 3.42Å; Y523-Y630 VanDerWaalsContact OH-CD2 3.29Å; Y523-Y630 WeakPolarHBondContact OH-CD2 3.29Å; F525-Y630 AromaticContact CD2-CD2 3.85Å; F525-Y630 HydrophobicContact CD2-CD2 3.85Å; F525-Y630 AromaticContact CD2-CE2 3.62Å; F525-Y630 HydrophobicContact CD2-CE2 3.62Å; F525-Y630 HydrophobicContact CE2-CD2 4.27Å; F525-Y630 AromaticContact CE2-CE2 3.78Å; F525-Y630 HydrophobicContact CE2-CE2 3.78Å; Y630-F632 VanDerWaalsContact C-N 3.29Å; Y630-F632 PolarHBondContact O-N 3.42Å; Y630-M633 PolarHBondContact O-N 3.08Å; Y630-R634 PolarHBondContact O-N 3.45Å; Y630-R634 VanDerWaalsContact O-N 3.12Å; Y630-R634 PolarHBondContact OH-NH2 3.13Å
631	P	90.9	Very high	88.7	Confident	65 Å²	65	50.6 Å²	50.6	42%	0.422	29%	0.294	S	S	.	.	H	α-helix	trans	-60.3	-38	176	-24.6	34.9	0	0	0	112.8	A627 R634 S635	A627-P631 WeakPolarHBondContact O-CD 3.31Å; P631-R634 PolarHBondContact O-N 2.59Å; P631-S635 PolarHBondContact O-N 3.21Å; P631-S635 PolarHBondContact O-OG 2.81Å
632	F	91.9	Very high	88	Confident	1 Å²	1	50.5 Å²	50.5	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-64.9	-48.2	178.8	175.5	-135.9	0	0	0	112.2	I614 E617 V618 V629 Y630 R634 S635 L636 T652 I662	I614-F632 HydrophobicContact CG2-CE1 4.31Å; I614-F632 HydrophobicContact CG2-CZ 4.45Å; E617-F632 HydrophobicContact CB-CE1 3.72Å; E617-F632 HydrophobicContact CB-CZ 3.8Å; E617-F632 HydrophobicContact CG-CD1 3.93Å; E617-F632 HydrophobicContact CG-CE1 3.34Å; E617-F632 HydrophobicContact CG-CE2 4Å; E617-F632 HydrophobicContact CG-CG 4.49Å; E617-F632 HydrophobicContact CG-CZ 3.38Å; V618-F632 HydrophobicContact CG2-CD1 4.13Å; V618-F632 HydrophobicContact CG2-CE1 4.01Å; V629-F632 PolarHBondContact O-N 3.08Å; Y630-F632 VanDerWaalsContact C-N 3.29Å; Y630-F632 PolarHBondContact O-N 3.42Å; F632-R634 PolarHBondContact O-N 3Å; F632-S635 PolarHBondContact O-N 3.17Å; F632-L636 HydrophobicContact CD1-CD1 4.46Å; F632-L636 HydrophobicContact CD2-CD1 4.31Å; F632-L636 HydrophobicContact CD2-CG 4.05Å; F632-L636 HydrophobicContact CE1-CD1 4Å; F632-L636 HydrophobicContact CE2-CD1 3.84Å; F632-L636 HydrophobicContact CE2-CD2 3.73Å; F632-L636 HydrophobicContact CE2-CG 3.65Å; F632-L636 HydrophobicContact CZ-CD1 3.67Å; F632-L636 HydrophobicContact CZ-CD2 4.07Å; F632-L636 HydrophobicContact CZ-CG 4.01Å; F632-L636 WeakPolarHBondContact O-CG 3.15Å; F632-L636 PolarHBondContact O-N 2.85Å; F632-T652 HydrophobicContact CD2-CG2 3.71Å; F632-T652 HydrophobicContact CE2-CG2 4.07Å; F632-I662 HydrophobicContact CD2-CD1 4.25Å; F632-I662 HydrophobicContact CE2-CD1 3.46Å; F632-I662 VanDerWaalsContact CE2-CD1 3.46Å; F632-I662 HydrophobicContact CZ-CD1 3.9Å
633	M	92.6	Very high	87.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.2	-36.7	175.7	-67.8	-60.5	104.9	0	0	112.2	F500 F503 F525 I614 V618 V629 Y630 L636 M637	F500-M633 HydrophobicContact CZ-CB 4.43Å; F500-M633 HydrophobicContact CZ-SD 4.2Å; F503-M633 HydrophobicContact CB-CG 4.43Å; F503-M633 HydrophobicContact CB-SD 3.93Å; F503-M633 HydrophobicContact CD1-CG 3.56Å; F503-M633 HydrophobicContact CD1-SD 3.77Å; F503-M633 HydrophobicContact CD2-SD 3.66Å; F503-M633 HydrophobicContact CE1-CG 3.76Å; F503-M633 HydrophobicContact CE1-SD 4.08Å; F503-M633 HydrophobicContact CE2-SD 3.96Å; F503-M633 HydrophobicContact CG-CG 3.95Å; F503-M633 HydrophobicContact CG-SD 3.51Å; F503-M633 VanDerWaalsContact CG-SD 3.51Å; F503-M633 HydrophobicContact CZ-CG 4.29Å; F503-M633 HydrophobicContact CZ-SD 4.13Å; F525-M633 HydrophobicContact CD1-CB 3.68Å; F525-M633 HydrophobicContact CD2-CB 4.45Å; F525-M633 HydrophobicContact CE1-CB 3.85Å; F525-M633 HydrophobicContact CG-CB 4.01Å; F525-M633 HydrophobicContact CZ-CB 4.33Å; I614-M633 HydrophobicContact CG2-CE 4.07Å; V618-M633 HydrophobicContact CG2-CE 3.42Å; V618-M633 VanDerWaalsContact CG2-CE 3.42Å; V629-M633 HydrophobicContact CG1-CG 4.15Å; V629-M633 WeakPolarHBondContact O-CG 3.37Å; V629-M633 PolarHBondContact O-N 3.22Å; Y630-M633 PolarHBondContact O-N 3.08Å; M633-L636 HydrophobicContact CE-CD1 3.5Å; M633-L636 VanDerWaalsContact CE-CD1 3.5Å; M633-L636 HydrophobicContact SD-CD1 4.2Å; M633-M637 WeakPolarHBondContact O-CB 3.46Å; M633-M637 PolarHBondContact O-N 3.27Å; M633-M637 VanDerWaalsContact O-N 3.1Å
634	R	90.4	Very high	86.8	Confident	112 Å²	112	50.6 Å²	50.6	42%	0.423	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-51.7	173.2	-172.9	-170	-72.7	-176.1	-7.1	111.6	F525 Y630 P631 F632 L636 M637 E638	F525-R634 HydrophobicContact CE2-CB 4.28Å; F525-R634 HydrophobicContact CZ-CB 4.03Å; Y630-R634 PolarHBondContact O-N 3.45Å; Y630-R634 VanDerWaalsContact O-N 3.12Å; Y630-R634 PolarHBondContact OH-NH2 3.13Å; P631-R634 PolarHBondContact O-N 2.59Å; F632-R634 PolarHBondContact O-N 3Å; R634-L636 VanDerWaalsContact C-N 3.26Å; R634-L636 PolarHBondContact O-N 3.47Å; R634-M637 PolarHBondContact O-N 2.88Å; R634-E638 VanDerWaalsContact CD-OE1 3.27Å; R634-E638 WeakPolarHBondContact CD-OE1 3.44Å; R634-E638 HydrophobicContact CG-CG 4.29Å; R634-E638 WeakPolarHBondContact CG-OE1 3.4Å; R634-E638 WeakPolarHBondContact O-CG 3.21Å; R634-E638 PolarHBondContact O-N 2.82Å
635	S	89.8	Confident	86.1	Confident	36 Å²	36	47.7 Å²	47.7	25%	0.252	28%	0.283	S	S	.	.	H	α-helix	trans	-62.9	-29	179.5	-59.7	0	0	0	0	113.7	P631 F632 S639	P631-S635 PolarHBondContact O-N 3.21Å; P631-S635 PolarHBondContact O-OG 2.81Å; F632-S635 PolarHBondContact O-N 3.17Å; S635-S639 WeakPolarHBondContact O-CB 3.26Å; S635-S639 PolarHBondContact O-N 2.83Å; S635-S639 PolarHBondContact O-OG 2.85Å
636	L	90.3	Very high	85.7	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-43.4	170.3	-70.8	175.9	0	0	0	112.5	L499 F500 I614 F632 M633 R634 S639 V650 L664	L499-L636 HydrophobicContact CD2-CB 4.43Å; L499-L636 HydrophobicContact CD2-CD2 4.34Å; F500-L636 HydrophobicContact CE1-CB 3.89Å; F500-L636 HydrophobicContact CE1-CD1 4.3Å; I614-L636 HydrophobicContact CB-CD1 4.43Å; I614-L636 HydrophobicContact CD1-CD1 4.08Å; I614-L636 HydrophobicContact CD1-CD2 4.21Å; I614-L636 HydrophobicContact CG1-CD1 3.97Å; I614-L636 HydrophobicContact CG1-CD2 4.13Å; I614-L636 HydrophobicContact CG2-CD1 3.61Å; F632-L636 HydrophobicContact CD1-CD1 4.46Å; F632-L636 HydrophobicContact CD2-CD1 4.31Å; F632-L636 HydrophobicContact CD2-CG 4.05Å; F632-L636 HydrophobicContact CE1-CD1 4Å; F632-L636 HydrophobicContact CE2-CD1 3.84Å; F632-L636 HydrophobicContact CE2-CD2 3.73Å; F632-L636 HydrophobicContact CE2-CG 3.65Å; F632-L636 HydrophobicContact CZ-CD1 3.67Å; F632-L636 HydrophobicContact CZ-CD2 4.07Å; F632-L636 HydrophobicContact CZ-CG 4.01Å; F632-L636 WeakPolarHBondContact O-CG 3.15Å; F632-L636 PolarHBondContact O-N 2.85Å; M633-L636 HydrophobicContact CE-CD1 3.5Å; M633-L636 VanDerWaalsContact CE-CD1 3.5Å; M633-L636 HydrophobicContact SD-CD1 4.2Å; R634-L636 VanDerWaalsContact C-N 3.26Å; R634-L636 PolarHBondContact O-N 3.47Å; L636-S639 WeakPolarHBondContact O-CB 3.22Å; L636-S639 PolarHBondContact O-N 3.03Å; L636-V650 HydrophobicContact CD2-CG1 4.15Å; L636-V650 HydrophobicContact CD2-CG2 4.04Å; L636-L664 HydrophobicContact CD2-CD1 3.71Å
637	M	87.3	Confident	85.6	Confident	60 Å²	60	52.9 Å²	52.9	30%	0.296	29%	0.292	S	S	.	.	H	α-helix	trans	-73.7	-28.2	-178.2	-161.6	174.7	76.3	0	0	112.4	F500 F525 P526 M633 R634 S639	F500-M637 HydrophobicContact CZ-CB 4.22Å; F525-M637 HydrophobicContact CE1-CB 4.25Å; F525-M637 HydrophobicContact CE1-CE 3.93Å; F525-M637 HydrophobicContact CE1-SD 3.65Å; F525-M637 HydrophobicContact CZ-CE 3.83Å; F525-M637 HydrophobicContact CZ-SD 4.19Å; P526-M637 HydrophobicContact CB-CE 4.46Å; P526-M637 HydrophobicContact CG-SD 4.43Å; M633-M637 WeakPolarHBondContact O-CB 3.46Å; M633-M637 PolarHBondContact O-N 3.27Å; M633-M637 VanDerWaalsContact O-N 3.1Å; R634-M637 PolarHBondContact O-N 2.88Å; M637-S639 VanDerWaalsContact C-N 3.32Å
638	E	85.9	Confident	85.5	Confident	136 Å²	136	50.1 Å²	50.1	64%	0.636	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-11.6	171.5	-69.4	169.7	174.5	0	0	113.4	R634	R634-E638 VanDerWaalsContact CD-OE1 3.27Å; R634-E638 WeakPolarHBondContact CD-OE1 3.44Å; R634-E638 HydrophobicContact CG-CG 4.29Å; R634-E638 WeakPolarHBondContact CG-OE1 3.4Å; R634-E638 WeakPolarHBondContact O-CG 3.21Å; R634-E638 PolarHBondContact O-N 2.82Å
639	S	84.7	Confident	85.3	Confident	20 Å²	20	54.7 Å²	54.7	14%	0.14	29%	0.286	C	S	.	.	S	Bend	trans	-79.4	146.6	-179.3	-72.7	0	0	0	0	112.5	S635 L636 M637 F641	S635-S639 WeakPolarHBondContact O-CB 3.26Å; S635-S639 PolarHBondContact O-N 2.83Å; S635-S639 PolarHBondContact O-OG 2.85Å; L636-S639 WeakPolarHBondContact O-CB 3.22Å; L636-S639 PolarHBondContact O-N 3.03Å; M637-S639 VanDerWaalsContact C-N 3.32Å; S639-F641 PolarHBondContact O-N 2.95Å
640	P	81	Confident	85.1	Confident	98 Å²	98	54.5 Å²	54.5	64%	0.636	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-67.1	134.2	-179.5	28.3	-35.2	0	0	0	111.7	I648	P640-I648 WeakPolarHBondContact O-CD1 3.41Å; P640-I648 WeakPolarHBondContact O-CG1 3.46Å
641	F	75.9	Confident	84.8	Confident	49 Å²	49	58.6 Å²	58.6	22%	0.215	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-54.8	138.8	177.9	179.9	-89.3	0	0	0	113.1	Q495 L605 S639 A643	Q495-F641 HydrophobicContact CB-CE1 4.48Å; Q495-F641 HydrophobicContact CG-CE1 3.95Å; Q495-F641 HydrophobicContact CG-CZ 3.86Å; L605-F641 HydrophobicContact CB-CE2 4.41Å; L605-F641 HydrophobicContact CD1-CE2 4.17Å; L605-F641 HydrophobicContact CD1-CZ 3.93Å; L605-F641 HydrophobicContact CD2-CE2 4.28Å; S639-F641 PolarHBondContact O-N 2.95Å; F641-A643 PolarHBondContact O-N 3.17Å
642	P	77.4	Confident	84.3	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.013	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-83.5	120.8	-174.6	28.3	-24.1	0	0	0	111.8	L499 L605 L610 I648 R666	L499-P642 HydrophobicContact CD1-CG 4.15Å; L605-P642 HydrophobicContact CD2-CG 4.28Å; L610-P642 HydrophobicContact CD1-CG 4.08Å; P642-I648 HydrophobicContact CB-CD1 3.68Å; P642-I648 HydrophobicContact CB-CG1 3.99Å; P642-I648 HydrophobicContact CG-CD1 3.73Å; P642-R666 HydrophobicContact CB-CB 3.87Å; P642-R666 HydrophobicContact CG-CB 4.28Å; P642-R666 WeakPolarHBondContact O-CD 3.28Å; P642-R666 PolarHBondContact O-NH1 3.26Å
643	A	78.4	Confident	83.9	Confident	50 Å²	50	61.7 Å²	61.7	41%	0.413	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-66.2	151.1	161.3	0	0	0	0	0	110.4	F641 G645 K646	F641-A643 PolarHBondContact O-N 3.17Å; A643-G645 PolarHBondContact O-N 2.99Å; A643-K646 HydrophobicContact CB-CG 3.95Å; A643-K646 VanDerWaalsContact O-CB 3.32Å; A643-K646 WeakPolarHBondContact O-CB 3.43Å; A643-K646 PolarHBondContact O-N 3.15Å; A643-K646 VanDerWaalsContact O-N 3.1Å
644	P	76.1	Confident	83.5	Confident	53 Å²	53	62.1 Å²	62.1	34%	0.344	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	140.3	175.3	-26.5	35.1	0	0	0	112.2	K646	P644-K646 PolarHBondContact O-N 3.38Å
645	G	75.9	Confident	83.1	Confident	23 Å²	23	59.6 Å²	59.6	24%	0.237	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	11.7	-176.4	0	0	0	0	0	115.6	A643 R666 P667 N668	A643-G645 PolarHBondContact O-N 2.99Å; G645-R666 VanDerWaalsContact CA-O 3.28Å; G645-R666 WeakPolarHBondContact CA-O 3.42Å; G645-R666 PolarHBondContact N-O 3.3Å; G645-P667 PolarHBondContact N-O 2.89Å; G645-N668 WeakPolarHBondContact CA-OD1 3.45Å
646	K	81.6	Confident	82.7	Confident	130 Å²	130	62.5 Å²	62.5	57%	0.565	35%	0.348	S	S	*	.			trans	-109.8	158.3	177.4	-56	-56.5	174	-163.6	0	112.2	A643 P644 R666	A643-K646 HydrophobicContact CB-CG 3.95Å; A643-K646 VanDerWaalsContact O-CB 3.32Å; A643-K646 WeakPolarHBondContact O-CB 3.43Å; A643-K646 PolarHBondContact O-N 3.15Å; A643-K646 VanDerWaalsContact O-N 3.1Å; P644-K646 PolarHBondContact O-N 3.38Å; K646-R666 PolarHBondContact O-N 3.19Å
647	I	85.1	Confident	82.3	Confident	83 Å²	83	65 Å²	65	43%	0.426	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.9	179.3	-57.1	176.1	0	0	0	107.6	K649 E663 L664 R665	I647-K649 HydrophobicContact CG2-CG 4.49Å; I647-E663 HydrophobicContact CG2-CB 3.78Å; I647-E663 HydrophobicContact CG2-CG 4.39Å; I647-L664 WeakPolarHBondContact CA-O 3.34Å; I647-R665 HydrophobicContact CG1-CB 4Å; I647-R665 HydrophobicContact CG1-CG 4.1Å
648	I	86.7	Confident	82.2	Confident	14 Å²	14	63.4 Å²	63.4	7%	0.072	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	136.7	166.2	-55.9	160.3	0	0	0	107.7	P640 P642 V650 E663 L664	P640-I648 WeakPolarHBondContact O-CD1 3.41Å; P640-I648 WeakPolarHBondContact O-CG1 3.46Å; P642-I648 HydrophobicContact CB-CD1 3.68Å; P642-I648 HydrophobicContact CB-CG1 3.99Å; P642-I648 HydrophobicContact CG-CD1 3.73Å; I648-V650 HydrophobicContact CG2-CG2 3.73Å; I648-E663 WeakPolarHBondContact O-CA 3.48Å; I648-L664 HydrophobicContact CB-CB 4.38Å; I648-L664 PolarHBondContact N-O 3.29Å; I648-L664 PolarHBondContact O-N 2.96Å
649	K	87.3	Confident	82.1	Confident	126 Å²	126	63.7 Å²	63.7	55%	0.548	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	95.3	172.6	-59.9	-152.8	-177.6	-153.9	0	109.5	I647 K651 V661 I662 E663	I647-K649 HydrophobicContact CG2-CG 4.49Å; K649-K651 PolarHBondContact O-N 3.13Å; K649-V661 HydrophobicContact CB-CG1 3.72Å; K649-V661 HydrophobicContact CD-CG1 4.32Å; K649-V661 HydrophobicContact CG-CG1 4.43Å; K649-I662 WeakPolarHBondContact CA-O 3.4Å; K649-E663 HydrophobicContact CD-CG 4.24Å; K649-E663 VanDerWaalsContact CE-OE1 3.29Å; K649-E663 WeakPolarHBondContact CE-OE1 3.4Å; K649-E663 WeakPolarHBondContact CE-OE2 3.3Å; K649-E663 HydrophobicContact CG-CG 4.22Å; K649-E663 IonicContact NZ-OE1 2.64Å; K649-E663 PolarHBondContact NZ-OE1 3.28Å; K649-E663 IonicContact NZ-OE2 3.03Å; K649-E663 PolarHBondContact NZ-OE2 3.32Å
650	V	87.1	Confident	82.2	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.012	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	109.6	-177.9	-171.3	0	0	0	0	108.2	L636 I648 T652 I662 L664	L636-V650 HydrophobicContact CD2-CG1 4.15Å; L636-V650 HydrophobicContact CD2-CG2 4.04Å; I648-V650 HydrophobicContact CG2-CG2 3.73Å; V650-T652 HydrophobicContact CG1-CG2 3.95Å; V650-I662 HydrophobicContact CB-CB 4.46Å; V650-I662 PolarHBondContact N-O 3.07Å; V650-I662 PolarHBondContact O-N 3.32Å; V650-L664 HydrophobicContact CG2-CD1 3.86Å; V650-L664 HydrophobicContact CG2-CG 4.3Å
651	K	84.7	Confident	82.4	Confident	169 Å²	169	64.3 Å²	64.3	74%	0.735	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.3	130.8	172.5	-67.1	-175.6	177.8	-178	0	109.1	K649 V661	K649-K651 PolarHBondContact O-N 3.13Å; K651-V661 HydrophobicContact CG-CG2 4.33Å
652	T	81.3	Confident	83	Confident	9 Å²	9	63 Å²	63	6%	0.055	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	156.2	179.4	66.3	0	0	0	0	110.6	R621 F632 V650 N659 E660 I662	R621-T652 VanDerWaalsContact NH2-CB 3.33Å; R621-T652 PolarHBondContact NH2-OG1 3.07Å; F632-T652 HydrophobicContact CD2-CG2 3.71Å; F632-T652 HydrophobicContact CE2-CG2 4.07Å; V650-T652 HydrophobicContact CG1-CG2 3.95Å; T652-N659 CarbonylContact O-C 3.56Å; T652-N659 WeakPolarHBondContact O-CA 3.21Å; T652-E660 PolarHBondContact N-O 2.94Å; T652-E660 PolarHBondContact O-N 3.03Å; T652-E660 VanDerWaalsContact O-O 3.14Å; T652-E660 PolarHBondContact OG1-O 3.27Å; T652-I662 HydrophobicContact CG2-CD1 3.7Å
653	F	81.7	Confident	83.6	Confident	123 Å²	123	67.4 Å²	67.4	54%	0.539	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	141.3	169.8	-178.6	-105	0	0	0	109.9	R621 P655 G658	R621-F653 PolarHBondContact NH1-O 3.22Å; R621-F653 PolarHBondContact NH2-O 3.4Å; F653-P655 HydrophobicContact CE1-CG 4.1Å; F653-G658 WeakPolarHBondContact CA-O 3.16Å; F653-G658 VanDerWaalsContact CD2-O 3.3Å; F653-G658 WeakPolarHBondContact CD2-O 3.38Å
654	L	85	Confident	84	Confident	9 Å²	9	65.1 Å²	65.1	5%	0.047	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.2	165.6	-169.5	84.9	0	0	0	109	R621 L628 G656 A657 G658 E660	R621-L654 HydrophobicContact CG-CD1 3.78Å; L628-L654 HydrophobicContact CD1-CD1 4.03Å; L654-G656 PolarHBondContact O-N 3.07Å; L654-A657 HydrophobicContact CB-CB 4.29Å; L654-A657 HydrophobicContact CD2-CB 4.01Å; L654-A657 PolarHBondContact O-N 3.02Å; L654-G658 PolarHBondContact N-O 3.05Å; L654-G658 PolarHBondContact O-N 3.4Å; L654-E660 WeakPolarHBondContact CB-OE2 3.4Å
655	P	83.2	Confident	84.3	Confident	59 Å²	59	68.8 Å²	68.8	38%	0.383	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	135	169.9	-25.5	34.8	0	0	0	111.4	L628 F653 A657	L628-P655 HydrophobicContact CD1-CG 4.12Å; L628-P655 HydrophobicContact CD2-CG 3.85Å; F653-P655 HydrophobicContact CE1-CG 4.1Å; P655-A657 VanDerWaalsContact C-N 3.29Å; P655-A657 PolarHBondContact O-N 3.35Å
656	G	81.2	Confident	84.6	Confident	96 Å²	96	68.2 Å²	68.2	99%	0.99	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-38.5	-177.2	0	0	0	0	0	115.1	L654	L654-G656 PolarHBondContact O-N 3.07Å
657	A	81.8	Confident	84.3	Confident	55 Å²	55	63.2 Å²	63.2	46%	0.455	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-22.3	178.1	0	0	0	0	0	113.9	L654 P655 E660	L654-A657 HydrophobicContact CB-CB 4.29Å; L654-A657 HydrophobicContact CD2-CB 4.01Å; L654-A657 PolarHBondContact O-N 3.02Å; P655-A657 VanDerWaalsContact C-N 3.29Å; P655-A657 PolarHBondContact O-N 3.35Å; A657-E660 HydrophobicContact CB-CG 4.27Å
658	G	84.4	Confident	83.6	Confident	25 Å²	25	63.6 Å²	63.6	26%	0.258	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	89.7	-140.1	177	0	0	0	0	0	113.4	F653 L654	F653-G658 WeakPolarHBondContact CA-O 3.16Å; F653-G658 VanDerWaalsContact CD2-O 3.3Å; F653-G658 WeakPolarHBondContact CD2-O 3.38Å; L654-G658 PolarHBondContact N-O 3.05Å; L654-G658 PolarHBondContact O-N 3.4Å
659	N	84.5	Confident	83	Confident	143 Å²	143	65.3 Å²	65.3	77%	0.765	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	106.3	178	-81.1	-27.2	0	0	0	110.2	T652	T652-N659 CarbonylContact O-C 3.56Å; T652-N659 WeakPolarHBondContact O-CA 3.21Å
660	E	85.2	Confident	82.2	Confident	53 Å²	53	62.5 Å²	62.5	25%	0.248	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	153.4	179.3	-66.6	172.3	115.8	0	0	110.8	R620 T652 L654 A657	R620-E660 IonicContact CZ-OE1 2.9Å; R620-E660 IonicContact CZ-OE2 3.44Å; R620-E660 IonicContact NH1-OE1 3.69Å; R620-E660 PolarHBondContact NH1-OE1 3Å; R620-E660 IonicContact NH1-OE2 2.76Å; R620-E660 PolarHBondContact NH1-OE2 3.34Å; R620-E660 VanDerWaalsContact NH1-OE2 3.16Å; R620-E660 IonicContact NH2-OE1 3.63Å; R620-E660 IonicContact NH2-OE2 3.2Å; R620-E660 PolarHBondContact NH2-OE2 3.33Å; T652-E660 PolarHBondContact N-O 2.94Å; T652-E660 PolarHBondContact O-N 3.03Å; T652-E660 VanDerWaalsContact O-O 3.14Å; T652-E660 PolarHBondContact OG1-O 3.27Å; L654-E660 WeakPolarHBondContact CB-OE2 3.4Å; A657-E660 HydrophobicContact CB-CG 4.27Å
661	V	87	Confident	81.8	Confident	78 Å²	78	64.7 Å²	64.7	47%	0.473	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	114.7	178.8	-176.5	0	0	0	0	109	K649 K651	K649-V661 HydrophobicContact CB-CG1 3.72Å; K649-V661 HydrophobicContact CD-CG1 4.32Å; K649-V661 HydrophobicContact CG-CG1 4.43Å; K651-V661 HydrophobicContact CG-CG2 4.33Å
662	I	88.8	Confident	81.5	Confident	20 Å²	20	57.8 Å²	57.8	10%	0.103	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	129.2	178.5	-57.9	156.2	0	0	0	108.3	T613 E617 F632 K649 V650 T652 L664	T613-I662 HydrophobicContact CG2-CG2 4.26Å; E617-I662 HydrophobicContact CG-CD1 3.67Å; F632-I662 HydrophobicContact CD2-CD1 4.25Å; F632-I662 HydrophobicContact CE2-CD1 3.46Å; F632-I662 VanDerWaalsContact CE2-CD1 3.46Å; F632-I662 HydrophobicContact CZ-CD1 3.9Å; K649-I662 WeakPolarHBondContact CA-O 3.4Å; V650-I662 HydrophobicContact CB-CB 4.46Å; V650-I662 PolarHBondContact N-O 3.07Å; V650-I662 PolarHBondContact O-N 3.32Å; T652-I662 HydrophobicContact CG2-CD1 3.7Å; I662-L664 HydrophobicContact CG2-CD2 3.86Å; I662-L664 HydrophobicContact CG2-CG 4.24Å
663	E	89.4	Confident	81.3	Confident	96 Å²	96	57.4 Å²	57.4	45%	0.449	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	100	-179.1	-61.9	-154.3	-164.7	0	0	110.9	I647 I648 K649 R665	I647-E663 HydrophobicContact CG2-CB 3.78Å; I647-E663 HydrophobicContact CG2-CG 4.39Å; I648-E663 WeakPolarHBondContact O-CA 3.48Å; K649-E663 HydrophobicContact CD-CG 4.24Å; K649-E663 VanDerWaalsContact CE-OE1 3.29Å; K649-E663 WeakPolarHBondContact CE-OE1 3.4Å; K649-E663 WeakPolarHBondContact CE-OE2 3.3Å; K649-E663 HydrophobicContact CG-CG 4.22Å; K649-E663 IonicContact NZ-OE1 2.64Å; K649-E663 PolarHBondContact NZ-OE1 3.28Å; K649-E663 IonicContact NZ-OE2 3.03Å; K649-E663 PolarHBondContact NZ-OE2 3.32Å; E663-R665 PolarHBondContact O-N 2.82Å
664	L	86.6	Confident	81	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	96.5	177.9	-59.4	-179.9	0	0	0	109.4	L499 L610 T613 I614 L636 I647 I648 V650 I662	L499-L664 HydrophobicContact CD2-CD1 4.25Å; L610-L664 HydrophobicContact CD1-CB 4.03Å; L610-L664 HydrophobicContact CG-CB 4.2Å; L610-L664 HydrophobicContact CG-CD2 4.47Å; T613-L664 HydrophobicContact CG2-CD2 3.85Å; I614-L664 HydrophobicContact CD1-CD1 3.99Å; I614-L664 HydrophobicContact CG1-CD1 4.07Å; I614-L664 HydrophobicContact CG1-CD2 3.96Å; L636-L664 HydrophobicContact CD2-CD1 3.71Å; I647-L664 WeakPolarHBondContact CA-O 3.34Å; I648-L664 HydrophobicContact CB-CB 4.38Å; I648-L664 PolarHBondContact N-O 3.29Å; I648-L664 PolarHBondContact O-N 2.96Å; V650-L664 HydrophobicContact CG2-CD1 3.86Å; V650-L664 HydrophobicContact CG2-CG 4.3Å; I662-L664 HydrophobicContact CG2-CD2 3.86Å; I662-L664 HydrophobicContact CG2-CG 4.24Å
665	R	82.2	Confident	81.1	Confident	131 Å²	131	52.9 Å²	52.9	49%	0.494	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	133	172.6	-177.8	173.8	179.3	162.9	-3.3	110.2	I647 E663 E821	I647-R665 HydrophobicContact CG1-CB 4Å; I647-R665 HydrophobicContact CG1-CG 4.1Å; E663-R665 PolarHBondContact O-N 2.82Å; R665-E821 IonicContact CZ-OE1 2.86Å; R665-E821 IonicContact NH2-OE1 3.69Å; R665-E821 PolarHBondContact NH2-OE1 3.04Å
666	R	82	Confident	81.4	Confident	10 Å²	10	52.9 Å²	52.9	4%	0.038	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-98	122.7	159.2	-172.6	175.6	179.8	-173.4	-0.6	108.9	P642 G645 K646 E673	P642-R666 HydrophobicContact CB-CB 3.87Å; P642-R666 HydrophobicContact CG-CB 4.28Å; P642-R666 WeakPolarHBondContact O-CD 3.28Å; P642-R666 PolarHBondContact O-NH1 3.26Å; G645-R666 VanDerWaalsContact CA-O 3.28Å; G645-R666 WeakPolarHBondContact CA-O 3.42Å; G645-R666 PolarHBondContact N-O 3.3Å; K646-R666 PolarHBondContact O-N 3.19Å; R666-E673 HydrophobicContact CG-CG 4.45Å; R666-E673 WeakPolarHBondContact CG-OE1 3.27Å; R666-E673 IonicContact CZ-OE1 3.4Å; R666-E673 IonicContact CZ-OE2 3.22Å; R666-E673 VanDerWaalsContact NE-CD 3.28Å; R666-E673 IonicContact NE-OE1 2.96Å; R666-E673 PolarHBondContact NE-OE1 2.75Å; R666-E673 IonicContact NE-OE2 3.77Å; R666-E673 PolarHBondContact NE-OE2 2.94Å; R666-E673 VanDerWaalsContact NE-OE2 3.16Å; R666-E673 IonicContact NH2-OE1 3.55Å; R666-E673 PolarHBondContact NH2-OE1 3.47Å; R666-E673 VanDerWaalsContact NH2-OE1 3.07Å; R666-E673 IonicContact NH2-OE2 3.22Å; R666-E673 PolarHBondContact NH2-OE2 3.29Å
667	P	75.9	Confident	82	Confident	26 Å²	26	48.3 Å²	48.3	17%	0.169	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-47	157.1	172.7	-32.9	35.1	0	0	0	114.9	G645 E673	G645-P667 PolarHBondContact N-O 2.89Å; P667-E673 HydrophobicContact CB-CG 3.92Å; P667-E673 HydrophobicContact CG-CG 3.97Å
668	N	70.3	Confident	82.5	Confident	90 Å²	90	48.4 Å²	48.4	48%	0.481	25%	0.254	S	S	.	.	S	Bend	trans	-71	-33.9	175.5	-96.4	-42.5	0	0	0	112.8	G645 E821	G645-N668 WeakPolarHBondContact CA-OD1 3.45Å; N668-E821 PolarHBondContact ND2-OE1 2.74Å; N668-E821 PolarHBondContact ND2-OE2 2.86Å
669	D	74.1	Confident	82.9	Confident	50 Å²	50	48.2 Å²	48.2	27%	0.267	25%	0.249	S	C	.	.			trans	-101.3	102.2	179.4	-166.7	-28.7	0	0	0	111.7	R671 L672 E673	D669-R671 PolarHBondContact O-N 3.31Å; D669-R671 VanDerWaalsContact OD1-CB 3.27Å; D669-R671 WeakPolarHBondContact OD1-CB 3.23Å; D669-R671 WeakPolarHBondContact OD1-CD 3.26Å; D669-R671 WeakPolarHBondContact OD1-CG 3.42Å; D669-R671 IonicContact OD1-CZ 2.66Å; D669-R671 PolarHBondContact OD1-N 3.41Å; D669-R671 IonicContact OD1-NE 3.34Å; D669-R671 PolarHBondContact OD1-NE 3.39Å; D669-R671 IonicContact OD1-NH2 3.97Å; D669-R671 IonicContact OD2-CZ 3.39Å; D669-R671 VanDerWaalsContact OD2-CZ 3.28Å; D669-R671 IonicContact OD2-NE 3.12Å; D669-R671 PolarHBondContact OD2-NE 2.94Å; D669-R671 VanDerWaalsContact OD2-NE 3.09Å; D669-R671 IonicContact OD2-NH2 3.77Å; D669-R671 PolarHBondContact OD2-NH2 3.45Å; D669-L672 PolarHBondContact O-N 2.81Å; D669-L672 VanDerWaalsContact O-N 3.09Å; D669-E673 PolarHBondContact O-N 2.68Å
670	S	70.7	Confident	83.5	Confident	67 Å²	67	41.4 Å²	41.4	47%	0.469	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-1.7	-175.8	69.7	0	0	0	0	115.8	E673	S670-E673 WeakPolarHBondContact CA-OE1 3.46Å; S670-E673 WeakPolarHBondContact CB-OE1 3.41Å
671	R	78.9	Confident	84	Confident	49 Å²	49	39.8 Å²	39.8	19%	0.185	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-22.7	175.2	-47.7	170.2	-54.1	109.5	7.3	111.9	D669 Y724 S830	D669-R671 PolarHBondContact O-N 3.31Å; D669-R671 VanDerWaalsContact OD1-CB 3.27Å; D669-R671 WeakPolarHBondContact OD1-CB 3.23Å; D669-R671 WeakPolarHBondContact OD1-CD 3.26Å; D669-R671 WeakPolarHBondContact OD1-CG 3.42Å; D669-R671 IonicContact OD1-CZ 2.66Å; D669-R671 PolarHBondContact OD1-N 3.41Å; D669-R671 IonicContact OD1-NE 3.34Å; D669-R671 PolarHBondContact OD1-NE 3.39Å; D669-R671 IonicContact OD1-NH2 3.97Å; D669-R671 IonicContact OD2-CZ 3.39Å; D669-R671 VanDerWaalsContact OD2-CZ 3.28Å; D669-R671 IonicContact OD2-NE 3.12Å; D669-R671 PolarHBondContact OD2-NE 2.94Å; D669-R671 VanDerWaalsContact OD2-NE 3.09Å; D669-R671 IonicContact OD2-NH2 3.77Å; D669-R671 PolarHBondContact OD2-NH2 3.45Å; R671-Y724 HydrophobicContact CG-CD2 4.27Å; R671-Y724 HydrophobicContact CG-CE2 4.12Å; R671-S830 PolarHBondContact NH1-OG 2.83Å; R671-S830 PolarHBondContact NH2-OG 3.04Å
672	L	78	Confident	84.4	Confident	23 Å²	23	44.9 Å²	44.9	12%	0.12	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-3.4	-173.4	-59.3	178.6	0	0	0	113.1	D669 H674 V675 F677 N826	D669-L672 PolarHBondContact O-N 2.81Å; D669-L672 VanDerWaalsContact O-N 3.09Å; L672-H674 PolarHBondContact O-N 2.96Å; L672-V675 HydrophobicContact CD2-CB 4.34Å; L672-V675 HydrophobicContact CD2-CG1 4.49Å; L672-V675 HydrophobicContact CD2-CG2 4.32Å; L672-V675 PolarHBondContact O-N 3.23Å; L672-F677 HydrophobicContact CD2-CE2 4.15Å; L672-N826 HydrophobicContact CD1-CB 4.28Å
673	E	76	Confident	84.8	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.009	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-18.7	170.7	-78.4	178.4	-148.7	0	0	114.1	G606 C607 F608 R666 P667 D669 S670	G606-E673 CarbonylContact O-C 3.57Å; G606-E673 WeakPolarHBondContact O-CB 3.33Å; C607-E673 CarbonylContact C-O 3.51Å; C607-E673 WeakPolarHBondContact CA-O 3.46Å; C607-E673 HydrophobicContact CB-CB 4.14Å; C607-E673 HydrophobicContact CB-CG 4.41Å; F608-E673 PolarHBondContact N-O 3.39Å; R666-E673 HydrophobicContact CG-CG 4.45Å; R666-E673 WeakPolarHBondContact CG-OE1 3.27Å; R666-E673 IonicContact CZ-OE1 3.4Å; R666-E673 IonicContact CZ-OE2 3.22Å; R666-E673 VanDerWaalsContact NE-CD 3.28Å; R666-E673 IonicContact NE-OE1 2.96Å; R666-E673 PolarHBondContact NE-OE1 2.75Å; R666-E673 IonicContact NE-OE2 3.77Å; R666-E673 PolarHBondContact NE-OE2 2.94Å; R666-E673 VanDerWaalsContact NE-OE2 3.16Å; R666-E673 IonicContact NH2-OE1 3.55Å; R666-E673 PolarHBondContact NH2-OE1 3.47Å; R666-E673 VanDerWaalsContact NH2-OE1 3.07Å; R666-E673 IonicContact NH2-OE2 3.22Å; R666-E673 PolarHBondContact NH2-OE2 3.29Å; P667-E673 HydrophobicContact CB-CG 3.92Å; P667-E673 HydrophobicContact CG-CG 3.97Å; D669-E673 PolarHBondContact O-N 2.68Å; S670-E673 WeakPolarHBondContact CA-OE1 3.46Å; S670-E673 WeakPolarHBondContact CB-OE1 3.41Å
674	H	76.9	Confident	85.2	Confident	23 Å²	23	40.7 Å²	40.7	11%	0.106	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.9	12.7	-173.6	-107.7	-1.2	0	0	0	116.3	F580 Y582 G606 C607 F608 F611 L672	F580-H674 AromaticContact CD1-CD2 3.59Å; F580-H674 AromaticContact CE1-CD2 3.14Å; F580-H674 WeakPolarHBondContact CE1-CD2 3.45Å; F580-H674 AromaticContact CE2-CD2 3.9Å; F580-H674 AromaticContact CZ-CD2 3.34Å; F580-H674 WeakPolarHBondContact CZ-CD2 3.3Å; Y582-H674 AromaticContact CD1-NE2 3.71Å; Y582-H674 AromaticContact CE1-NE2 2.6Å; Y582-H674 WeakPolarHBondContact CE1-NE2 3.25Å; Y582-H674 AromaticContact CE2-NE2 3.94Å; Y582-H674 AromaticContact CZ-NE2 2.75Å; Y582-H674 PolarHBondContact OH-NE2 2.87Å; G606-H674 VanDerWaalsContact C-CG 3.45Å; G606-H674 VanDerWaalsContact CA-CD2 3.44Å; G606-H674 WeakPolarHBondContact CA-CD2 3.41Å; G606-H674 WeakPolarHBondContact O-CB 3.31Å; G606-H674 PolarHBondContact O-CD2 3.26Å; G606-H674 VanDerWaalsContact O-CD2 3.24Å; G606-H674 PolarHBondContact O-CE1 3.07Å; G606-H674 PolarHBondContact O-N 3.4Å; G606-H674 PolarHBondContact O-ND1 2.89Å; G606-H674 VanDerWaalsContact O-ND1 3.16Å; C607-H674 WeakPolarHBondContact CA-NE2 3.43Å; C607-H674 PolarHBondContact N-NE2 2.84Å; C607-H674 PolarHBondContact O-NE2 3.23Å; F608-H674 WeakPolarHBondContact CA-CE1 3.43Å; F608-H674 WeakPolarHBondContact CA-NE2 3.01Å; F608-H674 WeakPolarHBondContact CB-CE1 3.49Å; F608-H674 WeakPolarHBondContact CB-ND1 3.12Å; F608-H674 AromaticContact CG-CE1 3.83Å; F608-H674 PolarHBondContact N-CE1 2.68Å; F608-H674 PolarHBondContact N-ND1 3.31Å; F608-H674 PolarHBondContact N-NE2 3.36Å; F611-H674 AromaticContact CD2-NE2 3.83Å; L672-H674 PolarHBondContact O-N 2.96Å
675	V	85.9	Confident	85.6	Confident	14 Å²	14	43 Å²	43	9%	0.085	21%	0.214	C	C	.	.			trans	-126.7	120	-157.1	-176	0	0	0	0	111.1	L672 F677 A718 A721 N826	L672-V675 HydrophobicContact CD2-CB 4.34Å; L672-V675 HydrophobicContact CD2-CG1 4.49Å; L672-V675 HydrophobicContact CD2-CG2 4.32Å; L672-V675 PolarHBondContact O-N 3.23Å; V675-F677 HydrophobicContact CB-CE2 4.48Å; V675-F677 HydrophobicContact CG1-CD1 4.24Å; V675-F677 HydrophobicContact CG1-CD2 3.46Å; V675-F677 VanDerWaalsContact CG1-CD2 3.46Å; V675-F677 HydrophobicContact CG1-CE1 4.01Å; V675-F677 HydrophobicContact CG1-CE2 3.27Å; V675-F677 HydrophobicContact CG1-CG 4Å; V675-F677 HydrophobicContact CG1-CZ 3.56Å; V675-A718 HydrophobicContact CG1-CB 4.36Å; V675-A721 HydrophobicContact CB-CB 4.39Å; V675-A721 HydrophobicContact CG1-CB 3.89Å; V675-A721 HydrophobicContact CG2-CB 3.53Å; V675-N826 PolarHBondContact O-ND2 2.91Å
676	D	89	Confident	86.3	Confident	58 Å²	58	37.3 Å²	37.3	31%	0.31	19%	0.194	S	C	.	.			trans	-114.7	99.2	167.4	169.4	19.2	0	0	0	109	D678 S679 S714	D676-D678 VanDerWaalsContact C-N 3.3Å; D676-D678 WeakPolarHBondContact OD1-CA 3.4Å; D676-D678 WeakPolarHBondContact OD1-CB 3.39Å; D676-D678 PolarHBondContact OD1-N 2.93Å; D676-S679 PolarHBondContact OD1-N 3.24Å; D676-S679 WeakPolarHBondContact OD2-CB 3.22Å; D676-S679 PolarHBondContact OD2-N 3.3Å; D676-S679 PolarHBondContact OD2-OG 2.81Å; D676-S714 PolarHBondContact OD2-OG 2.8Å
677	F	94	Very high	86.9	Confident	1 Å²	1	43.8 Å²	43.8	0%	0.004	22%	0.219	C	C	.	.	H	α-helix	trans	-76.9	-15.3	173.8	-72.6	-66.7	0	0	0	113.3	L672 V675 L680 F681 A718 A721 L722 L825 N826 V829	L672-F677 HydrophobicContact CD2-CE2 4.15Å; V675-F677 HydrophobicContact CB-CE2 4.48Å; V675-F677 HydrophobicContact CG1-CD1 4.24Å; V675-F677 HydrophobicContact CG1-CD2 3.46Å; V675-F677 VanDerWaalsContact CG1-CD2 3.46Å; V675-F677 HydrophobicContact CG1-CE1 4.01Å; V675-F677 HydrophobicContact CG1-CE2 3.27Å; V675-F677 HydrophobicContact CG1-CG 4Å; V675-F677 HydrophobicContact CG1-CZ 3.56Å; F677-L680 HydrophobicContact CD1-CD2 4.05Å; F677-L680 PolarHBondContact O-N 3.38Å; F677-F681 HydrophobicContact CB-CD2 4.25Å; F677-F681 HydrophobicContact CB-CE2 4.26Å; F677-F681 WeakPolarHBondContact O-CD2 3.41Å; F677-F681 PolarHBondContact O-N 3.17Å; F677-A718 HydrophobicContact CD1-CB 3.81Å; F677-A718 HydrophobicContact CE1-CB 4.01Å; F677-A718 VanDerWaalsContact CE1-O 3.26Å; F677-A718 WeakPolarHBondContact CE1-O 3.49Å; F677-A721 HydrophobicContact CZ-CB 3.87Å; F677-L722 HydrophobicContact CD1-CD2 4.2Å; F677-L722 HydrophobicContact CE1-CD2 3.27Å; F677-L722 HydrophobicContact CE1-CG 3.86Å; F677-L722 HydrophobicContact CZ-CD2 3.67Å; F677-L722 HydrophobicContact CZ-CG 4.42Å; F677-L825 HydrophobicContact CB-CD2 4.34Å; F677-L825 HydrophobicContact CB-CG 4.34Å; F677-N826 HydrophobicContact CD2-CB 4.17Å; F677-N826 WeakPolarHBondContact CD2-OD1 3.44Å; F677-N826 PolarHBondContact N-OD1 3.31Å; F677-V829 HydrophobicContact CB-CB 4.49Å; F677-V829 HydrophobicContact CB-CG2 4.21Å; F677-V829 HydrophobicContact CD1-CB 4.45Å; F677-V829 HydrophobicContact CD1-CG1 3.7Å; F677-V829 HydrophobicContact CD2-CB 3.82Å; F677-V829 HydrophobicContact CD2-CG1 3.86Å; F677-V829 HydrophobicContact CD2-CG2 4.41Å; F677-V829 HydrophobicContact CE1-CG1 3.71Å; F677-V829 HydrophobicContact CE2-CB 4Å; F677-V829 HydrophobicContact CE2-CG1 3.81Å; F677-V829 HydrophobicContact CG-CB 4.02Å; F677-V829 HydrophobicContact CG-CG1 3.78Å; F677-V829 HydrophobicContact CG-CG2 4.26Å; F677-V829 HydrophobicContact CZ-CB 4.44Å; F677-V829 HydrophobicContact CZ-CG1 3.74Å
678	D	93	Very high	87.8	Confident	57 Å²	57	43.6 Å²	43.6	31%	0.305	22%	0.216	S	C	.	.	H	α-helix	trans	-72.2	-41.6	177.9	-154.6	58.6	0	0	0	110.3	D676 L680 F681 R682 L825	D676-D678 VanDerWaalsContact C-N 3.3Å; D676-D678 WeakPolarHBondContact OD1-CA 3.4Å; D676-D678 WeakPolarHBondContact OD1-CB 3.39Å; D676-D678 PolarHBondContact OD1-N 2.93Å; D678-L680 VanDerWaalsContact C-N 3.26Å; D678-L680 PolarHBondContact O-N 3.29Å; D678-F681 PolarHBondContact O-N 2.97Å; D678-R682 WeakPolarHBondContact O-CB 3.26Å; D678-R682 WeakPolarHBondContact O-CG 3.29Å; D678-R682 PolarHBondContact O-N 3.01Å; D678-R682 IonicContact OD2-CZ 3.99Å; D678-R682 IonicContact OD2-NE 2.76Å; D678-R682 PolarHBondContact OD2-NE 3.42Å; D678-R682 IonicContact OD2-NH2 3.22Å; D678-R682 PolarHBondContact OD2-NH2 3.32Å; D678-L825 HydrophobicContact CB-CD2 3.68Å; D678-L825 WeakPolarHBondContact OD1-CD2 3.34Å
679	S	93.3	Very high	89.1	Confident	21 Å²	21	39.3 Å²	39.3	15%	0.147	19%	0.193	C	C	.	.	H	α-helix	trans	-52.8	-44.1	167	-78.8	0	0	0	0	112.3	D676 R682 C683 S714	D676-S679 PolarHBondContact OD1-N 3.24Å; D676-S679 WeakPolarHBondContact OD2-CB 3.22Å; D676-S679 PolarHBondContact OD2-N 3.3Å; D676-S679 PolarHBondContact OD2-OG 2.81Å; S679-R682 PolarHBondContact O-N 2.85Å; S679-C683 PolarHBondContact O-N 3.12Å; S679-C683 PolarHBondContact O-SG 3.31Å; S679-S714 WeakPolarHBondContact CB-OG 3.34Å; S679-S714 PolarHBondContact OG-OG 2.92Å
680	L	96.3	Very high	90.2	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-48.9	178.8	-176.9	64.6	0	0	0	112	F677 D678 R682 C683 L684 V689 C715 A718 V719 L722	F677-L680 HydrophobicContact CD1-CD2 4.05Å; F677-L680 PolarHBondContact O-N 3.38Å; D678-L680 VanDerWaalsContact C-N 3.26Å; D678-L680 PolarHBondContact O-N 3.29Å; L680-R682 VanDerWaalsContact C-N 3.32Å; L680-R682 PolarHBondContact O-N 2.76Å; L680-C683 PolarHBondContact O-N 3.02Å; L680-L684 HydrophobicContact CD1-CD1 4.03Å; L680-L684 PolarHBondContact O-N 3.2Å; L680-V689 HydrophobicContact CD1-CG2 4.32Å; L680-V689 HydrophobicContact CD2-CG1 4.01Å; L680-V689 HydrophobicContact CD2-CG2 4.15Å; L680-V689 HydrophobicContact CG-CG2 4Å; L680-C715 HydrophobicContact CD1-CB 4.03Å; L680-A718 HydrophobicContact CB-CB 3.97Å; L680-A718 HydrophobicContact CD2-CB 3.98Å; L680-A718 HydrophobicContact CG-CB 4.48Å; L680-V719 HydrophobicContact CD1-CG1 3.63Å; L680-V719 HydrophobicContact CD2-CG1 3.8Å; L680-V719 HydrophobicContact CG-CG1 4.39Å; L680-L722 HydrophobicContact CD2-CD1 4.42Å
681	F	96.3	Very high	91.3	Very high	19 Å²	19	35.7 Å²	35.7	8%	0.083	17%	0.165	C	C	.	.	H	α-helix	trans	-79.6	-8	-178	-70.6	-63.1	0	0	0	114.8	F677 D678 V686 V689 L803 V829	F677-F681 HydrophobicContact CB-CD2 4.25Å; F677-F681 HydrophobicContact CB-CE2 4.26Å; F677-F681 WeakPolarHBondContact O-CD2 3.41Å; F677-F681 PolarHBondContact O-N 3.17Å; D678-F681 PolarHBondContact O-N 2.97Å; F681-V686 HydrophobicContact CD1-CG2 4.31Å; F681-V686 HydrophobicContact CE1-CG2 4.06Å; F681-V689 HydrophobicContact CD1-CG2 4.23Å; F681-V689 HydrophobicContact CE1-CB 4.21Å; F681-V689 HydrophobicContact CE1-CG1 4.25Å; F681-V689 HydrophobicContact CE1-CG2 3.86Å; F681-V689 HydrophobicContact CZ-CG1 4.32Å; F681-L803 HydrophobicContact CE2-CD2 4.5Å; F681-L803 HydrophobicContact CZ-CD1 4.44Å; F681-L803 HydrophobicContact CZ-CD2 4.04Å; F681-V829 HydrophobicContact CD2-CG2 4.46Å; F681-V829 HydrophobicContact CE2-CG1 4.14Å; F681-V829 HydrophobicContact CE2-CG2 3.68Å
682	R	95.5	Very high	92.2	Very high	184 Å²	184	33.3 Å²	33.3	69%	0.694	16%	0.156	S	C	*	.	H	α-helix	trans	-76.9	-30.7	163	-72.8	167.7	-166.7	-176	7.5	112.5	D678 S679 L680	D678-R682 WeakPolarHBondContact O-CB 3.26Å; D678-R682 WeakPolarHBondContact O-CG 3.29Å; D678-R682 PolarHBondContact O-N 3.01Å; D678-R682 IonicContact OD2-CZ 3.99Å; D678-R682 IonicContact OD2-NE 2.76Å; D678-R682 PolarHBondContact OD2-NE 3.42Å; D678-R682 IonicContact OD2-NH2 3.22Å; D678-R682 PolarHBondContact OD2-NH2 3.32Å; S679-R682 PolarHBondContact O-N 2.85Å; L680-R682 VanDerWaalsContact C-N 3.32Å; L680-R682 PolarHBondContact O-N 2.76Å
683	C	96.6	Very high	93.1	Very high	25 Å²	25	32.3 Å²	32.3	17%	0.169	15%	0.151	C	C	.	.	H	α-helix	trans	-98.4	-34.2	-174.4	-57.5	0	0	0	0	113.3	S679 L680 T711 L775	S679-C683 PolarHBondContact O-N 3.12Å; S679-C683 PolarHBondContact O-SG 3.31Å; L680-C683 PolarHBondContact O-N 3.02Å; C683-T711 WeakPolarHBondContact SG-CG2 3.47Å; C683-L775 HydrophobicContact CB-CB 4.14Å; C683-L775 HydrophobicContact CB-CD2 3.85Å; C683-L775 WeakPolarHBondContact CB-O 3.26Å
684	L	96.9	Very high	94	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.016	15%	0.15	C	C	.	.	S	Bend	trans	-126.9	135.4	-177.5	-63.3	-179.4	0	0	0	112.1	L680 Q688 V689 F704 V773 L775 D778	L680-L684 HydrophobicContact CD1-CD1 4.03Å; L680-L684 PolarHBondContact O-N 3.2Å; L684-Q688 HydrophobicContact CB-CB 4.49Å; L684-Q688 HydrophobicContact CD2-CB 4.44Å; L684-V689 HydrophobicContact CB-CG2 3.67Å; L684-V689 HydrophobicContact CD1-CG2 4.36Å; L684-F704 HydrophobicContact CD1-CE1 4.05Å; L684-V773 HydrophobicContact CD1-CG1 3.96Å; L684-V773 HydrophobicContact CD2-CG1 3.94Å; L684-L775 HydrophobicContact CD1-CD2 3.96Å; L684-L775 HydrophobicContact CD2-CD2 4.25Å; L684-L775 HydrophobicContact CG-CD2 3.84Å; L684-D778 VanDerWaalsContact CA-OD1 3.25Å; L684-D778 WeakPolarHBondContact CA-OD1 3.45Å
685	S	96.3	Very high	94.8	Very high	49 Å²	49	31.1 Å²	31.1	34%	0.343	15%	0.145	S	C	.	.			trans	-68.9	153.8	169.7	61	0	0	0	0	111.3	R687 Q688 V689 D778	S685-R687 PolarHBondContact O-N 3.02Å; S685-R687 VanDerWaalsContact O-N 3.11Å; S685-Q688 PolarHBondContact O-N 2.91Å; S685-Q688 WeakPolarHBondContact OG-CG 3.2Å; S685-V689 PolarHBondContact O-N 2.68Å; S685-D778 WeakPolarHBondContact CB-OD2 3.48Å; S685-D778 PolarHBondContact N-OD1 2.72Å; S685-D778 PolarHBondContact OG-OD1 2.94Å; S685-D778 PolarHBondContact OG-OD2 2.92Å
686	V	96.8	Very high	95.3	Very high	13 Å²	13	30.5 Å²	30.5	8%	0.079	14%	0.141	C	C	.	.	H	α-helix	trans	-48.2	-44.9	-178.3	177.4	0	0	0	0	111.5	F681 Q688 V689 L690 E800 L803 E804	F681-V686 HydrophobicContact CD1-CG2 4.31Å; F681-V686 HydrophobicContact CE1-CG2 4.06Å; V686-Q688 PolarHBondContact O-N 3.29Å; V686-V689 PolarHBondContact O-N 2.96Å; V686-L690 HydrophobicContact CG1-CD1 4.15Å; V686-L690 HydrophobicContact CG1-CG 4.4Å; V686-L690 VanDerWaalsContact O-CG 3.31Å; V686-L690 WeakPolarHBondContact O-CG 3.36Å; V686-L690 PolarHBondContact O-N 3.3Å; V686-E800 HydrophobicContact CG1-CB 4.48Å; V686-E800 HydrophobicContact CG1-CG 4.11Å; V686-L803 HydrophobicContact CG1-CB 3.7Å; V686-L803 HydrophobicContact CG1-CD1 3.93Å; V686-L803 HydrophobicContact CG1-CG 4.49Å; V686-L803 HydrophobicContact CG2-CB 3.98Å; V686-E804 HydrophobicContact CG2-CG 4.3Å
687	R	94.2	Very high	95.5	Very high	146 Å²	146	27.8 Å²	27.8	55%	0.551	13%	0.127	S	C	*	.	H	α-helix	trans	-60.6	-38.3	178.9	179.5	171.5	170.1	162.3	-3.1	113.9	S685 R691	S685-R687 PolarHBondContact O-N 3.02Å; S685-R687 VanDerWaalsContact O-N 3.11Å; R687-R691 WeakPolarHBondContact O-CG 3.37Å; R687-R691 PolarHBondContact O-N 2.87Å
688	Q	95.3	Very high	95.2	Very high	22 Å²	22	28 Å²	28	10%	0.103	13%	0.128	C	C	.	.	H	α-helix	trans	-75.5	-40.1	177.5	-55.3	-70.5	55.5	0	0	110.7	L684 S685 V686 L690 R691 V692 D778 F780	L684-Q688 HydrophobicContact CB-CB 4.49Å; L684-Q688 HydrophobicContact CD2-CB 4.44Å; S685-Q688 PolarHBondContact O-N 2.91Å; S685-Q688 WeakPolarHBondContact OG-CG 3.2Å; V686-Q688 PolarHBondContact O-N 3.29Å; Q688-L690 VanDerWaalsContact C-N 3.28Å; Q688-L690 PolarHBondContact O-N 3.13Å; Q688-R691 PolarHBondContact O-N 3.27Å; Q688-R691 VanDerWaalsContact O-N 3.11Å; Q688-V692 WeakPolarHBondContact O-CG2 3.47Å; Q688-V692 PolarHBondContact O-N 2.87Å; Q688-D778 VanDerWaalsContact CG-OD1 3.27Å; Q688-D778 WeakPolarHBondContact CG-OD1 3.24Å; Q688-D778 PolarHBondContact NE2-O 2.87Å; Q688-F780 HydrophobicContact CB-CE2 4.48Å; Q688-F780 HydrophobicContact CB-CZ 4Å
689	V	97.4	Very high	95.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-55.8	-42.3	172.2	175.6	0	0	0	0	111.2	L680 F681 L684 S685 V686 R691 V692 F693 L722	L680-V689 HydrophobicContact CD1-CG2 4.32Å; L680-V689 HydrophobicContact CD2-CG1 4.01Å; L680-V689 HydrophobicContact CD2-CG2 4.15Å; L680-V689 HydrophobicContact CG-CG2 4Å; F681-V689 HydrophobicContact CD1-CG2 4.23Å; F681-V689 HydrophobicContact CE1-CB 4.21Å; F681-V689 HydrophobicContact CE1-CG1 4.25Å; F681-V689 HydrophobicContact CE1-CG2 3.86Å; F681-V689 HydrophobicContact CZ-CG1 4.32Å; L684-V689 HydrophobicContact CB-CG2 3.67Å; L684-V689 HydrophobicContact CD1-CG2 4.36Å; S685-V689 PolarHBondContact O-N 2.68Å; V686-V689 PolarHBondContact O-N 2.96Å; V689-R691 PolarHBondContact O-N 3.26Å; V689-V692 PolarHBondContact O-N 2.83Å; V689-F693 WeakPolarHBondContact O-CB 3.25Å; V689-F693 PolarHBondContact O-N 3.39Å; V689-L722 HydrophobicContact CG1-CD1 3.63Å
690	L	96.6	Very high	95	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-68	-32.5	177.3	-66.2	-178.8	0	0	0	113.8	V686 Q688 A694 Q796 L799 E800 L803 F833	V686-L690 HydrophobicContact CG1-CD1 4.15Å; V686-L690 HydrophobicContact CG1-CG 4.4Å; V686-L690 VanDerWaalsContact O-CG 3.31Å; V686-L690 WeakPolarHBondContact O-CG 3.36Å; V686-L690 PolarHBondContact O-N 3.3Å; Q688-L690 VanDerWaalsContact C-N 3.28Å; Q688-L690 PolarHBondContact O-N 3.13Å; L690-A694 VanDerWaalsContact O-CB 3.29Å; L690-A694 WeakPolarHBondContact O-CB 3.41Å; L690-A694 PolarHBondContact O-N 3Å; L690-Q796 HydrophobicContact CD1-CG 4.19Å; L690-L799 HydrophobicContact CD2-CD2 3.47Å; L690-L799 VanDerWaalsContact CD2-CD2 3.47Å; L690-L799 HydrophobicContact CD2-CG 3.72Å; L690-E800 HydrophobicContact CD1-CB 3.82Å; L690-E800 HydrophobicContact CD1-CG 4.21Å; L690-L803 HydrophobicContact CD2-CD1 4.16Å; L690-F833 HydrophobicContact CD2-CE1 4.19Å; L690-F833 HydrophobicContact CD2-CZ 3.8Å
691	R	95.1	Very high	94.9	Very high	39 Å²	39	26 Å²	26	15%	0.147	11%	0.113	C	C	.	.	H	α-helix	trans	-72.8	-36.9	174.2	-72.8	167.7	157.4	-162.9	-25	112.7	R687 Q688 V689 S695 F780 E787	R687-R691 WeakPolarHBondContact O-CG 3.37Å; R687-R691 PolarHBondContact O-N 2.87Å; Q688-R691 PolarHBondContact O-N 3.27Å; Q688-R691 VanDerWaalsContact O-N 3.11Å; V689-R691 PolarHBondContact O-N 3.26Å; R691-S695 WeakPolarHBondContact O-CB 3.46Å; R691-S695 PolarHBondContact O-N 3.13Å; R691-S695 PolarHBondContact O-OG 2.8Å; R691-F780 HydrophobicContact CB-CE2 4.16Å; R691-F780 HydrophobicContact CB-CZ 4.03Å; R691-E787 HydrophobicContact CB-CB 3.86Å; R691-E787 HydrophobicContact CG-CB 3.92Å
692	V	96.9	Very high	94.9	Very high	0 Å²	0	25 Å²	25	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.8	-52.5	169.4	171.2	0	0	0	0	109.8	Q688 V689 A694 S695 L696 F704 V719 L771 V773 F780	Q688-V692 WeakPolarHBondContact O-CG2 3.47Å; Q688-V692 PolarHBondContact O-N 2.87Å; V689-V692 PolarHBondContact O-N 2.83Å; V692-A694 VanDerWaalsContact C-N 3.32Å; V692-A694 PolarHBondContact O-N 2.9Å; V692-S695 CarbonylContact O-C 3.21Å; V692-S695 WeakPolarHBondContact O-CA 3.1Å; V692-S695 WeakPolarHBondContact O-CB 3.38Å; V692-S695 PolarHBondContact O-N 3.32Å; V692-L696 HydrophobicContact CG1-CD1 3.94Å; V692-L696 HydrophobicContact CG1-CG 4.29Å; V692-L696 WeakPolarHBondContact O-CG 3.33Å; V692-L696 PolarHBondContact O-N 3.44Å; V692-F704 HydrophobicContact CG1-CE2 3.97Å; V692-F704 HydrophobicContact CG1-CZ 3.78Å; V692-F704 HydrophobicContact CG2-CZ 4.03Å; V692-V719 HydrophobicContact CG1-CB 4.22Å; V692-V719 HydrophobicContact CG1-CG1 4.14Å; V692-L771 HydrophobicContact CG2-CD2 4.25Å; V692-V773 HydrophobicContact CG2-CG2 3.99Å; V692-F780 HydrophobicContact CG2-CE1 3.94Å; V692-F780 HydrophobicContact CG2-CZ 4.24Å
693	F	97.4	Very high	95	Very high	1 Å²	1	16.3 Å²	16.3	0%	0.004	8%	0.076	C	C	.	.	H	α-helix	trans	-54.3	-47.4	178.1	169.8	-112.1	0	0	0	111.8	V689 S695 L696 L697 L722 L723 L791 L799 F833 F836 F837	V689-F693 WeakPolarHBondContact O-CB 3.25Å; V689-F693 PolarHBondContact O-N 3.39Å; F693-S695 VanDerWaalsContact C-N 3.28Å; F693-S695 PolarHBondContact O-N 2.83Å; F693-L696 PolarHBondContact O-N 3.04Å; F693-L696 VanDerWaalsContact O-N 3.13Å; F693-L697 HydrophobicContact CD1-CD1 4.14Å; F693-L697 HydrophobicContact CD2-CG 4.37Å; F693-L697 HydrophobicContact CE1-CD1 3.62Å; F693-L697 HydrophobicContact CE1-CG 4.31Å; F693-L697 HydrophobicContact CE2-CD1 4.2Å; F693-L697 HydrophobicContact CE2-CD2 3.97Å; F693-L697 HydrophobicContact CE2-CG 4.06Å; F693-L697 HydrophobicContact CZ-CD1 3.66Å; F693-L697 HydrophobicContact CZ-CD2 4.07Å; F693-L697 HydrophobicContact CZ-CG 4.04Å; F693-L697 WeakPolarHBondContact O-CG 3.36Å; F693-L697 PolarHBondContact O-N 3.42Å; F693-L722 HydrophobicContact CD2-CB 3.99Å; F693-L722 HydrophobicContact CE2-CB 4.43Å; F693-L722 WeakPolarHBondContact CE2-O 3.33Å; F693-L723 HydrophobicContact CD2-CD2 4.14Å; F693-L723 HydrophobicContact CE2-CD2 4.21Å; F693-L791 HydrophobicContact CD1-CD1 4.23Å; F693-L791 HydrophobicContact CD1-CD2 4.42Å; F693-L791 HydrophobicContact CE1-CD2 4.38Å; F693-L799 HydrophobicContact CE1-CD2 4.49Å; F693-F833 HydrophobicContact CB-CE1 4.16Å; F693-F833 HydrophobicContact CD1-CD1 4.29Å; F693-F833 AromaticContact CD1-CE1 3.73Å; F693-F833 HydrophobicContact CD1-CE1 3.73Å; F693-F833 AromaticContact CD2-CD1 3.91Å; F693-F833 HydrophobicContact CD2-CD1 3.91Å; F693-F833 AromaticContact CD2-CE1 3.68Å; F693-F833 HydrophobicContact CD2-CE1 3.68Å; F693-F833 HydrophobicContact CE1-CD1 4.03Å; F693-F833 AromaticContact CE1-CE1 3.92Å; F693-F833 HydrophobicContact CE1-CE1 3.92Å; F693-F833 AromaticContact CE2-CD1 3.63Å; F693-F833 HydrophobicContact CE2-CD1 3.63Å; F693-F833 AromaticContact CE2-CE1 3.88Å; F693-F833 HydrophobicContact CE2-CE1 3.88Å; F693-F833 HydrophobicContact CG-CD1 4.23Å; F693-F833 AromaticContact CG-CE1 3.6Å; F693-F833 HydrophobicContact CG-CE1 3.6Å; F693-F833 AromaticContact CZ-CD1 3.68Å; F693-F833 HydrophobicContact CZ-CD1 3.68Å; F693-F833 AromaticContact CZ-CE1 3.98Å; F693-F833 HydrophobicContact CZ-CE1 3.98Å; F693-F836 HydrophobicContact CE1-CD1 4.06Å; F693-F836 HydrophobicContact CE1-CE1 4.01Å; F693-F836 HydrophobicContact CE1-CG 4.49Å; F693-F836 HydrophobicContact CE1-CZ 4.39Å; F693-F836 AromaticContact CZ-CD1 3.97Å; F693-F836 HydrophobicContact CZ-CD1 3.97Å; F693-F836 HydrophobicContact CZ-CE1 4.16Å; F693-F837 HydrophobicContact CE2-CE2 4.23Å; F693-F837 AromaticContact CE2-CZ 3.8Å; F693-F837 HydrophobicContact CE2-CZ 3.8Å; F693-F837 HydrophobicContact CZ-CE1 4.34Å; F693-F837 HydrophobicContact CZ-CE2 4.19Å; F693-F837 AromaticContact CZ-CZ 3.73Å; F693-F837 HydrophobicContact CZ-CZ 3.73Å
694	A	94.1	Very high	95.1	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.008	7%	0.068	C	C	.	.	H	α-helix	trans	-58.2	-38.6	175.3	0	0	0	0	0	113.1	L690 V692 L698 L790 L791	L690-A694 VanDerWaalsContact O-CB 3.29Å; L690-A694 WeakPolarHBondContact O-CB 3.41Å; L690-A694 PolarHBondContact O-N 3Å; V692-A694 VanDerWaalsContact C-N 3.32Å; V692-A694 PolarHBondContact O-N 2.9Å; A694-L698 PolarHBondContact O-N 2.97Å; A694-L790 HydrophobicContact CB-CB 4.12Å; A694-L790 HydrophobicContact CB-CD1 3.92Å; A694-L791 HydrophobicContact CB-CD1 4.12Å; A694-L791 HydrophobicContact CB-CD2 3.8Å; A694-L791 HydrophobicContact CB-CG 3.76Å
695	S	93.9	Very high	95.1	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-71.3	-32.4	176.2	-63.6	0	0	0	0	113.2	R691 V692 F693 L698 E699 R700 E787	R691-S695 WeakPolarHBondContact O-CB 3.46Å; R691-S695 PolarHBondContact O-N 3.13Å; R691-S695 PolarHBondContact O-OG 2.8Å; V692-S695 CarbonylContact O-C 3.21Å; V692-S695 WeakPolarHBondContact O-CA 3.1Å; V692-S695 WeakPolarHBondContact O-CB 3.38Å; V692-S695 PolarHBondContact O-N 3.32Å; F693-S695 VanDerWaalsContact C-N 3.28Å; F693-S695 PolarHBondContact O-N 2.83Å; S695-L698 CarbonylContact O-C 3.48Å; S695-L698 PolarHBondContact O-N 2.82Å; S695-E699 PolarHBondContact O-N 2.99Å; S695-R700 VanDerWaalsContact O-CB 3.32Å; S695-R700 WeakPolarHBondContact O-CB 3.4Å; S695-R700 WeakPolarHBondContact O-CG 3.49Å; S695-R700 PolarHBondContact O-N 3.47Å; S695-E787 WeakPolarHBondContact OG-CG 3.42Å
696	L	95.9	Very high	95.2	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-74.5	-38.7	174.5	-66.6	175.4	0	0	0	111.9	V692 F693 L698 E699 V702 V719 L723 W728 L751 M884	V692-L696 HydrophobicContact CG1-CD1 3.94Å; V692-L696 HydrophobicContact CG1-CG 4.29Å; V692-L696 WeakPolarHBondContact O-CG 3.33Å; V692-L696 PolarHBondContact O-N 3.44Å; F693-L696 PolarHBondContact O-N 3.04Å; F693-L696 VanDerWaalsContact O-N 3.13Å; L696-L698 PolarHBondContact O-N 3.44Å; L696-E699 PolarHBondContact O-N 3.27Å; L696-V702 HydrophobicContact CD2-CB 4.42Å; L696-V702 HydrophobicContact CD2-CG2 3.92Å; L696-V719 HydrophobicContact CD1-CB 4.16Å; L696-V719 HydrophobicContact CD1-CG2 4.15Å; L696-L723 HydrophobicContact CB-CD1 4.38Å; L696-L723 HydrophobicContact CB-CD2 3.89Å; L696-W728 HydrophobicContact CB-CZ3 4.3Å; L696-W728 HydrophobicContact CD2-CE3 4.29Å; L696-W728 HydrophobicContact CD2-CH2 4.03Å; L696-W728 HydrophobicContact CD2-CZ3 3.81Å; L696-W728 WeakPolarHBondContact O-CZ3 3.29Å; L696-L751 HydrophobicContact CD1-CD2 4.33Å; L696-L751 HydrophobicContact CD2-CB 4.39Å; L696-L751 HydrophobicContact CD2-CD1 4.39Å; L696-L751 HydrophobicContact CD2-CD2 4.05Å; L696-M884 WeakPolarHBondContact O-CE 3.38Å
697	L	92.9	Very high	95.1	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-57.3	-32.1	170.5	-68.6	-179.7	0	0	0	112.3	F693 E699 L723 L791 F836 F837 F875 F879	F693-L697 HydrophobicContact CD1-CD1 4.14Å; F693-L697 HydrophobicContact CD2-CG 4.37Å; F693-L697 HydrophobicContact CE1-CD1 3.62Å; F693-L697 HydrophobicContact CE1-CG 4.31Å; F693-L697 HydrophobicContact CE2-CD1 4.2Å; F693-L697 HydrophobicContact CE2-CD2 3.97Å; F693-L697 HydrophobicContact CE2-CG 4.06Å; F693-L697 HydrophobicContact CZ-CD1 3.66Å; F693-L697 HydrophobicContact CZ-CD2 4.07Å; F693-L697 HydrophobicContact CZ-CG 4.04Å; F693-L697 WeakPolarHBondContact O-CG 3.36Å; F693-L697 PolarHBondContact O-N 3.42Å; L697-E699 VanDerWaalsContact C-N 3.32Å; L697-L723 HydrophobicContact CD2-CD2 4.13Å; L697-L791 HydrophobicContact CD1-CD2 3.85Å; L697-F836 HydrophobicContact CD1-CE1 4.15Å; L697-F837 HydrophobicContact CD2-CE1 3.81Å; L697-F837 HydrophobicContact CD2-CZ 3.84Å; L697-F875 HydrophobicContact CD1-CE2 3.91Å; L697-F875 HydrophobicContact CD1-CZ 3.97Å; L697-F879 HydrophobicContact CB-CD2 4.07Å; L697-F879 HydrophobicContact CB-CE2 4.17Å; L697-F879 HydrophobicContact CD2-CD2 4.28Å; L697-F879 HydrophobicContact CD2-CE2 3.65Å; L697-F879 HydrophobicContact CD2-CZ 4.03Å; L697-F879 HydrophobicContact CG-CE2 4.47Å; L697-F879 WeakPolarHBondContact O-CD2 3.38Å
698	L	87.6	Confident	95.2	Very high	5 Å²	5	17.2 Å²	17.2	3%	0.026	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	16.1	175.3	-71.7	-156.9	0	0	0	114.2	H467 A694 S695 L696 R700 L790 V878	H467-L698 PolarHBondContact CE1-O 2.92Å; H467-L698 WeakPolarHBondContact NE2-CB 3.45Å; H467-L698 PolarHBondContact NE2-O 3.16Å; H467-L698 VanDerWaalsContact NE2-O 3.15Å; A694-L698 PolarHBondContact O-N 2.97Å; S695-L698 CarbonylContact O-C 3.48Å; S695-L698 PolarHBondContact O-N 2.82Å; L696-L698 PolarHBondContact O-N 3.44Å; L698-R700 HydrophobicContact CB-CG 4.15Å; L698-R700 PolarHBondContact O-N 3.01Å; L698-R700 VanDerWaalsContact O-N 3.08Å; L698-L790 HydrophobicContact CD1-CB 4.5Å; L698-L790 HydrophobicContact CD1-CD1 3.68Å; L698-L790 HydrophobicContact CD1-CD2 3.75Å; L698-L790 HydrophobicContact CD1-CG 4.15Å; L698-L790 HydrophobicContact CG-CD1 4.25Å; L698-V878 HydrophobicContact CD2-CB 4.43Å; L698-V878 HydrophobicContact CD2-CG1 3.69Å
699	E	91.6	Very high	95.3	Very high	8 Å²	8	16.2 Å²	16.2	4%	0.037	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.2	47.4	175.7	-57	-170.4	151	0	0	112.7	L471 S695 L696 L697 W728 H730 P749 Q883 M884	L471-E699 HydrophobicContact CD2-CB 4.13Å; S695-E699 PolarHBondContact O-N 2.99Å; L696-E699 PolarHBondContact O-N 3.27Å; L697-E699 VanDerWaalsContact C-N 3.32Å; E699-W728 HydrophobicContact CB-CZ3 4.46Å; E699-W728 HydrophobicContact CG-CZ3 4.37Å; E699-H730 IonicContact OE1-CD2 3.93Å; E699-H730 IonicContact OE1-NE2 3.33Å; E699-H730 PolarHBondContact OE1-NE2 3.2Å; E699-H730 IonicContact OE2-CD2 3.34Å; E699-H730 IonicContact OE2-CE1 3.7Å; E699-H730 IonicContact OE2-NE2 2.71Å; E699-H730 PolarHBondContact OE2-NE2 2.75Å; E699-P749 HydrophobicContact CB-CB 4.24Å; E699-P749 HydrophobicContact CB-CG 4.06Å; E699-P749 WeakPolarHBondContact O-CB 3.37Å; E699-P749 WeakPolarHBondContact O-CG 3.3Å; E699-Q883 VanDerWaalsContact CD-N 3.26Å; E699-Q883 PolarHBondContact OE1-N 3.37Å; E699-Q883 PolarHBondContact OE2-N 3.39Å; E699-M884 HydrophobicContact CG-CE 4.08Å; E699-M884 WeakPolarHBondContact OE1-CG 3.34Å; E699-M884 PolarHBondContact OE1-N 3.46Å
700	R	91.4	Very high	95.2	Very high	12 Å²	12	18 Å²	18	5%	0.045	9%	0.088	C	C	.	.			trans	-79	168.8	179.7	-65.7	-175.3	177	-166.6	-8.8	111.8	S695 L698 V702 D786 E787	S695-R700 VanDerWaalsContact O-CB 3.32Å; S695-R700 WeakPolarHBondContact O-CB 3.4Å; S695-R700 WeakPolarHBondContact O-CG 3.49Å; S695-R700 PolarHBondContact O-N 3.47Å; L698-R700 HydrophobicContact CB-CG 4.15Å; L698-R700 PolarHBondContact O-N 3.01Å; L698-R700 VanDerWaalsContact O-N 3.08Å; R700-V702 HydrophobicContact CB-CG2 4.32Å; R700-D786 IonicContact CZ-OD1 2.82Å; R700-D786 VanDerWaalsContact CZ-OD1 3.28Å; R700-D786 IonicContact CZ-OD2 3.15Å; R700-D786 IonicContact NH1-OD1 2.73Å; R700-D786 PolarHBondContact NH1-OD1 3.09Å; R700-D786 IonicContact NH1-OD2 3.74Å; R700-D786 VanDerWaalsContact NH2-CG 3.26Å; R700-D786 IonicContact NH2-OD1 3.5Å; R700-D786 PolarHBondContact NH2-OD1 2.83Å; R700-D786 IonicContact NH2-OD2 3.67Å; R700-D786 PolarHBondContact NH2-OD2 3.05Å; R700-E787 IonicContact NH1-OE1 2.8Å
701	R	94.4	Very high	95.2	Very high	16 Å²	16	19.6 Å²	19.6	6%	0.06	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	121.8	163.7	-68.1	-178.5	-79.3	-159	-6.6	107.4	C746 T748 F750 E768 E769 A770 L771	R701-C746 WeakPolarHBondContact CD-O 3.47Å; R701-C746 PolarHBondContact NH1-O 2.82Å; R701-T748 WeakPolarHBondContact CG-O 3.38Å; R701-F750 HydrophobicContact CB-CD1 4.37Å; R701-F750 HydrophobicContact CB-CD2 4.35Å; R701-F750 HydrophobicContact CB-CE1 3.97Å; R701-F750 HydrophobicContact CB-CE2 3.92Å; R701-F750 HydrophobicContact CB-CZ 3.73Å; R701-F750 VanDerWaalsContact CD-CE1 3.49Å; R701-F750 HydrophobicContact CG-CD1 3.85Å; R701-F750 HydrophobicContact CG-CE1 3.59Å; R701-F750 HydrophobicContact CG-CE2 4.43Å; R701-F750 HydrophobicContact CG-CG 4.4Å; R701-F750 HydrophobicContact CG-CZ 3.91Å; R701-E768 PolarHBondContact NE-O 2.96Å; R701-E768 VanDerWaalsContact NE-O 3.12Å; R701-E768 PolarHBondContact NH2-O 3.45Å; R701-E768 VanDerWaalsContact NH2-O 3.08Å; R701-E769 PolarHBondContact NE-O 3.26Å; R701-E769 IonicContact NH2-OE2 3.7Å; R701-E769 PolarHBondContact NH2-OE2 2.91Å; R701-A770 HydrophobicContact CB-CB 3.74Å; R701-A770 CarbonylContact O-C 3.6Å; R701-A770 VanDerWaalsContact O-CA 3.29Å; R701-A770 WeakPolarHBondContact O-CA 3.18Å; R701-L771 PolarHBondContact O-N 2.76Å
702	V	97	Very high	95.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127.7	-178.1	-172.2	0	0	0	0	109.7	L696 R700 F704 F750 L751 V752 L771 V773	L696-V702 HydrophobicContact CD2-CB 4.42Å; L696-V702 HydrophobicContact CD2-CG2 3.92Å; R700-V702 HydrophobicContact CB-CG2 4.32Å; V702-F704 HydrophobicContact CG1-CD2 3.95Å; V702-F704 HydrophobicContact CG1-CE2 3.7Å; V702-F750 PolarHBondContact N-O 2.78Å; V702-L751 HydrophobicContact CB-CD1 3.92Å; V702-L751 HydrophobicContact CG1-CD1 3.95Å; V702-L751 WeakPolarHBondContact O-CA 3.29Å; V702-V752 PolarHBondContact O-N 2.97Å; V702-L771 WeakPolarHBondContact CA-O 3.3Å; V702-L771 HydrophobicContact CG1-CB 4.44Å; V702-L771 HydrophobicContact CG1-CD2 4.21Å; V702-L771 HydrophobicContact CG2-CB 4.39Å; V702-V773 HydrophobicContact CG1-CG2 4.19Å
703	I	97.8	Very high	95.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.7	177.4	-57.4	179.1	0	0	0	107.8	V705 V744 F750 V752 L754 L762 V767 A770 L771 M772 V773	I703-V705 HydrophobicContact CG2-CG2 4.07Å; I703-V744 HydrophobicContact CD1-CB 4.41Å; I703-V744 HydrophobicContact CD1-CG1 4.22Å; I703-F750 HydrophobicContact CD1-CE2 4.38Å; I703-F750 HydrophobicContact CG1-CE2 3.79Å; I703-F750 HydrophobicContact CG1-CZ 4.49Å; I703-V752 CarbonylContact C-O 3.59Å; I703-V752 WeakPolarHBondContact CA-O 3.36Å; I703-V752 HydrophobicContact CB-CG2 4.45Å; I703-V752 HydrophobicContact CG1-CG2 3.94Å; I703-V752 HydrophobicContact CG2-CG2 4.47Å; I703-L754 HydrophobicContact CG2-CD1 3.79Å; I703-L754 HydrophobicContact CG2-CG 4.36Å; I703-L762 HydrophobicContact CD1-CD1 4.23Å; I703-L762 HydrophobicContact CD1-CD2 4.28Å; I703-L762 HydrophobicContact CG2-CD2 4.37Å; I703-V767 HydrophobicContact CD1-CG1 4.2Å; I703-A770 HydrophobicContact CD1-CB 4.49Å; I703-L771 PolarHBondContact N-O 2.94Å; I703-M772 HydrophobicContact CB-CG 4.24Å; I703-M772 HydrophobicContact CD1-CG 4.28Å; I703-M772 CarbonylContact O-C 3.58Å; I703-M772 WeakPolarHBondContact O-CA 3.35Å; I703-V773 PolarHBondContact O-N 3.19Å
704	F	98.2	Very high	95.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.1	168.7	-87.1	-103.8	0	0	0	110.2	L684 V692 V702 L712 M716 V719 L751 V752 G753 L754 V773 L775	L684-F704 HydrophobicContact CD1-CE1 4.05Å; V692-F704 HydrophobicContact CG1-CE2 3.97Å; V692-F704 HydrophobicContact CG1-CZ 3.78Å; V692-F704 HydrophobicContact CG2-CZ 4.03Å; V702-F704 HydrophobicContact CG1-CD2 3.95Å; V702-F704 HydrophobicContact CG1-CE2 3.7Å; F704-L712 HydrophobicContact CB-CD1 3.93Å; F704-M716 HydrophobicContact CB-CG 3.9Å; F704-M716 HydrophobicContact CB-SD 3.84Å; F704-M716 HydrophobicContact CD1-CG 4.36Å; F704-M716 HydrophobicContact CD2-CG 4.28Å; F704-M716 HydrophobicContact CG-CG 3.92Å; F704-M716 HydrophobicContact CG-SD 4.43Å; F704-V719 HydrophobicContact CE2-CG2 4.18Å; F704-V719 HydrophobicContact CZ-CG1 4.06Å; F704-V719 HydrophobicContact CZ-CG2 4.08Å; F704-L751 HydrophobicContact CD2-CD1 3.65Å; F704-L751 HydrophobicContact CE2-CD1 3.81Å; F704-V752 PolarHBondContact N-O 2.95Å; F704-G753 CarbonylContact O-C 3.4Å; F704-G753 WeakPolarHBondContact O-CA 3.31Å; F704-L754 PolarHBondContact O-N 3.08Å; F704-V773 CarbonylContact C-O 3.57Å; F704-V773 HydrophobicContact CD1-CB 4.1Å; F704-V773 HydrophobicContact CD1-CG1 4.21Å; F704-V773 HydrophobicContact CD2-CB 4.43Å; F704-V773 HydrophobicContact CD2-CG2 4.23Å; F704-V773 HydrophobicContact CE1-CB 4.11Å; F704-V773 HydrophobicContact CE1-CG1 3.89Å; F704-V773 HydrophobicContact CE1-CG2 4.4Å; F704-V773 HydrophobicContact CE2-CB 4.42Å; F704-V773 HydrophobicContact CE2-CG2 3.95Å; F704-V773 HydrophobicContact CG-CB 4.27Å; F704-V773 HydrophobicContact CZ-CB 4.26Å; F704-V773 HydrophobicContact CZ-CG1 4.23Å; F704-V773 HydrophobicContact CZ-CG2 4.03Å; F704-L775 HydrophobicContact CD1-CD1 3.91Å; F704-L775 HydrophobicContact CD1-CD2 3.81Å; F704-L775 HydrophobicContact CD1-CG 3.87Å; F704-L775 HydrophobicContact CE1-CD2 3.84Å; F704-L775 HydrophobicContact CE1-CG 4.41Å
705	V	97.3	Very high	95.3	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.006	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	136.6	-178.8	-169.1	0	0	0	0	110.2	I703 L754 L759 V773 L775 I781	I703-V705 HydrophobicContact CG2-CG2 4.07Å; V705-L754 WeakPolarHBondContact CA-O 3.01Å; V705-L759 HydrophobicContact CG1-CD1 3.97Å; V705-L759 HydrophobicContact CG1-CD2 4.01Å; V705-L759 HydrophobicContact CG1-CG 3.87Å; V705-L759 HydrophobicContact CG2-CD2 4.03Å; V705-V773 PolarHBondContact N-O 3.06Å; V705-L775 WeakPolarHBondContact O-CB 3.45Å; V705-L775 PolarHBondContact O-N 3.42Å; V705-I781 HydrophobicContact CB-CD1 4.44Å; V705-I781 HydrophobicContact CG2-CD1 4.12Å
706	A	97.3	Very high	95.4	Very high	4 Å²	4	18.8 Å²	18.8	3%	0.033	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	163.9	172.3	0	0	0	0	0	112	K708 L712 L754 L755 S756 L775	A706-K708 VanDerWaalsContact C-N 3.34Å; A706-L712 HydrophobicContact CB-CB 4.15Å; A706-L712 HydrophobicContact CB-CD1 4.31Å; A706-L754 PolarHBondContact N-O 3.43Å; A706-L755 CarbonylContact O-C 3.57Å; A706-L755 VanDerWaalsContact O-CA 3.32Å; A706-L755 WeakPolarHBondContact O-CA 3.38Å; A706-S756 VanDerWaalsContact C-OG 3.22Å; A706-S756 PolarHBondContact O-N 2.8Å; A706-S756 PolarHBondContact O-OG 3.14Å; A706-L775 HydrophobicContact CB-CB 4.07Å; A706-L775 HydrophobicContact CB-CD1 4.09Å
707	D	95.3	Very high	95.3	Very high	123 Å²	123	19.5 Å²	19.5	66%	0.658	10%	0.102	S	C	*	.	S	Bend	trans	-80.1	-14.9	174.4	-53.9	-41.9	0	0	0	113.6	S756	D707-S756 PolarHBondContact N-OG 3.15Å; D707-S756 WeakPolarHBondContact OD1-CB 3.33Å; D707-S756 PolarHBondContact OD1-OG 3.09Å
708	K	95.9	Very high	95.5	Very high	128 Å²	128	19.5 Å²	19.5	56%	0.557	10%	0.102	S	C	*	.			trans	-126.6	136.8	-174	-65	-175.5	-179.7	-179.3	0	111.7	A706 L712	A706-K708 VanDerWaalsContact C-N 3.34Å; K708-L712 VanDerWaalsContact O-CB 3.29Å; K708-L712 WeakPolarHBondContact O-CB 3.46Å; K708-L712 PolarHBondContact O-N 2.89Å; K708-L712 VanDerWaalsContact O-N 3.08Å
709	L	96.8	Very high	95.9	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-68.3	-40.7	179.1	-67.1	178.1	0	0	0	111.5	P551 E565 F567 L712 S713 V735 L755	P551-L709 HydrophobicContact CG-CD1 3.9Å; P551-L709 HydrophobicContact CG-CD2 3.73Å; P551-L709 HydrophobicContact CG-CG 4.45Å; E565-L709 PolarHBondContact OE1-N 3.48Å; F567-L709 HydrophobicContact CB-CB 3.69Å; F567-L709 HydrophobicContact CD1-CB 3.85Å; F567-L709 HydrophobicContact CD1-CD1 3.89Å; F567-L709 HydrophobicContact CD2-CB 4.05Å; F567-L709 HydrophobicContact CD2-CD1 4.2Å; F567-L709 HydrophobicContact CE1-CB 4.46Å; F567-L709 HydrophobicContact CE1-CD1 3.63Å; F567-L709 HydrophobicContact CE2-CD1 3.97Å; F567-L709 HydrophobicContact CG-CB 3.61Å; F567-L709 HydrophobicContact CG-CD1 4.16Å; F567-L709 HydrophobicContact CG-CG 4.49Å; F567-L709 HydrophobicContact CZ-CD1 3.67Å; L709-L712 PolarHBondContact O-N 3.29Å; L709-S713 PolarHBondContact O-N 3.09Å; L709-S713 PolarHBondContact O-OG 3.09Å; L709-S713 VanDerWaalsContact O-OG 3.11Å; L709-V735 HydrophobicContact CD2-CG1 3.69Å; L709-V735 HydrophobicContact CD2-CG2 4.1Å; L709-L755 HydrophobicContact CD2-CD1 3.72Å; L709-L755 HydrophobicContact CD2-CD2 3.68Å; L709-L755 HydrophobicContact CD2-CG 3.63Å; L709-L755 HydrophobicContact CG-CD1 4.2Å; L709-L755 HydrophobicContact CG-CD2 4.05Å; L709-L755 HydrophobicContact CG-CG 4.38Å
710	S	95.3	Very high	96.1	Very high	36 Å²	36	20.2 Å²	20.2	25%	0.252	11%	0.107	S	C	.	.	H	α-helix	trans	-51.3	-56.8	174.3	44.4	0	0	0	0	112.4	E565 T566 S713 S714	E565-S710 WeakPolarHBondContact OE1-CB 3.42Å; E565-S710 PolarHBondContact OE1-N 3.29Å; E565-S710 PolarHBondContact OE1-OG 3.11Å; T566-S710 VanDerWaalsContact O-CA 3.29Å; T566-S710 WeakPolarHBondContact O-CA 3.27Å; T566-S710 WeakPolarHBondContact O-CB 3.34Å; S710-S713 PolarHBondContact O-OG 3.26Å; S710-S714 VanDerWaalsContact O-CB 3.23Å; S710-S714 WeakPolarHBondContact O-CB 3.12Å; S710-S714 PolarHBondContact O-N 3.08Å; S710-S714 VanDerWaalsContact O-N 3.12Å
711	T	96.4	Very high	96.2	Very high	36 Å²	36	20.7 Å²	20.7	22%	0.221	11%	0.114	C	C	.	.	H	α-helix	trans	-60.2	-45.8	176.8	-56.4	0	0	0	0	112	C683 C715 L775	C683-T711 WeakPolarHBondContact SG-CG2 3.47Å; T711-C715 WeakPolarHBondContact O-CB 3.42Å; T711-C715 PolarHBondContact O-N 2.96Å; T711-C715 PolarHBondContact O-SG 2.73Å; T711-L775 HydrophobicContact CG2-CB 4.47Å; T711-L775 HydrophobicContact CG2-CD1 4.35Å
712	L	97.4	Very high	96.3	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.2	-54.9	-178.4	-175.6	65.4	0	0	0	112	F704 A706 K708 L709 S714 M716 V735 L775	F704-L712 HydrophobicContact CB-CD1 3.93Å; A706-L712 HydrophobicContact CB-CB 4.15Å; A706-L712 HydrophobicContact CB-CD1 4.31Å; K708-L712 VanDerWaalsContact O-CB 3.29Å; K708-L712 WeakPolarHBondContact O-CB 3.46Å; K708-L712 PolarHBondContact O-N 2.89Å; K708-L712 VanDerWaalsContact O-N 3.08Å; L709-L712 PolarHBondContact O-N 3.29Å; L712-S714 PolarHBondContact O-N 3.34Å; L712-M716 HydrophobicContact CD1-SD 4.19Å; L712-M716 HydrophobicContact CG-SD 4.39Å; L712-M716 WeakPolarHBondContact O-CB 3.19Å; L712-M716 VanDerWaalsContact O-CG 3.31Å; L712-M716 WeakPolarHBondContact O-CG 3.23Å; L712-M716 PolarHBondContact O-N 3.28Å; L712-M716 VanDerWaalsContact O-N 3.09Å; L712-V735 HydrophobicContact CD2-CG2 4.4Å; L712-L775 HydrophobicContact CD1-CD1 4.31Å
713	S	96.3	Very high	96.2	Very high	2 Å²	2	20 Å²	20	1%	0.014	11%	0.111	C	C	.	.	H	α-helix	trans	-65.6	-41.1	-177.7	61.1	0	0	0	0	112.1	S568 L709 S710 M716 H717	S568-S713 PolarHBondContact N-OG 3.36Å; S568-S713 WeakPolarHBondContact O-CB 3.45Å; L709-S713 PolarHBondContact O-N 3.09Å; L709-S713 PolarHBondContact O-OG 3.09Å; L709-S713 VanDerWaalsContact O-OG 3.11Å; S710-S713 PolarHBondContact O-OG 3.26Å; S713-M716 PolarHBondContact O-N 3.31Å; S713-H717 PolarHBondContact O-CD2 3.43Å; S713-H717 PolarHBondContact O-N 3.12Å
714	S	95.2	Very high	96.1	Very high	21 Å²	21	21.6 Å²	21.6	15%	0.147	12%	0.117	C	C	.	.	H	α-helix	trans	-60.6	-53.3	179.6	-177.5	0	0	0	0	111.6	D676 S679 S710 L712 M716 H717 A718	D676-S714 PolarHBondContact OD2-OG 2.8Å; S679-S714 WeakPolarHBondContact CB-OG 3.34Å; S679-S714 PolarHBondContact OG-OG 2.92Å; S710-S714 VanDerWaalsContact O-CB 3.23Å; S710-S714 WeakPolarHBondContact O-CB 3.12Å; S710-S714 PolarHBondContact O-N 3.08Å; S710-S714 VanDerWaalsContact O-N 3.12Å; L712-S714 PolarHBondContact O-N 3.34Å; S714-M716 VanDerWaalsContact C-N 3.27Å; S714-M716 PolarHBondContact O-N 3.49Å; S714-H717 PolarHBondContact O-N 3.06Å; S714-A718 WeakPolarHBondContact O-CB 3.33Å; S714-A718 PolarHBondContact O-N 3.29Å
715	C	97.2	Very high	95.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.6	-36.9	178.2	-64.7	0	0	0	0	112.3	L680 T711 A718 V719 L775	L680-C715 HydrophobicContact CD1-CB 4.03Å; T711-C715 WeakPolarHBondContact O-CB 3.42Å; T711-C715 PolarHBondContact O-N 2.96Å; T711-C715 PolarHBondContact O-SG 2.73Å; C715-A718 PolarHBondContact O-N 2.89Å; C715-V719 PolarHBondContact O-N 3.33Å; C715-L775 HydrophobicContact CB-CD1 3.67Å; C715-L775 HydrophobicContact CB-CD2 3.92Å; C715-L775 HydrophobicContact CB-CG 4.49Å
716	M	96.5	Very high	95.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-71.6	-37.7	179.5	-77.2	-170.8	74.5	0	0	113.9	F704 L712 S713 S714 A718 V720 F732 P734 L751 G753	F704-M716 HydrophobicContact CB-CG 3.9Å; F704-M716 HydrophobicContact CB-SD 3.84Å; F704-M716 HydrophobicContact CD1-CG 4.36Å; F704-M716 HydrophobicContact CD2-CG 4.28Å; F704-M716 HydrophobicContact CG-CG 3.92Å; F704-M716 HydrophobicContact CG-SD 4.43Å; L712-M716 HydrophobicContact CD1-SD 4.19Å; L712-M716 HydrophobicContact CG-SD 4.39Å; L712-M716 WeakPolarHBondContact O-CB 3.19Å; L712-M716 VanDerWaalsContact O-CG 3.31Å; L712-M716 WeakPolarHBondContact O-CG 3.23Å; L712-M716 PolarHBondContact O-N 3.28Å; L712-M716 VanDerWaalsContact O-N 3.09Å; S713-M716 PolarHBondContact O-N 3.31Å; S714-M716 VanDerWaalsContact C-N 3.27Å; S714-M716 PolarHBondContact O-N 3.49Å; M716-A718 VanDerWaalsContact C-N 3.34Å; M716-V720 WeakPolarHBondContact O-CG2 3.45Å; M716-V720 PolarHBondContact O-N 3.21Å; M716-F732 HydrophobicContact CB-CE2 4.28Å; M716-F732 HydrophobicContact CE-CD2 4.35Å; M716-F732 HydrophobicContact CE-CE2 4Å; M716-P734 HydrophobicContact CB-CB 4.49Å; M716-P734 VanDerWaalsContact SD-O 3.33Å; M716-L751 HydrophobicContact CE-CD1 3.82Å; M716-L751 HydrophobicContact CE-CG 3.67Å; M716-G753 VanDerWaalsContact CE-N 3.35Å; M716-G753 WeakPolarHBondContact SD-CA 3.31Å; M716-G753 PolarHBondContact SD-N 2.92Å; M716-G753 VanDerWaalsContact SD-N 3.39Å
717	H	94.4	Very high	95.1	Very high	16 Å²	16	24.3 Å²	24.3	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-66.6	-38.7	170.5	-73.1	-62.5	0	0	0	111.2	S568 F580 S713 S714 V720 A721 F732	S568-H717 PolarHBondContact OG-CD2 2.98Å; S568-H717 PolarHBondContact OG-NE2 3.12Å; F580-H717 AromaticContact CD1-CE1 3.93Å; F580-H717 AromaticContact CE1-CE1 3.85Å; S713-H717 PolarHBondContact O-CD2 3.43Å; S713-H717 PolarHBondContact O-N 3.12Å; S714-H717 PolarHBondContact O-N 3.06Å; H717-V720 PolarHBondContact O-N 2.76Å; H717-A721 PolarHBondContact O-N 3.07Å; H717-A721 VanDerWaalsContact O-N 3.12Å; H717-F732 AromaticContact ND1-CE1 3.89Å; H717-F732 AromaticContact ND1-CZ 3.88Å
718	A	96	Very high	94.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.1	-49.4	176.7	0	0	0	0	0	113.2	V675 F677 L680 S714 C715 M716 V720 A721 L722	V675-A718 HydrophobicContact CG1-CB 4.36Å; F677-A718 HydrophobicContact CD1-CB 3.81Å; F677-A718 HydrophobicContact CE1-CB 4.01Å; F677-A718 VanDerWaalsContact CE1-O 3.26Å; F677-A718 WeakPolarHBondContact CE1-O 3.49Å; L680-A718 HydrophobicContact CB-CB 3.97Å; L680-A718 HydrophobicContact CD2-CB 3.98Å; L680-A718 HydrophobicContact CG-CB 4.48Å; S714-A718 WeakPolarHBondContact O-CB 3.33Å; S714-A718 PolarHBondContact O-N 3.29Å; C715-A718 PolarHBondContact O-N 2.89Å; M716-A718 VanDerWaalsContact C-N 3.34Å; A718-V720 VanDerWaalsContact C-N 3.25Å; A718-V720 PolarHBondContact O-N 2.9Å; A718-A721 WeakPolarHBondContact O-CB 3.39Å; A718-A721 PolarHBondContact O-N 3.25Å; A718-L722 PolarHBondContact O-N 2.53Å
719	V	97.1	Very high	94.4	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.9	-23.6	179.8	-61.1	0	0	0	0	113.9	L680 V692 L696 F704 C715 L722 L751	L680-V719 HydrophobicContact CD1-CG1 3.63Å; L680-V719 HydrophobicContact CD2-CG1 3.8Å; L680-V719 HydrophobicContact CG-CG1 4.39Å; V692-V719 HydrophobicContact CG1-CB 4.22Å; V692-V719 HydrophobicContact CG1-CG1 4.14Å; L696-V719 HydrophobicContact CD1-CB 4.16Å; L696-V719 HydrophobicContact CD1-CG2 4.15Å; F704-V719 HydrophobicContact CE2-CG2 4.18Å; F704-V719 HydrophobicContact CZ-CG1 4.06Å; F704-V719 HydrophobicContact CZ-CG2 4.08Å; C715-V719 PolarHBondContact O-N 3.33Å; V719-L722 HydrophobicContact CG1-CD1 4.49Å; V719-L751 HydrophobicContact CG2-CD2 4.16Å
720	V	94.8	Very high	94.1	Very high	29 Å²	29	15.1 Å²	15.1	18%	0.176	9%	0.09	C	C	.	.	H	α-helix	trans	-73.2	-38	170.7	172.5	0	0	0	0	111.4	M716 H717 A718 L722 L723 W728 F732 L751	M716-V720 WeakPolarHBondContact O-CG2 3.45Å; M716-V720 PolarHBondContact O-N 3.21Å; H717-V720 PolarHBondContact O-N 2.76Å; A718-V720 VanDerWaalsContact C-N 3.25Å; A718-V720 PolarHBondContact O-N 2.9Å; V720-L722 PolarHBondContact O-N 2.84Å; V720-L723 VanDerWaalsContact O-CB 3.31Å; V720-L723 WeakPolarHBondContact O-CB 3.32Å; V720-L723 PolarHBondContact O-N 2.67Å; V720-L723 VanDerWaalsContact O-N 3.08Å; V720-W728 HydrophobicContact CG1-CB 4.42Å; V720-F732 HydrophobicContact CB-CZ 4.47Å; V720-F732 HydrophobicContact CG2-CD2 4.05Å; V720-F732 HydrophobicContact CG2-CE1 4.27Å; V720-F732 HydrophobicContact CG2-CE2 3.56Å; V720-F732 HydrophobicContact CG2-CZ 3.69Å; V720-L751 HydrophobicContact CG2-CD2 3.47Å; V720-L751 VanDerWaalsContact CG2-CD2 3.47Å
721	A	93.4	Very high	93.9	Very high	22 Å²	22	16 Å²	16	18%	0.182	9%	0.094	C	C	.	.	H	α-helix	trans	-63.4	-27.9	178.1	0	0	0	0	0	113.3	V675 F677 H717 A718 L723 Y724	V675-A721 HydrophobicContact CB-CB 4.39Å; V675-A721 HydrophobicContact CG1-CB 3.89Å; V675-A721 HydrophobicContact CG2-CB 3.53Å; F677-A721 HydrophobicContact CZ-CB 3.87Å; H717-A721 PolarHBondContact O-N 3.07Å; H717-A721 VanDerWaalsContact O-N 3.12Å; A718-A721 WeakPolarHBondContact O-CB 3.39Å; A718-A721 PolarHBondContact O-N 3.25Å; A721-L723 PolarHBondContact O-N 2.98Å; A721-L723 VanDerWaalsContact O-N 3.13Å; A721-Y724 PolarHBondContact O-N 3.36Å
722	L	96.6	Very high	93.8	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.01	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-20.5	172.7	-60.2	-177.9	0	0	0	113.9	F677 L680 V689 F693 A718 V719 V720 Y724 V829 F833	F677-L722 HydrophobicContact CD1-CD2 4.2Å; F677-L722 HydrophobicContact CE1-CD2 3.27Å; F677-L722 HydrophobicContact CE1-CG 3.86Å; F677-L722 HydrophobicContact CZ-CD2 3.67Å; F677-L722 HydrophobicContact CZ-CG 4.42Å; L680-L722 HydrophobicContact CD2-CD1 4.42Å; V689-L722 HydrophobicContact CG1-CD1 3.63Å; F693-L722 HydrophobicContact CD2-CB 3.99Å; F693-L722 HydrophobicContact CE2-CB 4.43Å; F693-L722 WeakPolarHBondContact CE2-O 3.33Å; A718-L722 PolarHBondContact O-N 2.53Å; V719-L722 HydrophobicContact CG1-CD1 4.49Å; V720-L722 PolarHBondContact O-N 2.84Å; L722-Y724 VanDerWaalsContact C-N 3.35Å; L722-V829 HydrophobicContact CD2-CG1 3.73Å; L722-F833 HydrophobicContact CB-CD1 3.94Å; L722-F833 HydrophobicContact CB-CE1 3.97Å; L722-F833 HydrophobicContact CB-CG 4.42Å; L722-F833 HydrophobicContact CB-CZ 4.46Å; L722-F833 HydrophobicContact CD1-CE1 4Å; L722-F833 HydrophobicContact CD1-CE2 4.46Å; L722-F833 HydrophobicContact CD1-CZ 3.84Å; L722-F833 HydrophobicContact CD2-CD1 4.12Å; L722-F833 HydrophobicContact CD2-CD2 3.65Å; L722-F833 HydrophobicContact CD2-CE1 3.99Å; L722-F833 HydrophobicContact CD2-CE2 3.48Å; L722-F833 VanDerWaalsContact CD2-CE2 3.48Å; L722-F833 HydrophobicContact CD2-CG 3.97Å; L722-F833 HydrophobicContact CD2-CZ 3.67Å; L722-F833 HydrophobicContact CG-CD1 4.49Å; L722-F833 HydrophobicContact CG-CE1 4.21Å; L722-F833 HydrophobicContact CG-CE2 4.47Å; L722-F833 HydrophobicContact CG-CZ 4.2Å
723	L	96.1	Very high	93.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-13.5	-177.4	-58.7	171.9	0	0	0	113.2	F693 L696 L697 V720 A721 F726 W728 M884	F693-L723 HydrophobicContact CD2-CD2 4.14Å; F693-L723 HydrophobicContact CE2-CD2 4.21Å; L696-L723 HydrophobicContact CB-CD1 4.38Å; L696-L723 HydrophobicContact CB-CD2 3.89Å; L697-L723 HydrophobicContact CD2-CD2 4.13Å; V720-L723 VanDerWaalsContact O-CB 3.31Å; V720-L723 WeakPolarHBondContact O-CB 3.32Å; V720-L723 PolarHBondContact O-N 2.67Å; V720-L723 VanDerWaalsContact O-N 3.08Å; A721-L723 PolarHBondContact O-N 2.98Å; A721-L723 VanDerWaalsContact O-N 3.13Å; L723-F726 CarbonylContact C-O 3.59Å; L723-F726 HydrophobicContact CB-CB 4.42Å; L723-F726 WeakPolarHBondContact O-CA 3.3Å; L723-F726 VanDerWaalsContact O-CB 3.27Å; L723-F726 WeakPolarHBondContact O-CB 3.11Å; L723-F726 WeakPolarHBondContact O-CD2 3.46Å; L723-F726 PolarHBondContact O-N 3.13Å; L723-W728 HydrophobicContact CD1-CB 4.1Å; L723-W728 HydrophobicContact CD1-CE3 4.17Å; L723-M884 HydrophobicContact CD1-SD 3.96Å; L723-M884 HydrophobicContact CD2-CE 4.36Å; L723-M884 HydrophobicContact CD2-SD 4.47Å
724	Y	93.6	Very high	93.8	Very high	32 Å²	32	15.3 Å²	15.3	13%	0.125	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	124.7	-178.2	-179.9	-92.8	0	0	0	111.7	R671 A721 L722 I834 F837 F903	R671-Y724 HydrophobicContact CG-CD2 4.27Å; R671-Y724 HydrophobicContact CG-CE2 4.12Å; A721-Y724 PolarHBondContact O-N 3.36Å; L722-Y724 VanDerWaalsContact C-N 3.35Å; Y724-I834 HydrophobicContact CD1-CD1 4Å; Y724-I834 HydrophobicContact CD1-CG1 3.82Å; Y724-I834 HydrophobicContact CE1-CD1 4.01Å; Y724-I834 HydrophobicContact CE1-CG1 4.11Å; Y724-F837 WeakPolarHBondContact O-CD2 3.22Å; Y724-F837 WeakPolarHBondContact O-CE2 3.36Å; Y724-F903 HydrophobicContact CE1-CB 3.88Å; Y724-F903 WeakPolarHBondContact OH-CB 3.38Å; Y724-F903 PolarHBondContact OH-N 3.1Å; Y724-F903 VanDerWaalsContact OH-N 3.07Å
725	P	92.1	Very high	93.8	Very high	8 Å²	8	14.4 Å²	14.4	5%	0.052	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	cis	-87.1	1.3	25.8	36.3	-40.4	0	0	0	116.7	F888 F903	P725-F888 HydrophobicContact CB-CD2 4.19Å; P725-F888 HydrophobicContact CB-CE2 3.84Å; P725-F888 HydrophobicContact CG-CD2 4.23Å; P725-F888 HydrophobicContact CG-CE2 3.88Å; P725-F903 HydrophobicContact CB-CB 3.92Å; P725-F903 HydrophobicContact CB-CD1 3.88Å; P725-F903 HydrophobicContact CB-CD2 4.05Å; P725-F903 HydrophobicContact CB-CE1 4.41Å; P725-F903 HydrophobicContact CB-CG 3.67Å; P725-F903 HydrophobicContact CG-CD1 3.82Å; P725-F903 HydrophobicContact CG-CD2 3.82Å; P725-F903 HydrophobicContact CG-CE1 3.85Å; P725-F903 HydrophobicContact CG-CE2 3.87Å; P725-F903 HydrophobicContact CG-CG 3.8Å; P725-F903 HydrophobicContact CG-CZ 3.88Å
726	F	92.2	Very high	93.8	Very high	9 Å²	9	14.6 Å²	14.6	4%	0.039	8%	0.083	C	C	.	.	P	Polyproline II helix	trans	-83.8	143	-179.9	-57.3	-79	0	0	0	112.1	L723 F837 M841 F879 M884 F885 F888	L723-F726 CarbonylContact C-O 3.59Å; L723-F726 HydrophobicContact CB-CB 4.42Å; L723-F726 WeakPolarHBondContact O-CA 3.3Å; L723-F726 VanDerWaalsContact O-CB 3.27Å; L723-F726 WeakPolarHBondContact O-CB 3.11Å; L723-F726 WeakPolarHBondContact O-CD2 3.46Å; L723-F726 PolarHBondContact O-N 3.13Å; F726-F837 HydrophobicContact CD2-CD1 4.26Å; F726-F837 AromaticContact CD2-CE1 3.78Å; F726-F837 HydrophobicContact CD2-CE1 3.78Å; F726-F837 AromaticContact CD2-CZ 3.95Å; F726-F837 HydrophobicContact CD2-CZ 3.95Å; F726-F837 AromaticContact CE2-CD1 3.71Å; F726-F837 HydrophobicContact CE2-CD1 3.71Å; F726-F837 AromaticContact CE2-CE1 3.59Å; F726-F837 HydrophobicContact CE2-CE1 3.59Å; F726-F837 HydrophobicContact CE2-CG 4.43Å; F726-F837 HydrophobicContact CE2-CZ 4.22Å; F726-M841 HydrophobicContact CE2-SD 3.67Å; F726-M841 HydrophobicContact CZ-CE 3.84Å; F726-M841 HydrophobicContact CZ-SD 3.37Å; F726-M841 WeakPolarHBondContact CZ-SD 3.47Å; F726-F879 HydrophobicContact CD1-CZ 4.47Å; F726-F879 AromaticContact CD2-CZ 3.92Å; F726-F879 HydrophobicContact CD2-CZ 3.92Å; F726-F879 HydrophobicContact CE1-CE1 4.43Å; F726-F879 HydrophobicContact CE1-CZ 4.08Å; F726-F879 AromaticContact CE2-CE1 3.77Å; F726-F879 HydrophobicContact CE2-CE1 3.77Å; F726-F879 AromaticContact CE2-CZ 3.47Å; F726-F879 HydrophobicContact CE2-CZ 3.47Å; F726-F879 VanDerWaalsContact CE2-CZ 3.47Å; F726-F879 HydrophobicContact CG-CZ 4.39Å; F726-F879 AromaticContact CZ-CE1 3.63Å; F726-F879 HydrophobicContact CZ-CE1 3.63Å; F726-F879 AromaticContact CZ-CZ 3.53Å; F726-F879 HydrophobicContact CZ-CZ 3.53Å; F726-M884 HydrophobicContact CB-CB 4.18Å; F726-M884 HydrophobicContact CB-CG 4.42Å; F726-M884 HydrophobicContact CB-SD 3.99Å; F726-M884 HydrophobicContact CD1-CB 4.07Å; F726-M884 WeakPolarHBondContact CD1-O 3.37Å; F726-M884 HydrophobicContact CG-CB 4.34Å; F726-F885 HydrophobicContact CE1-CB 4.4Å; F726-F885 HydrophobicContact CE1-CD2 4.15Å; F726-F885 HydrophobicContact CZ-CD2 4.09Å; F726-F888 HydrophobicContact CD1-CB 3.65Å; F726-F888 HydrophobicContact CD1-CG 4.19Å; F726-F888 HydrophobicContact CE1-CB 3.41Å; F726-F888 VanDerWaalsContact CE1-CB 3.41Å; F726-F888 HydrophobicContact CE1-CD1 4.17Å; F726-F888 HydrophobicContact CE1-CD2 4.26Å; F726-F888 AromaticContact CE1-CG 3.69Å; F726-F888 HydrophobicContact CE1-CG 3.69Å; F726-F888 HydrophobicContact CZ-CG 4.39Å
727	S	88	Confident	93.8	Very high	45 Å²	45	14.6 Å²	14.6	32%	0.315	8%	0.083	S	C	.	.	P	Polyproline II helix	trans	-96.4	133.8	163	-66.9	0	0	0	0	109.2	Q729 M884	S727-Q729 PolarHBondContact O-N 3.03Å; S727-Q729 PolarHBondContact O-NE2 3.39Å; S727-M884 WeakPolarHBondContact O-CG 3.26Å
728	W	91.6	Very high	93.6	Very high	1 Å²	1	14.6 Å²	14.6	0%	0.004	9%	0.085	C	C	.	.	P	Polyproline II helix	trans	-60.6	123.9	171.9	176.8	-102.2	0	0	0	110.9	R578 L696 E699 V720 L723 H730 T731 P749 L751 M884	R578-W728 VanDerWaalsContact CZ-O 3.3Å; R578-W728 PolarHBondContact NH1-O 3.39Å; R578-W728 PolarHBondContact NH2-O 3.08Å; L696-W728 HydrophobicContact CB-CZ3 4.3Å; L696-W728 HydrophobicContact CD2-CE3 4.29Å; L696-W728 HydrophobicContact CD2-CH2 4.03Å; L696-W728 HydrophobicContact CD2-CZ3 3.81Å; L696-W728 WeakPolarHBondContact O-CZ3 3.29Å; E699-W728 HydrophobicContact CB-CZ3 4.46Å; E699-W728 HydrophobicContact CG-CZ3 4.37Å; V720-W728 HydrophobicContact CG1-CB 4.42Å; L723-W728 HydrophobicContact CD1-CB 4.1Å; L723-W728 HydrophobicContact CD1-CE3 4.17Å; W728-H730 VanDerWaalsContact CD1-O 3.3Å; W728-H730 HydrophobicContact CZ2-CB 3.93Å; W728-H730 PolarHBondContact NE1-O 3.24Å; W728-T731 PolarHBondContact NE1-O 3.19Å; W728-P749 HydrophobicContact CH2-CB 4.2Å; W728-P749 HydrophobicContact CZ2-CB 4.19Å; W728-L751 HydrophobicContact CZ2-CB 4.23Å; W728-M884 HydrophobicContact CE3-CE 4.4Å; W728-M884 HydrophobicContact CE3-SD 4.17Å
729	Q	86.2	Confident	93.3	Very high	43 Å²	43	17.5 Å²	17.5	20%	0.201	11%	0.105	C	C	.	.			trans	-91.9	-15.8	-169.4	-63.3	-57.1	-38.4	0	0	115	Y484 S727 Q883 M884	Y484-Q729 PolarHBondContact OH-NE2 3.23Å; Y484-Q729 PolarHBondContact OH-OE1 3.15Å; S727-Q729 PolarHBondContact O-N 3.03Å; S727-Q729 PolarHBondContact O-NE2 3.39Å; Q729-Q883 HydrophobicContact CB-CB 4.12Å; Q729-Q883 HydrophobicContact CB-CG 3.83Å; Q729-Q883 HydrophobicContact CG-CB 4.29Å; Q729-Q883 HydrophobicContact CG-CG 4.01Å; Q729-M884 HydrophobicContact CG-CG 4.06Å
730	H	89.1	Confident	93.1	Very high	16 Å²	16	19.2 Å²	19.2	7%	0.074	11%	0.114	C	C	.	.	S	Bend	trans	-102.6	-170.9	-170.3	-54	-73	0	0	0	112.1	L478 R578 E699 W728 F732 P749	L478-H730 VanDerWaalsContact CD1-CE1 3.41Å; L478-H730 WeakPolarHBondContact CD1-CE1 3.21Å; R578-H730 PolarHBondContact NH2-O 2.66Å; E699-H730 IonicContact OE1-CD2 3.93Å; E699-H730 IonicContact OE1-NE2 3.33Å; E699-H730 PolarHBondContact OE1-NE2 3.2Å; E699-H730 IonicContact OE2-CD2 3.34Å; E699-H730 IonicContact OE2-CE1 3.7Å; E699-H730 IonicContact OE2-NE2 2.71Å; E699-H730 PolarHBondContact OE2-NE2 2.75Å; W728-H730 VanDerWaalsContact CD1-O 3.3Å; W728-H730 HydrophobicContact CZ2-CB 3.93Å; W728-H730 PolarHBondContact NE1-O 3.24Å; H730-F732 PolarHBondContact O-N 2.66Å; H730-P749 HydrophobicContact CB-CB 3.9Å
731	T	91.9	Very high	93	Very high	54 Å²	54	18.3 Å²	18.3	33%	0.331	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-52	128.1	173.8	-57.8	0	0	0	0	110.8	W728 I733 F750 L751	W728-T731 PolarHBondContact NE1-O 3.19Å; T731-I733 HydrophobicContact CG2-CD1 3.74Å; T731-I733 HydrophobicContact CG2-CG1 3.87Å; T731-F750 HydrophobicContact CG2-CB 4.19Å; T731-F750 WeakPolarHBondContact O-CA 3.41Å; T731-L751 PolarHBondContact O-N 2.94Å
732	F	94.6	Very high	93	Very high	5 Å²	5	22.5 Å²	22.5	2%	0.022	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	117.4	175	174.7	-126.9	0	0	0	109	M570 M716 H717 V720 H730 P734 L751	M570-F732 HydrophobicContact CE-CD1 4.36Å; M570-F732 HydrophobicContact CE-CE1 4.24Å; M570-F732 HydrophobicContact SD-CD1 3.56Å; M570-F732 VanDerWaalsContact SD-CD1 3.56Å; M570-F732 HydrophobicContact SD-CE1 4.01Å; M716-F732 HydrophobicContact CB-CE2 4.28Å; M716-F732 HydrophobicContact CE-CD2 4.35Å; M716-F732 HydrophobicContact CE-CE2 4Å; H717-F732 AromaticContact ND1-CE1 3.89Å; H717-F732 AromaticContact ND1-CZ 3.88Å; V720-F732 HydrophobicContact CB-CZ 4.47Å; V720-F732 HydrophobicContact CG2-CD2 4.05Å; V720-F732 HydrophobicContact CG2-CE1 4.27Å; V720-F732 HydrophobicContact CG2-CE2 3.56Å; V720-F732 HydrophobicContact CG2-CZ 3.69Å; H730-F732 PolarHBondContact O-N 2.66Å; F732-P734 HydrophobicContact CD1-CG 4.48Å; F732-P734 HydrophobicContact CE1-CG 3.86Å; F732-P734 HydrophobicContact CE2-CG 4.19Å; F732-P734 HydrophobicContact CZ-CG 3.7Å; F732-L751 WeakPolarHBondContact CA-O 3.34Å; F732-L751 HydrophobicContact CD2-CB 4.03Å; F732-L751 HydrophobicContact CD2-CD2 3.76Å; F732-L751 HydrophobicContact CD2-CG 3.79Å; F732-L751 HydrophobicContact CE2-CD2 3.72Å; F732-L751 HydrophobicContact CE2-CG 4Å
733	I	96.2	Very high	92.8	Very high	19 Å²	19	25.6 Å²	25.6	10%	0.097	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	92.4	-174.7	-52.9	176.4	0	0	0	107.8	F548 T731 V735 L736 I743 L751 V752 G753	F548-I733 HydrophobicContact CE1-CG2 3.88Å; T731-I733 HydrophobicContact CG2-CD1 3.74Å; T731-I733 HydrophobicContact CG2-CG1 3.87Å; I733-V735 WeakPolarHBondContact CG2-O 3.39Å; I733-V735 PolarHBondContact O-N 3.32Å; I733-V735 VanDerWaalsContact O-N 3.13Å; I733-L736 HydrophobicContact CD1-CD1 3.95Å; I733-L736 HydrophobicContact CG2-CB 3.99Å; I733-L736 HydrophobicContact CG2-CD1 4.13Å; I733-I743 HydrophobicContact CD1-CD1 4.38Å; I733-I743 HydrophobicContact CD1-CG2 4.36Å; I733-L751 PolarHBondContact N-O 2.93Å; I733-V752 HydrophobicContact CB-CG1 4.18Å; I733-V752 HydrophobicContact CD1-CG1 4.4Å; I733-V752 HydrophobicContact CG1-CG1 4.43Å; I733-V752 CarbonylContact O-C 3.57Å; I733-V752 WeakPolarHBondContact O-CA 3.46Å; I733-G753 PolarHBondContact O-N 2.98Å
734	P	95.9	Very high	92.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-56.6	-28.2	-177.8	-25.9	32.9	0	0	0	114.4	M570 M716 F732	M570-P734 HydrophobicContact CB-CG 4.04Å; M716-P734 HydrophobicContact CB-CB 4.49Å; M716-P734 VanDerWaalsContact SD-O 3.33Å; F732-P734 HydrophobicContact CD1-CG 4.48Å; F732-P734 HydrophobicContact CE1-CG 3.86Å; F732-P734 HydrophobicContact CE2-CG 4.19Å; F732-P734 HydrophobicContact CZ-CG 3.7Å
735	V	97.2	Very high	92.6	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.012	15%	0.152	C	C	.	.	S	Bend	trans	-141.7	104.5	179.1	174.9	0	0	0	0	107	F548 P551 F567 F569 L709 L712 I733	F548-V735 VanDerWaalsContact CD1-O 3.25Å; F548-V735 WeakPolarHBondContact CD1-O 3.36Å; F548-V735 WeakPolarHBondContact CE1-O 3.35Å; P551-V735 HydrophobicContact CB-CG1 3.82Å; P551-V735 HydrophobicContact CG-CG1 3.62Å; F567-V735 HydrophobicContact CD2-CG2 4.21Å; F569-V735 HydrophobicContact CB-CB 4.26Å; L709-V735 HydrophobicContact CD2-CG1 3.69Å; L709-V735 HydrophobicContact CD2-CG2 4.1Å; L712-V735 HydrophobicContact CD2-CG2 4.4Å; I733-V735 WeakPolarHBondContact CG2-O 3.39Å; I733-V735 PolarHBondContact O-N 3.32Å; I733-V735 VanDerWaalsContact O-N 3.13Å
736	L	96.8	Very high	92.4	Very high	4 Å²	4	28 Å²	28	2%	0.021	16%	0.164	C	C	.	.			trans	-93.2	120.6	177.9	179.9	63.4	0	0	0	109.6	I733 M740 I743 V744 V752 G753 L754	I733-L736 HydrophobicContact CD1-CD1 3.95Å; I733-L736 HydrophobicContact CG2-CB 3.99Å; I733-L736 HydrophobicContact CG2-CD1 4.13Å; L736-M740 HydrophobicContact CD1-CB 3.8Å; L736-I743 HydrophobicContact CD1-CD1 4.11Å; L736-I743 HydrophobicContact CD2-CB 4.48Å; L736-V744 HydrophobicContact CD2-CG1 4.17Å; L736-V752 HydrophobicContact CD2-CB 4.38Å; L736-G753 WeakPolarHBondContact CB-O 3.46Å; L736-G753 PolarHBondContact N-O 2.86Å; L736-L754 HydrophobicContact CB-CD2 3.99Å; L736-L754 HydrophobicContact CD2-CD2 4.12Å; L736-L754 HydrophobicContact CG-CD2 4.27Å
737	P	95.1	Very high	92.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.189	C	C	.	.			trans	-62.8	144.5	178.8	-25.7	36.6	0	0	0	112.9	Q547 F548 P551 S739 M740	Q547-P737 HydrophobicContact CB-CB 4.15Å; Q547-P737 HydrophobicContact CB-CG 4.01Å; Q547-P737 WeakPolarHBondContact O-CB 3.31Å; Q547-P737 VanDerWaalsContact O-CG 3.25Å; Q547-P737 WeakPolarHBondContact O-CG 3.25Å; F548-P737 HydrophobicContact CD1-CG 3.85Å; F548-P737 HydrophobicContact CD2-CG 4.29Å; F548-P737 HydrophobicContact CE1-CG 3.94Å; F548-P737 HydrophobicContact CE2-CG 4.37Å; F548-P737 HydrophobicContact CG-CG 4.03Å; F548-P737 HydrophobicContact CZ-CG 4.2Å; P551-P737 HydrophobicContact CB-CB 4.34Å; P737-S739 PolarHBondContact O-N 3.4Å; P737-M740 HydrophobicContact CB-CG 4.38Å; P737-M740 HydrophobicContact CG-SD 4.1Å; P737-M740 PolarHBondContact O-N 2.92Å
738	A	90.6	Very high	92.1	Very high	15 Å²	15	31 Å²	31	12%	0.124	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-2	177.2	0	0	0	0	0	114.2	P551	P551-A738 WeakPolarHBondContact O-CB 3.37Å; P551-A738 PolarHBondContact O-N 2.72Å; P551-A738 VanDerWaalsContact O-N 3.09Å
739	S	89.4	Confident	92.1	Very high	61 Å²	61	30.9 Å²	30.9	43%	0.427	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-7.6	169	47.9	0	0	0	0	113.9	Q547 P737	Q547-S739 PolarHBondContact OE1-OG 3.17Å; P737-S739 PolarHBondContact O-N 3.4Å
740	M	92.8	Very high	92.5	Very high	37 Å²	37	29 Å²	29	18%	0.182	17%	0.173	C	C	.	.	S	Bend	trans	-123.2	17.6	-177.3	-58.6	-178.6	-176.8	0	0	112.1	Q547 F548 L736 P737 D742 I743	Q547-M740 HydrophobicContact CB-CE 4.08Å; Q547-M740 HydrophobicContact CG-CE 4.22Å; F548-M740 HydrophobicContact CE2-CE 4.09Å; F548-M740 HydrophobicContact CE2-SD 4.06Å; F548-M740 HydrophobicContact CZ-SD 3.91Å; L736-M740 HydrophobicContact CD1-CB 3.8Å; P737-M740 HydrophobicContact CB-CG 4.38Å; P737-M740 HydrophobicContact CG-SD 4.1Å; P737-M740 PolarHBondContact O-N 2.92Å; M740-D742 VanDerWaalsContact C-N 3.25Å; M740-D742 PolarHBondContact O-N 3.04Å; M740-I743 HydrophobicContact CB-CD1 4.21Å; M740-I743 WeakPolarHBondContact O-CG1 3.35Å; M740-I743 PolarHBondContact O-N 3.26Å
741	L	93.6	Very high	92.9	Very high	9 Å²	9	28.2 Å²	28.2	5%	0.047	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-58.5	-36	-169.1	-170.8	62.5	0	0	0	112.6	I743 V744 L754 K761 L762 L765	L741-I743 PolarHBondContact O-N 2.9Å; L741-V744 HydrophobicContact CD1-CG1 4.43Å; L741-V744 WeakPolarHBondContact O-CG1 3.47Å; L741-V744 WeakPolarHBondContact O-CG2 3.25Å; L741-V744 PolarHBondContact O-N 2.95Å; L741-L754 HydrophobicContact CD1-CD1 3.76Å; L741-L754 HydrophobicContact CD1-CD2 3.46Å; L741-L754 VanDerWaalsContact CD1-CD2 3.46Å; L741-L754 HydrophobicContact CD1-CG 4.29Å; L741-K761 HydrophobicContact CD2-CB 3.57Å; L741-L762 HydrophobicContact CD1-CD1 4.34Å; L741-L765 HydrophobicContact CB-CD1 4.41Å; L741-L765 HydrophobicContact CD2-CD1 3.94Å; L741-L765 HydrophobicContact CG-CD1 3.73Å
742	D	93.3	Very high	93.2	Very high	110 Å²	110	25.6 Å²	25.6	59%	0.588	15%	0.154	S	C	*	.	G	3₁₀ helix	trans	-55.7	-16.9	-177.1	-50.5	-32.6	0	0	0	114.6	M740 V744 C745	M740-D742 VanDerWaalsContact C-N 3.25Å; M740-D742 PolarHBondContact O-N 3.04Å; D742-V744 PolarHBondContact O-N 3.38Å; D742-V744 VanDerWaalsContact O-N 3.17Å; D742-C745 VanDerWaalsContact O-CB 3.3Å; D742-C745 WeakPolarHBondContact O-CB 3.35Å; D742-C745 PolarHBondContact O-N 3.18Å
743	I	92.1	Very high	93.4	Very high	68 Å²	68	25.4 Å²	25.4	35%	0.349	15%	0.153	S	C	.	.	G	3₁₀ helix	trans	-55.4	-28.9	171.8	-68.7	178.4	0	0	0	112	I733 L736 M740 L741 C745 C746	I733-I743 HydrophobicContact CD1-CD1 4.38Å; I733-I743 HydrophobicContact CD1-CG2 4.36Å; L736-I743 HydrophobicContact CD1-CD1 4.11Å; L736-I743 HydrophobicContact CD2-CB 4.48Å; M740-I743 HydrophobicContact CB-CD1 4.21Å; M740-I743 WeakPolarHBondContact O-CG1 3.35Å; M740-I743 PolarHBondContact O-N 3.26Å; L741-I743 PolarHBondContact O-N 2.9Å; I743-C745 PolarHBondContact O-N 3.07Å; I743-C746 WeakPolarHBondContact O-CB 3.45Å; I743-C746 PolarHBondContact O-N 3.21Å; I743-C746 VanDerWaalsContact O-N 3.07Å
744	V	94.1	Very high	93.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-62.9	-20.3	175.9	-59.4	0	0	0	0	113.8	I703 L736 L741 D742 C746 F750 V752 L762 L765 V767	I703-V744 HydrophobicContact CD1-CB 4.41Å; I703-V744 HydrophobicContact CD1-CG1 4.22Å; L736-V744 HydrophobicContact CD2-CG1 4.17Å; L741-V744 HydrophobicContact CD1-CG1 4.43Å; L741-V744 WeakPolarHBondContact O-CG1 3.47Å; L741-V744 WeakPolarHBondContact O-CG2 3.25Å; L741-V744 PolarHBondContact O-N 2.95Å; D742-V744 PolarHBondContact O-N 3.38Å; D742-V744 VanDerWaalsContact O-N 3.17Å; V744-C746 PolarHBondContact O-N 3.05Å; V744-F750 HydrophobicContact CB-CZ 4.32Å; V744-F750 WeakPolarHBondContact O-CE1 3.32Å; V744-F750 WeakPolarHBondContact O-CZ 3.42Å; V744-V752 HydrophobicContact CG1-CG2 4.21Å; V744-L762 HydrophobicContact CB-CD1 4.18Å; V744-L762 HydrophobicContact CG1-CD1 4.07Å; V744-L762 HydrophobicContact CG2-CD1 3.71Å; V744-L765 HydrophobicContact CG2-CD1 3.66Å; V744-V767 HydrophobicContact CB-CG2 4.35Å; V744-V767 HydrophobicContact CG2-CG2 3.73Å
745	C	92.3	Very high	93.4	Very high	46 Å²	46	25.2 Å²	25.2	31%	0.311	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-78.7	-3	176.2	-59.1	0	0	0	0	112.7	D742 I743	D742-C745 VanDerWaalsContact O-CB 3.3Å; D742-C745 WeakPolarHBondContact O-CB 3.35Å; D742-C745 PolarHBondContact O-N 3.18Å; I743-C745 PolarHBondContact O-N 3.07Å
746	C	88.6	Confident	93.3	Very high	44 Å²	44	26.4 Å²	26.4	30%	0.297	16%	0.16	S	C	.	.			trans	-62.6	137.8	180	-165.1	0	0	0	0	111.6	R701 I743 V744 T748 F750	R701-C746 WeakPolarHBondContact CD-O 3.47Å; R701-C746 PolarHBondContact NH1-O 2.82Å; I743-C746 WeakPolarHBondContact O-CB 3.45Å; I743-C746 PolarHBondContact O-N 3.21Å; I743-C746 VanDerWaalsContact O-N 3.07Å; V744-C746 PolarHBondContact O-N 3.05Å; C746-T748 VanDerWaalsContact C-N 3.3Å; C746-T748 PolarHBondContact O-N 2.81Å; C746-T748 PolarHBondContact SG-OG1 3.14Å; C746-F750 HydrophobicContact CB-CD1 4.43Å
747	P	85.2	Confident	93.2	Very high	88 Å²	88	28.5 Å²	28.5	57%	0.571	18%	0.176	S	C	*	.	S	Bend	trans	-75.5	-14	174.4	30	-36.4	0	0	0	114
748	T	88.1	Confident	93.1	Very high	28 Å²	28	28.7 Å²	28.7	17%	0.172	18%	0.177	C	C	.	.	S	Bend	trans	-75.1	162.9	177.9	66.9	0	0	0	0	111.6	R701 C746	R701-T748 WeakPolarHBondContact CG-O 3.38Å; C746-T748 VanDerWaalsContact C-N 3.3Å; C746-T748 PolarHBondContact O-N 2.81Å; C746-T748 PolarHBondContact SG-OG1 3.14Å
749	P	91.7	Very high	93.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.18	C	C	.	.			trans	-57.6	149.8	165.6	-22.7	36	0	0	0	111.3	L474 E699 W728 H730	L474-P749 HydrophobicContact CD1-CG 3.89Å; E699-P749 HydrophobicContact CB-CB 4.24Å; E699-P749 HydrophobicContact CB-CG 4.06Å; E699-P749 WeakPolarHBondContact O-CB 3.37Å; E699-P749 WeakPolarHBondContact O-CG 3.3Å; W728-P749 HydrophobicContact CH2-CB 4.2Å; W728-P749 HydrophobicContact CZ2-CB 4.19Å; H730-P749 HydrophobicContact CB-CB 3.9Å
750	F	94.4	Very high	93.3	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.009	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	155.5	171.3	57.9	-111.9	0	0	0	110.3	R701 V702 I703 T731 V744 C746 V752	R701-F750 HydrophobicContact CB-CD1 4.37Å; R701-F750 HydrophobicContact CB-CD2 4.35Å; R701-F750 HydrophobicContact CB-CE1 3.97Å; R701-F750 HydrophobicContact CB-CE2 3.92Å; R701-F750 HydrophobicContact CB-CZ 3.73Å; R701-F750 VanDerWaalsContact CD-CE1 3.49Å; R701-F750 HydrophobicContact CG-CD1 3.85Å; R701-F750 HydrophobicContact CG-CE1 3.59Å; R701-F750 HydrophobicContact CG-CE2 4.43Å; R701-F750 HydrophobicContact CG-CG 4.4Å; R701-F750 HydrophobicContact CG-CZ 3.91Å; V702-F750 PolarHBondContact N-O 2.78Å; I703-F750 HydrophobicContact CD1-CE2 4.38Å; I703-F750 HydrophobicContact CG1-CE2 3.79Å; I703-F750 HydrophobicContact CG1-CZ 4.49Å; T731-F750 HydrophobicContact CG2-CB 4.19Å; T731-F750 WeakPolarHBondContact O-CA 3.41Å; V744-F750 HydrophobicContact CB-CZ 4.32Å; V744-F750 WeakPolarHBondContact O-CE1 3.32Å; V744-F750 WeakPolarHBondContact O-CZ 3.42Å; C746-F750 HydrophobicContact CB-CD1 4.43Å; F750-V752 HydrophobicContact CB-CG1 4.17Å; F750-V752 HydrophobicContact CD2-CB 4.38Å; F750-V752 HydrophobicContact CD2-CG1 3.87Å; F750-V752 HydrophobicContact CD2-CG2 3.76Å; F750-V752 HydrophobicContact CE2-CG2 3.8Å; F750-V752 HydrophobicContact CG-CG1 4.25Å
751	L	97.6	Very high	93.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	108.7	166.1	172	59.2	0	0	0	108	L696 V702 F704 M716 V719 V720 W728 T731 F732 I733	L696-L751 HydrophobicContact CD1-CD2 4.33Å; L696-L751 HydrophobicContact CD2-CB 4.39Å; L696-L751 HydrophobicContact CD2-CD1 4.39Å; L696-L751 HydrophobicContact CD2-CD2 4.05Å; V702-L751 HydrophobicContact CB-CD1 3.92Å; V702-L751 HydrophobicContact CG1-CD1 3.95Å; V702-L751 WeakPolarHBondContact O-CA 3.29Å; F704-L751 HydrophobicContact CD2-CD1 3.65Å; F704-L751 HydrophobicContact CE2-CD1 3.81Å; M716-L751 HydrophobicContact CE-CD1 3.82Å; M716-L751 HydrophobicContact CE-CG 3.67Å; V719-L751 HydrophobicContact CG2-CD2 4.16Å; V720-L751 HydrophobicContact CG2-CD2 3.47Å; V720-L751 VanDerWaalsContact CG2-CD2 3.47Å; W728-L751 HydrophobicContact CZ2-CB 4.23Å; T731-L751 PolarHBondContact O-N 2.94Å; F732-L751 WeakPolarHBondContact CA-O 3.34Å; F732-L751 HydrophobicContact CD2-CB 4.03Å; F732-L751 HydrophobicContact CD2-CD2 3.76Å; F732-L751 HydrophobicContact CD2-CG 3.79Å; F732-L751 HydrophobicContact CE2-CD2 3.72Å; F732-L751 HydrophobicContact CE2-CG 4Å; I733-L751 PolarHBondContact N-O 2.93Å
752	V	97.8	Very high	93.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.6	-172.9	-58.5	0	0	0	0	112.2	V702 I703 F704 I733 L736 V744 F750	V702-V752 PolarHBondContact O-N 2.97Å; I703-V752 CarbonylContact C-O 3.59Å; I703-V752 WeakPolarHBondContact CA-O 3.36Å; I703-V752 HydrophobicContact CB-CG2 4.45Å; I703-V752 HydrophobicContact CG1-CG2 3.94Å; I703-V752 HydrophobicContact CG2-CG2 4.47Å; F704-V752 PolarHBondContact N-O 2.95Å; I733-V752 HydrophobicContact CB-CG1 4.18Å; I733-V752 HydrophobicContact CD1-CG1 4.4Å; I733-V752 HydrophobicContact CG1-CG1 4.43Å; I733-V752 CarbonylContact O-C 3.57Å; I733-V752 WeakPolarHBondContact O-CA 3.46Å; L736-V752 HydrophobicContact CD2-CB 4.38Å; V744-V752 HydrophobicContact CG1-CG2 4.21Å; F750-V752 HydrophobicContact CB-CG1 4.17Å; F750-V752 HydrophobicContact CD2-CB 4.38Å; F750-V752 HydrophobicContact CD2-CG1 3.87Å; F750-V752 HydrophobicContact CD2-CG2 3.76Å; F750-V752 HydrophobicContact CE2-CG2 3.8Å; F750-V752 HydrophobicContact CG-CG1 4.25Å
753	G	98	Very high	93	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	137.8	178.8	0	0	0	0	0	112	F704 M716 I733 L736	F704-G753 CarbonylContact O-C 3.4Å; F704-G753 WeakPolarHBondContact O-CA 3.31Å; M716-G753 VanDerWaalsContact CE-N 3.35Å; M716-G753 WeakPolarHBondContact SD-CA 3.31Å; M716-G753 PolarHBondContact SD-N 2.92Å; M716-G753 VanDerWaalsContact SD-N 3.39Å; I733-G753 PolarHBondContact O-N 2.98Å; L736-G753 WeakPolarHBondContact CB-O 3.46Å; L736-G753 PolarHBondContact N-O 2.86Å
754	L	96.9	Very high	93	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.6	178.9	-69.4	173.3	0	0	0	111.5	I703 F704 V705 A706 L736 L741 L762	I703-L754 HydrophobicContact CG2-CD1 3.79Å; I703-L754 HydrophobicContact CG2-CG 4.36Å; F704-L754 PolarHBondContact O-N 3.08Å; V705-L754 WeakPolarHBondContact CA-O 3.01Å; A706-L754 PolarHBondContact N-O 3.43Å; L736-L754 HydrophobicContact CB-CD2 3.99Å; L736-L754 HydrophobicContact CD2-CD2 4.12Å; L736-L754 HydrophobicContact CG-CD2 4.27Å; L741-L754 HydrophobicContact CD1-CD1 3.76Å; L741-L754 HydrophobicContact CD1-CD2 3.46Å; L741-L754 VanDerWaalsContact CD1-CD2 3.46Å; L741-L754 HydrophobicContact CD1-CG 4.29Å; L754-L762 HydrophobicContact CD1-CD1 4.13Å; L754-L762 HydrophobicContact CD1-CD2 3.72Å; L754-L762 HydrophobicContact CD1-CG 4.42Å
755	L	96.6	Very high	92.9	Very high	14 Å²	14	40.3 Å²	40.3	7%	0.073	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	145.6	162.6	-76.2	173.9	0	0	0	110.4	P551 D552 A706 L709 S757 S758	P551-L755 HydrophobicContact CG-CD1 4.09Å; D552-L755 HydrophobicContact CB-CD1 3.73Å; A706-L755 CarbonylContact O-C 3.57Å; A706-L755 VanDerWaalsContact O-CA 3.32Å; A706-L755 WeakPolarHBondContact O-CA 3.38Å; L709-L755 HydrophobicContact CD2-CD1 3.72Å; L709-L755 HydrophobicContact CD2-CD2 3.68Å; L709-L755 HydrophobicContact CD2-CG 3.63Å; L709-L755 HydrophobicContact CG-CD1 4.2Å; L709-L755 HydrophobicContact CG-CD2 4.05Å; L709-L755 HydrophobicContact CG-CG 4.38Å; L755-S757 PolarHBondContact O-N 2.8Å; L755-S757 VanDerWaalsContact O-N 3.08Å; L755-S758 WeakPolarHBondContact O-CB 3.15Å; L755-S758 PolarHBondContact O-N 3.2Å
756	S	95	Very high	92.8	Very high	27 Å²	27	42.8 Å²	42.8	19%	0.189	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-53.8	-29.2	178.1	-57.5	0	0	0	0	113.9	A706 D707 S758 L759	A706-S756 VanDerWaalsContact C-OG 3.22Å; A706-S756 PolarHBondContact O-N 2.8Å; A706-S756 PolarHBondContact O-OG 3.14Å; D707-S756 PolarHBondContact N-OG 3.15Å; D707-S756 WeakPolarHBondContact OD1-CB 3.33Å; D707-S756 PolarHBondContact OD1-OG 3.09Å; S756-S758 PolarHBondContact O-N 3.28Å; S756-S758 VanDerWaalsContact O-N 3.13Å; S756-L759 VanDerWaalsContact O-CB 3.28Å; S756-L759 WeakPolarHBondContact O-CB 3.39Å; S756-L759 PolarHBondContact O-N 2.83Å
757	S	93.3	Very high	92.7	Very high	49 Å²	49	41.3 Å²	41.3	34%	0.343	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-64.6	-13.4	174.8	73	0	0	0	0	114.4	D555 L755 K761	D555-S757 WeakPolarHBondContact OD2-CB 3.16Å; D555-S757 PolarHBondContact OD2-OG 2.7Å; L755-S757 PolarHBondContact O-N 2.8Å; L755-S757 VanDerWaalsContact O-N 3.08Å; S757-K761 PolarHBondContact O-NZ 2.57Å
758	S	93.8	Very high	92.5	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.021	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-91.1	-11.6	173	-61.9	0	0	0	0	113.7	L755 S756 P760 K761 L762	L755-S758 WeakPolarHBondContact O-CB 3.15Å; L755-S758 PolarHBondContact O-N 3.2Å; S756-S758 PolarHBondContact O-N 3.28Å; S756-S758 VanDerWaalsContact O-N 3.13Å; S758-P760 VanDerWaalsContact C-CD 3.47Å; S758-K761 PolarHBondContact O-N 3.45Å; S758-L762 WeakPolarHBondContact O-CB 3.29Å; S758-L762 PolarHBondContact O-N 3.37Å
759	L	92.2	Very high	92.3	Very high	38 Å²	38	46.8 Å²	46.8	20%	0.199	24%	0.242	C	C	.	.	H	α-helix	trans	-56.4	-38.2	178.4	-78.7	177.5	0	0	0	115.2	V705 S756 L762 K763 M772 I781	V705-L759 HydrophobicContact CG1-CD1 3.97Å; V705-L759 HydrophobicContact CG1-CD2 4.01Å; V705-L759 HydrophobicContact CG1-CG 3.87Å; V705-L759 HydrophobicContact CG2-CD2 4.03Å; S756-L759 VanDerWaalsContact O-CB 3.28Å; S756-L759 WeakPolarHBondContact O-CB 3.39Å; S756-L759 PolarHBondContact O-N 2.83Å; L759-L762 HydrophobicContact CD2-CD2 4.19Å; L759-L762 PolarHBondContact O-N 2.97Å; L759-K763 WeakPolarHBondContact O-CG 3.27Å; L759-K763 PolarHBondContact O-N 3.03Å; L759-M772 HydrophobicContact CD2-CE 4.44Å; L759-I781 HydrophobicContact CD1-CD1 4.39Å; L759-I781 HydrophobicContact CD2-CD1 3.91Å
760	P	92.4	Very high	92.3	Very high	74 Å²	74	46.8 Å²	46.8	48%	0.481	24%	0.242	S	C	.	.	H	α-helix	trans	-61.6	-50.9	177.4	-23.8	35.1	0	0	0	111.3	S758 L762 K763	S758-P760 VanDerWaalsContact C-CD 3.47Å; P760-L762 VanDerWaalsContact C-N 3.28Å; P760-L762 PolarHBondContact O-N 2.95Å; P760-K763 WeakPolarHBondContact O-CB 3.36Å; P760-K763 PolarHBondContact O-N 3.28Å
761	K	90.9	Very high	92.3	Very high	63 Å²	63	46.7 Å²	46.7	27%	0.274	24%	0.242	S	C	.	.	H	α-helix	trans	-61.7	-35.7	178.7	-50	-176.9	-169.5	80.3	0	111.7	L741 S757 S758 K763 E764	L741-K761 HydrophobicContact CD2-CB 3.57Å; S757-K761 PolarHBondContact O-NZ 2.57Å; S758-K761 PolarHBondContact O-N 3.45Å; K761-K763 VanDerWaalsContact C-N 3.27Å; K761-K763 PolarHBondContact O-N 3.42Å; K761-E764 WeakPolarHBondContact O-CB 3.5Å; K761-E764 PolarHBondContact O-N 3.34Å
762	L	92.2	Very high	92.2	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-64.4	-29.3	176.4	-175.4	65.7	0	0	0	113	I703 L741 V744 L754 S758 L759 P760 E764 L765 V767 M772	I703-L762 HydrophobicContact CD1-CD1 4.23Å; I703-L762 HydrophobicContact CD1-CD2 4.28Å; I703-L762 HydrophobicContact CG2-CD2 4.37Å; L741-L762 HydrophobicContact CD1-CD1 4.34Å; V744-L762 HydrophobicContact CB-CD1 4.18Å; V744-L762 HydrophobicContact CG1-CD1 4.07Å; V744-L762 HydrophobicContact CG2-CD1 3.71Å; L754-L762 HydrophobicContact CD1-CD1 4.13Å; L754-L762 HydrophobicContact CD1-CD2 3.72Å; L754-L762 HydrophobicContact CD1-CG 4.42Å; S758-L762 WeakPolarHBondContact O-CB 3.29Å; S758-L762 PolarHBondContact O-N 3.37Å; L759-L762 HydrophobicContact CD2-CD2 4.19Å; L759-L762 PolarHBondContact O-N 2.97Å; P760-L762 VanDerWaalsContact C-N 3.28Å; P760-L762 PolarHBondContact O-N 2.95Å; L762-E764 VanDerWaalsContact C-N 3.3Å; L762-L765 PolarHBondContact O-N 2.96Å; L762-V767 HydrophobicContact CD1-CG2 3.91Å; L762-M772 HydrophobicContact CD2-CE 3.53Å; L762-M772 HydrophobicContact CG-CE 4.45Å
763	K	89.9	Confident	92.2	Very high	169 Å²	169	47.3 Å²	47.3	74%	0.735	25%	0.245	S	C	*	.	H	α-helix	trans	-75.9	-18.9	176.6	-67.7	169.4	-178	-179.8	0	113.1	L759 P760 K761 L765	L759-K763 WeakPolarHBondContact O-CG 3.27Å; L759-K763 PolarHBondContact O-N 3.03Å; P760-K763 WeakPolarHBondContact O-CB 3.36Å; P760-K763 PolarHBondContact O-N 3.28Å; K761-K763 VanDerWaalsContact C-N 3.27Å; K761-K763 PolarHBondContact O-N 3.42Å; K763-L765 VanDerWaalsContact C-N 3.34Å
764	E	92.1	Very high	92.1	Very high	153 Å²	153	48.9 Å²	48.9	72%	0.715	25%	0.253	S	S	*	.	H	α-helix	trans	-81.7	-17	176.6	-62.5	159.8	-169.4	0	0	111.8	K761 L762	K761-E764 WeakPolarHBondContact O-CB 3.5Å; K761-E764 PolarHBondContact O-N 3.34Å; L762-E764 VanDerWaalsContact C-N 3.3Å
765	L	92.3	Very high	92.1	Very high	42 Å²	42	49.2 Å²	49.2	22%	0.22	26%	0.255	C	S	.	.	S	Bend	trans	-90.1	146.1	-177.9	-68.3	177.9	0	0	0	113	L741 V744 L762 K763 V767	L741-L765 HydrophobicContact CB-CD1 4.41Å; L741-L765 HydrophobicContact CD2-CD1 3.94Å; L741-L765 HydrophobicContact CG-CD1 3.73Å; V744-L765 HydrophobicContact CG2-CD1 3.66Å; L762-L765 PolarHBondContact O-N 2.96Å; K763-L765 VanDerWaalsContact C-N 3.34Å; L765-V767 HydrophobicContact CB-CG2 4Å; L765-V767 PolarHBondContact O-N 3.41Å
766	P	90	Very high	91.8	Very high	98 Å²	98	51.1 Å²	51.1	64%	0.636	28%	0.278	S	S	*	.			trans	-76.4	62.9	178.1	33.8	-37.5	0	0	0	112	E768	P766-E768 PolarHBondContact O-N 3.34Å
767	V	86.4	Confident	91.6	Very high	12 Å²	12	53.5 Å²	53.5	7%	0.073	29%	0.292	C	S	.	.			trans	-79.5	113.2	177.7	-168.9	0	0	0	0	109.5	I703 V744 L762 L765 A770 R782	I703-V767 HydrophobicContact CD1-CG1 4.2Å; V744-V767 HydrophobicContact CB-CG2 4.35Å; V744-V767 HydrophobicContact CG2-CG2 3.73Å; L762-V767 HydrophobicContact CD1-CG2 3.91Å; L765-V767 HydrophobicContact CB-CG2 4Å; L765-V767 PolarHBondContact O-N 3.41Å; V767-A770 HydrophobicContact CG1-CB 3.97Å; V767-R782 PolarHBondContact O-NH1 2.85Å
768	E	80.2	Confident	91.4	Very high	133 Å²	133	53.6 Å²	53.6	62%	0.621	29%	0.288	S	S	*	.			trans	-105.4	153.2	175.6	-65.1	-179.1	166.7	0	0	111.8	R701 P766 A770	R701-E768 PolarHBondContact NE-O 2.96Å; R701-E768 VanDerWaalsContact NE-O 3.12Å; R701-E768 PolarHBondContact NH2-O 3.45Å; R701-E768 VanDerWaalsContact NH2-O 3.08Å; P766-E768 PolarHBondContact O-N 3.34Å; E768-A770 PolarHBondContact O-N 2.97Å; E768-A770 VanDerWaalsContact O-N 3.16Å
769	E	84.5	Confident	91.2	Very high	98 Å²	98	61.9 Å²	61.9	46%	0.458	32%	0.319	S	S	.	.	S	Bend	trans	36.4	58.8	172.1	-44.3	177.9	133.5	0	0	115.7	R470 R701 M784	R470-E769 IonicContact CZ-OE2 3.35Å; R470-E769 IonicContact NE-OE2 3.91Å; R470-E769 IonicContact NH1-OE2 2.74Å; R470-E769 PolarHBondContact NH1-OE2 2.96Å; R701-E769 PolarHBondContact NE-O 3.26Å; R701-E769 IonicContact NH2-OE2 3.7Å; R701-E769 PolarHBondContact NH2-OE2 2.91Å; E769-M784 HydrophobicContact CB-SD 4.08Å
770	A	92.1	Very high	91.3	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.4	176.2	0	0	0	0	0	110.9	R701 I703 V767 E768 R782	R701-A770 HydrophobicContact CB-CB 3.74Å; R701-A770 CarbonylContact O-C 3.6Å; R701-A770 VanDerWaalsContact O-CA 3.29Å; R701-A770 WeakPolarHBondContact O-CA 3.18Å; I703-A770 HydrophobicContact CD1-CB 4.49Å; V767-A770 HydrophobicContact CG1-CB 3.97Å; E768-A770 PolarHBondContact O-N 2.97Å; E768-A770 VanDerWaalsContact O-N 3.16Å; A770-R782 WeakPolarHBondContact O-CD 3.33Å
771	L	94.7	Very high	91.2	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127.5	168.5	178.3	70.1	0	0	0	108.1	V692 R701 V702 I703 V773 F780	V692-L771 HydrophobicContact CG2-CD2 4.25Å; R701-L771 PolarHBondContact O-N 2.76Å; V702-L771 WeakPolarHBondContact CA-O 3.3Å; V702-L771 HydrophobicContact CG1-CB 4.44Å; V702-L771 HydrophobicContact CG1-CD2 4.21Å; V702-L771 HydrophobicContact CG2-CB 4.39Å; I703-L771 PolarHBondContact N-O 2.94Å; L771-V773 HydrophobicContact CD2-CG2 4.23Å; L771-V773 HydrophobicContact CG-CG2 4.15Å; L771-F780 HydrophobicContact CD1-CB 4.48Å; L771-F780 HydrophobicContact CD1-CD1 3.76Å; L771-F780 HydrophobicContact CD1-CD2 4.37Å; L771-F780 HydrophobicContact CD1-CE1 4.06Å; L771-F780 HydrophobicContact CD1-CG 3.95Å; L771-F780 HydrophobicContact CD1-CZ 4.47Å; L771-F780 HydrophobicContact CD2-CE1 4.28Å; L771-F780 HydrophobicContact CG-CD1 4.28Å; L771-F780 HydrophobicContact CG-CE1 4.38Å
772	M	95.8	Very high	91.2	Very high	13 Å²	13	63 Å²	63	6%	0.064	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.4	179.1	-63.5	177.2	59.9	0	0	109.9	I703 L759 L762 F780 I781 R782	I703-M772 HydrophobicContact CB-CG 4.24Å; I703-M772 HydrophobicContact CD1-CG 4.28Å; I703-M772 CarbonylContact O-C 3.58Å; I703-M772 WeakPolarHBondContact O-CA 3.35Å; L759-M772 HydrophobicContact CD2-CE 4.44Å; L762-M772 HydrophobicContact CD2-CE 3.53Å; L762-M772 HydrophobicContact CG-CE 4.45Å; M772-F780 CarbonylContact O-C 3.58Å; M772-F780 WeakPolarHBondContact O-CA 3.41Å; M772-F780 WeakPolarHBondContact O-CB 3.42Å; M772-I781 HydrophobicContact CB-CB 3.89Å; M772-I781 HydrophobicContact CE-CB 4.28Å; M772-I781 HydrophobicContact CE-CD1 4.39Å; M772-I781 HydrophobicContact CE-CG2 4.05Å; M772-I781 PolarHBondContact O-N 2.97Å; M772-R782 HydrophobicContact CB-CB 3.95Å; M772-R782 HydrophobicContact CG-CB 3.95Å; M772-R782 PolarHBondContact N-O 2.85Å; M772-R782 HydrophobicContact SD-CB 3.89Å
773	V	96.8	Very high	91.1	Very high	0 Å²	0	66 Å²	66	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.3	-172.6	-165.2	0	0	0	0	110.1	L684 V692 V702 I703 F704 V705 L771 F780	L684-V773 HydrophobicContact CD1-CG1 3.96Å; L684-V773 HydrophobicContact CD2-CG1 3.94Å; V692-V773 HydrophobicContact CG2-CG2 3.99Å; V702-V773 HydrophobicContact CG1-CG2 4.19Å; I703-V773 PolarHBondContact O-N 3.19Å; F704-V773 CarbonylContact C-O 3.57Å; F704-V773 HydrophobicContact CD1-CB 4.1Å; F704-V773 HydrophobicContact CD1-CG1 4.21Å; F704-V773 HydrophobicContact CD2-CB 4.43Å; F704-V773 HydrophobicContact CD2-CG2 4.23Å; F704-V773 HydrophobicContact CE1-CB 4.11Å; F704-V773 HydrophobicContact CE1-CG1 3.89Å; F704-V773 HydrophobicContact CE1-CG2 4.4Å; F704-V773 HydrophobicContact CE2-CB 4.42Å; F704-V773 HydrophobicContact CE2-CG2 3.95Å; F704-V773 HydrophobicContact CG-CB 4.27Å; F704-V773 HydrophobicContact CZ-CB 4.26Å; F704-V773 HydrophobicContact CZ-CG1 4.23Å; F704-V773 HydrophobicContact CZ-CG2 4.03Å; V705-V773 PolarHBondContact N-O 3.06Å; L771-V773 HydrophobicContact CD2-CG2 4.23Å; L771-V773 HydrophobicContact CG-CG2 4.15Å; V773-F780 HydrophobicContact CB-CD1 4.15Å; V773-F780 HydrophobicContact CB-CE1 4.25Å; V773-F780 HydrophobicContact CG1-CD1 4.06Å; V773-F780 HydrophobicContact CG1-CE1 3.86Å; V773-F780 HydrophobicContact CG2-CD1 3.85Å; V773-F780 HydrophobicContact CG2-CE1 3.76Å
774	D	95.8	Very high	90.7	Very high	32 Å²	32	61 Å²	61	17%	0.171	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113	172.3	179.1	7.3	0	0	0	109.7	G776 T777 R779 I781	D774-G776 VanDerWaalsContact C-N 3.25Å; D774-G776 PolarHBondContact O-N 2.9Å; D774-G776 WeakPolarHBondContact OD1-CA 3.28Å; D774-G776 PolarHBondContact OD1-N 3.11Å; D774-T777 VanDerWaalsContact CG-OG1 3.27Å; D774-T777 WeakPolarHBondContact OD2-CB 3.38Å; D774-T777 VanDerWaalsContact OD2-CG2 3.25Å; D774-T777 WeakPolarHBondContact OD2-CG2 3.26Å; D774-T777 PolarHBondContact OD2-OG1 3.17Å; D774-R779 PolarHBondContact N-O 2.9Å; D774-I781 HydrophobicContact CB-CD1 4.14Å; D774-I781 HydrophobicContact CB-CG1 3.93Å
775	L	96.1	Very high	90.2	Very high	8 Å²	8	59.6 Å²	59.6	4%	0.042	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-13.5	177.3	-67.5	174.4	0	0	0	112.9	C683 L684 F704 V705 A706 T711 L712 C715	C683-L775 HydrophobicContact CB-CB 4.14Å; C683-L775 HydrophobicContact CB-CD2 3.85Å; C683-L775 WeakPolarHBondContact CB-O 3.26Å; L684-L775 HydrophobicContact CD1-CD2 3.96Å; L684-L775 HydrophobicContact CD2-CD2 4.25Å; L684-L775 HydrophobicContact CG-CD2 3.84Å; F704-L775 HydrophobicContact CD1-CD1 3.91Å; F704-L775 HydrophobicContact CD1-CD2 3.81Å; F704-L775 HydrophobicContact CD1-CG 3.87Å; F704-L775 HydrophobicContact CE1-CD2 3.84Å; F704-L775 HydrophobicContact CE1-CG 4.41Å; V705-L775 WeakPolarHBondContact O-CB 3.45Å; V705-L775 PolarHBondContact O-N 3.42Å; A706-L775 HydrophobicContact CB-CB 4.07Å; A706-L775 HydrophobicContact CB-CD1 4.09Å; T711-L775 HydrophobicContact CG2-CB 4.47Å; T711-L775 HydrophobicContact CG2-CD1 4.35Å; L712-L775 HydrophobicContact CD1-CD1 4.31Å; C715-L775 HydrophobicContact CB-CD1 3.67Å; C715-L775 HydrophobicContact CB-CD2 3.92Å; C715-L775 HydrophobicContact CB-CG 4.49Å
776	G	91.2	Very high	89.8	Confident	54 Å²	54	58.4 Å²	58.4	56%	0.557	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-17.7	177.3	0	0	0	0	0	114.4	D774	D774-G776 VanDerWaalsContact C-N 3.25Å; D774-G776 PolarHBondContact O-N 2.9Å; D774-G776 WeakPolarHBondContact OD1-CA 3.28Å; D774-G776 PolarHBondContact OD1-N 3.11Å
777	T	90.1	Very high	89.5	Confident	78 Å²	78	53.9 Å²	53.9	48%	0.479	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.9	8.2	-169.2	67.8	0	0	0	0	116.6	D774 R779	D774-T777 VanDerWaalsContact CG-OG1 3.27Å; D774-T777 WeakPolarHBondContact OD2-CB 3.38Å; D774-T777 VanDerWaalsContact OD2-CG2 3.25Å; D774-T777 WeakPolarHBondContact OD2-CG2 3.26Å; D774-T777 PolarHBondContact OD2-OG1 3.17Å; T777-R779 WeakPolarHBondContact O-CG 3.25Å; T777-R779 PolarHBondContact O-N 3.48Å
778	D	90.5	Very high	89.1	Confident	51 Å²	51	55.5 Å²	55.5	27%	0.273	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	31.2	-173.8	-168.6	36.1	0	0	0	114.2	L684 S685 Q688	L684-D778 VanDerWaalsContact CA-OD1 3.25Å; L684-D778 WeakPolarHBondContact CA-OD1 3.45Å; S685-D778 WeakPolarHBondContact CB-OD2 3.48Å; S685-D778 PolarHBondContact N-OD1 2.72Å; S685-D778 PolarHBondContact OG-OD1 2.94Å; S685-D778 PolarHBondContact OG-OD2 2.92Å; Q688-D778 VanDerWaalsContact CG-OD1 3.27Å; Q688-D778 WeakPolarHBondContact CG-OD1 3.24Å; Q688-D778 PolarHBondContact NE2-O 2.87Å
779	R	89.8	Confident	89.2	Confident	176 Å²	176	51.8 Å²	51.8	66%	0.664	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133	158.3	-171.3	-72.2	172.6	75.5	156.1	4.9	112.5	D774 T777	D774-R779 PolarHBondContact N-O 2.9Å; T777-R779 WeakPolarHBondContact O-CG 3.25Å; T777-R779 PolarHBondContact O-N 3.48Å
780	F	92.5	Very high	89.1	Confident	24 Å²	24	47.4 Å²	47.4	11%	0.105	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128.1	169.1	-58.1	-56.4	0	0	0	109.5	Q688 R691 V692 L771 M772 V773 Q783	Q688-F780 HydrophobicContact CB-CE2 4.48Å; Q688-F780 HydrophobicContact CB-CZ 4Å; R691-F780 HydrophobicContact CB-CE2 4.16Å; R691-F780 HydrophobicContact CB-CZ 4.03Å; V692-F780 HydrophobicContact CG2-CE1 3.94Å; V692-F780 HydrophobicContact CG2-CZ 4.24Å; L771-F780 HydrophobicContact CD1-CB 4.48Å; L771-F780 HydrophobicContact CD1-CD1 3.76Å; L771-F780 HydrophobicContact CD1-CD2 4.37Å; L771-F780 HydrophobicContact CD1-CE1 4.06Å; L771-F780 HydrophobicContact CD1-CG 3.95Å; L771-F780 HydrophobicContact CD1-CZ 4.47Å; L771-F780 HydrophobicContact CD2-CE1 4.28Å; L771-F780 HydrophobicContact CG-CD1 4.28Å; L771-F780 HydrophobicContact CG-CE1 4.38Å; M772-F780 CarbonylContact O-C 3.58Å; M772-F780 WeakPolarHBondContact O-CA 3.41Å; M772-F780 WeakPolarHBondContact O-CB 3.42Å; V773-F780 HydrophobicContact CB-CD1 4.15Å; V773-F780 HydrophobicContact CB-CE1 4.25Å; V773-F780 HydrophobicContact CG1-CD1 4.06Å; V773-F780 HydrophobicContact CG1-CE1 3.86Å; V773-F780 HydrophobicContact CG2-CD1 3.85Å; V773-F780 HydrophobicContact CG2-CE1 3.76Å; F780-Q783 HydrophobicContact CB-CG 3.54Å; F780-Q783 HydrophobicContact CD2-CG 3.77Å; F780-Q783 HydrophobicContact CG-CG 4.01Å
781	I	91.9	Very high	89	Confident	75 Å²	75	47.7 Å²	47.7	39%	0.385	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	-29	170.7	-51	174.8	0	0	0	109.5	V705 L759 M772 D774	V705-I781 HydrophobicContact CB-CD1 4.44Å; V705-I781 HydrophobicContact CG2-CD1 4.12Å; L759-I781 HydrophobicContact CD1-CD1 4.39Å; L759-I781 HydrophobicContact CD2-CD1 3.91Å; M772-I781 HydrophobicContact CB-CB 3.89Å; M772-I781 HydrophobicContact CE-CB 4.28Å; M772-I781 HydrophobicContact CE-CD1 4.39Å; M772-I781 HydrophobicContact CE-CG2 4.05Å; M772-I781 PolarHBondContact O-N 2.97Å; D774-I781 HydrophobicContact CB-CD1 4.14Å; D774-I781 HydrophobicContact CB-CG1 3.93Å
782	R	91.1	Very high	88.9	Confident	101 Å²	101	47.9 Å²	47.9	38%	0.381	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	132.9	176.3	-173.3	-176.5	-70.8	-178.5	-5.8	109.8	V767 A770 M772	V767-R782 PolarHBondContact O-NH1 2.85Å; A770-R782 WeakPolarHBondContact O-CD 3.33Å; M772-R782 HydrophobicContact CB-CB 3.95Å; M772-R782 HydrophobicContact CG-CB 3.95Å; M772-R782 PolarHBondContact N-O 2.85Å; M772-R782 HydrophobicContact SD-CB 3.89Å
783	Q	88.7	Confident	88.7	Confident	69 Å²	69	55.9 Å²	55.9	32%	0.322	29%	0.286	S	S	.	.			trans	-115.6	165.7	176.9	-61.8	177.2	126.9	0	0	110.2	F780 D785	F780-Q783 HydrophobicContact CB-CG 3.54Å; F780-Q783 HydrophobicContact CD2-CG 3.77Å; F780-Q783 HydrophobicContact CG-CG 4.01Å; Q783-D785 WeakPolarHBondContact CB-OD1 3.5Å; Q783-D785 PolarHBondContact NE2-OD1 3.21Å
784	M	83	Confident	88.5	Confident	64 Å²	64	61.6 Å²	61.6	32%	0.315	31%	0.311	S	S	.	.			trans	-104.6	-1	165.9	-49.5	-81.1	75	0	0	112	E769 D786 E787	E769-M784 HydrophobicContact CB-SD 4.08Å; M784-D786 PolarHBondContact O-N 2.73Å; M784-E787 WeakPolarHBondContact CA-OE1 3.42Å; M784-E787 WeakPolarHBondContact CB-OE1 3.48Å; M784-E787 PolarHBondContact N-OE1 3.15Å
785	D	81.1	Confident	88.4	Confident	122 Å²	122	60.3 Å²	60.3	65%	0.652	30%	0.303	S	S	*	.	S	Bend	trans	59.7	11.2	173	-60.8	-45.1	0	0	0	116.3	Q783 E787	Q783-D785 WeakPolarHBondContact CB-OD1 3.5Å; Q783-D785 PolarHBondContact NE2-OD1 3.21Å; D785-E787 PolarHBondContact N-OE2 2.8Å; D785-E787 VanDerWaalsContact N-OE2 3.08Å
786	D	82.9	Confident	88.4	Confident	18 Å²	18	61.1 Å²	61.1	10%	0.096	31%	0.307	C	S	.	.			trans	-113.3	-6.9	174.2	74.2	-13.9	0	0	0	113.7	R700 M784 A788 S789 L790	R700-D786 IonicContact CZ-OD1 2.82Å; R700-D786 VanDerWaalsContact CZ-OD1 3.28Å; R700-D786 IonicContact CZ-OD2 3.15Å; R700-D786 IonicContact NH1-OD1 2.73Å; R700-D786 PolarHBondContact NH1-OD1 3.09Å; R700-D786 IonicContact NH1-OD2 3.74Å; R700-D786 VanDerWaalsContact NH2-CG 3.26Å; R700-D786 IonicContact NH2-OD1 3.5Å; R700-D786 PolarHBondContact NH2-OD1 2.83Å; R700-D786 IonicContact NH2-OD2 3.67Å; R700-D786 PolarHBondContact NH2-OD2 3.05Å; M784-D786 PolarHBondContact O-N 2.73Å; D786-A788 PolarHBondContact O-N 2.91Å; D786-A788 VanDerWaalsContact O-N 3.08Å; D786-S789 WeakPolarHBondContact O-CB 3.41Å; D786-S789 PolarHBondContact O-N 3.44Å; D786-S789 PolarHBondContact O-OG 2.85Å; D786-L790 HydrophobicContact CB-CD2 4.48Å; D786-L790 WeakPolarHBondContact O-CG 3.33Å
787	E	83.3	Confident	88.6	Confident	2 Å²	2	60 Å²	60	1%	0.009	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-59.5	-32.3	-168.1	-62.3	85.1	172.8	0	0	113	R691 S695 R700 M784 D785 S789	R691-E787 HydrophobicContact CB-CB 3.86Å; R691-E787 HydrophobicContact CG-CB 3.92Å; S695-E787 WeakPolarHBondContact OG-CG 3.42Å; R700-E787 IonicContact NH1-OE1 2.8Å; M784-E787 WeakPolarHBondContact CA-OE1 3.42Å; M784-E787 WeakPolarHBondContact CB-OE1 3.48Å; M784-E787 PolarHBondContact N-OE1 3.15Å; D785-E787 PolarHBondContact N-OE2 2.8Å; D785-E787 VanDerWaalsContact N-OE2 3.08Å; E787-S789 PolarHBondContact O-N 3Å
788	A	78.3	Confident	88.9	Confident	46 Å²	46	56.3 Å²	56.3	38%	0.38	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-74.5	-5.7	178	0	0	0	0	0	114.3	D786	D786-A788 PolarHBondContact O-N 2.91Å; D786-A788 VanDerWaalsContact O-N 3.08Å
789	S	81.9	Confident	89.2	Confident	55 Å²	55	53.9 Å²	53.9	39%	0.385	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-107.1	-13.9	-179.7	76	0	0	0	0	114.1	D786 E787	D786-S789 WeakPolarHBondContact O-CB 3.41Å; D786-S789 PolarHBondContact O-N 3.44Å; D786-S789 PolarHBondContact O-OG 2.85Å; E787-S789 PolarHBondContact O-N 3Å
790	L	82.4	Confident	89.6	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.037	24%	0.235	C	C	.	.	S	Bend	trans	-71.1	-33.8	-170.5	-52.1	179.7	0	0	0	113.3	F464 A694 L698 D786	F464-L790 HydrophobicContact CE1-CD2 3.84Å; F464-L790 HydrophobicContact CZ-CD2 4.24Å; A694-L790 HydrophobicContact CB-CB 4.12Å; A694-L790 HydrophobicContact CB-CD1 3.92Å; L698-L790 HydrophobicContact CD1-CB 4.5Å; L698-L790 HydrophobicContact CD1-CD1 3.68Å; L698-L790 HydrophobicContact CD1-CD2 3.75Å; L698-L790 HydrophobicContact CD1-CG 4.15Å; L698-L790 HydrophobicContact CG-CD1 4.25Å; D786-L790 HydrophobicContact CB-CD2 4.48Å; D786-L790 WeakPolarHBondContact O-CG 3.33Å
791	L	91.8	Very high	89.8	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.031	24%	0.242	C	C	.	.	S	Bend	trans	-88.7	147.8	-176.9	-57	-178	0	0	0	111.3	F693 A694 L697 R793 Q796 F836 F875	F693-L791 HydrophobicContact CD1-CD1 4.23Å; F693-L791 HydrophobicContact CD1-CD2 4.42Å; F693-L791 HydrophobicContact CE1-CD2 4.38Å; A694-L791 HydrophobicContact CB-CD1 4.12Å; A694-L791 HydrophobicContact CB-CD2 3.8Å; A694-L791 HydrophobicContact CB-CG 3.76Å; L697-L791 HydrophobicContact CD1-CD2 3.85Å; L791-R793 PolarHBondContact O-N 3.09Å; L791-Q796 HydrophobicContact CB-CB 4.1Å; L791-Q796 HydrophobicContact CD1-CB 4.38Å; L791-Q796 HydrophobicContact CD1-CG 4.19Å; L791-F836 HydrophobicContact CD2-CZ 3.96Å; L791-F875 HydrophobicContact CD2-CE2 4.46Å
792	P	92.6	Very high	90	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.032	22%	0.223	C	C	.	.			trans	-61.8	105	171.5	-22.4	34.2	0	0	0	110.8	K794 L795 Q796 I872 F875	P792-K794 PolarHBondContact O-N 2.94Å; P792-L795 HydrophobicContact CB-CD1 4.28Å; P792-L795 HydrophobicContact CB-CG 4.35Å; P792-L795 HydrophobicContact CG-CD1 4.43Å; P792-L795 PolarHBondContact O-N 3.1Å; P792-Q796 PolarHBondContact O-N 2.94Å; P792-Q796 VanDerWaalsContact O-N 3.1Å; P792-I872 HydrophobicContact CB-CG1 3.92Å; P792-I872 HydrophobicContact CG-CG1 3.99Å; P792-F875 HydrophobicContact CG-CB 3.79Å; P792-F875 HydrophobicContact CG-CD1 4.23Å; P792-F875 HydrophobicContact CG-CG 3.98Å
793	R	90.9	Very high	90.3	Very high	180 Å²	180	40.5 Å²	40.5	68%	0.679	21%	0.205	S	C	*	.	H	α-helix	trans	-40.2	-40.1	-170.9	-60.4	-174.6	-170.4	160.4	8.5	115.6	L791 A797	L791-R793 PolarHBondContact O-N 3.09Å; R793-A797 WeakPolarHBondContact O-CB 3.24Å; R793-A797 PolarHBondContact O-N 2.62Å
794	K	92.1	Very high	90.6	Very high	121 Å²	121	43 Å²	43	53%	0.526	22%	0.217	S	C	.	.	H	α-helix	trans	-69	-33.2	178	-83.8	174.6	159.5	-84.5	0	114.9	K430 R431 P792 A798	K430-K794 PolarHBondContact O-NZ 2.76Å; R431-K794 PolarHBondContact O-NZ 2.75Å; P792-K794 PolarHBondContact O-N 2.94Å; K794-A798 PolarHBondContact O-N 3.41Å
795	L	94.6	Very high	91.2	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-81.3	-38.3	175.8	-59.4	-176.7	0	0	0	110.3	Y427 P792 A798 L799 F836 E839 T840 I872	Y427-L795 HydrophobicContact CD1-CD2 4.07Å; Y427-L795 HydrophobicContact CE1-CB 4.44Å; Y427-L795 HydrophobicContact CE1-CD2 4.25Å; P792-L795 HydrophobicContact CB-CD1 4.28Å; P792-L795 HydrophobicContact CB-CG 4.35Å; P792-L795 HydrophobicContact CG-CD1 4.43Å; P792-L795 PolarHBondContact O-N 3.1Å; L795-A798 WeakPolarHBondContact O-CB 3.37Å; L795-A798 PolarHBondContact O-N 3.22Å; L795-A798 VanDerWaalsContact O-N 3.16Å; L795-L799 WeakPolarHBondContact O-CB 3.34Å; L795-L799 PolarHBondContact O-N 3.38Å; L795-F836 HydrophobicContact CB-CD2 3.87Å; L795-F836 HydrophobicContact CB-CE2 3.8Å; L795-F836 HydrophobicContact CD1-CE2 4.42Å; L795-E839 HydrophobicContact CD1-CB 3.98Å; L795-E839 HydrophobicContact CD2-CB 3.76Å; L795-E839 HydrophobicContact CD2-CG 4.19Å; L795-T840 HydrophobicContact CD1-CG2 3.51Å; L795-I872 HydrophobicContact CD1-CD1 3.97Å; L795-I872 HydrophobicContact CD1-CG1 4.34Å
796	Q	95.3	Very high	91.7	Very high	25 Å²	25	39.1 Å²	39.1	12%	0.117	19%	0.192	C	C	.	.	H	α-helix	trans	-55.9	-52.1	170.1	-177.2	-178.2	-11.3	0	0	111.1	L690 L791 P792 A798 L799 E800	L690-Q796 HydrophobicContact CD1-CG 4.19Å; L791-Q796 HydrophobicContact CB-CB 4.1Å; L791-Q796 HydrophobicContact CD1-CB 4.38Å; L791-Q796 HydrophobicContact CD1-CG 4.19Å; P792-Q796 PolarHBondContact O-N 2.94Å; P792-Q796 VanDerWaalsContact O-N 3.1Å; Q796-A798 PolarHBondContact O-N 3.12Å; Q796-A798 VanDerWaalsContact O-N 3.13Å; Q796-L799 PolarHBondContact O-N 2.83Å; Q796-L799 VanDerWaalsContact O-N 3.17Å; Q796-E800 VanDerWaalsContact O-CB 3.25Å; Q796-E800 WeakPolarHBondContact O-CB 3.23Å; Q796-E800 PolarHBondContact O-N 3.15Å
797	A	95.3	Very high	92	Very high	32 Å²	32	42.9 Å²	42.9	26%	0.264	21%	0.212	S	C	.	.	H	α-helix	trans	-69.7	-6.8	179.1	0	0	0	0	0	115	K430 R793	K430-A797 HydrophobicContact CD-CB 4.37Å; K430-A797 WeakPolarHBondContact CD-O 3.49Å; K430-A797 VanDerWaalsContact CE-O 3.3Å; K430-A797 WeakPolarHBondContact CE-O 3.31Å; K430-A797 PolarHBondContact NZ-O 3.1Å; R793-A797 WeakPolarHBondContact O-CB 3.24Å; R793-A797 PolarHBondContact O-N 2.62Å
798	A	96.5	Very high	92.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-90.6	-44.6	169.3	0	0	0	0	0	111.3	I426 Y427 K430 K794 L795 Q796 Q801 A802	I426-A798 HydrophobicContact CG2-CB 4.45Å; I426-A798 WeakPolarHBondContact CG2-O 3.04Å; Y427-A798 HydrophobicContact CD1-CB 3.58Å; Y427-A798 HydrophobicContact CD2-CB 4.22Å; Y427-A798 HydrophobicContact CE1-CB 3.81Å; Y427-A798 HydrophobicContact CE2-CB 4.43Å; Y427-A798 HydrophobicContact CG-CB 3.83Å; K430-A798 HydrophobicContact CB-CB 3.82Å; K430-A798 HydrophobicContact CG-CB 4.04Å; K794-A798 PolarHBondContact O-N 3.41Å; L795-A798 WeakPolarHBondContact O-CB 3.37Å; L795-A798 PolarHBondContact O-N 3.22Å; L795-A798 VanDerWaalsContact O-N 3.16Å; Q796-A798 PolarHBondContact O-N 3.12Å; Q796-A798 VanDerWaalsContact O-N 3.13Å; A798-Q801 PolarHBondContact O-N 3.16Å; A798-A802 WeakPolarHBondContact O-CB 3.29Å; A798-A802 PolarHBondContact O-N 3.1Å
799	L	97.3	Very high	92.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-44.3	175	-176.6	51.9	0	0	0	111.4	Y427 L690 F693 L795 Q796 A802 L803 A832 F833 F836	Y427-L799 WeakPolarHBondContact OH-CB 3.46Å; L690-L799 HydrophobicContact CD2-CD2 3.47Å; L690-L799 VanDerWaalsContact CD2-CD2 3.47Å; L690-L799 HydrophobicContact CD2-CG 3.72Å; F693-L799 HydrophobicContact CE1-CD2 4.49Å; L795-L799 WeakPolarHBondContact O-CB 3.34Å; L795-L799 PolarHBondContact O-N 3.38Å; Q796-L799 PolarHBondContact O-N 2.83Å; Q796-L799 VanDerWaalsContact O-N 3.17Å; L799-A802 PolarHBondContact O-N 2.86Å; L799-L803 HydrophobicContact CD1-CD1 3.82Å; L799-L803 HydrophobicContact CD1-CG 4.17Å; L799-L803 HydrophobicContact CG-CD1 3.95Å; L799-L803 WeakPolarHBondContact O-CB 3.14Å; L799-L803 WeakPolarHBondContact O-CD1 3.26Å; L799-L803 WeakPolarHBondContact O-CG 3.47Å; L799-L803 PolarHBondContact O-N 3.01Å; L799-A832 HydrophobicContact CD1-CB 3.66Å; L799-A832 WeakPolarHBondContact CD1-O 3.46Å; L799-F833 HydrophobicContact CD1-CD2 3.77Å; L799-F833 HydrophobicContact CD1-CE2 3.83Å; L799-F833 HydrophobicContact CD1-CG 4.2Å; L799-F833 HydrophobicContact CD1-CZ 4.26Å; L799-F833 HydrophobicContact CD2-CD1 4.06Å; L799-F833 HydrophobicContact CD2-CE1 3.81Å; L799-F833 HydrophobicContact CD2-CE2 4.4Å; L799-F833 HydrophobicContact CD2-CG 4.45Å; L799-F833 HydrophobicContact CD2-CZ 4.01Å; L799-F833 HydrophobicContact CG-CE2 4.4Å; L799-F833 HydrophobicContact CG-CZ 4.37Å; L799-F836 HydrophobicContact CD2-CB 4.34Å; L799-F836 HydrophobicContact CD2-CD2 4.18Å; L799-F836 HydrophobicContact CD2-CG 4.41Å
800	E	97.1	Very high	93	Very high	43 Å²	43	44.3 Å²	44.3	20%	0.201	21%	0.206	C	C	.	.	H	α-helix	trans	-56.3	-53.3	174.8	-165.6	160.2	-135.4	0	0	110.6	V686 L690 Q796 A802 L803 E804	V686-E800 HydrophobicContact CG1-CB 4.48Å; V686-E800 HydrophobicContact CG1-CG 4.11Å; L690-E800 HydrophobicContact CD1-CB 3.82Å; L690-E800 HydrophobicContact CD1-CG 4.21Å; Q796-E800 VanDerWaalsContact O-CB 3.25Å; Q796-E800 WeakPolarHBondContact O-CB 3.23Å; Q796-E800 PolarHBondContact O-N 3.15Å; E800-A802 PolarHBondContact O-N 3Å; E800-L803 PolarHBondContact O-N 3.45Å; E800-L803 VanDerWaalsContact O-N 3.17Å; E800-E804 WeakPolarHBondContact O-CB 3.31Å; E800-E804 VanDerWaalsContact O-CG 3.3Å; E800-E804 WeakPolarHBondContact O-CG 3.35Å; E800-E804 PolarHBondContact O-N 2.94Å
801	Q	96.8	Very high	93	Very high	51 Å²	51	49.3 Å²	49.3	24%	0.238	23%	0.232	C	C	.	.	H	α-helix	trans	-58.2	-43.7	175.3	177.9	177.8	-12.5	0	0	112.8	I426 A798 L803 E804 Q805	I426-Q801 HydrophobicContact CG2-CB 4.07Å; I426-Q801 HydrophobicContact CG2-CG 4.02Å; A798-Q801 PolarHBondContact O-N 3.16Å; Q801-L803 VanDerWaalsContact C-N 3.26Å; Q801-L803 PolarHBondContact O-N 3.5Å; Q801-E804 PolarHBondContact O-N 2.82Å; Q801-Q805 HydrophobicContact CG-CG 4.24Å; Q801-Q805 WeakPolarHBondContact O-CB 3.25Å; Q801-Q805 WeakPolarHBondContact O-CG 3.37Å; Q801-Q805 PolarHBondContact O-N 2.93Å
802	A	96.6	Very high	92.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-30.8	-179.2	0	0	0	0	0	112.8	I426 A798 L799 E800 A832	I426-A802 HydrophobicContact CD1-CB 4.18Å; A798-A802 WeakPolarHBondContact O-CB 3.29Å; A798-A802 PolarHBondContact O-N 3.1Å; L799-A802 PolarHBondContact O-N 2.86Å; E800-A802 PolarHBondContact O-N 3Å; A802-A832 HydrophobicContact CB-CB 4.16Å
803	L	97.2	Very high	90.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-86.8	-27.9	177.5	-63.2	167.7	0	0	0	112.7	F681 V686 L690 L799 E800 Q801 R806 V829 A832 F833	F681-L803 HydrophobicContact CE2-CD2 4.5Å; F681-L803 HydrophobicContact CZ-CD1 4.44Å; F681-L803 HydrophobicContact CZ-CD2 4.04Å; V686-L803 HydrophobicContact CG1-CB 3.7Å; V686-L803 HydrophobicContact CG1-CD1 3.93Å; V686-L803 HydrophobicContact CG1-CG 4.49Å; V686-L803 HydrophobicContact CG2-CB 3.98Å; L690-L803 HydrophobicContact CD2-CD1 4.16Å; L799-L803 HydrophobicContact CD1-CD1 3.82Å; L799-L803 HydrophobicContact CD1-CG 4.17Å; L799-L803 HydrophobicContact CG-CD1 3.95Å; L799-L803 WeakPolarHBondContact O-CB 3.14Å; L799-L803 WeakPolarHBondContact O-CD1 3.26Å; L799-L803 WeakPolarHBondContact O-CG 3.47Å; L799-L803 PolarHBondContact O-N 3.01Å; E800-L803 PolarHBondContact O-N 3.45Å; E800-L803 VanDerWaalsContact O-N 3.17Å; Q801-L803 VanDerWaalsContact C-N 3.26Å; Q801-L803 PolarHBondContact O-N 3.5Å; L803-R806 WeakPolarHBondContact O-CB 3.31Å; L803-R806 WeakPolarHBondContact O-CD 3.41Å; L803-R806 WeakPolarHBondContact O-CG 2.6Å; L803-R806 PolarHBondContact O-NH1 2.85Å; L803-V829 HydrophobicContact CD2-CB 4.35Å; L803-V829 HydrophobicContact CD2-CG1 4.14Å; L803-V829 HydrophobicContact CD2-CG2 3.97Å; L803-A832 HydrophobicContact CD2-CB 4.26Å; L803-F833 HydrophobicContact CD1-CE2 3.57Å; L803-F833 HydrophobicContact CD1-CZ 3.98Å; L803-F833 HydrophobicContact CD2-CE2 4.03Å; L803-F833 HydrophobicContact CG-CE2 4.36Å
804	E	96.1	Very high	89.4	Confident	122 Å²	122	48.8 Å²	48.8	57%	0.57	24%	0.244	S	C	*	.	H	α-helix	trans	-68.3	-49.4	170.1	-73.2	172.7	151.8	0	0	110.6	V686 E800 Q801 R806	V686-E804 HydrophobicContact CG2-CG 4.3Å; E800-E804 WeakPolarHBondContact O-CB 3.31Å; E800-E804 VanDerWaalsContact O-CG 3.3Å; E800-E804 WeakPolarHBondContact O-CG 3.35Å; E800-E804 PolarHBondContact O-N 2.94Å; Q801-E804 PolarHBondContact O-N 2.82Å; E804-R806 PolarHBondContact O-N 2.97Å; E804-R806 VanDerWaalsContact O-N 3.16Å
805	Q	94.3	Very high	87.7	Confident	58 Å²	58	50.4 Å²	50.4	27%	0.271	26%	0.258	S	S	.	.	S	Bend	trans	-79	10.5	-179.8	-61.7	-166.7	-82.9	0	0	114.2	Q801 N807 E808 I809	Q801-Q805 HydrophobicContact CG-CG 4.24Å; Q801-Q805 WeakPolarHBondContact O-CB 3.25Å; Q801-Q805 WeakPolarHBondContact O-CG 3.37Å; Q801-Q805 PolarHBondContact O-N 2.93Å; Q805-N807 VanDerWaalsContact C-N 3.31Å; Q805-N807 PolarHBondContact O-N 2.9Å; Q805-N807 VanDerWaalsContact O-N 3.17Å; Q805-E808 WeakPolarHBondContact CG-OE2 3.23Å; Q805-E808 PolarHBondContact NE2-OE2 3.25Å; Q805-E808 WeakPolarHBondContact O-CB 3.5Å; Q805-E808 PolarHBondContact O-N 3.25Å; Q805-I809 HydrophobicContact CB-CD1 3.98Å; Q805-I809 HydrophobicContact CB-CG1 4.27Å; Q805-I809 WeakPolarHBondContact O-CG1 3.46Å; Q805-I809 PolarHBondContact O-N 3.2Å
806	R	92.8	Very high	85.8	Confident	47 Å²	47	51.9 Å²	51.9	18%	0.177	27%	0.269	C	S	.	.	H	α-helix	trans	-51.1	-45	-172.2	63.5	-173.9	-175.2	-86.2	4.2	113.9	L803 E804 I809 I810 L825 L828	L803-R806 WeakPolarHBondContact O-CB 3.31Å; L803-R806 WeakPolarHBondContact O-CD 3.41Å; L803-R806 WeakPolarHBondContact O-CG 2.6Å; L803-R806 PolarHBondContact O-NH1 2.85Å; E804-R806 PolarHBondContact O-N 2.97Å; E804-R806 VanDerWaalsContact O-N 3.16Å; R806-I809 PolarHBondContact O-N 3.48Å; R806-I810 WeakPolarHBondContact O-CD1 3.27Å; R806-I810 VanDerWaalsContact O-CG1 3.3Å; R806-I810 WeakPolarHBondContact O-CG1 3.49Å; R806-I810 PolarHBondContact O-N 2.95Å; R806-I810 VanDerWaalsContact O-N 3.09Å; R806-L825 HydrophobicContact CB-CD1 4.44Å; R806-L825 HydrophobicContact CG-CD1 4.37Å; R806-L828 HydrophobicContact CB-CD1 4Å; R806-L828 HydrophobicContact CB-CD2 3.61Å; R806-L828 HydrophobicContact CB-CG 4.49Å; R806-L828 WeakPolarHBondContact O-CD1 3.38Å
807	N	89.1	Confident	83.8	Confident	96 Å²	96	60.1 Å²	60.1	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-69.5	-35.5	-179.3	-64.7	-4.2	0	0	0	112.1	Q805 N811	Q805-N807 VanDerWaalsContact C-N 3.31Å; Q805-N807 PolarHBondContact O-N 2.9Å; Q805-N807 VanDerWaalsContact O-N 3.17Å; N807-N811 WeakPolarHBondContact O-CB 2.72Å; N807-N811 PolarHBondContact O-N 2.84Å; N807-N811 PolarHBondContact O-ND2 2.98Å; N807-N811 PolarHBondContact O-OD1 3.43Å
808	E	89.8	Confident	81.7	Confident	97 Å²	97	63.3 Å²	63.3	45%	0.453	33%	0.328	S	S	.	.	H	α-helix	trans	-66.5	-44.8	177.1	-54.3	-179.3	157.8	0	0	110.5	Q805 I810 Q812	Q805-E808 WeakPolarHBondContact CG-OE2 3.23Å; Q805-E808 PolarHBondContact NE2-OE2 3.25Å; Q805-E808 WeakPolarHBondContact O-CB 3.5Å; Q805-E808 PolarHBondContact O-N 3.25Å; E808-I810 PolarHBondContact O-N 3.26Å; E808-Q812 VanDerWaalsContact O-CB 3.26Å; E808-Q812 WeakPolarHBondContact O-CB 3.45Å; E808-Q812 WeakPolarHBondContact O-CG 2.55Å; E808-Q812 PolarHBondContact O-N 2.89Å; E808-Q812 PolarHBondContact O-NE2 3.32Å
809	I	88.3	Confident	79.7	Confident	10 Å²	10	65.6 Å²	65.6	5%	0.051	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-37.8	-178.7	-63.5	165.4	0	0	0	111.2	L419 R422 I426 Q805 R806 L828	L419-I809 HydrophobicContact CD1-CG2 3.48Å; L419-I809 VanDerWaalsContact CD1-CG2 3.48Å; R422-I809 HydrophobicContact CB-CG2 4.31Å; R422-I809 PolarHBondContact NH1-O 3.28Å; I426-I809 HydrophobicContact CD1-CD1 3.9Å; Q805-I809 HydrophobicContact CB-CD1 3.98Å; Q805-I809 HydrophobicContact CB-CG1 4.27Å; Q805-I809 WeakPolarHBondContact O-CG1 3.46Å; Q805-I809 PolarHBondContact O-N 3.2Å; R806-I809 PolarHBondContact O-N 3.48Å; I809-L828 HydrophobicContact CB-CD1 3.81Å; I809-L828 HydrophobicContact CD1-CD1 4.43Å; I809-L828 HydrophobicContact CG2-CD1 3.77Å
810	I	86.2	Confident	77.7	Confident	26 Å²	26	72.5 Å²	72.5	13%	0.133	37%	0.373	C	S	.	.	H	α-helix	trans	-67.5	-57.7	175.1	-70.8	164.1	0	0	0	110.4	R806 E808 Q812 D813 N823 L825 L828	R806-I810 WeakPolarHBondContact O-CD1 3.27Å; R806-I810 VanDerWaalsContact O-CG1 3.3Å; R806-I810 WeakPolarHBondContact O-CG1 3.49Å; R806-I810 PolarHBondContact O-N 2.95Å; R806-I810 VanDerWaalsContact O-N 3.09Å; E808-I810 PolarHBondContact O-N 3.26Å; I810-Q812 PolarHBondContact O-N 2.84Å; I810-D813 PolarHBondContact O-N 2.82Å; I810-N823 VanDerWaalsContact CG2-O 3.31Å; I810-N823 WeakPolarHBondContact CG2-O 2.97Å; I810-L825 HydrophobicContact CD1-CB 4.34Å; I810-L828 HydrophobicContact CD1-CD1 4.14Å; I810-L828 HydrophobicContact CG1-CD1 3.83Å
811	N	82.6	Confident	75.8	Confident	112 Å²	112	74.2 Å²	74.2	60%	0.599	38%	0.381	S	S	*	.	H	α-helix	trans	-62.4	-31.9	-172.9	-66.4	-8.4	0	0	0	112.6	N807 D813 S814	N807-N811 WeakPolarHBondContact O-CB 2.72Å; N807-N811 PolarHBondContact O-N 2.84Å; N807-N811 PolarHBondContact O-ND2 2.98Å; N807-N811 PolarHBondContact O-OD1 3.43Å; N811-D813 PolarHBondContact O-N 2.8Å; N811-S814 PolarHBondContact O-N 2.88Å
812	Q	74.6	Confident	74	Confident	116 Å²	116	75.9 Å²	75.9	54%	0.542	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-3.6	176.7	-73.2	172	36.8	0	0	114.3	R422 E808 I810	R422-Q812 PolarHBondContact NH1-O 3.19Å; R422-Q812 PolarHBondContact NH2-O 2.82Å; E808-Q812 VanDerWaalsContact O-CB 3.26Å; E808-Q812 WeakPolarHBondContact O-CB 3.45Å; E808-Q812 WeakPolarHBondContact O-CG 2.55Å; E808-Q812 PolarHBondContact O-N 2.89Å; E808-Q812 PolarHBondContact O-NE2 3.32Å; I810-Q812 PolarHBondContact O-N 2.84Å
813	D	64.1	Low	72.5	Confident	4 Å²	4	76.8 Å²	76.8	2%	0.021	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	1	174.4	-87.3	-28.2	0	0	0	113.7	K418 L419 R422 I810 N811 D815 N823	K418-D813 WeakPolarHBondContact CB-OD1 3.42Å; K418-D813 VanDerWaalsContact CB-OD2 3.25Å; K418-D813 WeakPolarHBondContact CB-OD2 3.44Å; K418-D813 WeakPolarHBondContact CD-OD1 3.44Å; K418-D813 IonicContact NZ-OD1 3.18Å; L419-D813 PolarHBondContact N-OD2 3.4Å; R422-D813 IonicContact CZ-OD1 2.99Å; R422-D813 IonicContact CZ-OD2 3.28Å; R422-D813 IonicContact NE-OD1 2.58Å; R422-D813 IonicContact NE-OD2 3.21Å; R422-D813 IonicContact NH1-OD1 2.98Å; R422-D813 PolarHBondContact NH1-OD1 3.22Å; R422-D813 IonicContact NH1-OD2 3.96Å; R422-D813 PolarHBondContact NH1-OD2 3Å; R422-D813 VanDerWaalsContact NH2-CG 3.31Å; R422-D813 IonicContact NH2-OD1 3.49Å; R422-D813 PolarHBondContact NH2-OD1 3.29Å; R422-D813 IonicContact NH2-OD2 2.75Å; I810-D813 PolarHBondContact O-N 2.82Å; N811-D813 PolarHBondContact O-N 2.8Å; D813-D815 VanDerWaalsContact C-N 3.31Å; D813-D815 PolarHBondContact O-N 2.77Å; D813-N823 PolarHBondContact O-ND2 2.23Å
814	S	60.3	Low	71.9	Confident	60 Å²	60	79 Å²	79	42%	0.42	41%	0.406	S	S	.	.			trans	-69.3	-17.4	178.7	-61.2	0	0	0	0	115.1	N811 S816	N811-S814 PolarHBondContact O-N 2.88Å; S814-S816 PolarHBondContact O-N 3.02Å
815	D	56.9	Low	71.6	Confident	155 Å²	155	74.5 Å²	74.5	83%	0.829	39%	0.385	S	S	*	.	S	Bend	trans	-71.2	32.1	177.2	-64.3	-35.7	0	0	0	113.2	D813	D813-D815 VanDerWaalsContact C-N 3.31Å; D813-D815 PolarHBondContact O-N 2.77Å
816	S	55.8	Low	71.4	Confident	35 Å²	35	73.7 Å²	73.7	25%	0.245	38%	0.383	C	S	.	.			trans	-153.7	92.5	-173.7	-68.4	0	0	0	0	111.9	K418 S814 S818 D819	K418-S816 PolarHBondContact NZ-OG 2.89Å; S814-S816 PolarHBondContact O-N 3.02Å; S816-S818 PolarHBondContact O-N 3.45Å; S816-D819 PolarHBondContact O-N 3.37Å; S816-D819 VanDerWaalsContact O-N 3.14Å
817	E	52.6	Low	71.3	Confident	198 Å²	198	72 Å²	72	93%	0.925	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-4.1	178.5	-58.1	-90	139.8	0	0	116
818	S	51.9	Low	71.5	Confident	100 Å²	100	67.4 Å²	67.4	70%	0.699	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-19.6	179.4	58.3	0	0	0	0	115.3	S816	S816-S818 PolarHBondContact O-N 3.45Å
819	D	53.2	Low	71.7	Confident	47 Å²	47	62.8 Å²	62.8	25%	0.251	33%	0.332	S	S	.	.			trans	-114	4	-159.9	-70.2	19.7	0	0	0	114.1	S816 E821 Y822 N823	S816-D819 PolarHBondContact O-N 3.37Å; S816-D819 VanDerWaalsContact O-N 3.14Å; D819-E821 VanDerWaalsContact C-N 3.31Å; D819-E821 PolarHBondContact O-N 2.94Å; D819-E821 VanDerWaalsContact O-N 3.07Å; D819-Y822 PolarHBondContact O-N 2.54Å; D819-N823 PolarHBondContact O-N 3.26Å
820	E	54.9	Low	72	Confident	146 Å²	146	62.7 Å²	62.7	68%	0.682	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-37.3	-50.3	-178.8	-76.2	-90.1	109.6	0	0	114.9	Y822 N823	E820-Y822 VanDerWaalsContact C-N 3.26Å; E820-Y822 PolarHBondContact O-N 3Å; E820-N823 PolarHBondContact O-N 3.05Å; E820-N823 VanDerWaalsContact O-N 3.17Å
821	E	58.4	Low	72.4	Confident	79 Å²	79	61.8 Å²	61.8	37%	0.369	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-66.7	-24.6	-175.3	-165.5	172.1	-142.8	0	0	113.2	R665 N668 D819	R665-E821 IonicContact CZ-OE1 2.86Å; R665-E821 IonicContact NH2-OE1 3.69Å; R665-E821 PolarHBondContact NH2-OE1 3.04Å; N668-E821 PolarHBondContact ND2-OE1 2.74Å; N668-E821 PolarHBondContact ND2-OE2 2.86Å; D819-E821 VanDerWaalsContact C-N 3.31Å; D819-E821 PolarHBondContact O-N 2.94Å; D819-E821 VanDerWaalsContact O-N 3.07Å
822	Y	57.6	Low	73	Confident	85 Å²	85	56.5 Å²	56.5	33%	0.333	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-87.8	-18.7	175.9	-81.4	-84.8	0	0	0	113.8	P417 L419 D819 E820 S824 S827	P417-Y822 HydrophobicContact CB-CD1 4.48Å; P417-Y822 HydrophobicContact CG-CD1 4.06Å; P417-Y822 HydrophobicContact CG-CE1 4.3Å; L419-Y822 WeakPolarHBondContact CD2-O 3.27Å; D819-Y822 PolarHBondContact O-N 2.54Å; E820-Y822 VanDerWaalsContact C-N 3.26Å; E820-Y822 PolarHBondContact O-N 3Å; Y822-S824 PolarHBondContact O-N 3.46Å; Y822-S827 WeakPolarHBondContact O-CB 3.04Å; Y822-S827 PolarHBondContact O-OG 3.28Å
823	N	65.7	Low	74.1	Confident	19 Å²	19	51.1 Å²	51.1	10%	0.102	27%	0.274	C	S	.	.	S	Bend	trans	-85.5	11.7	-176.5	-70.3	-17.9	0	0	0	113.7	I810 D813 D819 E820	I810-N823 VanDerWaalsContact CG2-O 3.31Å; I810-N823 WeakPolarHBondContact CG2-O 2.97Å; D813-N823 PolarHBondContact O-ND2 2.23Å; D819-N823 PolarHBondContact O-N 3.26Å; E820-N823 PolarHBondContact O-N 3.05Å; E820-N823 VanDerWaalsContact O-N 3.17Å
824	S	84.6	Confident	75.7	Confident	48 Å²	48	51 Å²	51	34%	0.336	27%	0.273	S	S	.	.	S	Bend	trans	-71.1	150.8	175.4	64	0	0	0	0	112.9	Y822 N826 S827 L828	Y822-S824 PolarHBondContact O-N 3.46Å; S824-N826 PolarHBondContact O-N 3.24Å; S824-S827 WeakPolarHBondContact O-CB 3.41Å; S824-S827 PolarHBondContact O-N 3.25Å; S824-S827 VanDerWaalsContact OG-CB 3.3Å; S824-S827 WeakPolarHBondContact OG-CB 3.2Å; S824-S827 PolarHBondContact OG-N 3.39Å; S824-L828 PolarHBondContact O-N 2.74Å
825	L	90.3	Very high	77.4	Confident	27 Å²	27	48.3 Å²	48.3	14%	0.141	25%	0.254	C	S	.	.	H	α-helix	trans	-52.2	-41.2	169.8	173.9	62.6	0	0	0	111.5	F677 D678 R806 I810 S827 L828 V829	F677-L825 HydrophobicContact CB-CD2 4.34Å; F677-L825 HydrophobicContact CB-CG 4.34Å; D678-L825 HydrophobicContact CB-CD2 3.68Å; D678-L825 WeakPolarHBondContact OD1-CD2 3.34Å; R806-L825 HydrophobicContact CB-CD1 4.44Å; R806-L825 HydrophobicContact CG-CD1 4.37Å; I810-L825 HydrophobicContact CD1-CB 4.34Å; L825-S827 PolarHBondContact O-N 2.77Å; L825-L828 PolarHBondContact O-N 3.16Å; L825-V829 HydrophobicContact CD1-CG2 3.7Å; L825-V829 HydrophobicContact CG-CG2 4.21Å; L825-V829 VanDerWaalsContact O-CG2 3.26Å; L825-V829 WeakPolarHBondContact O-CG2 3.19Å; L825-V829 PolarHBondContact O-N 2.97Å
826	N	90.4	Very high	79.3	Confident	41 Å²	41	41 Å²	41	22%	0.219	22%	0.215	C	C	.	.	H	α-helix	trans	-65.7	-39.1	-177.8	-65.4	-18.9	0	0	0	113	L672 V675 F677 S824 S830	L672-N826 HydrophobicContact CD1-CB 4.28Å; V675-N826 PolarHBondContact O-ND2 2.91Å; F677-N826 HydrophobicContact CD2-CB 4.17Å; F677-N826 WeakPolarHBondContact CD2-OD1 3.44Å; F677-N826 PolarHBondContact N-OD1 3.31Å; S824-N826 PolarHBondContact O-N 3.24Å; N826-S830 WeakPolarHBondContact O-CB 3.42Å; N826-S830 PolarHBondContact O-N 3.31Å
827	S	89.4	Confident	81.2	Confident	11 Å²	11	39.3 Å²	39.3	8%	0.077	20%	0.203	C	C	.	.	H	α-helix	trans	-60.1	-55.2	170.5	173.1	0	0	0	0	110.7	L419 Y822 S824 L825 V829 S830 E831	L419-S827 WeakPolarHBondContact CD2-OG 3.17Å; Y822-S827 WeakPolarHBondContact O-CB 3.04Å; Y822-S827 PolarHBondContact O-OG 3.28Å; S824-S827 WeakPolarHBondContact O-CB 3.41Å; S824-S827 PolarHBondContact O-N 3.25Å; S824-S827 VanDerWaalsContact OG-CB 3.3Å; S824-S827 WeakPolarHBondContact OG-CB 3.2Å; S824-S827 PolarHBondContact OG-N 3.39Å; L825-S827 PolarHBondContact O-N 2.77Å; S827-V829 PolarHBondContact O-N 2.73Å; S827-S830 PolarHBondContact O-N 2.74Å; S827-E831 WeakPolarHBondContact O-CB 3.11Å; S827-E831 VanDerWaalsContact O-CG 3.23Å; S827-E831 WeakPolarHBondContact O-CG 3.47Å; S827-E831 PolarHBondContact O-N 2.77Å
828	L	93.1	Very high	83.3	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-55	-47.9	-179	-179.6	152.7	0	0	0	112.8	L419 I423 R806 I809 I810 S824 L825 E831 A832	L419-L828 HydrophobicContact CD1-CB 3.87Å; L419-L828 HydrophobicContact CD1-CD1 3.74Å; L419-L828 HydrophobicContact CD1-CG 3.8Å; L419-L828 HydrophobicContact CD2-CB 4.25Å; I423-L828 HydrophobicContact CD1-CG 4.5Å; R806-L828 HydrophobicContact CB-CD1 4Å; R806-L828 HydrophobicContact CB-CD2 3.61Å; R806-L828 HydrophobicContact CB-CG 4.49Å; R806-L828 WeakPolarHBondContact O-CD1 3.38Å; I809-L828 HydrophobicContact CB-CD1 3.81Å; I809-L828 HydrophobicContact CD1-CD1 4.43Å; I809-L828 HydrophobicContact CG2-CD1 3.77Å; I810-L828 HydrophobicContact CD1-CD1 4.14Å; I810-L828 HydrophobicContact CG1-CD1 3.83Å; S824-L828 PolarHBondContact O-N 2.74Å; L825-L828 PolarHBondContact O-N 3.16Å; L828-E831 PolarHBondContact O-N 3.26Å; L828-A832 WeakPolarHBondContact O-CB 3.4Å; L828-A832 PolarHBondContact O-N 2.77Å
829	V	95.5	Very high	85.2	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-47	-179.2	176.5	0	0	0	0	109.8	F677 F681 L722 L803 L825 S827 E831 A832 F833	F677-V829 HydrophobicContact CB-CB 4.49Å; F677-V829 HydrophobicContact CB-CG2 4.21Å; F677-V829 HydrophobicContact CD1-CB 4.45Å; F677-V829 HydrophobicContact CD1-CG1 3.7Å; F677-V829 HydrophobicContact CD2-CB 3.82Å; F677-V829 HydrophobicContact CD2-CG1 3.86Å; F677-V829 HydrophobicContact CD2-CG2 4.41Å; F677-V829 HydrophobicContact CE1-CG1 3.71Å; F677-V829 HydrophobicContact CE2-CB 4Å; F677-V829 HydrophobicContact CE2-CG1 3.81Å; F677-V829 HydrophobicContact CG-CB 4.02Å; F677-V829 HydrophobicContact CG-CG1 3.78Å; F677-V829 HydrophobicContact CG-CG2 4.26Å; F677-V829 HydrophobicContact CZ-CB 4.44Å; F677-V829 HydrophobicContact CZ-CG1 3.74Å; F681-V829 HydrophobicContact CD2-CG2 4.46Å; F681-V829 HydrophobicContact CE2-CG1 4.14Å; F681-V829 HydrophobicContact CE2-CG2 3.68Å; L722-V829 HydrophobicContact CD2-CG1 3.73Å; L803-V829 HydrophobicContact CD2-CB 4.35Å; L803-V829 HydrophobicContact CD2-CG1 4.14Å; L803-V829 HydrophobicContact CD2-CG2 3.97Å; L825-V829 HydrophobicContact CD1-CG2 3.7Å; L825-V829 HydrophobicContact CG-CG2 4.21Å; L825-V829 VanDerWaalsContact O-CG2 3.26Å; L825-V829 WeakPolarHBondContact O-CG2 3.19Å; L825-V829 PolarHBondContact O-N 2.97Å; S827-V829 PolarHBondContact O-N 2.73Å; V829-E831 PolarHBondContact O-N 3.12Å; V829-A832 PolarHBondContact O-N 3.35Å; V829-F833 HydrophobicContact CG1-CD2 4.15Å; V829-F833 HydrophobicContact CG1-CE2 4.13Å; V829-F833 VanDerWaalsContact O-CD2 3.31Å; V829-F833 WeakPolarHBondContact O-CD2 3.21Å; V829-F833 PolarHBondContact O-N 3.48Å
830	S	94	Very high	87.2	Confident	7 Å²	7	23.5 Å²	23.5	5%	0.049	12%	0.117	C	C	.	.	H	α-helix	trans	-56.7	-39.8	175	-179.5	0	0	0	0	112.6	R671 N826 S827 I834	R671-S830 PolarHBondContact NH1-OG 2.83Å; R671-S830 PolarHBondContact NH2-OG 3.04Å; N826-S830 WeakPolarHBondContact O-CB 3.42Å; N826-S830 PolarHBondContact O-N 3.31Å; S827-S830 PolarHBondContact O-N 2.74Å; S830-I834 WeakPolarHBondContact O-CB 3.44Å; S830-I834 WeakPolarHBondContact O-CD1 3.35Å; S830-I834 WeakPolarHBondContact O-CG1 3.17Å; S830-I834 PolarHBondContact O-N 3.07Å
831	E	93.9	Very high	89	Confident	8 Å²	8	16.6 Å²	16.6	4%	0.037	9%	0.085	C	C	.	.	H	α-helix	trans	-72.7	-37.6	-177	-70.2	-69.5	-171.7	0	0	112.3	V420 I423 S827 L828 V829 F833 I834 R835 R906	V420-E831 HydrophobicContact CG2-CB 4.35Å; V420-E831 VanDerWaalsContact CG2-CD 3.46Å; V420-E831 HydrophobicContact CG2-CG 3.82Å; I423-E831 HydrophobicContact CD1-CB 3.53Å; S827-E831 WeakPolarHBondContact O-CB 3.11Å; S827-E831 VanDerWaalsContact O-CG 3.23Å; S827-E831 WeakPolarHBondContact O-CG 3.47Å; S827-E831 PolarHBondContact O-N 2.77Å; L828-E831 PolarHBondContact O-N 3.26Å; V829-E831 PolarHBondContact O-N 3.12Å; E831-F833 VanDerWaalsContact C-N 3.32Å; E831-F833 PolarHBondContact O-N 3.16Å; E831-I834 PolarHBondContact O-N 2.71Å; E831-R835 PolarHBondContact O-N 3.25Å; E831-R906 IonicContact OE1-CZ 3.18Å; E831-R906 IonicContact OE1-NH1 2.89Å; E831-R906 PolarHBondContact OE1-NH1 3.28Å; E831-R906 IonicContact OE1-NH2 3.1Å; E831-R906 PolarHBondContact OE1-NH2 3.48Å; E831-R906 IonicContact OE2-CZ 3Å; E831-R906 IonicContact OE2-NH1 2.6Å; E831-R906 PolarHBondContact OE2-NH1 3.09Å; E831-R906 IonicContact OE2-NH2 2.73Å
832	A	96.8	Very high	90.7	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-61.4	-40.8	175.1	0	0	0	0	0	111.7	Y427 L799 A802 L803 L828 V829 F836	Y427-A832 PolarHBondContact OH-O 3.26Å; L799-A832 HydrophobicContact CD1-CB 3.66Å; L799-A832 WeakPolarHBondContact CD1-O 3.46Å; A802-A832 HydrophobicContact CB-CB 4.16Å; L803-A832 HydrophobicContact CD2-CB 4.26Å; L828-A832 WeakPolarHBondContact O-CB 3.4Å; L828-A832 PolarHBondContact O-N 2.77Å; V829-A832 PolarHBondContact O-N 3.35Å; A832-F836 PolarHBondContact O-N 3.32Å
833	F	97.4	Very high	92.4	Very high	3 Å²	3	9 Å²	9	1%	0.013	5%	0.052	C	C	.	.	H	α-helix	trans	-77.6	-36.2	176.3	-77.5	-101.1	0	0	0	112.9	L690 F693 L722 L799 L803 V829 E831 R835 F836 F837	L690-F833 HydrophobicContact CD2-CE1 4.19Å; L690-F833 HydrophobicContact CD2-CZ 3.8Å; F693-F833 HydrophobicContact CB-CE1 4.16Å; F693-F833 HydrophobicContact CD1-CD1 4.29Å; F693-F833 AromaticContact CD1-CE1 3.73Å; F693-F833 HydrophobicContact CD1-CE1 3.73Å; F693-F833 AromaticContact CD2-CD1 3.91Å; F693-F833 HydrophobicContact CD2-CD1 3.91Å; F693-F833 AromaticContact CD2-CE1 3.68Å; F693-F833 HydrophobicContact CD2-CE1 3.68Å; F693-F833 HydrophobicContact CE1-CD1 4.03Å; F693-F833 AromaticContact CE1-CE1 3.92Å; F693-F833 HydrophobicContact CE1-CE1 3.92Å; F693-F833 AromaticContact CE2-CD1 3.63Å; F693-F833 HydrophobicContact CE2-CD1 3.63Å; F693-F833 AromaticContact CE2-CE1 3.88Å; F693-F833 HydrophobicContact CE2-CE1 3.88Å; F693-F833 HydrophobicContact CG-CD1 4.23Å; F693-F833 AromaticContact CG-CE1 3.6Å; F693-F833 HydrophobicContact CG-CE1 3.6Å; F693-F833 AromaticContact CZ-CD1 3.68Å; F693-F833 HydrophobicContact CZ-CD1 3.68Å; F693-F833 AromaticContact CZ-CE1 3.98Å; F693-F833 HydrophobicContact CZ-CE1 3.98Å; L722-F833 HydrophobicContact CB-CD1 3.94Å; L722-F833 HydrophobicContact CB-CE1 3.97Å; L722-F833 HydrophobicContact CB-CG 4.42Å; L722-F833 HydrophobicContact CB-CZ 4.46Å; L722-F833 HydrophobicContact CD1-CE1 4Å; L722-F833 HydrophobicContact CD1-CE2 4.46Å; L722-F833 HydrophobicContact CD1-CZ 3.84Å; L722-F833 HydrophobicContact CD2-CD1 4.12Å; L722-F833 HydrophobicContact CD2-CD2 3.65Å; L722-F833 HydrophobicContact CD2-CE1 3.99Å; L722-F833 HydrophobicContact CD2-CE2 3.48Å; L722-F833 VanDerWaalsContact CD2-CE2 3.48Å; L722-F833 HydrophobicContact CD2-CG 3.97Å; L722-F833 HydrophobicContact CD2-CZ 3.67Å; L722-F833 HydrophobicContact CG-CD1 4.49Å; L722-F833 HydrophobicContact CG-CE1 4.21Å; L722-F833 HydrophobicContact CG-CE2 4.47Å; L722-F833 HydrophobicContact CG-CZ 4.2Å; L799-F833 HydrophobicContact CD1-CD2 3.77Å; L799-F833 HydrophobicContact CD1-CE2 3.83Å; L799-F833 HydrophobicContact CD1-CG 4.2Å; L799-F833 HydrophobicContact CD1-CZ 4.26Å; L799-F833 HydrophobicContact CD2-CD1 4.06Å; L799-F833 HydrophobicContact CD2-CE1 3.81Å; L799-F833 HydrophobicContact CD2-CE2 4.4Å; L799-F833 HydrophobicContact CD2-CG 4.45Å; L799-F833 HydrophobicContact CD2-CZ 4.01Å; L799-F833 HydrophobicContact CG-CE2 4.4Å; L799-F833 HydrophobicContact CG-CZ 4.37Å; L803-F833 HydrophobicContact CD1-CE2 3.57Å; L803-F833 HydrophobicContact CD1-CZ 3.98Å; L803-F833 HydrophobicContact CD2-CE2 4.03Å; L803-F833 HydrophobicContact CG-CE2 4.36Å; V829-F833 HydrophobicContact CG1-CD2 4.15Å; V829-F833 HydrophobicContact CG1-CE2 4.13Å; V829-F833 VanDerWaalsContact O-CD2 3.31Å; V829-F833 WeakPolarHBondContact O-CD2 3.21Å; V829-F833 PolarHBondContact O-N 3.48Å; E831-F833 VanDerWaalsContact C-N 3.32Å; E831-F833 PolarHBondContact O-N 3.16Å; F833-R835 VanDerWaalsContact C-N 3.27Å; F833-R835 PolarHBondContact O-N 2.71Å; F833-F836 VanDerWaalsContact O-CB 3.32Å; F833-F836 WeakPolarHBondContact O-CB 3.47Å; F833-F836 PolarHBondContact O-N 2.8Å; F833-F836 VanDerWaalsContact O-N 3.12Å; F833-F837 WeakPolarHBondContact O-CD2 3.45Å; F833-F837 PolarHBondContact O-N 2.84Å
834	I	96.1	Very high	93.7	Very high	2 Å²	2	8.6 Å²	8.6	1%	0.01	5%	0.049	C	C	.	.	H	α-helix	trans	-55.2	-45.2	168.9	-76.4	164.8	0	0	0	110.2	Y724 S830 E831 F836 F837 L838 L902 F903 R906	Y724-I834 HydrophobicContact CD1-CD1 4Å; Y724-I834 HydrophobicContact CD1-CG1 3.82Å; Y724-I834 HydrophobicContact CE1-CD1 4.01Å; Y724-I834 HydrophobicContact CE1-CG1 4.11Å; S830-I834 WeakPolarHBondContact O-CB 3.44Å; S830-I834 WeakPolarHBondContact O-CD1 3.35Å; S830-I834 WeakPolarHBondContact O-CG1 3.17Å; S830-I834 PolarHBondContact O-N 3.07Å; E831-I834 PolarHBondContact O-N 2.71Å; I834-F836 VanDerWaalsContact C-N 3.31Å; I834-F836 PolarHBondContact O-N 3.31Å; I834-F837 PolarHBondContact O-N 2.92Å; I834-F837 VanDerWaalsContact O-N 3.11Å; I834-L838 HydrophobicContact CG2-CD1 3.91Å; I834-L838 HydrophobicContact CG2-CG 4.21Å; I834-L838 WeakPolarHBondContact O-CG 3.21Å; I834-L838 PolarHBondContact O-N 2.6Å; I834-L902 HydrophobicContact CD1-CD2 3.92Å; I834-F903 HydrophobicContact CG2-CD2 4.42Å; I834-R906 HydrophobicContact CG2-CB 4.35Å; I834-R906 HydrophobicContact CG2-CG 4.39Å
835	R	95.9	Very high	94.1	Very high	4 Å²	4	8.5 Å²	8.5	2%	0.015	5%	0.048	C	C	.	.	H	α-helix	trans	-64.7	-32.9	178.7	-171.2	59.2	-178.3	-148.7	12.3	112.7	I423 N424 Y427 E831 F833 F837 L838 E839 E913	I423-R835 HydrophobicContact CG2-CB 3.95Å; I423-R835 HydrophobicContact CG2-CG 4.34Å; N424-R835 PolarHBondContact ND2-NH1 2.98Å; N424-R835 VanDerWaalsContact ND2-NH1 3.11Å; N424-R835 WeakPolarHBondContact OD1-CD 3.5Å; N424-R835 PolarHBondContact OD1-NH1 2.71Å; Y427-R835 HydrophobicContact CD1-CG 4.09Å; Y427-R835 HydrophobicContact CD2-CB 3.91Å; Y427-R835 HydrophobicContact CD2-CG 3.37Å; Y427-R835 HydrophobicContact CE1-CG 4.36Å; Y427-R835 HydrophobicContact CE2-CB 3.69Å; Y427-R835 HydrophobicContact CE2-CG 3.69Å; Y427-R835 HydrophobicContact CG-CB 4.48Å; Y427-R835 HydrophobicContact CG-CG 3.56Å; E831-R835 PolarHBondContact O-N 3.25Å; F833-R835 VanDerWaalsContact C-N 3.27Å; F833-R835 PolarHBondContact O-N 2.71Å; R835-F837 VanDerWaalsContact C-N 3.32Å; R835-F837 PolarHBondContact O-N 3.15Å; R835-L838 PolarHBondContact O-N 2.89Å; R835-E839 HydrophobicContact CG-CG 4.18Å; R835-E839 IonicContact CZ-OE1 3.19Å; R835-E839 VanDerWaalsContact CZ-OE1 3.22Å; R835-E839 IonicContact NE-OE1 2.73Å; R835-E839 PolarHBondContact NE-OE1 2.73Å; R835-E839 IonicContact NH2-OE1 2.74Å; R835-E839 PolarHBondContact NH2-OE1 3Å; R835-E839 WeakPolarHBondContact O-CB 3.46Å; R835-E839 WeakPolarHBondContact O-CG 3.37Å; R835-E839 PolarHBondContact O-N 2.88Å; R835-E913 IonicContact CZ-OE2 2.73Å; R835-E913 IonicContact NH1-OE1 2.68Å; R835-E913 PolarHBondContact NH1-OE1 2.73Å; R835-E913 IonicContact NH1-OE2 2.69Å; R835-E913 PolarHBondContact NH1-OE2 3.33Å; R835-E913 IonicContact NH2-OE2 3.88Å; R835-E913 PolarHBondContact NH2-OE2 3.04Å
836	F	96.9	Very high	94.2	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-57.7	-44.9	170.9	-178.3	-91.5	0	0	0	111.8	Y427 F693 L697 L791 L795 L799 A832 F833 I834 E839 T840 F875	Y427-F836 WeakPolarHBondContact OH-CA 3.21Å; Y427-F836 WeakPolarHBondContact OH-CB 3.41Å; Y427-F836 PolarHBondContact OH-N 3.01Å; F693-F836 HydrophobicContact CE1-CD1 4.06Å; F693-F836 HydrophobicContact CE1-CE1 4.01Å; F693-F836 HydrophobicContact CE1-CG 4.49Å; F693-F836 HydrophobicContact CE1-CZ 4.39Å; F693-F836 AromaticContact CZ-CD1 3.97Å; F693-F836 HydrophobicContact CZ-CD1 3.97Å; F693-F836 HydrophobicContact CZ-CE1 4.16Å; L697-F836 HydrophobicContact CD1-CE1 4.15Å; L791-F836 HydrophobicContact CD2-CZ 3.96Å; L795-F836 HydrophobicContact CB-CD2 3.87Å; L795-F836 HydrophobicContact CB-CE2 3.8Å; L795-F836 HydrophobicContact CD1-CE2 4.42Å; L799-F836 HydrophobicContact CD2-CB 4.34Å; L799-F836 HydrophobicContact CD2-CD2 4.18Å; L799-F836 HydrophobicContact CD2-CG 4.41Å; A832-F836 PolarHBondContact O-N 3.32Å; F833-F836 VanDerWaalsContact O-CB 3.32Å; F833-F836 WeakPolarHBondContact O-CB 3.47Å; F833-F836 PolarHBondContact O-N 2.8Å; F833-F836 VanDerWaalsContact O-N 3.12Å; I834-F836 VanDerWaalsContact C-N 3.31Å; I834-F836 PolarHBondContact O-N 3.31Å; F836-E839 PolarHBondContact O-N 3.25Å; F836-T840 HydrophobicContact CD1-CG2 4.48Å; F836-T840 HydrophobicContact CE1-CG2 4.05Å; F836-T840 HydrophobicContact CZ-CG2 4.09Å; F836-T840 WeakPolarHBondContact O-CG2 3.33Å; F836-T840 PolarHBondContact O-N 2.95Å; F836-T840 VanDerWaalsContact O-N 3.12Å; F836-T840 PolarHBondContact O-OG1 2.89Å; F836-F875 HydrophobicContact CE1-CZ 4.17Å; F836-F875 HydrophobicContact CZ-CZ 4.39Å
837	F	97.1	Very high	94.3	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-71.7	-36.7	178.1	-66.5	-62.3	0	0	0	113	F693 L697 Y724 F726 F833 I834 R835 E839 T840 M841 G842 F879 F903	F693-F837 HydrophobicContact CE2-CE2 4.23Å; F693-F837 AromaticContact CE2-CZ 3.8Å; F693-F837 HydrophobicContact CE2-CZ 3.8Å; F693-F837 HydrophobicContact CZ-CE1 4.34Å; F693-F837 HydrophobicContact CZ-CE2 4.19Å; F693-F837 AromaticContact CZ-CZ 3.73Å; F693-F837 HydrophobicContact CZ-CZ 3.73Å; L697-F837 HydrophobicContact CD2-CE1 3.81Å; L697-F837 HydrophobicContact CD2-CZ 3.84Å; Y724-F837 WeakPolarHBondContact O-CD2 3.22Å; Y724-F837 WeakPolarHBondContact O-CE2 3.36Å; F726-F837 HydrophobicContact CD2-CD1 4.26Å; F726-F837 AromaticContact CD2-CE1 3.78Å; F726-F837 HydrophobicContact CD2-CE1 3.78Å; F726-F837 AromaticContact CD2-CZ 3.95Å; F726-F837 HydrophobicContact CD2-CZ 3.95Å; F726-F837 AromaticContact CE2-CD1 3.71Å; F726-F837 HydrophobicContact CE2-CD1 3.71Å; F726-F837 AromaticContact CE2-CE1 3.59Å; F726-F837 HydrophobicContact CE2-CE1 3.59Å; F726-F837 HydrophobicContact CE2-CG 4.43Å; F726-F837 HydrophobicContact CE2-CZ 4.22Å; F833-F837 WeakPolarHBondContact O-CD2 3.45Å; F833-F837 PolarHBondContact O-N 2.84Å; I834-F837 PolarHBondContact O-N 2.92Å; I834-F837 VanDerWaalsContact O-N 3.11Å; R835-F837 VanDerWaalsContact C-N 3.32Å; R835-F837 PolarHBondContact O-N 3.15Å; F837-E839 VanDerWaalsContact C-N 3.34Å; F837-E839 PolarHBondContact O-N 3.1Å; F837-T840 WeakPolarHBondContact CA-OG1 3.31Å; F837-T840 PolarHBondContact O-N 2.84Å; F837-T840 PolarHBondContact O-OG1 2.92Å; F837-M841 HydrophobicContact CB-CG 4.4Å; F837-M841 HydrophobicContact CD1-SD 4.38Å; F837-M841 WeakPolarHBondContact O-CG 3.29Å; F837-M841 PolarHBondContact O-N 3.41Å; F837-G842 PolarHBondContact O-N 3.22Å; F837-F879 HydrophobicContact CE1-CZ 4.43Å; F837-F903 HydrophobicContact CB-CE2 3.78Å; F837-F903 HydrophobicContact CB-CZ 4.15Å
838	L	95.1	Very high	94.4	Very high	8 Å²	8	8.7 Å²	8.7	4%	0.042	5%	0.048	C	C	.	.	H	α-helix	trans	-60.9	-43.2	172.4	-64.4	171.5	0	0	0	111.8	I834 R835 T840 G842 F903 R906 V907 Y910	I834-L838 HydrophobicContact CG2-CD1 3.91Å; I834-L838 HydrophobicContact CG2-CG 4.21Å; I834-L838 WeakPolarHBondContact O-CG 3.21Å; I834-L838 PolarHBondContact O-N 2.6Å; R835-L838 PolarHBondContact O-N 2.89Å; L838-T840 PolarHBondContact O-N 2.86Å; L838-G842 WeakPolarHBondContact O-CA 3.47Å; L838-G842 PolarHBondContact O-N 2.79Å; L838-F903 HydrophobicContact CD2-CD2 4.45Å; L838-F903 HydrophobicContact CD2-CE2 3.89Å; L838-F903 HydrophobicContact CD2-CZ 4.23Å; L838-F903 HydrophobicContact CG-CE2 4.26Å; L838-R906 HydrophobicContact CD1-CB 3.85Å; L838-R906 HydrophobicContact CD2-CB 4.21Å; L838-V907 HydrophobicContact CD2-CB 4.41Å; L838-V907 HydrophobicContact CD2-CG2 3.63Å; L838-Y910 HydrophobicContact CB-CD1 4.49Å; L838-Y910 HydrophobicContact CB-CD2 4.14Å; L838-Y910 HydrophobicContact CB-CG 4.11Å; L838-Y910 WeakPolarHBondContact O-CE1 3.3Å; L838-Y910 VanDerWaalsContact O-CZ 3.27Å; L838-Y910 PolarHBondContact O-OH 3.12Å
839	E	93.7	Very high	94.3	Very high	5 Å²	5	10.7 Å²	10.7	2%	0.023	6%	0.06	C	C	.	.	H	α-helix	trans	-69.9	-27.3	-179.4	-69.4	-73.7	166.8	0	0	113.8	Y427 R431 L795 R835 F836 F837	Y427-E839 HydrophobicContact CD1-CG 3.85Å; Y427-E839 HydrophobicContact CE1-CG 4.35Å; Y427-E839 HydrophobicContact CG-CG 4.46Å; R431-E839 WeakPolarHBondContact CD-OE2 3.22Å; R431-E839 IonicContact CZ-OE2 2.85Å; R431-E839 IonicContact NE-OE2 2.62Å; R431-E839 PolarHBondContact NE-OE2 2.71Å; R431-E839 IonicContact NH1-OE1 2.7Å; R431-E839 IonicContact NH1-OE2 3.09Å; R431-E839 PolarHBondContact NH1-OE2 2.89Å; L795-E839 HydrophobicContact CD1-CB 3.98Å; L795-E839 HydrophobicContact CD2-CB 3.76Å; L795-E839 HydrophobicContact CD2-CG 4.19Å; R835-E839 HydrophobicContact CG-CG 4.18Å; R835-E839 IonicContact CZ-OE1 3.19Å; R835-E839 VanDerWaalsContact CZ-OE1 3.22Å; R835-E839 IonicContact NE-OE1 2.73Å; R835-E839 PolarHBondContact NE-OE1 2.73Å; R835-E839 IonicContact NH2-OE1 2.74Å; R835-E839 PolarHBondContact NH2-OE1 3Å; R835-E839 WeakPolarHBondContact O-CB 3.46Å; R835-E839 WeakPolarHBondContact O-CG 3.37Å; R835-E839 PolarHBondContact O-N 2.88Å; F836-E839 PolarHBondContact O-N 3.25Å; F837-E839 VanDerWaalsContact C-N 3.34Å; F837-E839 PolarHBondContact O-N 3.1Å
840	T	93.9	Very high	94	Very high	1 Å²	1	17.7 Å²	17.7	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-92	-36.9	177.5	49.1	0	0	0	0	113.9	L795 F836 F837 L838 H843 I872 F875	L795-T840 HydrophobicContact CD1-CG2 3.51Å; F836-T840 HydrophobicContact CD1-CG2 4.48Å; F836-T840 HydrophobicContact CE1-CG2 4.05Å; F836-T840 HydrophobicContact CZ-CG2 4.09Å; F836-T840 WeakPolarHBondContact O-CG2 3.33Å; F836-T840 PolarHBondContact O-N 2.95Å; F836-T840 VanDerWaalsContact O-N 3.12Å; F836-T840 PolarHBondContact O-OG1 2.89Å; F837-T840 WeakPolarHBondContact CA-OG1 3.31Å; F837-T840 PolarHBondContact O-N 2.84Å; F837-T840 PolarHBondContact O-OG1 2.92Å; L838-T840 PolarHBondContact O-N 2.86Å; T840-H843 PolarHBondContact O-CE1 3.2Å; T840-I872 HydrophobicContact CG2-CG2 4.24Å; T840-F875 HydrophobicContact CG2-CD1 4.12Å; T840-F875 HydrophobicContact CG2-CE1 3.89Å
841	M	94	Very high	93.6	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-145.2	6.3	-168.3	63.8	168.9	-70	0	0	115.8	F726 F837 H843 Y844 F863 F885 F888	F726-M841 HydrophobicContact CE2-SD 3.67Å; F726-M841 HydrophobicContact CZ-CE 3.84Å; F726-M841 HydrophobicContact CZ-SD 3.37Å; F726-M841 WeakPolarHBondContact CZ-SD 3.47Å; F837-M841 HydrophobicContact CB-CG 4.4Å; F837-M841 HydrophobicContact CD1-SD 4.38Å; F837-M841 WeakPolarHBondContact O-CG 3.29Å; F837-M841 PolarHBondContact O-N 3.41Å; M841-H843 PolarHBondContact O-N 2.81Å; M841-Y844 HydrophobicContact CE-CD1 4.26Å; M841-Y844 HydrophobicContact CE-CG 4.44Å; M841-Y844 WeakPolarHBondContact O-CB 3.28Å; M841-Y844 WeakPolarHBondContact O-CD1 3.32Å; M841-Y844 PolarHBondContact O-N 3Å; M841-F863 HydrophobicContact CB-CE2 4.21Å; M841-F863 HydrophobicContact CB-CZ 3.67Å; M841-F885 HydrophobicContact CE-CE2 4.23Å; M841-F888 HydrophobicContact CE-CD1 3.85Å; M841-F888 HydrophobicContact CE-CE1 3.39Å; M841-F888 HydrophobicContact CE-CZ 3.88Å
842	G	93.4	Very high	93.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-16.4	-177	0	0	0	0	0	114.8	F837 L838 V907	F837-G842 PolarHBondContact O-N 3.22Å; L838-G842 WeakPolarHBondContact O-CA 3.47Å; L838-G842 PolarHBondContact O-N 2.79Å; G842-V907 WeakPolarHBondContact O-CG1 3.21Å
843	H	92.9	Very high	92.8	Very high	3 Å²	3	38.9 Å²	38.9	1%	0.014	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	0.1	175.1	59.8	-65.4	0	0	0	115.4	L436 T840 M841 S845 L846 F847 F863 S866 V867	L436-H843 HydrophobicContact CD2-CB 3.45Å; L436-H843 VanDerWaalsContact CD2-CB 3.45Å; L436-H843 VanDerWaalsContact CD2-CG 3.5Å; T840-H843 PolarHBondContact O-CE1 3.2Å; M841-H843 PolarHBondContact O-N 2.81Å; H843-S845 PolarHBondContact O-N 3.35Å; H843-S845 VanDerWaalsContact O-N 3.07Å; H843-L846 HydrophobicContact CB-CD1 4.4Å; H843-L846 WeakPolarHBondContact O-CB 3.49Å; H843-L846 PolarHBondContact O-N 2.79Å; H843-F847 AromaticContact CD2-CE2 3.72Å; H843-F847 WeakPolarHBondContact O-CD2 3.44Å; H843-F863 AromaticContact CD2-CD2 3.57Å; H843-F863 AromaticContact CD2-CE2 3.66Å; H843-F863 AromaticContact CE1-CE2 3.36Å; H843-F863 WeakPolarHBondContact CE1-CE2 3.26Å; H843-F863 AromaticContact CE1-CZ 3.88Å; H843-F863 AromaticContact ND1-CE2 3.89Å; H843-F863 AromaticContact NE2-CD2 3.35Å; H843-F863 WeakPolarHBondContact NE2-CD2 3.32Å; H843-F863 AromaticContact NE2-CE2 3.2Å; H843-F863 WeakPolarHBondContact NE2-CE2 3.37Å; H843-F863 AromaticContact NE2-CZ 3.93Å; H843-F863 PolarHBondContact NE2-O 3.35Å; H843-S866 PolarHBondContact CD2-OG 3.43Å; H843-S866 VanDerWaalsContact CD2-OG 3.31Å; H843-S866 PolarHBondContact NE2-OG 3.35Å; H843-V867 VanDerWaalsContact CE1-CG2 3.46Å; H843-V867 WeakPolarHBondContact CE1-CG2 3.35Å; H843-V867 VanDerWaalsContact NE2-CG2 3.33Å; H843-V867 WeakPolarHBondContact NE2-CG2 3.45Å
844	Y	93.9	Very high	92.1	Very high	11 Å²	11	41 Å²	41	4%	0.043	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-53.5	-33.3	-175.1	82.3	-83.2	0	0	0	113.8	M841 L846 F847 I848 F888 I889 R892 F903 V907	M841-Y844 HydrophobicContact CE-CD1 4.26Å; M841-Y844 HydrophobicContact CE-CG 4.44Å; M841-Y844 WeakPolarHBondContact O-CB 3.28Å; M841-Y844 WeakPolarHBondContact O-CD1 3.32Å; M841-Y844 PolarHBondContact O-N 3Å; Y844-L846 PolarHBondContact O-N 2.78Å; Y844-F847 PolarHBondContact O-N 2.97Å; Y844-I848 HydrophobicContact CD2-CD1 3.88Å; Y844-I848 HydrophobicContact CE2-CD1 3.8Å; Y844-F888 HydrophobicContact CD1-CE1 4.18Å; Y844-F888 HydrophobicContact CD1-CZ 4.27Å; Y844-F888 AromaticContact CD2-CE1 3.9Å; Y844-F888 HydrophobicContact CD2-CE1 3.9Å; Y844-F888 HydrophobicContact CD2-CZ 4.48Å; Y844-F888 HydrophobicContact CE1-CE1 4.11Å; Y844-F888 AromaticContact CE1-CZ 3.81Å; Y844-F888 HydrophobicContact CE1-CZ 3.81Å; Y844-F888 AromaticContact CE2-CE1 3.85Å; Y844-F888 HydrophobicContact CE2-CE1 3.85Å; Y844-F888 HydrophobicContact CE2-CZ 4.06Å; Y844-F888 HydrophobicContact CG-CE1 4.08Å; Y844-F888 AromaticContact CZ-CE1 3.95Å; Y844-F888 AromaticContact CZ-CZ 3.7Å; Y844-I889 HydrophobicContact CD2-CD1 4.12Å; Y844-R892 HydrophobicContact CE2-CB 4.19Å; Y844-R892 HydrophobicContact CE2-CG 3.81Å; Y844-F903 HydrophobicContact CD1-CE1 4.43Å; Y844-F903 AromaticContact CE1-CE1 3.93Å; Y844-F903 HydrophobicContact CE1-CE1 3.93Å; Y844-V907 HydrophobicContact CE1-CG1 4.4Å; Y844-V907 HydrophobicContact CE1-CG2 4.09Å
845	S	91.9	Very high	91.6	Very high	46 Å²	46	45.8 Å²	45.8	32%	0.322	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-63.6	-25.1	-178.8	53.4	0	0	0	0	113.5	H843 F847	H843-S845 PolarHBondContact O-N 3.35Å; H843-S845 VanDerWaalsContact O-N 3.07Å; S845-F847 PolarHBondContact O-N 3.07Å
846	L	92.1	Very high	91.3	Very high	48 Å²	48	49.8 Å²	49.8	25%	0.251	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-72.7	-11.9	174.9	-55.3	-179.8	0	0	0	113	L439 H843 Y844 L911	L439-L846 HydrophobicContact CB-CD1 4.42Å; L439-L846 HydrophobicContact CD1-CD1 4.49Å; H843-L846 HydrophobicContact CB-CD1 4.4Å; H843-L846 WeakPolarHBondContact O-CB 3.49Å; H843-L846 PolarHBondContact O-N 2.79Å; Y844-L846 PolarHBondContact O-N 2.78Å; L846-L911 HydrophobicContact CD1-CD2 4.06Å; L846-L911 HydrophobicContact CD2-CD1 4.4Å; L846-L911 HydrophobicContact CG-CD2 4.43Å
847	F	93.8	Very high	91.1	Very high	1 Å²	1	52.9 Å²	52.9	0%	0.004	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-114.3	8.5	-174.4	-64.5	-90.7	0	0	0	113.1	L439 L444 H843 Y844 S845 F858 Q859 A862 F863	L439-F847 HydrophobicContact CD1-CE2 3.95Å; L439-F847 HydrophobicContact CD1-CZ 3.53Å; L444-F847 HydrophobicContact CD1-CE1 3.78Å; L444-F847 HydrophobicContact CD1-CZ 4.27Å; H843-F847 AromaticContact CD2-CE2 3.72Å; H843-F847 WeakPolarHBondContact O-CD2 3.44Å; Y844-F847 PolarHBondContact O-N 2.97Å; S845-F847 PolarHBondContact O-N 3.07Å; F847-F858 HydrophobicContact CB-CD2 4.15Å; F847-F858 HydrophobicContact CB-CE2 3.94Å; F847-F858 CarbonylContact O-C 3.52Å; F847-F858 WeakPolarHBondContact O-CA 3.41Å; F847-Q859 HydrophobicContact CB-CB 4.31Å; F847-Q859 HydrophobicContact CD1-CB 4.37Å; F847-Q859 PolarHBondContact O-N 3.43Å; F847-A862 HydrophobicContact CD1-CB 3.74Å; F847-A862 HydrophobicContact CE1-CB 3.78Å; F847-A862 WeakPolarHBondContact CE1-O 3.08Å; F847-F863 HydrophobicContact CB-CB 3.92Å; F847-F863 HydrophobicContact CD1-CB 3.99Å; F847-F863 HydrophobicContact CD2-CB 4.01Å; F847-F863 HydrophobicContact CD2-CD2 4.02Å; F847-F863 HydrophobicContact CG-CB 3.68Å; F847-F863 HydrophobicContact CG-CD2 4.48Å
848	I	91.7	Very high	90.9	Very high	35 Å²	35	53.8 Å²	53.8	18%	0.179	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	97	169.8	-60.5	179.2	0	0	0	107.9	Y844 R856 F858 R892	Y844-I848 HydrophobicContact CD2-CD1 3.88Å; Y844-I848 HydrophobicContact CE2-CD1 3.8Å; I848-R856 HydrophobicContact CG2-CB 3.73Å; I848-R856 HydrophobicContact CG2-CG 4.12Å; I848-F858 HydrophobicContact CG1-CB 4.45Å; I848-F858 HydrophobicContact CG1-CD2 3.89Å; I848-R892 HydrophobicContact CD1-CB 3.73Å
849	T	90.3	Very high	90.9	Very high	41 Å²	41	56.6 Å²	56.6	25%	0.252	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	151.1	-178.5	50.2	0	0	0	0	111.6	R856 V857 Q859	T849-R856 CarbonylContact O-C 3.58Å; T849-R856 WeakPolarHBondContact O-CA 3.5Å; T849-V857 PolarHBondContact N-O 2.94Å; T849-V857 PolarHBondContact O-N 2.86Å; T849-V857 PolarHBondContact OG1-O 3.16Å; T849-Q859 HydrophobicContact CG2-CG 4.5Å; T849-Q859 VanDerWaalsContact CG2-NE2 3.26Å; T849-Q859 PolarHBondContact OG1-NE2 3.49Å
850	Q	89	Confident	90.8	Very high	148 Å²	148	60 Å²	60	69%	0.692	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	136.8	168.8	-67	177.8	19.5	0	0	109.8	E855 R856	Q850-E855 CarbonylContact C-O 3.57Å; Q850-E855 WeakPolarHBondContact CA-O 3.46Å; Q850-R856 HydrophobicContact CG-CG 4.08Å
851	N	86.7	Confident	90.8	Very high	54 Å²	54	63.6 Å²	63.6	29%	0.289	31%	0.309	S	S	.	.			trans	-84.5	178.5	169.9	75	5	0	0	0	111	R853 G854 E855 V857	N851-R853 PolarHBondContact O-N 3.04Å; N851-R853 WeakPolarHBondContact OD1-CA 3.25Å; N851-R853 WeakPolarHBondContact OD1-CB 3.31Å; N851-R853 PolarHBondContact OD1-N 3.48Å; N851-G854 PolarHBondContact O-N 3.35Å; N851-G854 PolarHBondContact OD1-N 3.26Å; N851-E855 PolarHBondContact N-O 2.69Å; N851-E855 PolarHBondContact ND2-OE2 2.91Å; N851-E855 WeakPolarHBondContact OD1-CB 2.99Å; N851-E855 PolarHBondContact OD1-N 3.44Å; N851-E855 PolarHBondContact OD1-O 2.76Å; N851-V857 HydrophobicContact CB-CG2 4.21Å
852	E	86.9	Confident	90.7	Very high	202 Å²	202	65.1 Å²	65.1	94%	0.944	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-16.1	178.4	-58.7	173.9	158.8	0	0	114.5
853	R	85.9	Confident	90.8	Very high	203 Å²	203	65.1 Å²	65.1	77%	0.766	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	0.9	-178.7	-50	177.1	-174.7	-167.2	0.1	112.3	N851 E855	N851-R853 PolarHBondContact O-N 3.04Å; N851-R853 WeakPolarHBondContact OD1-CA 3.25Å; N851-R853 WeakPolarHBondContact OD1-CB 3.31Å; N851-R853 PolarHBondContact OD1-N 3.48Å; R853-E855 HydrophobicContact CB-CG 4.06Å; R853-E855 WeakPolarHBondContact CD-OE2 3.47Å; R853-E855 PolarHBondContact O-N 2.95Å
854	G	82.9	Confident	90.8	Very high	47 Å²	47	68.8 Å²	68.8	49%	0.485	34%	0.336	S	S	.	.	S	Bend	trans	77.1	3.4	-173.5	0	0	0	0	0	114.4	N851	N851-G854 PolarHBondContact O-N 3.35Å; N851-G854 PolarHBondContact OD1-N 3.26Å
855	E	86	Confident	90.7	Very high	103 Å²	103	74.4 Å²	74.4	48%	0.481	36%	0.36	S	S	.	.			trans	-77.6	138	177.1	-52.9	165.4	133.8	0	0	109.1	Q850 N851 R853	Q850-E855 CarbonylContact C-O 3.57Å; Q850-E855 WeakPolarHBondContact CA-O 3.46Å; N851-E855 PolarHBondContact N-O 2.69Å; N851-E855 PolarHBondContact ND2-OE2 2.91Å; N851-E855 WeakPolarHBondContact OD1-CB 2.99Å; N851-E855 PolarHBondContact OD1-N 3.44Å; N851-E855 PolarHBondContact OD1-O 2.76Å; R853-E855 HydrophobicContact CB-CG 4.06Å; R853-E855 WeakPolarHBondContact CD-OE2 3.47Å; R853-E855 PolarHBondContact O-N 2.95Å
856	R	89.5	Confident	90.6	Very high	88 Å²	88	73.6 Å²	73.6	33%	0.332	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	130.9	174.6	-73.5	179.2	-58.1	-156.1	-7	110.2	I848 T849 Q850 E893 L894 R895	I848-R856 HydrophobicContact CG2-CB 3.73Å; I848-R856 HydrophobicContact CG2-CG 4.12Å; T849-R856 CarbonylContact O-C 3.58Å; T849-R856 WeakPolarHBondContact O-CA 3.5Å; Q850-R856 HydrophobicContact CG-CG 4.08Å; R856-E893 VanDerWaalsContact CZ-O 3.23Å; R856-E893 PolarHBondContact NE-O 3.26Å; R856-E893 PolarHBondContact NH2-O 3.32Å; R856-L894 PolarHBondContact NH2-O 3.36Å; R856-R895 VanDerWaalsContact CZ-O 3.29Å; R856-R895 PolarHBondContact NH1-O 3.23Å; R856-R895 VanDerWaalsContact NH2-C 3.27Å; R856-R895 PolarHBondContact NH2-O 3.37Å
857	V	91.5	Very high	90.4	Very high	65 Å²	65	71.7 Å²	71.7	39%	0.394	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	132.9	-178.4	-176.4	0	0	0	0	109.6	T849 N851 E893	T849-V857 PolarHBondContact N-O 2.94Å; T849-V857 PolarHBondContact O-N 2.86Å; T849-V857 PolarHBondContact OG1-O 3.16Å; N851-V857 HydrophobicContact CB-CG2 4.21Å; V857-E893 WeakPolarHBondContact CA-OE1 3.4Å
858	F	94.3	Very high	90.1	Very high	20 Å²	20	75 Å²	75	9%	0.088	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121	179.4	178.7	-113.9	0	0	0	112.8	F847 I848 R860 F863 M880 F885 I889 E893	F847-F858 HydrophobicContact CB-CD2 4.15Å; F847-F858 HydrophobicContact CB-CE2 3.94Å; F847-F858 CarbonylContact O-C 3.52Å; F847-F858 WeakPolarHBondContact O-CA 3.41Å; I848-F858 HydrophobicContact CG1-CB 4.45Å; I848-F858 HydrophobicContact CG1-CD2 3.89Å; F858-R860 VanDerWaalsContact C-N 3.27Å; F858-R860 HydrophobicContact CD1-CB 4.42Å; F858-R860 HydrophobicContact CE1-CB 4.46Å; F858-R860 PolarHBondContact O-N 2.88Å; F858-F863 HydrophobicContact CE1-CD1 4.29Å; F858-F863 HydrophobicContact CE1-CG 4.46Å; F858-F863 HydrophobicContact CE2-CB 3.99Å; F858-F863 HydrophobicContact CE2-CD2 4.18Å; F858-F863 AromaticContact CE2-CG 3.97Å; F858-F863 HydrophobicContact CE2-CG 3.97Å; F858-F863 HydrophobicContact CZ-CB 3.68Å; F858-F863 AromaticContact CZ-CD1 3.59Å; F858-F863 HydrophobicContact CZ-CD1 3.59Å; F858-F863 AromaticContact CZ-CD2 3.99Å; F858-F863 HydrophobicContact CZ-CD2 3.99Å; F858-F863 HydrophobicContact CZ-CE1 4.21Å; F858-F863 AromaticContact CZ-CG 3.46Å; F858-F863 HydrophobicContact CZ-CG 3.46Å; F858-F863 VanDerWaalsContact CZ-CG 3.46Å; F858-M880 HydrophobicContact CE1-CE 4.33Å; F858-F885 AromaticContact CE1-CE1 3.79Å; F858-F885 HydrophobicContact CE1-CE1 3.79Å; F858-F885 AromaticContact CE1-CZ 3.81Å; F858-F885 HydrophobicContact CE1-CZ 3.81Å; F858-F885 HydrophobicContact CZ-CE1 4.39Å; F858-F885 AromaticContact CZ-CZ 3.93Å; F858-F885 HydrophobicContact CZ-CZ 3.93Å; F858-I889 HydrophobicContact CB-CG2 3.47Å; F858-I889 VanDerWaalsContact CB-CG2 3.47Å; F858-I889 HydrophobicContact CD1-CD1 4.04Å; F858-I889 HydrophobicContact CD1-CG1 4.08Å; F858-I889 HydrophobicContact CD1-CG2 3.83Å; F858-I889 HydrophobicContact CD2-CD1 3.93Å; F858-I889 HydrophobicContact CD2-CG2 4.5Å; F858-I889 HydrophobicContact CE1-CD1 3.95Å; F858-I889 HydrophobicContact CE1-CG1 4.14Å; F858-I889 HydrophobicContact CE2-CD1 3.84Å; F858-I889 HydrophobicContact CG-CD1 4.01Å; F858-I889 HydrophobicContact CG-CG1 4.4Å; F858-I889 HydrophobicContact CG-CG2 3.7Å; F858-I889 HydrophobicContact CZ-CD1 3.84Å; F858-E893 WeakPolarHBondContact CB-OE1 3.48Å; F858-E893 PolarHBondContact N-OE1 3.36Å
859	Q	94.1	Very high	89.9	Confident	66 Å²	66	74.9 Å²	74.9	31%	0.308	38%	0.375	S	S	.	.			trans	-78.8	69.5	-178.7	-57.9	-170.6	-1.4	0	0	112.4	F847 T849 E861 A862 F863	F847-Q859 HydrophobicContact CB-CB 4.31Å; F847-Q859 HydrophobicContact CD1-CB 4.37Å; F847-Q859 PolarHBondContact O-N 3.43Å; T849-Q859 HydrophobicContact CG2-CG 4.5Å; T849-Q859 VanDerWaalsContact CG2-NE2 3.26Å; T849-Q859 PolarHBondContact OG1-NE2 3.49Å; Q859-E861 PolarHBondContact O-N 3.49Å; Q859-A862 HydrophobicContact CB-CB 3.97Å; Q859-A862 PolarHBondContact O-N 3.08Å; Q859-F863 PolarHBondContact O-N 2.93Å
860	R	93.1	Very high	89.8	Confident	76 Å²	76	78.2 Å²	78.2	29%	0.287	39%	0.386	S	S	.	.	H	α-helix	trans	-37.3	-59.9	-174.7	-171.2	-174.7	-178.6	78.4	0.3	114.9	F858 R864 M880 E881	F858-R860 VanDerWaalsContact C-N 3.27Å; F858-R860 HydrophobicContact CD1-CB 4.42Å; F858-R860 HydrophobicContact CE1-CB 4.46Å; F858-R860 PolarHBondContact O-N 2.88Å; R860-R864 PolarHBondContact O-N 3.4Å; R860-R864 VanDerWaalsContact O-N 3.17Å; R860-M880 HydrophobicContact CB-CE 4.42Å; R860-M880 HydrophobicContact CG-CE 3.4Å; R860-M880 VanDerWaalsContact CG-CE 3.4Å; R860-M880 VanDerWaalsContact CZ-O 3.32Å; R860-M880 PolarHBondContact NH1-O 2.89Å; R860-M880 PolarHBondContact NH2-O 3.03Å; R860-E881 IonicContact CZ-OE1 3.16Å; R860-E881 IonicContact CZ-OE2 3.75Å; R860-E881 IonicContact NE-OE1 3.07Å; R860-E881 IonicContact NH2-OE1 3.34Å; R860-E881 PolarHBondContact NH2-OE1 2.81Å; R860-E881 IonicContact NH2-OE2 3.48Å; R860-E881 PolarHBondContact NH2-OE2 2.93Å; R860-E881 VanDerWaalsContact NH2-OE2 3.1Å
861	E	92.5	Very high	89.7	Confident	77 Å²	77	73.9 Å²	73.9	36%	0.36	37%	0.372	S	S	.	.	H	α-helix	trans	-75.5	-29.8	-175.7	-72.2	-53.7	129.2	0	0	113.4	Q859 R864 K865	Q859-E861 PolarHBondContact O-N 3.49Å; E861-R864 PolarHBondContact O-N 3.32Å; E861-R864 IonicContact OE1-NH1 2.71Å; E861-R864 IonicContact OE2-NH1 3.38Å; E861-R864 PolarHBondContact OE2-NH1 3.43Å; E861-K865 VanDerWaalsContact O-CB 3.23Å; E861-K865 WeakPolarHBondContact O-CB 3.41Å; E861-K865 WeakPolarHBondContact O-CG 3.35Å; E861-K865 PolarHBondContact O-N 3.1Å
862	A	93.1	Very high	89.9	Confident	33 Å²	33	71.6 Å²	71.6	27%	0.273	36%	0.36	S	S	.	.	H	α-helix	trans	-67.1	-44	174.8	0	0	0	0	0	110.6	F847 Q859 R864 K865 S866	F847-A862 HydrophobicContact CD1-CB 3.74Å; F847-A862 HydrophobicContact CE1-CB 3.78Å; F847-A862 WeakPolarHBondContact CE1-O 3.08Å; Q859-A862 HydrophobicContact CB-CB 3.97Å; Q859-A862 PolarHBondContact O-N 3.08Å; A862-R864 PolarHBondContact O-N 3.48Å; A862-K865 PolarHBondContact O-N 2.66Å; A862-S866 WeakPolarHBondContact O-CB 3.28Å; A862-S866 PolarHBondContact O-N 3.36Å
863	F	95	Very high	90.1	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-54.7	-49.7	173.2	162.7	-99	0	0	0	111.5	M841 H843 F847 F858 Q859 S866 L876 M880 F885	M841-F863 HydrophobicContact CB-CE2 4.21Å; M841-F863 HydrophobicContact CB-CZ 3.67Å; H843-F863 AromaticContact CD2-CD2 3.57Å; H843-F863 AromaticContact CD2-CE2 3.66Å; H843-F863 AromaticContact CE1-CE2 3.36Å; H843-F863 WeakPolarHBondContact CE1-CE2 3.26Å; H843-F863 AromaticContact CE1-CZ 3.88Å; H843-F863 AromaticContact ND1-CE2 3.89Å; H843-F863 AromaticContact NE2-CD2 3.35Å; H843-F863 WeakPolarHBondContact NE2-CD2 3.32Å; H843-F863 AromaticContact NE2-CE2 3.2Å; H843-F863 WeakPolarHBondContact NE2-CE2 3.37Å; H843-F863 AromaticContact NE2-CZ 3.93Å; H843-F863 PolarHBondContact NE2-O 3.35Å; F847-F863 HydrophobicContact CB-CB 3.92Å; F847-F863 HydrophobicContact CD1-CB 3.99Å; F847-F863 HydrophobicContact CD2-CB 4.01Å; F847-F863 HydrophobicContact CD2-CD2 4.02Å; F847-F863 HydrophobicContact CG-CB 3.68Å; F847-F863 HydrophobicContact CG-CD2 4.48Å; F858-F863 HydrophobicContact CE1-CD1 4.29Å; F858-F863 HydrophobicContact CE1-CG 4.46Å; F858-F863 HydrophobicContact CE2-CB 3.99Å; F858-F863 HydrophobicContact CE2-CD2 4.18Å; F858-F863 AromaticContact CE2-CG 3.97Å; F858-F863 HydrophobicContact CE2-CG 3.97Å; F858-F863 HydrophobicContact CZ-CB 3.68Å; F858-F863 AromaticContact CZ-CD1 3.59Å; F858-F863 HydrophobicContact CZ-CD1 3.59Å; F858-F863 AromaticContact CZ-CD2 3.99Å; F858-F863 HydrophobicContact CZ-CD2 3.99Å; F858-F863 HydrophobicContact CZ-CE1 4.21Å; F858-F863 AromaticContact CZ-CG 3.46Å; F858-F863 HydrophobicContact CZ-CG 3.46Å; F858-F863 VanDerWaalsContact CZ-CG 3.46Å; Q859-F863 PolarHBondContact O-N 2.93Å; F863-S866 PolarHBondContact O-OG 3.25Å; F863-L876 HydrophobicContact CE1-CD1 4.02Å; F863-L876 HydrophobicContact CE1-CD2 4.13Å; F863-L876 HydrophobicContact CZ-CD1 4.28Å; F863-L876 HydrophobicContact CZ-CD2 4.33Å; F863-M880 HydrophobicContact CD1-CE 3.76Å; F863-M880 HydrophobicContact CD1-SD 3.79Å; F863-M880 HydrophobicContact CE1-CE 4.12Å; F863-M880 HydrophobicContact CE1-CG 4.46Å; F863-M880 HydrophobicContact CE1-SD 3.62Å; F863-F885 HydrophobicContact CE1-CZ 4.21Å
864	R	93.4	Very high	90.2	Very high	80 Å²	80	60.1 Å²	60.1	30%	0.302	31%	0.308	S	S	.	.	H	α-helix	trans	-65.1	-46.9	178.8	-179.4	176.1	167.2	-129.5	7.4	112.1	R860 E861 A862 S866 V867 R873 L876 M880	R860-R864 PolarHBondContact O-N 3.4Å; R860-R864 VanDerWaalsContact O-N 3.17Å; E861-R864 PolarHBondContact O-N 3.32Å; E861-R864 IonicContact OE1-NH1 2.71Å; E861-R864 IonicContact OE2-NH1 3.38Å; E861-R864 PolarHBondContact OE2-NH1 3.43Å; A862-R864 PolarHBondContact O-N 3.48Å; R864-S866 VanDerWaalsContact C-N 3.31Å; R864-S866 PolarHBondContact O-N 3Å; R864-V867 PolarHBondContact O-N 2.6Å; R864-R873 PolarHBondContact NE-O 3.18Å; R864-R873 VanDerWaalsContact O-CD 3.32Å; R864-R873 WeakPolarHBondContact O-CD 3.3Å; R864-R873 WeakPolarHBondContact O-CG 3.34Å; R864-L876 HydrophobicContact CG-CB 4.48Å; R864-M880 HydrophobicContact CB-CE 4.41Å; R864-M880 HydrophobicContact CB-SD 4.2Å
865	K	91.2	Very high	90.6	Very high	129 Å²	129	58.4 Å²	58.4	56%	0.561	29%	0.287	S	S	*	.	H	α-helix	trans	-64	-32	-179.2	-75.1	173.8	-179.7	-175.7	0	113.2	E861 A862 V867	E861-K865 VanDerWaalsContact O-CB 3.23Å; E861-K865 WeakPolarHBondContact O-CB 3.41Å; E861-K865 WeakPolarHBondContact O-CG 3.35Å; E861-K865 PolarHBondContact O-N 3.1Å; A862-K865 PolarHBondContact O-N 2.66Å; K865-V867 PolarHBondContact O-N 2.99Å; K865-V867 VanDerWaalsContact O-N 3.12Å
866	S	89.1	Confident	90.9	Very high	29 Å²	29	53.5 Å²	53.5	20%	0.203	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.1	178.8	75.4	0	0	0	0	114.6	L436 H843 A862 F863 R864 A868	L436-S866 VanDerWaalsContact CD1-O 3.31Å; L436-S866 WeakPolarHBondContact CD1-O 3.38Å; H843-S866 PolarHBondContact CD2-OG 3.43Å; H843-S866 VanDerWaalsContact CD2-OG 3.31Å; H843-S866 PolarHBondContact NE2-OG 3.35Å; A862-S866 WeakPolarHBondContact O-CB 3.28Å; A862-S866 PolarHBondContact O-N 3.36Å; F863-S866 PolarHBondContact O-OG 3.25Å; R864-S866 VanDerWaalsContact C-N 3.31Å; R864-S866 PolarHBondContact O-N 3Å; S866-A868 PolarHBondContact O-N 3.26Å
867	V	89.1	Confident	90.9	Very high	8 Å²	8	50.1 Å²	50.1	5%	0.048	26%	0.257	C	S	.	.			trans	-80.5	108	-176.9	-177	0	0	0	0	111.4	H843 R864 K865 S869 I872 R873 L876	H843-V867 VanDerWaalsContact CE1-CG2 3.46Å; H843-V867 WeakPolarHBondContact CE1-CG2 3.35Å; H843-V867 VanDerWaalsContact NE2-CG2 3.33Å; H843-V867 WeakPolarHBondContact NE2-CG2 3.45Å; R864-V867 PolarHBondContact O-N 2.6Å; K865-V867 PolarHBondContact O-N 2.99Å; K865-V867 VanDerWaalsContact O-N 3.12Å; V867-S869 PolarHBondContact O-N 3.42Å; V867-I872 HydrophobicContact CG1-CB 3.76Å; V867-I872 HydrophobicContact CG1-CD1 4.42Å; V867-I872 HydrophobicContact CG1-CG2 3.77Å; V867-R873 HydrophobicContact CB-CG 3.97Å; V867-R873 HydrophobicContact CG1-CG 4.47Å; V867-R873 WeakPolarHBondContact O-CD 3.46Å; V867-R873 VanDerWaalsContact O-CG 3.27Å; V867-R873 WeakPolarHBondContact O-CG 3.47Å; V867-R873 PolarHBondContact O-NE 2.86Å; V867-L876 HydrophobicContact CG2-CD1 3.91Å
868	A	85.9	Confident	90.6	Very high	70 Å²	70	47.4 Å²	47.4	58%	0.579	24%	0.24	S	C	*	.			trans	-61.2	-17	-178.1	0	0	0	0	0	115.5	S866	S866-A868 PolarHBondContact O-N 3.26Å
869	S	88.1	Confident	90.5	Very high	33 Å²	33	46.4 Å²	46.4	23%	0.231	24%	0.236	C	C	.	.			trans	-88.6	117.1	179.4	-170.8	0	0	0	0	112.1	V867 S871 I872 R873	V867-S869 PolarHBondContact O-N 3.42Å; S869-S871 VanDerWaalsContact C-N 3.27Å; S869-S871 PolarHBondContact O-N 2.84Å; S869-S871 PolarHBondContact OG-OG 3.24Å; S869-S871 VanDerWaalsContact OG-OG 3.12Å; S869-I872 PolarHBondContact O-N 2.97Å; S869-R873 PolarHBondContact O-N 3.18Å
870	K	88	Confident	90.4	Very high	112 Å²	112	43.4 Å²	43.4	49%	0.487	22%	0.222	S	C	.	.	H	α-helix	trans	-52.4	-43.1	174.8	-72.5	-171.9	175.8	-176	0	111.7	D452 I872 R873 R874	D452-K870 WeakPolarHBondContact O-CE 3.37Å; D452-K870 PolarHBondContact O-NZ 2.9Å; K870-I872 PolarHBondContact O-N 2.75Å; K870-R873 PolarHBondContact O-N 3.17Å; K870-R874 PolarHBondContact O-N 2.89Å
871	S	88.4	Confident	90.1	Very high	56 Å²	56	41.5 Å²	41.5	39%	0.392	22%	0.216	S	C	.	.	H	α-helix	trans	-67.2	-35.5	-179.5	58.9	0	0	0	0	114.2	S869 R874 F875	S869-S871 VanDerWaalsContact C-N 3.27Å; S869-S871 PolarHBondContact O-N 2.84Å; S869-S871 PolarHBondContact OG-OG 3.24Å; S869-S871 VanDerWaalsContact OG-OG 3.12Å; S871-R874 PolarHBondContact O-N 2.85Å; S871-F875 PolarHBondContact O-N 2.84Å; S871-F875 VanDerWaalsContact O-N 3.08Å
872	I	91.1	Very high	90	Very high	7 Å²	7	37.9 Å²	37.9	4%	0.036	20%	0.199	C	C	.	.	H	α-helix	trans	-73.6	-34.9	174.9	-55.7	174.3	0	0	0	109.7	P792 L795 T840 V867 S869 K870 R874 F875 L876	P792-I872 HydrophobicContact CB-CG1 3.92Å; P792-I872 HydrophobicContact CG-CG1 3.99Å; L795-I872 HydrophobicContact CD1-CD1 3.97Å; L795-I872 HydrophobicContact CD1-CG1 4.34Å; T840-I872 HydrophobicContact CG2-CG2 4.24Å; V867-I872 HydrophobicContact CG1-CB 3.76Å; V867-I872 HydrophobicContact CG1-CD1 4.42Å; V867-I872 HydrophobicContact CG1-CG2 3.77Å; S869-I872 PolarHBondContact O-N 2.97Å; K870-I872 PolarHBondContact O-N 2.75Å; I872-R874 VanDerWaalsContact C-N 3.35Å; I872-R874 PolarHBondContact O-N 3.4Å; I872-F875 PolarHBondContact O-N 2.97Å; I872-L876 HydrophobicContact CG2-CD1 3.98Å; I872-L876 HydrophobicContact CG2-CG 4.08Å; I872-L876 VanDerWaalsContact O-CB 3.29Å; I872-L876 WeakPolarHBondContact O-CB 3.25Å; I872-L876 VanDerWaalsContact O-CG 3.29Å; I872-L876 WeakPolarHBondContact O-CG 3.31Å; I872-L876 PolarHBondContact O-N 2.79Å
873	R	91.1	Very high	89.8	Confident	87 Å²	87	37.7 Å²	37.7	33%	0.328	19%	0.193	S	C	.	.	H	α-helix	trans	-65.9	-31	172.7	-73.9	-163.7	-80.3	138.5	-8.7	114.1	R864 V867 S869 K870 G877	R864-R873 PolarHBondContact NE-O 3.18Å; R864-R873 VanDerWaalsContact O-CD 3.32Å; R864-R873 WeakPolarHBondContact O-CD 3.3Å; R864-R873 WeakPolarHBondContact O-CG 3.34Å; V867-R873 HydrophobicContact CB-CG 3.97Å; V867-R873 HydrophobicContact CG1-CG 4.47Å; V867-R873 WeakPolarHBondContact O-CD 3.46Å; V867-R873 VanDerWaalsContact O-CG 3.27Å; V867-R873 WeakPolarHBondContact O-CG 3.47Å; V867-R873 PolarHBondContact O-NE 2.86Å; S869-R873 PolarHBondContact O-N 3.18Å; K870-R873 PolarHBondContact O-N 3.17Å; R873-G877 PolarHBondContact O-N 3.34Å; R873-G877 VanDerWaalsContact O-N 3.14Å
874	R	87.6	Confident	89.7	Confident	76 Å²	76	37.8 Å²	37.8	29%	0.287	19%	0.193	S	C	.	.	H	α-helix	trans	-67.4	-55.4	170.1	-171.3	-172.7	-98.8	151.5	-3.6	110.1	E457 S460 D461 F464 K870 S871 I872 L876 G877	E457-R874 IonicContact OE2-CZ 2.65Å; E457-R874 IonicContact OE2-NH1 2.65Å; E457-R874 PolarHBondContact OE2-NH1 2.77Å; E457-R874 IonicContact OE2-NH2 3.5Å; E457-R874 PolarHBondContact OE2-NH2 2.96Å; S460-R874 PolarHBondContact OG-NH2 3.01Å; S460-R874 VanDerWaalsContact OG-NH2 3.17Å; D461-R874 IonicContact OD1-CZ 2.85Å; D461-R874 IonicContact OD1-NE 2.85Å; D461-R874 PolarHBondContact OD1-NE 3.09Å; D461-R874 IonicContact OD1-NH2 3.79Å; D461-R874 PolarHBondContact OD1-NH2 3.06Å; F464-R874 HydrophobicContact CD2-CG 4.26Å; F464-R874 HydrophobicContact CE2-CG 4.36Å; K870-R874 PolarHBondContact O-N 2.89Å; S871-R874 PolarHBondContact O-N 2.85Å; I872-R874 VanDerWaalsContact C-N 3.35Å; I872-R874 PolarHBondContact O-N 3.4Å; R874-L876 PolarHBondContact O-N 2.9Å; R874-G877 PolarHBondContact O-N 2.76Å; R874-G877 VanDerWaalsContact O-N 3.12Å
875	F	90.7	Very high	89.6	Confident	12 Å²	12	34 Å²	34	5%	0.053	18%	0.179	C	C	.	.	H	α-helix	trans	-52.7	-52.4	176.1	165.8	-101.7	0	0	0	112.9	L697 L791 P792 F836 T840 S871 I872 G877 V878 F879	L697-F875 HydrophobicContact CD1-CE2 3.91Å; L697-F875 HydrophobicContact CD1-CZ 3.97Å; L791-F875 HydrophobicContact CD2-CE2 4.46Å; P792-F875 HydrophobicContact CG-CB 3.79Å; P792-F875 HydrophobicContact CG-CD1 4.23Å; P792-F875 HydrophobicContact CG-CG 3.98Å; F836-F875 HydrophobicContact CE1-CZ 4.17Å; F836-F875 HydrophobicContact CZ-CZ 4.39Å; T840-F875 HydrophobicContact CG2-CD1 4.12Å; T840-F875 HydrophobicContact CG2-CE1 3.89Å; S871-F875 PolarHBondContact O-N 2.84Å; S871-F875 VanDerWaalsContact O-N 3.08Å; I872-F875 PolarHBondContact O-N 2.97Å; F875-G877 VanDerWaalsContact C-N 3.29Å; F875-G877 PolarHBondContact O-N 2.72Å; F875-V878 PolarHBondContact O-N 3.3Å; F875-V878 VanDerWaalsContact O-N 3.09Å; F875-F879 HydrophobicContact CD2-CB 4.4Å; F875-F879 HydrophobicContact CE1-CB 4.08Å; F875-F879 AromaticContact CE1-CD1 3.95Å; F875-F879 HydrophobicContact CE1-CD1 3.95Å; F875-F879 HydrophobicContact CE1-CG 4.17Å; F875-F879 HydrophobicContact CE2-CB 3.92Å; F875-F879 HydrophobicContact CE2-CG 4.23Å; F875-F879 HydrophobicContact CZ-CB 3.74Å; F875-F879 AromaticContact CZ-CD1 3.8Å; F875-F879 HydrophobicContact CZ-CD1 3.8Å; F875-F879 HydrophobicContact CZ-CD2 4.35Å; F875-F879 AromaticContact CZ-CG 3.68Å; F875-F879 HydrophobicContact CZ-CG 3.68Å; F875-F879 WeakPolarHBondContact O-CB 3.4Å; F875-F879 PolarHBondContact O-N 3.35Å
876	L	92.6	Very high	89.6	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.4	-37.1	178.5	-75.2	178.4	0	0	0	112.3	F863 R864 V867 I872 R874 V878 M880	F863-L876 HydrophobicContact CE1-CD1 4.02Å; F863-L876 HydrophobicContact CE1-CD2 4.13Å; F863-L876 HydrophobicContact CZ-CD1 4.28Å; F863-L876 HydrophobicContact CZ-CD2 4.33Å; R864-L876 HydrophobicContact CG-CB 4.48Å; V867-L876 HydrophobicContact CG2-CD1 3.91Å; I872-L876 HydrophobicContact CG2-CD1 3.98Å; I872-L876 HydrophobicContact CG2-CG 4.08Å; I872-L876 VanDerWaalsContact O-CB 3.29Å; I872-L876 WeakPolarHBondContact O-CB 3.25Å; I872-L876 VanDerWaalsContact O-CG 3.29Å; I872-L876 WeakPolarHBondContact O-CG 3.31Å; I872-L876 PolarHBondContact O-N 2.79Å; R874-L876 PolarHBondContact O-N 2.9Å; L876-V878 PolarHBondContact O-N 2.67Å; L876-M880 HydrophobicContact CB-CG 4.35Å; L876-M880 HydrophobicContact CB-SD 3.79Å; L876-M880 HydrophobicContact CD2-CG 4.32Å; L876-M880 HydrophobicContact CD2-SD 4.31Å; L876-M880 HydrophobicContact CG-SD 4.49Å; L876-M880 WeakPolarHBondContact O-CB 3.15Å; L876-M880 WeakPolarHBondContact O-CG 3.22Å; L876-M880 PolarHBondContact O-N 2.98Å; L876-M880 VanDerWaalsContact O-SD 3.41Å
877	G	88.4	Confident	89.5	Confident	17 Å²	17	28.1 Å²	28.1	18%	0.175	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-10.8	176.9	0	0	0	0	0	115.1	R873 R874 F875	R873-G877 PolarHBondContact O-N 3.34Å; R873-G877 VanDerWaalsContact O-N 3.14Å; R874-G877 PolarHBondContact O-N 2.76Å; R874-G877 VanDerWaalsContact O-N 3.12Å; F875-G877 VanDerWaalsContact C-N 3.29Å; F875-G877 PolarHBondContact O-N 2.72Å
878	V	85.8	Confident	89.6	Confident	7 Å²	7	28 Å²	28	4%	0.042	16%	0.155	C	C	.	.	H	α-helix	trans	-113.2	-49	174.5	-172.9	0	0	0	0	110.2	F464 L471 L698 F875 L876 M880 E881	F464-V878 HydrophobicContact CB-CG2 4.16Å; F464-V878 HydrophobicContact CD1-CG2 3.85Å; F464-V878 HydrophobicContact CG-CG2 4.31Å; L471-V878 HydrophobicContact CD1-CG1 4.29Å; L698-V878 HydrophobicContact CD2-CB 4.43Å; L698-V878 HydrophobicContact CD2-CG1 3.69Å; F875-V878 PolarHBondContact O-N 3.3Å; F875-V878 VanDerWaalsContact O-N 3.09Å; L876-V878 PolarHBondContact O-N 2.67Å; V878-M880 PolarHBondContact O-N 2.87Å; V878-E881 WeakPolarHBondContact O-CB 3.41Å; V878-E881 PolarHBondContact O-N 2.79Å
879	F	91.3	Very high	89.9	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-34.2	-179.5	178.8	-122.4	0	0	0	113.1	L697 F726 F837 F875 E881 S882 M884 F885	L697-F879 HydrophobicContact CB-CD2 4.07Å; L697-F879 HydrophobicContact CB-CE2 4.17Å; L697-F879 HydrophobicContact CD2-CD2 4.28Å; L697-F879 HydrophobicContact CD2-CE2 3.65Å; L697-F879 HydrophobicContact CD2-CZ 4.03Å; L697-F879 HydrophobicContact CG-CE2 4.47Å; L697-F879 WeakPolarHBondContact O-CD2 3.38Å; F726-F879 HydrophobicContact CD1-CZ 4.47Å; F726-F879 AromaticContact CD2-CZ 3.92Å; F726-F879 HydrophobicContact CD2-CZ 3.92Å; F726-F879 HydrophobicContact CE1-CE1 4.43Å; F726-F879 HydrophobicContact CE1-CZ 4.08Å; F726-F879 AromaticContact CE2-CE1 3.77Å; F726-F879 HydrophobicContact CE2-CE1 3.77Å; F726-F879 AromaticContact CE2-CZ 3.47Å; F726-F879 HydrophobicContact CE2-CZ 3.47Å; F726-F879 VanDerWaalsContact CE2-CZ 3.47Å; F726-F879 HydrophobicContact CG-CZ 4.39Å; F726-F879 AromaticContact CZ-CE1 3.63Å; F726-F879 HydrophobicContact CZ-CE1 3.63Å; F726-F879 AromaticContact CZ-CZ 3.53Å; F726-F879 HydrophobicContact CZ-CZ 3.53Å; F837-F879 HydrophobicContact CE1-CZ 4.43Å; F875-F879 HydrophobicContact CD2-CB 4.4Å; F875-F879 HydrophobicContact CE1-CB 4.08Å; F875-F879 AromaticContact CE1-CD1 3.95Å; F875-F879 HydrophobicContact CE1-CD1 3.95Å; F875-F879 HydrophobicContact CE1-CG 4.17Å; F875-F879 HydrophobicContact CE2-CB 3.92Å; F875-F879 HydrophobicContact CE2-CG 4.23Å; F875-F879 HydrophobicContact CZ-CB 3.74Å; F875-F879 AromaticContact CZ-CD1 3.8Å; F875-F879 HydrophobicContact CZ-CD1 3.8Å; F875-F879 HydrophobicContact CZ-CD2 4.35Å; F875-F879 AromaticContact CZ-CG 3.68Å; F875-F879 HydrophobicContact CZ-CG 3.68Å; F875-F879 WeakPolarHBondContact O-CB 3.4Å; F875-F879 PolarHBondContact O-N 3.35Å; F879-E881 PolarHBondContact O-N 2.79Å; F879-S882 VanDerWaalsContact O-CB 3.29Å; F879-S882 WeakPolarHBondContact O-CB 3.3Å; F879-S882 PolarHBondContact O-N 3.48Å; F879-S882 VanDerWaalsContact O-N 3.13Å; F879-S882 PolarHBondContact O-OG 2.77Å; F879-M884 HydrophobicContact CE2-CE 4.48Å; F879-F885 HydrophobicContact CD1-CD2 4.23Å; F879-F885 AromaticContact CE1-CD2 3.9Å; F879-F885 HydrophobicContact CE1-CD2 3.9Å
880	M	92.2	Very high	89.8	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-8.7	178.6	-64.8	168.3	55	0	0	114	F858 R860 F863 R864 L876 V878 F885	F858-M880 HydrophobicContact CE1-CE 4.33Å; R860-M880 HydrophobicContact CB-CE 4.42Å; R860-M880 HydrophobicContact CG-CE 3.4Å; R860-M880 VanDerWaalsContact CG-CE 3.4Å; R860-M880 VanDerWaalsContact CZ-O 3.32Å; R860-M880 PolarHBondContact NH1-O 2.89Å; R860-M880 PolarHBondContact NH2-O 3.03Å; F863-M880 HydrophobicContact CD1-CE 3.76Å; F863-M880 HydrophobicContact CD1-SD 3.79Å; F863-M880 HydrophobicContact CE1-CE 4.12Å; F863-M880 HydrophobicContact CE1-CG 4.46Å; F863-M880 HydrophobicContact CE1-SD 3.62Å; R864-M880 HydrophobicContact CB-CE 4.41Å; R864-M880 HydrophobicContact CB-SD 4.2Å; L876-M880 HydrophobicContact CB-CG 4.35Å; L876-M880 HydrophobicContact CB-SD 3.79Å; L876-M880 HydrophobicContact CD2-CG 4.32Å; L876-M880 HydrophobicContact CD2-SD 4.31Å; L876-M880 HydrophobicContact CG-SD 4.49Å; L876-M880 WeakPolarHBondContact O-CB 3.15Å; L876-M880 WeakPolarHBondContact O-CG 3.22Å; L876-M880 PolarHBondContact O-N 2.98Å; L876-M880 VanDerWaalsContact O-SD 3.41Å; V878-M880 PolarHBondContact O-N 2.87Å; M880-F885 HydrophobicContact CB-CD1 3.83Å; M880-F885 HydrophobicContact CB-CE1 3.92Å; M880-F885 HydrophobicContact CB-CG 4.27Å; M880-F885 HydrophobicContact CB-CZ 4.42Å; M880-F885 HydrophobicContact CE-CE1 4.16Å; M880-F885 HydrophobicContact CE-CZ 4.31Å; M880-F885 HydrophobicContact CG-CD1 4Å; M880-F885 HydrophobicContact CG-CD2 4.22Å; M880-F885 HydrophobicContact CG-CE1 3.74Å; M880-F885 HydrophobicContact CG-CE2 3.97Å; M880-F885 HydrophobicContact CG-CG 4.24Å; M880-F885 HydrophobicContact CG-CZ 3.73Å; M880-F885 HydrophobicContact SD-CZ 4.48Å
881	E	88.5	Confident	89.6	Confident	37 Å²	37	22.3 Å²	22.3	17%	0.173	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-12.2	172	-55.8	-57.4	157.6	0	0	113.1	T468 L471 Q475 R860 V878 F879	T468-E881 HydrophobicContact CG2-CG 4.29Å; L471-E881 HydrophobicContact CB-CB 4.23Å; L471-E881 HydrophobicContact CD1-CB 4.11Å; Q475-E881 PolarHBondContact NE2-O 3.39Å; Q475-E881 VanDerWaalsContact NE2-O 3.17Å; R860-E881 IonicContact CZ-OE1 3.16Å; R860-E881 IonicContact CZ-OE2 3.75Å; R860-E881 IonicContact NE-OE1 3.07Å; R860-E881 IonicContact NH2-OE1 3.34Å; R860-E881 PolarHBondContact NH2-OE1 2.81Å; R860-E881 IonicContact NH2-OE2 3.48Å; R860-E881 PolarHBondContact NH2-OE2 2.93Å; R860-E881 VanDerWaalsContact NH2-OE2 3.1Å; V878-E881 WeakPolarHBondContact O-CB 3.41Å; V878-E881 PolarHBondContact O-N 2.79Å; F879-E881 PolarHBondContact O-N 2.79Å
882	S	89.9	Confident	89.6	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	-62.2	146.6	177.6	66.8	0	0	0	0	112.4	F879 M884 F885 A886	F879-S882 VanDerWaalsContact O-CB 3.29Å; F879-S882 WeakPolarHBondContact O-CB 3.3Å; F879-S882 PolarHBondContact O-N 3.48Å; F879-S882 VanDerWaalsContact O-N 3.13Å; F879-S882 PolarHBondContact O-OG 2.77Å; S882-M884 PolarHBondContact O-N 3.15Å; S882-F885 PolarHBondContact O-N 3.35Å; S882-F885 VanDerWaalsContact OG-CB 3.26Å; S882-F885 WeakPolarHBondContact OG-CB 3.33Å; S882-F885 PolarHBondContact OG-N 2.98Å; S882-A886 PolarHBondContact O-N 3.07Å; S882-A886 VanDerWaalsContact O-N 3.08Å
883	Q	89.4	Confident	89.4	Confident	30 Å²	30	22.4 Å²	22.4	14%	0.14	11%	0.108	C	C	.	.	H	α-helix	trans	-63.7	-33.5	172.3	-168.8	61.4	35.6	0	0	111	Y484 E699 Q729 A886 G887	Y484-Q883 HydrophobicContact CE2-CG 4.27Å; Y484-Q883 VanDerWaalsContact CE2-NE2 3.35Å; E699-Q883 VanDerWaalsContact CD-N 3.26Å; E699-Q883 PolarHBondContact OE1-N 3.37Å; E699-Q883 PolarHBondContact OE2-N 3.39Å; Q729-Q883 HydrophobicContact CB-CB 4.12Å; Q729-Q883 HydrophobicContact CB-CG 3.83Å; Q729-Q883 HydrophobicContact CG-CB 4.29Å; Q729-Q883 HydrophobicContact CG-CG 4.01Å; Q883-A886 PolarHBondContact O-N 2.86Å; Q883-G887 PolarHBondContact O-N 3.37Å
884	M	91.2	Very high	89	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-53.7	-50.9	169.5	-74.6	-164	-65.3	0	0	112.5	L696 E699 L723 F726 S727 W728 Q729 F879 S882 G887 F888	L696-M884 WeakPolarHBondContact O-CE 3.38Å; E699-M884 HydrophobicContact CG-CE 4.08Å; E699-M884 WeakPolarHBondContact OE1-CG 3.34Å; E699-M884 PolarHBondContact OE1-N 3.46Å; L723-M884 HydrophobicContact CD1-SD 3.96Å; L723-M884 HydrophobicContact CD2-CE 4.36Å; L723-M884 HydrophobicContact CD2-SD 4.47Å; F726-M884 HydrophobicContact CB-CB 4.18Å; F726-M884 HydrophobicContact CB-CG 4.42Å; F726-M884 HydrophobicContact CB-SD 3.99Å; F726-M884 HydrophobicContact CD1-CB 4.07Å; F726-M884 WeakPolarHBondContact CD1-O 3.37Å; F726-M884 HydrophobicContact CG-CB 4.34Å; S727-M884 WeakPolarHBondContact O-CG 3.26Å; W728-M884 HydrophobicContact CE3-CE 4.4Å; W728-M884 HydrophobicContact CE3-SD 4.17Å; Q729-M884 HydrophobicContact CG-CG 4.06Å; F879-M884 HydrophobicContact CE2-CE 4.48Å; S882-M884 PolarHBondContact O-N 3.15Å; M884-G887 PolarHBondContact O-N 2.91Å; M884-F888 PolarHBondContact O-N 2.8Å
885	F	93.1	Very high	88.4	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.009	12%	0.115	C	C	.	.	H	α-helix	trans	-67.7	-43.2	-179.4	-173.2	-89.2	0	0	0	112.3	F726 M841 F858 F863 F879 M880 S882 G887 F888 I889	F726-F885 HydrophobicContact CE1-CB 4.4Å; F726-F885 HydrophobicContact CE1-CD2 4.15Å; F726-F885 HydrophobicContact CZ-CD2 4.09Å; M841-F885 HydrophobicContact CE-CE2 4.23Å; F858-F885 AromaticContact CE1-CE1 3.79Å; F858-F885 HydrophobicContact CE1-CE1 3.79Å; F858-F885 AromaticContact CE1-CZ 3.81Å; F858-F885 HydrophobicContact CE1-CZ 3.81Å; F858-F885 HydrophobicContact CZ-CE1 4.39Å; F858-F885 AromaticContact CZ-CZ 3.93Å; F858-F885 HydrophobicContact CZ-CZ 3.93Å; F863-F885 HydrophobicContact CE1-CZ 4.21Å; F879-F885 HydrophobicContact CD1-CD2 4.23Å; F879-F885 AromaticContact CE1-CD2 3.9Å; F879-F885 HydrophobicContact CE1-CD2 3.9Å; M880-F885 HydrophobicContact CB-CD1 3.83Å; M880-F885 HydrophobicContact CB-CE1 3.92Å; M880-F885 HydrophobicContact CB-CG 4.27Å; M880-F885 HydrophobicContact CB-CZ 4.42Å; M880-F885 HydrophobicContact CE-CE1 4.16Å; M880-F885 HydrophobicContact CE-CZ 4.31Å; M880-F885 HydrophobicContact CG-CD1 4Å; M880-F885 HydrophobicContact CG-CD2 4.22Å; M880-F885 HydrophobicContact CG-CE1 3.74Å; M880-F885 HydrophobicContact CG-CE2 3.97Å; M880-F885 HydrophobicContact CG-CG 4.24Å; M880-F885 HydrophobicContact CG-CZ 3.73Å; M880-F885 HydrophobicContact SD-CZ 4.48Å; S882-F885 PolarHBondContact O-N 3.35Å; S882-F885 VanDerWaalsContact OG-CB 3.26Å; S882-F885 WeakPolarHBondContact OG-CB 3.33Å; S882-F885 PolarHBondContact OG-N 2.98Å; F885-G887 VanDerWaalsContact C-N 3.31Å; F885-G887 PolarHBondContact O-N 2.92Å; F885-F888 PolarHBondContact O-N 2.71Å; F885-I889 HydrophobicContact CD1-CG1 4.08Å; F885-I889 HydrophobicContact CE1-CD1 4.25Å; F885-I889 HydrophobicContact CE1-CG1 3.56Å; F885-I889 HydrophobicContact CE2-CG1 4.42Å; F885-I889 HydrophobicContact CZ-CD1 3.95Å; F885-I889 HydrophobicContact CZ-CG1 3.75Å; F885-I889 WeakPolarHBondContact O-CG1 3.38Å; F885-I889 PolarHBondContact O-N 3.27Å; F885-I889 VanDerWaalsContact O-N 3.16Å
886	A	89.9	Confident	87.3	Confident	34 Å²	34	31.2 Å²	31.2	28%	0.281	15%	0.154	S	C	.	.	H	α-helix	trans	-56.8	-46.1	175.2	0	0	0	0	0	111.6	S882 Q883 I889 Q890	S882-A886 PolarHBondContact O-N 3.07Å; S882-A886 VanDerWaalsContact O-N 3.08Å; Q883-A886 PolarHBondContact O-N 2.86Å; A886-I889 PolarHBondContact O-N 3.38Å; A886-Q890 WeakPolarHBondContact O-CB 3.42Å; A886-Q890 PolarHBondContact O-N 2.89Å
887	G	87	Confident	85.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-50.2	177.8	0	0	0	0	0	114.5	Y484 Q883 M884 F885 I889 Q890 D891	Y484-G887 WeakPolarHBondContact OH-CA 3.46Å; Q883-G887 PolarHBondContact O-N 3.37Å; M884-G887 PolarHBondContact O-N 2.91Å; F885-G887 VanDerWaalsContact C-N 3.31Å; F885-G887 PolarHBondContact O-N 2.92Å; G887-I889 VanDerWaalsContact C-N 3.3Å; G887-I889 PolarHBondContact O-N 3.48Å; G887-Q890 PolarHBondContact O-N 2.94Å; G887-D891 PolarHBondContact O-N 2.96Å
888	F	90.9	Very high	84.3	Confident	6 Å²	6	47 Å²	47	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-55.8	-46.3	178.2	171	-90.8	0	0	0	111.6	P725 F726 M841 Y844 M884 F885 R892 F903	P725-F888 HydrophobicContact CB-CD2 4.19Å; P725-F888 HydrophobicContact CB-CE2 3.84Å; P725-F888 HydrophobicContact CG-CD2 4.23Å; P725-F888 HydrophobicContact CG-CE2 3.88Å; F726-F888 HydrophobicContact CD1-CB 3.65Å; F726-F888 HydrophobicContact CD1-CG 4.19Å; F726-F888 HydrophobicContact CE1-CB 3.41Å; F726-F888 VanDerWaalsContact CE1-CB 3.41Å; F726-F888 HydrophobicContact CE1-CD1 4.17Å; F726-F888 HydrophobicContact CE1-CD2 4.26Å; F726-F888 AromaticContact CE1-CG 3.69Å; F726-F888 HydrophobicContact CE1-CG 3.69Å; F726-F888 HydrophobicContact CZ-CG 4.39Å; M841-F888 HydrophobicContact CE-CD1 3.85Å; M841-F888 HydrophobicContact CE-CE1 3.39Å; M841-F888 HydrophobicContact CE-CZ 3.88Å; Y844-F888 HydrophobicContact CD1-CE1 4.18Å; Y844-F888 HydrophobicContact CD1-CZ 4.27Å; Y844-F888 AromaticContact CD2-CE1 3.9Å; Y844-F888 HydrophobicContact CD2-CE1 3.9Å; Y844-F888 HydrophobicContact CD2-CZ 4.48Å; Y844-F888 HydrophobicContact CE1-CE1 4.11Å; Y844-F888 AromaticContact CE1-CZ 3.81Å; Y844-F888 HydrophobicContact CE1-CZ 3.81Å; Y844-F888 AromaticContact CE2-CE1 3.85Å; Y844-F888 HydrophobicContact CE2-CE1 3.85Å; Y844-F888 HydrophobicContact CE2-CZ 4.06Å; Y844-F888 HydrophobicContact CG-CE1 4.08Å; Y844-F888 AromaticContact CZ-CE1 3.95Å; Y844-F888 AromaticContact CZ-CZ 3.7Å; M884-F888 PolarHBondContact O-N 2.8Å; F885-F888 PolarHBondContact O-N 2.71Å; F888-R892 HydrophobicContact CE1-CG 4.24Å; F888-R892 HydrophobicContact CZ-CG 4.22Å; F888-R892 WeakPolarHBondContact O-CG 3.45Å; F888-R892 PolarHBondContact O-N 2.71Å; F888-F903 HydrophobicContact CE2-CD1 4.17Å; F888-F903 HydrophobicContact CE2-CE1 4.27Å; F888-F903 HydrophobicContact CZ-CD1 4.12Å; F888-F903 AromaticContact CZ-CE1 3.89Å; F888-F903 HydrophobicContact CZ-CE1 3.89Å
889	I	91.9	Very high	83.3	Confident	9 Å²	9	50 Å²	50	5%	0.046	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-47.4	178.8	-67.8	-61.5	0	0	0	111.1	Y844 F858 F885 A886 G887 D891 R892 E893	Y844-I889 HydrophobicContact CD2-CD1 4.12Å; F858-I889 HydrophobicContact CB-CG2 3.47Å; F858-I889 VanDerWaalsContact CB-CG2 3.47Å; F858-I889 HydrophobicContact CD1-CD1 4.04Å; F858-I889 HydrophobicContact CD1-CG1 4.08Å; F858-I889 HydrophobicContact CD1-CG2 3.83Å; F858-I889 HydrophobicContact CD2-CD1 3.93Å; F858-I889 HydrophobicContact CD2-CG2 4.5Å; F858-I889 HydrophobicContact CE1-CD1 3.95Å; F858-I889 HydrophobicContact CE1-CG1 4.14Å; F858-I889 HydrophobicContact CE2-CD1 3.84Å; F858-I889 HydrophobicContact CG-CD1 4.01Å; F858-I889 HydrophobicContact CG-CG1 4.4Å; F858-I889 HydrophobicContact CG-CG2 3.7Å; F858-I889 HydrophobicContact CZ-CD1 3.84Å; F885-I889 HydrophobicContact CD1-CG1 4.08Å; F885-I889 HydrophobicContact CE1-CD1 4.25Å; F885-I889 HydrophobicContact CE1-CG1 3.56Å; F885-I889 HydrophobicContact CE2-CG1 4.42Å; F885-I889 HydrophobicContact CZ-CD1 3.95Å; F885-I889 HydrophobicContact CZ-CG1 3.75Å; F885-I889 WeakPolarHBondContact O-CG1 3.38Å; F885-I889 PolarHBondContact O-N 3.27Å; F885-I889 VanDerWaalsContact O-N 3.16Å; A886-I889 PolarHBondContact O-N 3.38Å; G887-I889 VanDerWaalsContact C-N 3.3Å; G887-I889 PolarHBondContact O-N 3.48Å; I889-D891 VanDerWaalsContact C-N 3.28Å; I889-D891 PolarHBondContact O-N 2.64Å; I889-R892 CarbonylContact O-C 3.49Å; I889-R892 WeakPolarHBondContact O-CA 3.16Å; I889-R892 PolarHBondContact O-N 2.7Å; I889-E893 HydrophobicContact CG2-CG 4.16Å; I889-E893 WeakPolarHBondContact O-CG 3.5Å; I889-E893 PolarHBondContact O-N 2.74Å
890	Q	87.3	Confident	82.4	Confident	75 Å²	75	55 Å²	55	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-56.9	-40.7	179.8	-173.1	177.6	9.8	0	0	112	Y484 A886 G887 R892 E893 L894	Y484-Q890 VanDerWaalsContact CD1-OE1 3.23Å; A886-Q890 WeakPolarHBondContact O-CB 3.42Å; A886-Q890 PolarHBondContact O-N 2.89Å; G887-Q890 PolarHBondContact O-N 2.94Å; Q890-R892 VanDerWaalsContact C-N 3.32Å; Q890-R892 PolarHBondContact O-N 3.16Å; Q890-E893 PolarHBondContact O-N 2.76Å; Q890-L894 HydrophobicContact CG-CD1 3.92Å; Q890-L894 HydrophobicContact CG-CG 4.46Å; Q890-L894 WeakPolarHBondContact O-CB 3.29Å; Q890-L894 VanDerWaalsContact O-CG 3.3Å; Q890-L894 WeakPolarHBondContact O-CG 3.35Å; Q890-L894 PolarHBondContact O-N 3.03Å
891	D	83.9	Confident	81.9	Confident	11 Å²	11	56.4 Å²	56.4	6%	0.059	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-42.8	172.9	-76.9	-15.4	0	0	0	112.2	T486 G887 I889 L894 R895	T486-D891 WeakPolarHBondContact CB-OD1 3.22Å; T486-D891 WeakPolarHBondContact CB-OD2 3.18Å; T486-D891 VanDerWaalsContact CG2-OD1 3.25Å; T486-D891 WeakPolarHBondContact CG2-OD1 3.29Å; T486-D891 WeakPolarHBondContact CG2-OD2 3.37Å; T486-D891 VanDerWaalsContact OG1-CG 3.26Å; T486-D891 PolarHBondContact OG1-OD1 2.93Å; T486-D891 PolarHBondContact OG1-OD2 3.4Å; G887-D891 PolarHBondContact O-N 2.96Å; I889-D891 VanDerWaalsContact C-N 3.28Å; I889-D891 PolarHBondContact O-N 2.64Å; D891-L894 PolarHBondContact O-N 3.36Å; D891-R895 WeakPolarHBondContact O-CB 3.44Å; D891-R895 PolarHBondContact O-N 3.45Å
892	R	86.9	Confident	81.8	Confident	12 Å²	12	56 Å²	56	5%	0.045	28%	0.281	C	S	.	.	H	α-helix	trans	-74.5	-30.3	-178	-54.8	-33.3	-177.2	-115	27.6	111.7	E488 Y844 I848 F888 I889 Q890 E904	E488-R892 IonicContact OE1-NH2 3.83Å; E488-R892 IonicContact OE2-CZ 3.4Å; E488-R892 IonicContact OE2-NH1 3.01Å; E488-R892 PolarHBondContact OE2-NH1 2.91Å; E488-R892 VanDerWaalsContact OE2-NH1 3.17Å; E488-R892 IonicContact OE2-NH2 2.7Å; E488-R892 PolarHBondContact OE2-NH2 3.43Å; Y844-R892 HydrophobicContact CE2-CB 4.19Å; Y844-R892 HydrophobicContact CE2-CG 3.81Å; I848-R892 HydrophobicContact CD1-CB 3.73Å; F888-R892 HydrophobicContact CE1-CG 4.24Å; F888-R892 HydrophobicContact CZ-CG 4.22Å; F888-R892 WeakPolarHBondContact O-CG 3.45Å; F888-R892 PolarHBondContact O-N 2.71Å; I889-R892 CarbonylContact O-C 3.49Å; I889-R892 WeakPolarHBondContact O-CA 3.16Å; I889-R892 PolarHBondContact O-N 2.7Å; Q890-R892 VanDerWaalsContact C-N 3.32Å; Q890-R892 PolarHBondContact O-N 3.16Å; R892-E904 IonicContact CZ-OE1 2.84Å; R892-E904 VanDerWaalsContact CZ-OE1 3.25Å; R892-E904 IonicContact NE-OE1 2.79Å; R892-E904 PolarHBondContact NE-OE1 3.17Å; R892-E904 IonicContact NH2-OE1 3.18Å; R892-E904 PolarHBondContact NH2-OE1 2.81Å
893	E	86.9	Confident	81.8	Confident	52 Å²	52	56 Å²	56	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-68.1	-36.8	170.9	-70.2	175.6	143.8	0	0	112.3	R856 V857 F858 I889 Q890	R856-E893 VanDerWaalsContact CZ-O 3.23Å; R856-E893 PolarHBondContact NE-O 3.26Å; R856-E893 PolarHBondContact NH2-O 3.32Å; V857-E893 WeakPolarHBondContact CA-OE1 3.4Å; F858-E893 WeakPolarHBondContact CB-OE1 3.48Å; F858-E893 PolarHBondContact N-OE1 3.36Å; I889-E893 HydrophobicContact CG2-CG 4.16Å; I889-E893 WeakPolarHBondContact O-CG 3.5Å; I889-E893 PolarHBondContact O-N 2.74Å; Q890-E893 PolarHBondContact O-N 2.76Å
894	L	83	Confident	81.8	Confident	109 Å²	109	55 Å²	55	57%	0.571	28%	0.277	S	S	*	.	H	α-helix	trans	-88.8	-28.5	-178.1	-66.8	175.7	0	0	0	115	R856 Q890 D891 K896	R856-L894 PolarHBondContact NH2-O 3.36Å; Q890-L894 HydrophobicContact CG-CD1 3.92Å; Q890-L894 HydrophobicContact CG-CG 4.46Å; Q890-L894 WeakPolarHBondContact O-CB 3.29Å; Q890-L894 VanDerWaalsContact O-CG 3.3Å; Q890-L894 WeakPolarHBondContact O-CG 3.35Å; Q890-L894 PolarHBondContact O-N 3.03Å; D891-L894 PolarHBondContact O-N 3.36Å; L894-K896 PolarHBondContact O-N 3.27Å
895	R	76.7	Confident	81.7	Confident	52 Å²	52	58.2 Å²	58.2	20%	0.196	29%	0.291	C	S	.	.			trans	-55.9	104.2	-173.5	178.4	179.3	-65.2	172.1	-2.3	114.1	E488 R856 D891 T897 E904	E488-R895 IonicContact OE2-NH2 2.84Å; E488-R895 PolarHBondContact OE2-NH2 3.36Å; E488-R895 VanDerWaalsContact OE2-NH2 3.15Å; R856-R895 VanDerWaalsContact CZ-O 3.29Å; R856-R895 PolarHBondContact NH1-O 3.23Å; R856-R895 VanDerWaalsContact NH2-C 3.27Å; R856-R895 PolarHBondContact NH2-O 3.37Å; D891-R895 WeakPolarHBondContact O-CB 3.44Å; D891-R895 PolarHBondContact O-N 3.45Å; R895-T897 WeakPolarHBondContact CG-O 3.42Å; R895-E904 IonicContact CZ-OE1 2.97Å; R895-E904 IonicContact NH1-OE1 3.35Å; R895-E904 PolarHBondContact NH1-OE1 2.97Å; R895-E904 IonicContact NH2-OE1 2.72Å
896	K	66.8	Low	81.6	Confident	200 Å²	200	58.3 Å²	58.3	87%	0.87	29%	0.292	S	S	*	.			trans	-74.9	-29.6	177.7	-62.8	179.5	-177.8	175.9	0	113	L894	L894-K896 PolarHBondContact O-N 3.27Å
897	T	62.4	Low	81.8	Confident	104 Å²	104	56.9 Å²	56.9	64%	0.638	28%	0.279	S	S	*	.	S	Bend	trans	-87.2	142.1	-170.7	-46.7	0	0	0	0	112.6	R895 A899	R895-T897 WeakPolarHBondContact CG-O 3.42Å; T897-A899 VanDerWaalsContact C-N 3.26Å; T897-A899 HydrophobicContact CG2-CB 4.26Å; T897-A899 PolarHBondContact O-N 3.12Å
898	R	56.1	Low	81.9	Confident	244 Å²	244	59.8 Å²	59.8	92%	0.921	30%	0.295	S	S	*	.			trans	-75.9	1.8	179.3	-74.2	-173.4	175.9	-178.2	-0.2	115.6	K900	R898-K900 PolarHBondContact O-N 3.33Å
899	A	64.8	Low	81.9	Confident	70 Å²	70	61 Å²	61	58%	0.579	30%	0.301	S	S	*	.			trans	-63.4	121.4	179.8	0	0	0	0	0	110.6	T897	T897-A899 VanDerWaalsContact C-N 3.26Å; T897-A899 HydrophobicContact CG2-CB 4.26Å; T897-A899 PolarHBondContact O-N 3.12Å
900	K	72.6	Confident	81.8	Confident	105 Å²	105	60.7 Å²	60.7	46%	0.457	30%	0.299	S	S	.	.			trans	-101.5	119.1	178.1	-71.9	-166.8	-179.9	-172	0	109.9	R898 E904 Q905 D908	R898-K900 PolarHBondContact O-N 3.33Å; K900-E904 HydrophobicContact CB-CB 3.79Å; K900-E904 HydrophobicContact CD-CB 4.11Å; K900-E904 HydrophobicContact CG-CB 3.93Å; K900-Q905 HydrophobicContact CB-CG 4.19Å; K900-Q905 PolarHBondContact O-NE2 3.27Å; K900-D908 WeakPolarHBondContact CD-OD2 3.44Å; K900-D908 IonicContact NZ-OD1 2.9Å; K900-D908 PolarHBondContact NZ-OD1 3.43Å; K900-D908 IonicContact NZ-OD2 3Å; K900-D908 PolarHBondContact NZ-OD2 3.31Å
901	G	81.1	Confident	82	Confident	31 Å²	31	58.5 Å²	58.5	32%	0.32	29%	0.29	S	S	.	.			trans	-68.9	177.9	169.6	0	0	0	0	0	111.4	F903 E904 Q905	G901-F903 VanDerWaalsContact C-N 3.32Å; G901-F903 PolarHBondContact O-N 3.41Å; G901-E904 VanDerWaalsContact CA-OE2 3.3Å; G901-E904 WeakPolarHBondContact CA-OE2 3.39Å; G901-E904 PolarHBondContact N-OE2 3.26Å; G901-E904 VanDerWaalsContact N-OE2 3.1Å; G901-E904 PolarHBondContact O-N 2.88Å; G901-Q905 WeakPolarHBondContact O-CG 3.41Å; G901-Q905 PolarHBondContact O-N 3.27Å; G901-Q905 VanDerWaalsContact O-N 3.08Å
902	L	86	Confident	82.1	Confident	28 Å²	28	63 Å²	63	15%	0.147	31%	0.31	C	S	.	.	H	α-helix	trans	-57.3	-45.9	-178	-175.1	65.8	0	0	0	111.4	I834 E904 Q905 R906	I834-L902 HydrophobicContact CD1-CD2 3.92Å; L902-E904 PolarHBondContact O-N 3.3Å; L902-Q905 WeakPolarHBondContact O-CB 3.47Å; L902-Q905 PolarHBondContact O-N 2.98Å; L902-Q905 VanDerWaalsContact O-N 3.13Å; L902-R906 HydrophobicContact CD1-CG 4.48Å; L902-R906 HydrophobicContact CG-CG 4.46Å; L902-R906 WeakPolarHBondContact O-CG 3.08Å; L902-R906 PolarHBondContact O-N 3.35Å
903	F	90.4	Very high	81.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.2	-45.2	178.6	-171.4	-106.4	0	0	0	112.4	Y724 P725 I834 F837 L838 Y844 F888 G901 Q905 R906 V907	Y724-F903 HydrophobicContact CE1-CB 3.88Å; Y724-F903 WeakPolarHBondContact OH-CB 3.38Å; Y724-F903 PolarHBondContact OH-N 3.1Å; Y724-F903 VanDerWaalsContact OH-N 3.07Å; P725-F903 HydrophobicContact CB-CB 3.92Å; P725-F903 HydrophobicContact CB-CD1 3.88Å; P725-F903 HydrophobicContact CB-CD2 4.05Å; P725-F903 HydrophobicContact CB-CE1 4.41Å; P725-F903 HydrophobicContact CB-CG 3.67Å; P725-F903 HydrophobicContact CG-CD1 3.82Å; P725-F903 HydrophobicContact CG-CD2 3.82Å; P725-F903 HydrophobicContact CG-CE1 3.85Å; P725-F903 HydrophobicContact CG-CE2 3.87Å; P725-F903 HydrophobicContact CG-CG 3.8Å; P725-F903 HydrophobicContact CG-CZ 3.88Å; I834-F903 HydrophobicContact CG2-CD2 4.42Å; F837-F903 HydrophobicContact CB-CE2 3.78Å; F837-F903 HydrophobicContact CB-CZ 4.15Å; L838-F903 HydrophobicContact CD2-CD2 4.45Å; L838-F903 HydrophobicContact CD2-CE2 3.89Å; L838-F903 HydrophobicContact CD2-CZ 4.23Å; L838-F903 HydrophobicContact CG-CE2 4.26Å; Y844-F903 HydrophobicContact CD1-CE1 4.43Å; Y844-F903 AromaticContact CE1-CE1 3.93Å; Y844-F903 HydrophobicContact CE1-CE1 3.93Å; F888-F903 HydrophobicContact CE2-CD1 4.17Å; F888-F903 HydrophobicContact CE2-CE1 4.27Å; F888-F903 HydrophobicContact CZ-CD1 4.12Å; F888-F903 AromaticContact CZ-CE1 3.89Å; F888-F903 HydrophobicContact CZ-CE1 3.89Å; G901-F903 VanDerWaalsContact C-N 3.32Å; G901-F903 PolarHBondContact O-N 3.41Å; F903-Q905 VanDerWaalsContact C-N 3.31Å; F903-Q905 PolarHBondContact O-N 2.69Å; F903-R906 CarbonylContact O-C 3.57Å; F903-R906 PolarHBondContact O-N 3.06Å; F903-R906 VanDerWaalsContact O-N 3.15Å; F903-V907 HydrophobicContact CD1-CG2 3.9Å; F903-V907 HydrophobicContact CE1-CG2 3.59Å; F903-V907 HydrophobicContact CE2-CG2 4.48Å; F903-V907 HydrophobicContact CG-CG2 4.47Å; F903-V907 HydrophobicContact CZ-CG2 3.91Å; F903-V907 WeakPolarHBondContact O-CB 3.39Å; F903-V907 VanDerWaalsContact O-CG2 3.3Å; F903-V907 WeakPolarHBondContact O-CG2 3.41Å; F903-V907 PolarHBondContact O-N 3.47Å
904	E	89.4	Confident	81.6	Confident	11 Å²	11	63 Å²	63	5%	0.051	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-34.2	176.9	-68.4	82.2	178.5	0	0	112.9	R892 R895 K900 G901 L902 V907 D908	R892-E904 IonicContact CZ-OE1 2.84Å; R892-E904 VanDerWaalsContact CZ-OE1 3.25Å; R892-E904 IonicContact NE-OE1 2.79Å; R892-E904 PolarHBondContact NE-OE1 3.17Å; R892-E904 IonicContact NH2-OE1 3.18Å; R892-E904 PolarHBondContact NH2-OE1 2.81Å; R895-E904 IonicContact CZ-OE1 2.97Å; R895-E904 IonicContact NH1-OE1 3.35Å; R895-E904 PolarHBondContact NH1-OE1 2.97Å; R895-E904 IonicContact NH2-OE1 2.72Å; K900-E904 HydrophobicContact CB-CB 3.79Å; K900-E904 HydrophobicContact CD-CB 4.11Å; K900-E904 HydrophobicContact CG-CB 3.93Å; G901-E904 VanDerWaalsContact CA-OE2 3.3Å; G901-E904 WeakPolarHBondContact CA-OE2 3.39Å; G901-E904 PolarHBondContact N-OE2 3.26Å; G901-E904 VanDerWaalsContact N-OE2 3.1Å; G901-E904 PolarHBondContact O-N 2.88Å; L902-E904 PolarHBondContact O-N 3.3Å; E904-V907 PolarHBondContact O-N 3Å; E904-D908 PolarHBondContact O-N 3.05Å
905	Q	88.9	Confident	81.1	Confident	67 Å²	67	60.3 Å²	60.3	31%	0.313	30%	0.3	S	S	.	.	H	α-helix	trans	-67.6	-36.4	173.8	-64.2	167.5	33.3	0	0	111.9	K900 G901 L902 F903 Q909	K900-Q905 HydrophobicContact CB-CG 4.19Å; K900-Q905 PolarHBondContact O-NE2 3.27Å; G901-Q905 WeakPolarHBondContact O-CG 3.41Å; G901-Q905 PolarHBondContact O-N 3.27Å; G901-Q905 VanDerWaalsContact O-N 3.08Å; L902-Q905 WeakPolarHBondContact O-CB 3.47Å; L902-Q905 PolarHBondContact O-N 2.98Å; L902-Q905 VanDerWaalsContact O-N 3.13Å; F903-Q905 VanDerWaalsContact C-N 3.31Å; F903-Q905 PolarHBondContact O-N 2.69Å; Q905-Q909 WeakPolarHBondContact O-CG 3.2Å; Q905-Q909 PolarHBondContact O-N 2.87Å
906	R	91.3	Very high	80.4	Confident	5 Å²	5	62.8 Å²	62.8	2%	0.019	32%	0.317	C	S	.	.	H	α-helix	trans	-78.9	-24.8	175.9	-55.3	-48.6	-178	69.7	5.4	113.2	E831 I834 L838 L902 F903 Y910	E831-R906 IonicContact OE1-CZ 3.18Å; E831-R906 IonicContact OE1-NH1 2.89Å; E831-R906 PolarHBondContact OE1-NH1 3.28Å; E831-R906 IonicContact OE1-NH2 3.1Å; E831-R906 PolarHBondContact OE1-NH2 3.48Å; E831-R906 IonicContact OE2-CZ 3Å; E831-R906 IonicContact OE2-NH1 2.6Å; E831-R906 PolarHBondContact OE2-NH1 3.09Å; E831-R906 IonicContact OE2-NH2 2.73Å; I834-R906 HydrophobicContact CG2-CB 4.35Å; I834-R906 HydrophobicContact CG2-CG 4.39Å; L838-R906 HydrophobicContact CD1-CB 3.85Å; L838-R906 HydrophobicContact CD2-CB 4.21Å; L902-R906 HydrophobicContact CD1-CG 4.48Å; L902-R906 HydrophobicContact CG-CG 4.46Å; L902-R906 WeakPolarHBondContact O-CG 3.08Å; L902-R906 PolarHBondContact O-N 3.35Å; F903-R906 CarbonylContact O-C 3.57Å; F903-R906 PolarHBondContact O-N 3.06Å; F903-R906 VanDerWaalsContact O-N 3.15Å; R906-Y910 VanDerWaalsContact O-CB 3.27Å; R906-Y910 WeakPolarHBondContact O-CB 3.41Å; R906-Y910 PolarHBondContact O-N 2.87Å
907	V	92.8	Very high	79.9	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-46.4	167.8	160	0	0	0	0	110.8	L838 G842 Y844 F903 E904 Q909 Y910 L911	L838-V907 HydrophobicContact CD2-CB 4.41Å; L838-V907 HydrophobicContact CD2-CG2 3.63Å; G842-V907 WeakPolarHBondContact O-CG1 3.21Å; Y844-V907 HydrophobicContact CE1-CG1 4.4Å; Y844-V907 HydrophobicContact CE1-CG2 4.09Å; F903-V907 HydrophobicContact CD1-CG2 3.9Å; F903-V907 HydrophobicContact CE1-CG2 3.59Å; F903-V907 HydrophobicContact CE2-CG2 4.48Å; F903-V907 HydrophobicContact CG-CG2 4.47Å; F903-V907 HydrophobicContact CZ-CG2 3.91Å; F903-V907 WeakPolarHBondContact O-CB 3.39Å; F903-V907 VanDerWaalsContact O-CG2 3.3Å; F903-V907 WeakPolarHBondContact O-CG2 3.41Å; F903-V907 PolarHBondContact O-N 3.47Å; E904-V907 PolarHBondContact O-N 3Å; V907-Q909 VanDerWaalsContact C-N 3.31Å; V907-Q909 PolarHBondContact O-N 2.83Å; V907-Y910 PolarHBondContact O-N 3.44Å; V907-L911 HydrophobicContact CG1-CD1 3.96Å; V907-L911 WeakPolarHBondContact O-CB 3.42Å; V907-L911 VanDerWaalsContact O-CG 3.28Å; V907-L911 WeakPolarHBondContact O-CG 3.15Å; V907-L911 PolarHBondContact O-N 2.94Å
908	D	90.8	Very high	78.9	Confident	62 Å²	62	57.3 Å²	57.3	33%	0.332	29%	0.292	S	S	.	.	H	α-helix	trans	-55.1	-48.8	173.1	-70.9	-12.2	0	0	0	110.9	K900 E904 L911 E912	K900-D908 WeakPolarHBondContact CD-OD2 3.44Å; K900-D908 IonicContact NZ-OD1 2.9Å; K900-D908 PolarHBondContact NZ-OD1 3.43Å; K900-D908 IonicContact NZ-OD2 3Å; K900-D908 PolarHBondContact NZ-OD2 3.31Å; E904-D908 PolarHBondContact O-N 3.05Å; D908-L911 PolarHBondContact O-N 3.43Å; D908-E912 PolarHBondContact O-N 3.32Å
909	Q	90.1	Very high	78.2	Confident	30 Å²	30	51.6 Å²	51.6	14%	0.14	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-45.4	178.3	-68.5	167.4	11.9	0	0	112.6	I416 Q905 V907 L911 E912 E913	I416-Q909 HydrophobicContact CD1-CB 4.43Å; I416-Q909 HydrophobicContact CD1-CG 4.39Å; Q905-Q909 WeakPolarHBondContact O-CG 3.2Å; Q905-Q909 PolarHBondContact O-N 2.87Å; V907-Q909 VanDerWaalsContact C-N 3.31Å; V907-Q909 PolarHBondContact O-N 2.83Å; Q909-L911 VanDerWaalsContact C-N 3.27Å; Q909-L911 PolarHBondContact O-N 3.27Å; Q909-E912 CarbonylContact O-C 3.58Å; Q909-E912 PolarHBondContact O-N 3.23Å; Q909-E913 WeakPolarHBondContact O-CG 3.38Å; Q909-E913 PolarHBondContact O-N 3.32Å
910	Y	90.7	Very high	77.1	Confident	3 Å²	3	52.5 Å²	52.5	1%	0.012	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-32.5	177.8	177.4	-104.6	0	0	0	112.4	R431 L838 R906 V907 E913 L914	R431-Y910 PolarHBondContact NH1-OH 3.39Å; R431-Y910 VanDerWaalsContact NH1-OH 3.08Å; L838-Y910 HydrophobicContact CB-CD1 4.49Å; L838-Y910 HydrophobicContact CB-CD2 4.14Å; L838-Y910 HydrophobicContact CB-CG 4.11Å; L838-Y910 WeakPolarHBondContact O-CE1 3.3Å; L838-Y910 VanDerWaalsContact O-CZ 3.27Å; L838-Y910 PolarHBondContact O-OH 3.12Å; R906-Y910 VanDerWaalsContact O-CB 3.27Å; R906-Y910 WeakPolarHBondContact O-CB 3.41Å; R906-Y910 PolarHBondContact O-N 2.87Å; V907-Y910 PolarHBondContact O-N 3.44Å; Y910-E913 WeakPolarHBondContact O-CB 3.49Å; Y910-E913 PolarHBondContact O-N 2.95Å; Y910-L914 HydrophobicContact CE1-CD2 4.07Å; Y910-L914 HydrophobicContact CE2-CD2 4.35Å; Y910-L914 WeakPolarHBondContact O-CG 3.34Å; Y910-L914 PolarHBondContact O-N 3.21Å
911	L	89.5	Confident	75.7	Confident	30 Å²	30	49.8 Å²	49.8	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-75.8	-36	174.2	-69.6	174.1	0	0	0	112.8	L846 V907 D908 Q909 E913 L914	L846-L911 HydrophobicContact CD1-CD2 4.06Å; L846-L911 HydrophobicContact CD2-CD1 4.4Å; L846-L911 HydrophobicContact CG-CD2 4.43Å; V907-L911 HydrophobicContact CG1-CD1 3.96Å; V907-L911 WeakPolarHBondContact O-CB 3.42Å; V907-L911 VanDerWaalsContact O-CG 3.28Å; V907-L911 WeakPolarHBondContact O-CG 3.15Å; V907-L911 PolarHBondContact O-N 2.94Å; D908-L911 PolarHBondContact O-N 3.43Å; Q909-L911 VanDerWaalsContact C-N 3.27Å; Q909-L911 PolarHBondContact O-N 3.27Å; L911-E913 VanDerWaalsContact C-N 3.31Å; L911-L914 HydrophobicContact CD2-CD1 3.89Å; L911-L914 PolarHBondContact O-N 2.91Å
912	E	87.5	Confident	74.1	Confident	104 Å²	104	52.6 Å²	52.6	49%	0.486	29%	0.29	S	S	.	.	H	α-helix	trans	-65	-32.6	167.5	-72.5	-174.8	176.2	0	0	111.1	R411 H413 D908 Q909 L914	R411-E912 IonicContact CZ-OE1 2.76Å; R411-E912 IonicContact NH1-OE1 2.84Å; R411-E912 PolarHBondContact NH1-OE1 3.21Å; R411-E912 IonicContact NH1-OE2 2.66Å; R411-E912 IonicContact NH2-OE1 2.77Å; R411-E912 PolarHBondContact NH2-OE1 3.05Å; H413-E912 IonicContact CE1-OE2 3.41Å; D908-E912 PolarHBondContact O-N 3.32Å; Q909-E912 CarbonylContact O-C 3.58Å; Q909-E912 PolarHBondContact O-N 3.23Å; E912-L914 PolarHBondContact O-N 3.14Å
913	E	82.8	Confident	72.1	Confident	58 Å²	58	54.6 Å²	54.6	27%	0.271	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.9	174.3	-78.4	-174.5	179	0	0	114.4	N424 R435 R835 Q909 Y910 L911	N424-E913 PolarHBondContact ND2-OE1 2.78Å; R435-E913 VanDerWaalsContact CZ-O 3.24Å; R435-E913 PolarHBondContact NH1-O 2.83Å; R435-E913 PolarHBondContact NH2-O 2.69Å; R435-E913 IonicContact NH2-OE2 3.75Å; R835-E913 IonicContact CZ-OE2 2.73Å; R835-E913 IonicContact NH1-OE1 2.68Å; R835-E913 PolarHBondContact NH1-OE1 2.73Å; R835-E913 IonicContact NH1-OE2 2.69Å; R835-E913 PolarHBondContact NH1-OE2 3.33Å; R835-E913 IonicContact NH2-OE2 3.88Å; R835-E913 PolarHBondContact NH2-OE2 3.04Å; Q909-E913 WeakPolarHBondContact O-CG 3.38Å; Q909-E913 PolarHBondContact O-N 3.32Å; Y910-E913 WeakPolarHBondContact O-CB 3.49Å; Y910-E913 PolarHBondContact O-N 2.95Å; L911-E913 VanDerWaalsContact C-N 3.31Å
914	L	80.1	Confident	70.2	Confident	6 Å²	6	60.4 Å²	60.4	3%	0.031	33%	0.326	C	S	.	.	S	Bend	trans	-69.2	139.5	-171.3	-69.7	-168.4	0	0	0	112	L436 K438 Y910 L911 E912 D916	L436-L914 HydrophobicContact CB-CD1 4.38Å; L436-L914 HydrophobicContact CB-CD2 4.4Å; L436-L914 HydrophobicContact CD2-CD1 3.99Å; L436-L914 HydrophobicContact CG-CD1 4.17Å; K438-L914 HydrophobicContact CB-CB 3.95Å; K438-L914 HydrophobicContact CG-CB 4.47Å; Y910-L914 HydrophobicContact CE1-CD2 4.07Å; Y910-L914 HydrophobicContact CE2-CD2 4.35Å; Y910-L914 WeakPolarHBondContact O-CG 3.34Å; Y910-L914 PolarHBondContact O-N 3.21Å; L911-L914 HydrophobicContact CD2-CD1 3.89Å; L911-L914 PolarHBondContact O-N 2.91Å; E912-L914 PolarHBondContact O-N 3.14Å; L914-D916 PolarHBondContact O-N 3.12Å
915	P	72.1	Confident	68.2	Low	53 Å²	53	67.2 Å²	67.2	34%	0.344	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-63.9	128.3	174.6	29.2	-33.5	0	0	0	109.3	R435 L436 K438	R435-P915 HydrophobicContact CB-CG 4.19Å; L436-P915 WeakPolarHBondContact O-CD 3.37Å; K438-P915 WeakPolarHBondContact CB-O 3.42Å; K438-P915 PolarHBondContact N-O 3.44Å
916	D	62.5	Low	66.5	Low	104 Å²	104	68.7 Å²	68.7	56%	0.556	37%	0.366	S	S	*	.	B	Isolated β-bridge	trans	-51.2	143.5	170.8	-69.9	-67.4	0	0	0	110.5	K438 L914 E918	K438-D916 WeakPolarHBondContact CD-OD1 3.45Å; K438-D916 WeakPolarHBondContact CE-OD1 3.44Å; K438-D916 IonicContact NZ-OD1 3.81Å; K438-D916 PolarHBondContact NZ-OD1 3.31Å; K438-D916 IonicContact NZ-OD2 2.64Å; L914-D916 PolarHBondContact O-N 3.12Å; D916-E918 PolarHBondContact O-N 3.34Å
917	T	56.1	Low	64.6	Low	61 Å²	61	75.4 Å²	75.4	37%	0.374	40%	0.395	S	S	.	.			trans	-68.4	80.7	158	48.2	0	0	0	0	108.9	K437 K438 Q919	K437-T917 HydrophobicContact CB-CG2 3.72Å; K437-T917 HydrophobicContact CD-CG2 4.12Å; K438-T917 WeakPolarHBondContact O-CG2 3.27Å; K438-T917 PolarHBondContact O-OG1 3.36Å; T917-Q919 PolarHBondContact O-N 2.99Å
918	E	41.3	Very low	62.4	Low	129 Å²	129	77.1 Å²	77.1	60%	0.603	41%	0.413	S	S	*	.			trans	-48.9	126.4	150.6	-73	-140.4	127.6	0	0	107.3	D916 S920 K924	D916-E918 PolarHBondContact O-N 3.34Å; E918-S920 PolarHBondContact O-N 3.23Å; E918-K924 WeakPolarHBondContact OE1-CE 3.38Å; E918-K924 IonicContact OE1-NZ 2.73Å; E918-K924 PolarHBondContact OE1-NZ 2.9Å; E918-K924 IonicContact OE2-NZ 3.14Å; E918-K924 PolarHBondContact OE2-NZ 3.29Å
919	Q	42.2	Very low	60.6	Low	124 Å²	124	78 Å²	78	58%	0.579	42%	0.417	S	S	*	.			trans	-52.4	132.5	173.3	-65.8	-178.7	-9.6	0	0	108.2	T917 G921 N923	T917-Q919 PolarHBondContact O-N 2.99Å; Q919-G921 PolarHBondContact O-N 2.93Å; Q919-N923 HydrophobicContact CB-CB 4.12Å; Q919-N923 PolarHBondContact OE1-ND2 2.91Å
920	S	42	Very low	58.7	Low	88 Å²	88	78.1 Å²	78.1	62%	0.615	43%	0.426	S	S	*	.			trans	-38	133.1	-176.3	-176.9	0	0	0	0	111.2	E918 V922 N923	E918-S920 PolarHBondContact O-N 3.23Å; S920-V922 CarbonylContact O-C 3.59Å; S920-V922 PolarHBondContact O-N 2.87Å; S920-N923 PolarHBondContact O-N 3.24Å
921	G	41.6	Very low	56.7	Low	49 Å²	49	82.9 Å²	82.9	51%	0.505	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-22	-168	0	0	0	0	0	115.1	Q919 N923 K924 F925	Q919-G921 PolarHBondContact O-N 2.93Å; G921-N923 VanDerWaalsContact C-N 3.26Å; G921-N923 PolarHBondContact O-N 3.22Å; G921-K924 WeakPolarHBondContact O-CB 3.47Å; G921-K924 PolarHBondContact O-N 2.93Å; G921-F925 PolarHBondContact O-N 3.01Å
922	V	47.5	Very low	54.8	Low	89 Å²	89	89.3 Å²	89.3	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-44.8	-44.1	164.1	-172.1	0	0	0	0	112.7	S920 F925 L926	S920-V922 CarbonylContact O-C 3.59Å; S920-V922 PolarHBondContact O-N 2.87Å; V922-F925 PolarHBondContact O-N 2.86Å; V922-L926 HydrophobicContact CG1-CD1 3.8Å; V922-L926 HydrophobicContact CG1-CG 4.19Å; V922-L926 WeakPolarHBondContact O-CB 3.31Å; V922-L926 VanDerWaalsContact O-CG 3.31Å; V922-L926 WeakPolarHBondContact O-CG 3.38Å; V922-L926 PolarHBondContact O-N 3.39Å
923	N	45.1	Very low	53	Low	70 Å²	70	90.5 Å²	90.5	37%	0.374	49%	0.486	S	S	.	.	H	α-helix	trans	-68.7	-32.7	177.5	-95.7	15.7	0	0	0	113.5	Q919 S920 G921 K927	Q919-N923 HydrophobicContact CB-CB 4.12Å; Q919-N923 PolarHBondContact OE1-ND2 2.91Å; S920-N923 PolarHBondContact O-N 3.24Å; G921-N923 VanDerWaalsContact C-N 3.26Å; G921-N923 PolarHBondContact O-N 3.22Å; N923-K927 WeakPolarHBondContact O-CB 3.26Å; N923-K927 WeakPolarHBondContact O-CG 3.3Å; N923-K927 PolarHBondContact O-N 2.87Å; N923-K927 VanDerWaalsContact O-N 3.1Å
924	K	49.3	Very low	51.3	Low	122 Å²	122	95.1 Å²	95.1	53%	0.53	51%	0.505	S	S	.	.	H	α-helix	trans	-69	-41.5	171.3	-73.1	-177.8	173.8	177.2	0	110.2	E918 G921 G928	E918-K924 WeakPolarHBondContact OE1-CE 3.38Å; E918-K924 IonicContact OE1-NZ 2.73Å; E918-K924 PolarHBondContact OE1-NZ 2.9Å; E918-K924 IonicContact OE2-NZ 3.14Å; E918-K924 PolarHBondContact OE2-NZ 3.29Å; G921-K924 WeakPolarHBondContact O-CB 3.47Å; G921-K924 PolarHBondContact O-N 2.93Å; K924-G928 PolarHBondContact O-N 3.32Å
925	F	48.1	Very low	49.8	Very low	154 Å²	154	103.7 Å²	103.7	68%	0.675	54%	0.543	S	S	*	.	H	α-helix	trans	-66.6	-46.1	178.3	-154.8	-90.7	0	0	0	112.4	G921 V922 G928 L929	G921-F925 PolarHBondContact O-N 3.01Å; V922-F925 PolarHBondContact O-N 2.86Å; F925-G928 CarbonylContact O-C 3.55Å; F925-G928 WeakPolarHBondContact O-CA 3.49Å; F925-G928 PolarHBondContact O-N 3.42Å; F925-G928 VanDerWaalsContact O-N 3.14Å; F925-L929 HydrophobicContact CE1-CD1 4.42Å; F925-L929 PolarHBondContact O-N 2.97Å
926	L	53.9	Low	48.7	Very low	99 Å²	99	108.1 Å²	108.1	52%	0.518	56%	0.563	S	S	.	*	H	α-helix	trans	-65.7	-37.9	177.4	-71.9	174.6	0	0	0	112.6	V922 G928 L929 G930	V922-L926 HydrophobicContact CG1-CD1 3.8Å; V922-L926 HydrophobicContact CG1-CG 4.19Å; V922-L926 WeakPolarHBondContact O-CB 3.31Å; V922-L926 VanDerWaalsContact O-CG 3.31Å; V922-L926 WeakPolarHBondContact O-CG 3.38Å; V922-L926 PolarHBondContact O-N 3.39Å; L926-G928 VanDerWaalsContact C-N 3.33Å; L926-L929 PolarHBondContact O-N 3.19Å; L926-G930 PolarHBondContact O-N 2.97Å
927	K	50	Low	48	Very low	146 Å²	146	111.9 Å²	111.9	64%	0.635	58%	0.576	S	S	*	*	H	α-helix	trans	-64.8	-36.7	170.5	-77.6	-177.9	174.5	-177.8	0	112.1	N923 N931	N923-K927 WeakPolarHBondContact O-CB 3.26Å; N923-K927 WeakPolarHBondContact O-CG 3.3Å; N923-K927 PolarHBondContact O-N 2.87Å; N923-K927 VanDerWaalsContact O-N 3.1Å; K927-N931 PolarHBondContact O-N 3.05Å
928	G	47.8	Very low	47.7	Very low	38 Å²	38	118.6 Å²	118.6	39%	0.392	60%	0.6	S	S	.	*	H	α-helix	trans	-63.2	-43.6	171.2	0	0	0	0	0	112.9	K924 F925 L926 N931 K932	K924-G928 PolarHBondContact O-N 3.32Å; F925-G928 CarbonylContact O-C 3.55Å; F925-G928 WeakPolarHBondContact O-CA 3.49Å; F925-G928 PolarHBondContact O-N 3.42Å; F925-G928 VanDerWaalsContact O-N 3.14Å; L926-G928 VanDerWaalsContact C-N 3.33Å; G928-N931 PolarHBondContact O-N 3.34Å; G928-K932 PolarHBondContact O-N 3.13Å; G928-K932 VanDerWaalsContact O-N 3.17Å
929	L	53.2	Low	48	Very low	81 Å²	81	121.9 Å²	121.9	42%	0.424	61%	0.613	S	S	.	*	H	α-helix	trans	-66.5	-45	179.2	-147.5	76	0	0	0	111.8	F925 L926 N931 K932 M933	F925-L929 HydrophobicContact CE1-CD1 4.42Å; F925-L929 PolarHBondContact O-N 2.97Å; L926-L929 PolarHBondContact O-N 3.19Å; L929-N931 PolarHBondContact O-N 2.76Å; L929-K932 PolarHBondContact O-N 2.91Å; L929-M933 HydrophobicContact CG-SD 4.49Å; L929-M933 PolarHBondContact O-N 3.15Å
930	G	49.2	Very low	47.9	Very low	32 Å²	32	127.6 Å²	127.6	33%	0.33	65%	0.647	S	S	.	*	H	α-helix	trans	-63.8	-22.4	176.5	0	0	0	0	0	114.3	L926 K934	L926-G930 PolarHBondContact O-N 2.97Å; G930-K934 WeakPolarHBondContact O-CD 3.45Å; G930-K934 WeakPolarHBondContact O-CG 3.49Å
931	N	48.3	Very low	48.2	Very low	103 Å²	103	129.6 Å²	129.6	55%	0.551	65%	0.649	S	S	*	*	H	α-helix	trans	-83.8	-29.6	170.4	-77.1	-6.1	0	0	0	112.9	K927 G928 L929	K927-N931 PolarHBondContact O-N 3.05Å; G928-N931 PolarHBondContact O-N 3.34Å; L929-N931 PolarHBondContact O-N 2.76Å
932	K	50.8	Low	48.5	Very low	166 Å²	166	133.8 Å²	133.8	72%	0.722	66%	0.656	S	S	*	*	H	α-helix	trans	-74.1	-40.6	173.3	-74.9	-169.9	174.6	-171.6	0	112.9	G928 L929 K934 F935	G928-K932 PolarHBondContact O-N 3.13Å; G928-K932 VanDerWaalsContact O-N 3.17Å; L929-K932 PolarHBondContact O-N 2.91Å; K932-K934 PolarHBondContact O-N 3.47Å; K932-F935 PolarHBondContact O-N 3.44Å
933	M	48.3	Very low	48.6	Very low	129 Å²	129	136.3 Å²	136.3	64%	0.635	66%	0.663	S	S	*	*	H	α-helix	trans	-64.7	-25.4	179.6	-75.6	168.7	62.4	0	0	113.6	L929 F935 L936	L929-M933 HydrophobicContact CG-SD 4.49Å; L929-M933 PolarHBondContact O-N 3.15Å; M933-F935 PolarHBondContact O-N 3.3Å; M933-L936 PolarHBondContact O-N 3.5Å
934	K	48.9	Very low	48.8	Very low	155 Å²	155	140.2 Å²	140.2	67%	0.674	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-65.5	-15.8	177.1	-77	173.7	-178.6	-179.8	0	114.6	G930 K932 L936	G930-K934 WeakPolarHBondContact O-CD 3.45Å; G930-K934 WeakPolarHBondContact O-CG 3.49Å; K932-K934 PolarHBondContact O-N 3.47Å; K934-L936 VanDerWaalsContact C-N 3.32Å
935	F	47.3	Very low	48.7	Very low	186 Å²	186	141.3 Å²	141.3	82%	0.816	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-81.9	-4.2	176.5	-82.9	-87.9	0	0	0	114.5	K932 M933	K932-F935 PolarHBondContact O-N 3.44Å; M933-F935 PolarHBondContact O-N 3.3Å
936	L	49	Very low	48.8	Very low	146 Å²	146	140.5 Å²	140.5	76%	0.764	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-106.8	18.1	-177.6	-71.4	173.2	0	0	0	114.5	M933 K934	M933-L936 PolarHBondContact O-N 3.5Å; K934-L936 VanDerWaalsContact C-N 3.32Å
937	H	48.5	Very low	48.4	Very low	182 Å²	182	143.4 Å²	143.4	84%	0.843	70%	0.702	S	S	*	*	S	Bend	trans	-128	31.1	178.6	-92.9	42	0	0	0	113.5
938	K	49.6	Very low	48.3	Very low	202 Å²	202	143.2 Å²	143.2	88%	0.878	71%	0.707	S	S	*	*			trans	-142.7	57.1	168.8	-154.4	171.5	-175.2	177.7	0	113.6
939	K	48.2	Very low	48.3	Very low	199 Å²	199	152 Å²	152	87%	0.865	73%	0.733	S	S	*	*			trans	-144.3	89.8	157	-102	-163.9	173.9	-171.6	0	109.6
940	N	38.8	Very low	47.9	Very low	243 Å²	243	158.5 Å²	158.5	100%	1.299	76%	0.762	S	S	*	*			trans	-169.6	0	142.4	-88.1	-11.9	0	0	0	105.7

Retrieved 940 of 940 residues in 2311.2 ms (Link to these results)

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