A0A5K4F281_SCHMA Loading...

ULP_PROTEASE domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F281, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,198 aa.

						>A0A5K4F281_SCHMA|A0A5K4F281
MSKSTTPSEEFGYPHLPVRQKSDQETISQCIKTLKSRRPNTLDFSPLALGNRDRNHKTYAKRPTVLSVHDSFQTAVCSTSAYSSSIISACPTKRPNFLPIPSQGNKYPSFPKPSDGLVSGNGKRIISTVKASSLNTRSVHIIHPDSMELFIKKNTQLLKYHTCRTSVRRRPDKCGHMSTKNFIAWSRNNTQLYSVFCFDKFRIIHKRLPCPYCSTCSHHKRRAFNHSSYVLGGSNYLSHSQTFPNLLSFRRCCSYNFTKHMDFTSSDILTSSIRLCPRYCRRINNSVGTVTFGRPSETIEGPVFDSTNLPEVYDIPIKSSQKLGEPTSKPHIEKVTLPTTIFNDKNMQTINININDANHVFQQRIDPSLANTSLDENCSDGKQLHTSKKLQQIQPNGDIWPPLVISSHPELVLQFNPPVGLLISLLENTNKKSDYLYDKNVRELTIDSEKSSLDSVTMTPATQSESSPKSDHVSPGITIALTRNLHVRVHPTELNCCLRQSTWCFSSSGFYQFGQEEIVILLRRRFDERLPPMEIFYQYWLIYQALVNYAEKQVKSDVNFESFNSQTYNRPFGSAPFRSHDCFFEKLYFANDRCSSSPCTDSDMANGYCWLNSRSLTSRIYGSSNPYGFVFFHPTHQCLLGLHLPNPPFLIALLVHIQEAPWAYHLPSRILLNLGKMSHYYPTTLLSDRDRKILFDCKLDGESFLQLFTNIKPFIYPDFMTFTPKQRCIPLPELLFHINGFYAHLNVVKSESDTNTTTHNNGIEDVIVELLIPMSSCASVARFLDSSAMESMTFALSADCNPMSDSHLVCSQSKILLKESKDNHNKLICQNVTNSQMVSNPNYFTDQNCSQTFETEAISIENTRLKVTGVSFVAFSGHAPYCSAVIVEDGIYISMTSLKFHQLVSSLKGGYDLSIPIRSSCNIPPSAIVEHISGDFGDNISNRDLLNGNVASSVHVKWFKVFDSFLSSASFSTTVTPCYTNSASIWDLEPITTFLVPVHYQLWHWIHLNESIIPSSESRLSSLPTTKSSDPPFLRLAWIRFHVLNVDQVEFISTSSSKAVTFGHFSNEVAECVIKALRPYLGHLLNNNRTQITLRILLQPPDQVGYRMGASCQEVYTLHNQLDSSNDLENTSCENCEETYADALDDILLPVLSSWTSCLKIVDPNMKEFEQRRSPGTSNSCYHPNEVIQMEFDFCILN
					

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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	26.9	Very low	28.6	Very low	254 Å²	254	152.4 Å²	152.4	100%	1.251	82%	0.824	S	S	*	*				0	171.6	0	-76.4	175.2	164.2	0	0	108.9
2	S	30.3	Very low	28.3	Very low	101 Å²	101	144.9 Å²	144.9	71%	0.706	81%	0.809	S	S	*	*			trans	-126.6	136	-151.8	54	0	0	0	0	115.3
3	K	32.8	Very low	27.8	Very low	204 Å²	204	151.5 Å²	151.5	89%	0.887	82%	0.816	S	S	*	*			trans	62.1	160.8	159.8	-58.9	174.1	179.5	-178.3	0	115.2
4	S	30.9	Very low	27.9	Very low	101 Å²	101	149.4 Å²	149.4	71%	0.706	82%	0.815	S	S	*	*			cis	-163.2	175.5	-35.2	59.8	0	0	0	0	106.1
5	T	32.4	Very low	27.6	Very low	123 Å²	123	151.5 Å²	151.5	76%	0.755	82%	0.816	S	S	*	*			cis	-149.6	179.8	12.8	-33.2	0	0	0	0	109.7
6	T	24.8	Very low	27.5	Very low	126 Å²	126	151.1 Å²	151.1	77%	0.773	81%	0.813	S	S	*	*			trans	-120.4	-174.6	173.1	53.5	0	0	0	0	108.7
7	P	34.9	Very low	27.6	Very low	116 Å²	116	149.7 Å²	149.7	75%	0.753	81%	0.814	S	S	*	*			cis	-138.8	175.6	6	44	-25.6	0	0	0	117.9
8	S	25.2	Very low	27.4	Very low	104 Å²	104	147.5 Å²	147.5	73%	0.727	81%	0.806	S	S	*	*			trans	-82.6	165.1	158.4	51.2	0	0	0	0	112.3
9	E	27.7	Very low	27.4	Very low	170 Å²	170	152.8 Å²	152.8	79%	0.794	81%	0.813	S	S	*	*			trans	-130.9	113.4	146.8	-73.8	-157.6	143.3	0	0	111.4
10	E	22.5	Very low	27.4	Very low	192 Å²	192	153.9 Å²	153.9	90%	0.897	81%	0.813	S	S	*	*			trans	-145.2	114.1	163.7	-177	177.9	-123	0	0	105.1
11	F	26.5	Very low	27.4	Very low	185 Å²	185	155.5 Å²	155.5	81%	0.811	81%	0.813	S	S	*	*			trans	-99.9	108.6	-167.7	-101.8	-77.8	0	0	0	112.5
12	G	25	Very low	27.3	Very low	63 Å²	63	147.8 Å²	147.8	65%	0.649	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-99.9	172.6	175.8	0	0	0	0	0	114.8
13	Y	21.1	Very low	27.1	Very low	230 Å²	230	149.8 Å²	149.8	90%	0.902	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-62.9	141.4	174.9	-66.5	-99.7	0	0	0	113.1
14	P	30.3	Very low	26.7	Very low	123 Å²	123	148.9 Å²	148.9	80%	0.799	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-95.1	134.6	161.8	34.6	-29.5	0	0	0	111.9
15	H	23.4	Very low	26.4	Very low	180 Å²	180	151.3 Å²	151.3	83%	0.833	79%	0.786	S	S	*	*			trans	-137.1	164.5	171.7	-110	-37.3	0	0	0	110
16	L	24.7	Very low	26.2	Very low	146 Å²	146	150.1 Å²	150.1	76%	0.764	78%	0.778	S	S	*	*			trans	72.4	160	168	-70.5	163	0	0	0	115.5	V18	L16-V18 HydrophobicContact CD2-CG2 3.86Å
17	P	30.7	Very low	26.4	Very low	127 Å²	127	152.5 Å²	152.5	83%	0.825	79%	0.785	S	S	*	*			cis	-122.7	171	19.4	41.4	-27.4	0	0	0	118.4
18	V	24.1	Very low	26	Very low	110 Å²	110	151.4 Å²	151.4	67%	0.667	78%	0.779	S	S	*	*			trans	-78.7	147.2	-175.1	172.6	0	0	0	0	113.2	L16	L16-V18 HydrophobicContact CD2-CG2 3.86Å
19	R	27.4	Very low	26.2	Very low	249 Å²	249	152 Å²	152	94%	0.94	77%	0.771	S	S	*	*			trans	-131.6	145.2	146.4	-92.8	-172.4	170.7	-175.3	-2.4	110.4
20	Q	25.6	Very low	26.3	Very low	174 Å²	174	149.4 Å²	149.4	81%	0.813	77%	0.77	S	S	*	*			trans	-95.2	135.5	177.9	-62.5	171.2	-33.7	0	0	110.8
21	K	27.6	Very low	26.6	Very low	188 Å²	188	147.8 Å²	147.8	82%	0.817	77%	0.766	S	S	*	*				171.7	152.8	107.8	-96.6	-168.3	172.5	-169.8	0	113.3
22	S	25.8	Very low	26.7	Very low	91 Å²	91	147 Å²	147	64%	0.636	76%	0.762	S	S	*	*			trans	54.9	110.4	152	52.7	0	0	0	0	120.5
23	D	25.3	Very low	26.9	Very low	144 Å²	144	149 Å²	149	77%	0.77	76%	0.762	S	S	*	*				82.4	112.1	124.4	-48.5	-20.8	0	0	0	121.8
24	Q	24.5	Very low	27.3	Very low	184 Å²	184	144.3 Å²	144.3	86%	0.86	75%	0.751	S	S	*	*			trans	58.2	160.2	137.2	-64.9	-176.2	-27.5	0	0	121.3
25	E	25.2	Very low	27.1	Very low	153 Å²	153	146.9 Å²	146.9	72%	0.715	75%	0.75	S	S	*	*			trans	59	89.6	178.9	-57.3	-161.9	141.7	0	0	117.9	N942	E25-N942 PolarHBondContact OE1-ND2 2.82Å
26	T	29	Very low	27.1	Very low	98 Å²	98	143.2 Å²	143.2	60%	0.601	75%	0.745	S	S	*	*			trans	-153.5	71.4	157.5	-15.2	0	0	0	0	115.8	Q29	T26-Q29 HydrophobicContact CG2-CB 3.84Å; T26-Q29 HydrophobicContact CG2-CG 3.68Å
27	I	27.2	Very low	27.2	Very low	176 Å²	176	148.1 Å²	148.1	90%	0.903	75%	0.753	S	S	*	*	S	Bend	trans	-107	-10	157.3	-69.4	178.1	0	0	0	111.4
28	S	27	Very low	26.8	Very low	92 Å²	92	153.9 Å²	153.9	64%	0.643	76%	0.758	S	S	*	*	S	Bend	trans	-103.4	17.7	-170.7	-157.6	0	0	0	0	115.6
29	Q	30.2	Very low	27.1	Very low	118 Å²	118	154.2 Å²	154.2	55%	0.551	76%	0.763	S	S	*	*			trans	-111.5	-15.7	-175.7	-68.2	-165.7	2.1	0	0	116.9	T26 I31 K32	T26-Q29 HydrophobicContact CG2-CB 3.84Å; T26-Q29 HydrophobicContact CG2-CG 3.68Å; Q29-I31 PolarHBondContact O-N 3.4Å; Q29-K32 PolarHBondContact O-N 3.18Å; Q29-K32 VanDerWaalsContact O-N 3.13Å
30	C	30	Very low	27.1	Very low	114 Å²	114	150.1 Å²	150.1	77%	0.77	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-17.4	-179.2	-65	0	0	0	0	114.6
31	I	29.1	Very low	27.1	Very low	159 Å²	159	147.5 Å²	147.5	82%	0.815	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-11.4	-178.4	-67.9	172.7	0	0	0	113	Q29	Q29-I31 PolarHBondContact O-N 3.4Å
32	K	28.5	Very low	27.1	Very low	169 Å²	169	147 Å²	147	74%	0.735	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	-12.6	-173.7	-78.4	175.2	179.3	165.3	0	115.9	Q29	Q29-K32 PolarHBondContact O-N 3.18Å; Q29-K32 VanDerWaalsContact O-N 3.13Å
33	T	28.8	Very low	27	Very low	103 Å²	103	148.6 Å²	148.6	63%	0.632	76%	0.762	S	S	*	*	S	Bend	trans	-85.6	-8.9	-179	40.9	0	0	0	0	115.2	K35	T33-K35 PolarHBondContact O-N 3.05Å
34	L	28.5	Very low	26.9	Very low	132 Å²	132	152.1 Å²	152.1	69%	0.691	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	30.7	174	-77.9	169.1	0	0	0	114.4
35	K	25.6	Very low	26.8	Very low	177 Å²	177	148.2 Å²	148.2	77%	0.77	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.7	23.7	-178.6	-84.9	-168.9	176.7	179.9	0	115.7	T33	T33-K35 PolarHBondContact O-N 3.05Å
36	S	24.7	Very low	27	Very low	104 Å²	104	146.9 Å²	146.9	73%	0.727	77%	0.769	S	S	*	*			trans	-163.5	86.4	166.4	45.6	0	0	0	0	115.7
37	R	26.6	Very low	26.8	Very low	249 Å²	249	149.5 Å²	149.5	94%	0.94	78%	0.779	S	S	*	*			trans	-162.7	106	150.7	-108.8	160.8	-160.3	-145.9	3.1	111.1
38	R	22.8	Very low	26.9	Very low	247 Å²	247	146 Å²	146	93%	0.932	78%	0.776	S	S	*	*			trans	-92.5	134.2	158.9	-71.7	-180	176	175.9	-3.1	108.1
39	P	29.6	Very low	26.8	Very low	117 Å²	117	149.2 Å²	149.2	76%	0.76	79%	0.785	S	S	*	*			trans	-102.8	127.6	149.9	6.8	13.5	0	0	0	109.5
40	N	27.4	Very low	26.7	Very low	164 Å²	164	147.3 Å²	147.3	88%	0.877	80%	0.798	S	S	*	*			trans	1.9	123.2	167.7	-55.9	-8.7	0	0	0	119.4
41	T	26.5	Very low	26.6	Very low	118 Å²	118	148.2 Å²	148.2	72%	0.724	79%	0.794	S	S	*	*			trans	-66.1	145.7	159.8	42	0	0	0	0	112.2
42	L	26.2	Very low	26.5	Very low	178 Å²	178	150.7 Å²	150.7	93%	0.932	79%	0.794	S	S	*	*			trans	-120.6	135.1	142.1	-93.3	168.8	0	0	0	107.3
43	D	23.4	Very low	26.6	Very low	124 Å²	124	148.3 Å²	148.3	66%	0.663	79%	0.789	S	S	*	*			trans	-90	144.8	-166.9	-58.9	-76.1	0	0	0	113
44	F	23.8	Very low	26.6	Very low	218 Å²	218	153.5 Å²	153.5	96%	0.956	80%	0.797	S	S	*	*			trans	-133.6	133.1	142.8	-91.2	-72.4	0	0	0	110.3
45	S	23.7	Very low	26.5	Very low	103 Å²	103	153.4 Å²	153.4	72%	0.72	80%	0.797	S	S	*	*			trans	-104	140.2	-160.9	51.6	0	0	0	0	113.5
46	P	27.7	Very low	26.7	Very low	125 Å²	125	153.6 Å²	153.6	81%	0.812	80%	0.801	S	S	*	*			trans	-100.1	98.6	171.7	34.6	-28.9	0	0	0	111.6
47	L	24.9	Very low	26.8	Very low	152 Å²	152	157.7 Å²	157.7	80%	0.796	81%	0.805	S	S	*	*			trans	-144.5	113.5	170.6	-89	-179.7	0	0	0	113.9	L49	L47-L49 HydrophobicContact CD2-CD1 4.21Å
48	A	29.9	Very low	26.8	Very low	104 Å²	104	151.4 Å²	151.4	86%	0.86	79%	0.794	S	S	*	*			trans	-149.4	122.4	151.8	0	0	0	0	0	108.2
49	L	25	Very low	26.8	Very low	159 Å²	159	150.1 Å²	150.1	83%	0.832	79%	0.791	S	S	*	*			trans	-93.4	148.4	-176.5	-73.7	109.6	0	0	0	112.4	L47	L47-L49 HydrophobicContact CD2-CD1 4.21Å
50	G	27.2	Very low	26.6	Very low	78 Å²	78	148.7 Å²	148.7	80%	0.804	79%	0.789	S	S	*	*			trans	-152.1	26.3	-173.1	0	0	0	0	0	117.6
51	N	29.4	Very low	26.5	Very low	132 Å²	132	151 Å²	151	71%	0.706	79%	0.791	S	S	*	*			trans	30.6	114.9	162.8	-82.7	-33.9	0	0	0	122.2
52	R	26.3	Very low	26.5	Very low	211 Å²	211	156 Å²	156	80%	0.796	80%	0.797	S	S	*	*				91	140.5	121.2	-76.8	-174.5	-176.4	-175.7	-0.1	124.4
53	D	30	Very low	26.5	Very low	120 Å²	120	153.6 Å²	153.6	64%	0.642	79%	0.792	S	S	*	*			trans	79.1	88	142	-62.3	-31.6	0	0	0	124.2
54	R	29.5	Very low	26.5	Very low	212 Å²	212	153 Å²	153	80%	0.8	79%	0.793	S	S	*	*				58.5	120.7	115.5	-71.4	177.7	170.6	-174.6	-1.1	122.3
55	N	26.8	Very low	26.4	Very low	130 Å²	130	149 Å²	149	70%	0.695	79%	0.786	S	S	*	*			trans	64.6	116.2	141.3	-51.9	-8.6	0	0	0	118.3
56	H	30.4	Very low	26.5	Very low	181 Å²	181	151.8 Å²	151.8	84%	0.838	79%	0.792	S	S	*	*				-167.5	-178.5	75.7	-104.1	-84.5	0	0	0	113.9
57	K	25.6	Very low	26.3	Very low	189 Å²	189	150.2 Å²	150.2	82%	0.822	78%	0.784	S	S	*	*			trans	-79	168.2	175.9	-49.8	170.7	-178.2	175.7	0	110.2
58	T	27.1	Very low	26.2	Very low	117 Å²	117	149.1 Å²	149.1	72%	0.718	78%	0.784	S	S	*	*			cis	-166.3	153.5	35.3	25.5	0	0	0	0	113.3
59	Y	23	Very low	25.8	Very low	221 Å²	221	151.7 Å²	151.7	87%	0.867	78%	0.778	S	S	*	*			trans	46.5	108.5	147	-78.7	-83.4	0	0	0	124.2
60	A	24.3	Very low	25.7	Very low	87 Å²	87	149.9 Å²	149.9	72%	0.719	77%	0.769	S	S	*	*				57.3	123.3	121.1	0	0	0	0	0	124.1
61	K	26.7	Very low	25.5	Very low	211 Å²	211	150.9 Å²	150.9	92%	0.917	76%	0.763	S	S	*	*				-171.2	151.9	121.5	-107.6	172	-176.8	179.3	0	113.8
62	R	24.7	Very low	25.2	Very low	224 Å²	224	154.4 Å²	154.4	85%	0.845	77%	0.773	S	S	*	*			trans	-84.2	162.5	156.9	-79.7	-176.6	174.4	176.2	-2.5	109.8
63	P	27	Very low	25	Very low	127 Å²	127	152.4 Å²	152.4	83%	0.825	77%	0.772	S	S	*	*				-135	-177.8	127.1	38.5	-28	0	0	0	113.5
64	T	23	Very low	24.9	Very low	113 Å²	113	153.4 Å²	153.4	69%	0.693	78%	0.783	S	S	*	*			trans	-142.2	137.6	-170.1	43.8	0	0	0	0	113.4
65	V	23.3	Very low	24.5	Very low	133 Å²	133	147.3 Å²	147.3	81%	0.806	78%	0.778	S	S	*	*			trans	63.8	137.9	145.4	178.9	0	0	0	0	120.3
66	L	24.3	Very low	24.5	Very low	161 Å²	161	147.3 Å²	147.3	84%	0.843	78%	0.782	S	S	*	*			trans	147.8	146.9	152	-79.7	168.3	0	0	0	108.6
67	S	23.8	Very low	24	Very low	93 Å²	93	144.5 Å²	144.5	65%	0.65	78%	0.782	S	S	*	*			cis	-173	147.8	-11.4	51.7	0	0	0	0	114
68	V	22.5	Very low	24	Very low	129 Å²	129	140.7 Å²	140.7	78%	0.782	78%	0.779	S	S	*	*			trans	78.7	123.2	139.9	165.6	0	0	0	0	122.2
69	H	22.1	Very low	24	Very low	158 Å²	158	141.1 Å²	141.1	73%	0.731	78%	0.782	S	S	*	*			trans	68.7	142.5	147.3	-93.8	-108.5	0	0	0	127
70	D	23	Very low	23.9	Very low	121 Å²	121	135.9 Å²	135.9	65%	0.647	78%	0.777	S	S	*	*			trans	72.3	102.7	146.8	-82.2	-49.5	0	0	0	123.9
71	S	23	Very low	23.8	Very low	98 Å²	98	135.9 Å²	135.9	69%	0.685	78%	0.777	S	S	*	*				58.5	115	110.5	-57.3	0	0	0	0	120.3
72	F	22.8	Very low	23.8	Very low	206 Å²	206	136.9 Å²	136.9	90%	0.904	78%	0.777	S	S	*	*				-137.1	138.2	129.4	-127.9	-81.1	0	0	0	112.4
73	Q	22.7	Very low	23.6	Very low	169 Å²	169	131.3 Å²	131.3	79%	0.79	77%	0.772	S	S	*	*			trans	-125	125.5	-171.6	179.8	-172.7	25	0	0	108.7
74	T	26.5	Very low	23.4	Very low	142 Å²	142	130.5 Å²	130.5	87%	0.871	77%	0.769	S	S	*	*			trans	-144.2	137.9	160.8	25.1	0	0	0	0	107.9
75	A	22.7	Very low	23.4	Very low	83 Å²	83	130.1 Å²	130.1	69%	0.686	77%	0.771	S	S	*	*			trans	-147.9	-172.3	-157.9	0	0	0	0	0	112.9
76	V	25.1	Very low	23.5	Very low	130 Å²	130	131.2 Å²	131.2	79%	0.788	77%	0.771	S	S	*	*			trans	95.5	91.4	166.8	-167.8	0	0	0	0	116.7
77	C	21.2	Very low	23.4	Very low	122 Å²	122	130.7 Å²	130.7	82%	0.824	77%	0.768	S	S	*	*			trans	33.9	118.8	131.6	-52.2	0	0	0	0	121.3
78	S	26	Very low	23.4	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	78%	0.778	S	S	*	*			trans	-159.7	113.2	130.5	41.4	0	0	0	0	114
79	T	26	Very low	23.5	Very low	126 Å²	126	130.8 Å²	130.8	77%	0.773	78%	0.78	S	S	*	*			trans	28.7	113.8	143.3	54.4	0	0	0	0	122.1
80	S	22.1	Very low	23.5	Very low	110 Å²	110	129 Å²	129	77%	0.769	78%	0.784	S	S	*	*				68.4	129.6	129.2	66.2	0	0	0	0	122.9
81	A	22	Very low	23.6	Very low	87 Å²	87	128.7 Å²	128.7	72%	0.719	79%	0.789	S	S	*	*			trans	67.4	99.9	151.9	0	0	0	0	0	119.3
82	Y	25.8	Very low	23.6	Very low	233 Å²	233	130.6 Å²	130.6	91%	0.914	80%	0.796	S	S	*	*				-162.8	169	109.1	-106.5	-72.2	0	0	0	110.5
83	S	20.9	Very low	23.6	Very low	107 Å²	107	130.2 Å²	130.2	75%	0.748	79%	0.794	S	S	*	*			trans	-98.7	123.2	-168.4	53.9	0	0	0	0	114.4
84	S	22.9	Very low	23.6	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	80%	0.796	S	S	*	*			trans	-170.9	132.5	150.5	56.7	0	0	0	0	114.8
85	S	21.9	Very low	23.5	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	79%	0.792	S	S	*	*			trans	-15.2	123.8	158.7	53.7	0	0	0	0	120.5
86	I	25.6	Very low	23.5	Very low	157 Å²	157	134.8 Å²	134.8	81%	0.805	80%	0.797	S	S	*	*			trans	-142.5	105.9	152.6	-62.9	-178.8	0	0	0	104.8
87	I	22.3	Very low	23.5	Very low	150 Å²	150	138.5 Å²	138.5	77%	0.769	80%	0.803	S	S	*	*				54.9	84.3	69.2	-50.5	-177.5	0	0	0	112.7
88	S	25.3	Very low	23.6	Very low	123 Å²	123	140.5 Å²	140.5	86%	0.86	81%	0.805	S	S	*	*			trans	-130.4	115	160.7	-174.6	0	0	0	0	108.5
89	A	22.8	Very low	23.5	Very low	100 Å²	100	140.5 Å²	140.5	83%	0.826	80%	0.802	S	S	*	*			trans	-98.6	127.6	-177.6	0	0	0	0	0	110.4
90	C	23.1	Very low	23.4	Very low	120 Å²	120	140.7 Å²	140.7	81%	0.811	80%	0.797	S	S	*	*			trans	-132.4	140.4	170.4	-134.4	0	0	0	0	109
91	P	25.4	Very low	23.5	Very low	116 Å²	116	141 Å²	141	75%	0.753	80%	0.796	S	S	*	*			trans	-81	128.5	-157.1	29.8	-35.2	0	0	0	113.9	K93	P91-K93 PolarHBondContact O-N 3.41Å; P91-K93 VanDerWaalsContact O-N 3.14Å
92	T	22.1	Very low	23.6	Very low	138 Å²	138	142 Å²	142	85%	0.847	80%	0.799	S	S	*	*			trans	-59.5	111.4	169.5	51.4	0	0	0	0	111.1
93	K	24.3	Very low	23.6	Very low	197 Å²	197	140.1 Å²	140.1	86%	0.857	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-71.6	130.8	162.3	-75.5	178.9	-179.8	170.2	0	108.7	P91	P91-K93 PolarHBondContact O-N 3.41Å; P91-K93 VanDerWaalsContact O-N 3.14Å
94	R	21.8	Very low	23.8	Very low	221 Å²	221	138.3 Å²	138.3	83%	0.834	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62.4	140.5	162.7	-67	175.9	174.6	171.4	-3.6	108.6	N96	R94-N96 PolarHBondContact O-N 3.11Å
95	P	24.6	Very low	23.8	Very low	120 Å²	120	140.1 Å²	140.1	78%	0.779	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-60	130.4	158.9	27.6	-32.5	0	0	0	107.9
96	N	23.4	Very low	24.1	Very low	150 Å²	150	143.9 Å²	143.9	80%	0.802	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-73.9	131.1	174.2	-77	-42.3	0	0	0	108.6	R94 L98	R94-N96 PolarHBondContact O-N 3.11Å; N96-L98 PolarHBondContact O-N 2.81Å
97	F	23.5	Very low	24	Very low	207 Å²	207	146.9 Å²	146.9	91%	0.908	80%	0.803	S	S	*	*			trans	-57.9	111.2	163.8	-76.1	-91.2	0	0	0	108.6
98	L	23.8	Very low	24.3	Very low	165 Å²	165	145.5 Å²	145.5	86%	0.864	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-63.5	124.1	170.5	-82.6	168.7	0	0	0	108.5	N96	N96-L98 PolarHBondContact O-N 2.81Å
99	P	25	Very low	24.3	Very low	109 Å²	109	144.5 Å²	144.5	71%	0.708	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.9	136.9	178.2	29.2	-33.5	0	0	0	109.8
100	I	23.3	Very low	24.3	Very low	131 Å²	131	149.2 Å²	149.2	67%	0.672	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-55.2	126.4	166.6	-61.8	168.8	0	0	0	107.6	S102	I100-S102 PolarHBondContact O-N 3.43Å
101	P	23.4	Very low	24.6	Very low	115 Å²	115	149 Å²	149	75%	0.747	80%	0.797	S	S	*	*			trans	-71	93.6	-177.6	27.8	-34.3	0	0	0	110.5	Q103	P101-Q103 PolarHBondContact O-N 3.24Å; P101-Q103 VanDerWaalsContact O-N 3.08Å
102	S	24.6	Very low	24.6	Very low	110 Å²	110	152.7 Å²	152.7	77%	0.769	80%	0.801	S	S	*	*			trans	-66	104.6	170.4	56.7	0	0	0	0	109.6	I100 G104	I100-S102 PolarHBondContact O-N 3.43Å; S102-G104 PolarHBondContact O-N 3.2Å
103	Q	24.7	Very low	25	Very low	193 Å²	193	152.1 Å²	152.1	90%	0.902	80%	0.799	S	S	*	*			trans	-69.9	74.8	173.4	-73.6	-162.6	-7.2	0	0	111.6	P101 N105	P101-Q103 PolarHBondContact O-N 3.24Å; P101-Q103 VanDerWaalsContact O-N 3.08Å; Q103-N105 PolarHBondContact O-N 3.36Å; Q103-N105 VanDerWaalsContact O-N 3.12Å
104	G	26.3	Very low	25.1	Very low	69 Å²	69	147.9 Å²	147.9	71%	0.711	79%	0.794	S	S	*	*			trans	-77.1	87.3	175.1	0	0	0	0	0	111.9	S102 K106	S102-G104 PolarHBondContact O-N 3.2Å; G104-K106 PolarHBondContact O-N 3.11Å; G104-K106 VanDerWaalsContact O-N 3.13Å
105	N	23.4	Very low	25.3	Very low	146 Å²	146	145.1 Å²	145.1	78%	0.781	80%	0.796	S	S	*	*			trans	-64.6	106.7	178.9	-130.8	-33.4	0	0	0	111.6	Q103	Q103-N105 PolarHBondContact O-N 3.36Å; Q103-N105 VanDerWaalsContact O-N 3.12Å
106	K	26.4	Very low	25.4	Very low	185 Å²	185	143.1 Å²	143.1	80%	0.804	80%	0.797	S	S	*	*			trans	-159.8	73.7	172.8	-110.9	163.7	-171.6	173.5	0	112.9	G104	G104-K106 PolarHBondContact O-N 3.11Å; G104-K106 VanDerWaalsContact O-N 3.13Å
107	Y	24.2	Very low	25.5	Very low	220 Å²	220	144.4 Å²	144.4	86%	0.863	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78	137.5	163.6	-80.8	-80.7	0	0	0	111.6
108	P	28.1	Very low	25.7	Very low	121 Å²	121	141.6 Å²	141.6	79%	0.786	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-100.7	137.7	146.2	33.5	-27.5	0	0	0	110.8
109	S	27	Very low	25.8	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-83.8	134.9	-168	52.4	0	0	0	0	115.9
110	F	22.6	Very low	26	Very low	198 Å²	198	137.8 Å²	137.8	87%	0.868	81%	0.805	S	S	*	*			trans	57.1	167.7	137.5	-78.7	-74.3	0	0	0	119.1
111	P	28.1	Very low	26.1	Very low	117 Å²	117	139.7 Å²	139.7	76%	0.76	82%	0.816	S	S	*	*			cis	-133.3	169.4	19.3	42	-23.8	0	0	0	119
112	K	25.2	Very low	26.3	Very low	193 Å²	193	137.8 Å²	137.8	84%	0.839	82%	0.817	S	S	*	*			trans	-97.9	147.3	149.7	-76.6	-174.7	174.2	-175.4	0	107.5
113	P	30.3	Very low	26.5	Very low	126 Å²	126	141.7 Å²	141.7	82%	0.818	82%	0.821	S	S	*	*				-139.7	-164.2	76.1	39.9	-20.6	0	0	0	111.4
114	S	27.9	Very low	26.6	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	82%	0.818	S	S	*	*			cis	-153.2	173.7	14.6	58.9	0	0	0	0	113.3
115	D	24.7	Very low	26.6	Very low	164 Å²	164	147 Å²	147	88%	0.877	82%	0.82	S	S	*	*			trans	-68.1	163.1	178.8	-54.9	-87.2	0	0	0	115.4
116	G	27.7	Very low	26.7	Very low	78 Å²	78	146.4 Å²	146.4	80%	0.804	82%	0.816	S	S	*	*			trans	-170.3	97	172.7	0	0	0	0	0	113.5
117	L	24.4	Very low	26.9	Very low	176 Å²	176	142.6 Å²	142.6	92%	0.921	81%	0.812	S	S	*	*			trans	-86.9	142.7	168.9	-87.5	136.3	0	0	0	111.1
118	V	28.7	Very low	27	Very low	148 Å²	148	137.9 Å²	137.9	90%	0.897	81%	0.807	S	S	*	*			trans	-174.8	156.1	137.6	140.8	0	0	0	0	109.3
119	S	26.5	Very low	26.9	Very low	116 Å²	116	138.4 Å²	138.4	81%	0.811	81%	0.807	S	S	*	*			trans	-107.9	164.6	-168.5	57.8	0	0	0	0	114.8
120	G	27.9	Very low	26.9	Very low	78 Å²	78	143.4 Å²	143.4	80%	0.804	82%	0.816	S	S	*	*			trans	-165.5	133.6	170.4	0	0	0	0	0	112.6
121	N	26.9	Very low	27	Very low	171 Å²	171	138.8 Å²	138.8	91%	0.914	82%	0.815	S	S	*	*			trans	-110.8	152.2	-173.8	-82.5	-64.5	0	0	0	113.2
122	G	27.2	Very low	27.1	Very low	75 Å²	75	138.8 Å²	138.8	77%	0.773	82%	0.817	S	S	*	*			trans	-162.2	151.6	168.9	0	0	0	0	0	112.5
123	K	28.4	Very low	27.3	Very low	193 Å²	193	134.1 Å²	134.1	84%	0.839	81%	0.809	S	S	*	*			trans	-144	133.9	-168.1	-72.5	176.1	176.6	171.4	0	115.6
124	R	26	Very low	27.3	Very low	225 Å²	225	135.5 Å²	135.5	85%	0.849	81%	0.809	S	S	*	*			trans	58.4	171.1	150.9	-58.9	-178.4	173.8	-179.2	-3.8	115.7
125	I	26.7	Very low	27.4	Very low	147 Å²	147	136.3 Å²	136.3	75%	0.754	81%	0.805	S	S	*	*			cis	-151.3	123.9	29	-67.4	173.1	0	0	0	107.7
126	I	26.3	Very low	27.6	Very low	135 Å²	135	133.7 Å²	133.7	69%	0.692	80%	0.795	S	S	*	*				63.8	113.9	91.9	-52.3	165	0	0	0	119	T128	I126-T128 HydrophobicContact CG2-CG2 4.34Å
127	S	29.4	Very low	27.5	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	80%	0.796	S	S	*	*			trans	-168.7	123.9	138.9	42.6	0	0	0	0	108.5
128	T	27.4	Very low	27.6	Very low	122 Å²	122	136.5 Å²	136.5	75%	0.748	78%	0.783	S	S	*	*				73.6	141.3	59.6	68.7	0	0	0	0	113.4	I126	I126-T128 HydrophobicContact CG2-CG2 4.34Å
129	V	26.7	Very low	27.3	Very low	131 Å²	131	135.7 Å²	135.7	79%	0.794	78%	0.778	S	S	*	*			cis	-154.6	138.1	24	176.9	0	0	0	0	112.8
130	K	25.9	Very low	27.2	Very low	208 Å²	208	138.3 Å²	138.3	90%	0.904	78%	0.777	S	S	*	*				-179.9	149.4	125.5	-115.4	171.2	-180	173.5	0	112.5
131	A	25.8	Very low	26.9	Very low	101 Å²	101	141.1 Å²	141.1	84%	0.835	77%	0.772	S	S	*	*			trans	-163.2	147.8	-174.5	0	0	0	0	0	114.5
132	S	28.8	Very low	26.8	Very low	116 Å²	116	140.8 Å²	140.8	81%	0.811	77%	0.769	S	S	*	*			trans	-173.1	136	157.2	50.9	0	0	0	0	109.4
133	S	30.3	Very low	26.6	Very low	96 Å²	96	144.2 Å²	144.2	67%	0.671	76%	0.764	S	S	*	*			cis	-169.3	131.3	-7.6	47.4	0	0	0	0	112.7
134	L	29.5	Very low	26.6	Very low	154 Å²	154	140.4 Å²	140.4	81%	0.806	76%	0.759	S	S	*	*			trans	67.2	138.3	141.8	-60.4	171.2	0	0	0	119.9
135	N	29.8	Very low	26.5	Very low	125 Å²	125	135.6 Å²	135.6	67%	0.668	75%	0.75	S	S	*	*			cis	-161.4	127.4	-14.3	-146.3	0.2	0	0	0	114.5
136	T	28.6	Very low	26.3	Very low	108 Å²	108	134.2 Å²	134.2	66%	0.663	75%	0.754	S	S	*	*			trans	24.2	155.1	142.5	63.2	0	0	0	0	123
137	R	26.8	Very low	26.2	Very low	223 Å²	223	135.9 Å²	135.9	84%	0.842	76%	0.761	S	S	*	*			cis	-149	127.6	37.8	-74.7	176.8	177.6	175.9	-2.5	111.1
138	S	25.9	Very low	25.9	Very low	91 Å²	91	138.4 Å²	138.4	64%	0.636	76%	0.761	S	S	*	*				68.3	118.8	72.1	74.7	0	0	0	0	115
139	V	22.7	Very low	25.7	Very low	131 Å²	131	139 Å²	139	79%	0.794	76%	0.759	S	S	*	*			cis	75.8	132.7	44.2	-177.2	0	0	0	0	111
140	H	23.6	Very low	25.6	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.787	76%	0.756	S	S	*	*			cis	-141.6	-147.3	32.2	-147.9	-16.1	0	0	0	116
141	I	22	Very low	25.6	Very low	138 Å²	138	137.1 Å²	137.1	71%	0.708	75%	0.745	S	S	*	*			trans	-125.1	145	-166.8	-61.3	159.1	0	0	0	112
142	I	24.3	Very low	25.6	Very low	164 Å²	164	141.7 Å²	141.7	84%	0.841	75%	0.746	S	S	*	*			trans	-147.4	141.9	150.7	-56.4	-175.8	0	0	0	109.8
143	H	24	Very low	25.6	Very low	147 Å²	147	144.8 Å²	144.8	68%	0.681	75%	0.745	S	S	*	*			trans	-122.4	148.3	166.6	-150.5	-115.4	0	0	0	108.4	D145	H143-D145 IonicContact CE1-OD1 3.32Å; H143-D145 PolarHBondContact CE1-OD1 3.15Å; H143-D145 VanDerWaalsContact CE1-OD1 3.32Å; H143-D145 PolarHBondContact ND1-N 2.99Å; H143-D145 IonicContact ND1-OD1 2.64Å; H143-D145 PolarHBondContact ND1-OD1 3.09Å
144	P	28.2	Very low	25.4	Very low	113 Å²	113	146.6 Å²	146.6	73%	0.734	75%	0.747	S	S	*	*				-152.3	140.2	94.2	37.6	-18.3	0	0	0	117.9
145	D	23	Very low	25.3	Very low	123 Å²	123	145.1 Å²	145.1	66%	0.658	75%	0.745	S	S	*	*			trans	42.5	130.3	136.3	-55.1	7.4	0	0	0	124.6	H143	H143-D145 IonicContact CE1-OD1 3.32Å; H143-D145 PolarHBondContact CE1-OD1 3.15Å; H143-D145 VanDerWaalsContact CE1-OD1 3.32Å; H143-D145 PolarHBondContact ND1-N 2.99Å; H143-D145 IonicContact ND1-OD1 2.64Å; H143-D145 PolarHBondContact ND1-OD1 3.09Å
146	S	22.8	Very low	25.1	Very low	118 Å²	118	146.9 Å²	146.9	83%	0.825	75%	0.749	S	S	*	*			trans	101.2	151.8	141.6	80	0	0	0	0	121.7
147	M	24.8	Very low	24.9	Very low	170 Å²	170	149 Å²	149	84%	0.837	76%	0.756	S	S	*	*			trans	74.3	94.9	176.6	-73.5	-161.6	148.4	0	0	121.7
148	E	23.2	Very low	25	Very low	157 Å²	157	145.2 Å²	145.2	73%	0.734	75%	0.751	S	S	*	*				45.3	117.1	122.9	-67.1	-164.4	124.3	0	0	124.1
149	L	22.5	Very low	24.8	Very low	136 Å²	136	150 Å²	150	71%	0.712	76%	0.76	S	S	*	*				85.4	151.2	124.4	-71.5	171.4	0	0	0	123.8
150	F	25.4	Very low	25	Very low	167 Å²	167	154 Å²	154	73%	0.732	76%	0.763	S	S	*	*			trans	77	90.8	159.6	-80.4	-71.4	0	0	0	123.1
151	I	24.8	Very low	25.2	Very low	132 Å²	132	153.1 Å²	153.1	68%	0.677	76%	0.759	S	S	*	*				50.4	113.7	125.9	-59.9	-176.7	0	0	0	119.3
152	K	26.9	Very low	25.5	Very low	196 Å²	196	152.7 Å²	152.7	85%	0.852	76%	0.762	S	S	*	*				-177.3	152.5	98.6	-127.6	148.1	-170.5	174.1	0	116.4
153	K	27.8	Very low	25.5	Very low	182 Å²	182	150.4 Å²	150.4	79%	0.791	76%	0.76	S	S	*	*			trans	-30.6	133.7	174.8	-70.4	179.6	169.3	-175.8	0	121.1
154	N	26.2	Very low	25.7	Very low	134 Å²	134	154.4 Å²	154.4	72%	0.717	77%	0.769	S	S	*	*				62.8	135.9	126.1	-64.8	22.6	0	0	0	124
155	T	28.3	Very low	25.6	Very low	122 Å²	122	154.3 Å²	154.3	75%	0.748	77%	0.767	S	S	*	*			trans	63.2	145.7	142.8	50.2	0	0	0	0	119.9
156	Q	25.6	Very low	25.7	Very low	163 Å²	163	153.2 Å²	153.2	76%	0.762	77%	0.769	S	S	*	*			cis	-177.9	-176.6	-26.4	-130.5	-172.3	9.3	0	0	106.6
157	L	24.1	Very low	25.9	Very low	153 Å²	153	153.7 Å²	153.7	80%	0.801	77%	0.766	S	S	*	*			trans	74.6	158.9	172.4	-49.7	171.8	0	0	0	115
158	L	28.2	Very low	25.9	Very low	142 Å²	142	156.2 Å²	156.2	74%	0.743	77%	0.766	S	S	*	*			cis	-126.6	162.4	10.4	-93	89.6	0	0	0	114.1
159	K	23.4	Very low	26.1	Very low	192 Å²	192	160.3 Å²	160.3	84%	0.835	78%	0.775	S	S	*	*			trans	-101.1	153.7	153.5	-67.4	178.9	175.8	-179.8	0	109.7
160	Y	27	Very low	26	Very low	216 Å²	216	164.5 Å²	164.5	85%	0.847	78%	0.781	S	S	*	*			trans	-83.6	127.7	159.6	-81.5	-102.3	0	0	0	108.3
161	H	27.4	Very low	26.5	Very low	151 Å²	151	161.5 Å²	161.5	70%	0.699	78%	0.779	S	S	*	*				67	135.3	76.5	-75	-42.9	0	0	0	113.4
162	T	26.6	Very low	26.5	Very low	128 Å²	128	161.6 Å²	161.6	79%	0.785	78%	0.781	S	S	*	*			cis	-146.7	150.6	44	40.1	0	0	0	0	116.7
163	C	25.8	Very low	26.6	Very low	116 Å²	116	162.4 Å²	162.4	78%	0.784	78%	0.784	S	S	*	*			trans	142.8	104.4	151	-75.9	0	0	0	0	109.5
164	R	27.1	Very low	26.4	Very low	231 Å²	231	160.2 Å²	160.2	87%	0.872	79%	0.79	S	S	*	*				66.7	124.9	57.9	-77.1	-159.8	167.7	176	-3.2	113.9
165	T	27.7	Very low	26.4	Very low	112 Å²	112	157.6 Å²	157.6	69%	0.687	80%	0.795	S	S	*	*			cis	-160.3	134.5	-5.1	-8.8	0	0	0	0	114.8
166	S	24.2	Very low	26.2	Very low	100 Å²	100	160.9 Å²	160.9	70%	0.699	80%	0.801	S	S	*	*			trans	41.4	139.4	138.9	65.8	0	0	0	0	124.3
167	V	27.4	Very low	26.1	Very low	127 Å²	127	161.1 Å²	161.1	77%	0.77	80%	0.804	S	S	*	*				-166.8	132.1	111.4	139.5	0	0	0	0	113.7
168	R	24.8	Very low	26.1	Very low	223 Å²	223	158 Å²	158	84%	0.842	80%	0.795	S	S	*	*			trans	14.3	136.4	153.8	-46.5	169.9	174.6	167.1	-4.6	119.2
169	R	26.4	Very low	26	Very low	244 Å²	244	157.4 Å²	157.4	92%	0.921	80%	0.797	S	S	*	*				-163.7	164.6	54	-79.6	-176.6	166.4	150.2	-4.1	114.4
170	R	21.5	Very low	26	Very low	223 Å²	223	157.2 Å²	157.2	84%	0.842	80%	0.797	S	S	*	*			trans	-105.1	-175.6	159.7	-85.6	-169.2	-176.7	180	1.6	109
171	P	36.1	Very low	26	Very low	104 Å²	104	153.3 Å²	153.3	68%	0.675	79%	0.79	S	S	*	*			cis	-143.8	167.5	13.4	34.7	-10.5	0	0	0	120.1
172	D	24.4	Very low	25.8	Very low	135 Å²	135	155 Å²	155	72%	0.722	80%	0.796	S	S	*	*			trans	38.2	134.6	136.4	-42	-20.5	0	0	0	124.7
173	K	28.2	Very low	25.7	Very low	212 Å²	212	157 Å²	157	92%	0.922	80%	0.8	S	S	*	*				-161.2	154	126.1	-113.7	175.1	-174.3	179.7	0	113
174	C	23.1	Very low	25.6	Very low	137 Å²	137	155 Å²	155	93%	0.926	79%	0.793	S	S	*	*			trans	-102.7	160.3	-175.6	-55.2	0	0	0	0	113.3
175	G	26.5	Very low	25.5	Very low	78 Å²	78	156 Å²	156	80%	0.804	80%	0.797	S	S	*	*			trans	-164	150.3	170.6	0	0	0	0	0	111.5
176	H	24.7	Very low	25.4	Very low	191 Å²	191	154.6 Å²	154.6	88%	0.884	79%	0.791	S	S	*	*			trans	-132.7	171.6	-166.8	-126.8	-83.9	0	0	0	112.4
177	M	24.1	Very low	25.6	Very low	169 Å²	169	161.4 Å²	161.4	83%	0.833	80%	0.801	S	S	*	*			trans	86.4	176.2	165	-56.7	-137.1	67.6	0	0	118
178	S	24.4	Very low	25.7	Very low	86 Å²	86	161.5 Å²	161.5	60%	0.601	80%	0.797	S	S	*	*			trans	-142.3	167.2	-135.6	58.9	0	0	0	0	116.1
179	T	24.3	Very low	25.9	Very low	130 Å²	130	158.8 Å²	158.8	80%	0.798	80%	0.8	S	S	*	*			trans	74.1	129.7	157.2	44.8	0	0	0	0	120.8
180	K	25.1	Very low	25.8	Very low	188 Å²	188	152.3 Å²	152.3	82%	0.817	79%	0.787	S	S	*	*			trans	86.8	101.9	160.3	-67.7	-176.5	176.8	-179.3	0	120.5
181	N	26.5	Very low	26	Very low	134 Å²	134	150.5 Å²	150.5	72%	0.717	79%	0.788	S	S	*	*				84.7	104.5	126	-66.6	18.9	0	0	0	122.2
182	F	22	Very low	25.4	Very low	188 Å²	188	152.7 Å²	152.7	83%	0.825	79%	0.794	S	S	*	*				58.5	109.2	116.1	-90.9	-79.2	0	0	0	120.9
183	I	25.2	Very low	25.2	Very low	168 Å²	168	157.2 Å²	157.2	86%	0.862	80%	0.802	S	S	*	*				-177.5	162.6	98.4	-97.2	162.7	0	0	0	112.5
184	A	24.3	Very low	24.9	Very low	76 Å²	76	152.3 Å²	152.3	63%	0.628	80%	0.795	S	S	*	*			trans	-83.3	162.6	-162.5	0	0	0	0	0	117.8
185	W	25.5	Very low	25	Very low	252 Å²	252	151.8 Å²	151.8	96%	0.955	79%	0.787	S	S	*	*				-157.3	129.8	121.1	-96.8	11.8	0	0	0	107.9
186	S	25.2	Very low	24.8	Very low	82 Å²	82	156.5 Å²	156.5	57%	0.573	79%	0.786	S	S	*	*			cis	102.3	100.9	15	79.6	0	0	0	0	116
187	R	28.1	Very low	24.6	Very low	242 Å²	242	153.4 Å²	153.4	91%	0.913	78%	0.784	S	S	*	*			trans	-177.5	144	152.4	-103.6	176.6	-177.1	-170.7	0.6	109.3
188	N	29	Very low	24.5	Very low	129 Å²	129	153 Å²	153	69%	0.69	78%	0.778	S	S	*	*			cis	-164.2	128.1	-36.8	-118.6	21.4	0	0	0	108.7
189	N	28.5	Very low	24.4	Very low	167 Å²	167	154 Å²	154	89%	0.893	78%	0.776	S	S	*	*			trans	-172	148.4	139.1	-103.5	-4.8	0	0	0	109.7
190	T	24.5	Very low	24.4	Very low	107 Å²	107	155.1 Å²	155.1	66%	0.656	77%	0.77	S	S	*	*			trans	-149.9	122	-155.3	49.2	0	0	0	0	114.1
191	Q	27.1	Very low	24.2	Very low	185 Å²	185	155 Å²	155	86%	0.864	77%	0.771	S	S	*	*			trans	-164	114	144	-102	165.6	15.1	0	0	104.5
192	L	22.4	Very low	24	Very low	151 Å²	151	159.9 Å²	159.9	79%	0.791	78%	0.779	S	S	*	*			cis	64.7	75	46	-76.7	171.8	0	0	0	114.9
193	Y	21	Very low	24.1	Very low	229 Å²	229	156.1 Å²	156.1	90%	0.898	77%	0.766	S	S	*	*			trans	-139.7	101.6	142.7	-98.2	-81.3	0	0	0	110.4
194	S	21.4	Very low	24.1	Very low	109 Å²	109	156.2 Å²	156.2	76%	0.762	77%	0.767	S	S	*	*			trans	-167	117	148.6	32.6	0	0	0	0	111.9
195	V	25	Very low	24.2	Very low	126 Å²	126	159.5 Å²	159.5	76%	0.764	77%	0.769	S	S	*	*			trans	36.7	121.7	140.2	-173.6	0	0	0	0	119
196	F	21.9	Very low	24.2	Very low	177 Å²	177	157.3 Å²	157.3	78%	0.776	77%	0.766	S	S	*	*			trans	-156.7	114.8	133.7	-112.9	-72.2	0	0	0	113.4	F198	F196-F198 AromaticContact CD1-CD2 3.83Å; F196-F198 HydrophobicContact CD1-CD2 3.83Å; F196-F198 HydrophobicContact CD1-CE2 4.04Å; F196-F198 AromaticContact CE1-CD2 3.55Å; F196-F198 HydrophobicContact CE1-CD2 3.55Å; F196-F198 AromaticContact CE1-CE2 3.38Å; F196-F198 HydrophobicContact CE1-CE2 3.38Å; F196-F198 HydrophobicContact CE1-CG 4.35Å; F196-F198 HydrophobicContact CE1-CZ 4.06Å; F196-F198 HydrophobicContact CZ-CE2 4.12Å
197	C	21.6	Very low	24.3	Very low	126 Å²	126	164.2 Å²	164.2	85%	0.851	78%	0.779	S	S	*	*			trans	-156	110.5	147.7	-134.7	0	0	0	0	110.1
198	F	22.2	Very low	24.2	Very low	161 Å²	161	160.8 Å²	160.8	71%	0.706	78%	0.778	S	S	*	*			trans	-84.2	178.7	170.7	-86.1	-139.6	0	0	0	108.7	F196	F196-F198 AromaticContact CD1-CD2 3.83Å; F196-F198 HydrophobicContact CD1-CD2 3.83Å; F196-F198 HydrophobicContact CD1-CE2 4.04Å; F196-F198 AromaticContact CE1-CD2 3.55Å; F196-F198 HydrophobicContact CE1-CD2 3.55Å; F196-F198 AromaticContact CE1-CE2 3.38Å; F196-F198 HydrophobicContact CE1-CE2 3.38Å; F196-F198 HydrophobicContact CE1-CG 4.35Å; F196-F198 HydrophobicContact CE1-CZ 4.06Å; F196-F198 HydrophobicContact CZ-CE2 4.12Å
199	D	21.6	Very low	24.1	Very low	106 Å²	106	160 Å²	160	57%	0.567	78%	0.78	S	S	*	*			cis	-168.4	172.1	31.9	-156.6	0	0	0	0	114.4
200	K	24.1	Very low	24	Very low	154 Å²	154	157.5 Å²	157.5	67%	0.67	77%	0.774	S	S	*	*			trans	69.3	92.2	154.1	-77.6	161.4	-177.7	109	0	122.7
201	F	21.9	Very low	24.2	Very low	187 Å²	187	158 Å²	158	82%	0.82	78%	0.779	S	S	*	*				17.1	131	122.8	-81.6	-93.7	0	0	0	121.7	I203	F201-I203 HydrophobicContact CD1-CG1 4.38Å
202	R	22.1	Very low	24.1	Very low	236 Å²	236	159.4 Å²	159.4	89%	0.891	78%	0.778	S	S	*	*				-161.5	104.2	111.1	-127.9	-178.4	179.9	178.5	0.3	116.5
203	I	23.4	Very low	24.2	Very low	109 Å²	109	158.1 Å²	158.1	56%	0.559	78%	0.78	S	S	*	*				29	124.8	129.2	-55.3	166.4	0	0	0	119.5	F201	F201-I203 HydrophobicContact CD1-CG1 4.38Å
204	I	26.4	Very low	24.5	Very low	170 Å²	170	151.9 Å²	151.9	87%	0.872	77%	0.771	S	S	*	*				-145.1	144.9	118.9	-100.7	165	0	0	0	108.9
205	H	24.4	Very low	24.8	Very low	145 Å²	145	153 Å²	153	67%	0.671	77%	0.773	S	S	*	*			trans	-93	152.3	-173.8	-67.7	-98.6	0	0	0	113.7
206	K	27.5	Very low	24.9	Very low	206 Å²	206	152.9 Å²	152.9	90%	0.896	78%	0.776	S	S	*	*				-165.8	105.2	112.6	-105.4	167.8	-176.6	179.7	0	115.1
207	R	25.9	Very low	25	Very low	227 Å²	227	149.5 Å²	149.5	86%	0.857	78%	0.775	S	S	*	*			trans	4.9	120.3	152.8	-61.7	176.4	179.8	170.3	-1.3	119.3
208	L	26.1	Very low	25.3	Very low	170 Å²	170	151 Å²	151	89%	0.89	77%	0.769	S	S	*	*				-78.9	161.6	123.1	-80.4	163	0	0	0	109.4
209	P	26.6	Very low	25.6	Very low	113 Å²	113	149 Å²	149	73%	0.734	76%	0.761	S	S	*	*				-143.6	137.7	121.8	35.7	-21.5	0	0	0	114.4
210	C	26.8	Very low	25.9	Very low	113 Å²	113	151.7 Å²	151.7	76%	0.764	77%	0.768	S	S	*	*			trans	-105.7	145.7	152.5	-178.1	0	0	0	0	107.8
211	P	29.3	Very low	26.1	Very low	118 Å²	118	155 Å²	155	77%	0.766	78%	0.776	S	S	*	*			trans	-141.8	162.1	136	37.2	-24	0	0	0	113.8
212	Y	24.8	Very low	26.3	Very low	214 Å²	214	157.4 Å²	157.4	84%	0.839	78%	0.78	S	S	*	*			trans	-119	160	172	-114.3	-91.9	0	0	0	110.9
213	C	23.8	Very low	26.6	Very low	124 Å²	124	149.8 Å²	149.8	84%	0.838	77%	0.768	S	S	*	*			trans	69.1	150.8	175.9	-58.1	0	0	0	0	115.7
214	S	27.6	Very low	26.8	Very low	99 Å²	99	154 Å²	154	69%	0.692	78%	0.782	S	S	*	*			cis	-144.5	140.7	10.5	56.9	0	0	0	0	114.2
215	T	28.7	Very low	26.7	Very low	132 Å²	132	152 Å²	152	81%	0.81	77%	0.773	S	S	*	*			trans	36.1	133.3	146.4	54.9	0	0	0	0	123.4
216	C	25.4	Very low	26.8	Very low	123 Å²	123	152.7 Å²	152.7	83%	0.831	78%	0.776	S	S	*	*			trans	-17.7	150.8	151.1	-63.6	0	0	0	0	118.3
217	S	25.9	Very low	26.8	Very low	107 Å²	107	147.3 Å²	147.3	75%	0.748	76%	0.764	S	S	*	*			cis	-170	-164	-1.9	49.6	0	0	0	0	108.1
218	H	27	Very low	26.7	Very low	156 Å²	156	141.3 Å²	141.3	72%	0.722	76%	0.758	S	S	*	*			cis	-167.2	-174.6	12.5	-160.8	35.1	0	0	0	112.8
219	H	28.7	Very low	26.8	Very low	119 Å²	119	144 Å²	144	55%	0.551	76%	0.758	S	S	*	*			trans	80.1	118	150.9	-100.1	7.1	0	0	0	123.7
220	K	27.1	Very low	26.9	Very low	163 Å²	163	144.2 Å²	144.2	71%	0.709	76%	0.756	S	S	*	*			trans	73.2	131.2	142.6	-70.6	157.8	-179.9	161	0	116.5
221	R	28.2	Very low	26.8	Very low	224 Å²	224	147.3 Å²	147.3	85%	0.845	76%	0.764	S	S	*	*			cis	-153.1	147.8	17.7	-106.3	163.5	-175.7	-176.9	2.2	112.4
222	R	26.2	Very low	26.7	Very low	238 Å²	238	145.5 Å²	145.5	90%	0.898	77%	0.768	S	S	*	*			trans	31	146.2	130.4	-70	-176.6	179.3	178.5	-1.5	121.1
223	A	28.3	Very low	26.8	Very low	76 Å²	76	139 Å²	139	63%	0.628	77%	0.765	S	S	*	*			cis	-174.3	179	-1.6	0	0	0	0	0	113.7
224	F	27.9	Very low	26.9	Very low	197 Å²	197	138 Å²	138	86%	0.864	76%	0.759	S	S	*	*			trans	106.1	141.6	153.3	-78.5	-72.4	0	0	0	122.3
225	N	24.8	Very low	26.8	Very low	127 Å²	127	139.4 Å²	139.4	68%	0.679	76%	0.759	S	S	*	*			trans	-86.9	-178.8	-172	-47.7	-11.9	0	0	0	111.2
226	H	26.8	Very low	26.8	Very low	161 Å²	161	144.9 Å²	144.9	75%	0.745	77%	0.767	S	S	*	*			cis	-172.5	168.1	43.1	-119.5	-64.9	0	0	0	113.8
227	S	27.6	Very low	26.7	Very low	92 Å²	92	146.1 Å²	146.1	64%	0.643	76%	0.764	S	S	*	*			trans	61.7	96.1	145.2	63.1	0	0	0	0	124.1
228	S	23.9	Very low	26.6	Very low	102 Å²	102	145.3 Å²	145.3	71%	0.713	76%	0.759	S	S	*	*				19.2	126	119.4	59.2	0	0	0	0	123.3
229	Y	28.1	Very low	26.6	Very low	227 Å²	227	146.9 Å²	146.9	89%	0.89	77%	0.766	S	S	*	*			trans	-152.6	-177.1	141.9	-93.3	-88.8	0	0	0	109
230	V	27.5	Very low	26.3	Very low	117 Å²	117	145.9 Å²	145.9	71%	0.709	77%	0.773	S	S	*	*				-175	126.7	-85.7	149	0	0	0	0	109.9
231	L	25.1	Very low	26.4	Very low	177 Å²	177	147.8 Å²	147.8	93%	0.927	78%	0.784	S	S	*	*			trans	16.7	135.6	165.9	-78.3	130.1	0	0	0	123.7
232	G	26.8	Very low	26.2	Very low	81 Å²	81	142.7 Å²	142.7	84%	0.835	78%	0.778	S	S	*	*			trans	140.8	140.2	154.8	0	0	0	0	0	114
233	G	26.4	Very low	26.1	Very low	76 Å²	76	141.6 Å²	141.6	78%	0.784	78%	0.78	S	S	*	*			cis	167.9	149.7	-12.1	0	0	0	0	0	114.4
234	S	27	Very low	26.1	Very low	103 Å²	103	142.7 Å²	142.7	72%	0.72	78%	0.781	S	S	*	*			trans	71.5	107.4	156	-172.3	0	0	0	0	122.7
235	N	24.8	Very low	25.8	Very low	130 Å²	130	139.7 Å²	139.7	70%	0.695	77%	0.774	S	S	*	*				46.6	130.2	125.1	-48.5	-17.5	0	0	0	123
236	Y	28.7	Very low	26	Very low	246 Å²	246	141.5 Å²	141.5	97%	0.965	78%	0.783	S	S	*	*				-143.9	159.3	127.2	-102.9	-76.9	0	0	0	110.2
237	L	24	Very low	25.7	Very low	149 Å²	149	139.7 Å²	139.7	78%	0.78	78%	0.778	S	S	*	*			trans	-113.8	150.8	-166.3	-116.7	86.4	0	0	0	114.5
238	S	23.4	Very low	25.5	Very low	90 Å²	90	140 Å²	140	63%	0.629	78%	0.78	S	S	*	*			trans	33.3	127.5	148	64.1	0	0	0	0	121.3
239	H	27.5	Very low	25.6	Very low	189 Å²	189	145.9 Å²	145.9	88%	0.875	79%	0.793	S	S	*	*				-148.5	155	117.1	-115.4	-73.3	0	0	0	112.1
240	S	22.8	Very low	25.2	Very low	99 Å²	99	146.5 Å²	146.5	69%	0.692	79%	0.794	S	S	*	*			trans	-91.8	148.6	-175	48.3	0	0	0	0	113.4
241	Q	28.3	Very low	25.1	Very low	202 Å²	202	152.2 Å²	152.2	94%	0.944	80%	0.803	S	S	*	*			trans	-147.9	147.4	144.3	-115.5	175.4	23.1	0	0	111.3
242	T	23.5	Very low	24.9	Very low	118 Å²	118	149.7 Å²	149.7	72%	0.724	80%	0.799	S	S	*	*			trans	-105	139.8	-168	48.6	0	0	0	0	112.5
243	F	25.7	Very low	24.7	Very low	214 Å²	214	151.4 Å²	151.4	94%	0.939	80%	0.797	S	S	*	*			trans	-149.9	127.2	145.3	-98.4	-72	0	0	0	110.3
244	P	26.9	Very low	24.4	Very low	99 Å²	99	153 Å²	153	64%	0.643	80%	0.796	S	S	*	*			trans	-104.1	170	-175.8	39.8	-35.6	0	0	0	113.9
245	N	22.5	Very low	24.3	Very low	134 Å²	134	158.2 Å²	158.2	72%	0.717	80%	0.801	S	S	*	*			trans	58.3	128.1	156.8	-64.4	0.5	0	0	0	119.7
246	L	28.1	Very low	24.1	Very low	165 Å²	165	159.1 Å²	159.1	86%	0.864	81%	0.806	S	S	*	*				-158	118.3	117.1	-110.1	169	0	0	0	111.8
247	L	21.9	Very low	24	Very low	123 Å²	123	155.6 Å²	155.6	64%	0.644	80%	0.796	S	S	*	*			trans	-76.8	175.1	157.9	-100.2	80.1	0	0	0	110.3	F936	L247-F936 HydrophobicContact CD2-CE2 3.71Å; L247-F936 HydrophobicContact CD2-CZ 4.33Å
248	S	22.7	Very low	23.8	Very low	99 Å²	99	154.5 Å²	154.5	69%	0.692	80%	0.796	S	S	*	*			trans	81.7	114.5	164.1	80.7	0	0	0	0	117.7
249	F	25	Very low	23.9	Very low	225 Å²	225	158.9 Å²	158.9	99%	0.987	80%	0.803	S	S	*	*			trans	-122.2	66.6	147.9	-114.1	-83.1	0	0	0	109.4
250	R	20.9	Very low	23.6	Very low	241 Å²	241	157 Å²	157	91%	0.909	79%	0.794	S	S	*	*			trans	-111	106	165.2	-136	-167.3	-167.5	-156.6	5.3	107.5
251	R	24.7	Very low	23.7	Very low	236 Å²	236	160.4 Å²	160.4	89%	0.891	80%	0.801	S	S	*	*			trans	-153	99.8	165.5	-118.3	174.5	-169.3	178.7	4.2	112
252	C	20.4	Very low	23.3	Very low	125 Å²	125	155.8 Å²	155.8	85%	0.845	78%	0.783	S	S	*	*			trans	-66.8	134.8	144.3	-61.9	0	0	0	0	107.6
253	C	23.5	Very low	23.2	Very low	117 Å²	117	159 Å²	159	79%	0.791	79%	0.788	S	S	*	*			trans	-164	134.7	140.7	-99.7	0	0	0	0	109
254	S	20.5	Very low	23	Very low	109 Å²	109	155.3 Å²	155.3	76%	0.762	78%	0.783	S	S	*	*			trans	-68.3	147.2	169.9	41.5	0	0	0	0	110.8
255	Y	25.5	Very low	22.9	Very low	212 Å²	212	155.1 Å²	155.1	83%	0.831	78%	0.784	S	S	*	*			trans	-139.6	112.1	154	-103.9	-79.3	0	0	0	109.6
256	N	20.2	Very low	23.1	Very low	149 Å²	149	153.5 Å²	153.5	80%	0.797	78%	0.783	S	S	*	*			trans	-67.6	132.8	162.9	-75.8	-24.5	0	0	0	108.3
257	F	25.3	Very low	22.8	Very low	173 Å²	173	153 Å²	153	76%	0.759	78%	0.781	S	S	*	*			trans	-127.5	78.8	161.7	-123.9	-70.7	0	0	0	110.3	K259	F257-K259 PolarHBondContact O-N 2.97Å
258	T	20.9	Very low	23	Very low	126 Å²	126	155.3 Å²	155.3	77%	0.773	79%	0.792	S	S	*	*			trans	-60.8	113	161.2	44.2	0	0	0	0	109.1
259	K	25.3	Very low	22.9	Very low	181 Å²	181	157.7 Å²	157.7	79%	0.787	80%	0.797	S	S	*	*			trans	-125.5	119	155.3	-96.3	-168.9	171.8	-175.6	0	109.3	F257	F257-K259 PolarHBondContact O-N 2.97Å
260	H	21.7	Very low	22.8	Very low	149 Å²	149	153.5 Å²	153.5	69%	0.69	79%	0.79	S	S	*	*			trans	-55.4	136.8	163.7	-81.2	-109.4	0	0	0	110.3	D262	H260-D262 IonicContact CE1-OD2 2.77Å; H260-D262 IonicContact CG-OD2 2.87Å; H260-D262 IonicContact ND1-OD1 2.69Å; H260-D262 IonicContact ND1-OD2 3.19Å; H260-D262 PolarHBondContact ND1-OD2 3.39Å
261	M	23.5	Very low	23	Very low	171 Å²	171	147.1 Å²	147.1	84%	0.842	78%	0.782	S	S	*	*			trans	-141.5	90.6	142.7	-101.5	-64.2	172.5	0	0	106.3
262	D	20.1	Very low	22.8	Very low	106 Å²	106	141.1 Å²	141.1	57%	0.567	78%	0.776	S	S	*	*			trans	-69.2	127.4	178	-58.7	-85.8	0	0	0	110.1	H260	H260-D262 IonicContact CE1-OD2 2.77Å; H260-D262 IonicContact CG-OD2 2.87Å; H260-D262 IonicContact ND1-OD1 2.69Å; H260-D262 IonicContact ND1-OD2 3.19Å; H260-D262 PolarHBondContact ND1-OD2 3.39Å
263	F	22.7	Very low	23	Very low	185 Å²	185	143.2 Å²	143.2	81%	0.811	78%	0.777	S	S	*	*			trans	-132.6	83.5	164.1	-95.6	-76	0	0	0	109.6
264	T	19.9	Very low	22.9	Very low	137 Å²	137	148.4 Å²	148.4	84%	0.84	78%	0.78	S	S	*	*			trans	-100.4	96.2	174.9	37.9	0	0	0	0	110.8
265	S	26.4	Very low	23	Very low	94 Å²	94	150.7 Å²	150.7	66%	0.657	78%	0.783	S	S	*	*			trans	-152.9	96.3	165.3	54.2	0	0	0	0	107.7
266	S	25.5	Very low	22.8	Very low	100 Å²	100	146.4 Å²	146.4	70%	0.699	78%	0.783	S	S	*	*				85.7	107.2	76.9	68.3	0	0	0	0	112.4
267	D	21.9	Very low	23.4	Very low	154 Å²	154	144.7 Å²	144.7	82%	0.824	78%	0.779	S	S	*	*			trans	34.5	129	144.8	-48.6	-38.5	0	0	0	120.9
268	I	25.6	Very low	23.3	Very low	173 Å²	173	147.4 Å²	147.4	89%	0.887	78%	0.784	S	S	*	*				-150.4	142.3	119.1	-105	153.9	0	0	0	110
269	L	22	Very low	23.3	Very low	149 Å²	149	152 Å²	152	78%	0.78	79%	0.79	S	S	*	*			trans	-93.2	154.2	-177.2	-84.3	158.9	0	0	0	112
270	T	22.4	Very low	23.2	Very low	137 Å²	137	148.6 Å²	148.6	84%	0.84	79%	0.787	S	S	*	*			trans	64	161.9	160.5	60.8	0	0	0	0	116.6
271	S	24.3	Very low	23.3	Very low	106 Å²	106	151.2 Å²	151.2	74%	0.741	79%	0.791	S	S	*	*			cis	-142.3	170.7	4.9	56	0	0	0	0	112.5
272	S	21	Very low	23.3	Very low	110 Å²	110	151.1 Å²	151.1	77%	0.769	78%	0.781	S	S	*	*			trans	-63.6	151	171.2	54.9	0	0	0	0	115.1
273	I	24.4	Very low	23.7	Very low	169 Å²	169	153.8 Å²	153.8	87%	0.867	79%	0.794	S	S	*	*			trans	-153	157.9	151.5	-105.8	152.3	0	0	0	110.2
274	R	21	Very low	23.8	Very low	227 Å²	227	149.9 Å²	149.9	86%	0.857	78%	0.781	S	S	*	*			trans	-104	175.3	-176	-63.7	179	177.7	178.1	-1.3	112.4
275	L	22.8	Very low	24.1	Very low	157 Å²	157	151.2 Å²	151.2	82%	0.822	78%	0.783	S	S	*	*			trans	98.9	104	155.3	-58.6	166.6	0	0	0	118.7
276	C	21.1	Very low	24.1	Very low	122 Å²	122	151.6 Å²	151.6	82%	0.824	79%	0.786	S	S	*	*				58.1	158.3	115.5	-68.8	0	0	0	0	122.4
277	P	34.2	Very low	24.1	Very low	112 Å²	112	153 Å²	153	73%	0.727	79%	0.79	S	S	*	*			trans	-121.9	-176	-137.4	44.1	-34.9	0	0	0	117.4
278	R	21.6	Very low	24.2	Very low	230 Å²	230	149 Å²	149	87%	0.868	79%	0.785	S	S	*	*			trans	86	115	172.7	-60.2	179.3	171.6	-179.2	-2.6	116.3
279	Y	22.4	Very low	24	Very low	224 Å²	224	147.1 Å²	147.1	88%	0.878	78%	0.782	S	S	*	*				-160.9	165.6	96.4	-123.5	-95.3	0	0	0	112.4
280	C	22.5	Very low	24	Very low	108 Å²	108	147 Å²	147	73%	0.73	79%	0.787	S	S	*	*			trans	-119.5	174.8	-178.1	-64.1	0	0	0	0	112.1
281	R	23.9	Very low	24	Very low	205 Å²	205	145 Å²	145	77%	0.774	77%	0.774	S	S	*	*			trans	79	152.4	169	-61	-175.9	169.7	172.8	0.5	115
282	R	24.2	Very low	23.9	Very low	168 Å²	168	149.5 Å²	149.5	63%	0.634	78%	0.781	S	S	*	*			cis	-160.8	164.3	-4.9	-126.5	173.9	-173.7	166.7	-2.1	109.7
283	I	27.5	Very low	24	Very low	163 Å²	163	147.7 Å²	147.7	84%	0.836	78%	0.779	S	S	*	*			trans	169.9	150.6	131.4	-92.9	154.7	0	0	0	108.7
284	N	24.8	Very low	24	Very low	102 Å²	102	151.4 Å²	151.4	55%	0.545	78%	0.783	S	S	.	*			cis	-177.1	151.4	-46.9	-114.9	15.3	0	0	0	107.4
285	N	26.6	Very low	24.3	Very low	166 Å²	166	146.8 Å²	146.8	89%	0.888	78%	0.782	S	S	*	*				-170.3	154.2	129.4	-95.4	-22.5	0	0	0	111.2
286	S	26.6	Very low	24.3	Very low	102 Å²	102	144.4 Å²	144.4	71%	0.713	78%	0.779	S	S	*	*			trans	-124	-176.3	-165.2	47.6	0	0	0	0	111.1
287	V	24.9	Very low	24.6	Very low	128 Å²	128	148.1 Å²	148.1	78%	0.776	78%	0.784	S	S	*	*				-173.1	148	65.8	168.7	0	0	0	0	107.3
288	G	24.3	Very low	24.1	Very low	70 Å²	70	148.8 Å²	148.8	72%	0.722	79%	0.786	S	S	*	*			cis	174.2	-158.3	6	0	0	0	0	0	114.5
289	T	22.4	Very low	24.3	Very low	135 Å²	135	145.6 Å²	145.6	83%	0.828	79%	0.785	S	S	*	*			trans	-112.8	160	-152.4	49.2	0	0	0	0	116.9
290	V	22.1	Very low	24.5	Very low	145 Å²	145	143.5 Å²	143.5	88%	0.879	78%	0.783	S	S	*	*			trans	-146	153.3	143.1	-170.8	0	0	0	0	110
291	T	21.9	Very low	24.5	Very low	95 Å²	95	141.8 Å²	141.8	58%	0.583	78%	0.783	S	S	*	*			trans	-126.3	172.7	-177.4	48.4	0	0	0	0	111.3
292	F	22.2	Very low	24.8	Very low	202 Å²	202	137.5 Å²	137.5	89%	0.886	78%	0.782	S	S	*	*			cis	-136.1	-156.3	20.6	-53.2	-99.2	0	0	0	110
293	G	22.6	Very low	24.7	Very low	71 Å²	71	135 Å²	135	73%	0.732	79%	0.785	S	S	*	*			cis	175.9	-156	9.7	0	0	0	0	0	113.3
294	R	24.6	Very low	24.6	Very low	247 Å²	247	136 Å²	136	93%	0.932	78%	0.783	S	S	*	*			trans	-139.2	152.8	169.3	-92.4	-172.6	175.7	179.9	-0.7	109
295	P	27.6	Very low	24.6	Very low	131 Å²	131	137.4 Å²	137.4	85%	0.851	79%	0.791	S	S	*	*				-140.3	-175.6	102.1	39.1	-25.4	0	0	0	114.2
296	S	22.5	Very low	24.5	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	78%	0.779	S	S	*	*			trans	-103.3	158.7	-176.2	51.1	0	0	0	0	113.3
297	E	28.2	Very low	24.4	Very low	199 Å²	199	134.2 Å²	134.2	93%	0.93	78%	0.778	S	S	*	*			trans	-156.3	163.5	144.7	-121.8	161.3	-138.4	0	0	112
298	T	22.1	Very low	24.5	Very low	126 Å²	126	135.4 Å²	135.4	77%	0.773	78%	0.779	S	S	*	*			trans	-130.5	154.1	-165.4	47.9	0	0	0	0	112.3
299	I	27	Very low	24.4	Very low	164 Å²	164	140.1 Å²	140.1	84%	0.841	79%	0.787	S	S	*	*			trans	-162.8	152.5	151.6	-103	146.2	0	0	0	110.6
300	E	26	Very low	24.9	Very low	180 Å²	180	138.2 Å²	138.2	84%	0.841	78%	0.777	S	S	*	*			trans	-65.9	171	-177.3	-54.7	111.4	168	0	0	113.2
301	G	23.1	Very low	24.9	Very low	71 Å²	71	139.4 Å²	139.4	73%	0.732	77%	0.773	S	S	*	*			cis	139.6	174.5	18.5	0	0	0	0	0	107.9
302	P	29.7	Very low	24.9	Very low	115 Å²	115	140.1 Å²	140.1	75%	0.747	78%	0.777	S	S	*	*			cis	-115.5	160.6	-4.6	41.7	-28.4	0	0	0	114
303	V	23.2	Very low	24.8	Very low	115 Å²	115	140.1 Å²	140.1	70%	0.697	77%	0.773	S	S	*	*				48.6	125.9	91.1	-152.2	0	0	0	0	113.6
304	F	24.8	Very low	24.8	Very low	184 Å²	184	142.4 Å²	142.4	81%	0.807	77%	0.768	S	S	*	*			cis	-137.8	172.2	36.2	-72.8	-100	0	0	0	112.2
305	D	25.2	Very low	24.6	Very low	132 Å²	132	137.8 Å²	137.8	71%	0.706	76%	0.76	S	S	*	*			cis	-146.7	176.8	-1.4	-144.2	-44.9	0	0	0	111.3
306	S	22.8	Very low	24.7	Very low	92 Å²	92	136.2 Å²	136.2	64%	0.643	75%	0.75	S	S	*	*			trans	-63.1	165.7	170.6	59.5	0	0	0	0	114.3
307	T	24.9	Very low	24.6	Very low	110 Å²	110	138.4 Å²	138.4	68%	0.675	75%	0.752	S	S	*	*			cis	-153.2	-179.1	35.5	54	0	0	0	0	114.1
308	N	27.6	Very low	24.4	Very low	152 Å²	152	137.7 Å²	137.7	81%	0.813	75%	0.746	S	S	*	*			trans	97	79.7	157.8	-58.5	-11.3	0	0	0	120.3
309	L	20.9	Very low	24.4	Very low	169 Å²	169	136.5 Å²	136.5	89%	0.885	74%	0.742	S	S	*	*			trans	-122.9	167	137.5	-82.5	166.7	0	0	0	106.3
310	P	34.5	Very low	24.2	Very low	95 Å²	95	133.5 Å²	133.5	62%	0.617	74%	0.736	S	S	*	*			cis	-139.5	-161.2	-32	38.9	-19.1	0	0	0	112.7
311	E	22	Very low	24.4	Very low	170 Å²	170	132.7 Å²	132.7	79%	0.794	73%	0.732	S	S	*	*			trans	76.5	130.6	144.5	-81.9	177	-150	0	0	124.6
312	V	20.7	Very low	24.5	Very low	110 Å²	110	138.1 Å²	138.1	67%	0.667	74%	0.736	S	S	*	*			trans	87	101	130.6	168.5	0	0	0	0	122.6
313	Y	21.6	Very low	24.2	Very low	203 Å²	203	140.5 Å²	140.5	80%	0.796	74%	0.741	S	S	*	*			trans	66.2	137.1	138.1	-75	-101.2	0	0	0	125.5
314	D	20.7	Very low	24.4	Very low	118 Å²	118	138.6 Å²	138.6	63%	0.631	75%	0.745	S	S	*	*			trans	63.3	103.5	141.1	-79.8	12.4	0	0	0	125
315	I	21.5	Very low	24.3	Very low	150 Å²	150	138.1 Å²	138.1	77%	0.769	75%	0.745	S	S	*	*			trans	42.7	170.8	131.1	27.6	172.4	0	0	0	122.4
316	P	29.4	Very low	24.3	Very low	98 Å²	98	137.4 Å²	137.4	64%	0.636	75%	0.748	S	S	*	*			cis	-136.6	161.1	-21.4	32.6	-12.4	0	0	0	117
317	I	20.8	Very low	24.4	Very low	153 Å²	153	138.7 Å²	138.7	79%	0.785	75%	0.752	S	S	*	*			trans	66.8	142.8	139.5	-68.8	168.1	0	0	0	121.8
318	K	23	Very low	24.5	Very low	185 Å²	185	139.1 Å²	139.1	80%	0.804	76%	0.759	S	S	*	*			trans	92.8	93.6	156.7	-93.4	168.9	-175.8	176.8	0	122.3
319	S	23	Very low	24.2	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	76%	0.763	S	S	*	*				63.6	117.6	117.9	67.9	0	0	0	0	122.5
320	S	23.8	Very low	24.3	Very low	101 Å²	101	139 Å²	139	71%	0.706	76%	0.756	S	S	*	*				148.2	160.2	95.2	64.1	0	0	0	0	115.3
321	Q	28.8	Very low	23.8	Very low	164 Å²	164	143.7 Å²	143.7	77%	0.766	77%	0.769	S	S	*	*			trans	74.6	112	168.6	-49.5	-159.8	35	0	0	115.8
322	K	24.9	Very low	23.9	Very low	185 Å²	185	143.3 Å²	143.3	80%	0.804	77%	0.771	S	S	*	*				73.6	139.9	88.4	-73.4	-179.8	173.6	-176.6	0	112.7
323	L	25.2	Very low	23.9	Very low	165 Å²	165	146.1 Å²	146.1	86%	0.864	78%	0.777	S	S	*	*			cis	-154.4	154.6	18	-162.2	78	0	0	0	110.8
324	G	26.3	Very low	24	Very low	75 Å²	75	145.6 Å²	145.6	77%	0.773	78%	0.778	S	S	*	*			trans	137.8	95.3	157.8	0	0	0	0	0	117.3
325	E	22.2	Very low	24.1	Very low	173 Å²	173	145.9 Å²	145.9	81%	0.808	78%	0.784	S	S	*	*			trans	-96.5	166.3	154.6	-59.2	-172	145.1	0	0	109.3
326	P	26.5	Very low	24.2	Very low	118 Å²	118	144.4 Å²	144.4	77%	0.766	78%	0.782	S	S	*	*				-142.3	121.3	90	34.5	-17.9	0	0	0	115.6
327	T	23.3	Very low	24	Very low	118 Å²	118	145.7 Å²	145.7	72%	0.724	78%	0.783	S	S	*	*			trans	36.3	107	138.4	61.1	0	0	0	0	120.6
328	S	27.2	Very low	24.4	Very low	119 Å²	119	143.6 Å²	143.6	83%	0.832	78%	0.779	S	S	*	*			trans	-141.7	142.8	130.5	65.9	0	0	0	0	109.5
329	K	21.5	Very low	24.8	Very low	208 Å²	208	137.5 Å²	137.5	90%	0.904	76%	0.758	S	S	*	*			trans	-123.9	126.5	-179.1	-72.8	-175.8	179.2	179.7	0	110.7
330	P	24.2	Very low	25.1	Very low	111 Å²	111	136.2 Å²	136.2	72%	0.721	75%	0.746	S	S	*	*			trans	-94.9	169.1	141.8	7.3	13	0	0	0	110.1
331	H	22.3	Very low	25.7	Very low	194 Å²	194	134.5 Å²	134.5	90%	0.898	73%	0.728	S	S	*	*			trans	-71.3	132.4	173.8	-79.9	-118.3	0	0	0	110.9
332	I	24.5	Very low	25.7	Very low	162 Å²	162	133.3 Å²	133.3	83%	0.831	72%	0.721	S	S	*	*			trans	-102.9	114.7	160.5	-65.2	175.9	0	0	0	106.4
333	E	22.4	Very low	26.3	Very low	169 Å²	169	128 Å²	128	79%	0.79	70%	0.701	S	S	*	*			trans	-65.8	138.7	167.8	-65.3	-173.1	120	0	0	109.7	V335	E333-V335 VanDerWaalsContact C-N 3.28Å; E333-V335 PolarHBondContact O-N 3.35Å
334	K	23	Very low	26.7	Very low	192 Å²	192	127.1 Å²	127.1	84%	0.835	70%	0.697	S	S	*	*			trans	-76.4	82.8	174.1	-78.3	-174.4	173	-177.3	0	110	T336	K334-T336 VanDerWaalsContact C-N 3.27Å; K334-T336 PolarHBondContact O-N 3.17Å; K334-T336 PolarHBondContact O-OG1 3.22Å
335	V	23.3	Very low	27.3	Very low	123 Å²	123	130.7 Å²	130.7	75%	0.745	69%	0.692	S	S	*	*			trans	-61.6	95.3	160.3	-179.2	0	0	0	0	107.3	E333 L337	E333-V335 VanDerWaalsContact C-N 3.28Å; E333-V335 PolarHBondContact O-N 3.35Å; V335-L337 PolarHBondContact O-N 3.38Å
336	T	23.1	Very low	27.8	Very low	120 Å²	120	127.7 Å²	127.7	74%	0.736	68%	0.681	S	S	*	*			trans	-84.8	83.3	-171.7	-46.5	0	0	0	0	108.6	K334	K334-T336 VanDerWaalsContact C-N 3.27Å; K334-T336 PolarHBondContact O-N 3.17Å; K334-T336 PolarHBondContact O-OG1 3.22Å
337	L	25.5	Very low	28	Very low	124 Å²	124	129.9 Å²	129.9	65%	0.649	68%	0.683	S	S	*	*			trans	-51.5	125.2	171.9	-76.6	164.1	0	0	0	109.7	V335 T339	V335-L337 PolarHBondContact O-N 3.38Å; L337-T339 HydrophobicContact CB-CG2 4.27Å; L337-T339 PolarHBondContact O-N 3Å; L337-T339 PolarHBondContact O-OG1 3.1Å
338	P	28.1	Very low	28.3	Very low	109 Å²	109	130.7 Å²	130.7	71%	0.708	68%	0.679	S	S	*	*			trans	-75.9	71.7	-172.4	31.1	-36.3	0	0	0	111.8
339	T	32.4	Very low	28.4	Very low	57 Å²	57	128.9 Å²	128.9	35%	0.35	66%	0.663	S	S	.	*			trans	-98.2	0.5	-175.9	48.4	0	0	0	0	113.8	L337 I354	L337-T339 HydrophobicContact CB-CG2 4.27Å; L337-T339 PolarHBondContact O-N 3Å; L337-T339 PolarHBondContact O-OG1 3.1Å; T339-I354 HydrophobicContact CG2-CD1 4.12Å
340	T	29.8	Very low	29.1	Very low	74 Å²	74	122.7 Å²	122.7	45%	0.454	64%	0.639	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.1	109.8	-179.9	55.2	0	0	0	0	111.4
341	I	34.6	Very low	29.5	Very low	64 Å²	64	123.8 Å²	123.8	33%	0.328	64%	0.638	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.1	129.7	163.9	-67.1	176.8	0	0	0	108.5	S407 V412	I341-S407 WeakPolarHBondContact CD1-OG 3.21Å; I341-V412 HydrophobicContact CD1-CB 4.11Å; I341-V412 HydrophobicContact CD1-CG1 3.68Å; I341-V412 HydrophobicContact CD1-CG2 4.44Å; I341-V412 HydrophobicContact CG1-CG1 4.26Å
342	F	29.9	Very low	30.2	Very low	140 Å²	140	116.1 Å²	116.1	61%	0.614	60%	0.604	S	S	*	*			trans	-84.4	134.3	167.8	-120.7	-98.6	0	0	0	109.8	T349	F342-T349 HydrophobicContact CD2-CG2 3.83Å; F342-T349 HydrophobicContact CE2-CG2 3.72Å; F342-T349 HydrophobicContact CZ-CG2 4.47Å
343	N	37.6	Very low	31	Very low	74 Å²	74	112.2 Å²	112.2	40%	0.396	58%	0.584	S	S	.	*			trans	-117.5	92.8	175.9	-177.4	-5.9	0	0	0	109.7	K345 N346 M347	N343-K345 PolarHBondContact O-N 3.16Å; N343-K345 PolarHBondContact OD1-N 3.2Å; N343-N346 PolarHBondContact O-N 3.15Å; N343-M347 PolarHBondContact O-N 2.85Å
344	D	33.4	Very low	31.7	Very low	145 Å²	145	108.5 Å²	108.5	78%	0.775	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-19.7	-173	-64.6	-14.1	0	0	0	114.8
345	K	38.6	Very low	32.5	Very low	151 Å²	151	105 Å²	105	66%	0.657	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-23.9	178.8	-68.9	-180	179.7	173.9	0	113.7	N343	N343-K345 PolarHBondContact O-N 3.16Å; N343-K345 PolarHBondContact OD1-N 3.2Å
346	N	32.4	Very low	33.5	Very low	110 Å²	110	103.8 Å²	103.8	59%	0.588	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-5.4	-166.6	-80.9	8	0	0	0	116.2	N343 Q348	N343-N346 PolarHBondContact O-N 3.15Å; N346-Q348 PolarHBondContact O-N 3.06Å; N346-Q348 VanDerWaalsContact O-N 3.13Å
347	M	31.1	Very low	34.2	Very low	164 Å²	164	99 Å²	99	81%	0.808	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	32.1	179.5	-69.1	-73.4	-77.5	0	0	114.5	N343	N343-M347 PolarHBondContact O-N 2.85Å
348	Q	29.7	Very low	34.8	Very low	135 Å²	135	96.2 Å²	96.2	63%	0.631	51%	0.507	S	S	*	.			trans	-116.8	115.7	174.2	-74.4	-173.7	-18.7	0	0	110.5	N346	N346-Q348 PolarHBondContact O-N 3.06Å; N346-Q348 VanDerWaalsContact O-N 3.13Å
349	T	28.7	Very low	35.5	Very low	81 Å²	81	95.9 Å²	95.9	50%	0.497	50%	0.496	S	S	.	.			trans	-81	122.4	167	26.1	0	0	0	0	110	F342	F342-T349 HydrophobicContact CD2-CG2 3.83Å; F342-T349 HydrophobicContact CE2-CG2 3.72Å; F342-T349 HydrophobicContact CZ-CG2 4.47Å
350	I	36.4	Very low	35.8	Very low	78 Å²	78	95.5 Å²	95.5	40%	0.4	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	109.1	174.4	-56.8	177	0	0	0	108	I352	I350-I352 HydrophobicContact CG2-CG1 4.17Å
351	N	32.7	Very low	36	Very low	133 Å²	133	93.7 Å²	93.7	71%	0.711	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	123.7	168	-89	-3.7	0	0	0	109.4
352	I	37.7	Very low	36.2	Very low	34 Å²	34	95.1 Å²	95.1	17%	0.174	49%	0.485	C	S	.	.			trans	-106.7	111.2	176	-60.8	174.8	0	0	0	108.7	I350 I354 V412	I350-I352 HydrophobicContact CG2-CG1 4.17Å; I352-I354 PolarHBondContact O-N 3.3Å; I352-V412 HydrophobicContact CD1-CG1 3.6Å
353	N	41.7	Very low	36.7	Very low	80 Å²	80	95 Å²	95	43%	0.428	49%	0.486	S	S	.	.			trans	-80.7	96.2	172.6	-172.6	5.9	0	0	0	110	N355 D356 A357	N353-N355 PolarHBondContact O-N 3.04Å; N353-N355 VanDerWaalsContact O-N 3.17Å; N353-N355 PolarHBondContact OD1-N 3.12Å; N353-D356 HydrophobicContact CB-CB 4.29Å; N353-D356 WeakPolarHBondContact CB-OD2 3.2Å; N353-D356 PolarHBondContact ND2-OD1 3.16Å; N353-D356 VanDerWaalsContact ND2-OD1 3.14Å; N353-D356 PolarHBondContact ND2-OD2 2.93Å; N353-D356 PolarHBondContact O-N 2.92Å; N353-D356 VanDerWaalsContact O-N 3.13Å; N353-A357 PolarHBondContact O-N 3.03Å
354	I	36.9	Very low	36.7	Very low	91 Å²	91	96.8 Å²	96.8	47%	0.467	49%	0.487	S	S	.	.	H	α-helix	trans	-55.2	-32.9	-179.9	-64	168.8	0	0	0	111.6	T339 I352 A357 N358	T339-I354 HydrophobicContact CG2-CD1 4.12Å; I352-I354 PolarHBondContact O-N 3.3Å; I354-A357 PolarHBondContact O-N 2.93Å; I354-N358 WeakPolarHBondContact O-CB 3.32Å; I354-N358 PolarHBondContact O-N 2.99Å; I354-N358 PolarHBondContact O-ND2 3.36Å
355	N	40	Very low	36.8	Very low	117 Å²	117	94.9 Å²	94.9	63%	0.626	48%	0.476	S	S	*	.	H	α-helix	trans	-69.7	-38	-179.9	-66.3	-21.8	0	0	0	112.6	N353 N358 H359	N353-N355 PolarHBondContact O-N 3.04Å; N353-N355 VanDerWaalsContact O-N 3.17Å; N353-N355 PolarHBondContact OD1-N 3.12Å; N355-N358 PolarHBondContact O-N 3.31Å; N355-H359 WeakPolarHBondContact O-CB 3.25Å; N355-H359 PolarHBondContact O-N 3.34Å
356	D	43	Very low	36.3	Very low	99 Å²	99	91.3 Å²	91.3	53%	0.529	46%	0.464	S	S	.	.	H	α-helix	trans	-67.5	-40.9	176.2	-65.9	-21.3	0	0	0	110.8	N353 H359 V360	N353-D356 HydrophobicContact CB-CB 4.29Å; N353-D356 WeakPolarHBondContact CB-OD2 3.2Å; N353-D356 PolarHBondContact ND2-OD1 3.16Å; N353-D356 VanDerWaalsContact ND2-OD1 3.14Å; N353-D356 PolarHBondContact ND2-OD2 2.93Å; N353-D356 PolarHBondContact O-N 2.92Å; N353-D356 VanDerWaalsContact O-N 3.13Å; D356-H359 PolarHBondContact O-N 3.25Å; D356-V360 WeakPolarHBondContact O-CG2 3.5Å; D356-V360 PolarHBondContact O-N 2.79Å
357	A	37.4	Very low	36.2	Very low	20 Å²	20	90.7 Å²	90.7	17%	0.165	47%	0.466	C	S	.	.	H	α-helix	trans	-60.9	-46	175.2	0	0	0	0	0	111.4	N353 I354 F361	N353-A357 PolarHBondContact O-N 3.03Å; I354-A357 PolarHBondContact O-N 2.93Å; A357-F361 VanDerWaalsContact O-CB 3.24Å; A357-F361 WeakPolarHBondContact O-CB 3.13Å; A357-F361 PolarHBondContact O-N 3.17Å
358	N	38.8	Very low	36.2	Very low	65 Å²	65	87.1 Å²	87.1	35%	0.348	46%	0.457	S	S	.	.	H	α-helix	trans	-62	-42.6	176.4	-80.2	-27.5	0	0	0	112.8	I354 N355 F361 Q362	I354-N358 WeakPolarHBondContact O-CB 3.32Å; I354-N358 PolarHBondContact O-N 2.99Å; I354-N358 PolarHBondContact O-ND2 3.36Å; N355-N358 PolarHBondContact O-N 3.31Å; N358-F361 PolarHBondContact O-N 3.29Å; N358-Q362 WeakPolarHBondContact O-CG 3.31Å; N358-Q362 PolarHBondContact O-N 3.08Å
359	H	43.3	Very low	36.3	Very low	101 Å²	101	87 Å²	87	47%	0.468	46%	0.46	S	S	.	.	H	α-helix	trans	-68	-44.7	-179.5	-177.1	-98.3	0	0	0	112.3	N355 D356 F361 Q362 Q363	N355-H359 WeakPolarHBondContact O-CB 3.25Å; N355-H359 PolarHBondContact O-N 3.34Å; D356-H359 PolarHBondContact O-N 3.25Å; H359-F361 VanDerWaalsContact C-N 3.27Å; H359-F361 PolarHBondContact O-N 3.26Å; H359-Q362 PolarHBondContact O-N 3.41Å; H359-Q363 PolarHBondContact CE1-NE2 2.93Å; H359-Q363 WeakPolarHBondContact O-CG 3.09Å; H359-Q363 PolarHBondContact O-N 2.91Å; H359-Q363 VanDerWaalsContact O-N 3.16Å
360	V	38	Very low	36.3	Very low	50 Å²	50	86.4 Å²	86.4	30%	0.303	46%	0.463	S	S	.	.	H	α-helix	trans	-67.2	-30	175.7	177.1	0	0	0	0	111.7	D356 F415	D356-V360 WeakPolarHBondContact O-CG2 3.5Å; D356-V360 PolarHBondContact O-N 2.79Å; V360-F415 HydrophobicContact CB-CZ 4.43Å; V360-F415 HydrophobicContact CG1-CE1 4.19Å; V360-F415 HydrophobicContact CG1-CE2 4.27Å; V360-F415 HydrophobicContact CG1-CZ 3.57Å
361	F	35.1	Very low	35.9	Very low	35 Å²	35	88.8 Å²	88.8	15%	0.154	48%	0.477	C	S	.	.	H	α-helix	trans	-69.8	-43.2	173.5	-173.2	-86.1	0	0	0	112.2	A357 N358 H359 Q363 R364 I365 R483	A357-F361 VanDerWaalsContact O-CB 3.24Å; A357-F361 WeakPolarHBondContact O-CB 3.13Å; A357-F361 PolarHBondContact O-N 3.17Å; N358-F361 PolarHBondContact O-N 3.29Å; H359-F361 VanDerWaalsContact C-N 3.27Å; H359-F361 PolarHBondContact O-N 3.26Å; F361-Q363 VanDerWaalsContact C-N 3.28Å; F361-Q363 PolarHBondContact O-N 3.11Å; F361-R364 PolarHBondContact O-N 3.13Å; F361-I365 HydrophobicContact CD1-CD1 4.15Å; F361-I365 HydrophobicContact CE1-CD1 3.36Å; F361-I365 HydrophobicContact CE1-CG1 4.12Å; F361-I365 HydrophobicContact CZ-CD1 3.93Å; F361-R483 HydrophobicContact CD1-CG 4.24Å; F361-R483 HydrophobicContact CE1-CG 3.53Å; F361-R483 HydrophobicContact CZ-CG 3.93Å
362	Q	37.3	Very low	35.5	Very low	95 Å²	95	88.2 Å²	88.2	44%	0.444	48%	0.478	S	S	.	.	H	α-helix	trans	-56.1	-41.8	173	-77.4	171.7	-36.1	0	0	111.9	N358 H359 R364	N358-Q362 WeakPolarHBondContact O-CG 3.31Å; N358-Q362 PolarHBondContact O-N 3.08Å; H359-Q362 PolarHBondContact O-N 3.41Å; Q362-R364 PolarHBondContact O-N 3.04Å
363	Q	41	Very low	35	Very low	136 Å²	136	90.8 Å²	90.8	64%	0.636	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-1.4	-179.9	-72.2	-174.5	-14.4	0	0	115.5	H359 F361	H359-Q363 PolarHBondContact CE1-NE2 2.93Å; H359-Q363 WeakPolarHBondContact O-CG 3.09Å; H359-Q363 PolarHBondContact O-N 2.91Å; H359-Q363 VanDerWaalsContact O-N 3.16Å; F361-Q363 VanDerWaalsContact C-N 3.28Å; F361-Q363 PolarHBondContact O-N 3.11Å
364	R	37.5	Very low	34.2	Very low	113 Å²	113	94.9 Å²	94.9	43%	0.426	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-16.8	-177.1	-71.4	-175.8	-177.3	165.8	1.3	115.9	F361 Q362 D366 P402 F415	F361-R364 PolarHBondContact O-N 3.13Å; Q362-R364 PolarHBondContact O-N 3.04Å; R364-D366 PolarHBondContact O-N 2.87Å; R364-P402 VanDerWaalsContact CZ-CG 3.47Å; R364-P402 VanDerWaalsContact NH1-CG 3.26Å; R364-P402 PolarHBondContact NH1-O 2.95Å; R364-P402 VanDerWaalsContact NH2-CG 3.29Å; R364-F415 VanDerWaalsContact NH1-CZ 3.28Å; R364-F415 VanDerWaalsContact NH2-CZ 3.33Å
365	I	35.4	Very low	33.7	Very low	104 Å²	104	97.1 Å²	97.1	53%	0.533	53%	0.533	S	S	.	.	S	Bend	trans	-69.3	-18.6	-174.1	-89.3	-177.1	0	0	0	112.5	F361	F361-I365 HydrophobicContact CD1-CD1 4.15Å; F361-I365 HydrophobicContact CE1-CD1 3.36Å; F361-I365 HydrophobicContact CE1-CG1 4.12Å; F361-I365 HydrophobicContact CZ-CD1 3.93Å
366	D	28.3	Very low	33	Very low	77 Å²	77	100 Å²	100	41%	0.412	54%	0.543	S	S	.	.			trans	-130.6	99.9	-173.4	-126.7	-36.7	0	0	0	116.3	R364 S368 L369	R364-D366 PolarHBondContact O-N 2.87Å; D366-S368 PolarHBondContact OD1-N 2.68Å; D366-L369 WeakPolarHBondContact OD1-CB 3.28Å; D366-L369 PolarHBondContact OD1-N 3.42Å; D366-L369 WeakPolarHBondContact OD2-CD1 3.45Å
367	P	31.3	Very low	32.3	Very low	96 Å²	96	102.6 Å²	102.6	62%	0.623	56%	0.557	S	S	*	*	S	Bend	trans	-101.7	-7.3	153.1	-2.4	23.3	0	0	0	112.7	N371	P367-N371 PolarHBondContact O-ND2 2.8Å
368	S	30.9	Very low	32	Very low	89 Å²	89	108 Å²	108	62%	0.622	59%	0.592	S	S	*	*	S	Bend	trans	-111.4	-35.2	-159	34.8	0	0	0	0	115.5	D366	D366-S368 PolarHBondContact OD1-N 2.68Å
369	L	31	Very low	31.4	Very low	133 Å²	133	109.5 Å²	109.5	70%	0.696	61%	0.608	S	S	*	*	S	Bend	trans	-86.2	-18.4	174.5	-69.1	147.2	0	0	0	112.1	D366 N371	D366-L369 WeakPolarHBondContact OD1-CB 3.28Å; D366-L369 PolarHBondContact OD1-N 3.42Å; D366-L369 WeakPolarHBondContact OD2-CD1 3.45Å; L369-N371 VanDerWaalsContact C-N 3.3Å; L369-N371 PolarHBondContact O-N 3.25Å
370	A	29.4	Very low	30.9	Very low	68 Å²	68	112.5 Å²	112.5	56%	0.562	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-11.2	179.1	0	0	0	0	0	114.9
371	N	26.8	Very low	30.5	Very low	129 Å²	129	113.8 Å²	113.8	69%	0.69	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	29.6	-169	-77	-59.4	0	0	0	114.3	P367 L369	P367-N371 PolarHBondContact O-ND2 2.8Å; L369-N371 VanDerWaalsContact C-N 3.3Å; L369-N371 PolarHBondContact O-N 3.25Å
372	T	25	Very low	30.2	Very low	121 Å²	121	121.8 Å²	121.8	74%	0.742	69%	0.685	S	S	*	*			trans	-119.1	25.8	174.5	53	0	0	0	0	114.6	L374	T372-L374 PolarHBondContact O-N 3.01Å
373	S	26.2	Very low	29.7	Very low	88 Å²	88	125.7 Å²	125.7	62%	0.615	70%	0.703	S	S	*	*			trans	-85.8	97.2	156.5	53.2	0	0	0	0	110.4	D375	S373-D375 PolarHBondContact O-N 2.85Å
374	L	24.8	Very low	29.1	Very low	166 Å²	166	127 Å²	127	87%	0.869	71%	0.714	S	S	*	*			trans	-76.2	71.6	166.4	-90.6	169	0	0	0	110.1	T372 E376	T372-L374 PolarHBondContact O-N 3.01Å; L374-E376 VanDerWaalsContact C-N 3.28Å; L374-E376 PolarHBondContact O-N 2.96Å
375	D	26.9	Very low	28.4	Very low	137 Å²	137	129.5 Å²	129.5	73%	0.733	73%	0.73	S	S	*	*			trans	-71.4	84.8	169.4	-82.7	-48.7	0	0	0	110.3	S373 N377	S373-D375 PolarHBondContact O-N 2.85Å; D375-N377 PolarHBondContact O-N 3.3Å
376	E	26.6	Very low	28.1	Very low	177 Å²	177	131 Å²	131	83%	0.827	74%	0.744	S	S	*	*			trans	-66.1	66.1	161.3	-72.1	-160	140.3	0	0	110.7	L374	L374-E376 VanDerWaalsContact C-N 3.28Å; L374-E376 PolarHBondContact O-N 2.96Å
377	N	28	Very low	27.9	Very low	155 Å²	155	133 Å²	133	83%	0.829	76%	0.764	S	S	*	*			trans	-171.2	77.3	158.4	-90.9	-40.7	0	0	0	111.8	D375	D375-N377 PolarHBondContact O-N 3.3Å
378	C	30	Very low	27.7	Very low	133 Å²	133	137.6 Å²	137.6	90%	0.899	77%	0.774	S	S	*	*			trans	-111.5	102.6	166.8	-168	0	0	0	0	110.6
379	S	27.5	Very low	27.4	Very low	97 Å²	97	143.2 Å²	143.2	68%	0.678	79%	0.787	S	S	*	*			trans	-124.2	147.7	167.4	51.9	0	0	0	0	109.3
380	D	32.9	Very low	27.1	Very low	163 Å²	163	144.2 Å²	144.2	87%	0.872	79%	0.793	S	S	*	*	S	Bend	trans	65	98.9	-179.1	-57.5	-20.2	0	0	0	116.1
381	G	28.2	Very low	26.9	Very low	77 Å²	77	149.6 Å²	149.6	79%	0.794	81%	0.806	S	S	*	*			trans	-93.1	146.7	179.1	0	0	0	0	0	114
382	K	30.3	Very low	26.8	Very low	204 Å²	204	152.7 Å²	152.7	89%	0.887	82%	0.817	S	S	*	*			trans	-130.1	134.9	158.8	-74.6	179.6	178.8	170.9	0	109.2
383	Q	26	Very low	27	Very low	177 Å²	177	153.6 Å²	153.6	83%	0.827	82%	0.815	S	S	*	*			trans	-74.3	135.5	173.8	-68.8	173.4	-26.5	0	0	109.8
384	L	27.8	Very low	27	Very low	162 Å²	162	157 Å²	157	85%	0.848	82%	0.821	S	S	*	*			trans	-118.1	111.5	169.3	-87.2	166.7	0	0	0	109.8
385	H	24	Very low	27.1	Very low	167 Å²	167	154.6 Å²	154.6	77%	0.773	82%	0.816	S	S	*	*			trans	-82.9	109	172.8	-78.9	-83.5	0	0	0	110.5	S387	H385-S387 PolarHBondContact O-N 3.13Å
386	T	28.2	Very low	27.1	Very low	136 Å²	136	155.3 Å²	155.3	83%	0.834	82%	0.82	S	S	*	*			trans	-97.7	74.5	172.4	38.8	0	0	0	0	111.5	K388	T386-K388 VanDerWaalsContact C-N 3.32Å; T386-K388 PolarHBondContact O-N 2.83Å
387	S	23.3	Very low	27.2	Very low	117 Å²	117	149.2 Å²	149.2	82%	0.818	80%	0.804	S	S	*	*			trans	-76.8	66.4	-177.5	50.5	0	0	0	0	114.4	H385	H385-S387 PolarHBondContact O-N 3.13Å
388	K	28.4	Very low	27.5	Very low	193 Å²	193	147.9 Å²	147.9	84%	0.839	80%	0.797	S	S	*	*			trans	-93.1	97.9	160.7	-79.2	-177.5	178.2	172.3	0	109.9	T386 L390	T386-K388 VanDerWaalsContact C-N 3.32Å; T386-K388 PolarHBondContact O-N 2.83Å; K388-L390 PolarHBondContact O-N 3.12Å; K388-L390 VanDerWaalsContact O-N 3.15Å
389	K	23.3	Very low	27.8	Very low	207 Å²	207	147.7 Å²	147.7	90%	0.9	79%	0.786	S	S	*	*			trans	-60.1	113.9	167.1	-83.9	-173.9	173.5	-177.1	0	109.1
390	L	25.3	Very low	28.3	Very low	155 Å²	155	144.1 Å²	144.1	81%	0.812	76%	0.757	S	S	*	*			trans	-59.6	144.6	151.7	-102.3	71.8	0	0	0	108.2	K388	K388-L390 PolarHBondContact O-N 3.12Å; K388-L390 VanDerWaalsContact O-N 3.15Å
391	Q	26.1	Very low	28.4	Very low	181 Å²	181	139.4 Å²	139.4	85%	0.846	74%	0.736	S	S	*	*			trans	-65.8	142.1	173.1	-68.3	178.6	-10.5	0	0	109.6	I393	Q391-I393 PolarHBondContact O-N 2.88Å
392	Q	24.3	Very low	28.9	Very low	194 Å²	194	138.1 Å²	138.1	91%	0.907	71%	0.714	S	S	*	*			trans	-72.1	91.3	176.9	-70.9	174.8	-64.6	0	0	109.6
393	I	28.8	Very low	29.6	Very low	139 Å²	139	129.3 Å²	129.3	71%	0.713	68%	0.676	S	S	*	*			trans	-64	137.4	165.8	-61.4	172.8	0	0	0	107.7	Q391	Q391-I393 PolarHBondContact O-N 2.88Å
394	Q	26	Very low	30.6	Very low	159 Å²	159	121.4 Å²	121.4	74%	0.743	64%	0.64	S	S	*	*			trans	-65.6	137.5	-177.1	-65	-173.6	2.1	0	0	111	N396	Q394-N396 PolarHBondContact O-N 3.25Å
395	P	27.2	Very low	31.2	Very low	117 Å²	117	114 Å²	114	76%	0.76	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	10.4	-170.7	32	-36.9	0	0	0	115.1
396	N	27.6	Very low	31.9	Very low	152 Å²	152	106.1 Å²	106.1	81%	0.813	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	13	-167.1	-70.8	15.8	0	0	0	114.4	Q394	Q394-N396 PolarHBondContact O-N 3.25Å
397	G	28.1	Very low	32.3	Very low	48 Å²	48	102.6 Å²	102.6	50%	0.495	55%	0.546	S	S	.	.	S	Bend	trans	-113.9	135.6	165.6	0	0	0	0	0	109.4	I399	G397-I399 WeakPolarHBondContact O-CG1 3.47Å; G397-I399 PolarHBondContact O-N 3.05Å
398	D	34.3	Very low	32.9	Very low	127 Å²	127	101.4 Å²	101.4	68%	0.679	53%	0.527	S	S	*	.			trans	-60	107.1	175.4	-70	-65.3	0	0	0	109.8	W400	D398-W400 VanDerWaalsContact C-N 3.32Å; D398-W400 PolarHBondContact O-N 3.29Å
399	I	36.5	Very low	33.3	Very low	129 Å²	129	96.6 Å²	96.6	66%	0.662	52%	0.515	S	S	*	.			trans	-75.4	91.4	179.9	-54.2	-178	0	0	0	107.3	G397	G397-I399 WeakPolarHBondContact O-CG1 3.47Å; G397-I399 PolarHBondContact O-N 3.05Å
400	W	37	Very low	34	Very low	22 Å²	22	93.9 Å²	93.9	8%	0.083	51%	0.506	C	S	.	.			trans	-50.9	138.6	164.5	-79.7	67.6	0	0	0	108.9	D398 L403 L422 L530 P531 M533 F536	D398-W400 VanDerWaalsContact C-N 3.32Å; D398-W400 PolarHBondContact O-N 3.29Å; W400-L403 HydrophobicContact CE3-CD1 3.61Å; W400-L403 HydrophobicContact CE3-CG 4.43Å; W400-L403 HydrophobicContact CZ3-CD1 3.84Å; W400-L422 HydrophobicContact CD2-CD1 4.38Å; W400-L422 HydrophobicContact CE3-CD1 4.4Å; W400-L530 HydrophobicContact CH2-CB 4.28Å; W400-L530 HydrophobicContact CZ2-CB 3.79Å; W400-L530 HydrophobicContact CZ2-CD1 3.76Å; W400-L530 HydrophobicContact CZ2-CD2 4.31Å; W400-L530 HydrophobicContact CZ2-CG 4.16Å; W400-P531 HydrophobicContact CH2-CG 4.47Å; W400-P531 WeakPolarHBondContact CH2-O 3.45Å; W400-M533 HydrophobicContact CD2-CG 4.37Å; W400-M533 HydrophobicContact CD2-SD 3.83Å; W400-M533 HydrophobicContact CE3-CG 4.06Å; W400-M533 HydrophobicContact CE3-SD 3.88Å; W400-M533 HydrophobicContact CG-SD 4.19Å; W400-M533 HydrophobicContact CH2-CG 3.87Å; W400-M533 HydrophobicContact CZ2-CG 4.16Å; W400-M533 HydrophobicContact CZ3-CG 3.82Å; W400-M533 HydrophobicContact CZ3-SD 4.27Å; W400-F536 HydrophobicContact CH2-CE2 4.49Å; W400-F536 HydrophobicContact CZ3-CE2 4.08Å
401	P	34.6	Very low	34.6	Very low	64 Å²	64	89.9 Å²	89.9	42%	0.416	49%	0.485	S	S	.	.			trans	-57.8	150.2	169.8	28.5	-34.1	0	0	0	108	L403 M533	P401-L403 HydrophobicContact CG-CD2 4.11Å; P401-L403 HydrophobicContact CG-CG 4.48Å; P401-L403 WeakPolarHBondContact O-CG 3.32Å; P401-L403 PolarHBondContact O-N 3.4Å; P401-M533 WeakPolarHBondContact CD-SD 3.48Å; P401-M533 HydrophobicContact CG-SD 4.34Å
402	P	39.3	Very low	35.4	Very low	51 Å²	51	82.7 Å²	82.7	33%	0.331	45%	0.453	S	S	.	.			trans	-68.4	78	-175	26.9	-36.2	0	0	0	112.6	R364 F415 N416	R364-P402 VanDerWaalsContact CZ-CG 3.47Å; R364-P402 VanDerWaalsContact NH1-CG 3.26Å; R364-P402 PolarHBondContact NH1-O 2.95Å; R364-P402 VanDerWaalsContact NH2-CG 3.29Å; P402-F415 HydrophobicContact CB-CE1 4.06Å; P402-F415 HydrophobicContact CB-CZ 4.49Å; P402-N416 HydrophobicContact CB-CB 4.27Å
403	L	45.4	Very low	36.5	Very low	18 Å²	18	76.3 Å²	76.3	9%	0.094	43%	0.425	C	S	.	.			trans	-67.2	149.5	176.9	-64	-170.9	0	0	0	110.3	W400 P401 I405 N416 I479	W400-L403 HydrophobicContact CE3-CD1 3.61Å; W400-L403 HydrophobicContact CE3-CG 4.43Å; W400-L403 HydrophobicContact CZ3-CD1 3.84Å; P401-L403 HydrophobicContact CG-CD2 4.11Å; P401-L403 HydrophobicContact CG-CG 4.48Å; P401-L403 WeakPolarHBondContact O-CG 3.32Å; P401-L403 PolarHBondContact O-N 3.4Å; L403-I405 HydrophobicContact CB-CD1 3.76Å; L403-I405 HydrophobicContact CB-CG1 3.63Å; L403-I405 HydrophobicContact CD1-CD1 3.72Å; L403-I405 HydrophobicContact CD1-CG1 4.35Å; L403-I405 HydrophobicContact CG-CD1 4.39Å; L403-N416 PolarHBondContact O-N 3.23Å; L403-I479 HydrophobicContact CB-CG2 4.47Å; L403-I479 HydrophobicContact CD1-CD1 3.83Å; L403-I479 HydrophobicContact CD1-CG1 4.1Å; L403-I479 HydrophobicContact CD1-CG2 4.02Å; L403-I479 HydrophobicContact CD2-CG2 3.89Å; L403-I479 HydrophobicContact CG-CG2 4.35Å
404	V	47.4	Very low	37.5	Very low	12 Å²	12	71.8 Å²	71.8	7%	0.073	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	114.9	167.1	-153.6	0	0	0	0	107	L413 F415 A480	V404-L413 HydrophobicContact CB-CD2 4.32Å; V404-L413 HydrophobicContact CG1-CB 3.53Å; V404-L413 HydrophobicContact CG1-CD1 4.2Å; V404-L413 HydrophobicContact CG1-CD2 3.75Å; V404-L413 HydrophobicContact CG1-CG 4Å; V404-F415 HydrophobicContact CG1-CD2 4.24Å; V404-F415 HydrophobicContact CG2-CD2 3.84Å; V404-F415 HydrophobicContact CG2-CE2 3.94Å; V404-A480 HydrophobicContact CB-CB 4.34Å; V404-A480 PolarHBondContact O-N 3.14Å
405	I	39	Very low	38.8	Very low	5 Å²	5	67.7 Å²	67.7	3%	0.026	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	132.4	-165.9	-46.5	-166	0	0	0	109.8	L403 Q414 P417 L422 I477 T478 I479	L403-I405 HydrophobicContact CB-CD1 3.76Å; L403-I405 HydrophobicContact CB-CG1 3.63Å; L403-I405 HydrophobicContact CD1-CD1 3.72Å; L403-I405 HydrophobicContact CD1-CG1 4.35Å; L403-I405 HydrophobicContact CG-CD1 4.39Å; I405-Q414 PolarHBondContact N-O 2.89Å; I405-Q414 WeakPolarHBondContact O-CB 3.42Å; I405-Q414 PolarHBondContact O-N 3.02Å; I405-P417 HydrophobicContact CB-CG 4.12Å; I405-P417 HydrophobicContact CD1-CG 3.54Å; I405-P417 HydrophobicContact CG1-CG 3.92Å; I405-L422 HydrophobicContact CD1-CD1 4.2Å; I405-L422 HydrophobicContact CD1-CD2 3.72Å; I405-L422 HydrophobicContact CD1-CG 4.32Å; I405-I477 HydrophobicContact CG2-CB 4.07Å; I405-T478 CarbonylContact C-O 3.25Å; I405-T478 VanDerWaalsContact CA-O 3.31Å; I405-T478 WeakPolarHBondContact CA-O 3.46Å; I405-T478 WeakPolarHBondContact CG2-O 2.96Å; I405-I479 HydrophobicContact CD1-CG1 4.04Å; I405-I479 HydrophobicContact CG1-CG1 4.07Å; I405-I479 HydrophobicContact CG2-CG1 4.22Å
406	S	39.3	Very low	40.6	Very low	2 Å²	2	65.7 Å²	65.7	1%	0.014	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135	172.6	-175.4	0	0	0	0	111.9	H408 L411 V412 T478	S406-H408 WeakPolarHBondContact CB-O 3.32Å; S406-H408 PolarHBondContact OG-N 2.89Å; S406-H408 PolarHBondContact OG-O 2.53Å; S406-L411 VanDerWaalsContact OG-CA 3.3Å; S406-L411 WeakPolarHBondContact OG-CA 3.5Å; S406-L411 PolarHBondContact OG-N 3.23Å; S406-V412 WeakPolarHBondContact CA-O 3.26Å; S406-V412 PolarHBondContact OG-N 3.43Å; S406-T478 PolarHBondContact N-O 2.89Å; S406-T478 PolarHBondContact O-N 3.42Å
407	S	36.5	Very low	42.4	Very low	63 Å²	63	59 Å²	59	44%	0.441	33%	0.328	S	S	.	.	S	Bend	trans	-90.5	-2.2	167.5	60.7	0	0	0	0	113.5	I341	I341-S407 WeakPolarHBondContact CD1-OG 3.21Å
408	H	35.8	Very low	44.4	Very low	92 Å²	92	60.8 Å²	60.8	43%	0.426	33%	0.331	S	S	.	.	S	Bend	trans	-117	150.5	174.5	-146.5	-116.2	0	0	0	109.5	S406 E410 L411 V412	S406-H408 WeakPolarHBondContact CB-O 3.32Å; S406-H408 PolarHBondContact OG-N 2.89Å; S406-H408 PolarHBondContact OG-O 2.53Å; H408-E410 IonicContact CE1-OE2 3.4Å; H408-E410 PolarHBondContact CE1-OE2 3.47Å; H408-E410 IonicContact ND1-OE2 2.73Å; H408-E410 PolarHBondContact ND1-OE2 2.99Å; H408-E410 PolarHBondContact O-N 2.88Å; H408-E410 VanDerWaalsContact O-N 3.14Å; H408-L411 PolarHBondContact O-N 2.65Å; H408-V412 HydrophobicContact CB-CG2 4.11Å
409	P	36.7	Very low	46.4	Very low	91 Å²	91	57.3 Å²	57.3	59%	0.591	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.3	168.6	22.5	-33.2	0	0	0	112.7	L411	P409-L411 PolarHBondContact O-N 2.7Å
410	E	38.1	Very low	48.4	Very low	151 Å²	151	53.8 Å²	53.8	71%	0.706	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	44	-178.1	-57	174.7	136.2	0	0	113.5	H408 V412	H408-E410 IonicContact CE1-OE2 3.4Å; H408-E410 PolarHBondContact CE1-OE2 3.47Å; H408-E410 IonicContact ND1-OE2 2.73Å; H408-E410 PolarHBondContact ND1-OE2 2.99Å; H408-E410 PolarHBondContact O-N 2.88Å; H408-E410 VanDerWaalsContact O-N 3.14Å; E410-V412 PolarHBondContact O-N 2.95Å
411	L	39.4	Very low	50.4	Low	70 Å²	70	55.5 Å²	55.5	37%	0.366	32%	0.32	S	S	.	.			trans	53.7	51.3	159.7	-62.8	169.5	0	0	0	117.7	S406 H408 P409 L413 T478	S406-L411 VanDerWaalsContact OG-CA 3.3Å; S406-L411 WeakPolarHBondContact OG-CA 3.5Å; S406-L411 PolarHBondContact OG-N 3.23Å; H408-L411 PolarHBondContact O-N 2.65Å; P409-L411 PolarHBondContact O-N 2.7Å; L411-L413 VanDerWaalsContact C-N 3.34Å; L411-L413 HydrophobicContact CD2-CD2 4.41Å; L411-L413 PolarHBondContact O-N 2.76Å; L411-T478 HydrophobicContact CD2-CG2 4.16Å
412	V	42.1	Very low	52.6	Low	30 Å²	30	52.6 Å²	52.6	18%	0.182	30%	0.301	C	S	.	.			trans	-78.3	84.7	165.7	-173.9	0	0	0	0	110.2	I341 I352 S406 H408 E410 Q414	I341-V412 HydrophobicContact CD1-CB 4.11Å; I341-V412 HydrophobicContact CD1-CG1 3.68Å; I341-V412 HydrophobicContact CD1-CG2 4.44Å; I341-V412 HydrophobicContact CG1-CG1 4.26Å; I352-V412 HydrophobicContact CD1-CG1 3.6Å; S406-V412 WeakPolarHBondContact CA-O 3.26Å; S406-V412 PolarHBondContact OG-N 3.43Å; H408-V412 HydrophobicContact CB-CG2 4.11Å; E410-V412 PolarHBondContact O-N 2.95Å; V412-Q414 PolarHBondContact O-N 2.81Å; V412-Q414 VanDerWaalsContact O-N 3.1Å
413	L	46.9	Very low	54.7	Low	60 Å²	60	51.9 Å²	51.9	31%	0.314	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	98.8	-172.3	-68.5	-175.2	0	0	0	114.4	V404 L411	V404-L413 HydrophobicContact CB-CD2 4.32Å; V404-L413 HydrophobicContact CG1-CB 3.53Å; V404-L413 HydrophobicContact CG1-CD1 4.2Å; V404-L413 HydrophobicContact CG1-CD2 3.75Å; V404-L413 HydrophobicContact CG1-CG 4Å; L411-L413 VanDerWaalsContact C-N 3.34Å; L411-L413 HydrophobicContact CD2-CD2 4.41Å; L411-L413 PolarHBondContact O-N 2.76Å
414	Q	50.7	Low	56.3	Low	44 Å²	44	53.8 Å²	53.8	21%	0.206	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	129.7	172	-164.3	172.8	84.8	0	0	111.3	I405 V412	I405-Q414 PolarHBondContact N-O 2.89Å; I405-Q414 WeakPolarHBondContact O-CB 3.42Å; I405-Q414 PolarHBondContact O-N 3.02Å; V412-Q414 PolarHBondContact O-N 2.81Å; V412-Q414 VanDerWaalsContact O-N 3.1Å
415	F	53.8	Low	57.8	Low	74 Å²	74	55.1 Å²	55.1	33%	0.325	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	122.8	-169.3	-154.4	-94.8	0	0	0	112.1	V360 R364 P402 V404	V360-F415 HydrophobicContact CB-CZ 4.43Å; V360-F415 HydrophobicContact CG1-CE1 4.19Å; V360-F415 HydrophobicContact CG1-CE2 4.27Å; V360-F415 HydrophobicContact CG1-CZ 3.57Å; R364-F415 VanDerWaalsContact NH1-CZ 3.28Å; R364-F415 VanDerWaalsContact NH2-CZ 3.33Å; P402-F415 HydrophobicContact CB-CE1 4.06Å; P402-F415 HydrophobicContact CB-CZ 4.49Å; V404-F415 HydrophobicContact CG1-CD2 4.24Å; V404-F415 HydrophobicContact CG2-CD2 3.84Å; V404-F415 HydrophobicContact CG2-CE2 3.94Å
416	N	63.6	Low	60.1	Low	74 Å²	74	55.2 Å²	55.2	40%	0.396	32%	0.317	S	S	.	.	S	Bend	trans	48.3	56.1	179	-149.4	20.1	0	0	0	114.5	P402 L403	P402-N416 HydrophobicContact CB-CB 4.27Å; L403-N416 PolarHBondContact O-N 3.23Å
417	P	66	Low	62	Low	11 Å²	11	58.9 Å²	58.9	7%	0.071	33%	0.333	C	S	.	.			trans	-64.8	149.9	-174.1	28.2	-35.8	0	0	0	112.6	I405 L421 L422	I405-P417 HydrophobicContact CB-CG 4.12Å; I405-P417 HydrophobicContact CD1-CG 3.54Å; I405-P417 HydrophobicContact CG1-CG 3.92Å; P417-L421 HydrophobicContact CB-CD2 4.21Å; P417-L422 HydrophobicContact CG-CG 4.37Å
418	P	71	Confident	63.1	Low	86 Å²	86	58.6 Å²	58.6	56%	0.558	33%	0.327	S	S	*	.			trans	-66.1	143.5	-177.2	27.4	-34.3	0	0	0	111.5	G420 L421 L422	P418-G420 PolarHBondContact O-N 2.85Å; P418-G420 VanDerWaalsContact O-N 3.08Å; P418-L421 HydrophobicContact CG-CB 3.95Å; P418-L421 WeakPolarHBondContact O-CA 3.24Å; P418-L421 WeakPolarHBondContact O-CB 3.38Å; P418-L421 PolarHBondContact O-N 2.95Å; P418-L422 PolarHBondContact O-N 3.45Å
419	V	76.4	Confident	63.7	Low	55 Å²	55	58.8 Å²	58.8	33%	0.333	33%	0.334	S	S	.	.	H	α-helix	trans	-51.9	-37.5	-176.6	175.1	0	0	0	0	113.1	L421 L422 I423 L530	V419-L421 VanDerWaalsContact C-N 3.3Å; V419-L421 PolarHBondContact O-N 2.8Å; V419-L422 WeakPolarHBondContact O-CB 3.39Å; V419-L422 PolarHBondContact O-N 3.18Å; V419-I423 HydrophobicContact CG1-CD1 3.91Å; V419-I423 HydrophobicContact CG1-CG1 4.3Å; V419-I423 WeakPolarHBondContact O-CG1 3.11Å; V419-I423 PolarHBondContact O-N 3.26Å; V419-L530 HydrophobicContact CG1-CD1 3.7Å
420	G	77.8	Confident	63.6	Low	54 Å²	54	58.9 Å²	58.9	56%	0.557	33%	0.33	S	S	*	.	H	α-helix	trans	-64.1	-29.7	176.2	0	0	0	0	0	114.5	P418 S424	P418-G420 PolarHBondContact O-N 2.85Å; P418-G420 VanDerWaalsContact O-N 3.08Å; G420-S424 VanDerWaalsContact O-CB 3.25Å; G420-S424 WeakPolarHBondContact O-CB 3.44Å; G420-S424 PolarHBondContact O-N 3.18Å
421	L	79.1	Confident	63.3	Low	58 Å²	58	60.6 Å²	60.6	30%	0.304	34%	0.335	S	S	.	.	H	α-helix	trans	-73.2	-43.1	173.4	-174.9	156.2	0	0	0	110.4	P417 P418 V419 S424 L425	P417-L421 HydrophobicContact CB-CD2 4.21Å; P418-L421 HydrophobicContact CG-CB 3.95Å; P418-L421 WeakPolarHBondContact O-CA 3.24Å; P418-L421 WeakPolarHBondContact O-CB 3.38Å; P418-L421 PolarHBondContact O-N 2.95Å; V419-L421 VanDerWaalsContact C-N 3.3Å; V419-L421 PolarHBondContact O-N 2.8Å; L421-S424 CarbonylContact O-C 3.38Å; L421-S424 PolarHBondContact O-N 2.92Å; L421-S424 VanDerWaalsContact O-N 3.17Å; L421-L425 HydrophobicContact CD2-CD1 3.6Å; L421-L425 HydrophobicContact CD2-CG 3.99Å; L421-L425 WeakPolarHBondContact O-CG 3.48Å; L421-L425 PolarHBondContact O-N 3.14Å
422	L	79.9	Confident	62.8	Low	3 Å²	3	65.5 Å²	65.5	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-58.2	-50	174.3	-85.7	171.3	0	0	0	112.1	W400 I405 P417 P418 V419 S424 L425 L426 I477 L530	W400-L422 HydrophobicContact CD2-CD1 4.38Å; W400-L422 HydrophobicContact CE3-CD1 4.4Å; I405-L422 HydrophobicContact CD1-CD1 4.2Å; I405-L422 HydrophobicContact CD1-CD2 3.72Å; I405-L422 HydrophobicContact CD1-CG 4.32Å; P417-L422 HydrophobicContact CG-CG 4.37Å; P418-L422 PolarHBondContact O-N 3.45Å; V419-L422 WeakPolarHBondContact O-CB 3.39Å; V419-L422 PolarHBondContact O-N 3.18Å; L422-S424 VanDerWaalsContact C-N 3.3Å; L422-S424 PolarHBondContact O-N 2.79Å; L422-L425 PolarHBondContact O-N 2.69Å; L422-L426 WeakPolarHBondContact O-CG 3.27Å; L422-L426 PolarHBondContact O-N 2.81Å; L422-L426 VanDerWaalsContact O-N 3.12Å; L422-I477 HydrophobicContact CD2-CD1 3.61Å; L422-I477 HydrophobicContact CD2-CG2 4.14Å; L422-L530 HydrophobicContact CB-CD2 3.8Å
423	I	83.4	Confident	62.1	Low	36 Å²	36	68 Å²	68	19%	0.185	37%	0.373	C	S	.	.	H	α-helix	trans	-58.8	-44.7	174	-64.9	175.1	0	0	0	109.8	V419 L425 L426 E427 R529 L530	V419-I423 HydrophobicContact CG1-CD1 3.91Å; V419-I423 HydrophobicContact CG1-CG1 4.3Å; V419-I423 WeakPolarHBondContact O-CG1 3.11Å; V419-I423 PolarHBondContact O-N 3.26Å; I423-L425 VanDerWaalsContact C-N 3.33Å; I423-L425 PolarHBondContact O-N 2.92Å; I423-L426 PolarHBondContact O-N 2.92Å; I423-E427 HydrophobicContact CG2-CG 3.87Å; I423-E427 WeakPolarHBondContact CG2-OE1 3.39Å; I423-E427 VanDerWaalsContact O-CB 3.32Å; I423-E427 WeakPolarHBondContact O-CB 3.26Å; I423-E427 PolarHBondContact O-N 2.89Å; I423-R529 HydrophobicContact CD1-CB 4.31Å; I423-R529 HydrophobicContact CG1-CB 4.37Å; I423-L530 HydrophobicContact CG1-CD1 4.37Å; I423-L530 HydrophobicContact CG1-CD2 3.71Å; I423-L530 HydrophobicContact CG1-CG 3.97Å
424	S	79	Confident	61.1	Low	59 Å²	59	73 Å²	73	41%	0.413	40%	0.399	S	S	.	.	H	α-helix	trans	-63.7	-32.3	178.6	-173.9	0	0	0	0	113.9	G420 L421 L422 N428	G420-S424 VanDerWaalsContact O-CB 3.25Å; G420-S424 WeakPolarHBondContact O-CB 3.44Å; G420-S424 PolarHBondContact O-N 3.18Å; L421-S424 CarbonylContact O-C 3.38Å; L421-S424 PolarHBondContact O-N 2.92Å; L421-S424 VanDerWaalsContact O-N 3.17Å; L422-S424 VanDerWaalsContact C-N 3.3Å; L422-S424 PolarHBondContact O-N 2.79Å; S424-N428 WeakPolarHBondContact O-CB 3.43Å; S424-N428 PolarHBondContact O-N 2.71Å; S424-N428 PolarHBondContact O-ND2 3.14Å
425	L	80.5	Confident	59.8	Low	40 Å²	40	80 Å²	80	21%	0.209	43%	0.426	C	S	.	.	H	α-helix	trans	-73.9	-34.3	176	-72.5	-179.6	0	0	0	112.1	L421 L422 I423 P475 G476 I477	L421-L425 HydrophobicContact CD2-CD1 3.6Å; L421-L425 HydrophobicContact CD2-CG 3.99Å; L421-L425 WeakPolarHBondContact O-CG 3.48Å; L421-L425 PolarHBondContact O-N 3.14Å; L422-L425 PolarHBondContact O-N 2.69Å; I423-L425 VanDerWaalsContact C-N 3.33Å; I423-L425 PolarHBondContact O-N 2.92Å; L425-P475 WeakPolarHBondContact O-CA 3.47Å; L425-P475 WeakPolarHBondContact O-CB 3.13Å; L425-G476 PolarHBondContact O-N 3.15Å; L425-I477 HydrophobicContact CB-CG2 3.83Å; L425-I477 HydrophobicContact CD1-CG2 3.87Å
426	L	85.3	Confident	58.4	Low	7 Å²	7	84.7 Å²	84.7	4%	0.037	45%	0.453	C	S	.	.	H	α-helix	trans	-85.2	-32.7	-178.9	-63.6	170.4	0	0	0	113.3	L422 I423 P475 I477 P491 W503 L530 P531	L422-L426 WeakPolarHBondContact O-CG 3.27Å; L422-L426 PolarHBondContact O-N 2.81Å; L422-L426 VanDerWaalsContact O-N 3.12Å; I423-L426 PolarHBondContact O-N 2.92Å; L426-P475 WeakPolarHBondContact O-CB 3.17Å; L426-I477 HydrophobicContact CD1-CD1 4.32Å; L426-I477 HydrophobicContact CD2-CD1 4.28Å; L426-I477 HydrophobicContact CD2-CG1 4.14Å; L426-I477 HydrophobicContact CD2-CG2 4.11Å; L426-I477 HydrophobicContact CG-CG2 4.32Å; L426-P491 HydrophobicContact CB-CG 4.48Å; L426-P491 VanDerWaalsContact O-CG 3.29Å; L426-P491 WeakPolarHBondContact O-CG 3.48Å; L426-W503 HydrophobicContact CB-CZ3 4.48Å; L426-W503 HydrophobicContact CD1-CH2 4.12Å; L426-W503 HydrophobicContact CD1-CZ3 4.07Å; L426-W503 HydrophobicContact CD2-CZ3 4.19Å; L426-W503 HydrophobicContact CG-CZ3 4.49Å; L426-L530 HydrophobicContact CD1-CD2 4.22Å; L426-P531 HydrophobicContact CD1-CG 4.42Å
427	E	80	Confident	56.6	Low	79 Å²	79	92.3 Å²	92.3	37%	0.369	48%	0.478	S	S	.	.	S	Bend	trans	-89	-0.1	177.7	-65.2	-173.7	176.9	0	0	113	I423 T429 R529	I423-E427 HydrophobicContact CG2-CG 3.87Å; I423-E427 WeakPolarHBondContact CG2-OE1 3.39Å; I423-E427 VanDerWaalsContact O-CB 3.32Å; I423-E427 WeakPolarHBondContact O-CB 3.26Å; I423-E427 PolarHBondContact O-N 2.89Å; E427-T429 PolarHBondContact O-N 3.45Å; E427-T429 PolarHBondContact O-OG1 2.93Å; E427-R529 WeakPolarHBondContact OE1-CD 3.44Å; E427-R529 IonicContact OE1-CZ 3.94Å; E427-R529 IonicContact OE1-NE 3.34Å; E427-R529 IonicContact OE1-NH1 3.52Å; E427-R529 PolarHBondContact OE1-NH1 2.89Å; E427-R529 IonicContact OE2-NH1 2.82Å; E427-R529 PolarHBondContact OE2-NH1 3.04Å
428	N	59.3	Low	54.6	Low	57 Å²	57	98.3 Å²	98.3	31%	0.305	51%	0.509	S	S	.	.			trans	-72	53.1	-177.3	-114.2	-21.6	0	0	0	114.2	S424 N430 P475	S424-N428 WeakPolarHBondContact O-CB 3.43Å; S424-N428 PolarHBondContact O-N 2.71Å; S424-N428 PolarHBondContact O-ND2 3.14Å; N428-N430 PolarHBondContact O-N 3.36Å; N428-N430 VanDerWaalsContact O-N 3.11Å; N428-P475 HydrophobicContact CB-CB 4.32Å
429	T	48.4	Very low	52.4	Low	95 Å²	95	102.4 Å²	102.4	58%	0.583	52%	0.518	S	S	*	.			trans	-56.2	112.8	145.4	54.8	0	0	0	0	107.4	E427 K431	E427-T429 PolarHBondContact O-N 3.45Å; E427-T429 PolarHBondContact O-OG1 2.93Å; T429-K431 PolarHBondContact O-N 2.77Å
430	N	34.5	Very low	49.9	Very low	93 Å²	93	107 Å²	107	50%	0.497	54%	0.541	S	S	.	.			trans	-73.5	80.6	-176.5	-120.3	-26.9	0	0	0	109.4	N428 K432	N428-N430 PolarHBondContact O-N 3.36Å; N428-N430 VanDerWaalsContact O-N 3.11Å; N430-K432 PolarHBondContact O-N 3.39Å
431	K	31.6	Very low	47.5	Very low	188 Å²	188	111.2 Å²	111.2	82%	0.817	56%	0.555	S	S	*	*			trans	-65.1	73	164.2	-69	-177.4	178.5	178.7	0	108.9	T429 S433	T429-K431 PolarHBondContact O-N 2.77Å; K431-S433 PolarHBondContact O-N 2.72Å
432	K	29.2	Very low	44.9	Very low	172 Å²	172	118.9 Å²	118.9	75%	0.748	58%	0.58	S	S	*	*			trans	-57.7	134.5	156.3	-82.6	-173.3	173.1	178.6	0	106.7	N430	N430-K432 PolarHBondContact O-N 3.39Å
433	S	27.4	Very low	42.1	Very low	84 Å²	84	127.5 Å²	127.5	59%	0.587	62%	0.621	S	S	*	*			trans	-66.3	132.4	-171.2	44.5	0	0	0	0	111.8	K431 Y435	K431-S433 PolarHBondContact O-N 2.72Å; S433-Y435 PolarHBondContact O-N 3.39Å; S433-Y435 PolarHBondContact OG-O 2.81Å; S433-Y435 VanDerWaalsContact OG-O 3.11Å
434	D	25.3	Very low	39.3	Very low	163 Å²	163	134 Å²	134	87%	0.872	66%	0.655	S	S	*	*	S	Bend	trans	-69.2	30.6	163.2	-63.9	-57.8	0	0	0	112.6
435	Y	25.4	Very low	36.7	Very low	193 Å²	193	137 Å²	137	76%	0.757	67%	0.671	S	S	*	*	S	Bend	trans	-135.3	126.6	177	-60.4	-77.5	0	0	0	106.8	S433	S433-Y435 PolarHBondContact O-N 3.39Å; S433-Y435 PolarHBondContact OG-O 2.81Å; S433-Y435 VanDerWaalsContact OG-O 3.11Å
436	L	24.4	Very low	33.9	Very low	171 Å²	171	142 Å²	142	90%	0.895	70%	0.696	S	S	*	*	S	Bend	trans	81.4	60.9	-171.6	-54.8	167.3	0	0	0	116.3
437	Y	25.3	Very low	31	Very low	234 Å²	234	149.7 Å²	149.7	92%	0.918	74%	0.738	S	S	*	*				-134.9	138.9	126.5	-115.7	-84.7	0	0	0	109.9
438	D	24.6	Very low	28.2	Very low	138 Å²	138	150.6 Å²	150.6	74%	0.738	75%	0.753	S	S	*	*			trans	-63.4	136.4	-179	-84.5	-65.7	0	0	0	111.2
439	K	23.8	Very low	26.6	Very low	171 Å²	171	157.6 Å²	157.6	74%	0.743	78%	0.784	S	S	*	*				44.9	120.8	83.7	-84.8	-178.4	175.2	176.5	0	113.8
440	N	23.3	Very low	25.4	Very low	153 Å²	153	163 Å²	163	82%	0.818	80%	0.799	S	S	*	*			trans	77.8	66.2	163.9	-41.3	-41.7	0	0	0	117.9
441	V	27.9	Very low	24.9	Very low	141 Å²	141	163.8 Å²	163.8	86%	0.855	81%	0.812	S	S	*	*				-131.6	131.9	128.3	-176.3	0	0	0	0	109.8
442	R	25.3	Very low	24.6	Very low	219 Å²	219	160.2 Å²	160.2	83%	0.826	81%	0.81	S	S	*	*			trans	-30.4	134.2	175.2	-65.2	163.7	-176.9	153.1	1.3	114.7
443	E	21.4	Very low	24.4	Very low	184 Å²	184	159.5 Å²	159.5	86%	0.86	81%	0.814	S	S	*	*				47.4	99.1	80.6	-79.3	-170.3	140.3	0	0	113.6
444	L	24.3	Very low	24.1	Very low	172 Å²	172	162.4 Å²	162.4	90%	0.901	82%	0.823	S	S	*	*			trans	-146.5	147.4	141.1	-110.7	169.3	0	0	0	108.3
445	T	23.2	Very low	24	Very low	122 Å²	122	159.9 Å²	159.9	75%	0.748	82%	0.818	S	S	*	*			trans	-90.3	153.9	-162.7	44.1	0	0	0	0	114.2
446	I	22.7	Very low	23.9	Very low	145 Å²	145	156.6 Å²	156.6	74%	0.744	82%	0.817	S	S	*	*			trans	-6.1	123.8	144.7	-56.8	158.3	0	0	0	114
447	D	23.8	Very low	23.8	Very low	170 Å²	170	154.1 Å²	154.1	91%	0.909	81%	0.81	S	S	*	*				-134.8	150.1	129.1	-110.6	-37.6	0	0	0	109
448	S	22.4	Very low	23.7	Very low	98 Å²	98	150.4 Å²	150.4	69%	0.685	80%	0.803	S	S	*	*			trans	-130.8	130.1	-168.2	65.6	0	0	0	0	112.2
449	E	24.8	Very low	23.6	Very low	204 Å²	204	149 Å²	149	95%	0.953	80%	0.799	S	S	*	*			trans	-146.1	163.6	161.6	-128.8	169.8	-143.2	0	0	112.7
450	K	22.8	Very low	23.5	Very low	209 Å²	209	146.8 Å²	146.8	91%	0.909	80%	0.802	S	S	*	*			trans	-125.7	122.8	-166.6	-67.7	175.2	178.6	173.5	0	112.2
451	S	23.9	Very low	23.6	Very low	109 Å²	109	143.7 Å²	143.7	76%	0.762	80%	0.798	S	S	*	*			trans	-155	101.7	158.9	38.9	0	0	0	0	107.6
452	S	25	Very low	23.4	Very low	112 Å²	112	143 Å²	143	78%	0.783	79%	0.794	S	S	*	*				76.9	117.4	80	68.7	0	0	0	0	113.1
453	L	24.7	Very low	23.6	Very low	157 Å²	157	138.4 Å²	138.4	82%	0.822	78%	0.782	S	S	*	*			trans	-51.8	137.6	165.9	-88.4	57.4	0	0	0	110.6
454	D	22.6	Very low	23.8	Very low	146 Å²	146	133.8 Å²	133.8	78%	0.781	77%	0.77	S	S	*	*				-178	164.6	110.9	-94.1	-25.6	0	0	0	112.3
455	S	23	Very low	23.9	Very low	109 Å²	109	135 Å²	135	76%	0.762	77%	0.771	S	S	*	*			trans	58.5	80.9	170.7	61.2	0	0	0	0	118
456	V	23.9	Very low	24	Very low	124 Å²	124	135 Å²	135	75%	0.752	78%	0.776	S	S	*	*			trans	-91.7	101	156.6	178.6	0	0	0	0	109.1	M458	V456-M458 HydrophobicContact CG1-CE 4.17Å; V456-M458 PolarHBondContact O-N 3.4Å
457	T	20.9	Very low	24.1	Very low	120 Å²	120	131.1 Å²	131.1	74%	0.736	76%	0.762	S	S	*	*			trans	-70.3	111.6	170.2	-57.6	0	0	0	0	109.3	T459	T457-T459 PolarHBondContact O-N 3.44Å
458	M	22.6	Very low	24.3	Very low	156 Å²	156	129.8 Å²	129.8	77%	0.768	76%	0.763	S	S	*	*			trans	-77	86.8	-179	-70.1	-94	62.9	0	0	111.4	V456	V456-M458 HydrophobicContact CG1-CE 4.17Å; V456-M458 PolarHBondContact O-N 3.4Å
459	T	24.1	Very low	24.4	Very low	109 Å²	109	133.4 Å²	133.4	67%	0.669	77%	0.766	S	S	*	*			trans	-69.3	133.2	159.9	48.2	0	0	0	0	109.5	T457 A461	T457-T459 PolarHBondContact O-N 3.44Å; T459-A461 PolarHBondContact O-N 2.73Å
460	P	21.9	Very low	24.6	Very low	123 Å²	123	128 Å²	128	80%	0.799	75%	0.751	S	S	*	*			trans	-63.9	125.9	175.7	26.8	-33.7	0	0	0	109.8	T462	P460-T462 PolarHBondContact O-N 3.47Å
461	A	24.3	Very low	25.1	Very low	89 Å²	89	125.7 Å²	125.7	74%	0.736	75%	0.748	S	S	*	*			trans	-79.4	99.4	-178.3	0	0	0	0	0	110.7	T459	T459-A461 PolarHBondContact O-N 2.73Å
462	T	24.8	Very low	25.9	Very low	125 Å²	125	126.6 Å²	126.6	77%	0.767	74%	0.74	S	S	*	*			trans	-54.8	141.5	159.3	-15.4	0	0	0	0	109.1	P460 S464	P460-T462 PolarHBondContact O-N 3.47Å; T462-S464 PolarHBondContact O-N 2.86Å
463	Q	27.5	Very low	26.9	Very low	123 Å²	123	127.2 Å²	127.2	58%	0.575	74%	0.739	S	S	*	*	S	Bend	trans	-73	87.2	-177.5	-67.2	-173.2	8.3	0	0	111.7
464	S	26.6	Very low	28.3	Very low	88 Å²	88	122.1 Å²	122.1	62%	0.615	72%	0.717	S	S	*	*			trans	-158.5	71.2	172.7	64.1	0	0	0	0	113.2	T462	T462-S464 PolarHBondContact O-N 2.86Å
465	E	26.8	Very low	30.5	Very low	196 Å²	196	116.8 Å²	116.8	92%	0.916	69%	0.69	S	S	*	*			trans	-170.6	55.8	151	-112	173.3	-142.4	0	0	113.3	S467	E465-S467 PolarHBondContact O-N 2.77Å; E465-S467 VanDerWaalsContact O-N 3.16Å
466	S	25.6	Very low	33.4	Very low	122 Å²	122	112.4 Å²	112.4	85%	0.853	66%	0.662	S	S	*	*			trans	-78	89.5	159.5	43.3	0	0	0	0	109.8
467	S	24.8	Very low	36.3	Very low	65 Å²	65	106.7 Å²	106.7	46%	0.455	63%	0.627	S	S	.	*			trans	-47.3	143.2	160.8	59.4	0	0	0	0	110.5	E465 K469	E465-S467 PolarHBondContact O-N 2.77Å; E465-S467 VanDerWaalsContact O-N 3.16Å; S467-K469 PolarHBondContact O-N 3.14Å; S467-K469 WeakPolarHBondContact OG-CE 3.36Å
468	P	26.7	Very low	39.3	Very low	141 Å²	141	101.8 Å²	101.8	92%	0.916	60%	0.597	S	S	*	*			trans	-69.6	78.2	175.7	30.3	-35.6	0	0	0	110.8
469	K	26	Very low	42.2	Very low	175 Å²	175	94.3 Å²	94.3	76%	0.761	56%	0.56	S	S	*	*			trans	-74.5	127.9	167.1	-75.1	167.7	-179	169.4	0	106.9	S467	S467-K469 PolarHBondContact O-N 3.14Å; S467-K469 WeakPolarHBondContact OG-CE 3.36Å
470	S	28.4	Very low	44.9	Very low	90 Å²	90	89.9 Å²	89.9	63%	0.629	54%	0.535	S	S	*	.			trans	-36	142.8	179	56.1	0	0	0	0	113.7	H472	S470-H472 PolarHBondContact O-N 3.2Å
471	D	33.2	Very low	47.8	Very low	161 Å²	161	85.7 Å²	85.7	86%	0.861	51%	0.505	S	S	*	.			trans	-60.8	63.5	-172.7	-53.5	-75.3	0	0	0	115.7	V473	D471-V473 PolarHBondContact O-N 2.64Å
472	H	40.2	Very low	50.5	Low	128 Å²	128	82.2 Å²	82.2	59%	0.593	48%	0.475	S	S	*	.			trans	-76	73.6	161.2	-97.3	-77.8	0	0	0	108.3	S470 S474	S470-H472 PolarHBondContact O-N 3.2Å; H472-S474 PolarHBondContact O-N 2.8Å; H472-S474 VanDerWaalsContact O-N 3.09Å
473	V	45.4	Very low	52.8	Low	124 Å²	124	79 Å²	79	75%	0.752	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-46.8	119.4	165.9	-178.6	0	0	0	0	107.5	D471	D471-V473 PolarHBondContact O-N 2.64Å
474	S	54.7	Low	55.2	Low	51 Å²	51	74.2 Å²	74.2	36%	0.357	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-64.2	140.2	-179.2	-58.6	0	0	0	0	109.4	H472 G476 H643	H472-S474 PolarHBondContact O-N 2.8Å; H472-S474 VanDerWaalsContact O-N 3.09Å; S474-G476 PolarHBondContact O-N 2.87Å; S474-H643 VanDerWaalsContact CB-NE2 3.25Å; S474-H643 WeakPolarHBondContact CB-NE2 3.43Å; S474-H643 PolarHBondContact OG-NE2 2.88Å
475	P	70	Confident	58	Low	33 Å²	33	70 Å²	70	21%	0.214	40%	0.398	C	S	.	.	S	Bend	trans	-56.7	135.4	175.6	24	-33.2	0	0	0	110.1	L425 L426 N428 P491	L425-P475 WeakPolarHBondContact O-CA 3.47Å; L425-P475 WeakPolarHBondContact O-CB 3.13Å; L426-P475 WeakPolarHBondContact O-CB 3.17Å; N428-P475 HydrophobicContact CB-CB 4.32Å; P475-P491 WeakPolarHBondContact O-CD 3.14Å
476	G	82.4	Confident	60.9	Low	18 Å²	18	62 Å²	62	19%	0.186	36%	0.36	C	S	.	.			trans	177	167.9	-168.6	0	0	0	0	0	112.2	L425 S474 V489	L425-G476 PolarHBondContact O-N 3.15Å; S474-G476 PolarHBondContact O-N 2.87Å; G476-V489 CarbonylContact C-O 3.57Å; G476-V489 WeakPolarHBondContact CA-O 3.45Å
477	I	85.7	Confident	64	Low	4 Å²	4	56.1 Å²	56.1	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.6	179.5	63.1	-177.4	0	0	0	110.4	I405 L422 L425 L426 I479 V489 P531	I405-I477 HydrophobicContact CG2-CB 4.07Å; L422-I477 HydrophobicContact CD2-CD1 3.61Å; L422-I477 HydrophobicContact CD2-CG2 4.14Å; L425-I477 HydrophobicContact CB-CG2 3.83Å; L425-I477 HydrophobicContact CD1-CG2 3.87Å; L426-I477 HydrophobicContact CD1-CD1 4.32Å; L426-I477 HydrophobicContact CD2-CD1 4.28Å; L426-I477 HydrophobicContact CD2-CG1 4.14Å; L426-I477 HydrophobicContact CD2-CG2 4.11Å; L426-I477 HydrophobicContact CG-CG2 4.32Å; I477-I479 HydrophobicContact CD1-CD1 3.7Å; I477-I479 HydrophobicContact CD1-CG1 4.23Å; I477-I479 HydrophobicContact CG1-CD1 4.24Å; I477-I479 HydrophobicContact CG1-CG1 4.44Å; I477-V489 HydrophobicContact CG1-CB 3.94Å; I477-V489 HydrophobicContact CG1-CG2 4.38Å; I477-V489 PolarHBondContact N-O 3.43Å; I477-V489 PolarHBondContact O-N 2.67Å; I477-P531 HydrophobicContact CD1-CG 4.48Å
478	T	84	Confident	67.2	Low	16 Å²	16	57.3 Å²	57.3	10%	0.098	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.8	168	-60.5	0	0	0	0	109.5	I405 S406 L411 H486 R488	I405-T478 CarbonylContact C-O 3.25Å; I405-T478 VanDerWaalsContact CA-O 3.31Å; I405-T478 WeakPolarHBondContact CA-O 3.46Å; I405-T478 WeakPolarHBondContact CG2-O 2.96Å; S406-T478 PolarHBondContact N-O 2.89Å; S406-T478 PolarHBondContact O-N 3.42Å; L411-T478 HydrophobicContact CD2-CG2 4.16Å; T478-H486 HydrophobicContact CG2-CB 3.99Å; T478-R488 HydrophobicContact CG2-CG 4.28Å
479	I	83.8	Confident	70.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.9	-178.5	-68.7	162.3	0	0	0	109.1	L403 I405 I477 L481 H486 V487 F536	L403-I479 HydrophobicContact CB-CG2 4.47Å; L403-I479 HydrophobicContact CD1-CD1 3.83Å; L403-I479 HydrophobicContact CD1-CG1 4.1Å; L403-I479 HydrophobicContact CD1-CG2 4.02Å; L403-I479 HydrophobicContact CD2-CG2 3.89Å; L403-I479 HydrophobicContact CG-CG2 4.35Å; I405-I479 HydrophobicContact CD1-CG1 4.04Å; I405-I479 HydrophobicContact CG1-CG1 4.07Å; I405-I479 HydrophobicContact CG2-CG1 4.22Å; I477-I479 HydrophobicContact CD1-CD1 3.7Å; I477-I479 HydrophobicContact CD1-CG1 4.23Å; I477-I479 HydrophobicContact CG1-CD1 4.24Å; I477-I479 HydrophobicContact CG1-CG1 4.44Å; I479-L481 HydrophobicContact CG2-CD2 4.41Å; I479-H486 CarbonylContact O-C 3.56Å; I479-H486 WeakPolarHBondContact O-CA 3.34Å; I479-V487 PolarHBondContact N-O 3.07Å; I479-V487 PolarHBondContact O-N 2.92Å; I479-F536 HydrophobicContact CD1-CD1 4.28Å; I479-F536 HydrophobicContact CD1-CE1 3.5Å; I479-F536 VanDerWaalsContact CD1-CE1 3.5Å; I479-F536 HydrophobicContact CD1-CE2 3.91Å; I479-F536 HydrophobicContact CD1-CZ 3.29Å
480	A	80.8	Confident	73.4	Confident	15 Å²	15	43.4 Å²	43.4	12%	0.124	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	125.9	173.7	0	0	0	0	0	112	V404	V404-A480 HydrophobicContact CB-CB 4.34Å; V404-A480 PolarHBondContact O-N 3.14Å
481	L	81.7	Confident	76.4	Confident	35 Å²	35	40.4 Å²	40.4	18%	0.183	22%	0.218	C	C	.	.	S	Bend	trans	-94.7	-38.1	171.2	-57.5	-177	0	0	0	110.9	I479 L485 V487 F536 Y539	I479-L481 HydrophobicContact CG2-CD2 4.41Å; L481-L485 HydrophobicContact CD1-CD2 4.35Å; L481-L485 PolarHBondContact N-O 3.47Å; L481-V487 HydrophobicContact CD1-CG2 3.62Å; L481-V487 HydrophobicContact CG-CG2 4.1Å; L481-F536 HydrophobicContact CD2-CB 4.12Å; L481-Y539 VanDerWaalsContact CD1-CB 3.44Å; L481-Y539 HydrophobicContact CD1-CG 4.47Å
482	T	80.6	Confident	79	Confident	17 Å²	17	33.3 Å²	33.3	10%	0.104	18%	0.181	C	C	.	.	S	Bend	trans	-135.5	-175.7	166.4	79.4	0	0	0	0	108.9	N484 L485 Y543	T482-N484 PolarHBondContact O-N 2.76Å; T482-N484 PolarHBondContact OG1-N 2.92Å; T482-N484 VanDerWaalsContact OG1-N 3.11Å; T482-L485 PolarHBondContact N-O 2.95Å; T482-L485 VanDerWaalsContact N-O 3.1Å; T482-L485 PolarHBondContact OG1-N 3.37Å; T482-Y543 HydrophobicContact CG2-CD1 4.27Å; T482-Y543 HydrophobicContact CG2-CE1 3.85Å; T482-Y543 HydrophobicContact CG2-CE2 4.44Å
483	R	73.3	Confident	81.3	Confident	56 Å²	56	31.8 Å²	31.8	21%	0.211	17%	0.173	C	C	.	.	S	Bend	trans	-63.4	-25.3	170.3	-78.1	166.9	179.2	177.4	-2.4	114	F361 H486 N1198	F361-R483 HydrophobicContact CD1-CG 4.24Å; F361-R483 HydrophobicContact CE1-CG 3.53Å; F361-R483 HydrophobicContact CZ-CG 3.93Å; R483-H486 PolarHBondContact O-NE2 2.69Å; R483-N1198 HydrophobicContact CB-CB 4.18Å; R483-N1198 WeakPolarHBondContact CD-OXT 3.45Å; R483-N1198 HydrophobicContact CG-CB 4.49Å; R483-N1198 PolarHBondContact NH1-OXT 2.88Å
484	N	78	Confident	83.2	Confident	23 Å²	23	26.6 Å²	26.6	12%	0.123	14%	0.141	C	C	.	.	S	Bend	trans	-121.1	-0.4	-165.4	-58.5	-27.8	0	0	0	111.3	T482 G509 Q512 F513 N1198	T482-N484 PolarHBondContact O-N 2.76Å; T482-N484 PolarHBondContact OG1-N 2.92Å; T482-N484 VanDerWaalsContact OG1-N 3.11Å; N484-G509 WeakPolarHBondContact O-CA 3.43Å; N484-Q512 PolarHBondContact O-OE1 3.48Å; N484-F513 HydrophobicContact CB-CE2 4.19Å; N484-F513 HydrophobicContact CB-CZ 3.98Å; N484-N1198 PolarHBondContact ND2-O 3.32Å; N484-N1198 PolarHBondContact OD1-N 3.41Å
485	L	85.3	Confident	84.4	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.158	C	C	.	.			trans	-136.4	114.9	176.8	-177.8	64.7	0	0	0	110.2	L481 T482 F510 Y543	L481-L485 HydrophobicContact CD1-CD2 4.35Å; L481-L485 PolarHBondContact N-O 3.47Å; T482-L485 PolarHBondContact N-O 2.95Å; T482-L485 VanDerWaalsContact N-O 3.1Å; T482-L485 PolarHBondContact OG1-N 3.37Å; L485-F510 HydrophobicContact CD1-CD1 3.86Å; L485-F510 HydrophobicContact CD1-CD2 4.32Å; L485-F510 HydrophobicContact CD1-CE1 3.99Å; L485-F510 HydrophobicContact CD1-CE2 4.45Å; L485-F510 HydrophobicContact CD1-CG 4.01Å; L485-F510 HydrophobicContact CD1-CZ 4.28Å; L485-F510 HydrophobicContact CD2-CD1 4.23Å; L485-F510 HydrophobicContact CD2-CE1 3.65Å; L485-F510 HydrophobicContact CD2-CZ 4.03Å; L485-Y543 HydrophobicContact CD2-CD2 3.89Å; L485-Y543 HydrophobicContact CD2-CG 3.95Å
486	H	87.9	Confident	84.7	Confident	27 Å²	27	31.6 Å²	31.6	13%	0.125	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	154.6	179	-48.4	124.4	0	0	0	110.3	T478 I479 R483 S507 S508	T478-H486 HydrophobicContact CG2-CB 3.99Å; I479-H486 CarbonylContact O-C 3.56Å; I479-H486 WeakPolarHBondContact O-CA 3.34Å; R483-H486 PolarHBondContact O-NE2 2.69Å; H486-S507 CarbonylContact O-C 3.55Å; H486-S507 WeakPolarHBondContact O-CA 3.47Å; H486-S508 PolarHBondContact N-O 3.13Å; H486-S508 PolarHBondContact O-N 2.77Å
487	V	91.3	Very high	84.3	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	118.5	170.5	-179.9	0	0	0	0	108.5	I479 L481 V489 F505 F536 Y539	I479-V487 PolarHBondContact N-O 3.07Å; I479-V487 PolarHBondContact O-N 2.92Å; L481-V487 HydrophobicContact CD1-CG2 3.62Å; L481-V487 HydrophobicContact CG-CG2 4.1Å; V487-V489 HydrophobicContact CG1-CG2 4.08Å; V487-F505 HydrophobicContact CG1-CB 4.2Å; V487-F505 HydrophobicContact CG1-CD1 4.09Å; V487-F536 HydrophobicContact CB-CD1 4.36Å; V487-F536 HydrophobicContact CB-CE1 4.49Å; V487-F536 HydrophobicContact CG1-CD1 4.23Å; V487-F536 HydrophobicContact CG1-CE1 4.11Å; V487-Y539 HydrophobicContact CG1-CD2 4.11Å; V487-Y539 HydrophobicContact CG1-CE2 3.88Å; V487-Y539 HydrophobicContact CG2-CD1 4.09Å; V487-Y539 HydrophobicContact CG2-CD2 3.73Å; V487-Y539 HydrophobicContact CG2-CE2 4.18Å; V487-Y539 HydrophobicContact CG2-CG 3.69Å
488	R	91.1	Very high	84.1	Confident	89 Å²	89	34.9 Å²	34.9	34%	0.336	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	139.1	170.8	-59	178.6	178.4	173.6	-0.1	108.3	T478 F505 S506	T478-R488 HydrophobicContact CG2-CG 4.28Å; R488-F505 WeakPolarHBondContact O-CA 3.25Å; R488-S506 PolarHBondContact N-O 2.92Å; R488-S506 PolarHBondContact O-N 3.27Å
489	V	92.5	Very high	84.1	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	126	-179.3	-167.3	0	0	0	0	110.6	G476 I477 V487 W503 C504 F505 P531 F536	G476-V489 CarbonylContact C-O 3.57Å; G476-V489 WeakPolarHBondContact CA-O 3.45Å; I477-V489 HydrophobicContact CG1-CB 3.94Å; I477-V489 HydrophobicContact CG1-CG2 4.38Å; I477-V489 PolarHBondContact N-O 3.43Å; I477-V489 PolarHBondContact O-N 2.67Å; V487-V489 HydrophobicContact CG1-CG2 4.08Å; V489-W503 HydrophobicContact CG1-CE3 4.29Å; V489-C504 WeakPolarHBondContact CA-O 3.32Å; V489-F505 HydrophobicContact CB-CD1 4.45Å; V489-F505 HydrophobicContact CG1-CD1 4.03Å; V489-F505 HydrophobicContact CG1-CE1 4.05Å; V489-F505 HydrophobicContact CG1-CG 4.43Å; V489-F505 HydrophobicContact CG1-CZ 4.47Å; V489-F505 HydrophobicContact CG2-CD1 3.63Å; V489-F505 HydrophobicContact CG2-CE1 4.02Å; V489-F505 HydrophobicContact CG2-CG 4.47Å; V489-P531 HydrophobicContact CG1-CB 3.9Å; V489-P531 HydrophobicContact CG1-CG 4.06Å; V489-F536 HydrophobicContact CG2-CE1 3.62Å; V489-F536 HydrophobicContact CG2-CZ 3.9Å
490	H	90.8	Very high	84.3	Confident	25 Å²	25	46.7 Å²	46.7	12%	0.116	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135.1	178.3	-56.1	89.5	0	0	0	109.8	C504 H643	H490-C504 PolarHBondContact N-O 3.2Å; H490-C504 PolarHBondContact O-N 2.99Å; H490-H643 HydrophobicContact CB-CB 4.24Å; H490-H643 AromaticContact CD2-CD2 3.93Å; H490-H643 AromaticContact CD2-CG 3.89Å; H490-H643 AromaticContact CE1-CG 3.84Å; H490-H643 AromaticContact CG-CD2 3.82Å; H490-H643 AromaticContact CG-CG 3.73Å; H490-H643 WeakPolarHBondContact ND1-CB 3.39Å; H490-H643 AromaticContact ND1-CG 3.72Å; H490-H643 AromaticContact NE2-CG 3.98Å
491	P	91	Very high	84.8	Confident	27 Å²	27	47.6 Å²	47.6	18%	0.175	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	135.1	161.2	23.7	-15.5	0	0	0	108.7	L426 P475 T502 W503	L426-P491 HydrophobicContact CB-CG 4.48Å; L426-P491 VanDerWaalsContact O-CG 3.29Å; L426-P491 WeakPolarHBondContact O-CG 3.48Å; P475-P491 WeakPolarHBondContact O-CD 3.14Å; P491-T502 WeakPolarHBondContact CA-O 3.35Å; P491-W503 HydrophobicContact CB-CE3 4.05Å; P491-W503 HydrophobicContact CB-CH2 4.48Å; P491-W503 HydrophobicContact CB-CZ3 3.72Å; P491-W503 HydrophobicContact CG-CZ3 4.1Å
492	T	89.2	Confident	85.3	Confident	12 Å²	12	45.9 Å²	45.9	7%	0.074	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	128.4	-173.4	-51.7	0	0	0	0	111.5	L494 T502 G641 L642	T492-L494 HydrophobicContact CG2-CD2 4.02Å; T492-T502 PolarHBondContact N-O 3.33Å; T492-T502 PolarHBondContact O-N 3.26Å; T492-T502 PolarHBondContact O-OG1 3.11Å; T492-G641 WeakPolarHBondContact CG2-O 3.32Å; T492-L642 HydrophobicContact CG2-CD2 4.22Å
493	E	88.3	Confident	85.9	Confident	95 Å²	95	45.1 Å²	45.1	44%	0.444	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	111.7	178	-61.2	-57.1	145.7	0	0	110.1	N495 S501	E493-N495 VanDerWaalsContact C-N 3.25Å; E493-N495 PolarHBondContact O-N 2.69Å; E493-S501 WeakPolarHBondContact OE1-CB 3.24Å; E493-S501 PolarHBondContact OE1-OG 2.97Å; E493-S501 WeakPolarHBondContact OE2-CA 3.19Å; E493-S501 WeakPolarHBondContact OE2-CB 3.34Å; E493-S501 PolarHBondContact OE2-N 3.49Å
494	L	85.2	Confident	86.9	Confident	15 Å²	15	42.5 Å²	42.5	8%	0.079	21%	0.211	C	C	.	.			trans	-81.3	65.2	-170.6	-59.9	-173.5	0	0	0	112.9	T492 C496 L498 R499 Q500 T502 L642	T492-L494 HydrophobicContact CG2-CD2 4.02Å; L494-C496 VanDerWaalsContact C-N 3.3Å; L494-C496 PolarHBondContact O-N 3.16Å; L494-L498 HydrophobicContact CB-CB 4.33Å; L494-L498 HydrophobicContact CD1-CB 4.25Å; L494-L498 HydrophobicContact CD1-CD1 3.97Å; L494-R499 VanDerWaalsContact O-CA 3.3Å; L494-R499 WeakPolarHBondContact O-CA 3.22Å; L494-R499 PolarHBondContact O-N 2.72Å; L494-Q500 PolarHBondContact N-O 2.8Å; L494-T502 HydrophobicContact CD1-CG2 3.6Å; L494-T502 HydrophobicContact CG-CG2 3.87Å; L494-L642 HydrophobicContact CD2-CD2 3.5Å
495	N	79.3	Confident	87.8	Confident	131 Å²	131	41.4 Å²	41.4	70%	0.701	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.4	-170.2	-67	-38.4	0	0	0	115.2	E493	E493-N495 VanDerWaalsContact C-N 3.25Å; E493-N495 PolarHBondContact O-N 2.69Å
496	C	77.1	Confident	88.2	Confident	59 Å²	59	41.4 Å²	41.4	40%	0.399	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-67.3	-179.1	56.2	0	0	0	0	112.5	L494 C638	L494-C496 VanDerWaalsContact C-N 3.3Å; L494-C496 PolarHBondContact O-N 3.16Å; C496-C638 HydrophobicContact CB-CB 4.27Å; C496-C638 WeakPolarHBondContact CB-SG 3.48Å; C496-C638 WeakPolarHBondContact SG-CB 3.5Å; C496-C638 CovalentContact SG-SG 2.06Å; C496-C638 PolarHBondContact SG-SG 2.96Å
497	C	74.4	Confident	88.5	Confident	64 Å²	64	40.2 Å²	40.2	43%	0.432	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-51.9	-163.8	-60	0	0	0	0	113.8	C638 Y680	C497-C638 VanDerWaalsContact SG-CB 3.55Å; C497-Y680 HydrophobicContact CB-CD2 4.24Å; C497-Y680 HydrophobicContact CB-CE2 3.36Å
498	L	80.5	Confident	88.3	Confident	27 Å²	27	42 Å²	42	14%	0.141	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-22.2	-172.2	-65.5	179.5	0	0	0	114	L494 Q500 Y680 L686	L494-L498 HydrophobicContact CB-CB 4.33Å; L494-L498 HydrophobicContact CD1-CB 4.25Å; L494-L498 HydrophobicContact CD1-CD1 3.97Å; L498-Q500 VanDerWaalsContact C-N 3.32Å; L498-Q500 WeakPolarHBondContact O-CG 3.45Å; L498-Q500 PolarHBondContact O-N 3.1Å; L498-Y680 HydrophobicContact CD2-CG 4.39Å; L498-L686 HydrophobicContact CD1-CB 3.63Å; L498-L686 HydrophobicContact CD1-CD2 4.17Å
499	R	84.6	Confident	88	Confident	207 Å²	207	38 Å²	38	78%	0.781	20%	0.199	S	C	*	.			trans	50.6	46.4	179.3	-58.5	-177	-178	173.4	2	113.4	L494	L494-R499 VanDerWaalsContact O-CA 3.3Å; L494-R499 WeakPolarHBondContact O-CA 3.22Å; L494-R499 PolarHBondContact O-N 2.72Å
500	Q	87.5	Confident	87.7	Confident	57 Å²	57	38 Å²	38	27%	0.266	20%	0.199	S	C	.	.			trans	-131.8	148.5	-178.3	-75.8	177.5	61.3	0	0	111.6	L494 L498 R523 L686	L494-Q500 PolarHBondContact N-O 2.8Å; L498-Q500 VanDerWaalsContact C-N 3.32Å; L498-Q500 WeakPolarHBondContact O-CG 3.45Å; L498-Q500 PolarHBondContact O-N 3.1Å; Q500-R523 VanDerWaalsContact OE1-CD 3.3Å; Q500-R523 VanDerWaalsContact OE1-NE 3.13Å; Q500-L686 HydrophobicContact CB-CD2 4.14Å
501	S	90.7	Very high	87.1	Confident	33 Å²	33	37.8 Å²	37.8	23%	0.231	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.1	169.7	-168.5	0	0	0	0	110.1	E493 R524	E493-S501 WeakPolarHBondContact OE1-CB 3.24Å; E493-S501 PolarHBondContact OE1-OG 2.97Å; E493-S501 WeakPolarHBondContact OE2-CA 3.19Å; E493-S501 WeakPolarHBondContact OE2-CB 3.34Å; E493-S501 PolarHBondContact OE2-N 3.49Å; S501-R524 WeakPolarHBondContact O-CB 3.45Å; S501-R524 PolarHBondContact O-N 2.95Å; S501-R524 VanDerWaalsContact O-N 3.12Å
502	T	92.7	Very high	86.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	157.7	-172.1	66.1	0	0	0	0	112.2	P491 T492 L494 L522 L686	P491-T502 WeakPolarHBondContact CA-O 3.35Å; T492-T502 PolarHBondContact N-O 3.33Å; T492-T502 PolarHBondContact O-N 3.26Å; T492-T502 PolarHBondContact O-OG1 3.11Å; L494-T502 HydrophobicContact CD1-CG2 3.6Å; L494-T502 HydrophobicContact CG-CG2 3.87Å; T502-L522 CarbonylContact C-O 3.6Å; T502-L522 VanDerWaalsContact CA-O 3.3Å; T502-L522 WeakPolarHBondContact CA-O 3.3Å; T502-L522 WeakPolarHBondContact CB-O 3.41Å; T502-L686 HydrophobicContact CG2-CD1 3.46Å; T502-L686 VanDerWaalsContact CG2-CD1 3.46Å; T502-L686 HydrophobicContact CG2-CD2 3.9Å; T502-L686 HydrophobicContact CG2-CG 4.32Å
503	W	94	Very high	86	Confident	1 Å²	1	38.6 Å²	38.6	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	119.7	160.8	-62.1	111.5	0	0	0	108.3	L426 V489 P491 F505 L521 L522 R524 E528 L530 P531	L426-W503 HydrophobicContact CB-CZ3 4.48Å; L426-W503 HydrophobicContact CD1-CH2 4.12Å; L426-W503 HydrophobicContact CD1-CZ3 4.07Å; L426-W503 HydrophobicContact CD2-CZ3 4.19Å; L426-W503 HydrophobicContact CG-CZ3 4.49Å; V489-W503 HydrophobicContact CG1-CE3 4.29Å; P491-W503 HydrophobicContact CB-CE3 4.05Å; P491-W503 HydrophobicContact CB-CH2 4.48Å; P491-W503 HydrophobicContact CB-CZ3 3.72Å; P491-W503 HydrophobicContact CG-CZ3 4.1Å; W503-F505 HydrophobicContact CB-CD2 3.99Å; W503-F505 HydrophobicContact CB-CE2 3.45Å; W503-F505 VanDerWaalsContact CB-CE2 3.45Å; W503-F505 HydrophobicContact CB-CZ 4.15Å; W503-F505 HydrophobicContact CG-CE2 4.31Å; W503-L521 WeakPolarHBondContact O-CA 3.43Å; W503-L522 PolarHBondContact N-O 3.23Å; W503-L522 PolarHBondContact O-N 3.14Å; W503-R524 HydrophobicContact CZ2-CG 4.37Å; W503-E528 HydrophobicContact CZ2-CG 4.46Å; W503-E528 PolarHBondContact NE1-OE2 2.88Å; W503-L530 VanDerWaalsContact CZ2-C 3.43Å; W503-P531 HydrophobicContact CD2-CB 4.21Å; W503-P531 HydrophobicContact CE3-CB 4.38Å; W503-P531 HydrophobicContact CG-CB 4.49Å
504	C	94.6	Very high	85.3	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	104.7	170.5	-176.3	0	0	0	0	108.4	V489 H490 L521	V489-C504 WeakPolarHBondContact CA-O 3.32Å; H490-C504 PolarHBondContact N-O 3.2Å; H490-C504 PolarHBondContact O-N 2.99Å; C504-L521 HydrophobicContact CB-CD2 3.69Å
505	F	95.5	Very high	85.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.6	169.3	-57.6	-104.6	0	0	0	108.7	V487 R488 V489 W503 V519 I520 L522 P531 I535 F536 Y539	V487-F505 HydrophobicContact CG1-CB 4.2Å; V487-F505 HydrophobicContact CG1-CD1 4.09Å; R488-F505 WeakPolarHBondContact O-CA 3.25Å; V489-F505 HydrophobicContact CB-CD1 4.45Å; V489-F505 HydrophobicContact CG1-CD1 4.03Å; V489-F505 HydrophobicContact CG1-CE1 4.05Å; V489-F505 HydrophobicContact CG1-CG 4.43Å; V489-F505 HydrophobicContact CG1-CZ 4.47Å; V489-F505 HydrophobicContact CG2-CD1 3.63Å; V489-F505 HydrophobicContact CG2-CE1 4.02Å; V489-F505 HydrophobicContact CG2-CG 4.47Å; W503-F505 HydrophobicContact CB-CD2 3.99Å; W503-F505 HydrophobicContact CB-CE2 3.45Å; W503-F505 VanDerWaalsContact CB-CE2 3.45Å; W503-F505 HydrophobicContact CB-CZ 4.15Å; W503-F505 HydrophobicContact CG-CE2 4.31Å; F505-V519 CarbonylContact O-C 3.59Å; F505-V519 WeakPolarHBondContact O-CA 3.49Å; F505-V519 WeakPolarHBondContact O-CG1 3.48Å; F505-I520 HydrophobicContact CB-CB 4.24Å; F505-I520 WeakPolarHBondContact CB-O 3.32Å; F505-I520 HydrophobicContact CD2-CB 4.48Å; F505-I520 HydrophobicContact CD2-CG2 4.34Å; F505-I520 WeakPolarHBondContact CD2-O 3.38Å; F505-I520 PolarHBondContact N-O 3.47Å; F505-I520 PolarHBondContact O-N 3.14Å; F505-L522 HydrophobicContact CE2-CB 4.17Å; F505-L522 HydrophobicContact CE2-CD2 4.36Å; F505-P531 HydrophobicContact CE1-CB 3.75Å; F505-P531 HydrophobicContact CZ-CB 3.57Å; F505-I535 HydrophobicContact CB-CG2 4.38Å; F505-I535 HydrophobicContact CD1-CB 4.25Å; F505-I535 HydrophobicContact CD1-CG2 3.62Å; F505-I535 HydrophobicContact CD2-CG2 3.9Å; F505-I535 HydrophobicContact CE1-CB 3.78Å; F505-I535 HydrophobicContact CE1-CG1 4.4Å; F505-I535 HydrophobicContact CE1-CG2 3.68Å; F505-I535 HydrophobicContact CE2-CB 4.18Å; F505-I535 HydrophobicContact CE2-CG1 4.01Å; F505-I535 HydrophobicContact CE2-CG2 3.94Å; F505-I535 HydrophobicContact CG-CG2 3.74Å; F505-I535 HydrophobicContact CZ-CB 3.73Å; F505-I535 HydrophobicContact CZ-CG1 3.83Å; F505-I535 HydrophobicContact CZ-CG2 3.83Å; F505-F536 AromaticContact CD1-CE1 3.89Å; F505-F536 HydrophobicContact CD1-CE1 3.89Å; F505-F536 HydrophobicContact CD1-CZ 4.34Å; F505-F536 HydrophobicContact CE1-CD1 4.41Å; F505-F536 AromaticContact CE1-CE1 3.7Å; F505-F536 HydrophobicContact CE1-CE1 3.7Å; F505-F536 HydrophobicContact CE1-CE2 4.46Å; F505-F536 AromaticContact CE1-CZ 3.72Å; F505-F536 HydrophobicContact CE1-CZ 3.72Å; F505-Y539 HydrophobicContact CB-CE2 3.87Å; F505-Y539 PolarHBondContact O-OH 3.38Å
506	S	94.3	Very high	85.4	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.007	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	129.2	173.8	41.7	0	0	0	0	110.2	R488 H643	R488-S506 PolarHBondContact N-O 2.92Å; R488-S506 PolarHBondContact O-N 3.27Å; S506-H643 PolarHBondContact OG-O 3.4Å
507	S	93.7	Very high	86	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.007	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	159.9	174.2	62.2	0	0	0	0	111.9	H486 F510 E517 I518	H486-S507 CarbonylContact O-C 3.55Å; H486-S507 WeakPolarHBondContact O-CA 3.47Å; S507-F510 VanDerWaalsContact OG-CD2 3.3Å; S507-F510 WeakPolarHBondContact OG-CD2 3.2Å; S507-E517 VanDerWaalsContact CB-OE2 3.24Å; S507-E517 WeakPolarHBondContact CB-OE2 3.19Å; S507-E517 WeakPolarHBondContact OG-CA 3.17Å; S507-E517 PolarHBondContact OG-OE2 2.94Å; S507-I518 PolarHBondContact N-O 3.36Å; S507-I518 VanDerWaalsContact N-O 3.12Å; S507-I518 PolarHBondContact OG-N 3.28Å; S507-I518 PolarHBondContact OG-O 3.4Å
508	S	87.8	Confident	87	Confident	38 Å²	38	22.4 Å²	22.4	27%	0.266	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	107.4	167.2	-177.5	0	0	0	0	107.2	H486 E517	H486-S508 PolarHBondContact N-O 3.13Å; H486-S508 PolarHBondContact O-N 2.77Å; S508-E517 WeakPolarHBondContact CA-OE2 3.45Å; S508-E517 PolarHBondContact N-OE2 3.37Å
509	G	84.1	Confident	87.7	Confident	5 Å²	5	21.1 Å²	21.1	5%	0.052	10%	0.098	C	C	.	.	S	Bend	trans	139.5	-18.7	-178.5	0	0	0	0	0	115.4	N484 Y511 Q512 F513 E517	N484-G509 WeakPolarHBondContact O-CA 3.43Å; G509-Y511 PolarHBondContact O-N 2.97Å; G509-Q512 WeakPolarHBondContact O-CB 3.41Å; G509-Q512 PolarHBondContact O-N 3.08Å; G509-F513 WeakPolarHBondContact O-CD2 3.4Å; G509-E517 PolarHBondContact N-OE1 3.23Å; G509-E517 PolarHBondContact N-OE2 2.84Å
510	F	86	Confident	88.3	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-61.9	-28.2	-178.4	-82.5	-43	0	0	0	113.1	L485 S507 Q512 F513 G514 Q515 E517 I518 Y539 I542 L546	L485-F510 HydrophobicContact CD1-CD1 3.86Å; L485-F510 HydrophobicContact CD1-CD2 4.32Å; L485-F510 HydrophobicContact CD1-CE1 3.99Å; L485-F510 HydrophobicContact CD1-CE2 4.45Å; L485-F510 HydrophobicContact CD1-CG 4.01Å; L485-F510 HydrophobicContact CD1-CZ 4.28Å; L485-F510 HydrophobicContact CD2-CD1 4.23Å; L485-F510 HydrophobicContact CD2-CE1 3.65Å; L485-F510 HydrophobicContact CD2-CZ 4.03Å; S507-F510 VanDerWaalsContact OG-CD2 3.3Å; S507-F510 WeakPolarHBondContact OG-CD2 3.2Å; F510-Q512 PolarHBondContact O-N 3.28Å; F510-F513 CarbonylContact O-C 3.6Å; F510-F513 WeakPolarHBondContact O-CA 3.48Å; F510-F513 PolarHBondContact O-N 2.92Å; F510-G514 PolarHBondContact O-N 3.24Å; F510-Q515 CarbonylContact C-O 3.57Å; F510-Q515 HydrophobicContact CB-CB 4.14Å; F510-Q515 HydrophobicContact CB-CG 4.22Å; F510-Q515 HydrophobicContact CG-CG 4.34Å; F510-Q515 PolarHBondContact O-N 2.56Å; F510-E517 PolarHBondContact N-OE1 2.86Å; F510-E517 PolarHBondContact N-OE2 3.47Å; F510-E517 VanDerWaalsContact N-OE2 3.11Å; F510-I518 HydrophobicContact CD2-CB 4.21Å; F510-I518 HydrophobicContact CD2-CD1 4.06Å; F510-I518 HydrophobicContact CD2-CG1 4.05Å; F510-I518 HydrophobicContact CE2-CB 4.06Å; F510-I518 HydrophobicContact CE2-CD1 3.78Å; F510-I518 HydrophobicContact CE2-CG1 4.1Å; F510-Y539 AromaticContact CE2-CD1 3.71Å; F510-Y539 HydrophobicContact CE2-CD1 3.71Å; F510-Y539 HydrophobicContact CE2-CE1 4.1Å; F510-Y539 HydrophobicContact CZ-CD1 4.09Å; F510-I542 HydrophobicContact CE1-CG2 4.08Å; F510-I542 HydrophobicContact CE2-CG2 4.28Å; F510-I542 HydrophobicContact CZ-CB 4.11Å; F510-I542 HydrophobicContact CZ-CG2 3.66Å; F510-L546 HydrophobicContact CD1-CD1 3.59Å; F510-L546 HydrophobicContact CE1-CD1 3.71Å
511	Y	78.8	Confident	88.7	Confident	21 Å²	21	8.5 Å²	8.5	8%	0.082	5%	0.049	C	C	.	.	G	3₁₀ helix	trans	-58.3	-30	174.7	-86.3	-54.7	0	0	0	114	G509 F513 G514 Q515 E516 E517 P648 L995	G509-Y511 PolarHBondContact O-N 2.97Å; Y511-F513 PolarHBondContact O-N 3.43Å; Y511-G514 PolarHBondContact O-N 3.31Å; Y511-Q515 WeakPolarHBondContact CA-O 3.47Å; Y511-Q515 PolarHBondContact N-O 3.12Å; Y511-Q515 VanDerWaalsContact N-O 3.07Å; Y511-E516 HydrophobicContact CE1-CB 4.42Å; Y511-E516 HydrophobicContact CE1-CG 4.11Å; Y511-E517 HydrophobicContact CD2-CG 3.68Å; Y511-E517 HydrophobicContact CE2-CG 3.78Å; Y511-E517 PolarHBondContact N-OE1 3.3Å; Y511-P648 WeakPolarHBondContact OH-CD 3.44Å; Y511-P648 VanDerWaalsContact OH-CG 3.27Å; Y511-P648 WeakPolarHBondContact OH-CG 3.39Å; Y511-P648 PolarHBondContact OH-O 3.01Å; Y511-L995 HydrophobicContact CD1-CD2 3.59Å; Y511-L995 HydrophobicContact CE1-CD1 4.35Å; Y511-L995 HydrophobicContact CE1-CD2 3.78Å
512	Q	78.9	Confident	88.9	Confident	40 Å²	40	7 Å²	7	19%	0.187	4%	0.038	C	C	.	.	G	3₁₀ helix	trans	-67.4	-24.3	176.1	-61.7	174.6	-6.2	0	0	111.6	N484 G509 F510 Q1001 C1195 L1197	N484-Q512 PolarHBondContact O-OE1 3.48Å; G509-Q512 WeakPolarHBondContact O-CB 3.41Å; G509-Q512 PolarHBondContact O-N 3.08Å; F510-Q512 PolarHBondContact O-N 3.28Å; Q512-Q1001 PolarHBondContact O-NE2 3.11Å; Q512-Q1001 PolarHBondContact O-OE1 3.1Å; Q512-C1195 HydrophobicContact CG-CB 4.19Å; Q512-L1197 HydrophobicContact CB-CD2 3.79Å; Q512-L1197 VanDerWaalsContact CD-CD2 3.43Å; Q512-L1197 HydrophobicContact CG-CD2 3.8Å; Q512-L1197 VanDerWaalsContact OE1-CD2 3.25Å
513	F	77.6	Confident	88.9	Confident	15 Å²	15	11.9 Å²	11.9	7%	0.066	6%	0.056	C	C	.	.	G	3₁₀ helix	trans	-102.7	23.5	179.6	-55.6	-77	0	0	0	113.2	N484 G509 F510 Y511 Q515 Y543 L546 V998	N484-F513 HydrophobicContact CB-CE2 4.19Å; N484-F513 HydrophobicContact CB-CZ 3.98Å; G509-F513 WeakPolarHBondContact O-CD2 3.4Å; F510-F513 CarbonylContact O-C 3.6Å; F510-F513 WeakPolarHBondContact O-CA 3.48Å; F510-F513 PolarHBondContact O-N 2.92Å; Y511-F513 PolarHBondContact O-N 3.43Å; F513-Q515 PolarHBondContact O-N 3.45Å; F513-Y543 HydrophobicContact CD1-CE2 4.12Å; F513-Y543 HydrophobicContact CD2-CD2 4.43Å; F513-Y543 HydrophobicContact CD2-CE2 4.27Å; F513-Y543 AromaticContact CE1-CE2 3.78Å; F513-Y543 HydrophobicContact CE1-CE2 3.78Å; F513-Y543 HydrophobicContact CE2-CD2 4.41Å; F513-Y543 AromaticContact CE2-CE2 3.95Å; F513-Y543 HydrophobicContact CE2-CE2 3.95Å; F513-Y543 HydrophobicContact CG-CE2 4.37Å; F513-Y543 AromaticContact CZ-CE2 3.69Å; F513-Y543 HydrophobicContact CZ-CE2 3.69Å; F513-L546 HydrophobicContact CB-CD1 4.21Å; F513-V998 VanDerWaalsContact C-CG2 3.43Å; F513-V998 HydrophobicContact CB-CG2 3.93Å; F513-V998 HydrophobicContact CD1-CG2 4.45Å; F513-V998 WeakPolarHBondContact O-CG2 3.4Å
514	G	73.6	Confident	88.9	Confident	1 Å²	1	14.8 Å²	14.8	1%	0.01	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	22.1	176	0	0	0	0	0	114.5	F510 Y511 V996	F510-G514 PolarHBondContact O-N 3.24Å; Y511-G514 PolarHBondContact O-N 3.31Å; G514-V996 WeakPolarHBondContact CA-O 3.35Å
515	Q	83.2	Confident	88.6	Confident	0 Å²	0	18 Å²	18	0%	0	8%	0.079	C	C	.	.	S	Bend	trans	-125.1	143.6	-176.6	179.6	55	59.6	0	0	108.9	F510 Y511 F513 L546 F577	F510-Q515 CarbonylContact C-O 3.57Å; F510-Q515 HydrophobicContact CB-CB 4.14Å; F510-Q515 HydrophobicContact CB-CG 4.22Å; F510-Q515 HydrophobicContact CG-CG 4.34Å; F510-Q515 PolarHBondContact O-N 2.56Å; Y511-Q515 WeakPolarHBondContact CA-O 3.47Å; Y511-Q515 PolarHBondContact N-O 3.12Å; Y511-Q515 VanDerWaalsContact N-O 3.07Å; F513-Q515 PolarHBondContact O-N 3.45Å; Q515-L546 HydrophobicContact CB-CD1 3.84Å; Q515-L546 HydrophobicContact CB-CD2 3.95Å; Q515-L546 HydrophobicContact CG-CD1 4Å; Q515-L546 HydrophobicContact CG-CD2 4.03Å; Q515-F577 PolarHBondContact NE2-O 3.33Å; Q515-F577 PolarHBondContact OE1-O 2.67Å
516	E	83.7	Confident	88	Confident	12 Å²	12	28 Å²	28	6%	0.056	12%	0.123	C	C	.	.			trans	-67.2	153.6	172.1	-68.1	173.9	-152.3	0	0	111.4	Y511 H633 P648 L650 L995	Y511-E516 HydrophobicContact CE1-CB 4.42Å; Y511-E516 HydrophobicContact CE1-CG 4.11Å; E516-H633 IonicContact OE1-NE2 2.71Å; E516-H633 IonicContact OE2-CE1 3.93Å; E516-H633 IonicContact OE2-NE2 2.61Å; E516-H633 PolarHBondContact OE2-NE2 3.29Å; E516-P648 HydrophobicContact CG-CG 4.43Å; E516-L650 HydrophobicContact CB-CG 4.34Å; E516-L995 HydrophobicContact CG-CD1 3.83Å
517	E	90.3	Very high	87.5	Confident	11 Å²	11	32.8 Å²	32.8	5%	0.051	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	147.5	172.2	-59	-59.3	162.6	0	0	110.8	S507 S508 G509 F510 Y511 P645 F649 L650	S507-E517 VanDerWaalsContact CB-OE2 3.24Å; S507-E517 WeakPolarHBondContact CB-OE2 3.19Å; S507-E517 WeakPolarHBondContact OG-CA 3.17Å; S507-E517 PolarHBondContact OG-OE2 2.94Å; S508-E517 WeakPolarHBondContact CA-OE2 3.45Å; S508-E517 PolarHBondContact N-OE2 3.37Å; G509-E517 PolarHBondContact N-OE1 3.23Å; G509-E517 PolarHBondContact N-OE2 2.84Å; F510-E517 PolarHBondContact N-OE1 2.86Å; F510-E517 PolarHBondContact N-OE2 3.47Å; F510-E517 VanDerWaalsContact N-OE2 3.11Å; Y511-E517 HydrophobicContact CD2-CG 3.68Å; Y511-E517 HydrophobicContact CE2-CG 3.78Å; Y511-E517 PolarHBondContact N-OE1 3.3Å; E517-P645 HydrophobicContact CB-CB 3.88Å; E517-P645 HydrophobicContact CB-CG 3.7Å; E517-P645 HydrophobicContact CG-CB 4.02Å; E517-P645 HydrophobicContact CG-CG 4.39Å; E517-F649 HydrophobicContact CB-CB 4.38Å; E517-F649 CarbonylContact O-C 3.54Å; E517-F649 VanDerWaalsContact O-CA 3.31Å; E517-F649 WeakPolarHBondContact O-CA 3.49Å; E517-F649 VanDerWaalsContact O-CB 3.27Å; E517-F649 WeakPolarHBondContact O-CB 3.34Å; E517-L650 PolarHBondContact O-N 3.39Å
518	I	94.2	Very high	87.1	Confident	0 Å²	0	34 Å²	34	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.8	-173.8	-64.4	173.4	0	0	0	109.2	S507 F510 Y539 I542 F631 L650 A652	S507-I518 PolarHBondContact N-O 3.36Å; S507-I518 VanDerWaalsContact N-O 3.12Å; S507-I518 PolarHBondContact OG-N 3.28Å; S507-I518 PolarHBondContact OG-O 3.4Å; F510-I518 HydrophobicContact CD2-CB 4.21Å; F510-I518 HydrophobicContact CD2-CD1 4.06Å; F510-I518 HydrophobicContact CD2-CG1 4.05Å; F510-I518 HydrophobicContact CE2-CB 4.06Å; F510-I518 HydrophobicContact CE2-CD1 3.78Å; F510-I518 HydrophobicContact CE2-CG1 4.1Å; I518-Y539 HydrophobicContact CB-CE1 4.07Å; I518-Y539 HydrophobicContact CG2-CE1 4.17Å; I518-Y539 WeakPolarHBondContact O-CE1 3.24Å; I518-Y539 PolarHBondContact O-OH 3.09Å; I518-I542 HydrophobicContact CD1-CD1 4.18Å; I518-I542 HydrophobicContact CD1-CG2 3.94Å; I518-F631 HydrophobicContact CD1-CE1 3.88Å; I518-F631 HydrophobicContact CD1-CZ 4.18Å; I518-F631 HydrophobicContact CG1-CE1 4.45Å; I518-F631 HydrophobicContact CG2-CE1 4.06Å; I518-L650 WeakPolarHBondContact CA-O 3.46Å; I518-L650 HydrophobicContact CG1-CB 4.42Å; I518-A652 HydrophobicContact CG2-CB 3.92Å
519	V	96.6	Very high	87.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124	178.6	179.1	0	0	0	0	109.4	F505 L521 L644 P645 F649 L650 I651 A652	F505-V519 CarbonylContact O-C 3.59Å; F505-V519 WeakPolarHBondContact O-CA 3.49Å; F505-V519 WeakPolarHBondContact O-CG1 3.48Å; V519-L521 HydrophobicContact CG1-CG 4.37Å; V519-L644 HydrophobicContact CG1-CD2 3.94Å; V519-L644 HydrophobicContact CG2-CD2 4.01Å; V519-P645 VanDerWaalsContact CG2-CD 3.5Å; V519-P645 HydrophobicContact CG2-CG 3.97Å; V519-F649 HydrophobicContact CG2-CB 4.49Å; V519-F649 HydrophobicContact CG2-CD2 3.82Å; V519-F649 HydrophobicContact CG2-CE2 4.39Å; V519-F649 HydrophobicContact CG2-CG 4.23Å; V519-L650 PolarHBondContact N-O 3.14Å; V519-I651 HydrophobicContact CB-CD1 3.99Å; V519-I651 HydrophobicContact CG1-CD1 4.12Å; V519-I651 WeakPolarHBondContact O-CA 3.23Å; V519-A652 PolarHBondContact O-N 3.17Å
520	I	96.5	Very high	87.3	Confident	0 Å²	0	40 Å²	40	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	113.6	169.9	-66.8	166.5	0	0	0	107.5	F505 L522 I535 Y539 F629 A652	F505-I520 HydrophobicContact CB-CB 4.24Å; F505-I520 WeakPolarHBondContact CB-O 3.32Å; F505-I520 HydrophobicContact CD2-CB 4.48Å; F505-I520 HydrophobicContact CD2-CG2 4.34Å; F505-I520 WeakPolarHBondContact CD2-O 3.38Å; F505-I520 PolarHBondContact N-O 3.47Å; F505-I520 PolarHBondContact O-N 3.14Å; I520-L522 HydrophobicContact CG2-CB 4.38Å; I520-I535 HydrophobicContact CB-CG2 4.37Å; I520-I535 HydrophobicContact CD1-CG2 3.82Å; I520-I535 HydrophobicContact CG2-CD1 4.38Å; I520-I535 HydrophobicContact CG2-CG2 4.21Å; I520-Y539 HydrophobicContact CD1-CD2 4.34Å; I520-Y539 HydrophobicContact CD1-CE2 3.79Å; I520-Y539 HydrophobicContact CG1-CE2 4.42Å; I520-Y539 PolarHBondContact N-OH 3.31Å; I520-F629 HydrophobicContact CD1-CE1 3.88Å; I520-F629 HydrophobicContact CD1-CE2 4.38Å; I520-F629 HydrophobicContact CD1-CZ 3.67Å; I520-F629 HydrophobicContact CG1-CE1 4.05Å; I520-F629 HydrophobicContact CG1-CZ 4.35Å; I520-F629 HydrophobicContact CG2-CE1 4.4Å; I520-A652 HydrophobicContact CG1-CB 3.86Å
521	L	95.7	Very high	87.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.2	166	-79.9	159.7	0	0	0	108.2	W503 C504 V519 L642 L685 L686 S687	W503-L521 WeakPolarHBondContact O-CA 3.43Å; C504-L521 HydrophobicContact CB-CD2 3.69Å; V519-L521 HydrophobicContact CG1-CG 4.37Å; L521-L642 HydrophobicContact CD1-CD1 3.91Å; L521-L642 HydrophobicContact CD1-CD2 4.05Å; L521-L642 HydrophobicContact CD2-CD2 3.81Å; L521-L685 WeakPolarHBondContact CB-O 3.39Å; L521-L685 HydrophobicContact CD1-CB 3.85Å; L521-L685 HydrophobicContact CD1-CD1 4.43Å; L521-L686 HydrophobicContact CB-CD1 4.35Å; L521-S687 VanDerWaalsContact O-CB 3.25Å; L521-S687 WeakPolarHBondContact O-CB 3.31Å; L521-S687 PolarHBondContact O-N 2.99Å
522	L	95.1	Very high	88	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.9	-176.3	-174.8	67.5	0	0	0	110.8	T502 W503 F505 I520 R524 P532 I535 L654 R689	T502-L522 CarbonylContact C-O 3.6Å; T502-L522 VanDerWaalsContact CA-O 3.3Å; T502-L522 WeakPolarHBondContact CA-O 3.3Å; T502-L522 WeakPolarHBondContact CB-O 3.41Å; W503-L522 PolarHBondContact N-O 3.23Å; W503-L522 PolarHBondContact O-N 3.14Å; F505-L522 HydrophobicContact CE2-CB 4.17Å; F505-L522 HydrophobicContact CE2-CD2 4.36Å; I520-L522 HydrophobicContact CG2-CB 4.38Å; L522-R524 PolarHBondContact O-N 3.41Å; L522-P532 HydrophobicContact CD2-CG 3.39Å; L522-I535 HydrophobicContact CD2-CD1 4.01Å; L522-I535 HydrophobicContact CD2-CG1 3.86Å; L522-L654 HydrophobicContact CD1-CD1 3.72Å; L522-R689 HydrophobicContact CD1-CB 4.42Å
523	R	93.7	Very high	88.1	Confident	103 Å²	103	41.5 Å²	41.5	39%	0.389	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	125.9	175	-172.6	-179.8	-179.2	-179	1.3	109.6	Q500 L686 S687 D688 R689	Q500-R523 VanDerWaalsContact OE1-CD 3.3Å; Q500-R523 VanDerWaalsContact OE1-NE 3.13Å; R523-L686 HydrophobicContact CB-CD1 4.16Å; R523-L686 HydrophobicContact CB-CD2 4.35Å; R523-L686 HydrophobicContact CB-CG 4.33Å; R523-L686 VanDerWaalsContact N-CD1 3.31Å; R523-S687 PolarHBondContact N-O 3.27Å; R523-D688 HydrophobicContact CB-CB 4.43Å; R523-D688 VanDerWaalsContact CD-CG 3.45Å; R523-D688 WeakPolarHBondContact CD-OD2 3.45Å; R523-D688 IonicContact CZ-OD2 3.53Å; R523-D688 IonicContact NE-OD2 3.42Å; R523-D688 IonicContact NH1-OD2 3Å; R523-D688 PolarHBondContact NH1-OD2 2.71Å; R523-R689 PolarHBondContact O-NH2 3.18Å
524	R	92.3	Very high	88.3	Confident	63 Å²	63	43 Å²	43	24%	0.238	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-79.2	132.6	178.7	-176.7	172.3	-178.9	-167.6	2.3	110.1	S501 W503 L522 E528	S501-R524 WeakPolarHBondContact O-CB 3.45Å; S501-R524 PolarHBondContact O-N 2.95Å; S501-R524 VanDerWaalsContact O-N 3.12Å; W503-R524 HydrophobicContact CZ2-CG 4.37Å; L522-R524 PolarHBondContact O-N 3.41Å; R524-E528 WeakPolarHBondContact CA-OE2 3.48Å; R524-E528 HydrophobicContact CG-CB 4.43Å; R524-E528 PolarHBondContact NE-O 3.13Å; R524-E528 PolarHBondContact NH2-O 3.4Å
525	R	89.8	Confident	89	Confident	66 Å²	66	43 Å²	43	25%	0.249	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-79.9	155.3	172	-67.3	179.1	173.9	163.8	-5.1	110.5	D527 E528 N591 D690	R525-D527 VanDerWaalsContact C-N 3.25Å; R525-D527 WeakPolarHBondContact CB-OD1 3.45Å; R525-D527 PolarHBondContact O-N 2.68Å; R525-E528 HydrophobicContact CB-CB 3.97Å; R525-E528 PolarHBondContact N-OE2 3.44Å; R525-E528 VanDerWaalsContact N-OE2 3.14Å; R525-E528 WeakPolarHBondContact O-CB 3.41Å; R525-E528 PolarHBondContact O-N 3.05Å; R525-E528 VanDerWaalsContact O-N 3.14Å; R525-N591 PolarHBondContact NH2-OD1 2.96Å; R525-D690 IonicContact CZ-OD1 3.47Å; R525-D690 IonicContact CZ-OD2 3.51Å; R525-D690 IonicContact NE-OD1 3.41Å; R525-D690 IonicContact NE-OD2 2.81Å; R525-D690 PolarHBondContact NE-OD2 3.49Å; R525-D690 IonicContact NH2-OD1 2.7Å; R525-D690 PolarHBondContact NH2-OD1 3.39Å; R525-D690 IonicContact NH2-OD2 3.46Å; R525-D690 PolarHBondContact NH2-OD2 3.45Å
526	F	83	Confident	89.2	Confident	211 Å²	211	43.6 Å²	43.6	93%	0.925	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.1	-170.6	57.8	-95.5	0	0	0	114.3
527	D	84	Confident	89.2	Confident	101 Å²	101	47.2 Å²	47.2	54%	0.54	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-12.2	177.2	58.5	-28.8	0	0	0	113.2	R525 R529	R525-D527 VanDerWaalsContact C-N 3.25Å; R525-D527 WeakPolarHBondContact CB-OD1 3.45Å; R525-D527 PolarHBondContact O-N 2.68Å; D527-R529 PolarHBondContact O-N 3.42Å
528	E	84.9	Confident	89	Confident	27 Å²	27	46.7 Å²	46.7	13%	0.126	20%	0.203	C	C	.	.			trans	-82	97.7	-169.1	-173.8	177.1	-114.8	0	0	111.9	W503 R524 R525 L530 P532 R689	W503-E528 HydrophobicContact CZ2-CG 4.46Å; W503-E528 PolarHBondContact NE1-OE2 2.88Å; R524-E528 WeakPolarHBondContact CA-OE2 3.48Å; R524-E528 HydrophobicContact CG-CB 4.43Å; R524-E528 PolarHBondContact NE-O 3.13Å; R524-E528 PolarHBondContact NH2-O 3.4Å; R525-E528 HydrophobicContact CB-CB 3.97Å; R525-E528 PolarHBondContact N-OE2 3.44Å; R525-E528 VanDerWaalsContact N-OE2 3.14Å; R525-E528 WeakPolarHBondContact O-CB 3.41Å; R525-E528 PolarHBondContact O-N 3.05Å; R525-E528 VanDerWaalsContact O-N 3.14Å; E528-L530 WeakPolarHBondContact CG-O 3.22Å; E528-P532 WeakPolarHBondContact OE1-CD 3.38Å; E528-R689 VanDerWaalsContact CD-NH2 3.25Å; E528-R689 IonicContact OE1-CZ 3.51Å; E528-R689 VanDerWaalsContact OE1-CZ 3.25Å; E528-R689 IonicContact OE1-NH1 3.51Å; E528-R689 PolarHBondContact OE1-NH1 3.21Å; E528-R689 IonicContact OE1-NH2 3.45Å; E528-R689 PolarHBondContact OE1-NH2 3.38Å; E528-R689 IonicContact OE2-CZ 2.99Å; E528-R689 IonicContact OE2-NH1 3.6Å; E528-R689 IonicContact OE2-NH2 2.78Å; E528-R689 PolarHBondContact OE2-NH2 2.88Å
529	R	86.3	Confident	88.8	Confident	138 Å²	138	46.7 Å²	46.7	52%	0.521	20%	0.203	S	C	.	.			trans	-83	-15.8	175.8	-67.7	-172.7	-179.2	-117.4	11.9	115	I423 E427 D527	I423-R529 HydrophobicContact CD1-CB 4.31Å; I423-R529 HydrophobicContact CG1-CB 4.37Å; E427-R529 WeakPolarHBondContact OE1-CD 3.44Å; E427-R529 IonicContact OE1-CZ 3.94Å; E427-R529 IonicContact OE1-NE 3.34Å; E427-R529 IonicContact OE1-NH1 3.52Å; E427-R529 PolarHBondContact OE1-NH1 2.89Å; E427-R529 IonicContact OE2-NH1 2.82Å; E427-R529 PolarHBondContact OE2-NH1 3.04Å; D527-R529 PolarHBondContact O-N 3.42Å
530	L	88.9	Confident	88.3	Confident	32 Å²	32	51.3 Å²	51.3	17%	0.168	22%	0.22	C	C	.	.	S	Bend	trans	-129.8	148.7	-174.9	-66.5	161.4	0	0	0	109.6	W400 V419 L422 I423 L426 W503 E528	W400-L530 HydrophobicContact CH2-CB 4.28Å; W400-L530 HydrophobicContact CZ2-CB 3.79Å; W400-L530 HydrophobicContact CZ2-CD1 3.76Å; W400-L530 HydrophobicContact CZ2-CD2 4.31Å; W400-L530 HydrophobicContact CZ2-CG 4.16Å; V419-L530 HydrophobicContact CG1-CD1 3.7Å; L422-L530 HydrophobicContact CB-CD2 3.8Å; I423-L530 HydrophobicContact CG1-CD1 4.37Å; I423-L530 HydrophobicContact CG1-CD2 3.71Å; I423-L530 HydrophobicContact CG1-CG 3.97Å; L426-L530 HydrophobicContact CD1-CD2 4.22Å; W503-L530 VanDerWaalsContact CZ2-C 3.43Å; E528-L530 WeakPolarHBondContact CG-O 3.22Å
531	P	90.5	Very high	87.6	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.013	22%	0.223	C	C	.	.			trans	-62	136.1	173.6	25.6	-34.7	0	0	0	110.9	W400 L426 I477 V489 W503 F505 M533 F536	W400-P531 HydrophobicContact CH2-CG 4.47Å; W400-P531 WeakPolarHBondContact CH2-O 3.45Å; L426-P531 HydrophobicContact CD1-CG 4.42Å; I477-P531 HydrophobicContact CD1-CG 4.48Å; V489-P531 HydrophobicContact CG1-CB 3.9Å; V489-P531 HydrophobicContact CG1-CG 4.06Å; W503-P531 HydrophobicContact CD2-CB 4.21Å; W503-P531 HydrophobicContact CE3-CB 4.38Å; W503-P531 HydrophobicContact CG-CB 4.49Å; F505-P531 HydrophobicContact CE1-CB 3.75Å; F505-P531 HydrophobicContact CZ-CB 3.57Å; P531-M533 PolarHBondContact O-N 2.87Å; P531-F536 HydrophobicContact CB-CE2 4.49Å; P531-F536 HydrophobicContact CB-CZ 4.15Å; P531-F536 HydrophobicContact CG-CE2 4.3Å; P531-F536 HydrophobicContact CG-CZ 3.95Å
532	P	88.4	Confident	87.1	Confident	13 Å²	13	51.9 Å²	51.9	8%	0.084	22%	0.223	C	C	.	.			trans	-65.5	131.6	-179.7	24.3	-33	0	0	0	111.6	L522 E528 E534 I535	L522-P532 HydrophobicContact CD2-CG 3.39Å; E528-P532 WeakPolarHBondContact OE1-CD 3.38Å; P532-E534 PolarHBondContact O-N 3.37Å; P532-I535 HydrophobicContact CG-CG1 4.16Å; P532-I535 PolarHBondContact O-N 2.87Å
533	M	81.9	Confident	86.7	Confident	76 Å²	76	54 Å²	54	37%	0.374	23%	0.231	S	C	.	.	H	α-helix	trans	-66.4	-24.8	-170.7	-64.8	-169.4	-64.7	0	0	113.3	W400 P401 P531 I535 F536 Y537	W400-M533 HydrophobicContact CD2-CG 4.37Å; W400-M533 HydrophobicContact CD2-SD 3.83Å; W400-M533 HydrophobicContact CE3-CG 4.06Å; W400-M533 HydrophobicContact CE3-SD 3.88Å; W400-M533 HydrophobicContact CG-SD 4.19Å; W400-M533 HydrophobicContact CH2-CG 3.87Å; W400-M533 HydrophobicContact CZ2-CG 4.16Å; W400-M533 HydrophobicContact CZ3-CG 3.82Å; W400-M533 HydrophobicContact CZ3-SD 4.27Å; P401-M533 WeakPolarHBondContact CD-SD 3.48Å; P401-M533 HydrophobicContact CG-SD 4.34Å; P531-M533 PolarHBondContact O-N 2.87Å; M533-I535 PolarHBondContact O-N 2.91Å; M533-I535 VanDerWaalsContact O-N 3.17Å; M533-F536 PolarHBondContact O-N 3.42Å; M533-F536 VanDerWaalsContact O-N 3.14Å; M533-Y537 PolarHBondContact O-N 3.27Å
534	E	80.9	Confident	86.1	Confident	48 Å²	48	51.9 Å²	51.9	22%	0.224	23%	0.226	C	C	.	.	H	α-helix	trans	-55.9	-30.7	178.1	-64	95.3	139.3	0	0	112.5	P532 Y537 Q538 F589 A590	P532-E534 PolarHBondContact O-N 3.37Å; E534-Y537 WeakPolarHBondContact O-CB 3.21Å; E534-Y537 PolarHBondContact O-N 3.36Å; E534-Q538 WeakPolarHBondContact O-CG 3.43Å; E534-Q538 PolarHBondContact O-N 3.09Å; E534-F589 HydrophobicContact CB-CD1 4.15Å; E534-F589 HydrophobicContact CB-CE1 3.98Å; E534-F589 HydrophobicContact CG-CD1 4.22Å; E534-A590 PolarHBondContact OE1-N 3.36Å
535	I	89	Confident	85.5	Confident	0 Å²	0	50 Å²	50	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-69.7	-39	179.7	-56.9	-56.5	0	0	0	111.8	F505 I520 L522 P532 M533 Y537 Q538 Y539 F589	F505-I535 HydrophobicContact CB-CG2 4.38Å; F505-I535 HydrophobicContact CD1-CB 4.25Å; F505-I535 HydrophobicContact CD1-CG2 3.62Å; F505-I535 HydrophobicContact CD2-CG2 3.9Å; F505-I535 HydrophobicContact CE1-CB 3.78Å; F505-I535 HydrophobicContact CE1-CG1 4.4Å; F505-I535 HydrophobicContact CE1-CG2 3.68Å; F505-I535 HydrophobicContact CE2-CB 4.18Å; F505-I535 HydrophobicContact CE2-CG1 4.01Å; F505-I535 HydrophobicContact CE2-CG2 3.94Å; F505-I535 HydrophobicContact CG-CG2 3.74Å; F505-I535 HydrophobicContact CZ-CB 3.73Å; F505-I535 HydrophobicContact CZ-CG1 3.83Å; F505-I535 HydrophobicContact CZ-CG2 3.83Å; I520-I535 HydrophobicContact CB-CG2 4.37Å; I520-I535 HydrophobicContact CD1-CG2 3.82Å; I520-I535 HydrophobicContact CG2-CD1 4.38Å; I520-I535 HydrophobicContact CG2-CG2 4.21Å; L522-I535 HydrophobicContact CD2-CD1 4.01Å; L522-I535 HydrophobicContact CD2-CG1 3.86Å; P532-I535 HydrophobicContact CG-CG1 4.16Å; P532-I535 PolarHBondContact O-N 2.87Å; M533-I535 PolarHBondContact O-N 2.91Å; M533-I535 VanDerWaalsContact O-N 3.17Å; I535-Y537 VanDerWaalsContact C-N 3.26Å; I535-Y537 PolarHBondContact O-N 3.39Å; I535-Q538 WeakPolarHBondContact O-CB 3.37Å; I535-Q538 PolarHBondContact O-N 3.18Å; I535-Q538 VanDerWaalsContact O-N 3.14Å; I535-Y539 HydrophobicContact CG2-CD2 4.08Å; I535-Y539 HydrophobicContact CG2-CE2 3.88Å; I535-Y539 WeakPolarHBondContact O-CD2 3.44Å; I535-Y539 PolarHBondContact O-N 3.11Å; I535-Y539 VanDerWaalsContact O-N 3.07Å; I535-F589 HydrophobicContact CD1-CE1 4.15Å; I535-F589 HydrophobicContact CD1-CZ 3.85Å
536	F	88	Confident	84.9	Confident	12 Å²	12	47 Å²	47	5%	0.053	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-36.1	173.4	-54	-57	0	0	0	111.6	W400 I479 L481 V487 V489 F505 P531 M533 Q538 Y539 W540	W400-F536 HydrophobicContact CH2-CE2 4.49Å; W400-F536 HydrophobicContact CZ3-CE2 4.08Å; I479-F536 HydrophobicContact CD1-CD1 4.28Å; I479-F536 HydrophobicContact CD1-CE1 3.5Å; I479-F536 VanDerWaalsContact CD1-CE1 3.5Å; I479-F536 HydrophobicContact CD1-CE2 3.91Å; I479-F536 HydrophobicContact CD1-CZ 3.29Å; L481-F536 HydrophobicContact CD2-CB 4.12Å; V487-F536 HydrophobicContact CB-CD1 4.36Å; V487-F536 HydrophobicContact CB-CE1 4.49Å; V487-F536 HydrophobicContact CG1-CD1 4.23Å; V487-F536 HydrophobicContact CG1-CE1 4.11Å; V489-F536 HydrophobicContact CG2-CE1 3.62Å; V489-F536 HydrophobicContact CG2-CZ 3.9Å; F505-F536 AromaticContact CD1-CE1 3.89Å; F505-F536 HydrophobicContact CD1-CE1 3.89Å; F505-F536 HydrophobicContact CD1-CZ 4.34Å; F505-F536 HydrophobicContact CE1-CD1 4.41Å; F505-F536 AromaticContact CE1-CE1 3.7Å; F505-F536 HydrophobicContact CE1-CE1 3.7Å; F505-F536 HydrophobicContact CE1-CE2 4.46Å; F505-F536 AromaticContact CE1-CZ 3.72Å; F505-F536 HydrophobicContact CE1-CZ 3.72Å; P531-F536 HydrophobicContact CB-CE2 4.49Å; P531-F536 HydrophobicContact CB-CZ 4.15Å; P531-F536 HydrophobicContact CG-CE2 4.3Å; P531-F536 HydrophobicContact CG-CZ 3.95Å; M533-F536 PolarHBondContact O-N 3.42Å; M533-F536 VanDerWaalsContact O-N 3.14Å; F536-Q538 VanDerWaalsContact C-N 3.35Å; F536-Y539 PolarHBondContact O-N 3.29Å; F536-W540 PolarHBondContact O-N 3.42Å
537	Y	83.2	Confident	84.6	Confident	89 Å²	89	38.9 Å²	38.9	35%	0.349	18%	0.18	S	C	.	.	H	α-helix	trans	-67.4	-33.9	174.3	-174.4	-115.3	0	0	0	112.3	M533 E534 I535 W540 L541 W610	M533-Y537 PolarHBondContact O-N 3.27Å; E534-Y537 WeakPolarHBondContact O-CB 3.21Å; E534-Y537 PolarHBondContact O-N 3.36Å; I535-Y537 VanDerWaalsContact C-N 3.26Å; I535-Y537 PolarHBondContact O-N 3.39Å; Y537-W540 AromaticContact CD2-CE3 3.84Å; Y537-W540 HydrophobicContact CD2-CE3 3.84Å; Y537-W540 HydrophobicContact CD2-CZ3 4.34Å; Y537-W540 AromaticContact CE2-CE3 3.51Å; Y537-W540 HydrophobicContact CE2-CE3 3.51Å; Y537-W540 AromaticContact CE2-CZ3 3.55Å; Y537-W540 HydrophobicContact CE2-CZ3 3.55Å; Y537-W540 PolarHBondContact O-N 3.13Å; Y537-L541 HydrophobicContact CD1-CD1 3.86Å; Y537-L541 HydrophobicContact CD1-CG 4.38Å; Y537-L541 HydrophobicContact CE1-CD1 3.47Å; Y537-L541 VanDerWaalsContact CE1-CD1 3.47Å; Y537-L541 HydrophobicContact CE1-CD2 4.47Å; Y537-L541 HydrophobicContact CE1-CG 4.02Å; Y537-L541 HydrophobicContact CE2-CG 4.39Å; Y537-L541 WeakPolarHBondContact O-CG 3.43Å; Y537-L541 PolarHBondContact O-N 3.01Å; Y537-W610 HydrophobicContact CE1-CH2 4.12Å; Y537-W610 HydrophobicContact CE1-CZ3 4.45Å; Y537-W610 HydrophobicContact CE2-CH2 4.49Å
538	Q	85.2	Confident	84.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-45.2	172.1	-68.5	-59.4	-69.7	0	0	112.6	E534 I535 F536 W540 L541 I542 L587 F629	E534-Q538 WeakPolarHBondContact O-CG 3.43Å; E534-Q538 PolarHBondContact O-N 3.09Å; I535-Q538 WeakPolarHBondContact O-CB 3.37Å; I535-Q538 PolarHBondContact O-N 3.18Å; I535-Q538 VanDerWaalsContact O-N 3.14Å; F536-Q538 VanDerWaalsContact C-N 3.35Å; Q538-W540 VanDerWaalsContact C-N 3.27Å; Q538-W540 PolarHBondContact O-N 3.33Å; Q538-L541 PolarHBondContact O-N 3.41Å; Q538-I542 WeakPolarHBondContact O-CG1 3.14Å; Q538-I542 PolarHBondContact O-N 2.94Å; Q538-L587 HydrophobicContact CG-CD1 4.4Å; Q538-L587 HydrophobicContact CG-CD2 3.81Å; Q538-L587 HydrophobicContact CG-CG 4.24Å; Q538-F629 HydrophobicContact CB-CE2 3.9Å; Q538-F629 HydrophobicContact CB-CZ 4.33Å; Q538-F629 HydrophobicContact CG-CE2 3.77Å; Q538-F629 HydrophobicContact CG-CZ 4.16Å
539	Y	90.8	Very high	83.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.4	-39.1	172.7	-81.3	-76	0	0	0	112.3	L481 V487 F505 F510 I518 I520 I535 F536 Y543	L481-Y539 VanDerWaalsContact CD1-CB 3.44Å; L481-Y539 HydrophobicContact CD1-CG 4.47Å; V487-Y539 HydrophobicContact CG1-CD2 4.11Å; V487-Y539 HydrophobicContact CG1-CE2 3.88Å; V487-Y539 HydrophobicContact CG2-CD1 4.09Å; V487-Y539 HydrophobicContact CG2-CD2 3.73Å; V487-Y539 HydrophobicContact CG2-CE2 4.18Å; V487-Y539 HydrophobicContact CG2-CG 3.69Å; F505-Y539 HydrophobicContact CB-CE2 3.87Å; F505-Y539 PolarHBondContact O-OH 3.38Å; F510-Y539 AromaticContact CE2-CD1 3.71Å; F510-Y539 HydrophobicContact CE2-CD1 3.71Å; F510-Y539 HydrophobicContact CE2-CE1 4.1Å; F510-Y539 HydrophobicContact CZ-CD1 4.09Å; I518-Y539 HydrophobicContact CB-CE1 4.07Å; I518-Y539 HydrophobicContact CG2-CE1 4.17Å; I518-Y539 WeakPolarHBondContact O-CE1 3.24Å; I518-Y539 PolarHBondContact O-OH 3.09Å; I520-Y539 HydrophobicContact CD1-CD2 4.34Å; I520-Y539 HydrophobicContact CD1-CE2 3.79Å; I520-Y539 HydrophobicContact CG1-CE2 4.42Å; I520-Y539 PolarHBondContact N-OH 3.31Å; I535-Y539 HydrophobicContact CG2-CD2 4.08Å; I535-Y539 HydrophobicContact CG2-CE2 3.88Å; I535-Y539 WeakPolarHBondContact O-CD2 3.44Å; I535-Y539 PolarHBondContact O-N 3.11Å; I535-Y539 VanDerWaalsContact O-N 3.07Å; F536-Y539 PolarHBondContact O-N 3.29Å; Y539-Y543 WeakPolarHBondContact O-CB 3.41Å; Y539-Y543 PolarHBondContact O-N 2.86Å
540	W	85.8	Confident	82.4	Confident	97 Å²	97	34 Å²	34	37%	0.367	16%	0.159	S	C	.	.	H	α-helix	trans	-67.2	-40.2	174.7	179.2	86.4	0	0	0	112.9	F536 Y537 Q538 Y543 Q544	F536-W540 PolarHBondContact O-N 3.42Å; Y537-W540 AromaticContact CD2-CE3 3.84Å; Y537-W540 HydrophobicContact CD2-CE3 3.84Å; Y537-W540 HydrophobicContact CD2-CZ3 4.34Å; Y537-W540 AromaticContact CE2-CE3 3.51Å; Y537-W540 HydrophobicContact CE2-CE3 3.51Å; Y537-W540 AromaticContact CE2-CZ3 3.55Å; Y537-W540 HydrophobicContact CE2-CZ3 3.55Å; Y537-W540 PolarHBondContact O-N 3.13Å; Q538-W540 VanDerWaalsContact C-N 3.27Å; Q538-W540 PolarHBondContact O-N 3.33Å; W540-Y543 WeakPolarHBondContact O-CB 3.36Å; W540-Y543 PolarHBondContact O-N 3.22Å; W540-Q544 HydrophobicContact CD2-CG 3.96Å; W540-Q544 HydrophobicContact CE3-CG 4.15Å; W540-Q544 HydrophobicContact CH2-CG 3.9Å; W540-Q544 HydrophobicContact CZ2-CG 3.7Å; W540-Q544 HydrophobicContact CZ3-CG 4.12Å; W540-Q544 WeakPolarHBondContact O-CG 3.4Å; W540-Q544 PolarHBondContact O-N 2.82Å
541	L	82.6	Confident	81.4	Confident	12 Å²	12	36.3 Å²	36.3	6%	0.063	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-42.4	175.2	-77.3	172.9	0	0	0	112.1	Y537 Q538 Y543 Q544 A545 F583 E585	Y537-L541 HydrophobicContact CD1-CD1 3.86Å; Y537-L541 HydrophobicContact CD1-CG 4.38Å; Y537-L541 HydrophobicContact CE1-CD1 3.47Å; Y537-L541 VanDerWaalsContact CE1-CD1 3.47Å; Y537-L541 HydrophobicContact CE1-CD2 4.47Å; Y537-L541 HydrophobicContact CE1-CG 4.02Å; Y537-L541 HydrophobicContact CE2-CG 4.39Å; Y537-L541 WeakPolarHBondContact O-CG 3.43Å; Y537-L541 PolarHBondContact O-N 3.01Å; Q538-L541 PolarHBondContact O-N 3.41Å; L541-Y543 VanDerWaalsContact C-N 3.32Å; L541-Y543 PolarHBondContact O-N 2.87Å; L541-Q544 PolarHBondContact O-N 3.41Å; L541-A545 WeakPolarHBondContact O-CB 3.37Å; L541-A545 PolarHBondContact O-N 3.44Å; L541-F583 HydrophobicContact CB-CE1 4.11Å; L541-F583 HydrophobicContact CB-CZ 3.92Å; L541-E585 HydrophobicContact CD1-CB 4.34Å; L541-E585 HydrophobicContact CD1-CG 4.11Å; L541-E585 HydrophobicContact CD2-CG 4.18Å
542	I	84.9	Confident	80.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.2	-47.2	173.3	-67.2	165.5	0	0	0	109.9	F510 I518 Q538 Q544 A545 L546 F577 F583 F631	F510-I542 HydrophobicContact CE1-CG2 4.08Å; F510-I542 HydrophobicContact CE2-CG2 4.28Å; F510-I542 HydrophobicContact CZ-CB 4.11Å; F510-I542 HydrophobicContact CZ-CG2 3.66Å; I518-I542 HydrophobicContact CD1-CD1 4.18Å; I518-I542 HydrophobicContact CD1-CG2 3.94Å; Q538-I542 WeakPolarHBondContact O-CG1 3.14Å; Q538-I542 PolarHBondContact O-N 2.94Å; I542-Q544 PolarHBondContact O-N 2.97Å; I542-A545 WeakPolarHBondContact O-CB 3.49Å; I542-A545 PolarHBondContact O-N 3.44Å; I542-A545 VanDerWaalsContact O-N 3.14Å; I542-L546 WeakPolarHBondContact O-CG 3.45Å; I542-L546 PolarHBondContact O-N 3.46Å; I542-F577 HydrophobicContact CG2-CD2 4.2Å; I542-F577 HydrophobicContact CG2-CE2 3.92Å; I542-F583 HydrophobicContact CD1-CD1 4.37Å; I542-F583 HydrophobicContact CG1-CD1 3.74Å; I542-F583 HydrophobicContact CG1-CD2 4.37Å; I542-F583 HydrophobicContact CG1-CE1 3.68Å; I542-F583 HydrophobicContact CG1-CE2 4.33Å; I542-F583 HydrophobicContact CG1-CG 4.1Å; I542-F583 HydrophobicContact CG1-CZ 4Å; I542-F631 HydrophobicContact CD1-CE1 4.43Å; I542-F631 HydrophobicContact CD1-CZ 4.14Å
543	Y	86.7	Confident	79	Confident	43 Å²	43	44 Å²	44	17%	0.169	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-45.5	174.3	172	-100.1	0	0	0	113	T482 L485 F513 Y539 W540 L541 A545 L546 V547	T482-Y543 HydrophobicContact CG2-CD1 4.27Å; T482-Y543 HydrophobicContact CG2-CE1 3.85Å; T482-Y543 HydrophobicContact CG2-CE2 4.44Å; L485-Y543 HydrophobicContact CD2-CD2 3.89Å; L485-Y543 HydrophobicContact CD2-CG 3.95Å; F513-Y543 HydrophobicContact CD1-CE2 4.12Å; F513-Y543 HydrophobicContact CD2-CD2 4.43Å; F513-Y543 HydrophobicContact CD2-CE2 4.27Å; F513-Y543 AromaticContact CE1-CE2 3.78Å; F513-Y543 HydrophobicContact CE1-CE2 3.78Å; F513-Y543 HydrophobicContact CE2-CD2 4.41Å; F513-Y543 AromaticContact CE2-CE2 3.95Å; F513-Y543 HydrophobicContact CE2-CE2 3.95Å; F513-Y543 HydrophobicContact CG-CE2 4.37Å; F513-Y543 AromaticContact CZ-CE2 3.69Å; F513-Y543 HydrophobicContact CZ-CE2 3.69Å; Y539-Y543 WeakPolarHBondContact O-CB 3.41Å; Y539-Y543 PolarHBondContact O-N 2.86Å; W540-Y543 WeakPolarHBondContact O-CB 3.36Å; W540-Y543 PolarHBondContact O-N 3.22Å; L541-Y543 VanDerWaalsContact C-N 3.32Å; L541-Y543 PolarHBondContact O-N 2.87Å; Y543-A545 VanDerWaalsContact C-N 3.32Å; Y543-A545 PolarHBondContact O-N 2.82Å; Y543-L546 PolarHBondContact O-N 2.84Å; Y543-V547 HydrophobicContact CE1-CG2 4.22Å; Y543-V547 HydrophobicContact CE2-CG2 4.04Å; Y543-V547 WeakPolarHBondContact O-CG2 3.41Å; Y543-V547 PolarHBondContact O-N 3.48Å; Y543-V547 VanDerWaalsContact O-N 3.11Å
544	Q	81.8	Confident	78.1	Confident	59 Å²	59	42 Å²	42	28%	0.276	19%	0.194	S	C	.	.	H	α-helix	trans	-61.4	-39.7	174.9	-71.2	-64.7	-22	0	0	111.8	W540 L541 I542 V547 N548	W540-Q544 HydrophobicContact CD2-CG 3.96Å; W540-Q544 HydrophobicContact CE3-CG 4.15Å; W540-Q544 HydrophobicContact CH2-CG 3.9Å; W540-Q544 HydrophobicContact CZ2-CG 3.7Å; W540-Q544 HydrophobicContact CZ3-CG 4.12Å; W540-Q544 WeakPolarHBondContact O-CG 3.4Å; W540-Q544 PolarHBondContact O-N 2.82Å; L541-Q544 PolarHBondContact O-N 3.41Å; I542-Q544 PolarHBondContact O-N 2.97Å; Q544-V547 PolarHBondContact O-N 2.81Å; Q544-N548 VanDerWaalsContact O-CB 3.27Å; Q544-N548 WeakPolarHBondContact O-CB 3.34Å; Q544-N548 PolarHBondContact O-N 3.22Å; Q544-N548 PolarHBondContact O-ND2 2.94Å
545	A	78.6	Confident	77.2	Confident	25 Å²	25	46.5 Å²	46.5	21%	0.207	21%	0.213	C	C	.	.	H	α-helix	trans	-64.5	-40.6	177	0	0	0	0	0	112.2	L541 I542 Y543 Y549 F577 F583	L541-A545 WeakPolarHBondContact O-CB 3.37Å; L541-A545 PolarHBondContact O-N 3.44Å; I542-A545 WeakPolarHBondContact O-CB 3.49Å; I542-A545 PolarHBondContact O-N 3.44Å; I542-A545 VanDerWaalsContact O-N 3.14Å; Y543-A545 VanDerWaalsContact C-N 3.32Å; Y543-A545 PolarHBondContact O-N 2.82Å; A545-Y549 VanDerWaalsContact O-CB 3.23Å; A545-Y549 WeakPolarHBondContact O-CB 3.43Å; A545-Y549 PolarHBondContact O-N 2.96Å; A545-F577 HydrophobicContact CB-CE2 4.43Å; A545-F577 HydrophobicContact CB-CZ 4Å; A545-F583 HydrophobicContact CB-CE2 3.79Å; A545-F583 HydrophobicContact CB-CZ 4.47Å
546	L	77.4	Confident	75.5	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-58.9	-50.1	173.6	-65	173.2	0	0	0	111.7	F510 F513 Q515 I542 Y543 Y549 A550 P576 F577	F510-L546 HydrophobicContact CD1-CD1 3.59Å; F510-L546 HydrophobicContact CE1-CD1 3.71Å; F513-L546 HydrophobicContact CB-CD1 4.21Å; Q515-L546 HydrophobicContact CB-CD1 3.84Å; Q515-L546 HydrophobicContact CB-CD2 3.95Å; Q515-L546 HydrophobicContact CG-CD1 4Å; Q515-L546 HydrophobicContact CG-CD2 4.03Å; I542-L546 WeakPolarHBondContact O-CG 3.45Å; I542-L546 PolarHBondContact O-N 3.46Å; Y543-L546 PolarHBondContact O-N 2.84Å; L546-Y549 PolarHBondContact O-N 3.01Å; L546-A550 PolarHBondContact O-N 3.12Å; L546-P576 HydrophobicContact CD2-CB 3.61Å; L546-P576 HydrophobicContact CD2-CG 3.64Å; L546-F577 HydrophobicContact CD2-CD2 3.98Å; L546-F577 HydrophobicContact CD2-CE2 3.89Å; L546-F577 HydrophobicContact CG-CE2 4.29Å
547	V	76.9	Confident	73.6	Confident	40 Å²	40	51.3 Å²	51.3	24%	0.242	25%	0.245	C	C	.	.	H	α-helix	trans	-64.6	-46.3	179.8	176	0	0	0	0	111.1	Y543 Q544 Y549 A550 E551	Y543-V547 HydrophobicContact CE1-CG2 4.22Å; Y543-V547 HydrophobicContact CE2-CG2 4.04Å; Y543-V547 WeakPolarHBondContact O-CG2 3.41Å; Y543-V547 PolarHBondContact O-N 3.48Å; Y543-V547 VanDerWaalsContact O-N 3.11Å; Q544-V547 PolarHBondContact O-N 2.81Å; V547-Y549 VanDerWaalsContact C-N 3.3Å; V547-Y549 PolarHBondContact O-N 2.7Å; V547-A550 WeakPolarHBondContact O-CB 3.4Å; V547-A550 PolarHBondContact O-N 3.41Å; V547-E551 PolarHBondContact O-N 2.94Å
548	N	72.9	Confident	71.4	Confident	67 Å²	67	53 Å²	53	36%	0.358	26%	0.264	S	S	.	.	H	α-helix	trans	-64.2	-32.3	177.3	-83.1	-81.4	0	0	0	112.8	Q544 K552	Q544-N548 VanDerWaalsContact O-CB 3.27Å; Q544-N548 WeakPolarHBondContact O-CB 3.34Å; Q544-N548 PolarHBondContact O-N 3.22Å; Q544-N548 PolarHBondContact O-ND2 2.94Å; N548-K552 WeakPolarHBondContact O-CB 3.16Å; N548-K552 VanDerWaalsContact O-CD 3.28Å; N548-K552 WeakPolarHBondContact O-CD 3.48Å; N548-K552 WeakPolarHBondContact O-CG 3.48Å; N548-K552 PolarHBondContact O-N 2.91Å
549	Y	69.3	Low	68.9	Low	94 Å²	94	58.4 Å²	58.4	37%	0.369	29%	0.292	S	S	.	.	H	α-helix	trans	-68.1	-46.6	172.8	178	-93.9	0	0	0	111	A545 L546 V547 E551 K552 Q553 P576	A545-Y549 VanDerWaalsContact O-CB 3.23Å; A545-Y549 WeakPolarHBondContact O-CB 3.43Å; A545-Y549 PolarHBondContact O-N 2.96Å; L546-Y549 PolarHBondContact O-N 3.01Å; V547-Y549 VanDerWaalsContact C-N 3.3Å; V547-Y549 PolarHBondContact O-N 2.7Å; Y549-E551 PolarHBondContact O-N 2.99Å; Y549-K552 PolarHBondContact O-N 3.17Å; Y549-Q553 HydrophobicContact CD1-CG 4.29Å; Y549-Q553 HydrophobicContact CE1-CG 3.91Å; Y549-Q553 VanDerWaalsContact CZ-NE2 3.28Å; Y549-Q553 PolarHBondContact O-N 2.83Å; Y549-Q553 PolarHBondContact OH-NE2 2.84Å; Y549-P576 HydrophobicContact CD1-CB 4.33Å; Y549-P576 HydrophobicContact CD1-CG 4.16Å; Y549-P576 HydrophobicContact CE1-CG 4.33Å
550	A	66.2	Low	66.4	Low	2 Å²	2	62.5 Å²	62.5	2%	0.017	31%	0.311	C	S	.	.	H	α-helix	trans	-58.8	-47.6	178	0	0	0	0	0	112.2	L546 V547 K552 Q553 V554 V998 L1002	L546-A550 PolarHBondContact O-N 3.12Å; V547-A550 WeakPolarHBondContact O-CB 3.4Å; V547-A550 PolarHBondContact O-N 3.41Å; A550-K552 VanDerWaalsContact C-N 3.32Å; A550-K552 PolarHBondContact O-N 2.87Å; A550-Q553 PolarHBondContact O-N 3.26Å; A550-V554 WeakPolarHBondContact O-CG2 3.08Å; A550-V554 PolarHBondContact O-N 2.94Å; A550-V554 VanDerWaalsContact O-N 3.15Å; A550-V998 HydrophobicContact CB-CB 3.7Å; A550-V998 HydrophobicContact CB-CG1 3.93Å; A550-L1002 HydrophobicContact CB-CD1 3.99Å
551	E	67.4	Low	63.8	Low	82 Å²	82	67.6 Å²	67.6	38%	0.383	34%	0.339	S	S	.	.	H	α-helix	trans	-57.7	-42.4	174.4	-78.4	-163.1	-165.2	0	0	112.8	V547 Y549 V554 K555	V547-E551 PolarHBondContact O-N 2.94Å; Y549-E551 PolarHBondContact O-N 2.99Å; E551-V554 PolarHBondContact O-N 3.03Å; E551-K555 HydrophobicContact CB-CD 4.49Å; E551-K555 VanDerWaalsContact O-CB 3.3Å; E551-K555 WeakPolarHBondContact O-CB 3.48Å; E551-K555 WeakPolarHBondContact O-CD 3.45Å; E551-K555 WeakPolarHBondContact O-CG 3.07Å; E551-K555 PolarHBondContact O-N 2.83Å; E551-K555 IonicContact OE2-NZ 3.65Å; E551-K555 PolarHBondContact OE2-NZ 3.46Å
552	K	66.7	Low	61.5	Low	137 Å²	137	69.3 Å²	69.3	60%	0.596	35%	0.351	S	S	*	.	H	α-helix	trans	-64.6	-38.9	180	-75.5	165.7	-170.2	168.5	0	111.9	N548 Y549 A550 K555 S556	N548-K552 WeakPolarHBondContact O-CB 3.16Å; N548-K552 VanDerWaalsContact O-CD 3.28Å; N548-K552 WeakPolarHBondContact O-CD 3.48Å; N548-K552 WeakPolarHBondContact O-CG 3.48Å; N548-K552 PolarHBondContact O-N 2.91Å; Y549-K552 PolarHBondContact O-N 3.17Å; A550-K552 VanDerWaalsContact C-N 3.32Å; A550-K552 PolarHBondContact O-N 2.87Å; K552-K555 PolarHBondContact O-N 3.16Å; K552-S556 WeakPolarHBondContact O-CB 3.35Å; K552-S556 PolarHBondContact O-N 3.39Å; K552-S556 PolarHBondContact O-OG 3.16Å
553	Q	63.7	Low	59.1	Low	40 Å²	40	72.3 Å²	72.3	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-61.8	-54.9	174.7	-63.8	-60.1	-23	0	0	110.5	Y549 A550 K555 S556 D557 H999	Y549-Q553 HydrophobicContact CD1-CG 4.29Å; Y549-Q553 HydrophobicContact CE1-CG 3.91Å; Y549-Q553 VanDerWaalsContact CZ-NE2 3.28Å; Y549-Q553 PolarHBondContact O-N 2.83Å; Y549-Q553 PolarHBondContact OH-NE2 2.84Å; A550-Q553 PolarHBondContact O-N 3.26Å; Q553-K555 VanDerWaalsContact C-N 3.26Å; Q553-K555 PolarHBondContact O-N 2.76Å; Q553-S556 PolarHBondContact O-N 3.17Å; Q553-S556 PolarHBondContact O-OG 3.04Å; Q553-D557 PolarHBondContact O-N 3.45Å; Q553-H999 HydrophobicContact CB-CB 4.08Å
554	V	62.6	Low	56.4	Low	34 Å²	34	75 Å²	75	21%	0.206	38%	0.382	C	S	.	.	H	α-helix	trans	-55.3	-40.1	178.6	178.5	0	0	0	0	112.1	A550 E551 S556 F560 H999 L1002	A550-V554 WeakPolarHBondContact O-CG2 3.08Å; A550-V554 PolarHBondContact O-N 2.94Å; A550-V554 VanDerWaalsContact O-N 3.15Å; E551-V554 PolarHBondContact O-N 3.03Å; V554-S556 VanDerWaalsContact C-N 3.34Å; V554-F560 HydrophobicContact CG1-CE2 4.33Å; V554-F560 HydrophobicContact CG1-CZ 4.09Å; V554-H999 HydrophobicContact CG2-CB 3.68Å; V554-L1002 HydrophobicContact CG2-CB 4.46Å; V554-L1002 HydrophobicContact CG2-CD1 4.34Å
555	K	60.7	Low	54.2	Low	141 Å²	141	74.3 Å²	74.3	61%	0.613	38%	0.383	S	S	*	.	H	α-helix	trans	-76.2	-15.9	178.1	-69.7	166.7	-178.7	174.3	0	114	E551 K552 Q553 V558	E551-K555 HydrophobicContact CB-CD 4.49Å; E551-K555 VanDerWaalsContact O-CB 3.3Å; E551-K555 WeakPolarHBondContact O-CB 3.48Å; E551-K555 WeakPolarHBondContact O-CD 3.45Å; E551-K555 WeakPolarHBondContact O-CG 3.07Å; E551-K555 PolarHBondContact O-N 2.83Å; E551-K555 IonicContact OE2-NZ 3.65Å; E551-K555 PolarHBondContact OE2-NZ 3.46Å; K552-K555 PolarHBondContact O-N 3.16Å; Q553-K555 VanDerWaalsContact C-N 3.26Å; Q553-K555 PolarHBondContact O-N 2.76Å; K555-V558 WeakPolarHBondContact O-CG2 3.48Å
556	S	53.4	Low	52	Low	69 Å²	69	80.8 Å²	80.8	48%	0.483	41%	0.41	S	S	.	.	H	α-helix	trans	-91.5	-22.6	-177.5	72.9	0	0	0	0	114.2	K552 Q553 V554 V558	K552-S556 WeakPolarHBondContact O-CB 3.35Å; K552-S556 PolarHBondContact O-N 3.39Å; K552-S556 PolarHBondContact O-OG 3.16Å; Q553-S556 PolarHBondContact O-N 3.17Å; Q553-S556 PolarHBondContact O-OG 3.04Å; V554-S556 VanDerWaalsContact C-N 3.34Å; S556-V558 PolarHBondContact O-N 3.43Å
557	D	48.8	Very low	49.9	Very low	45 Å²	45	82.9 Å²	82.9	24%	0.241	42%	0.422	C	S	.	.			trans	-80.8	67.5	171.7	-73.7	-42	0	0	0	110.3	Q553 N559 F560 F563	Q553-D557 PolarHBondContact O-N 3.45Å; D557-N559 PolarHBondContact O-N 2.86Å; D557-F560 WeakPolarHBondContact O-CD2 3.36Å; D557-F563 HydrophobicContact CB-CZ 4.48Å
558	V	36.8	Very low	47.8	Very low	125 Å²	125	83.4 Å²	83.4	76%	0.758	42%	0.42	S	S	*	.			trans	-69.8	29.5	-175	-167.1	0	0	0	0	113.3	K555 S556	K555-V558 WeakPolarHBondContact O-CG2 3.48Å; S556-V558 PolarHBondContact O-N 3.43Å
559	N	32.8	Very low	45.8	Very low	112 Å²	112	84.4 Å²	84.4	60%	0.599	43%	0.426	S	S	*	.			trans	-138.3	45.2	-179.3	-97.2	-16.2	0	0	0	110.9	D557 E561 S562 F563	D557-N559 PolarHBondContact O-N 2.86Å; N559-E561 VanDerWaalsContact C-N 3.27Å; N559-E561 PolarHBondContact O-N 3.23Å; N559-S562 WeakPolarHBondContact CB-OG 3.21Å; N559-S562 VanDerWaalsContact CG-OG 3.31Å; N559-S562 CarbonylContact O-C 3.18Å; N559-S562 VanDerWaalsContact O-C 3.25Å; N559-S562 WeakPolarHBondContact O-CA 3.29Å; N559-S562 PolarHBondContact O-N 3.38Å; N559-S562 PolarHBondContact OD1-OG 3.24Å; N559-F563 PolarHBondContact O-N 2.79Å
560	F	38.2	Very low	44.1	Very low	87 Å²	87	86.8 Å²	86.8	38%	0.382	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-50	-42.9	177.8	-103.6	-113	0	0	0	113.2	V554 D557 S562 H1007	V554-F560 HydrophobicContact CG1-CE2 4.33Å; V554-F560 HydrophobicContact CG1-CZ 4.09Å; D557-F560 WeakPolarHBondContact O-CD2 3.36Å; F560-S562 PolarHBondContact O-N 3.36Å; F560-H1007 AromaticContact CE1-CE1 3.7Å; F560-H1007 AromaticContact CE1-NE2 3.92Å
561	E	31.7	Very low	42.6	Very low	204 Å²	204	91.4 Å²	91.4	95%	0.953	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-72.2	-8.1	176.4	-62.6	-173.8	153.5	0	0	114.4	N559	N559-E561 VanDerWaalsContact C-N 3.27Å; N559-E561 PolarHBondContact O-N 3.23Å
562	S	34.1	Very low	41.2	Very low	47 Å²	47	88.4 Å²	88.4	33%	0.329	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-137.4	49	-176.9	65.5	0	0	0	0	113.4	N559 F560 N564	N559-S562 WeakPolarHBondContact CB-OG 3.21Å; N559-S562 VanDerWaalsContact CG-OG 3.31Å; N559-S562 CarbonylContact O-C 3.18Å; N559-S562 VanDerWaalsContact O-C 3.25Å; N559-S562 WeakPolarHBondContact O-CA 3.29Å; N559-S562 PolarHBondContact O-N 3.38Å; N559-S562 PolarHBondContact OD1-OG 3.24Å; F560-S562 PolarHBondContact O-N 3.36Å; S562-N564 PolarHBondContact O-N 3.02Å; S562-N564 PolarHBondContact O-ND2 3.12Å
563	F	34.7	Very low	39.9	Very low	63 Å²	63	83.1 Å²	83.1	28%	0.276	43%	0.433	S	S	.	.			trans	-58.6	71.4	159.4	-96.9	-89.8	0	0	0	111.4	D557 N559 T567 Y568	D557-F563 HydrophobicContact CB-CZ 4.48Å; N559-F563 PolarHBondContact O-N 2.79Å; F563-T567 HydrophobicContact CE1-CG2 4.32Å; F563-Y568 HydrophobicContact CB-CE2 4.05Å; F563-Y568 AromaticContact CD1-CE2 3.88Å; F563-Y568 HydrophobicContact CD1-CE2 3.88Å; F563-Y568 AromaticContact CD1-CZ 3.85Å; F563-Y568 HydrophobicContact CG-CE2 4.47Å
564	N	30.4	Very low	39.1	Very low	100 Å²	100	84.3 Å²	84.3	54%	0.535	45%	0.447	S	S	.	.			trans	-70.7	157.2	170.8	-88.8	-81	0	0	0	110.1	S562 Q566 T567	S562-N564 PolarHBondContact O-N 3.02Å; S562-N564 PolarHBondContact O-ND2 3.12Å; N564-Q566 PolarHBondContact O-N 2.75Å; N564-T567 PolarHBondContact O-N 2.87Å
565	S	34.8	Very low	38.7	Very low	44 Å²	44	83.2 Å²	83.2	31%	0.308	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	18.1	-177.1	84	0	0	0	0	116.2	N569 K1058	S565-N569 PolarHBondContact O-OD1 2.87Å; S565-K1058 WeakPolarHBondContact OG-CD 3.32Å; S565-K1058 WeakPolarHBondContact OG-CE 3.34Å; S565-K1058 PolarHBondContact OG-NZ 3.41Å
566	Q	32.4	Very low	39	Very low	162 Å²	162	78 Å²	78	76%	0.757	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-30.7	177.4	-70.2	-178.3	-31.9	0	0	111.6	N564 N569	N564-Q566 PolarHBondContact O-N 2.75Å; Q566-N569 PolarHBondContact O-N 2.85Å
567	T	32.7	Very low	40.2	Very low	45 Å²	45	76 Å²	76	28%	0.276	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-71.8	-41.5	176.9	-36.5	0	0	0	0	111.3	F563 N564 N569 R570	F563-T567 HydrophobicContact CE1-CG2 4.32Å; N564-T567 PolarHBondContact O-N 2.87Å; T567-N569 PolarHBondContact O-N 2.95Å; T567-R570 PolarHBondContact O-N 3.22Å; T567-R570 VanDerWaalsContact O-N 3.1Å
568	Y	33.5	Very low	41.7	Very low	51 Å²	51	77.2 Å²	77.2	20%	0.2	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-59	-14.5	174.9	-62.5	-85.8	0	0	0	114.5	F563 R570 T1061 H1064	F563-Y568 HydrophobicContact CB-CE2 4.05Å; F563-Y568 AromaticContact CD1-CE2 3.88Å; F563-Y568 HydrophobicContact CD1-CE2 3.88Å; F563-Y568 AromaticContact CD1-CZ 3.85Å; F563-Y568 HydrophobicContact CG-CE2 4.47Å; Y568-R570 VanDerWaalsContact C-N 3.27Å; Y568-R570 PolarHBondContact O-N 2.85Å; Y568-T1061 PolarHBondContact O-OG1 2.89Å; Y568-H1064 HydrophobicContact CD1-CB 4.22Å; Y568-H1064 AromaticContact CD1-CD2 3.7Å; Y568-H1064 AromaticContact CE1-CD2 3.96Å; Y568-H1064 AromaticContact CG-CD2 3.87Å
569	N	30.8	Very low	44	Very low	89 Å²	89	72 Å²	72	48%	0.476	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-84	1	177.5	-74.9	19.5	0	0	0	113.6	S565 Q566 T567 T1061	S565-N569 PolarHBondContact O-OD1 2.87Å; Q566-N569 PolarHBondContact O-N 2.85Å; T567-N569 PolarHBondContact O-N 2.95Å; N569-T1061 HydrophobicContact CB-CG2 4.32Å
570	R	33.3	Very low	46.7	Very low	144 Å²	144	67.1 Å²	67.1	54%	0.543	35%	0.348	S	S	.	.	S	Bend	trans	-69.8	130.7	159.8	-66.8	-177	179	168.8	4.3	108.3	T567 Y568	T567-R570 PolarHBondContact O-N 3.22Å; T567-R570 VanDerWaalsContact O-N 3.1Å; Y568-R570 VanDerWaalsContact C-N 3.27Å; Y568-R570 PolarHBondContact O-N 2.85Å
571	P	34.7	Very low	49	Very low	98 Å²	98	64.2 Å²	64.2	64%	0.636	34%	0.336	S	S	*	.			trans	-59.7	163.1	164.3	29.4	-34.7	0	0	0	109.2	G573	P571-G573 PolarHBondContact O-N 2.82Å; P571-G573 VanDerWaalsContact O-N 3.16Å
572	F	39.6	Very low	51.6	Low	20 Å²	20	55.9 Å²	55.9	9%	0.088	30%	0.3	C	S	.	.	S	Bend	trans	-44	127.6	172.3	-75.7	-81	0	0	0	109.6	S574 F994 V996 W1038 F1041 F1062 S1066	F572-S574 PolarHBondContact O-N 2.83Å; F572-F994 HydrophobicContact CB-CB 4.33Å; F572-F994 HydrophobicContact CB-CD1 4.04Å; F572-F994 HydrophobicContact CD2-CB 3.67Å; F572-F994 AromaticContact CD2-CD1 3.56Å; F572-F994 HydrophobicContact CD2-CD1 3.56Å; F572-F994 HydrophobicContact CD2-CD2 4.33Å; F572-F994 HydrophobicContact CD2-CE1 4.23Å; F572-F994 AromaticContact CD2-CG 3.59Å; F572-F994 HydrophobicContact CD2-CG 3.59Å; F572-F994 HydrophobicContact CE2-CB 4.07Å; F572-F994 HydrophobicContact CE2-CD1 4.42Å; F572-F994 HydrophobicContact CE2-CD2 4.43Å; F572-F994 HydrophobicContact CE2-CG 4.07Å; F572-F994 HydrophobicContact CG-CB 4.04Å; F572-F994 HydrophobicContact CG-CD1 4.19Å; F572-F994 HydrophobicContact CG-CG 4.33Å; F572-V996 HydrophobicContact CE1-CG2 4.49Å; F572-W1038 AromaticContact CE1-CH2 3.5Å; F572-W1038 HydrophobicContact CE1-CH2 3.5Å; F572-W1038 VanDerWaalsContact CE1-CH2 3.5Å; F572-W1038 AromaticContact CE1-CZ2 3.91Å; F572-W1038 HydrophobicContact CE1-CZ2 3.91Å; F572-W1038 HydrophobicContact CE1-CZ3 4.14Å; F572-W1038 AromaticContact CZ-CH2 3.48Å; F572-W1038 HydrophobicContact CZ-CH2 3.48Å; F572-W1038 VanDerWaalsContact CZ-CH2 3.48Å; F572-W1038 AromaticContact CZ-CZ2 3.7Å; F572-W1038 HydrophobicContact CZ-CZ2 3.7Å; F572-F1041 HydrophobicContact CE2-CD1 4.08Å; F572-F1041 HydrophobicContact CZ-CD1 4.43Å; F572-F1062 HydrophobicContact CE2-CD1 4.26Å; F572-S1066 VanDerWaalsContact CZ-OG 3.29Å; F572-S1066 WeakPolarHBondContact CZ-OG 3.48Å
573	G	38.5	Very low	54	Low	25 Å²	25	54.1 Å²	54.1	26%	0.258	29%	0.287	S	S	.	.			trans	-55.1	127.6	178.7	0	0	0	0	0	108.7	P571 P997	P571-G573 PolarHBondContact O-N 2.82Å; P571-G573 VanDerWaalsContact O-N 3.16Å; G573-P997 WeakPolarHBondContact O-CG 3.46Å
574	S	47.3	Very low	56.1	Low	66 Å²	66	52.7 Å²	52.7	46%	0.462	28%	0.28	S	S	.	.			trans	-57.2	148.7	177	57.8	0	0	0	0	110.7	F572	F572-S574 PolarHBondContact O-N 2.83Å
575	A	54.6	Low	57.7	Low	10 Å²	10	51.8 Å²	51.8	8%	0.083	27%	0.273	C	S	.	.			trans	-44.8	134.4	175.6	0	0	0	0	0	110.8	F577 R578 L995	A575-F577 PolarHBondContact O-N 2.87Å; A575-R578 HydrophobicContact CB-CG 4.36Å; A575-L995 HydrophobicContact CB-CD1 4.18Å
576	P	66.6	Low	58.6	Low	33 Å²	33	53.5 Å²	53.5	21%	0.214	28%	0.275	C	S	.	.	S	Bend	trans	-59.5	-26.1	-169.2	-28.2	37.1	0	0	0	114.4	L546 Y549	L546-P576 HydrophobicContact CD2-CB 3.61Å; L546-P576 HydrophobicContact CD2-CG 3.64Å; Y549-P576 HydrophobicContact CD1-CB 4.33Å; Y549-P576 HydrophobicContact CD1-CG 4.16Å; Y549-P576 HydrophobicContact CE1-CG 4.33Å
577	F	77.4	Confident	59.4	Low	26 Å²	26	46.8 Å²	46.8	11%	0.114	24%	0.244	C	C	.	.	S	Bend	trans	-126.3	129.3	165.4	-51.7	-72.4	0	0	0	109.8	Q515 I542 A545 L546 A575 F583 F631	Q515-F577 PolarHBondContact NE2-O 3.33Å; Q515-F577 PolarHBondContact OE1-O 2.67Å; I542-F577 HydrophobicContact CG2-CD2 4.2Å; I542-F577 HydrophobicContact CG2-CE2 3.92Å; A545-F577 HydrophobicContact CB-CE2 4.43Å; A545-F577 HydrophobicContact CB-CZ 4Å; L546-F577 HydrophobicContact CD2-CD2 3.98Å; L546-F577 HydrophobicContact CD2-CE2 3.89Å; L546-F577 HydrophobicContact CG-CE2 4.29Å; A575-F577 PolarHBondContact O-N 2.87Å; F577-F583 AromaticContact CE1-CD2 3.74Å; F577-F583 HydrophobicContact CE1-CD2 3.74Å; F577-F583 HydrophobicContact CE2-CD2 4.5Å; F577-F583 AromaticContact CZ-CD2 3.61Å; F577-F583 HydrophobicContact CZ-CD2 3.61Å; F577-F583 HydrophobicContact CZ-CE2 4.01Å; F577-F631 HydrophobicContact CB-CD2 3.86Å; F577-F631 HydrophobicContact CB-CE2 3.71Å; F577-F631 AromaticContact CD1-CE2 3.85Å; F577-F631 HydrophobicContact CD1-CE2 3.85Å; F577-F631 HydrophobicContact CG-CD2 4.39Å; F577-F631 AromaticContact CG-CE2 3.77Å; F577-F631 HydrophobicContact CG-CE2 3.77Å; F577-F631 HydrophobicContact CG-CZ 4.5Å
578	R	80.7	Confident	59.8	Low	71 Å²	71	47.5 Å²	47.5	27%	0.268	24%	0.242	S	C	.	.			trans	-118.8	-176.6	176.3	-63.6	156.4	-73.1	164.3	16.3	111.2	A575 H580 D581 F631 N739	A575-R578 HydrophobicContact CB-CG 4.36Å; R578-H580 PolarHBondContact O-N 2.9Å; R578-D581 WeakPolarHBondContact CB-OD2 3.47Å; R578-D581 IonicContact CZ-OD1 3.43Å; R578-D581 IonicContact CZ-OD2 3.7Å; R578-D581 PolarHBondContact N-OD2 3.32Å; R578-D581 IonicContact NE-OD2 2.79Å; R578-D581 PolarHBondContact NE-OD2 3.03Å; R578-D581 IonicContact NH2-OD1 3.76Å; R578-D581 PolarHBondContact NH2-OD1 2.83Å; R578-D581 IonicContact NH2-OD2 3.57Å; R578-D581 PolarHBondContact NH2-OD2 3.26Å; R578-D581 WeakPolarHBondContact O-CB 3.3Å; R578-D581 PolarHBondContact O-N 2.95Å; R578-F631 WeakPolarHBondContact O-CB 3.21Å; R578-N739 PolarHBondContact NH1-OD1 2.93Å; R578-N739 VanDerWaalsContact NH1-OD1 3.1Å; R578-N739 PolarHBondContact NH2-ND2 2.81Å; R578-N739 PolarHBondContact NH2-OD1 2.94Å
579	S	85.3	Confident	60.3	Low	14 Å²	14	46 Å²	46	10%	0.098	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	136.4	160.2	-136.6	0	0	0	0	111.5	D581 H633 N739	S579-D581 PolarHBondContact O-N 3.07Å; S579-D581 VanDerWaalsContact O-N 3.08Å; S579-H633 VanDerWaalsContact CB-ND1 3.28Å; S579-H633 WeakPolarHBondContact CB-ND1 3.23Å; S579-H633 PolarHBondContact OG-N 3.03Å; S579-H633 PolarHBondContact OG-ND1 2.9Å; S579-H633 VanDerWaalsContact OG-ND1 3.11Å; S579-N739 PolarHBondContact O-ND2 3.43Å
580	H	89.7	Confident	60.5	Low	10 Å²	10	44.7 Å²	44.7	5%	0.046	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	-3.8	-179.5	-54.3	99.8	0	0	0	115.9	R578 F631 P667 L671 D799 C800	R578-H580 PolarHBondContact O-N 2.9Å; H580-F631 WeakPolarHBondContact CA-O 3.35Å; H580-F631 PolarHBondContact N-O 2.85Å; H580-P667 HydrophobicContact CB-CB 4.09Å; H580-P667 HydrophobicContact CB-CG 3.74Å; H580-P667 WeakPolarHBondContact O-CB 3.33Å; H580-P667 WeakPolarHBondContact O-CG 3.3Å; H580-L671 VanDerWaalsContact CD2-CD1 3.46Å; H580-L671 WeakPolarHBondContact CD2-CD1 2.98Å; H580-D799 WeakPolarHBondContact CB-OD1 3.49Å; H580-D799 VanDerWaalsContact CE1-CB 3.47Å; H580-D799 WeakPolarHBondContact CE1-CB 3.49Å; H580-D799 IonicContact CE1-OD2 3.82Å; H580-D799 VanDerWaalsContact CG-CG 3.42Å; H580-D799 IonicContact CG-OD1 2.69Å; H580-D799 IonicContact CG-OD2 3.25Å; H580-D799 WeakPolarHBondContact ND1-CB 3.44Å; H580-D799 IonicContact ND1-OD1 2.79Å; H580-D799 IonicContact ND1-OD2 3.99Å; H580-D799 PolarHBondContact ND1-OD2 2.9Å; H580-C800 PolarHBondContact CE1-N 3.04Å; H580-C800 PolarHBondContact NE2-N 3.44Å; H580-C800 VanDerWaalsContact NE2-N 3.15Å
581	D	85.8	Confident	60.4	Low	26 Å²	26	40.4 Å²	40.4	14%	0.139	23%	0.226	C	C	.	.			trans	-68.9	153.1	166.5	-70.2	-32.1	0	0	0	110.4	R578 S579 F631 N739	R578-D581 WeakPolarHBondContact CB-OD2 3.47Å; R578-D581 IonicContact CZ-OD1 3.43Å; R578-D581 IonicContact CZ-OD2 3.7Å; R578-D581 PolarHBondContact N-OD2 3.32Å; R578-D581 IonicContact NE-OD2 2.79Å; R578-D581 PolarHBondContact NE-OD2 3.03Å; R578-D581 IonicContact NH2-OD1 3.76Å; R578-D581 PolarHBondContact NH2-OD1 2.83Å; R578-D581 IonicContact NH2-OD2 3.57Å; R578-D581 PolarHBondContact NH2-OD2 3.26Å; R578-D581 WeakPolarHBondContact O-CB 3.3Å; R578-D581 PolarHBondContact O-N 2.95Å; S579-D581 PolarHBondContact O-N 3.07Å; S579-D581 VanDerWaalsContact O-N 3.08Å; D581-F631 WeakPolarHBondContact O-CD2 3.25Å; D581-F631 PolarHBondContact O-N 3.14Å; D581-N739 PolarHBondContact OD1-ND2 3.45Å
582	C	86.4	Confident	60.3	Low	29 Å²	29	41.9 Å²	41.9	20%	0.196	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	145.1	-177.9	-66.7	0	0	0	0	112.1	F584 F629 A663	C582-F584 HydrophobicContact CB-CD2 4.13Å; C582-F584 HydrophobicContact CB-CE1 4.38Å; C582-F584 HydrophobicContact CB-CE2 3.4Å; C582-F584 VanDerWaalsContact CB-CE2 3.4Å; C582-F584 HydrophobicContact CB-CZ 3.52Å; C582-F629 CarbonylContact C-O 3.32Å; C582-F629 WeakPolarHBondContact CA-O 3.46Å; C582-A663 PolarHBondContact SG-O 2.88Å; C582-A663 VanDerWaalsContact SG-O 3.35Å
583	F	85.7	Confident	59.9	Low	11 Å²	11	51.3 Å²	51.3	5%	0.048	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	112.8	173.4	-175.1	-106	0	0	0	110.8	L541 I542 A545 F577 E585 G628 F629 F631	L541-F583 HydrophobicContact CB-CE1 4.11Å; L541-F583 HydrophobicContact CB-CZ 3.92Å; I542-F583 HydrophobicContact CD1-CD1 4.37Å; I542-F583 HydrophobicContact CG1-CD1 3.74Å; I542-F583 HydrophobicContact CG1-CD2 4.37Å; I542-F583 HydrophobicContact CG1-CE1 3.68Å; I542-F583 HydrophobicContact CG1-CE2 4.33Å; I542-F583 HydrophobicContact CG1-CG 4.1Å; I542-F583 HydrophobicContact CG1-CZ 4Å; A545-F583 HydrophobicContact CB-CE2 3.79Å; A545-F583 HydrophobicContact CB-CZ 4.47Å; F577-F583 AromaticContact CE1-CD2 3.74Å; F577-F583 HydrophobicContact CE1-CD2 3.74Å; F577-F583 HydrophobicContact CE2-CD2 4.5Å; F577-F583 AromaticContact CZ-CD2 3.61Å; F577-F583 HydrophobicContact CZ-CD2 3.61Å; F577-F583 HydrophobicContact CZ-CE2 4.01Å; F583-E585 HydrophobicContact CE1-CB 3.9Å; F583-E585 HydrophobicContact CE2-CB 4.44Å; F583-E585 HydrophobicContact CZ-CB 3.73Å; F583-E585 WeakPolarHBondContact CZ-OE2 3.39Å; F583-G628 CarbonylContact O-C 3.57Å; F583-G628 WeakPolarHBondContact O-CA 3.47Å; F583-F629 PolarHBondContact N-O 2.91Å; F583-F629 PolarHBondContact O-N 3.34Å; F583-F631 HydrophobicContact CB-CE2 3.71Å; F583-F631 HydrophobicContact CB-CZ 3.79Å
584	F	78	Confident	59.3	Low	32 Å²	32	55.9 Å²	55.9	14%	0.14	29%	0.29	C	S	.	.			trans	-124.2	94.9	-177.8	-61	-50.5	0	0	0	111.2	C582 Y627 V655 A660 A663 Y664	C582-F584 HydrophobicContact CB-CD2 4.13Å; C582-F584 HydrophobicContact CB-CE1 4.38Å; C582-F584 HydrophobicContact CB-CE2 3.4Å; C582-F584 VanDerWaalsContact CB-CE2 3.4Å; C582-F584 HydrophobicContact CB-CZ 3.52Å; F584-Y627 HydrophobicContact CB-CD1 4.21Å; F584-Y627 HydrophobicContact CB-CE1 3.8Å; F584-Y627 AromaticContact CD1-CD1 3.9Å; F584-Y627 HydrophobicContact CD1-CD1 3.9Å; F584-Y627 HydrophobicContact CD1-CE1 4.29Å; F584-Y627 HydrophobicContact CG-CD1 4.27Å; F584-Y627 HydrophobicContact CG-CE1 4.2Å; F584-V655 HydrophobicContact CE1-CB 4.1Å; F584-V655 HydrophobicContact CE1-CG1 4.1Å; F584-V655 HydrophobicContact CE1-CG2 4.32Å; F584-A660 HydrophobicContact CD1-CB 4.11Å; F584-A660 HydrophobicContact CE1-CB 3.93Å; F584-A660 HydrophobicContact CE2-CB 4.43Å; F584-A660 HydrophobicContact CG-CB 4.49Å; F584-A660 HydrophobicContact CZ-CB 4.12Å; F584-A663 HydrophobicContact CE1-CB 4.49Å; F584-A663 HydrophobicContact CZ-CB 3.66Å; F584-Y664 HydrophobicContact CE2-CD2 4.45Å
585	E	63.6	Low	58.2	Low	81 Å²	81	57.5 Å²	57.5	38%	0.379	30%	0.301	S	S	.	.			trans	-135.8	133.1	176.6	-166.7	144.4	-139.7	0	0	110.2	L541 F583 L587	L541-E585 HydrophobicContact CD1-CB 4.34Å; L541-E585 HydrophobicContact CD1-CG 4.11Å; L541-E585 HydrophobicContact CD2-CG 4.18Å; F583-E585 HydrophobicContact CE1-CB 3.9Å; F583-E585 HydrophobicContact CE2-CB 4.44Å; F583-E585 HydrophobicContact CZ-CB 3.73Å; F583-E585 WeakPolarHBondContact CZ-OE2 3.39Å; E585-L587 PolarHBondContact O-N 3.19Å
586	K	53.6	Low	56.8	Low	81 Å²	81	62.9 Å²	62.9	35%	0.352	34%	0.338	S	S	.	.			trans	-47	99.6	-155.9	-76	-174	178.6	179.9	0	114.1	Y588 D718	K586-Y588 HydrophobicContact CB-CE2 4.17Å; K586-Y588 WeakPolarHBondContact O-CD2 3.44Å; K586-D718 IonicContact NZ-OD1 3.01Å; K586-D718 PolarHBondContact NZ-OD1 2.78Å
587	L	49.1	Very low	54.9	Low	20 Å²	20	66 Å²	66	11%	0.105	36%	0.361	C	S	.	.			trans	-77.3	136.2	173.6	-102.3	167.2	0	0	0	112.3	Q538 E585 F589 P626 L654	Q538-L587 HydrophobicContact CG-CD1 4.4Å; Q538-L587 HydrophobicContact CG-CD2 3.81Å; Q538-L587 HydrophobicContact CG-CG 4.24Å; E585-L587 PolarHBondContact O-N 3.19Å; L587-F589 HydrophobicContact CD1-CD2 4.33Å; L587-F589 HydrophobicContact CD1-CE2 3.71Å; L587-F589 HydrophobicContact CD2-CD2 3.84Å; L587-F589 HydrophobicContact CD2-CE2 3.53Å; L587-F589 HydrophobicContact CD2-CZ 4.12Å; L587-F589 HydrophobicContact CG-CD2 4.45Å; L587-F589 HydrophobicContact CG-CE2 4.15Å; L587-P626 WeakPolarHBondContact CB-O 3.47Å; L587-L654 HydrophobicContact CD1-CD2 4.09Å
588	Y	42.4	Very low	52.5	Low	60 Å²	60	70.2 Å²	70.2	24%	0.235	39%	0.391	C	S	.	.			trans	-125.9	70	173.7	-67.7	-89.3	0	0	0	109.8	K586 A590 W610 L611 L616	K586-Y588 HydrophobicContact CB-CE2 4.17Å; K586-Y588 WeakPolarHBondContact O-CD2 3.44Å; Y588-A590 PolarHBondContact O-N 3.04Å; Y588-W610 HydrophobicContact CD2-CE3 4.29Å; Y588-W610 HydrophobicContact CD2-CZ3 4.2Å; Y588-W610 HydrophobicContact CG-CE3 4.46Å; Y588-L611 HydrophobicContact CE2-CD2 4.12Å; Y588-L616 HydrophobicContact CD1-CD1 4.25Å; Y588-L616 HydrophobicContact CE1-CD1 3.77Å; Y588-L616 HydrophobicContact CE1-CD2 3.67Å; Y588-L616 HydrophobicContact CE1-CG 4.39Å
589	F	42.8	Very low	50	Low	21 Å²	21	72.5 Å²	72.5	9%	0.092	42%	0.417	C	S	.	.			trans	-62	121.7	166.5	-80	-75.3	0	0	0	109.4	E534 I535 L587 N591 P626 L654	E534-F589 HydrophobicContact CB-CD1 4.15Å; E534-F589 HydrophobicContact CB-CE1 3.98Å; E534-F589 HydrophobicContact CG-CD1 4.22Å; I535-F589 HydrophobicContact CD1-CE1 4.15Å; I535-F589 HydrophobicContact CD1-CZ 3.85Å; L587-F589 HydrophobicContact CD1-CD2 4.33Å; L587-F589 HydrophobicContact CD1-CE2 3.71Å; L587-F589 HydrophobicContact CD2-CD2 3.84Å; L587-F589 HydrophobicContact CD2-CE2 3.53Å; L587-F589 HydrophobicContact CD2-CZ 4.12Å; L587-F589 HydrophobicContact CG-CD2 4.45Å; L587-F589 HydrophobicContact CG-CE2 4.15Å; F589-N591 PolarHBondContact O-N 2.92Å; F589-P626 HydrophobicContact CD2-CB 3.65Å; F589-P626 HydrophobicContact CD2-CG 3.63Å; F589-P626 HydrophobicContact CE2-CB 3.66Å; F589-P626 HydrophobicContact CE2-CG 3.97Å; F589-P626 HydrophobicContact CG-CG 4.36Å; F589-L654 HydrophobicContact CE2-CD1 4.1Å; F589-L654 HydrophobicContact CE2-CD2 3.91Å; F589-L654 HydrophobicContact CZ-CD1 3.97Å; F589-L654 HydrophobicContact CZ-CD2 4.18Å
590	A	34.9	Very low	47.2	Very low	61 Å²	61	78.3 Å²	78.3	50%	0.504	45%	0.452	S	S	.	.			trans	-77.4	70	-174.1	0	0	0	0	0	112.3	E534 Y588 D592	E534-A590 PolarHBondContact OE1-N 3.36Å; Y588-A590 PolarHBondContact O-N 3.04Å; A590-D592 PolarHBondContact O-N 3.03Å
591	N	32.8	Very low	44.3	Very low	53 Å²	53	85 Å²	85	28%	0.283	49%	0.488	S	S	.	.			trans	-65.3	122.4	170.2	-74.7	-20.4	0	0	0	110	R525 F589	R525-N591 PolarHBondContact NH2-OD1 2.96Å; F589-N591 PolarHBondContact O-N 2.92Å
592	D	32.3	Very low	41.6	Very low	129 Å²	129	89 Å²	89	69%	0.69	52%	0.518	S	S	*	.			trans	67.6	89.6	-177.3	-56.4	-39.3	0	0	0	118	A590	A590-D592 PolarHBondContact O-N 3.03Å
593	R	29.8	Very low	38.8	Very low	218 Å²	218	94.5 Å²	94.5	82%	0.823	55%	0.545	S	S	*	.			trans	-125.5	47.5	152.4	-81.2	-161.6	178.2	-168	3	112.7
594	C	25.7	Very low	36	Very low	122 Å²	122	102.7 Å²	102.7	82%	0.824	59%	0.586	S	S	*	*	S	Bend	trans	-141	20.5	177.1	-110.1	0	0	0	0	115.7
595	S	24.5	Very low	33.9	Very low	99 Å²	99	105.6 Å²	105.6	69%	0.692	62%	0.616	S	S	*	*	S	Bend	trans	-161.9	42.2	-175.5	54.7	0	0	0	0	117.2
596	S	25.1	Very low	32.1	Very low	123 Å²	123	108 Å²	108	86%	0.86	63%	0.631	S	S	*	*	S	Bend	trans	-160.8	155.9	158.8	30.7	0	0	0	0	114.3
597	S	27.3	Very low	31	Very low	99 Å²	99	107.6 Å²	107.6	69%	0.692	65%	0.65	S	S	*	*			trans	-60.5	143.9	-178	-175.3	0	0	0	0	112.8	C599	S597-C599 PolarHBondContact O-N 2.89Å
598	P	28.1	Very low	30.2	Very low	114 Å²	114	114.7 Å²	114.7	74%	0.74	68%	0.677	S	S	*	*			trans	-67.7	114.5	168.1	28.8	-33.5	0	0	0	110.1
599	C	26.8	Very low	29.7	Very low	120 Å²	120	116.7 Å²	116.7	81%	0.811	70%	0.698	S	S	*	*			trans	-74.3	131.6	167.9	-63.6	0	0	0	0	109.5	S597 D601	S597-C599 PolarHBondContact O-N 2.89Å; C599-D601 PolarHBondContact O-N 2.9Å
600	T	26.9	Very low	29.5	Very low	136 Å²	136	121.2 Å²	121.2	83%	0.834	72%	0.715	S	S	*	*			trans	-87.7	97.2	-176.7	52.8	0	0	0	0	111.7
601	D	28.2	Very low	29.3	Very low	149 Å²	149	122.7 Å²	122.7	80%	0.797	71%	0.714	S	S	*	*			trans	-134.3	150.1	165.1	-88.2	-53.1	0	0	0	110.6	C599 D603	C599-D601 PolarHBondContact O-N 2.9Å; D601-D603 PolarHBondContact O-N 3.19Å
602	S	29.5	Very low	29.2	Very low	110 Å²	110	125.1 Å²	125.1	77%	0.769	73%	0.727	S	S	*	*	S	Bend	trans	-89.6	5.5	-150.4	51.8	0	0	0	0	117.7	M604	S602-M604 PolarHBondContact O-N 2.94Å
603	D	27.7	Very low	29.4	Very low	146 Å²	146	122.2 Å²	122.2	78%	0.781	72%	0.717	S	S	*	*			trans	-83.3	30.5	-166	-70.1	-8.1	0	0	0	115.2	D601 A605	D601-D603 PolarHBondContact O-N 3.19Å; D603-A605 PolarHBondContact O-N 2.75Å
604	M	27.8	Very low	29.5	Very low	182 Å²	182	122.3 Å²	122.3	90%	0.897	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	19.7	-179.1	-94	-80.6	160.6	0	0	115.3	S602	S602-M604 PolarHBondContact O-N 2.94Å
605	A	32.1	Very low	30.1	Very low	93 Å²	93	120.1 Å²	120.1	77%	0.769	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-22.3	-172.9	0	0	0	0	0	114.9	D603	D603-A605 PolarHBondContact O-N 2.75Å
606	N	27.5	Very low	30.5	Very low	132 Å²	132	118.1 Å²	118.1	71%	0.706	68%	0.684	S	S	*	*	S	Bend	trans	-130.2	123.1	-178.7	-80	-38.2	0	0	0	111.2	Y608	N606-Y608 PolarHBondContact O-N 3.44Å
607	G	29.7	Very low	31	Very low	73 Å²	73	116.6 Å²	116.6	75%	0.753	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	21.7	-173.1	0	0	0	0	0	117.4
608	Y	32.8	Very low	31.4	Very low	168 Å²	168	116 Å²	116	66%	0.659	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	23.4	-172.3	-61.9	-77.2	0	0	0	113.4	N606 W610 L611	N606-Y608 PolarHBondContact O-N 3.44Å; Y608-W610 PolarHBondContact O-N 3.19Å; Y608-L611 PolarHBondContact O-N 2.84Å; Y608-L611 VanDerWaalsContact O-N 3.12Å
609	C	31.8	Very low	31.7	Very low	102 Å²	102	117.8 Å²	117.8	69%	0.689	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-65	1.5	-173.7	-160.3	0	0	0	0	115.5
610	W	37.4	Very low	32.4	Very low	117 Å²	117	115 Å²	115	44%	0.443	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-80.1	-15.2	171.5	53.3	-69.5	0	0	0	113.6	Y537 Y588 Y608	Y537-W610 HydrophobicContact CE1-CH2 4.12Å; Y537-W610 HydrophobicContact CE1-CZ3 4.45Å; Y537-W610 HydrophobicContact CE2-CH2 4.49Å; Y588-W610 HydrophobicContact CD2-CE3 4.29Å; Y588-W610 HydrophobicContact CD2-CZ3 4.2Å; Y588-W610 HydrophobicContact CG-CE3 4.46Å; Y608-W610 PolarHBondContact O-N 3.19Å
611	L	30.9	Very low	33	Very low	92 Å²	92	117.6 Å²	117.6	48%	0.482	63%	0.63	S	S	.	*	G	3₁₀ helix	trans	-91.6	11.7	-177.4	-72.4	167.3	0	0	0	115.1	Y588 Y608 S613	Y588-L611 HydrophobicContact CE2-CD2 4.12Å; Y608-L611 PolarHBondContact O-N 2.84Å; Y608-L611 VanDerWaalsContact O-N 3.12Å; L611-S613 PolarHBondContact O-N 3.14Å
612	N	31.1	Very low	33.6	Very low	103 Å²	103	114 Å²	114	55%	0.551	63%	0.629	S	S	*	*			trans	-76.6	88.1	-175.3	-165.9	-11.9	0	0	0	112.6	R614 S615	N612-R614 PolarHBondContact O-N 3.43Å; N612-S615 PolarHBondContact O-N 3.44Å
613	S	36.5	Very low	34.6	Very low	69 Å²	69	110.6 Å²	110.6	48%	0.483	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-53.4	-25.2	-172.8	60.5	0	0	0	0	115.6	L611 S615 L616	L611-S613 PolarHBondContact O-N 3.14Å; S613-S615 VanDerWaalsContact C-N 3.33Å; S613-S615 PolarHBondContact O-N 2.89Å; S613-L616 VanDerWaalsContact O-CB 3.25Å; S613-L616 WeakPolarHBondContact O-CB 3.32Å; S613-L616 PolarHBondContact O-N 3.03Å; S613-L616 VanDerWaalsContact O-N 3.1Å
614	R	32.7	Very low	36.3	Very low	219 Å²	219	105.4 Å²	105.4	83%	0.826	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-69.6	-23.2	-178	-73.1	-174.8	173	-176.3	-1.7	114.7	N612	N612-R614 PolarHBondContact O-N 3.43Å
615	S	36.9	Very low	38.5	Very low	76 Å²	76	99.1 Å²	99.1	53%	0.531	55%	0.55	S	S	.	.	G	3₁₀ helix	trans	-89.1	-6.1	172.2	-171.1	0	0	0	0	113.1	N612 S613	N612-S615 PolarHBondContact O-N 3.44Å; S613-S615 VanDerWaalsContact C-N 3.33Å; S613-S615 PolarHBondContact O-N 2.89Å
616	L	34.1	Very low	40.8	Very low	57 Å²	57	94.8 Å²	94.8	30%	0.298	51%	0.514	S	S	.	.	H	α-helix	trans	-84.5	-37.5	-172.6	-143	73.7	0	0	0	111.7	Y588 S613 S618 R619 I620	Y588-L616 HydrophobicContact CD1-CD1 4.25Å; Y588-L616 HydrophobicContact CE1-CD1 3.77Å; Y588-L616 HydrophobicContact CE1-CD2 3.67Å; Y588-L616 HydrophobicContact CE1-CG 4.39Å; S613-L616 VanDerWaalsContact O-CB 3.25Å; S613-L616 WeakPolarHBondContact O-CB 3.32Å; S613-L616 PolarHBondContact O-N 3.03Å; S613-L616 VanDerWaalsContact O-N 3.1Å; L616-S618 PolarHBondContact O-N 3.35Å; L616-S618 VanDerWaalsContact O-N 3.16Å; L616-R619 PolarHBondContact O-N 3.1Å; L616-R619 VanDerWaalsContact O-N 3.17Å; L616-I620 HydrophobicContact CB-CD1 4.2Å; L616-I620 HydrophobicContact CD2-CD1 3.85Å; L616-I620 HydrophobicContact CG-CD1 3.77Å; L616-I620 HydrophobicContact CG-CG1 4.36Å; L616-I620 WeakPolarHBondContact O-CD1 3.45Å; L616-I620 VanDerWaalsContact O-CG1 3.31Å; L616-I620 WeakPolarHBondContact O-CG1 3.45Å; L616-I620 PolarHBondContact O-N 3.33Å
617	T	35.4	Very low	43.3	Very low	92 Å²	92	89.6 Å²	89.6	56%	0.564	49%	0.485	S	S	*	.	H	α-helix	trans	-62.3	-22.7	-174.9	53.5	0	0	0	0	114.1	Y621	T617-Y621 WeakPolarHBondContact O-CD2 3.47Å; T617-Y621 WeakPolarHBondContact O-CE2 3.47Å
618	S	36.3	Very low	46	Very low	87 Å²	87	86.1 Å²	86.1	61%	0.608	45%	0.449	S	S	*	.	H	α-helix	trans	-85.7	-31.6	175.6	58.3	0	0	0	0	113.8	L616	L616-S618 PolarHBondContact O-N 3.35Å; L616-S618 VanDerWaalsContact O-N 3.16Å
619	R	34.7	Very low	48.8	Very low	151 Å²	151	78.1 Å²	78.1	57%	0.57	42%	0.418	S	S	*	.	H	α-helix	trans	-83.6	-27	-179.5	-66.4	-168.6	-179.5	-159.6	1.5	113.7	L616 Y621 G622 S623	L616-R619 PolarHBondContact O-N 3.1Å; L616-R619 VanDerWaalsContact O-N 3.17Å; R619-Y621 PolarHBondContact O-N 2.99Å; R619-Y621 VanDerWaalsContact O-N 3.16Å; R619-G622 PolarHBondContact O-N 3.32Å; R619-S623 PolarHBondContact O-OG 2.79Å
620	I	41.1	Very low	51.7	Low	61 Å²	61	73.3 Å²	73.3	31%	0.313	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.9	-179.4	-76.8	168.3	0	0	0	114	L616 K698	L616-I620 HydrophobicContact CB-CD1 4.2Å; L616-I620 HydrophobicContact CD2-CD1 3.85Å; L616-I620 HydrophobicContact CG-CD1 3.77Å; L616-I620 HydrophobicContact CG-CG1 4.36Å; L616-I620 WeakPolarHBondContact O-CD1 3.45Å; L616-I620 VanDerWaalsContact O-CG1 3.31Å; L616-I620 WeakPolarHBondContact O-CG1 3.45Å; L616-I620 PolarHBondContact O-N 3.33Å; I620-K698 PolarHBondContact O-NZ 3.06Å
621	Y	39.4	Very low	54.4	Low	190 Å²	190	67.8 Å²	67.8	75%	0.745	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.3	-179.3	-74.9	-84.3	0	0	0	114.7	T617 R619	T617-Y621 WeakPolarHBondContact O-CD2 3.47Å; T617-Y621 WeakPolarHBondContact O-CE2 3.47Å; R619-Y621 PolarHBondContact O-N 2.99Å; R619-Y621 VanDerWaalsContact O-N 3.16Å
622	G	40.2	Very low	57.3	Low	75 Å²	75	63.8 Å²	63.8	77%	0.773	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	-21.7	-172.5	0	0	0	0	0	117.7	R619	R619-G622 PolarHBondContact O-N 3.32Å
623	S	50.7	Low	60.1	Low	37 Å²	37	59.6 Å²	59.6	26%	0.259	32%	0.32	S	S	.	.			trans	-98.2	144.3	-168.6	47.3	0	0	0	0	114.6	R619 N625 Q658	R619-S623 PolarHBondContact O-OG 2.79Å; S623-N625 VanDerWaalsContact C-N 3.27Å; S623-N625 WeakPolarHBondContact CB-OD1 2.97Å; S623-N625 PolarHBondContact O-N 2.95Å; S623-N625 PolarHBondContact OG-ND2 2.91Å; S623-N625 PolarHBondContact OG-OD1 2.83Å; S623-N625 VanDerWaalsContact OG-OD1 3.12Å; S623-Q658 PolarHBondContact O-NE2 3.39Å
624	S	64	Low	62.8	Low	38 Å²	38	57 Å²	57	27%	0.266	30%	0.302	S	S	.	.			trans	-78.5	69.9	174.7	-166.9	0	0	0	0	110	P626 H656 R691 I693	S624-P626 WeakPolarHBondContact O-CD 3.3Å; S624-H656 VanDerWaalsContact C-ND1 3.34Å; S624-H656 PolarHBondContact O-CE1 3.01Å; S624-H656 VanDerWaalsContact O-CE1 3.3Å; S624-H656 PolarHBondContact O-ND1 3.47Å; S624-H656 PolarHBondContact OG-CE1 3Å; S624-H656 PolarHBondContact OG-ND1 2.87Å; S624-R691 PolarHBondContact OG-O 3.39Å; S624-R691 VanDerWaalsContact OG-O 3.13Å; S624-I693 VanDerWaalsContact OG-CG2 3.26Å; S624-I693 WeakPolarHBondContact OG-CG2 3.22Å
625	N	72.7	Confident	65.4	Low	49 Å²	49	49.7 Å²	49.7	26%	0.262	28%	0.281	S	S	.	.			trans	-84	124.3	-174.9	-70.3	-5.3	0	0	0	111.2	S623 H656 I657	S623-N625 VanDerWaalsContact C-N 3.27Å; S623-N625 WeakPolarHBondContact CB-OD1 2.97Å; S623-N625 PolarHBondContact O-N 2.95Å; S623-N625 PolarHBondContact OG-ND2 2.91Å; S623-N625 PolarHBondContact OG-OD1 2.83Å; S623-N625 VanDerWaalsContact OG-OD1 3.12Å; N625-H656 VanDerWaalsContact C-ND1 3.35Å; N625-H656 WeakPolarHBondContact O-CA 3.44Å; N625-H656 WeakPolarHBondContact O-CB 3.34Å; N625-I657 PolarHBondContact O-N 2.88Å
626	P	80.6	Confident	67.7	Low	3 Å²	3	50.1 Å²	50.1	2%	0.019	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	143.4	169.6	-12.7	26.2	0	0	0	110.2	L587 F589 S624 L654 R689	L587-P626 WeakPolarHBondContact CB-O 3.47Å; F589-P626 HydrophobicContact CD2-CB 3.65Å; F589-P626 HydrophobicContact CD2-CG 3.63Å; F589-P626 HydrophobicContact CE2-CB 3.66Å; F589-P626 HydrophobicContact CE2-CG 3.97Å; F589-P626 HydrophobicContact CG-CG 4.36Å; S624-P626 WeakPolarHBondContact O-CD 3.3Å; P626-L654 HydrophobicContact CB-CB 4.45Å; P626-L654 HydrophobicContact CB-CD1 4.18Å; P626-L654 HydrophobicContact CB-CD2 4.02Å; P626-L654 HydrophobicContact CB-CG 4.47Å; P626-L654 HydrophobicContact CG-CD1 4.45Å; P626-R689 HydrophobicContact CG-CB 4.03Å
627	Y	80.4	Confident	70.4	Confident	23 Å²	23	48 Å²	48	9%	0.09	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	-25.2	-163.8	-173.8	-111.2	0	0	0	114.4	F584 V655 I657 A660 Y716	F584-Y627 HydrophobicContact CB-CD1 4.21Å; F584-Y627 HydrophobicContact CB-CE1 3.8Å; F584-Y627 AromaticContact CD1-CD1 3.9Å; F584-Y627 HydrophobicContact CD1-CD1 3.9Å; F584-Y627 HydrophobicContact CD1-CE1 4.29Å; F584-Y627 HydrophobicContact CG-CD1 4.27Å; F584-Y627 HydrophobicContact CG-CE1 4.2Å; Y627-V655 PolarHBondContact N-O 3.29Å; Y627-I657 HydrophobicContact CD1-CG1 4.35Å; Y627-I657 HydrophobicContact CD2-CB 3.97Å; Y627-I657 HydrophobicContact CD2-CD1 3.78Å; Y627-I657 HydrophobicContact CD2-CG1 3.79Å; Y627-I657 HydrophobicContact CE2-CD1 3.85Å; Y627-I657 HydrophobicContact CE2-CG1 4.1Å; Y627-I657 HydrophobicContact CG-CB 3.86Å; Y627-I657 HydrophobicContact CG-CD1 4.44Å; Y627-I657 HydrophobicContact CG-CG1 3.93Å; Y627-A660 HydrophobicContact CD1-CB 3.67Å; Y627-A660 HydrophobicContact CE1-CB 4.12Å; Y627-Y716 VanDerWaalsContact OH-CD2 3.22Å; Y627-Y716 WeakPolarHBondContact OH-CD2 3.24Å; Y627-Y716 VanDerWaalsContact OH-CE2 3.32Å; Y627-Y716 WeakPolarHBondContact OH-CE2 3.38Å
628	G	86.2	Confident	72.9	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-157.2	176.5	0	0	0	0	0	111.4	F583 L654 V655	F583-G628 CarbonylContact O-C 3.57Å; F583-G628 WeakPolarHBondContact O-CA 3.47Å; G628-L654 WeakPolarHBondContact O-CA 3.33Å; G628-V655 PolarHBondContact N-O 3.23Å; G628-V655 PolarHBondContact O-N 3Å
629	F	91.8	Very high	75.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	149.5	-174.9	-57.3	-90.7	0	0	0	113.4	I520 Q538 C582 F583 F631 A652 L653 L654	I520-F629 HydrophobicContact CD1-CE1 3.88Å; I520-F629 HydrophobicContact CD1-CE2 4.38Å; I520-F629 HydrophobicContact CD1-CZ 3.67Å; I520-F629 HydrophobicContact CG1-CE1 4.05Å; I520-F629 HydrophobicContact CG1-CZ 4.35Å; I520-F629 HydrophobicContact CG2-CE1 4.4Å; Q538-F629 HydrophobicContact CB-CE2 3.9Å; Q538-F629 HydrophobicContact CB-CZ 4.33Å; Q538-F629 HydrophobicContact CG-CE2 3.77Å; Q538-F629 HydrophobicContact CG-CZ 4.16Å; C582-F629 CarbonylContact C-O 3.32Å; C582-F629 WeakPolarHBondContact CA-O 3.46Å; F583-F629 PolarHBondContact N-O 2.91Å; F583-F629 PolarHBondContact O-N 3.34Å; F629-F631 HydrophobicContact CB-CE1 4.46Å; F629-A652 HydrophobicContact CB-CB 4.1Å; F629-A652 HydrophobicContact CD1-CB 3.67Å; F629-A652 HydrophobicContact CE1-CB 4.31Å; F629-A652 HydrophobicContact CG-CB 3.99Å; F629-L653 VanDerWaalsContact CA-O 3.22Å; F629-L653 WeakPolarHBondContact CA-O 3.34Å; F629-L654 HydrophobicContact CD1-CD2 4Å; F629-L654 HydrophobicContact CD1-CG 4.35Å; F629-L654 HydrophobicContact CE1-CD2 3.43Å; F629-L654 VanDerWaalsContact CE1-CD2 3.43Å; F629-L654 HydrophobicContact CE1-CG 3.82Å; F629-L654 HydrophobicContact CE2-CD2 4.34Å; F629-L654 HydrophobicContact CZ-CD2 3.63Å; F629-L654 HydrophobicContact CZ-CG 4.44Å
630	V	93.3	Very high	77.9	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	135.5	151.6	-174	0	0	0	0	107.9	L653 V655 A663 P667 L671	V630-L653 PolarHBondContact N-O 2.96Å; V630-L653 VanDerWaalsContact N-O 3.09Å; V630-L653 PolarHBondContact O-N 2.8Å; V630-V655 HydrophobicContact CB-CG2 4.45Å; V630-V655 HydrophobicContact CG2-CG2 3.54Å; V630-A663 HydrophobicContact CG2-CB 3.93Å; V630-P667 HydrophobicContact CG1-CB 3.83Å; V630-L671 HydrophobicContact CB-CD2 4.21Å; V630-L671 HydrophobicContact CG1-CD1 4.22Å; V630-L671 HydrophobicContact CG1-CD2 4.05Å; V630-L671 HydrophobicContact CG1-CG 4.2Å
631	F	93.1	Very high	79.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	145.4	172.7	-58.5	-65.8	0	0	0	111.6	I518 I542 F577 R578 H580 D581 F583 F629 L650 I651 A652	I518-F631 HydrophobicContact CD1-CE1 3.88Å; I518-F631 HydrophobicContact CD1-CZ 4.18Å; I518-F631 HydrophobicContact CG1-CE1 4.45Å; I518-F631 HydrophobicContact CG2-CE1 4.06Å; I542-F631 HydrophobicContact CD1-CE1 4.43Å; I542-F631 HydrophobicContact CD1-CZ 4.14Å; F577-F631 HydrophobicContact CB-CD2 3.86Å; F577-F631 HydrophobicContact CB-CE2 3.71Å; F577-F631 AromaticContact CD1-CE2 3.85Å; F577-F631 HydrophobicContact CD1-CE2 3.85Å; F577-F631 HydrophobicContact CG-CD2 4.39Å; F577-F631 AromaticContact CG-CE2 3.77Å; F577-F631 HydrophobicContact CG-CE2 3.77Å; F577-F631 HydrophobicContact CG-CZ 4.5Å; R578-F631 WeakPolarHBondContact O-CB 3.21Å; H580-F631 WeakPolarHBondContact CA-O 3.35Å; H580-F631 PolarHBondContact N-O 2.85Å; D581-F631 WeakPolarHBondContact O-CD2 3.25Å; D581-F631 PolarHBondContact O-N 3.14Å; F583-F631 HydrophobicContact CB-CE2 3.71Å; F583-F631 HydrophobicContact CB-CZ 3.79Å; F629-F631 HydrophobicContact CB-CE1 4.46Å; F631-L650 HydrophobicContact CB-CB 4.28Å; F631-L650 HydrophobicContact CB-CD1 4.09Å; F631-L650 HydrophobicContact CB-CD2 4.45Å; F631-L650 HydrophobicContact CD1-CB 4.37Å; F631-L650 HydrophobicContact CG-CD1 4.27Å; F631-I651 CarbonylContact C-O 3.56Å; F631-I651 WeakPolarHBondContact CA-O 3.33Å; F631-A652 HydrophobicContact CD1-CB 3.69Å; F631-A652 HydrophobicContact CE1-CB 3.69Å
632	F	92.9	Very high	82	Confident	8 Å²	8	33.9 Å²	33.9	4%	0.035	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	154.9	169.5	76.5	-73.3	0	0	0	112	I651 L653 L671 T683 T684 L685	F632-I651 HydrophobicContact CD1-CB 3.98Å; F632-I651 HydrophobicContact CD1-CG2 4.33Å; F632-I651 HydrophobicContact CE1-CB 3.47Å; F632-I651 VanDerWaalsContact CE1-CB 3.47Å; F632-I651 HydrophobicContact CE1-CG1 4.31Å; F632-I651 HydrophobicContact CE1-CG2 3.46Å; F632-I651 VanDerWaalsContact CE1-CG2 3.46Å; F632-I651 HydrophobicContact CE2-CB 4.48Å; F632-I651 HydrophobicContact CZ-CB 3.76Å; F632-I651 HydrophobicContact CZ-CG1 4.09Å; F632-I651 HydrophobicContact CZ-CG2 3.82Å; F632-I651 PolarHBondContact N-O 3.04Å; F632-I651 PolarHBondContact O-N 2.7Å; F632-L653 HydrophobicContact CD1-CD1 3.93Å; F632-L653 HydrophobicContact CD1-CG 4.36Å; F632-L653 HydrophobicContact CE1-CD1 3.37Å; F632-L653 HydrophobicContact CE1-CG 3.73Å; F632-L653 HydrophobicContact CZ-CD1 4.18Å; F632-L671 HydrophobicContact CB-CD1 4Å; F632-L671 HydrophobicContact CD1-CD2 4.06Å; F632-L671 HydrophobicContact CG-CD1 4.43Å; F632-L671 HydrophobicContact CG-CD2 4.42Å; F632-T683 HydrophobicContact CD1-CG2 4.32Å; F632-T683 HydrophobicContact CD2-CG2 3.75Å; F632-T683 HydrophobicContact CE1-CG2 3.93Å; F632-T683 HydrophobicContact CE2-CG2 3.36Å; F632-T683 HydrophobicContact CG-CG2 4.24Å; F632-T683 HydrophobicContact CZ-CG2 3.45Å; F632-T683 VanDerWaalsContact CZ-CG2 3.45Å; F632-T684 WeakPolarHBondContact CZ-O 3.31Å; F632-L685 HydrophobicContact CZ-CD2 4.12Å
633	H	90.3	Very high	84.2	Confident	15 Å²	15	33.5 Å²	33.5	7%	0.069	20%	0.195	C	C	.	.			trans	-77.7	139.4	171.3	-69.9	68.8	0	0	0	110.9	E516 S579 L650	E516-H633 IonicContact OE1-NE2 2.71Å; E516-H633 IonicContact OE2-CE1 3.93Å; E516-H633 IonicContact OE2-NE2 2.61Å; E516-H633 PolarHBondContact OE2-NE2 3.29Å; S579-H633 VanDerWaalsContact CB-ND1 3.28Å; S579-H633 WeakPolarHBondContact CB-ND1 3.23Å; S579-H633 PolarHBondContact OG-N 3.03Å; S579-H633 PolarHBondContact OG-ND1 2.9Å; S579-H633 VanDerWaalsContact OG-ND1 3.11Å; H633-L650 VanDerWaalsContact CE1-CD2 3.44Å; H633-L650 WeakPolarHBondContact CE1-CD2 3.45Å
634	P	91.2	Very high	86.1	Confident	16 Å²	16	33.6 Å²	33.6	10%	0.104	19%	0.193	C	C	.	.			trans	-63.1	143	169.8	31.1	-35.7	0	0	0	110.5	L639 F649 I651	P634-L639 HydrophobicContact CB-CD1 4.21Å; P634-L639 HydrophobicContact CB-CD2 3.95Å; P634-L639 HydrophobicContact CB-CG 4.48Å; P634-L639 HydrophobicContact CG-CD1 4.26Å; P634-F649 HydrophobicContact CG-CD2 4.5Å; P634-F649 HydrophobicContact CG-CE2 3.73Å; P634-F649 HydrophobicContact CG-CZ 4.04Å; P634-I651 HydrophobicContact CB-CG1 4.42Å
635	T	88	Confident	87.2	Confident	64 Å²	64	32.5 Å²	32.5	39%	0.393	18%	0.184	S	C	.	.			trans	-130.8	-85.3	-175.9	49.8	0	0	0	0	110.7	Q637 P682 P802	T635-Q637 PolarHBondContact OG1-OE1 2.96Å; T635-P682 WeakPolarHBondContact OG1-CD 3.49Å; T635-P802 HydrophobicContact CG2-CB 3.84Å
636	H	86.3	Confident	87.2	Confident	86 Å²	86	34.9 Å²	34.9	40%	0.398	20%	0.197	S	C	.	.	S	Bend	trans	-95.4	2.2	-177.2	-62.7	-69.5	0	0	0	113.6	Y681 P802 I860	H636-Y681 HydrophobicContact CB-CD1 4.38Å; H636-Y681 AromaticContact CD2-CE1 3.88Å; H636-P802 PolarHBondContact NE2-O 3.24Å; H636-I860 HydrophobicContact CB-CD1 4.13Å; H636-I860 WeakPolarHBondContact ND1-CD1 3.1Å
637	Q	89.3	Confident	86.8	Confident	13 Å²	13	36.2 Å²	36.2	6%	0.061	21%	0.206	C	C	.	.	S	Bend	trans	-80	139.4	-174.2	-64.2	93.9	-13.1	0	0	113.7	T635 L639 Y680 T683 L685	T635-Q637 PolarHBondContact OG1-OE1 2.96Å; Q637-L639 PolarHBondContact O-N 2.76Å; Q637-L639 VanDerWaalsContact O-N 3.09Å; Q637-Y680 HydrophobicContact CB-CE1 3.63Å; Q637-Y680 HydrophobicContact CG-CD1 3.81Å; Q637-Y680 HydrophobicContact CG-CE1 3.38Å; Q637-T683 WeakPolarHBondContact CG-O 3.46Å; Q637-T683 PolarHBondContact NE2-O 2.94Å; Q637-L685 HydrophobicContact CB-CD1 3.87Å; Q637-L685 HydrophobicContact CB-CD2 3.75Å; Q637-L685 HydrophobicContact CB-CG 3.71Å; Q637-L685 HydrophobicContact CG-CD2 3.89Å; Q637-L685 HydrophobicContact CG-CG 3.94Å
638	C	88.5	Confident	86.6	Confident	33 Å²	33	35.7 Å²	35.7	22%	0.223	21%	0.205	C	C	.	.			trans	-56.9	110.2	166.4	176.2	0	0	0	0	110.8	C496 C497 Y680 L685	C496-C638 HydrophobicContact CB-CB 4.27Å; C496-C638 WeakPolarHBondContact CB-SG 3.48Å; C496-C638 WeakPolarHBondContact SG-CB 3.5Å; C496-C638 CovalentContact SG-SG 2.06Å; C496-C638 PolarHBondContact SG-SG 2.96Å; C497-C638 VanDerWaalsContact SG-CB 3.55Å; C638-Y680 VanDerWaalsContact CB-OH 3.22Å; C638-Y680 WeakPolarHBondContact CB-OH 3.34Å; C638-Y680 PolarHBondContact N-OH 2.95Å; C638-L685 WeakPolarHBondContact O-CD1 3.38Å
639	L	89.8	Confident	86.7	Confident	33 Å²	33	36 Å²	36	17%	0.173	21%	0.207	C	C	.	.			trans	-92.2	4.5	170.9	-63	177.6	0	0	0	113.1	P634 Q637 G641 L642 L644 F649 L685	P634-L639 HydrophobicContact CB-CD1 4.21Å; P634-L639 HydrophobicContact CB-CD2 3.95Å; P634-L639 HydrophobicContact CB-CG 4.48Å; P634-L639 HydrophobicContact CG-CD1 4.26Å; Q637-L639 PolarHBondContact O-N 2.76Å; Q637-L639 VanDerWaalsContact O-N 3.09Å; L639-G641 PolarHBondContact O-N 2.82Å; L639-L642 HydrophobicContact CB-CD1 4.37Å; L639-L642 HydrophobicContact CD2-CD1 3.94Å; L639-L642 WeakPolarHBondContact O-CB 3.34Å; L639-L642 WeakPolarHBondContact O-CG 3.39Å; L639-L642 PolarHBondContact O-N 2.77Å; L639-L644 HydrophobicContact CB-CD1 3.99Å; L639-L644 HydrophobicContact CD1-CD1 4.3Å; L639-L644 HydrophobicContact CD2-CD1 4.12Å; L639-L644 HydrophobicContact CG-CD1 4.37Å; L639-F649 HydrophobicContact CD1-CZ 4.33Å; L639-L685 HydrophobicContact CD2-CD1 3.92Å; L639-L685 HydrophobicContact CD2-CD2 4.41Å
640	L	85.3	Confident	86.7	Confident	139 Å²	139	36 Å²	36	73%	0.728	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	119.9	-164.7	-158.9	153.3	0	0	0	111.5
641	G	79.9	Confident	86.9	Confident	57 Å²	57	36 Å²	36	59%	0.588	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.7	6.1	-177.4	0	0	0	0	0	115.2	T492 L639	T492-G641 WeakPolarHBondContact CG2-O 3.32Å; L639-G641 PolarHBondContact O-N 2.82Å
642	L	87.8	Confident	87	Confident	21 Å²	21	36 Å²	36	11%	0.11	21%	0.206	C	C	.	.			trans	-86.9	144.9	175.7	-60.1	179.2	0	0	0	112.2	T492 L494 L521 L639 L644 L685	T492-L642 HydrophobicContact CG2-CD2 4.22Å; L494-L642 HydrophobicContact CD2-CD2 3.5Å; L521-L642 HydrophobicContact CD1-CD1 3.91Å; L521-L642 HydrophobicContact CD1-CD2 4.05Å; L521-L642 HydrophobicContact CD2-CD2 3.81Å; L639-L642 HydrophobicContact CB-CD1 4.37Å; L639-L642 HydrophobicContact CD2-CD1 3.94Å; L639-L642 WeakPolarHBondContact O-CB 3.34Å; L639-L642 WeakPolarHBondContact O-CG 3.39Å; L639-L642 PolarHBondContact O-N 2.77Å; L642-L644 HydrophobicContact CB-CD1 3.83Å; L642-L644 HydrophobicContact CB-CD2 4.02Å; L642-L644 HydrophobicContact CB-CG 3.64Å; L642-L644 HydrophobicContact CD1-CD1 4.18Å; L642-L644 HydrophobicContact CD1-CD2 4.16Å; L642-L644 HydrophobicContact CD1-CG 4.42Å; L642-L644 PolarHBondContact O-N 2.76Å; L642-L685 HydrophobicContact CD1-CD1 4.03Å
643	H	86.6	Confident	87.1	Confident	68 Å²	68	35.7 Å²	35.7	32%	0.315	21%	0.205	S	C	.	.			trans	-92.8	79.5	173.4	-83.7	-80.4	0	0	0	111.4	S474 H490 S506	S474-H643 VanDerWaalsContact CB-NE2 3.25Å; S474-H643 WeakPolarHBondContact CB-NE2 3.43Å; S474-H643 PolarHBondContact OG-NE2 2.88Å; H490-H643 HydrophobicContact CB-CB 4.24Å; H490-H643 AromaticContact CD2-CD2 3.93Å; H490-H643 AromaticContact CD2-CG 3.89Å; H490-H643 AromaticContact CE1-CG 3.84Å; H490-H643 AromaticContact CG-CD2 3.82Å; H490-H643 AromaticContact CG-CG 3.73Å; H490-H643 WeakPolarHBondContact ND1-CB 3.39Å; H490-H643 AromaticContact ND1-CG 3.72Å; H490-H643 AromaticContact NE2-CG 3.98Å; S506-H643 PolarHBondContact OG-O 3.4Å
644	L	89.6	Confident	87.3	Confident	39 Å²	39	35 Å²	35	20%	0.204	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-91.8	157.3	-172.2	-62.5	166.3	0	0	0	112.4	V519 L639 L642 F649	V519-L644 HydrophobicContact CG1-CD2 3.94Å; V519-L644 HydrophobicContact CG2-CD2 4.01Å; L639-L644 HydrophobicContact CB-CD1 3.99Å; L639-L644 HydrophobicContact CD1-CD1 4.3Å; L639-L644 HydrophobicContact CD2-CD1 4.12Å; L639-L644 HydrophobicContact CG-CD1 4.37Å; L642-L644 HydrophobicContact CB-CD1 3.83Å; L642-L644 HydrophobicContact CB-CD2 4.02Å; L642-L644 HydrophobicContact CB-CG 3.64Å; L642-L644 HydrophobicContact CD1-CD1 4.18Å; L642-L644 HydrophobicContact CD1-CD2 4.16Å; L642-L644 HydrophobicContact CD1-CG 4.42Å; L642-L644 PolarHBondContact O-N 2.76Å; L644-F649 HydrophobicContact CB-CE1 4.16Å; L644-F649 HydrophobicContact CB-CZ 4.24Å; L644-F649 HydrophobicContact CD1-CE1 4.38Å; L644-F649 HydrophobicContact CD1-CZ 3.79Å; L644-F649 HydrophobicContact CD2-CE2 3.95Å; L644-F649 HydrophobicContact CD2-CZ 3.94Å; L644-F649 HydrophobicContact CG-CZ 4.2Å
645	P	86.9	Confident	87.2	Confident	14 Å²	14	34.3 Å²	34.3	9%	0.091	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-74.8	167	166.9	34.5	-34.2	0	0	0	110.8	E517 V519 F649	E517-P645 HydrophobicContact CB-CB 3.88Å; E517-P645 HydrophobicContact CB-CG 3.7Å; E517-P645 HydrophobicContact CG-CB 4.02Å; E517-P645 HydrophobicContact CG-CG 4.39Å; V519-P645 VanDerWaalsContact CG2-CD 3.5Å; V519-P645 HydrophobicContact CG2-CG 3.97Å; P645-F649 HydrophobicContact CG-CB 3.78Å; P645-F649 HydrophobicContact CG-CD1 3.85Å; P645-F649 HydrophobicContact CG-CG 3.9Å
646	N	73.7	Confident	87.2	Confident	100 Å²	100	31.3 Å²	31.3	54%	0.535	18%	0.179	S	C	.	.	S	Bend	trans	-63.4	135.8	171.2	-66.1	17	0	0	0	109.5
647	P	72.4	Confident	87	Confident	31 Å²	31	29.9 Å²	29.9	20%	0.201	17%	0.173	C	C	.	.	S	Bend	trans	-71.7	165.9	-173.4	29	-36.1	0	0	0	114.4	F649 A969 S970	P647-F649 HydrophobicContact CB-CD1 4.27Å; P647-F649 HydrophobicContact CB-CE1 4.32Å; P647-A969 VanDerWaalsContact CB-O 3.23Å; P647-A969 WeakPolarHBondContact CB-O 3.33Å; P647-S970 WeakPolarHBondContact CG-O 3.46Å
648	P	75.1	Confident	86.6	Confident	11 Å²	11	29.8 Å²	29.8	7%	0.071	17%	0.173	C	C	.	.	S	Bend	cis	-64.9	170.6	-9.5	22.4	-29.2	0	0	0	114	Y511 E516	Y511-P648 WeakPolarHBondContact OH-CD 3.44Å; Y511-P648 VanDerWaalsContact OH-CG 3.27Å; Y511-P648 WeakPolarHBondContact OH-CG 3.39Å; Y511-P648 PolarHBondContact OH-O 3.01Å; E516-P648 HydrophobicContact CG-CG 4.43Å
649	F	88.6	Confident	86.5	Confident	8 Å²	8	28.2 Å²	28.2	4%	0.035	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	153.1	171.3	55.3	-99.7	0	0	0	110.7	E517 V519 P634 L639 L644 P645 P647 I651	E517-F649 HydrophobicContact CB-CB 4.38Å; E517-F649 CarbonylContact O-C 3.54Å; E517-F649 VanDerWaalsContact O-CA 3.31Å; E517-F649 WeakPolarHBondContact O-CA 3.49Å; E517-F649 VanDerWaalsContact O-CB 3.27Å; E517-F649 WeakPolarHBondContact O-CB 3.34Å; V519-F649 HydrophobicContact CG2-CB 4.49Å; V519-F649 HydrophobicContact CG2-CD2 3.82Å; V519-F649 HydrophobicContact CG2-CE2 4.39Å; V519-F649 HydrophobicContact CG2-CG 4.23Å; P634-F649 HydrophobicContact CG-CD2 4.5Å; P634-F649 HydrophobicContact CG-CE2 3.73Å; P634-F649 HydrophobicContact CG-CZ 4.04Å; L639-F649 HydrophobicContact CD1-CZ 4.33Å; L644-F649 HydrophobicContact CB-CE1 4.16Å; L644-F649 HydrophobicContact CB-CZ 4.24Å; L644-F649 HydrophobicContact CD1-CE1 4.38Å; L644-F649 HydrophobicContact CD1-CZ 3.79Å; L644-F649 HydrophobicContact CD2-CE2 3.95Å; L644-F649 HydrophobicContact CD2-CZ 3.94Å; L644-F649 HydrophobicContact CG-CZ 4.2Å; P645-F649 HydrophobicContact CG-CB 3.78Å; P645-F649 HydrophobicContact CG-CD1 3.85Å; P645-F649 HydrophobicContact CG-CG 3.9Å; P647-F649 HydrophobicContact CB-CD1 4.27Å; P647-F649 HydrophobicContact CB-CE1 4.32Å; F649-I651 HydrophobicContact CD2-CD1 4.12Å; F649-I651 HydrophobicContact CE2-CD1 3.8Å
650	L	92.8	Very high	86.2	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	130.7	177	-62.7	173.1	0	0	0	110.6	E516 E517 I518 V519 F631 H633	E516-L650 HydrophobicContact CB-CG 4.34Å; E517-L650 PolarHBondContact O-N 3.39Å; I518-L650 WeakPolarHBondContact CA-O 3.46Å; I518-L650 HydrophobicContact CG1-CB 4.42Å; V519-L650 PolarHBondContact N-O 3.14Å; F631-L650 HydrophobicContact CB-CB 4.28Å; F631-L650 HydrophobicContact CB-CD1 4.09Å; F631-L650 HydrophobicContact CB-CD2 4.45Å; F631-L650 HydrophobicContact CD1-CB 4.37Å; F631-L650 HydrophobicContact CG-CD1 4.27Å; H633-L650 VanDerWaalsContact CE1-CD2 3.44Å; H633-L650 WeakPolarHBondContact CE1-CD2 3.45Å
651	I	95.9	Very high	86	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	134.2	162.1	-52.3	-62.3	0	0	0	108.1	V519 F631 F632 P634 F649 L685	V519-I651 HydrophobicContact CB-CD1 3.99Å; V519-I651 HydrophobicContact CG1-CD1 4.12Å; V519-I651 WeakPolarHBondContact O-CA 3.23Å; F631-I651 CarbonylContact C-O 3.56Å; F631-I651 WeakPolarHBondContact CA-O 3.33Å; F632-I651 HydrophobicContact CD1-CB 3.98Å; F632-I651 HydrophobicContact CD1-CG2 4.33Å; F632-I651 HydrophobicContact CE1-CB 3.47Å; F632-I651 VanDerWaalsContact CE1-CB 3.47Å; F632-I651 HydrophobicContact CE1-CG1 4.31Å; F632-I651 HydrophobicContact CE1-CG2 3.46Å; F632-I651 VanDerWaalsContact CE1-CG2 3.46Å; F632-I651 HydrophobicContact CE2-CB 4.48Å; F632-I651 HydrophobicContact CZ-CB 3.76Å; F632-I651 HydrophobicContact CZ-CG1 4.09Å; F632-I651 HydrophobicContact CZ-CG2 3.82Å; F632-I651 PolarHBondContact N-O 3.04Å; F632-I651 PolarHBondContact O-N 2.7Å; P634-I651 HydrophobicContact CB-CG1 4.42Å; F649-I651 HydrophobicContact CD2-CD1 4.12Å; F649-I651 HydrophobicContact CE2-CD1 3.8Å; I651-L685 HydrophobicContact CD1-CD2 4.2Å; I651-L685 HydrophobicContact CG1-CD2 3.92Å; I651-L685 HydrophobicContact CG2-CD2 4.48Å
652	A	95.8	Very high	86.3	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.5	176.3	0	0	0	0	0	111.3	I518 V519 I520 F629 F631 S687	I518-A652 HydrophobicContact CG2-CB 3.92Å; V519-A652 PolarHBondContact O-N 3.17Å; I520-A652 HydrophobicContact CG1-CB 3.86Å; F629-A652 HydrophobicContact CB-CB 4.1Å; F629-A652 HydrophobicContact CD1-CB 3.67Å; F629-A652 HydrophobicContact CE1-CB 4.31Å; F629-A652 HydrophobicContact CG-CB 3.99Å; F631-A652 HydrophobicContact CD1-CB 3.69Å; F631-A652 HydrophobicContact CE1-CB 3.69Å; A652-S687 PolarHBondContact O-OG 2.94Å
653	L	95.6	Very high	86.3	Confident	2 Å²	2	17 Å²	17	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	127.9	-179.2	-75.9	170.4	0	0	0	113.1	F629 V630 F632 V655 L671 L674 T683 T684 S687	F629-L653 VanDerWaalsContact CA-O 3.22Å; F629-L653 WeakPolarHBondContact CA-O 3.34Å; V630-L653 PolarHBondContact N-O 2.96Å; V630-L653 VanDerWaalsContact N-O 3.09Å; V630-L653 PolarHBondContact O-N 2.8Å; F632-L653 HydrophobicContact CD1-CD1 3.93Å; F632-L653 HydrophobicContact CD1-CG 4.36Å; F632-L653 HydrophobicContact CE1-CD1 3.37Å; F632-L653 HydrophobicContact CE1-CG 3.73Å; F632-L653 HydrophobicContact CZ-CD1 4.18Å; L653-V655 PolarHBondContact O-N 3.27Å; L653-L671 HydrophobicContact CD1-CD2 3.67Å; L653-L674 HydrophobicContact CB-CD1 4.26Å; L653-L674 HydrophobicContact CD1-CD1 3.99Å; L653-T683 HydrophobicContact CD1-CG2 4.34Å; L653-T683 WeakPolarHBondContact CD1-OG1 3.27Å; L653-T684 HydrophobicContact CD1-CG2 4.21Å; L653-T684 WeakPolarHBondContact CD1-O 3.42Å; L653-T684 HydrophobicContact CD2-CG2 3.7Å; L653-S687 WeakPolarHBondContact CA-OG 3.35Å
654	L	93.4	Very high	86.2	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.005	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	127.2	178.1	-77.9	178.3	0	0	0	113.1	L522 L587 F589 P626 G628 F629 S687 R689 R691	L522-L654 HydrophobicContact CD1-CD1 3.72Å; L587-L654 HydrophobicContact CD1-CD2 4.09Å; F589-L654 HydrophobicContact CE2-CD1 4.1Å; F589-L654 HydrophobicContact CE2-CD2 3.91Å; F589-L654 HydrophobicContact CZ-CD1 3.97Å; F589-L654 HydrophobicContact CZ-CD2 4.18Å; P626-L654 HydrophobicContact CB-CB 4.45Å; P626-L654 HydrophobicContact CB-CD1 4.18Å; P626-L654 HydrophobicContact CB-CD2 4.02Å; P626-L654 HydrophobicContact CB-CG 4.47Å; P626-L654 HydrophobicContact CG-CD1 4.45Å; G628-L654 WeakPolarHBondContact O-CA 3.33Å; F629-L654 HydrophobicContact CD1-CD2 4Å; F629-L654 HydrophobicContact CD1-CG 4.35Å; F629-L654 HydrophobicContact CE1-CD2 3.43Å; F629-L654 VanDerWaalsContact CE1-CD2 3.43Å; F629-L654 HydrophobicContact CE1-CG 3.82Å; F629-L654 HydrophobicContact CE2-CD2 4.34Å; F629-L654 HydrophobicContact CZ-CD2 3.63Å; F629-L654 HydrophobicContact CZ-CG 4.44Å; L654-S687 PolarHBondContact N-OG 3.24Å; L654-R689 HydrophobicContact CD1-CB 4Å; L654-R691 PolarHBondContact O-NH2 2.97Å
655	V	90.3	Very high	85.9	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.006	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.2	175.5	-175.4	0	0	0	0	108.9	F584 Y627 G628 V630 L653 E659 A660 A663	F584-V655 HydrophobicContact CE1-CB 4.1Å; F584-V655 HydrophobicContact CE1-CG1 4.1Å; F584-V655 HydrophobicContact CE1-CG2 4.32Å; Y627-V655 PolarHBondContact N-O 3.29Å; G628-V655 PolarHBondContact N-O 3.23Å; G628-V655 PolarHBondContact O-N 3Å; V630-V655 HydrophobicContact CB-CG2 4.45Å; V630-V655 HydrophobicContact CG2-CG2 3.54Å; L653-V655 PolarHBondContact O-N 3.27Å; V655-E659 HydrophobicContact CG1-CB 3.65Å; V655-A660 HydrophobicContact CG1-CB 4.49Å; V655-A663 HydrophobicContact CG1-CB 3.93Å; V655-A663 HydrophobicContact CG2-CB 4.4Å
656	H	87.2	Confident	86.1	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	158.8	174.7	-61.7	-89.7	0	0	0	112.5	S624 N625 Q658 E659 A660 R691 I693	S624-H656 VanDerWaalsContact C-ND1 3.34Å; S624-H656 PolarHBondContact O-CE1 3.01Å; S624-H656 VanDerWaalsContact O-CE1 3.3Å; S624-H656 PolarHBondContact O-ND1 3.47Å; S624-H656 PolarHBondContact OG-CE1 3Å; S624-H656 PolarHBondContact OG-ND1 2.87Å; N625-H656 VanDerWaalsContact C-ND1 3.35Å; N625-H656 WeakPolarHBondContact O-CA 3.44Å; N625-H656 WeakPolarHBondContact O-CB 3.34Å; H656-Q658 PolarHBondContact O-N 2.98Å; H656-Q658 VanDerWaalsContact O-N 3.14Å; H656-E659 HydrophobicContact CB-CG 4.36Å; H656-E659 IonicContact CD2-OE2 3.38Å; H656-E659 PolarHBondContact CD2-OE2 3.22Å; H656-E659 IonicContact CG-OE2 2.9Å; H656-E659 PolarHBondContact N-OE2 3.48Å; H656-E659 WeakPolarHBondContact O-CA 3.46Å; H656-E659 WeakPolarHBondContact O-CB 3.43Å; H656-E659 PolarHBondContact O-N 3.4Å; H656-A660 PolarHBondContact O-N 3.13Å; H656-A660 VanDerWaalsContact O-N 3.07Å; H656-R691 PolarHBondContact CD2-NH1 2.86Å; H656-R691 PolarHBondContact CD2-NH2 3.19Å; H656-R691 VanDerWaalsContact NE2-CG 3.27Å; H656-R691 WeakPolarHBondContact NE2-CG 3.46Å; H656-I693 HydrophobicContact CB-CG2 3.74Å
657	I	82.3	Confident	86.9	Confident	56 Å²	56	13.6 Å²	13.6	29%	0.287	7%	0.065	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.6	-175.4	-168.2	168.7	0	0	0	113.5	N625 Y627 E659	N625-I657 PolarHBondContact O-N 2.88Å; Y627-I657 HydrophobicContact CD1-CG1 4.35Å; Y627-I657 HydrophobicContact CD2-CB 3.97Å; Y627-I657 HydrophobicContact CD2-CD1 3.78Å; Y627-I657 HydrophobicContact CD2-CG1 3.79Å; Y627-I657 HydrophobicContact CE2-CD1 3.85Å; Y627-I657 HydrophobicContact CE2-CG1 4.1Å; Y627-I657 HydrophobicContact CG-CB 3.86Å; Y627-I657 HydrophobicContact CG-CD1 4.44Å; Y627-I657 HydrophobicContact CG-CG1 3.93Å; I657-E659 VanDerWaalsContact C-N 3.32Å
658	Q	81.5	Confident	88	Confident	11 Å²	11	12.1 Å²	12.1	5%	0.051	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-21.2	174.3	-62.9	84.4	-13.6	0	0	113.6	S623 H656 I693 C697	S623-Q658 PolarHBondContact O-NE2 3.39Å; H656-Q658 PolarHBondContact O-N 2.98Å; H656-Q658 VanDerWaalsContact O-N 3.14Å; Q658-I693 HydrophobicContact CB-CD1 3.87Å; Q658-I693 HydrophobicContact CB-CG2 4.37Å; Q658-I693 HydrophobicContact CG-CD1 3.84Å; Q658-C697 WeakPolarHBondContact O-CB 3.06Å; Q658-C697 PolarHBondContact O-N 3.45Å; Q658-C697 PolarHBondContact O-SG 3.39Å
659	E	86.9	Confident	88.9	Confident	0 Å²	0	11.6 Å²	11.6	0%	0	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-21.1	-178.5	-58.5	171.1	153.3	0	0	112	V655 H656 I657 P661 W662 A663 I670 R691 I693 L694	V655-E659 HydrophobicContact CG1-CB 3.65Å; H656-E659 HydrophobicContact CB-CG 4.36Å; H656-E659 IonicContact CD2-OE2 3.38Å; H656-E659 PolarHBondContact CD2-OE2 3.22Å; H656-E659 IonicContact CG-OE2 2.9Å; H656-E659 PolarHBondContact N-OE2 3.48Å; H656-E659 WeakPolarHBondContact O-CA 3.46Å; H656-E659 WeakPolarHBondContact O-CB 3.43Å; H656-E659 PolarHBondContact O-N 3.4Å; I657-E659 VanDerWaalsContact C-N 3.32Å; E659-P661 VanDerWaalsContact C-CD 3.48Å; E659-W662 WeakPolarHBondContact O-CA 3.28Å; E659-W662 WeakPolarHBondContact O-CB 3.32Å; E659-W662 PolarHBondContact O-N 3.11Å; E659-A663 PolarHBondContact O-N 2.83Å; E659-I670 HydrophobicContact CB-CD1 4.26Å; E659-R691 IonicContact OE1-CZ 3.51Å; E659-R691 IonicContact OE1-NH1 3.74Å; E659-R691 PolarHBondContact OE1-NH1 3.11Å; E659-R691 IonicContact OE1-NH2 3.56Å; E659-R691 IonicContact OE2-CZ 2.8Å; E659-R691 IonicContact OE2-NH1 2.65Å; E659-R691 PolarHBondContact OE2-NH1 3.3Å; E659-R691 IonicContact OE2-NH2 2.68Å; E659-R691 PolarHBondContact OE2-NH2 3.43Å; E659-I693 HydrophobicContact CG-CB 4.36Å; E659-I693 WeakPolarHBondContact OE1-CA 3.13Å; E659-L694 WeakPolarHBondContact OE1-CB 3.34Å; E659-L694 PolarHBondContact OE1-N 2.82Å
660	A	83	Confident	89.2	Confident	7 Å²	7	11.2 Å²	11.2	6%	0.058	5%	0.05	C	C	.	.	H	α-helix	trans	-54.7	-38.8	-174.6	0	0	0	0	0	115	F584 Y627 V655 H656 W662 A663 Y664	F584-A660 HydrophobicContact CD1-CB 4.11Å; F584-A660 HydrophobicContact CE1-CB 3.93Å; F584-A660 HydrophobicContact CE2-CB 4.43Å; F584-A660 HydrophobicContact CG-CB 4.49Å; F584-A660 HydrophobicContact CZ-CB 4.12Å; Y627-A660 HydrophobicContact CD1-CB 3.67Å; Y627-A660 HydrophobicContact CE1-CB 4.12Å; V655-A660 HydrophobicContact CG1-CB 4.49Å; H656-A660 PolarHBondContact O-N 3.13Å; H656-A660 VanDerWaalsContact O-N 3.07Å; A660-W662 VanDerWaalsContact C-N 3.34Å; A660-W662 PolarHBondContact O-N 2.78Å; A660-A663 PolarHBondContact O-N 2.77Å; A660-Y664 WeakPolarHBondContact O-CB 3.48Å; A660-Y664 PolarHBondContact O-N 3.11Å
661	P	80.5	Confident	89.4	Confident	1 Å²	1	11.3 Å²	11.3	1%	0.006	5%	0.05	C	C	.	.	H	α-helix	trans	-63.1	-39.4	173	-22.5	35	0	0	0	112.6	E659 Y664 H665 C697 I711 F714	E659-P661 VanDerWaalsContact C-CD 3.48Å; P661-Y664 PolarHBondContact O-N 3.01Å; P661-H665 PolarHBondContact O-CD2 2.98Å; P661-H665 PolarHBondContact O-N 3.42Å; P661-C697 HydrophobicContact CG-CB 4.18Å; P661-I711 HydrophobicContact CB-CG2 4.46Å; P661-F714 HydrophobicContact CB-CD2 4.34Å; P661-F714 HydrophobicContact CG-CB 4.5Å; P661-F714 HydrophobicContact CG-CD2 4.4Å
662	W	86.6	Confident	89.4	Confident	6 Å²	6	11.3 Å²	11.3	2%	0.023	5%	0.05	C	C	.	.	H	α-helix	trans	-67.2	-44.7	177	-69.1	104.8	0	0	0	111.7	E659 A660 Y664 H665 L666 R669 I670 F695 L705 I711 F853	E659-W662 WeakPolarHBondContact O-CA 3.28Å; E659-W662 WeakPolarHBondContact O-CB 3.32Å; E659-W662 PolarHBondContact O-N 3.11Å; A660-W662 VanDerWaalsContact C-N 3.34Å; A660-W662 PolarHBondContact O-N 2.78Å; W662-Y664 VanDerWaalsContact C-N 3.33Å; W662-Y664 PolarHBondContact O-N 3.36Å; W662-H665 PolarHBondContact O-N 3.37Å; W662-L666 CarbonylContact O-C 2.96Å; W662-L666 WeakPolarHBondContact O-CA 3.27Å; W662-L666 PolarHBondContact O-N 2.84Å; W662-R669 VanDerWaalsContact CZ3-NH1 3.3Å; W662-I670 HydrophobicContact CB-CD1 3.93Å; W662-I670 HydrophobicContact CB-CG1 4.47Å; W662-F695 VanDerWaalsContact CD1-CB 3.43Å; W662-F695 HydrophobicContact CD2-CD1 4.44Å; W662-F695 HydrophobicContact CG-CB 4.04Å; W662-F695 HydrophobicContact CG-CG 4.2Å; W662-L705 HydrophobicContact CZ3-CD1 4.21Å; W662-I711 HydrophobicContact CE3-CD1 4.09Å; W662-I711 HydrophobicContact CH2-CD1 4.17Å; W662-I711 HydrophobicContact CZ2-CG2 4.41Å; W662-I711 HydrophobicContact CZ3-CD1 3.77Å; W662-F853 HydrophobicContact CH2-CE1 4.16Å; W662-F853 HydrophobicContact CH2-CZ 4.16Å; W662-F853 HydrophobicContact CZ2-CE1 4.08Å; W662-F853 AromaticContact CZ2-CZ 3.96Å; W662-F853 HydrophobicContact CZ2-CZ 3.96Å
663	A	88.1	Confident	89.4	Confident	0 Å²	0	11.6 Å²	11.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.4	-41	175.5	0	0	0	0	0	112.6	C582 F584 V630 V655 E659 A660 H665 P667 I670	C582-A663 PolarHBondContact SG-O 2.88Å; C582-A663 VanDerWaalsContact SG-O 3.35Å; F584-A663 HydrophobicContact CE1-CB 4.49Å; F584-A663 HydrophobicContact CZ-CB 3.66Å; V630-A663 HydrophobicContact CG2-CB 3.93Å; V655-A663 HydrophobicContact CG1-CB 3.93Å; V655-A663 HydrophobicContact CG2-CB 4.4Å; E659-A663 PolarHBondContact O-N 2.83Å; A660-A663 PolarHBondContact O-N 2.77Å; A663-H665 PolarHBondContact O-N 2.74Å; A663-P667 WeakPolarHBondContact O-CA 3.35Å; A663-P667 WeakPolarHBondContact O-CD 3.29Å; A663-I670 HydrophobicContact CB-CG1 3.89Å
664	Y	83.4	Confident	89.4	Confident	137 Å²	137	11.7 Å²	11.7	54%	0.537	5%	0.053	S	C	.	.	H	α-helix	trans	-63.6	-38.9	-179.5	-176.1	-99.4	0	0	0	113.3	F584 A660 P661 W662	F584-Y664 HydrophobicContact CE2-CD2 4.45Å; A660-Y664 WeakPolarHBondContact O-CB 3.48Å; A660-Y664 PolarHBondContact O-N 3.11Å; P661-Y664 PolarHBondContact O-N 3.01Å; W662-Y664 VanDerWaalsContact C-N 3.33Å; W662-Y664 PolarHBondContact O-N 3.36Å
665	H	83.9	Confident	89.4	Confident	11 Å²	11	11.7 Å²	11.7	5%	0.051	5%	0.053	C	C	.	.	H	α-helix	trans	-92.1	-40.7	-178.4	-64.7	-68.7	0	0	0	113	P661 W662 A663 E733 L735 S797	P661-H665 PolarHBondContact O-CD2 2.98Å; P661-H665 PolarHBondContact O-N 3.42Å; W662-H665 PolarHBondContact O-N 3.37Å; A663-H665 PolarHBondContact O-N 2.74Å; H665-E733 IonicContact CE1-OE1 2.85Å; H665-E733 PolarHBondContact CE1-OE1 2.88Å; H665-E733 IonicContact ND1-OE1 3.93Å; H665-E733 PolarHBondContact ND1-OE1 3.14Å; H665-L735 HydrophobicContact CB-CD2 3.82Å; H665-S797 WeakPolarHBondContact O-CB 3.18Å; H665-S797 PolarHBondContact O-OG 2.9Å
666	L	90.5	Very high	89.5	Confident	1 Å²	1	14.2 Å²	14.2	1%	0.005	6%	0.064	C	C	.	.			trans	-131.5	80.5	178.5	-100.9	78	0	0	0	110.4	W662 S668 R669 L705 L735 S797 F872	W662-L666 CarbonylContact O-C 2.96Å; W662-L666 WeakPolarHBondContact O-CA 3.27Å; W662-L666 PolarHBondContact O-N 2.84Å; L666-S668 VanDerWaalsContact C-N 3.28Å; L666-S668 PolarHBondContact O-N 3.1Å; L666-R669 HydrophobicContact CB-CB 3.91Å; L666-R669 HydrophobicContact CD2-CB 4.09Å; L666-R669 PolarHBondContact O-N 2.83Å; L666-L705 HydrophobicContact CD1-CD1 3.85Å; L666-L705 HydrophobicContact CD1-CD2 4.07Å; L666-L705 HydrophobicContact CD2-CD1 3.57Å; L666-L705 HydrophobicContact CG-CD1 4.32Å; L666-L735 HydrophobicContact CD1-CD1 4.36Å; L666-L735 HydrophobicContact CD1-CD2 3.73Å; L666-S797 WeakPolarHBondContact CG-OG 3.39Å; L666-F872 HydrophobicContact CD1-CB 4.44Å; L666-F872 HydrophobicContact CD2-CB 4.29Å; L666-F872 HydrophobicContact CD2-CD1 3.85Å; L666-F872 HydrophobicContact CD2-CG 4.46Å
667	P	92.1	Very high	89.7	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.006	8%	0.084	C	C	.	.	H	α-helix	trans	-58.3	-40.3	177.7	21.6	-33.2	0	0	0	112.1	H580 V630 A663 R669 I670 L671	H580-P667 HydrophobicContact CB-CB 4.09Å; H580-P667 HydrophobicContact CB-CG 3.74Å; H580-P667 WeakPolarHBondContact O-CB 3.33Å; H580-P667 WeakPolarHBondContact O-CG 3.3Å; V630-P667 HydrophobicContact CG1-CB 3.83Å; A663-P667 WeakPolarHBondContact O-CA 3.35Å; A663-P667 WeakPolarHBondContact O-CD 3.29Å; P667-R669 VanDerWaalsContact C-N 3.32Å; P667-R669 PolarHBondContact O-N 2.96Å; P667-I670 PolarHBondContact O-N 2.06Å; P667-I670 VanDerWaalsContact O-N 3.09Å; P667-L671 PolarHBondContact O-N 3.38Å; P667-L671 VanDerWaalsContact O-N 3.11Å
668	S	94.7	Very high	90.1	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.007	8%	0.082	C	C	.	.	H	α-helix	trans	-59.5	-35.5	178.1	-64.4	0	0	0	0	114.1	L666 I670 L671 L672 A798 D799 C800	L666-S668 VanDerWaalsContact C-N 3.28Å; L666-S668 PolarHBondContact O-N 3.1Å; S668-I670 PolarHBondContact O-N 2.98Å; S668-L671 PolarHBondContact O-N 2.9Å; S668-L672 WeakPolarHBondContact O-CB 3.45Å; S668-L672 VanDerWaalsContact O-CG 3.23Å; S668-L672 WeakPolarHBondContact O-CG 3.32Å; S668-L672 PolarHBondContact O-N 2.82Å; S668-A798 WeakPolarHBondContact CB-O 3.3Å; S668-A798 PolarHBondContact OG-O 2.84Å; S668-D799 WeakPolarHBondContact OG-CA 3.4Å; S668-C800 WeakPolarHBondContact CB-SG 3.35Å; S668-C800 PolarHBondContact OG-N 3.28Å; S668-C800 VanDerWaalsContact OG-N 3.1Å; S668-C800 PolarHBondContact OG-SG 2.96Å; S668-C800 VanDerWaalsContact OG-SG 3.33Å
669	R	94.5	Very high	90.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.5	-36.4	175.7	175	172.5	-71.7	-162.3	1.3	111.7	W662 L666 P667 N673 F695 E888 D889	W662-R669 VanDerWaalsContact CZ3-NH1 3.3Å; L666-R669 HydrophobicContact CB-CB 3.91Å; L666-R669 HydrophobicContact CD2-CB 4.09Å; L666-R669 PolarHBondContact O-N 2.83Å; P667-R669 VanDerWaalsContact C-N 3.32Å; P667-R669 PolarHBondContact O-N 2.96Å; R669-N673 WeakPolarHBondContact O-CB 3.34Å; R669-N673 PolarHBondContact O-N 2.86Å; R669-N673 PolarHBondContact O-ND2 2.94Å; R669-F695 HydrophobicContact CG-CE1 4.28Å; R669-F695 HydrophobicContact CG-CE2 3.76Å; R669-F695 HydrophobicContact CG-CZ 3.45Å; R669-F695 VanDerWaalsContact CG-CZ 3.45Å; R669-E888 IonicContact CZ-OE2 3.6Å; R669-E888 IonicContact NH1-OE2 3.91Å; R669-E888 PolarHBondContact NH1-OE2 2.95Å; R669-E888 IonicContact NH2-OE2 2.75Å; R669-E888 PolarHBondContact NH2-OE2 3.5Å; R669-D889 WeakPolarHBondContact CG-OD2 2.97Å; R669-D889 IonicContact CZ-OD1 3.78Å; R669-D889 IonicContact CZ-OD2 3.79Å; R669-D889 IonicContact NE-OD1 3.72Å; R669-D889 PolarHBondContact NE-OD1 2.98Å; R669-D889 IonicContact NE-OD2 2.65Å; R669-D889 PolarHBondContact NE-OD2 3.18Å; R669-D889 IonicContact NH2-OD1 3.31Å; R669-D889 PolarHBondContact NH2-OD1 3.1Å; R669-D889 IonicContact NH2-OD2 2.6Å; R669-D889 PolarHBondContact NH2-OD2 3.07Å
670	I	94.6	Very high	90.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-73.5	-49.3	176.1	-59.4	-54.9	0	0	0	110.7	E659 W662 A663 P667 S668 L672 N673 L674 F695	E659-I670 HydrophobicContact CB-CD1 4.26Å; W662-I670 HydrophobicContact CB-CD1 3.93Å; W662-I670 HydrophobicContact CB-CG1 4.47Å; A663-I670 HydrophobicContact CB-CG1 3.89Å; P667-I670 PolarHBondContact O-N 2.06Å; P667-I670 VanDerWaalsContact O-N 3.09Å; S668-I670 PolarHBondContact O-N 2.98Å; I670-L672 PolarHBondContact O-N 3.01Å; I670-N673 PolarHBondContact O-N 3.45Å; I670-L674 HydrophobicContact CG2-CD1 4.02Å; I670-L674 HydrophobicContact CG2-CG 4.39Å; I670-L674 WeakPolarHBondContact O-CG 3.29Å; I670-L674 PolarHBondContact O-N 2.85Å; I670-F695 HydrophobicContact CD1-CD2 3.47Å; I670-F695 VanDerWaalsContact CD1-CD2 3.47Å; I670-F695 HydrophobicContact CD1-CE2 3.79Å
671	L	96.4	Very high	90.9	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-56.9	-49.2	180	-63.1	177.6	0	0	0	111.8	H580 V630 F632 L653 P667 S668 N673 L674 G675 T683	H580-L671 VanDerWaalsContact CD2-CD1 3.46Å; H580-L671 WeakPolarHBondContact CD2-CD1 2.98Å; V630-L671 HydrophobicContact CB-CD2 4.21Å; V630-L671 HydrophobicContact CG1-CD1 4.22Å; V630-L671 HydrophobicContact CG1-CD2 4.05Å; V630-L671 HydrophobicContact CG1-CG 4.2Å; F632-L671 HydrophobicContact CB-CD1 4Å; F632-L671 HydrophobicContact CD1-CD2 4.06Å; F632-L671 HydrophobicContact CG-CD1 4.43Å; F632-L671 HydrophobicContact CG-CD2 4.42Å; L653-L671 HydrophobicContact CD1-CD2 3.67Å; P667-L671 PolarHBondContact O-N 3.38Å; P667-L671 VanDerWaalsContact O-N 3.11Å; S668-L671 PolarHBondContact O-N 2.9Å; L671-N673 VanDerWaalsContact C-N 3.33Å; L671-N673 PolarHBondContact O-N 2.81Å; L671-L674 WeakPolarHBondContact O-CB 3.28Å; L671-L674 PolarHBondContact O-N 3.26Å; L671-G675 PolarHBondContact O-N 3.35Å; L671-T683 HydrophobicContact CB-CG2 4.34Å; L671-T683 HydrophobicContact CD2-CG2 4.38Å; L671-T683 WeakPolarHBondContact O-CB 3.21Å; L671-T683 PolarHBondContact O-OG1 3.09Å
672	L	96.5	Very high	91.5	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67	-32.6	-178.3	-64.7	168.4	0	0	0	112.7	S668 I670 G675 K676 P682 H807 V809 I858 S871	S668-L672 WeakPolarHBondContact O-CB 3.45Å; S668-L672 VanDerWaalsContact O-CG 3.23Å; S668-L672 WeakPolarHBondContact O-CG 3.32Å; S668-L672 PolarHBondContact O-N 2.82Å; I670-L672 PolarHBondContact O-N 3.01Å; L672-G675 PolarHBondContact O-N 3.32Å; L672-K676 WeakPolarHBondContact O-CB 3.48Å; L672-K676 PolarHBondContact O-N 2.95Å; L672-P682 HydrophobicContact CD2-CB 4.06Å; L672-H807 HydrophobicContact CD1-CB 3.95Å; L672-H807 HydrophobicContact CD2-CB 3.63Å; L672-H807 HydrophobicContact CG-CB 4.42Å; L672-V809 HydrophobicContact CB-CG1 4.44Å; L672-V809 HydrophobicContact CB-CG2 4.11Å; L672-I858 HydrophobicContact CD2-CD1 4.05Å; L672-S871 WeakPolarHBondContact CD1-OG 3.44Å
673	N	95.4	Very high	92	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.037	13%	0.128	C	C	.	.	H	α-helix	trans	-73.6	-34.1	172.5	-86	-81.3	0	0	0	112.9	R669 I670 L671 G675 K676 M677 L694 F695 V809 C810 S811	R669-N673 WeakPolarHBondContact O-CB 3.34Å; R669-N673 PolarHBondContact O-N 2.86Å; R669-N673 PolarHBondContact O-ND2 2.94Å; I670-N673 PolarHBondContact O-N 3.45Å; L671-N673 VanDerWaalsContact C-N 3.33Å; L671-N673 PolarHBondContact O-N 2.81Å; N673-G675 VanDerWaalsContact C-N 3.3Å; N673-K676 PolarHBondContact O-N 3.4Å; N673-M677 VanDerWaalsContact O-CB 3.26Å; N673-M677 WeakPolarHBondContact O-CB 3.29Å; N673-M677 PolarHBondContact O-N 3.18Å; N673-L694 HydrophobicContact CB-CD1 3.7Å; N673-L694 HydrophobicContact CB-CD2 4.14Å; N673-L694 HydrophobicContact CB-CG 4.36Å; N673-F695 HydrophobicContact CB-CE2 4.34Å; N673-V809 HydrophobicContact CB-CG1 4.41Å; N673-V809 VanDerWaalsContact CG-CG1 3.49Å; N673-V809 WeakPolarHBondContact ND2-CG1 3.35Å; N673-V809 WeakPolarHBondContact OD1-CG1 3.36Å; N673-C810 PolarHBondContact ND2-O 3.11Å; N673-C810 PolarHBondContact OD1-O 3.27Å; N673-S811 PolarHBondContact OD1-OG 2.95Å
674	L	95.2	Very high	92.2	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-64.1	-38.4	169.7	-70.1	173	0	0	0	111.1	L653 I670 L671 M677 S678 T684 L694	L653-L674 HydrophobicContact CB-CD1 4.26Å; L653-L674 HydrophobicContact CD1-CD1 3.99Å; I670-L674 HydrophobicContact CG2-CD1 4.02Å; I670-L674 HydrophobicContact CG2-CG 4.39Å; I670-L674 WeakPolarHBondContact O-CG 3.29Å; I670-L674 PolarHBondContact O-N 2.85Å; L671-L674 WeakPolarHBondContact O-CB 3.28Å; L671-L674 PolarHBondContact O-N 3.26Å; L674-M677 HydrophobicContact CD2-CE 4.18Å; L674-S678 WeakPolarHBondContact O-CB 3.48Å; L674-S678 PolarHBondContact O-N 3.2Å; L674-S678 PolarHBondContact O-OG 3.16Å; L674-T684 HydrophobicContact CB-CG2 4.02Å; L674-L694 HydrophobicContact CD2-CD1 3.74Å; L674-L694 HydrophobicContact CG-CD1 3.8Å
675	G	94	Very high	92.7	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-60.7	-52.3	171	0	0	0	0	0	112.9	L671 L672 N673 M677 S678 H679 Y680	L671-G675 PolarHBondContact O-N 3.35Å; L672-G675 PolarHBondContact O-N 3.32Å; N673-G675 VanDerWaalsContact C-N 3.3Å; G675-M677 PolarHBondContact O-N 3.1Å; G675-S678 CarbonylContact O-C 3.6Å; G675-S678 PolarHBondContact O-N 2.96Å; G675-S678 PolarHBondContact O-OG 3.38Å; G675-S678 VanDerWaalsContact O-OG 3.13Å; G675-H679 WeakPolarHBondContact O-CA 3.48Å; G675-H679 PolarHBondContact O-N 3.12Å; G675-Y680 CarbonylContact C-O 3.5Å; G675-Y680 WeakPolarHBondContact CA-O 3.5Å; G675-Y680 PolarHBondContact O-N 2.84Å
676	K	92.8	Very high	93.2	Very high	54 Å²	54	21.8 Å²	21.8	24%	0.235	11%	0.106	C	C	.	.	H	α-helix	trans	-52.7	-49.8	173.8	-174.5	-163.1	179.5	-170.1	0	112.2	L672 N673 S678 H679 V809 S811 E856 I858	L672-K676 WeakPolarHBondContact O-CB 3.48Å; L672-K676 PolarHBondContact O-N 2.95Å; N673-K676 PolarHBondContact O-N 3.4Å; K676-S678 VanDerWaalsContact C-N 3.3Å; K676-S678 PolarHBondContact O-N 2.85Å; K676-H679 PolarHBondContact O-N 3.42Å; K676-V809 HydrophobicContact CB-CG1 4.48Å; K676-V809 HydrophobicContact CD-CG1 4.19Å; K676-S811 PolarHBondContact NZ-OG 2.98Å; K676-E856 WeakPolarHBondContact CE-OE2 3.23Å; K676-E856 IonicContact NZ-OE1 2.97Å; K676-E856 PolarHBondContact NZ-OE1 3.27Å; K676-E856 IonicContact NZ-OE2 3.18Å; K676-E856 PolarHBondContact NZ-OE2 3.38Å; K676-I858 HydrophobicContact CB-CG2 4.02Å; K676-I858 HydrophobicContact CG-CG2 4.2Å
677	M	91.1	Very high	93.4	Very high	87 Å²	87	21.8 Å²	21.8	43%	0.429	11%	0.107	S	C	.	.	H	α-helix	trans	-66.4	-29	-177.6	-170.9	-166.6	69.3	0	0	113.1	N673 L674 G675 R691 L694	N673-M677 VanDerWaalsContact O-CB 3.26Å; N673-M677 WeakPolarHBondContact O-CB 3.29Å; N673-M677 PolarHBondContact O-N 3.18Å; L674-M677 HydrophobicContact CD2-CE 4.18Å; G675-M677 PolarHBondContact O-N 3.1Å; M677-R691 HydrophobicContact CE-CB 4.29Å; M677-L694 HydrophobicContact CB-CD2 4.39Å; M677-L694 HydrophobicContact SD-CD2 4.02Å
678	S	89.5	Confident	93.4	Very high	34 Å²	34	22.8 Å²	22.8	24%	0.238	11%	0.112	C	C	.	.	H	α-helix	trans	-96.4	-1.9	178.6	58.3	0	0	0	0	114.1	L674 G675 K676 Y680 T684	L674-S678 WeakPolarHBondContact O-CB 3.48Å; L674-S678 PolarHBondContact O-N 3.2Å; L674-S678 PolarHBondContact O-OG 3.16Å; G675-S678 CarbonylContact O-C 3.6Å; G675-S678 PolarHBondContact O-N 2.96Å; G675-S678 PolarHBondContact O-OG 3.38Å; G675-S678 VanDerWaalsContact O-OG 3.13Å; K676-S678 VanDerWaalsContact C-N 3.3Å; K676-S678 PolarHBondContact O-N 2.85Å; S678-Y680 VanDerWaalsContact C-N 3.29Å; S678-Y680 PolarHBondContact O-N 2.7Å; S678-Y680 WeakPolarHBondContact OG-CB 3.44Å; S678-T684 WeakPolarHBondContact OG-CB 3.18Å
679	H	89	Confident	93.1	Very high	178 Å²	178	23.1 Å²	23.1	82%	0.824	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	43.1	-168.6	-57.7	-63.7	0	0	0	113.3	G675 K676	G675-H679 WeakPolarHBondContact O-CA 3.48Å; G675-H679 PolarHBondContact O-N 3.12Å; K676-H679 PolarHBondContact O-N 3.42Å
680	Y	88.8	Confident	92.7	Very high	31 Å²	31	27.2 Å²	27.2	12%	0.122	14%	0.135	C	C	.	.			trans	-134.9	129.5	-173.4	-150.5	-126.6	0	0	0	112.6	C497 L498 Q637 C638 G675 S678 P682 T683 L685	C497-Y680 HydrophobicContact CB-CD2 4.24Å; C497-Y680 HydrophobicContact CB-CE2 3.36Å; L498-Y680 HydrophobicContact CD2-CG 4.39Å; Q637-Y680 HydrophobicContact CB-CE1 3.63Å; Q637-Y680 HydrophobicContact CG-CD1 3.81Å; Q637-Y680 HydrophobicContact CG-CE1 3.38Å; C638-Y680 VanDerWaalsContact CB-OH 3.22Å; C638-Y680 WeakPolarHBondContact CB-OH 3.34Å; C638-Y680 PolarHBondContact N-OH 2.95Å; G675-Y680 CarbonylContact C-O 3.5Å; G675-Y680 WeakPolarHBondContact CA-O 3.5Å; G675-Y680 PolarHBondContact O-N 2.84Å; S678-Y680 VanDerWaalsContact C-N 3.29Å; S678-Y680 PolarHBondContact O-N 2.7Å; S678-Y680 WeakPolarHBondContact OG-CB 3.44Å; Y680-P682 CarbonylContact O-C 3.47Å; Y680-T683 WeakPolarHBondContact CD1-O 3.42Å; Y680-T683 PolarHBondContact O-N 3.41Å; Y680-L685 HydrophobicContact CE1-CG 4.38Å
681	Y	92	Very high	92.4	Very high	23 Å²	23	28 Å²	28	9%	0.09	14%	0.138	C	C	.	.	S	Bend	trans	-102.7	139.4	-170.8	-173.2	-95.6	0	0	0	112.7	H636 S804 S806 H807 I858 I860	H636-Y681 HydrophobicContact CB-CD1 4.38Å; H636-Y681 AromaticContact CD2-CE1 3.88Å; Y681-S804 PolarHBondContact OH-O 3.22Å; Y681-S806 WeakPolarHBondContact OH-CA 3.09Å; Y681-S806 PolarHBondContact OH-N 3Å; Y681-H807 AromaticContact CE2-ND1 3.97Å; Y681-H807 AromaticContact CZ-ND1 3.73Å; Y681-H807 PolarHBondContact OH-ND1 3.18Å; Y681-I858 HydrophobicContact CD2-CB 4.46Å; Y681-I858 HydrophobicContact CD2-CD1 3.97Å; Y681-I858 HydrophobicContact CD2-CG1 3.97Å; Y681-I858 HydrophobicContact CE2-CD1 4.33Å; Y681-I858 HydrophobicContact CE2-CG1 4.05Å; Y681-I860 HydrophobicContact CD1-CB 3.64Å; Y681-I860 HydrophobicContact CD1-CD1 4.21Å; Y681-I860 HydrophobicContact CD1-CG1 3.9Å; Y681-I860 HydrophobicContact CE1-CB 3.81Å; Y681-I860 HydrophobicContact CE1-CD1 4.42Å; Y681-I860 HydrophobicContact CE1-CG1 4.37Å; Y681-I860 HydrophobicContact CG-CB 4.17Å
682	P	93.3	Very high	92	Very high	10 Å²	10	35.9 Å²	35.9	7%	0.065	17%	0.172	C	C	.	.	S	Bend	cis	-75.6	-19.4	-15.1	31.3	-35.8	0	0	0	113	T635 L672 Y680	T635-P682 WeakPolarHBondContact OG1-CD 3.49Å; L672-P682 HydrophobicContact CD2-CB 4.06Å; Y680-P682 CarbonylContact O-C 3.47Å
683	T	95.2	Very high	91.6	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.012	18%	0.179	C	C	.	.			trans	-147.5	159	178.1	-177.7	0	0	0	0	111.3	F632 Q637 L653 L671 Y680	F632-T683 HydrophobicContact CD1-CG2 4.32Å; F632-T683 HydrophobicContact CD2-CG2 3.75Å; F632-T683 HydrophobicContact CE1-CG2 3.93Å; F632-T683 HydrophobicContact CE2-CG2 3.36Å; F632-T683 HydrophobicContact CG-CG2 4.24Å; F632-T683 HydrophobicContact CZ-CG2 3.45Å; F632-T683 VanDerWaalsContact CZ-CG2 3.45Å; Q637-T683 WeakPolarHBondContact CG-O 3.46Å; Q637-T683 PolarHBondContact NE2-O 2.94Å; L653-T683 HydrophobicContact CD1-CG2 4.34Å; L653-T683 WeakPolarHBondContact CD1-OG1 3.27Å; L671-T683 HydrophobicContact CB-CG2 4.34Å; L671-T683 HydrophobicContact CD2-CG2 4.38Å; L671-T683 WeakPolarHBondContact O-CB 3.21Å; L671-T683 PolarHBondContact O-OG1 3.09Å; Y680-T683 WeakPolarHBondContact CD1-O 3.42Å; Y680-T683 PolarHBondContact O-N 3.41Å
684	T	94.1	Very high	91.3	Very high	7 Å²	7	38.5 Å²	38.5	4%	0.043	19%	0.185	C	C	.	.			trans	-58.1	151	169.2	-170.7	0	0	0	0	112	F632 L653 L674 S678 L686	F632-T684 WeakPolarHBondContact CZ-O 3.31Å; L653-T684 HydrophobicContact CD1-CG2 4.21Å; L653-T684 WeakPolarHBondContact CD1-O 3.42Å; L653-T684 HydrophobicContact CD2-CG2 3.7Å; L674-T684 HydrophobicContact CB-CG2 4.02Å; S678-T684 WeakPolarHBondContact OG-CB 3.18Å; T684-L686 VanDerWaalsContact CG2-O 3.31Å; T684-L686 WeakPolarHBondContact CG2-O 3.23Å; T684-L686 PolarHBondContact OG1-N 2.84Å; T684-L686 PolarHBondContact OG1-O 3.3Å
685	L	94.1	Very high	90.9	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.021	18%	0.184	C	C	.	.	S	Bend	trans	-83	-20.1	160.9	-65.2	177.9	0	0	0	112	L521 F632 Q637 C638 L639 L642 I651 Y680	L521-L685 WeakPolarHBondContact CB-O 3.39Å; L521-L685 HydrophobicContact CD1-CB 3.85Å; L521-L685 HydrophobicContact CD1-CD1 4.43Å; F632-L685 HydrophobicContact CZ-CD2 4.12Å; Q637-L685 HydrophobicContact CB-CD1 3.87Å; Q637-L685 HydrophobicContact CB-CD2 3.75Å; Q637-L685 HydrophobicContact CB-CG 3.71Å; Q637-L685 HydrophobicContact CG-CD2 3.89Å; Q637-L685 HydrophobicContact CG-CG 3.94Å; C638-L685 WeakPolarHBondContact O-CD1 3.38Å; L639-L685 HydrophobicContact CD2-CD1 3.92Å; L639-L685 HydrophobicContact CD2-CD2 4.41Å; L642-L685 HydrophobicContact CD1-CD1 4.03Å; I651-L685 HydrophobicContact CD1-CD2 4.2Å; I651-L685 HydrophobicContact CG1-CD2 3.92Å; I651-L685 HydrophobicContact CG2-CD2 4.48Å; Y680-L685 HydrophobicContact CE1-CG 4.38Å
686	L	94.2	Very high	90.3	Very high	11 Å²	11	39.3 Å²	39.3	6%	0.058	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	116.9	-164.5	-179	56.2	0	0	0	112.2	L498 Q500 T502 L521 R523 T684 D688	L498-L686 HydrophobicContact CD1-CB 3.63Å; L498-L686 HydrophobicContact CD1-CD2 4.17Å; Q500-L686 HydrophobicContact CB-CD2 4.14Å; T502-L686 HydrophobicContact CG2-CD1 3.46Å; T502-L686 VanDerWaalsContact CG2-CD1 3.46Å; T502-L686 HydrophobicContact CG2-CD2 3.9Å; T502-L686 HydrophobicContact CG2-CG 4.32Å; L521-L686 HydrophobicContact CB-CD1 4.35Å; R523-L686 HydrophobicContact CB-CD1 4.16Å; R523-L686 HydrophobicContact CB-CD2 4.35Å; R523-L686 HydrophobicContact CB-CG 4.33Å; R523-L686 VanDerWaalsContact N-CD1 3.31Å; T684-L686 VanDerWaalsContact CG2-O 3.31Å; T684-L686 WeakPolarHBondContact CG2-O 3.23Å; T684-L686 PolarHBondContact OG1-N 2.84Å; T684-L686 PolarHBondContact OG1-O 3.3Å; L686-D688 PolarHBondContact O-N 2.95Å
687	S	94.5	Very high	89.3	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	118	163.1	-69.2	0	0	0	0	110.2	L521 R523 A652 L653 L654	L521-S687 VanDerWaalsContact O-CB 3.25Å; L521-S687 WeakPolarHBondContact O-CB 3.31Å; L521-S687 PolarHBondContact O-N 2.99Å; R523-S687 PolarHBondContact N-O 3.27Å; A652-S687 PolarHBondContact O-OG 2.94Å; L653-S687 WeakPolarHBondContact CA-OG 3.35Å; L654-S687 PolarHBondContact N-OG 3.24Å
688	D	91.1	Very high	88.1	Confident	21 Å²	21	37.8 Å²	37.8	11%	0.112	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-101.9	128.5	163.7	-167.3	-19.1	0	0	0	108.8	R523 L686 D690 R691	R523-D688 HydrophobicContact CB-CB 4.43Å; R523-D688 VanDerWaalsContact CD-CG 3.45Å; R523-D688 WeakPolarHBondContact CD-OD2 3.45Å; R523-D688 IonicContact CZ-OD2 3.53Å; R523-D688 IonicContact NE-OD2 3.42Å; R523-D688 IonicContact NH1-OD2 3Å; R523-D688 PolarHBondContact NH1-OD2 2.71Å; L686-D688 PolarHBondContact O-N 2.95Å; D688-D690 PolarHBondContact OD1-N 2.78Å; D688-R691 HydrophobicContact CB-CB 4.12Å; D688-R691 HydrophobicContact CB-CG 4.38Å; D688-R691 WeakPolarHBondContact O-CG 3.12Å
689	R	88.3	Confident	86.7	Confident	9 Å²	9	39.5 Å²	39.5	3%	0.034	19%	0.189	C	C	.	.	S	Bend	trans	-90.4	-14.8	-179.4	80.3	-170.3	95.3	157.2	10.3	113	L522 R523 E528 P626 L654	L522-R689 HydrophobicContact CD1-CB 4.42Å; R523-R689 PolarHBondContact O-NH2 3.18Å; E528-R689 VanDerWaalsContact CD-NH2 3.25Å; E528-R689 IonicContact OE1-CZ 3.51Å; E528-R689 VanDerWaalsContact OE1-CZ 3.25Å; E528-R689 IonicContact OE1-NH1 3.51Å; E528-R689 PolarHBondContact OE1-NH1 3.21Å; E528-R689 IonicContact OE1-NH2 3.45Å; E528-R689 PolarHBondContact OE1-NH2 3.38Å; E528-R689 IonicContact OE2-CZ 2.99Å; E528-R689 IonicContact OE2-NH1 3.6Å; E528-R689 IonicContact OE2-NH2 2.78Å; E528-R689 PolarHBondContact OE2-NH2 2.88Å; P626-R689 HydrophobicContact CG-CB 4.03Å; L654-R689 HydrophobicContact CD1-CB 4Å
690	D	86.7	Confident	84.8	Confident	86 Å²	86	38.4 Å²	38.4	46%	0.46	19%	0.189	S	C	.	.	S	Bend	trans	-109.6	5.3	-173.7	-63.4	-53	0	0	0	112.3	R525 D688	R525-D690 IonicContact CZ-OD1 3.47Å; R525-D690 IonicContact CZ-OD2 3.51Å; R525-D690 IonicContact NE-OD1 3.41Å; R525-D690 IonicContact NE-OD2 2.81Å; R525-D690 PolarHBondContact NE-OD2 3.49Å; R525-D690 IonicContact NH2-OD1 2.7Å; R525-D690 PolarHBondContact NH2-OD1 3.39Å; R525-D690 IonicContact NH2-OD2 3.46Å; R525-D690 PolarHBondContact NH2-OD2 3.45Å; D688-D690 PolarHBondContact OD1-N 2.78Å
691	R	89.2	Confident	83.4	Confident	16 Å²	16	37.6 Å²	37.6	6%	0.06	19%	0.191	C	C	.	.	S	Bend	trans	-67.4	158.7	176.5	68.1	180	-178.9	81.7	-4.2	112.4	S624 L654 H656 E659 M677 D688	S624-R691 PolarHBondContact OG-O 3.39Å; S624-R691 VanDerWaalsContact OG-O 3.13Å; L654-R691 PolarHBondContact O-NH2 2.97Å; H656-R691 PolarHBondContact CD2-NH1 2.86Å; H656-R691 PolarHBondContact CD2-NH2 3.19Å; H656-R691 VanDerWaalsContact NE2-CG 3.27Å; H656-R691 WeakPolarHBondContact NE2-CG 3.46Å; E659-R691 IonicContact OE1-CZ 3.51Å; E659-R691 IonicContact OE1-NH1 3.74Å; E659-R691 PolarHBondContact OE1-NH1 3.11Å; E659-R691 IonicContact OE1-NH2 3.56Å; E659-R691 IonicContact OE2-CZ 2.8Å; E659-R691 IonicContact OE2-NH1 2.65Å; E659-R691 PolarHBondContact OE2-NH1 3.3Å; E659-R691 IonicContact OE2-NH2 2.68Å; E659-R691 PolarHBondContact OE2-NH2 3.43Å; M677-R691 HydrophobicContact CE-CB 4.29Å; D688-R691 HydrophobicContact CB-CB 4.12Å; D688-R691 HydrophobicContact CB-CG 4.38Å; D688-R691 WeakPolarHBondContact O-CG 3.12Å
692	K	87	Confident	82.4	Confident	167 Å²	167	45.2 Å²	45.2	73%	0.726	23%	0.227	S	C	*	.	P	Polyproline II helix	trans	-68.6	145.1	167.4	-169.2	-171.2	170	-168.1	0	109.7
693	I	88.3	Confident	81.9	Confident	29 Å²	29	44.9 Å²	44.9	15%	0.149	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-61.2	138	167.3	65.2	-178.9	0	0	0	111	S624 H656 Q658 E659 D696	S624-I693 VanDerWaalsContact OG-CG2 3.26Å; S624-I693 WeakPolarHBondContact OG-CG2 3.22Å; H656-I693 HydrophobicContact CB-CG2 3.74Å; Q658-I693 HydrophobicContact CB-CD1 3.87Å; Q658-I693 HydrophobicContact CB-CG2 4.37Å; Q658-I693 HydrophobicContact CG-CD1 3.84Å; E659-I693 HydrophobicContact CG-CB 4.36Å; E659-I693 WeakPolarHBondContact OE1-CA 3.13Å; I693-D696 HydrophobicContact CD1-CB 3.86Å
694	L	89.8	Confident	81.4	Confident	32 Å²	32	46.8 Å²	46.8	17%	0.168	23%	0.233	C	C	.	.	S	Bend	trans	-78.1	-43	175	-63.6	170.7	0	0	0	111	E659 N673 L674 M677	E659-L694 WeakPolarHBondContact OE1-CB 3.34Å; E659-L694 PolarHBondContact OE1-N 2.82Å; N673-L694 HydrophobicContact CB-CD1 3.7Å; N673-L694 HydrophobicContact CB-CD2 4.14Å; N673-L694 HydrophobicContact CB-CG 4.36Å; L674-L694 HydrophobicContact CD2-CD1 3.74Å; L674-L694 HydrophobicContact CG-CD1 3.8Å; M677-L694 HydrophobicContact CB-CD2 4.39Å; M677-L694 HydrophobicContact SD-CD2 4.02Å
695	F	86.6	Confident	80.8	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	23%	0.231	C	C	.	.			trans	-126.5	145.4	-178.8	-63.5	-87	0	0	0	110.8	W662 R669 I670 N673 C810 Q812 F853	W662-F695 VanDerWaalsContact CD1-CB 3.43Å; W662-F695 HydrophobicContact CD2-CD1 4.44Å; W662-F695 HydrophobicContact CG-CB 4.04Å; W662-F695 HydrophobicContact CG-CG 4.2Å; R669-F695 HydrophobicContact CG-CE1 4.28Å; R669-F695 HydrophobicContact CG-CE2 3.76Å; R669-F695 HydrophobicContact CG-CZ 3.45Å; R669-F695 VanDerWaalsContact CG-CZ 3.45Å; I670-F695 HydrophobicContact CD1-CD2 3.47Å; I670-F695 VanDerWaalsContact CD1-CD2 3.47Å; I670-F695 HydrophobicContact CD1-CE2 3.79Å; N673-F695 HydrophobicContact CB-CE2 4.34Å; F695-C810 WeakPolarHBondContact CZ-O 3.27Å; F695-Q812 VanDerWaalsContact CA-OE1 3.24Å; F695-Q812 HydrophobicContact CD1-CB 3.9Å; F695-Q812 HydrophobicContact CE1-CB 4.16Å; F695-F853 HydrophobicContact CD1-CE1 4.23Å; F695-F853 HydrophobicContact CE1-CE1 4.29Å
696	D	80.5	Confident	80.1	Confident	22 Å²	22	49.7 Å²	49.7	12%	0.118	25%	0.246	C	C	.	.			trans	-124.3	93.2	-179.3	-163.3	-16.7	0	0	0	110	I693 K698 L699 Q812 K814	I693-D696 HydrophobicContact CD1-CB 3.86Å; D696-K698 PolarHBondContact O-N 3.08Å; D696-K698 VanDerWaalsContact O-N 3.13Å; D696-K698 PolarHBondContact OD1-N 2.77Å; D696-L699 HydrophobicContact CB-CD1 4.11Å; D696-L699 HydrophobicContact CB-CG 4.49Å; D696-L699 PolarHBondContact O-N 3.15Å; D696-L699 WeakPolarHBondContact OD2-CD1 3.37Å; D696-Q812 PolarHBondContact O-NE2 3.13Å; D696-K814 IonicContact OD2-NZ 3.56Å; D696-K814 PolarHBondContact OD2-NZ 2.83Å
697	C	72.3	Confident	79.4	Confident	22 Å²	22	55.1 Å²	55.1	15%	0.149	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	3.3	-179.4	74	0	0	0	0	114.5	Q658 P661	Q658-C697 WeakPolarHBondContact O-CB 3.06Å; Q658-C697 PolarHBondContact O-N 3.45Å; Q658-C697 PolarHBondContact O-SG 3.39Å; P661-C697 HydrophobicContact CG-CB 4.18Å
698	K	65.6	Low	78.7	Confident	86 Å²	86	55.5 Å²	55.5	37%	0.374	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-7	176.9	-62.8	-176.8	-177.4	177.4	0	113.5	I620 D696	I620-K698 PolarHBondContact O-NZ 3.06Å; D696-K698 PolarHBondContact O-N 3.08Å; D696-K698 VanDerWaalsContact O-N 3.13Å; D696-K698 PolarHBondContact OD1-N 2.77Å
699	L	60.2	Low	77.8	Confident	70 Å²	70	54.9 Å²	54.9	37%	0.366	27%	0.273	S	S	.	.	S	Bend	trans	-110.4	138.3	-173.1	-65.5	173.7	0	0	0	111.5	D696 G701 Q851	D696-L699 HydrophobicContact CB-CD1 4.11Å; D696-L699 HydrophobicContact CB-CG 4.49Å; D696-L699 PolarHBondContact O-N 3.15Å; D696-L699 WeakPolarHBondContact OD2-CD1 3.37Å; L699-G701 PolarHBondContact O-N 3.42Å; L699-G701 VanDerWaalsContact O-N 3.08Å; L699-Q851 VanDerWaalsContact CB-NE2 3.32Å
700	D	50.3	Low	76.5	Confident	156 Å²	156	57.1 Å²	57.1	83%	0.834	29%	0.286	S	S	*	.			trans	-69	105.5	-174.8	-61.7	-49.9	0	0	0	111.2
701	G	58.6	Low	75	Confident	14 Å²	14	54 Å²	54	14%	0.144	27%	0.269	C	S	.	.			trans	-155.9	120.3	173.8	0	0	0	0	0	109.6	L699 S703 Q706	L699-G701 PolarHBondContact O-N 3.42Å; L699-G701 VanDerWaalsContact O-N 3.08Å; G701-S703 PolarHBondContact O-N 2.78Å; G701-Q706 PolarHBondContact O-NE2 2.83Å
702	E	70.5	Confident	73.2	Confident	182 Å²	182	59.7 Å²	59.7	85%	0.85	29%	0.294	S	S	*	.			trans	-80	101.8	-178.8	-66.9	-171.9	166.2	0	0	110.3
703	S	82.6	Confident	71.4	Confident	4 Å²	4	54.5 Å²	54.5	3%	0.028	28%	0.277	C	S	.	.			trans	-80.2	146.4	165.5	166.3	0	0	0	0	110.3	G701 L705 Q706 E888	G701-S703 PolarHBondContact O-N 2.78Å; S703-L705 PolarHBondContact O-N 3.21Å; S703-L705 VanDerWaalsContact O-N 3.11Å; S703-L705 PolarHBondContact OG-N 2.82Å; S703-Q706 WeakPolarHBondContact O-CB 3.32Å; S703-Q706 PolarHBondContact O-N 3.44Å; S703-E888 VanDerWaalsContact CA-OE1 3.24Å; S703-E888 WeakPolarHBondContact CA-OE1 3.24Å; S703-E888 VanDerWaalsContact CB-OE1 3.3Å; S703-E888 WeakPolarHBondContact CB-OE1 3.37Å; S703-E888 PolarHBondContact OG-OE1 3.03Å; S703-E888 PolarHBondContact OG-OE2 2.88Å
704	F	84.3	Confident	69.4	Low	41 Å²	41	58.7 Å²	58.7	18%	0.18	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-52.4	-33	173.9	-176.5	-102.3	0	0	0	113.1	Q706 L707 F708 F872 A874 V887 E888 Y892	F704-Q706 VanDerWaalsContact C-N 3.27Å; F704-Q706 PolarHBondContact O-N 3.28Å; F704-L707 HydrophobicContact CD2-CD1 3.85Å; F704-L707 HydrophobicContact CE2-CD1 3.95Å; F704-L707 WeakPolarHBondContact O-CB 3.49Å; F704-L707 WeakPolarHBondContact O-CG 3.37Å; F704-L707 PolarHBondContact O-N 2.93Å; F704-F708 HydrophobicContact CD1-CE2 4.14Å; F704-F708 HydrophobicContact CE1-CD2 4.39Å; F704-F708 AromaticContact CE1-CE2 3.52Å; F704-F708 HydrophobicContact CE1-CE2 3.52Å; F704-F708 HydrophobicContact CE1-CZ 4.18Å; F704-F708 HydrophobicContact CE2-CE2 4.48Å; F704-F708 AromaticContact CZ-CE2 3.72Å; F704-F708 HydrophobicContact CZ-CE2 3.72Å; F704-F708 HydrophobicContact CZ-CZ 4.16Å; F704-F872 AromaticContact CD1-CE2 3.85Å; F704-F872 HydrophobicContact CD1-CE2 3.85Å; F704-F872 AromaticContact CD1-CZ 3.86Å; F704-F872 HydrophobicContact CD1-CZ 3.86Å; F704-F872 AromaticContact CE1-CE2 3.93Å; F704-F872 HydrophobicContact CE1-CE2 3.93Å; F704-F872 HydrophobicContact CE1-CZ 4.36Å; F704-A874 HydrophobicContact CE1-CB 3.95Å; F704-A874 HydrophobicContact CZ-CB 4.49Å; F704-V887 HydrophobicContact CB-CG1 3.74Å; F704-V887 HydrophobicContact CD1-CB 4.46Å; F704-V887 HydrophobicContact CD1-CG1 3.93Å; F704-V887 HydrophobicContact CD2-CG1 3.88Å; F704-V887 HydrophobicContact CE2-CG1 4.49Å; F704-V887 HydrophobicContact CG-CG1 3.57Å; F704-E888 PolarHBondContact N-OE1 3.48Å; F704-Y892 HydrophobicContact CE1-CD2 4.36Å; F704-Y892 AromaticContact CZ-CD2 3.65Å; F704-Y892 HydrophobicContact CZ-CD2 3.65Å; F704-Y892 HydrophobicContact CZ-CE2 4.23Å; F704-Y892 AromaticContact CZ-CG 3.83Å; F704-Y892 HydrophobicContact CZ-CG 3.83Å
705	L	81.7	Confident	66.9	Low	1 Å²	1	63.8 Å²	63.8	1%	0.005	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-69.1	-20.5	179.5	-74.3	165.1	0	0	0	113.9	W662 L666 S703 L707 F708 T709 I711 L735 F872	W662-L705 HydrophobicContact CZ3-CD1 4.21Å; L666-L705 HydrophobicContact CD1-CD1 3.85Å; L666-L705 HydrophobicContact CD1-CD2 4.07Å; L666-L705 HydrophobicContact CD2-CD1 3.57Å; L666-L705 HydrophobicContact CG-CD1 4.32Å; S703-L705 PolarHBondContact O-N 3.21Å; S703-L705 VanDerWaalsContact O-N 3.11Å; S703-L705 PolarHBondContact OG-N 2.82Å; L705-L707 PolarHBondContact O-N 2.89Å; L705-F708 PolarHBondContact O-N 2.96Å; L705-T709 PolarHBondContact O-N 3.42Å; L705-T709 VanDerWaalsContact O-N 3.1Å; L705-T709 PolarHBondContact O-OG1 2.98Å; L705-I711 HydrophobicContact CB-CD1 4.21Å; L705-L735 HydrophobicContact CD2-CD1 4.4Å; L705-F872 HydrophobicContact CD1-CD1 4.23Å; L705-F872 HydrophobicContact CD1-CE1 4.21Å; L705-F872 HydrophobicContact CD2-CD1 4.11Å; L705-F872 HydrophobicContact CD2-CD2 3.97Å; L705-F872 HydrophobicContact CD2-CE1 4.26Å; L705-F872 HydrophobicContact CD2-CE2 4.15Å; L705-F872 HydrophobicContact CD2-CG 3.95Å; L705-F872 HydrophobicContact CD2-CZ 4.29Å; L705-F872 HydrophobicContact CG-CD1 4.44Å; L705-F872 HydrophobicContact CG-CE1 4.23Å; L705-F872 HydrophobicContact CG-CZ 4.37Å
706	Q	80.6	Confident	64.4	Low	72 Å²	72	69.3 Å²	69.3	34%	0.336	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-67.7	-15.1	174.5	-62.8	170	14	0	0	112.3	G701 S703 F704 F708 T709 I711	G701-Q706 PolarHBondContact O-NE2 2.83Å; S703-Q706 WeakPolarHBondContact O-CB 3.32Å; S703-Q706 PolarHBondContact O-N 3.44Å; F704-Q706 VanDerWaalsContact C-N 3.27Å; F704-Q706 PolarHBondContact O-N 3.28Å; Q706-F708 VanDerWaalsContact C-N 3.25Å; Q706-F708 PolarHBondContact O-N 3.21Å; Q706-T709 VanDerWaalsContact O-O 3.1Å; Q706-I711 HydrophobicContact CG-CB 4.42Å
707	L	79.5	Confident	62.1	Low	125 Å²	125	72.5 Å²	72.5	65%	0.654	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-71.6	-20.3	169.4	-57.7	175.4	0	0	0	112.8	F704 L705	F704-L707 HydrophobicContact CD2-CD1 3.85Å; F704-L707 HydrophobicContact CE2-CD1 3.95Å; F704-L707 WeakPolarHBondContact O-CB 3.49Å; F704-L707 WeakPolarHBondContact O-CG 3.37Å; F704-L707 PolarHBondContact O-N 2.93Å; L705-L707 PolarHBondContact O-N 2.89Å
708	F	79.5	Confident	60.1	Low	9 Å²	9	76 Å²	76	4%	0.039	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-11.6	-176.1	-61.1	-95.4	0	0	0	113.1	F704 L705 Q706 L734 L735 T793 A795 A874	F704-F708 HydrophobicContact CD1-CE2 4.14Å; F704-F708 HydrophobicContact CE1-CD2 4.39Å; F704-F708 AromaticContact CE1-CE2 3.52Å; F704-F708 HydrophobicContact CE1-CE2 3.52Å; F704-F708 HydrophobicContact CE1-CZ 4.18Å; F704-F708 HydrophobicContact CE2-CE2 4.48Å; F704-F708 AromaticContact CZ-CE2 3.72Å; F704-F708 HydrophobicContact CZ-CE2 3.72Å; F704-F708 HydrophobicContact CZ-CZ 4.16Å; L705-F708 PolarHBondContact O-N 2.96Å; Q706-F708 VanDerWaalsContact C-N 3.25Å; Q706-F708 PolarHBondContact O-N 3.21Å; F708-L734 HydrophobicContact CB-CB 4.35Å; F708-L734 HydrophobicContact CD1-CB 4.15Å; F708-L734 PolarHBondContact O-N 3.37Å; F708-L735 HydrophobicContact CB-CB 4.24Å; F708-L735 PolarHBondContact O-N 3.23Å; F708-T793 HydrophobicContact CE1-CG2 3.75Å; F708-T793 HydrophobicContact CZ-CG2 4.18Å; F708-A795 HydrophobicContact CB-CB 4.35Å; F708-A795 HydrophobicContact CD1-CB 3.55Å; F708-A795 HydrophobicContact CE1-CB 3.94Å; F708-A795 HydrophobicContact CG-CB 3.9Å; F708-A874 HydrophobicContact CE1-CB 4.04Å; F708-A874 HydrophobicContact CE2-CB 4.15Å; F708-A874 HydrophobicContact CZ-CB 3.66Å
709	T	72.1	Confident	58.4	Low	8 Å²	8	81.8 Å²	81.8	5%	0.049	41%	0.407	C	S	.	.	S	Bend	trans	-142.5	150.4	-171	55.6	0	0	0	0	112	L705 Q706 I711 E733 L735	L705-T709 PolarHBondContact O-N 3.42Å; L705-T709 VanDerWaalsContact O-N 3.1Å; L705-T709 PolarHBondContact O-OG1 2.98Å; Q706-T709 VanDerWaalsContact O-O 3.1Å; T709-I711 PolarHBondContact O-N 3.34Å; T709-I711 VanDerWaalsContact O-N 3.16Å; T709-I711 WeakPolarHBondContact OG1-CD1 3.46Å; T709-I711 VanDerWaalsContact OG1-CG1 3.24Å; T709-I711 WeakPolarHBondContact OG1-CG1 3.34Å; T709-E733 HydrophobicContact CG2-CG 4.48Å; T709-L735 HydrophobicContact CG2-CB 3.43Å; T709-L735 VanDerWaalsContact CG2-CB 3.43Å; T709-L735 HydrophobicContact CG2-CD2 3.49Å; T709-L735 VanDerWaalsContact CG2-CD2 3.49Å; T709-L735 HydrophobicContact CG2-CG 4.11Å
710	N	61	Low	56.7	Low	57 Å²	57	85.7 Å²	85.7	31%	0.305	43%	0.425	S	S	.	.			trans	-85.2	58.8	162.6	-74.3	-87	0	0	0	110	K712 L731	N710-K712 VanDerWaalsContact C-N 3.29Å; N710-K712 PolarHBondContact O-N 2.86Å; N710-L731 PolarHBondContact ND2-O 2.95Å; N710-L731 VanDerWaalsContact ND2-O 3.14Å
711	I	54.9	Low	55.5	Low	21 Å²	21	84.7 Å²	84.7	11%	0.108	43%	0.425	C	S	.	.			trans	-62.3	97.1	168.2	-70.5	159.9	0	0	0	107.8	P661 W662 L705 Q706 T709	P661-I711 HydrophobicContact CB-CG2 4.46Å; W662-I711 HydrophobicContact CE3-CD1 4.09Å; W662-I711 HydrophobicContact CH2-CD1 4.17Å; W662-I711 HydrophobicContact CZ2-CG2 4.41Å; W662-I711 HydrophobicContact CZ3-CD1 3.77Å; L705-I711 HydrophobicContact CB-CD1 4.21Å; Q706-I711 HydrophobicContact CG-CB 4.42Å; T709-I711 PolarHBondContact O-N 3.34Å; T709-I711 VanDerWaalsContact O-N 3.16Å; T709-I711 WeakPolarHBondContact OG1-CD1 3.46Å; T709-I711 VanDerWaalsContact OG1-CG1 3.24Å; T709-I711 WeakPolarHBondContact OG1-CG1 3.34Å
712	K	51.8	Low	54	Low	134 Å²	134	92.5 Å²	92.5	58%	0.583	46%	0.455	S	S	*	.			trans	-125	151.6	170.8	-67.9	-178.3	-179.2	174.5	0	106.7	N710 F714	N710-K712 VanDerWaalsContact C-N 3.29Å; N710-K712 PolarHBondContact O-N 2.86Å; K712-F714 PolarHBondContact O-N 3.06Å
713	P	48.8	Very low	51.8	Low	58 Å²	58	89.2 Å²	89.2	38%	0.377	45%	0.448	S	S	.	.			trans	-55.1	118.1	174.2	21.9	-32.3	0	0	0	109.1	I715	P713-I715 PolarHBondContact O-N 2.9Å
714	F	45.9	Very low	49.3	Very low	117 Å²	117	94.3 Å²	94.3	51%	0.513	48%	0.48	S	S	.	.			trans	-68.6	77.7	176.6	-99.6	-92	0	0	0	109.6	P661 K712 Y716	P661-F714 HydrophobicContact CB-CD2 4.34Å; P661-F714 HydrophobicContact CG-CB 4.5Å; P661-F714 HydrophobicContact CG-CD2 4.4Å; K712-F714 PolarHBondContact O-N 3.06Å; F714-Y716 VanDerWaalsContact C-N 3.3Å; F714-Y716 PolarHBondContact O-N 3Å
715	I	37.6	Very low	46.7	Very low	139 Å²	139	101.4 Å²	101.4	71%	0.713	51%	0.511	S	S	*	.			trans	-65.2	100.3	158.5	-57.2	177.5	0	0	0	105	P713 P717	P713-I715 PolarHBondContact O-N 2.9Å; I715-P717 WeakPolarHBondContact O-CD 3.35Å; I715-P717 VanDerWaalsContact O-N 3.16Å
716	Y	35.2	Very low	44.4	Very low	118 Å²	118	110.1 Å²	110.1	46%	0.463	55%	0.552	S	S	.	*			trans	-49.7	123.9	167.5	-110.9	-107.1	0	0	0	107.7	Y627 F714 D718	Y627-Y716 VanDerWaalsContact OH-CD2 3.22Å; Y627-Y716 WeakPolarHBondContact OH-CD2 3.24Å; Y627-Y716 VanDerWaalsContact OH-CE2 3.32Å; Y627-Y716 WeakPolarHBondContact OH-CE2 3.38Å; F714-Y716 VanDerWaalsContact C-N 3.3Å; F714-Y716 PolarHBondContact O-N 3Å; Y716-D718 PolarHBondContact O-N 2.97Å
717	P	31	Very low	42	Very low	88 Å²	88	117.9 Å²	117.9	57%	0.571	58%	0.578	S	S	*	*			trans	-64	107.9	164.2	27.7	-30.6	0	0	0	106	I715 F719	I715-P717 WeakPolarHBondContact O-CD 3.35Å; I715-P717 VanDerWaalsContact O-N 3.16Å; P717-F719 PolarHBondContact O-N 2.76Å
718	D	30	Very low	40	Very low	96 Å²	96	117.2 Å²	117.2	51%	0.513	58%	0.583	S	S	.	*			trans	-51.6	140.9	160.2	-79.9	-31.3	0	0	0	107.1	K586 Y716 M720	K586-D718 IonicContact NZ-OD1 3.01Å; K586-D718 PolarHBondContact NZ-OD1 2.78Å; Y716-D718 PolarHBondContact O-N 2.97Å; D718-M720 PolarHBondContact O-N 3.34Å
719	F	30.7	Very low	38.1	Very low	208 Å²	208	124.3 Å²	124.3	91%	0.912	62%	0.619	S	S	*	*	S	Bend	trans	-66.5	15.2	-170.5	-106.5	-94.9	0	0	0	114.7	P717	P717-F719 PolarHBondContact O-N 2.76Å
720	M	25	Very low	37	Very low	151 Å²	151	128.5 Å²	128.5	74%	0.744	65%	0.647	S	S	*	*	S	Bend	trans	-135.4	128.3	175.4	-65.4	-70.1	163.1	0	0	109.7	D718	D718-M720 PolarHBondContact O-N 3.34Å
721	T	24.4	Very low	36.4	Very low	135 Å²	135	131.9 Å²	131.9	83%	0.828	66%	0.664	S	S	*	*			trans	69.2	63.9	162.4	62.6	0	0	0	0	119.5
722	F	26.6	Very low	36.6	Very low	179 Å²	179	134.5 Å²	134.5	79%	0.785	68%	0.682	S	S	*	*			trans	-123.5	102.8	144.5	-111.3	-85.4	0	0	0	111.2	P724	F722-P724 WeakPolarHBondContact O-CD 3.42Å
723	T	25.1	Very low	37.7	Very low	113 Å²	113	132.5 Å²	132.5	69%	0.693	68%	0.675	S	S	*	*			trans	-82.2	117.3	167.9	54.1	0	0	0	0	109	K725	T723-K725 PolarHBondContact O-N 2.79Å
724	P	30.3	Very low	39.5	Very low	110 Å²	110	130.8 Å²	130.8	71%	0.714	66%	0.663	S	S	*	*			trans	-75.4	90	-173.9	29.8	-35.2	0	0	0	111.6	F722	F722-P724 WeakPolarHBondContact O-CD 3.42Å
725	K	30	Very low	41.5	Very low	191 Å²	191	125.6 Å²	125.6	83%	0.83	64%	0.64	S	S	*	*	S	Bend	trans	-75.7	122	163	-71.4	-174.9	177.9	179.5	0	108.1	T723	T723-K725 PolarHBondContact O-N 2.79Å
726	Q	33.1	Very low	43.9	Very low	184 Å²	184	121.6 Å²	121.6	86%	0.86	62%	0.618	S	S	*	*	S	Bend	trans	59.9	107.1	-167.9	-71.9	171.5	-70.4	0	0	114.9	C728	Q726-C728 PolarHBondContact O-N 2.75Å; Q726-C728 VanDerWaalsContact O-N 3.11Å
727	R	28.7	Very low	46.4	Very low	234 Å²	234	117.9 Å²	117.9	88%	0.883	61%	0.605	S	S	*	*			trans	-69.2	96.7	155.3	-74.2	178.2	172.9	168	-4.2	108.4	I729	R727-I729 PolarHBondContact O-N 2.86Å
728	C	37.4	Very low	49	Very low	111 Å²	111	114 Å²	114	75%	0.75	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-60.5	129.7	147.1	-66.9	0	0	0	0	106.9	Q726 P730	Q726-C728 PolarHBondContact O-N 2.75Å; Q726-C728 VanDerWaalsContact O-N 3.11Å; C728-P730 WeakPolarHBondContact O-CD 3.49Å
729	I	39.6	Very low	51.4	Low	158 Å²	158	111 Å²	111	81%	0.81	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-66.7	119.9	168.2	-58.6	171.2	0	0	0	105.3	R727 L731	R727-I729 PolarHBondContact O-N 2.86Å; I729-L731 PolarHBondContact O-N 3.45Å
730	P	49.5	Very low	53.9	Low	97 Å²	97	101.6 Å²	101.6	63%	0.63	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-63	127.5	173.2	27.1	-32.2	0	0	0	107.6	C728	C728-P730 WeakPolarHBondContact O-CD 3.49Å
731	L	49.9	Very low	57.1	Low	127 Å²	127	94.4 Å²	94.4	67%	0.665	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-53	136.6	166.6	-75.5	163.9	0	0	0	108.1	N710 I729 E733	N710-L731 PolarHBondContact ND2-O 2.95Å; N710-L731 VanDerWaalsContact ND2-O 3.14Å; I729-L731 PolarHBondContact O-N 3.45Å; L731-E733 PolarHBondContact O-N 3.07Å
732	P	58.9	Low	60.5	Low	76 Å²	76	89.9 Å²	89.9	49%	0.494	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-56.5	137.3	177.2	25.7	-33.9	0	0	0	108.8	L734	P732-L734 HydrophobicContact CG-CD2 4.43Å; P732-L734 PolarHBondContact O-N 2.93Å; P732-L734 VanDerWaalsContact O-N 3.16Å
733	E	73.6	Confident	63.7	Low	93 Å²	93	81.3 Å²	81.3	44%	0.435	42%	0.42	S	S	.	.			trans	-69.3	115.6	175.1	-159.4	169.2	167.4	0	0	107.8	H665 T709 L731	H665-E733 IonicContact CE1-OE1 2.85Å; H665-E733 PolarHBondContact CE1-OE1 2.88Å; H665-E733 IonicContact ND1-OE1 3.93Å; H665-E733 PolarHBondContact ND1-OE1 3.14Å; T709-E733 HydrophobicContact CG2-CG 4.48Å; L731-E733 PolarHBondContact O-N 3.07Å
734	L	86.3	Confident	67.1	Low	21 Å²	21	76.5 Å²	76.5	11%	0.11	39%	0.389	C	S	.	.			trans	-101.3	-0.2	-177.3	-66.2	179.9	0	0	0	111.9	F708 P732 F794 A795	F708-L734 HydrophobicContact CB-CB 4.35Å; F708-L734 HydrophobicContact CD1-CB 4.15Å; F708-L734 PolarHBondContact O-N 3.37Å; P732-L734 HydrophobicContact CG-CD2 4.43Å; P732-L734 PolarHBondContact O-N 2.93Å; P732-L734 VanDerWaalsContact O-N 3.16Å; L734-F794 CarbonylContact O-C 3.48Å; L734-F794 WeakPolarHBondContact O-CA 3.4Å; L734-A795 PolarHBondContact O-N 2.6Å
735	L	87.8	Confident	70.1	Confident	8 Å²	8	71.9 Å²	71.9	4%	0.042	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	140	165.5	-176.1	70.5	0	0	0	109.8	H665 L666 L705 F708 T709 A795	H665-L735 HydrophobicContact CB-CD2 3.82Å; L666-L735 HydrophobicContact CD1-CD1 4.36Å; L666-L735 HydrophobicContact CD1-CD2 3.73Å; L705-L735 HydrophobicContact CD2-CD1 4.4Å; F708-L735 HydrophobicContact CB-CB 4.24Å; F708-L735 PolarHBondContact O-N 3.23Å; T709-L735 HydrophobicContact CG2-CB 3.43Å; T709-L735 VanDerWaalsContact CG2-CB 3.43Å; T709-L735 HydrophobicContact CG2-CD2 3.49Å; T709-L735 VanDerWaalsContact CG2-CD2 3.49Å; T709-L735 HydrophobicContact CG2-CG 4.11Å; L735-A795 CarbonylContact C-O 3.54Å; L735-A795 WeakPolarHBondContact CA-O 3.48Å; L735-A795 HydrophobicContact CD1-CB 3.61Å
736	F	88.6	Confident	73	Confident	55 Å²	55	64.2 Å²	64.2	24%	0.241	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	128.3	171.1	-175.4	-123.2	0	0	0	110.6	I738 V780 F783 A795 L796 S797	F736-I738 HydrophobicContact CD1-CD1 4.08Å; F736-I738 HydrophobicContact CD1-CG1 3.65Å; F736-I738 HydrophobicContact CE1-CD1 4.26Å; F736-I738 HydrophobicContact CE1-CG1 3.6Å; F736-V780 HydrophobicContact CE1-CG2 4.29Å; F736-F783 HydrophobicContact CB-CD1 3.69Å; F736-F783 HydrophobicContact CB-CD2 3.8Å; F736-F783 HydrophobicContact CB-CE1 3.65Å; F736-F783 HydrophobicContact CB-CE2 3.76Å; F736-F783 HydrophobicContact CB-CG 3.76Å; F736-F783 HydrophobicContact CB-CZ 3.69Å; F736-F783 HydrophobicContact CD1-CB 4.1Å; F736-F783 HydrophobicContact CD1-CD1 4.06Å; F736-F783 HydrophobicContact CD1-CG 4.06Å; F736-F783 HydrophobicContact CD2-CB 4.35Å; F736-F783 HydrophobicContact CD2-CD2 4.23Å; F736-F783 HydrophobicContact CD2-CG 4.24Å; F736-F783 HydrophobicContact CE1-CB 4.36Å; F736-F783 HydrophobicContact CG-CB 4.12Å; F736-F783 AromaticContact CG-CD1 3.99Å; F736-F783 HydrophobicContact CG-CD1 3.99Å; F736-F783 HydrophobicContact CG-CD2 4.05Å; F736-F783 HydrophobicContact CG-CE1 4.45Å; F736-F783 HydrophobicContact CG-CE2 4.5Å; F736-F783 AromaticContact CG-CG 3.77Å; F736-F783 HydrophobicContact CG-CG 3.77Å; F736-A795 PolarHBondContact N-O 3.38Å; F736-L796 HydrophobicContact CB-CD2 4.17Å; F736-L796 HydrophobicContact CD1-CD2 4.4Å; F736-L796 CarbonylContact O-C 3.56Å; F736-L796 VanDerWaalsContact O-CA 3.29Å; F736-L796 WeakPolarHBondContact O-CA 3.35Å; F736-S797 PolarHBondContact O-N 3.11Å
737	H	87.4	Confident	75.6	Confident	41 Å²	41	57.3 Å²	57.3	19%	0.19	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	143.2	173	177.2	-114.7	0	0	0	110.9	S797 D799	H737-S797 PolarHBondContact CD2-O 3.17Å; H737-D799 IonicContact CD2-OD1 2.63Å; H737-D799 IonicContact CE1-OD1 2.92Å; H737-D799 IonicContact NE2-OD1 3.42Å; H737-D799 PolarHBondContact NE2-OD1 3.25Å
738	I	85.8	Confident	78.2	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.036	27%	0.271	C	S	.	.			trans	-136	105.6	-179.9	-57.1	162	0	0	0	107.2	F736 G740 F741 V780 L796	F736-I738 HydrophobicContact CD1-CD1 4.08Å; F736-I738 HydrophobicContact CD1-CG1 3.65Å; F736-I738 HydrophobicContact CE1-CD1 4.26Å; F736-I738 HydrophobicContact CE1-CG1 3.6Å; I738-G740 PolarHBondContact O-N 3.45Å; I738-F741 HydrophobicContact CB-CB 3.63Å; I738-F741 HydrophobicContact CB-CG 4.46Å; I738-F741 HydrophobicContact CD1-CB 4.4Å; I738-F741 HydrophobicContact CD1-CG 4.46Å; I738-F741 HydrophobicContact CG2-CB 3.76Å; I738-F741 VanDerWaalsContact O-CB 3.28Å; I738-F741 WeakPolarHBondContact O-CB 3.45Å; I738-F741 PolarHBondContact O-N 3.06Å; I738-V780 HydrophobicContact CD1-CG2 3.59Å; I738-V780 HydrophobicContact CG1-CG2 4.24Å; I738-L796 HydrophobicContact CD1-CD1 4.3Å; I738-L796 HydrophobicContact CD1-CD2 4.07Å
739	N	80.8	Confident	79.7	Confident	32 Å²	32	50.4 Å²	50.4	17%	0.171	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	132.6	174.4	-47.8	76.8	0	0	0	110.1	R578 S579 D581 F741	R578-N739 PolarHBondContact NH1-OD1 2.93Å; R578-N739 VanDerWaalsContact NH1-OD1 3.1Å; R578-N739 PolarHBondContact NH2-ND2 2.81Å; R578-N739 PolarHBondContact NH2-OD1 2.94Å; S579-N739 PolarHBondContact O-ND2 3.43Å; D581-N739 PolarHBondContact OD1-ND2 3.45Å; N739-F741 VanDerWaalsContact C-N 3.28Å; N739-F741 PolarHBondContact O-N 3.48Å
740	G	83.4	Confident	80.4	Confident	11 Å²	11	45.3 Å²	45.3	11%	0.113	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	3.6	-175.7	0	0	0	0	0	115.6	I738 Y742 P773 D799	I738-G740 PolarHBondContact O-N 3.45Å; G740-Y742 WeakPolarHBondContact O-CD2 3.35Å; G740-P773 VanDerWaalsContact C-CG 3.42Å; G740-P773 WeakPolarHBondContact O-CD 3.41Å; G740-P773 VanDerWaalsContact O-CG 3.24Å; G740-P773 WeakPolarHBondContact O-CG 3.46Å; G740-D799 PolarHBondContact N-OD2 2.81Å
741	F	92.5	Very high	80.2	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.257	C	S	.	.			trans	-76.5	120.8	166	165.6	-125.5	0	0	0	109.6	I738 N739 A743 L770 L771 I772 L796 S797 A798 D799	I738-F741 HydrophobicContact CB-CB 3.63Å; I738-F741 HydrophobicContact CB-CG 4.46Å; I738-F741 HydrophobicContact CD1-CB 4.4Å; I738-F741 HydrophobicContact CD1-CG 4.46Å; I738-F741 HydrophobicContact CG2-CB 3.76Å; I738-F741 VanDerWaalsContact O-CB 3.28Å; I738-F741 WeakPolarHBondContact O-CB 3.45Å; I738-F741 PolarHBondContact O-N 3.06Å; N739-F741 VanDerWaalsContact C-N 3.28Å; N739-F741 PolarHBondContact O-N 3.48Å; F741-A743 HydrophobicContact CE2-CB 4.42Å; F741-A743 HydrophobicContact CZ-CB 3.97Å; F741-L770 HydrophobicContact CE2-CB 4.08Å; F741-L770 HydrophobicContact CE2-CD2 4.31Å; F741-L770 HydrophobicContact CZ-CD2 4.15Å; F741-L771 WeakPolarHBondContact CA-O 3.39Å; F741-L771 WeakPolarHBondContact CD2-O 3.46Å; F741-I772 HydrophobicContact CD2-CG1 3.87Å; F741-I772 HydrophobicContact CE2-CG1 4.08Å; F741-L796 HydrophobicContact CD1-CB 4.11Å; F741-L796 HydrophobicContact CE1-CB 3.49Å; F741-L796 VanDerWaalsContact CE1-CB 3.49Å; F741-L796 HydrophobicContact CE1-CD1 4.31Å; F741-L796 HydrophobicContact CZ-CB 4.15Å; F741-L796 HydrophobicContact CZ-CD1 4.29Å; F741-S797 WeakPolarHBondContact CD1-O 3.49Å; F741-A798 HydrophobicContact CD1-CB 3.78Å; F741-A798 HydrophobicContact CE1-CB 3.72Å; F741-A798 WeakPolarHBondContact O-CA 3.3Å; F741-D799 PolarHBondContact O-N 3.02Å
742	Y	94.4	Very high	79.7	Confident	39 Å²	39	48.5 Å²	48.5	15%	0.153	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.9	176.8	-55.3	-62.3	0	0	0	110.5	G740 L771 D799 C800 N801 F959	G740-Y742 WeakPolarHBondContact O-CD2 3.35Å; Y742-L771 PolarHBondContact N-O 3.1Å; Y742-L771 PolarHBondContact O-N 2.84Å; Y742-D799 HydrophobicContact CD1-CB 3.95Å; Y742-D799 HydrophobicContact CE1-CB 3.69Å; Y742-C800 WeakPolarHBondContact CE1-O 3.44Å; Y742-N801 HydrophobicContact CD1-CB 3.81Å; Y742-N801 HydrophobicContact CG-CB 4.08Å; Y742-F959 HydrophobicContact CD2-CZ 4.3Å; Y742-F959 HydrophobicContact CE2-CZ 4.28Å
743	A	95.6	Very high	78.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.3	172.2	0	0	0	0	0	109.8	F741 E769 L770 A798 G869 V870 V873	F741-A743 HydrophobicContact CE2-CB 4.42Å; F741-A743 HydrophobicContact CZ-CB 3.97Å; A743-E769 WeakPolarHBondContact CA-O 3.36Å; A743-L770 HydrophobicContact CB-CD2 3.9Å; A743-A798 HydrophobicContact CB-CB 4.1Å; A743-G869 WeakPolarHBondContact O-CA 3.34Å; A743-V870 HydrophobicContact CB-CG2 3.57Å; A743-V870 PolarHBondContact O-N 2.82Å; A743-V873 HydrophobicContact CB-CG2 3.51Å
744	H	95.2	Very high	76.6	Confident	11 Å²	11	53.4 Å²	53.4	5%	0.051	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	157.2	177.8	63.3	-107.3	0	0	0	113.4	E769 N801 V867 T868	H744-E769 IonicContact CD2-OE2 3.55Å; H744-E769 IonicContact CE1-OE2 3.6Å; H744-E769 PolarHBondContact N-O 3.38Å; H744-E769 VanDerWaalsContact N-O 3.07Å; H744-E769 WeakPolarHBondContact NE2-CB 3.38Å; H744-E769 IonicContact NE2-OE2 2.72Å; H744-E769 PolarHBondContact NE2-OE2 3.49Å; H744-E769 PolarHBondContact O-N 3.02Å; H744-N801 PolarHBondContact ND1-ND2 2.95Å; H744-V867 HydrophobicContact CB-CG1 4.12Å; H744-T868 CarbonylContact C-O 3.54Å; H744-T868 VanDerWaalsContact CA-O 3.24Å; H744-T868 WeakPolarHBondContact CA-O 3.33Å; H744-T868 WeakPolarHBondContact CB-O 3.37Å
745	L	94.4	Very high	74.1	Confident	14 Å²	14	59.9 Å²	59.9	7%	0.073	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.6	166.3	-64.7	170.3	0	0	0	108.8	V766 I767 V768 V867 T868 I886 I891 V950	L745-V766 HydrophobicContact CB-CG1 4.29Å; L745-V766 HydrophobicContact CD2-CG1 4.07Å; L745-I767 WeakPolarHBondContact CA-O 3.47Å; L745-V768 HydrophobicContact CD2-CG2 4.01Å; L745-V867 CarbonylContact O-C 3.57Å; L745-V867 WeakPolarHBondContact O-CA 3.37Å; L745-T868 PolarHBondContact N-O 2.8Å; L745-T868 PolarHBondContact O-N 3.34Å; L745-I886 HydrophobicContact CD1-CD1 3.95Å; L745-I886 HydrophobicContact CD1-CG1 4.33Å; L745-I891 HydrophobicContact CD2-CD1 3.65Å; L745-I891 HydrophobicContact CG-CD1 3.99Å; L745-V950 HydrophobicContact CD1-CG1 4.13Å; L745-V950 HydrophobicContact CD2-CG1 4.24Å
746	N	91.2	Very high	71.7	Confident	29 Å²	29	65.5 Å²	65.5	16%	0.155	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	122.6	178.4	-169.5	-9	0	0	0	110.2	V748 I767 E769	N746-V748 PolarHBondContact O-N 3.31Å; N746-I767 PolarHBondContact N-O 2.72Å; N746-I767 PolarHBondContact O-N 3.22Å; N746-E769 HydrophobicContact CB-CG 4.37Å; N746-E769 WeakPolarHBondContact CB-OE2 3.46Å; N746-E769 PolarHBondContact ND2-OE2 2.85Å
747	V	86.2	Confident	68.9	Low	40 Å²	40	70 Å²	70	24%	0.242	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	101.2	178.5	-173.4	0	0	0	0	109.5	E764 V766 K866	V747-E764 HydrophobicContact CG1-CB 3.95Å; V747-E764 HydrophobicContact CG1-CG 4.37Å; V747-V766 HydrophobicContact CG2-CG2 4.44Å; V747-K866 PolarHBondContact N-O 3.22Å
748	V	82.7	Confident	66.5	Low	55 Å²	55	72.7 Å²	72.7	33%	0.333	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.9	-178.2	-176.6	0	0	0	0	109.9	N746 D765 I767	N746-V748 PolarHBondContact O-N 3.31Å; V748-D765 PolarHBondContact N-O 2.79Å; V748-D765 PolarHBondContact O-N 3.16Å; V748-I767 HydrophobicContact CB-CD1 4.41Å; V748-I767 HydrophobicContact CG2-CD1 3.82Å; V748-I767 HydrophobicContact CG2-CG1 4.22Å
749	K	70.8	Confident	64.2	Low	145 Å²	145	81.9 Å²	81.9	63%	0.63	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.8	171.3	-75.7	171.4	177	174.4	0	109.2	E751 E764	K749-E751 PolarHBondContact O-N 3.48Å; K749-E751 VanDerWaalsContact O-N 3.07Å; K749-E764 WeakPolarHBondContact CE-OE1 3.49Å; K749-E764 HydrophobicContact CG-CG 3.94Å; K749-E764 IonicContact NZ-OE1 3.49Å
750	S	54.4	Low	62.1	Low	50 Å²	50	86.9 Å²	86.9	35%	0.35	48%	0.478	S	S	.	.			trans	-65.2	108.5	173.9	68.3	0	0	0	0	110.2	S752 I763	S750-S752 PolarHBondContact O-N 3.19Å; S750-I763 PolarHBondContact N-O 3.3Å; S750-I763 PolarHBondContact OG-O 3.39Å
751	E	43.3	Very low	60.1	Low	197 Å²	197	93.5 Å²	93.5	92%	0.921	51%	0.51	S	S	*	.			trans	-71	83.9	162.7	-70	-166.4	161.9	0	0	108.7	K749 D753	K749-E751 PolarHBondContact O-N 3.48Å; K749-E751 VanDerWaalsContact O-N 3.07Å; E751-D753 PolarHBondContact O-N 2.86Å
752	S	41	Very low	57.9	Low	95 Å²	95	96.1 Å²	96.1	66%	0.664	54%	0.537	S	S	*	.			trans	-65.5	119.6	172	56.2	0	0	0	0	109.3	S750 T754	S750-S752 PolarHBondContact O-N 3.19Å; S752-T754 PolarHBondContact O-N 3.13Å
753	D	35.9	Very low	56.2	Low	140 Å²	140	100 Å²	100	75%	0.749	56%	0.559	S	S	*	*			trans	-40.5	130	-179.2	-86.6	-56.1	0	0	0	112.1	E751 N755	E751-D753 PolarHBondContact O-N 2.86Å; D753-N755 VanDerWaalsContact C-N 3.34Å; D753-N755 PolarHBondContact O-N 3.06Å
754	T	31.2	Very low	54.9	Low	132 Å²	132	104.6 Å²	104.6	81%	0.81	58%	0.581	S	S	*	*	S	Bend	trans	-70.1	80.4	-172.2	54.5	0	0	0	0	112.5	S752	S752-T754 PolarHBondContact O-N 3.13Å
755	N	33.7	Very low	54.3	Low	156 Å²	156	107.3 Å²	107.3	83%	0.834	60%	0.596	S	S	*	*			trans	-163.1	49.7	169.1	-97.7	-35.1	0	0	0	114.2	D753	D753-N755 VanDerWaalsContact C-N 3.34Å; D753-N755 PolarHBondContact O-N 3.06Å
756	T	36.9	Very low	54	Low	127 Å²	127	108.5 Å²	108.5	78%	0.779	60%	0.603	S	S	*	*			trans	-158.6	125.5	156.3	-2.5	0	0	0	0	111.7	T758	T756-T758 PolarHBondContact O-N 3.43Å
757	T	30.8	Very low	54	Low	150 Å²	150	108.5 Å²	108.5	92%	0.92	60%	0.603	S	S	*	*			trans	-89.3	77.9	179.7	51.3	0	0	0	0	111.5
758	T	36.3	Very low	54.5	Low	96 Å²	96	106.6 Å²	106.6	59%	0.589	59%	0.592	S	S	*	*			trans	-133.1	142.1	166.5	49.9	0	0	0	0	110.4	T756 N760	T756-T758 PolarHBondContact O-N 3.43Å; T758-N760 PolarHBondContact O-N 3.36Å
759	H	36.9	Very low	55.1	Low	200 Å²	200	104.8 Å²	104.8	93%	0.926	58%	0.579	S	S	*	*			trans	-76.4	59.8	-179.4	-89	-76.6	0	0	0	112.4	N761	H759-N761 PolarHBondContact O-N 3.3Å
760	N	36.4	Very low	56.3	Low	138 Å²	138	98 Å²	98	74%	0.738	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-76.4	121.1	163.4	-72.7	-14.1	0	0	0	108.1	T758 G762	T758-N760 PolarHBondContact O-N 3.36Å; N760-G762 PolarHBondContact O-N 2.99Å
761	N	41.7	Very low	58.2	Low	150 Å²	150	97.6 Å²	97.6	80%	0.802	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-59	126.6	166.3	-65.2	-71.7	0	0	0	107.5	H759 I763	H759-N761 PolarHBondContact O-N 3.3Å; N761-I763 PolarHBondContact O-N 3.46Å
762	G	47.5	Very low	60.6	Low	55 Å²	55	88.2 Å²	88.2	57%	0.567	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-52.6	129.7	-178.8	0	0	0	0	0	110.6	N760 E764	N760-G762 PolarHBondContact O-N 2.99Å; G762-E764 PolarHBondContact O-N 3.21Å
763	I	58.5	Low	62.7	Low	119 Å²	119	83.8 Å²	83.8	61%	0.61	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-74.6	116.1	-178.4	-61.8	176.7	0	0	0	106.8	S750 N761 D765	S750-I763 PolarHBondContact N-O 3.3Å; S750-I763 PolarHBondContact OG-O 3.39Å; N761-I763 PolarHBondContact O-N 3.46Å; I763-D765 PolarHBondContact O-N 2.98Å
764	E	68.3	Low	64.7	Low	98 Å²	98	81.2 Å²	81.2	46%	0.458	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	105	172.9	-73.2	175.6	153.6	0	0	106.9	V747 K749 G762	V747-E764 HydrophobicContact CG1-CB 3.95Å; V747-E764 HydrophobicContact CG1-CG 4.37Å; K749-E764 WeakPolarHBondContact CE-OE1 3.49Å; K749-E764 HydrophobicContact CG-CG 3.94Å; K749-E764 IonicContact NZ-OE1 3.49Å; G762-E764 PolarHBondContact O-N 3.21Å
765	D	81.6	Confident	66.7	Low	68 Å²	68	79.2 Å²	79.2	36%	0.364	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.3	-179.3	-123.8	-37.4	0	0	0	108.8	V748 I763 S952	V748-D765 PolarHBondContact N-O 2.79Å; V748-D765 PolarHBondContact O-N 3.16Å; I763-D765 PolarHBondContact O-N 2.98Å; D765-S952 WeakPolarHBondContact OD1-CB 3.39Å; D765-S952 PolarHBondContact OD1-OG 2.96Å
766	V	88.1	Confident	68.9	Low	38 Å²	38	72.4 Å²	72.4	23%	0.23	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.6	-176.8	-179.2	0	0	0	0	109.9	L745 V747 V950 A951 S952	L745-V766 HydrophobicContact CB-CG1 4.29Å; L745-V766 HydrophobicContact CD2-CG1 4.07Å; V747-V766 HydrophobicContact CG2-CG2 4.44Å; V766-V950 VanDerWaalsContact CB-O 3.31Å; V766-V950 WeakPolarHBondContact CB-O 3.29Å; V766-V950 WeakPolarHBondContact CG1-O 3.42Å; V766-A951 HydrophobicContact CG1-CB 4.41Å; V766-A951 CarbonylContact O-C 3.57Å; V766-A951 WeakPolarHBondContact O-CA 3.47Å; V766-A951 WeakPolarHBondContact O-CB 3.48Å; V766-S952 PolarHBondContact O-N 3.23Å; V766-S952 PolarHBondContact O-OG 3.46Å
767	I	92.6	Very high	71.1	Confident	29 Å²	29	67.5 Å²	67.5	15%	0.149	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134.1	-177.3	-58.2	-173.2	0	0	0	109.7	L745 N746 V748 E769 H955	L745-I767 WeakPolarHBondContact CA-O 3.47Å; N746-I767 PolarHBondContact N-O 2.72Å; N746-I767 PolarHBondContact O-N 3.22Å; V748-I767 HydrophobicContact CB-CD1 4.41Å; V748-I767 HydrophobicContact CG2-CD1 3.82Å; V748-I767 HydrophobicContact CG2-CG1 4.22Å; I767-E769 HydrophobicContact CG2-CG 3.86Å; I767-H955 HydrophobicContact CG2-CB 4.48Å; I767-H955 WeakPolarHBondContact CG2-CD2 3.45Å
768	V	95.5	Very high	73.4	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	119.2	163.9	-172.6	0	0	0	0	108.3	L745 L770 I891 I893 A951 S953 V954 H955	L745-V768 HydrophobicContact CD2-CG2 4.01Å; V768-L770 HydrophobicContact CG1-CD2 3.88Å; V768-L770 HydrophobicContact CG1-CG 4.31Å; V768-I891 HydrophobicContact CG1-CD1 3.82Å; V768-I891 HydrophobicContact CG2-CD1 4.05Å; V768-I893 HydrophobicContact CG1-CD1 4.32Å; V768-A951 HydrophobicContact CG2-CB 3.62Å; V768-S953 PolarHBondContact N-O 2.93Å; V768-V954 HydrophobicContact CB-CG1 4.27Å; V768-V954 HydrophobicContact CB-CG2 4.38Å; V768-V954 HydrophobicContact CG1-CG1 4.41Å; V768-V954 CarbonylContact O-C 3.54Å; V768-V954 WeakPolarHBondContact O-CA 3.48Å; V768-H955 PolarHBondContact O-N 3.02Å
769	E	95.6	Very high	75.5	Confident	17 Å²	17	60.9 Å²	60.9	8%	0.079	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.1	172.9	-58.2	-167.9	103.6	0	0	110.6	A743 H744 N746 I767 K957	A743-E769 WeakPolarHBondContact CA-O 3.36Å; H744-E769 IonicContact CD2-OE2 3.55Å; H744-E769 IonicContact CE1-OE2 3.6Å; H744-E769 PolarHBondContact N-O 3.38Å; H744-E769 VanDerWaalsContact N-O 3.07Å; H744-E769 WeakPolarHBondContact NE2-CB 3.38Å; H744-E769 IonicContact NE2-OE2 2.72Å; H744-E769 PolarHBondContact NE2-OE2 3.49Å; H744-E769 PolarHBondContact O-N 3.02Å; N746-E769 HydrophobicContact CB-CG 4.37Å; N746-E769 WeakPolarHBondContact CB-OE2 3.46Å; N746-E769 PolarHBondContact ND2-OE2 2.85Å; I767-E769 HydrophobicContact CG2-CG 3.86Å; E769-K957 WeakPolarHBondContact OE1-CE 3.42Å; E769-K957 IonicContact OE1-NZ 2.66Å; E769-K957 PolarHBondContact OE1-NZ 3.34Å
770	L	96.6	Very high	77.9	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	99.9	-175.2	-55	176.8	0	0	0	107.5	F741 A743 V768 V873 F875 V954 H955 V956 K957	F741-L770 HydrophobicContact CE2-CB 4.08Å; F741-L770 HydrophobicContact CE2-CD2 4.31Å; F741-L770 HydrophobicContact CZ-CD2 4.15Å; A743-L770 HydrophobicContact CB-CD2 3.9Å; V768-L770 HydrophobicContact CG1-CD2 3.88Å; V768-L770 HydrophobicContact CG1-CG 4.31Å; L770-V873 HydrophobicContact CD2-CB 4.33Å; L770-V873 HydrophobicContact CD2-CG1 4.25Å; L770-V873 HydrophobicContact CD2-CG2 3.76Å; L770-F875 HydrophobicContact CD1-CE1 4.23Å; L770-F875 HydrophobicContact CD1-CZ 3.82Å; L770-V954 HydrophobicContact CD1-CG1 3.65Å; L770-V954 HydrophobicContact CG-CG1 4.25Å; L770-H955 PolarHBondContact N-O 3.16Å; L770-V956 HydrophobicContact CD1-CG2 4.05Å; L770-K957 PolarHBondContact O-N 2.65Å
771	L	94.2	Very high	80.4	Confident	42 Å²	42	45.7 Å²	45.7	22%	0.22	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	107.6	-176.6	-50.9	-174.9	0	0	0	109.2	F741 Y742 K957 F959	F741-L771 WeakPolarHBondContact CA-O 3.39Å; F741-L771 WeakPolarHBondContact CD2-O 3.46Å; Y742-L771 PolarHBondContact N-O 3.1Å; Y742-L771 PolarHBondContact O-N 2.84Å; L771-K957 WeakPolarHBondContact CA-O 3.47Å; L771-K957 HydrophobicContact CD2-CB 3.93Å; L771-K957 HydrophobicContact CD2-CD 3.97Å; L771-F959 HydrophobicContact CB-CD1 4.1Å; L771-F959 HydrophobicContact CB-CE1 3.93Å
772	I	93	Very high	82.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	126.8	-171.8	-47.7	-177.2	0	0	0	111.1	F741 M774 S776 L907 V956 K957 W958 F959	F741-I772 HydrophobicContact CD2-CG1 3.87Å; F741-I772 HydrophobicContact CE2-CG1 4.08Å; I772-M774 PolarHBondContact O-N 2.91Å; I772-S776 WeakPolarHBondContact CG2-OG 3.31Å; I772-L907 HydrophobicContact CD1-CD2 3.32Å; I772-V956 HydrophobicContact CD1-CG1 3.86Å; I772-K957 PolarHBondContact N-O 3.35Å; I772-W958 HydrophobicContact CB-CD2 4.09Å; I772-W958 HydrophobicContact CB-CE3 3.95Å; I772-W958 HydrophobicContact CB-CH2 4.29Å; I772-W958 HydrophobicContact CB-CZ2 4.38Å; I772-W958 HydrophobicContact CB-CZ3 4.06Å; I772-W958 HydrophobicContact CD1-CZ2 4.13Å; I772-W958 HydrophobicContact CG2-CD2 4.33Å; I772-W958 HydrophobicContact CG2-CE3 3.82Å; I772-W958 HydrophobicContact CG2-CH2 3.54Å; I772-W958 HydrophobicContact CG2-CZ2 4.05Å; I772-W958 HydrophobicContact CG2-CZ3 3.41Å; I772-W958 VanDerWaalsContact CG2-CZ3 3.41Å; I772-W958 WeakPolarHBondContact O-CA 3.48Å; I772-F959 VanDerWaalsContact O-CD1 3.3Å; I772-F959 WeakPolarHBondContact O-CD1 3.3Å; I772-F959 PolarHBondContact O-N 2.83Å
773	P	85.1	Confident	84.2	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	127.2	174.5	-27.9	37.2	0	0	0	113	G740 S775 S776 W958 F959 V961	G740-P773 VanDerWaalsContact C-CG 3.42Å; G740-P773 WeakPolarHBondContact O-CD 3.41Å; G740-P773 VanDerWaalsContact O-CG 3.24Å; G740-P773 WeakPolarHBondContact O-CG 3.46Å; P773-S775 WeakPolarHBondContact CB-OG 3.46Å; P773-S775 PolarHBondContact O-N 3.25Å; P773-S776 WeakPolarHBondContact O-CB 3.31Å; P773-S776 PolarHBondContact O-N 2.9Å; P773-S776 PolarHBondContact O-OG 2.88Å; P773-W958 WeakPolarHBondContact O-CZ3 3.39Å; P773-F959 HydrophobicContact CG-CE1 4.04Å; P773-F959 HydrophobicContact CG-CZ 4.11Å; P773-V961 HydrophobicContact CB-CB 4.33Å; P773-V961 HydrophobicContact CB-CG2 3.54Å; P773-V961 HydrophobicContact CG-CG2 3.68Å
774	M	78.8	Confident	85.6	Confident	87 Å²	87	38.9 Å²	38.9	43%	0.429	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-55.8	-32.3	172.9	-81	-65	-69.2	0	0	113.3	I772 S776 C777 W958 F959	I772-M774 PolarHBondContact O-N 2.91Å; M774-S776 PolarHBondContact O-N 3.46Å; M774-C777 WeakPolarHBondContact O-CB 3.37Å; M774-C777 PolarHBondContact O-N 2.89Å; M774-W958 HydrophobicContact CG-CB 4.3Å; M774-W958 HydrophobicContact SD-CB 3.74Å; M774-W958 HydrophobicContact SD-CD2 4.23Å; M774-W958 HydrophobicContact SD-CE3 3.84Å; M774-W958 HydrophobicContact SD-CG 4.23Å; M774-F959 WeakPolarHBondContact CG-O 3.34Å; M774-F959 PolarHBondContact N-O 2.81Å
775	S	71.6	Confident	86.3	Confident	90 Å²	90	39.5 Å²	39.5	63%	0.629	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-60.4	-25.1	172.9	50.1	0	0	0	0	113.4	P773	P773-S775 WeakPolarHBondContact CB-OG 3.46Å; P773-S775 PolarHBondContact O-N 3.25Å
776	S	81.1	Confident	85.9	Confident	12 Å²	12	40.7 Å²	40.7	8%	0.084	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-84	-14	179.2	77.6	0	0	0	0	114.5	I772 P773 M774 A778 S779 V780	I772-S776 WeakPolarHBondContact CG2-OG 3.31Å; P773-S776 WeakPolarHBondContact O-CB 3.31Å; P773-S776 PolarHBondContact O-N 2.9Å; P773-S776 PolarHBondContact O-OG 2.88Å; M774-S776 PolarHBondContact O-N 3.46Å; S776-A778 VanDerWaalsContact C-N 3.35Å; S776-A778 PolarHBondContact O-N 3.25Å; S776-S779 WeakPolarHBondContact O-CA 3.27Å; S776-S779 WeakPolarHBondContact O-CB 3.38Å; S776-S779 PolarHBondContact O-N 2.88Å; S776-V780 PolarHBondContact O-N 3.03Å
777	C	83.9	Confident	84.7	Confident	24 Å²	24	39.6 Å²	39.6	16%	0.162	23%	0.229	C	C	.	.	H	α-helix	trans	-53.2	-46.5	-169.1	-177.9	0	0	0	0	113.2	M774 S779 V780 A781 W958	M774-C777 WeakPolarHBondContact O-CB 3.37Å; M774-C777 PolarHBondContact O-N 2.89Å; C777-S779 PolarHBondContact O-N 3.36Å; C777-V780 PolarHBondContact O-N 3.11Å; C777-A781 WeakPolarHBondContact O-CB 3.24Å; C777-A781 PolarHBondContact O-N 3.36Å; C777-W958 HydrophobicContact CB-CE3 4.4Å; C777-W958 HydrophobicContact CB-CH2 3.92Å; C777-W958 HydrophobicContact CB-CZ3 3.6Å
778	A	77.9	Confident	83.1	Confident	68 Å²	68	38.2 Å²	38.2	56%	0.562	22%	0.222	S	C	*	.	H	α-helix	trans	-68.5	-16	177.7	0	0	0	0	0	114.3	S776 R782	S776-A778 VanDerWaalsContact C-N 3.35Å; S776-A778 PolarHBondContact O-N 3.25Å; A778-R782 VanDerWaalsContact O-CG 3.31Å; A778-R782 WeakPolarHBondContact O-CG 3.34Å; A778-R782 PolarHBondContact O-NE 2.96Å
779	S	80.8	Confident	81.6	Confident	39 Å²	39	41.4 Å²	41.4	27%	0.273	24%	0.238	S	C	.	.	H	α-helix	trans	-90.4	-43.4	173.6	-58.8	0	0	0	0	111.5	S776 C777 A781 R782 F783	S776-S779 WeakPolarHBondContact O-CA 3.27Å; S776-S779 WeakPolarHBondContact O-CB 3.38Å; S776-S779 PolarHBondContact O-N 2.88Å; C777-S779 PolarHBondContact O-N 3.36Å; S779-A781 VanDerWaalsContact C-N 3.33Å; S779-A781 PolarHBondContact O-N 3.43Å; S779-R782 PolarHBondContact O-N 2.92Å; S779-R782 PolarHBondContact OG-NH2 3.18Å; S779-F783 PolarHBondContact O-N 3.06Å
780	V	87.3	Confident	80.3	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-57.7	-45.8	172.7	175.3	0	0	0	0	110.8	F736 I738 S776 C777 R782 F783 L784 L907 W958	F736-V780 HydrophobicContact CE1-CG2 4.29Å; I738-V780 HydrophobicContact CD1-CG2 3.59Å; I738-V780 HydrophobicContact CG1-CG2 4.24Å; S776-V780 PolarHBondContact O-N 3.03Å; C777-V780 PolarHBondContact O-N 3.11Å; V780-R782 PolarHBondContact O-N 3.34Å; V780-F783 PolarHBondContact O-N 3.01Å; V780-L784 HydrophobicContact CG1-CD1 3.73Å; V780-L784 HydrophobicContact CG1-CG 4.36Å; V780-L784 WeakPolarHBondContact O-CB 3.5Å; V780-L784 VanDerWaalsContact O-CG 3.3Å; V780-L784 WeakPolarHBondContact O-CG 3.47Å; V780-L784 PolarHBondContact O-N 3.01Å; V780-L907 HydrophobicContact CG1-CB 4.19Å; V780-W958 HydrophobicContact CB-CH2 4.41Å; V780-W958 HydrophobicContact CG2-CH2 4.38Å
781	A	87.7	Confident	79.2	Confident	19 Å²	19	51.2 Å²	51.2	16%	0.157	29%	0.287	C	S	.	.	H	α-helix	trans	-58.8	-47.9	177.5	0	0	0	0	0	112.4	C777 S779 F783 L784 D785 K908	C777-A781 WeakPolarHBondContact O-CB 3.24Å; C777-A781 PolarHBondContact O-N 3.36Å; S779-A781 VanDerWaalsContact C-N 3.33Å; S779-A781 PolarHBondContact O-N 3.43Å; A781-F783 PolarHBondContact O-N 3.27Å; A781-L784 CarbonylContact O-C 3.55Å; A781-L784 PolarHBondContact O-N 3.34Å; A781-D785 PolarHBondContact O-N 2.87Å; A781-K908 HydrophobicContact CB-CG 4.42Å
782	R	85	Confident	78.9	Confident	162 Å²	162	50.2 Å²	50.2	61%	0.611	28%	0.282	S	S	*	.	H	α-helix	trans	-60.4	-42.3	178.5	-74.7	-179.7	-65.1	137.3	-1	112.8	A778 S779 V780 D785 S786	A778-R782 VanDerWaalsContact O-CG 3.31Å; A778-R782 WeakPolarHBondContact O-CG 3.34Å; A778-R782 PolarHBondContact O-NE 2.96Å; S779-R782 PolarHBondContact O-N 2.92Å; S779-R782 PolarHBondContact OG-NH2 3.18Å; V780-R782 PolarHBondContact O-N 3.34Å; R782-D785 PolarHBondContact O-N 3.09Å; R782-S786 WeakPolarHBondContact O-CB 3.43Å; R782-S786 PolarHBondContact O-N 2.59Å; R782-S786 PolarHBondContact O-OG 3.46Å
783	F	85.9	Confident	78.7	Confident	18 Å²	18	51.6 Å²	51.6	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-46.1	174.9	168	-108.4	0	0	0	111.8	F736 S779 V780 A781 D785 S786 S787 F794 L796	F736-F783 HydrophobicContact CB-CD1 3.69Å; F736-F783 HydrophobicContact CB-CD2 3.8Å; F736-F783 HydrophobicContact CB-CE1 3.65Å; F736-F783 HydrophobicContact CB-CE2 3.76Å; F736-F783 HydrophobicContact CB-CG 3.76Å; F736-F783 HydrophobicContact CB-CZ 3.69Å; F736-F783 HydrophobicContact CD1-CB 4.1Å; F736-F783 HydrophobicContact CD1-CD1 4.06Å; F736-F783 HydrophobicContact CD1-CG 4.06Å; F736-F783 HydrophobicContact CD2-CB 4.35Å; F736-F783 HydrophobicContact CD2-CD2 4.23Å; F736-F783 HydrophobicContact CD2-CG 4.24Å; F736-F783 HydrophobicContact CE1-CB 4.36Å; F736-F783 HydrophobicContact CG-CB 4.12Å; F736-F783 AromaticContact CG-CD1 3.99Å; F736-F783 HydrophobicContact CG-CD1 3.99Å; F736-F783 HydrophobicContact CG-CD2 4.05Å; F736-F783 HydrophobicContact CG-CE1 4.45Å; F736-F783 HydrophobicContact CG-CE2 4.5Å; F736-F783 AromaticContact CG-CG 3.77Å; F736-F783 HydrophobicContact CG-CG 3.77Å; S779-F783 PolarHBondContact O-N 3.06Å; V780-F783 PolarHBondContact O-N 3.01Å; A781-F783 PolarHBondContact O-N 3.27Å; F783-D785 PolarHBondContact O-N 3.26Å; F783-S786 PolarHBondContact O-N 3.17Å; F783-S786 VanDerWaalsContact O-N 3.16Å; F783-S786 PolarHBondContact O-OG 3.13Å; F783-S787 PolarHBondContact O-N 3.29Å; F783-S787 PolarHBondContact O-OG 3.35Å; F783-F794 HydrophobicContact CE1-CB 4.11Å; F783-F794 HydrophobicContact CE1-CD2 4.02Å; F783-F794 HydrophobicContact CE1-CG 4.3Å; F783-F794 HydrophobicContact CZ-CB 4.11Å; F783-L796 HydrophobicContact CE1-CD2 4.33Å
784	L	87.6	Confident	79.1	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-71.5	-15.2	178.9	-63.7	173.6	0	0	0	113.4	V780 A781 A788 M789 F794 V904 L907 K908	V780-L784 HydrophobicContact CG1-CD1 3.73Å; V780-L784 HydrophobicContact CG1-CG 4.36Å; V780-L784 WeakPolarHBondContact O-CB 3.5Å; V780-L784 VanDerWaalsContact O-CG 3.3Å; V780-L784 WeakPolarHBondContact O-CG 3.47Å; V780-L784 PolarHBondContact O-N 3.01Å; A781-L784 CarbonylContact O-C 3.55Å; A781-L784 PolarHBondContact O-N 3.34Å; L784-A788 HydrophobicContact CD2-CB 3.61Å; L784-M789 VanDerWaalsContact O-CG 3.27Å; L784-M789 WeakPolarHBondContact O-CG 3.23Å; L784-F794 HydrophobicContact CD2-CD1 4.07Å; L784-F794 HydrophobicContact CD2-CD2 4.08Å; L784-F794 HydrophobicContact CD2-CE1 3.94Å; L784-F794 HydrophobicContact CD2-CE2 3.94Å; L784-F794 HydrophobicContact CD2-CG 4.15Å; L784-F794 HydrophobicContact CD2-CZ 3.88Å; L784-V904 HydrophobicContact CB-CG1 4.35Å; L784-V904 HydrophobicContact CD1-CG1 4.35Å; L784-L907 HydrophobicContact CD1-CB 3.52Å; L784-L907 HydrophobicContact CD1-CD1 4.1Å; L784-L907 HydrophobicContact CD1-CG 4.48Å; L784-K908 HydrophobicContact CB-CD 4.39Å; L784-K908 HydrophobicContact CB-CG 4.15Å; L784-K908 HydrophobicContact CD1-CG 4.2Å; L784-K908 VanDerWaalsContact O-CE 3.26Å; L784-K908 WeakPolarHBondContact O-CE 3.39Å; L784-K908 PolarHBondContact O-NZ 3.05Å
785	D	83.4	Confident	79.7	Confident	112 Å²	112	47.4 Å²	47.4	60%	0.599	27%	0.269	S	S	*	.	H	α-helix	trans	-85.9	-30.4	168.9	-74.9	-30.3	0	0	0	112.7	A781 R782 F783 K908	A781-D785 PolarHBondContact O-N 2.87Å; R782-D785 PolarHBondContact O-N 3.09Å; F783-D785 PolarHBondContact O-N 3.26Å; D785-K908 VanDerWaalsContact OD1-CE 3.31Å; D785-K908 WeakPolarHBondContact OD1-CE 3.13Å; D785-K908 IonicContact OD1-NZ 3.82Å; D785-K908 PolarHBondContact OD1-NZ 3.18Å
786	S	72.2	Confident	80.8	Confident	92 Å²	92	43.2 Å²	43.2	64%	0.643	24%	0.24	S	C	*	.	H	α-helix	trans	-83.4	-28.7	-172.4	58.7	0	0	0	0	115.8	R782 F783	R782-S786 WeakPolarHBondContact O-CB 3.43Å; R782-S786 PolarHBondContact O-N 2.59Å; R782-S786 PolarHBondContact O-OG 3.46Å; F783-S786 PolarHBondContact O-N 3.17Å; F783-S786 VanDerWaalsContact O-N 3.16Å; F783-S786 PolarHBondContact O-OG 3.13Å
787	S	63.3	Low	81.4	Confident	15 Å²	15	42.7 Å²	42.7	11%	0.105	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-151.5	-37.7	-166.4	45.5	0	0	0	0	115.3	F783 M789	F783-S787 PolarHBondContact O-N 3.29Å; F783-S787 PolarHBondContact O-OG 3.35Å; S787-M789 VanDerWaalsContact C-N 3.34Å; S787-M789 PolarHBondContact O-N 3.14Å
788	A	58.5	Low	81.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-71.3	-19.1	-170.1	0	0	0	0	0	116	L784 S791 M792 F794	L784-A788 HydrophobicContact CD2-CB 3.61Å; A788-S791 PolarHBondContact O-OG 2.95Å; A788-M792 PolarHBondContact O-N 2.97Å; A788-F794 HydrophobicContact CB-CB 3.91Å; A788-F794 HydrophobicContact CB-CD1 3.87Å; A788-F794 HydrophobicContact CB-CG 4.05Å
789	M	63.2	Low	82.6	Confident	67 Å²	67	38.5 Å²	38.5	33%	0.33	20%	0.202	S	C	.	.	H	α-helix	trans	-85.1	-26	-175.6	-69.8	-87.9	70.2	0	0	114	L784 S787 M792 F900 V904	L784-M789 VanDerWaalsContact O-CG 3.27Å; L784-M789 WeakPolarHBondContact O-CG 3.23Å; S787-M789 VanDerWaalsContact C-N 3.34Å; S787-M789 PolarHBondContact O-N 3.14Å; M789-M792 HydrophobicContact CE-SD 4.13Å; M789-F900 HydrophobicContact CE-CD1 4.34Å; M789-F900 HydrophobicContact CE-CE1 3.77Å; M789-V904 HydrophobicContact CE-CB 4.11Å; M789-V904 HydrophobicContact CE-CG1 3.82Å; M789-V904 HydrophobicContact CE-CG2 3.98Å; M789-V904 HydrophobicContact SD-CG1 3.76Å
790	E	69.1	Low	83.1	Confident	194 Å²	194	37.4 Å²	37.4	91%	0.907	20%	0.195	S	C	*	.	H	α-helix	trans	-80.3	-32.5	175.9	-61.5	-169.7	161.1	0	0	111.7
791	S	74.3	Confident	83.2	Confident	31 Å²	31	37.6 Å²	37.6	22%	0.217	20%	0.196	C	C	.	.	H	α-helix	trans	-82.7	-21.7	177	61.5	0	0	0	0	114.1	A788 T793 H878	A788-S791 PolarHBondContact O-OG 2.95Å; S791-T793 WeakPolarHBondContact O-CB 3.31Å; S791-T793 PolarHBondContact O-N 3.32Å; S791-T793 PolarHBondContact O-OG1 3.34Å; S791-T793 PolarHBondContact OG-N 3.43Å; S791-T793 VanDerWaalsContact OG-N 3.16Å; S791-T793 PolarHBondContact OG-O 3.36Å; S791-H878 PolarHBondContact O-CE1 3.37Å
792	M	86.8	Confident	83.1	Confident	22 Å²	22	38 Å²	38	11%	0.108	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	28.7	-164.5	-70.5	-79.9	-75.2	0	0	112.8	A788 M789 G877 F900 H901	A788-M792 PolarHBondContact O-N 2.97Å; M789-M792 HydrophobicContact CE-SD 4.13Å; M792-G877 PolarHBondContact O-N 2.86Å; M792-F900 HydrophobicContact CB-CE1 4.14Å; M792-F900 HydrophobicContact CB-CZ 4.49Å; M792-F900 HydrophobicContact CE-CB 4.36Å; M792-F900 HydrophobicContact CE-CD1 3.57Å; M792-F900 HydrophobicContact CE-CE1 4.19Å; M792-F900 HydrophobicContact CE-CG 4.22Å; M792-F900 HydrophobicContact CG-CE1 4.44Å; M792-F900 WeakPolarHBondContact O-CE2 3.38Å; M792-F900 VanDerWaalsContact O-CZ 3.23Å; M792-F900 WeakPolarHBondContact O-CZ 3.31Å; M792-F900 HydrophobicContact SD-CD1 3.51Å; M792-F900 VanDerWaalsContact SD-CD1 3.51Å; M792-F900 HydrophobicContact SD-CE1 3.56Å; M792-F900 VanDerWaalsContact SD-CE1 3.56Å; M792-H901 WeakPolarHBondContact CE-NE2 3.46Å; M792-H901 PolarHBondContact SD-CE1 3.38Å
793	T	89.1	Confident	83	Confident	30 Å²	30	36.6 Å²	36.6	18%	0.184	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	124	-168.6	-52.3	0	0	0	0	109.6	F708 S791 F875	F708-T793 HydrophobicContact CE1-CG2 3.75Å; F708-T793 HydrophobicContact CZ-CG2 4.18Å; S791-T793 WeakPolarHBondContact O-CB 3.31Å; S791-T793 PolarHBondContact O-N 3.32Å; S791-T793 PolarHBondContact O-OG1 3.34Å; S791-T793 PolarHBondContact OG-N 3.43Å; S791-T793 VanDerWaalsContact OG-N 3.16Å; S791-T793 PolarHBondContact OG-O 3.36Å; T793-F875 WeakPolarHBondContact CA-O 3.38Å
794	F	92.7	Very high	83.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	166.9	177.5	69.1	-85.7	0	0	0	111.2	L734 F783 L784 A788 L796 A874 F875 F900 L903 V904 L907	L734-F794 CarbonylContact O-C 3.48Å; L734-F794 WeakPolarHBondContact O-CA 3.4Å; F783-F794 HydrophobicContact CE1-CB 4.11Å; F783-F794 HydrophobicContact CE1-CD2 4.02Å; F783-F794 HydrophobicContact CE1-CG 4.3Å; F783-F794 HydrophobicContact CZ-CB 4.11Å; L784-F794 HydrophobicContact CD2-CD1 4.07Å; L784-F794 HydrophobicContact CD2-CD2 4.08Å; L784-F794 HydrophobicContact CD2-CE1 3.94Å; L784-F794 HydrophobicContact CD2-CE2 3.94Å; L784-F794 HydrophobicContact CD2-CG 4.15Å; L784-F794 HydrophobicContact CD2-CZ 3.88Å; A788-F794 HydrophobicContact CB-CB 3.91Å; A788-F794 HydrophobicContact CB-CD1 3.87Å; A788-F794 HydrophobicContact CB-CG 4.05Å; F794-L796 HydrophobicContact CD2-CD2 4.16Å; F794-L796 HydrophobicContact CD2-CG 4.26Å; F794-L796 HydrophobicContact CE2-CD1 4.32Å; F794-L796 HydrophobicContact CE2-CD2 4.18Å; F794-L796 HydrophobicContact CE2-CG 4.03Å; F794-A874 CarbonylContact O-C 3.55Å; F794-F875 HydrophobicContact CD1-CB 4.44Å; F794-F875 HydrophobicContact CD2-CD2 4Å; F794-F875 HydrophobicContact CE1-CB 4.11Å; F794-F875 HydrophobicContact CE1-CD2 4.32Å; F794-F875 HydrophobicContact CE1-CG 4.44Å; F794-F875 AromaticContact CE2-CD2 3.44Å; F794-F875 HydrophobicContact CE2-CD2 3.44Å; F794-F875 VanDerWaalsContact CE2-CD2 3.44Å; F794-F875 AromaticContact CE2-CE2 3.87Å; F794-F875 HydrophobicContact CE2-CE2 3.87Å; F794-F875 HydrophobicContact CE2-CG 4.31Å; F794-F875 HydrophobicContact CZ-CB 4.22Å; F794-F875 AromaticContact CZ-CD2 3.62Å; F794-F875 HydrophobicContact CZ-CD2 3.62Å; F794-F875 HydrophobicContact CZ-CE2 4.21Å; F794-F875 HydrophobicContact CZ-CG 4.05Å; F794-F875 PolarHBondContact N-O 2.84Å; F794-F875 VanDerWaalsContact N-O 3.14Å; F794-F875 PolarHBondContact O-N 3.09Å; F794-F900 AromaticContact CD1-CE2 3.99Å; F794-F900 HydrophobicContact CD1-CE2 3.99Å; F794-F900 AromaticContact CD1-CZ 3.71Å; F794-F900 HydrophobicContact CD1-CZ 3.71Å; F794-F900 AromaticContact CE1-CE2 3.69Å; F794-F900 HydrophobicContact CE1-CE2 3.69Å; F794-F900 AromaticContact CE1-CZ 3.62Å; F794-F900 HydrophobicContact CE1-CZ 3.62Å; F794-L903 HydrophobicContact CZ-CD2 4.36Å; F794-V904 HydrophobicContact CE1-CG2 3.9Å; F794-V904 HydrophobicContact CZ-CG2 4.46Å; F794-L907 HydrophobicContact CE2-CD1 4.28Å; F794-L907 HydrophobicContact CZ-CD1 3.86Å
795	A	92.8	Very high	83.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	152	174.6	0	0	0	0	0	111.5	F708 L734 L735 F736 V873 A874	F708-A795 HydrophobicContact CB-CB 4.35Å; F708-A795 HydrophobicContact CD1-CB 3.55Å; F708-A795 HydrophobicContact CE1-CB 3.94Å; F708-A795 HydrophobicContact CG-CB 3.9Å; L734-A795 PolarHBondContact O-N 2.6Å; L735-A795 CarbonylContact C-O 3.54Å; L735-A795 WeakPolarHBondContact CA-O 3.48Å; L735-A795 HydrophobicContact CD1-CB 3.61Å; F736-A795 PolarHBondContact N-O 3.38Å; A795-V873 CarbonylContact C-O 3.59Å; A795-V873 VanDerWaalsContact CA-O 3.3Å; A795-V873 WeakPolarHBondContact CA-O 3.37Å; A795-A874 HydrophobicContact CB-CB 3.87Å
796	L	94.2	Very high	83.7	Confident	2 Å²	2	32 Å²	32	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.1	173.8	-57.7	179.9	0	0	0	108.9	F736 I738 F741 F783 F794 F872 V873 F875	F736-L796 HydrophobicContact CB-CD2 4.17Å; F736-L796 HydrophobicContact CD1-CD2 4.4Å; F736-L796 CarbonylContact O-C 3.56Å; F736-L796 VanDerWaalsContact O-CA 3.29Å; F736-L796 WeakPolarHBondContact O-CA 3.35Å; I738-L796 HydrophobicContact CD1-CD1 4.3Å; I738-L796 HydrophobicContact CD1-CD2 4.07Å; F741-L796 HydrophobicContact CD1-CB 4.11Å; F741-L796 HydrophobicContact CE1-CB 3.49Å; F741-L796 VanDerWaalsContact CE1-CB 3.49Å; F741-L796 HydrophobicContact CE1-CD1 4.31Å; F741-L796 HydrophobicContact CZ-CB 4.15Å; F741-L796 HydrophobicContact CZ-CD1 4.29Å; F783-L796 HydrophobicContact CE1-CD2 4.33Å; F794-L796 HydrophobicContact CD2-CD2 4.16Å; F794-L796 HydrophobicContact CD2-CG 4.26Å; F794-L796 HydrophobicContact CE2-CD1 4.32Å; F794-L796 HydrophobicContact CE2-CD2 4.18Å; F794-L796 HydrophobicContact CE2-CG 4.03Å; L796-F872 CarbonylContact O-C 3.57Å; L796-F872 VanDerWaalsContact O-CA 3.27Å; L796-F872 WeakPolarHBondContact O-CA 3.31Å; L796-F872 WeakPolarHBondContact O-CB 3.28Å; L796-V873 PolarHBondContact N-O 3.21Å; L796-V873 PolarHBondContact O-N 3.37Å; L796-F875 HydrophobicContact CD1-CE2 4.27Å; L796-F875 HydrophobicContact CG-CE2 4.36Å
797	S	93.5	Very high	84.8	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	130.5	172.4	-179.1	0	0	0	0	109.5	H665 L666 F736 H737 F741	H665-S797 WeakPolarHBondContact O-CB 3.18Å; H665-S797 PolarHBondContact O-OG 2.9Å; L666-S797 WeakPolarHBondContact CG-OG 3.39Å; F736-S797 PolarHBondContact O-N 3.11Å; H737-S797 PolarHBondContact CD2-O 3.17Å; F741-S797 WeakPolarHBondContact CD1-O 3.49Å
798	A	94	Very high	86.4	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.			trans	-110.8	148.7	-172	0	0	0	0	0	112.1	S668 F741 A743 S871	S668-A798 WeakPolarHBondContact CB-O 3.3Å; S668-A798 PolarHBondContact OG-O 2.84Å; F741-A798 HydrophobicContact CD1-CB 3.78Å; F741-A798 HydrophobicContact CE1-CB 3.72Å; F741-A798 WeakPolarHBondContact O-CA 3.3Å; A743-A798 HydrophobicContact CB-CB 4.1Å; A798-S871 PolarHBondContact N-O 3.23Å
799	D	92.8	Very high	88.1	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.021	14%	0.144	C	C	.	.			trans	-79.4	158.3	176.4	-81.4	15.1	0	0	0	111.4	H580 S668 H737 G740 F741 Y742 N801	H580-D799 WeakPolarHBondContact CB-OD1 3.49Å; H580-D799 VanDerWaalsContact CE1-CB 3.47Å; H580-D799 WeakPolarHBondContact CE1-CB 3.49Å; H580-D799 IonicContact CE1-OD2 3.82Å; H580-D799 VanDerWaalsContact CG-CG 3.42Å; H580-D799 IonicContact CG-OD1 2.69Å; H580-D799 IonicContact CG-OD2 3.25Å; H580-D799 WeakPolarHBondContact ND1-CB 3.44Å; H580-D799 IonicContact ND1-OD1 2.79Å; H580-D799 IonicContact ND1-OD2 3.99Å; H580-D799 PolarHBondContact ND1-OD2 2.9Å; S668-D799 WeakPolarHBondContact OG-CA 3.4Å; H737-D799 IonicContact CD2-OD1 2.63Å; H737-D799 IonicContact CE1-OD1 2.92Å; H737-D799 IonicContact NE2-OD1 3.42Å; H737-D799 PolarHBondContact NE2-OD1 3.25Å; G740-D799 PolarHBondContact N-OD2 2.81Å; F741-D799 PolarHBondContact O-N 3.02Å; Y742-D799 HydrophobicContact CD1-CB 3.95Å; Y742-D799 HydrophobicContact CE1-CB 3.69Å; D799-N801 PolarHBondContact O-N 3.24Å
800	C	91	Very high	89.5	Confident	16 Å²	16	24.5 Å²	24.5	11%	0.108	13%	0.128	C	C	.	.			trans	-66.4	117.5	174.9	-66.2	0	0	0	0	110.2	H580 S668 Y742 P802	H580-C800 PolarHBondContact CE1-N 3.04Å; H580-C800 PolarHBondContact NE2-N 3.44Å; H580-C800 VanDerWaalsContact NE2-N 3.15Å; S668-C800 WeakPolarHBondContact CB-SG 3.35Å; S668-C800 PolarHBondContact OG-N 3.28Å; S668-C800 VanDerWaalsContact OG-N 3.1Å; S668-C800 PolarHBondContact OG-SG 2.96Å; S668-C800 VanDerWaalsContact OG-SG 3.33Å; Y742-C800 WeakPolarHBondContact CE1-O 3.44Å; C800-P802 VanDerWaalsContact O-CD 3.31Å; C800-P802 WeakPolarHBondContact O-CD 3.22Å
801	N	89.6	Confident	90.5	Very high	5 Å²	5	16.1 Å²	16.1	3%	0.027	9%	0.091	C	C	.	.			trans	-79.9	112.1	-174.5	179.8	-2.8	0	0	0	111.4	Y742 H744 D799 M803 S804 H807	Y742-N801 HydrophobicContact CD1-CB 3.81Å; Y742-N801 HydrophobicContact CG-CB 4.08Å; H744-N801 PolarHBondContact ND1-ND2 2.95Å; D799-N801 PolarHBondContact O-N 3.24Å; N801-M803 PolarHBondContact O-N 3.33Å; N801-M803 VanDerWaalsContact O-N 3.11Å; N801-M803 WeakPolarHBondContact OD1-CB 3.28Å; N801-M803 PolarHBondContact OD1-N 2.89Å; N801-S804 WeakPolarHBondContact CB-OG 3.47Å; N801-S804 PolarHBondContact ND2-OG 3.11Å; N801-S804 VanDerWaalsContact ND2-OG 3.16Å; N801-S804 PolarHBondContact O-N 2.56Å; N801-S804 VanDerWaalsContact O-N 3.13Å; N801-H807 PolarHBondContact N-NE2 2.92Å; N801-H807 PolarHBondContact O-CE1 3.07Å; N801-H807 VanDerWaalsContact O-CE1 3.28Å
802	P	85.6	Confident	91	Very high	29 Å²	29	16 Å²	16	19%	0.188	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.4	-178.2	28.1	-36	0	0	0	113.6	T635 H636 C800	T635-P802 HydrophobicContact CG2-CB 3.84Å; H636-P802 PolarHBondContact NE2-O 3.24Å; C800-P802 VanDerWaalsContact O-CD 3.31Å; C800-P802 WeakPolarHBondContact O-CD 3.22Å
803	M	84.4	Confident	90.4	Very high	131 Å²	131	16.3 Å²	16.3	65%	0.645	9%	0.091	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-3	-180	-55.8	-64.3	116.6	0	0	113.7	N801	N801-M803 PolarHBondContact O-N 3.33Å; N801-M803 VanDerWaalsContact O-N 3.11Å; N801-M803 WeakPolarHBondContact OD1-CB 3.28Å; N801-M803 PolarHBondContact OD1-N 2.89Å
804	S	89	Confident	89.2	Confident	3 Å²	3	20.2 Å²	20.2	2%	0.021	11%	0.105	C	C	.	.			trans	-85	137.4	178.2	-65.5	0	0	0	0	112.2	Y681 N801 S806 V867 G869	Y681-S804 PolarHBondContact OH-O 3.22Å; N801-S804 WeakPolarHBondContact CB-OG 3.47Å; N801-S804 PolarHBondContact ND2-OG 3.11Å; N801-S804 VanDerWaalsContact ND2-OG 3.16Å; N801-S804 PolarHBondContact O-N 2.56Å; N801-S804 VanDerWaalsContact O-N 3.13Å; S804-S806 VanDerWaalsContact CB-O 3.31Å; S804-S806 WeakPolarHBondContact CB-O 3.47Å; S804-S806 PolarHBondContact O-N 2.85Å; S804-V867 CarbonylContact C-O 3.45Å; S804-V867 WeakPolarHBondContact CA-O 3.32Å; S804-V867 VanDerWaalsContact CB-O 3.27Å; S804-V867 WeakPolarHBondContact CB-O 3.34Å; S804-G869 PolarHBondContact OG-N 2.87Å
805	D	89.9	Confident	87.3	Confident	32 Å²	32	23.3 Å²	23.3	17%	0.171	12%	0.121	C	C	.	.	S	Bend	trans	-77.2	-13.3	173.9	61.1	48.2	0	0	0	113.2	S859 I860 K866 V867	D805-S859 VanDerWaalsContact O-CA 3.3Å; D805-S859 WeakPolarHBondContact O-CA 3.43Å; D805-S859 PolarHBondContact O-OG 2.85Å; D805-I860 HydrophobicContact CB-CG2 4.32Å; D805-I860 WeakPolarHBondContact O-CG2 3.3Å; D805-I860 PolarHBondContact O-N 2.88Å; D805-K866 PolarHBondContact OD1-N 3.17Å; D805-K866 WeakPolarHBondContact OD2-CA 3.2Å; D805-K866 VanDerWaalsContact OD2-CB 3.3Å; D805-K866 WeakPolarHBondContact OD2-CB 3.22Å; D805-K866 PolarHBondContact OD2-N 2.59Å; D805-V867 PolarHBondContact N-O 2.69Å; D805-V867 PolarHBondContact OD2-N 3.48Å
806	S	92.6	Very high	84.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	163.5	-177.1	49.1	0	0	0	0	111.9	Y681 S804 I858 V867 T868 G869	Y681-S806 WeakPolarHBondContact OH-CA 3.09Å; Y681-S806 PolarHBondContact OH-N 3Å; S804-S806 VanDerWaalsContact CB-O 3.31Å; S804-S806 WeakPolarHBondContact CB-O 3.47Å; S804-S806 PolarHBondContact O-N 2.85Å; S806-I858 CarbonylContact C-O 3.56Å; S806-I858 WeakPolarHBondContact CA-O 3.21Å; S806-I858 VanDerWaalsContact CB-O 3.23Å; S806-I858 WeakPolarHBondContact CB-O 3.46Å; S806-V867 PolarHBondContact N-O 3.24Å; S806-T868 CarbonylContact O-C 3.48Å; S806-T868 WeakPolarHBondContact O-CA 3.5Å; S806-T868 WeakPolarHBondContact OG-CA 3.47Å; S806-T868 WeakPolarHBondContact OG-CB 3.3Å; S806-T868 PolarHBondContact OG-OG1 3.04Å; S806-G869 PolarHBondContact O-N 2.92Å
807	H	95	Very high	82	Confident	3 Å²	3	35.3 Å²	35.3	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.2	172.9	-81.1	80.5	0	0	0	110.5	L672 Y681 N801 A857 I858 G869	L672-H807 HydrophobicContact CD1-CB 3.95Å; L672-H807 HydrophobicContact CD2-CB 3.63Å; L672-H807 HydrophobicContact CG-CB 4.42Å; Y681-H807 AromaticContact CE2-ND1 3.97Å; Y681-H807 AromaticContact CZ-ND1 3.73Å; Y681-H807 PolarHBondContact OH-ND1 3.18Å; N801-H807 PolarHBondContact N-NE2 2.92Å; N801-H807 PolarHBondContact O-CE1 3.07Å; N801-H807 VanDerWaalsContact O-CE1 3.28Å; H807-A857 CarbonylContact O-C 3.43Å; H807-A857 WeakPolarHBondContact O-CA 3.13Å; H807-A857 WeakPolarHBondContact O-CB 3.48Å; H807-I858 HydrophobicContact CB-CG1 4.35Å; H807-I858 PolarHBondContact N-O 3.27Å; H807-I858 PolarHBondContact O-N 3.15Å; H807-G869 WeakPolarHBondContact CA-O 3.22Å
808	L	95.2	Very high	79	Confident	13 Å²	13	45 Å²	45	7%	0.068	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	145.6	165.1	-60	-174.6	0	0	0	110.6	E856 A857 T868 G869 V870 I886 D889	L808-E856 WeakPolarHBondContact CA-O 3.41Å; L808-A857 HydrophobicContact CD2-CB 4.28Å; L808-T868 HydrophobicContact CD2-CG2 3.98Å; L808-T868 HydrophobicContact CG-CG2 4.08Å; L808-G869 PolarHBondContact N-O 3.36Å; L808-V870 HydrophobicContact CD1-CG1 3.71Å; L808-V870 HydrophobicContact CG-CG1 4.08Å; L808-I886 HydrophobicContact CD1-CD1 4.19Å; L808-I886 HydrophobicContact CD1-CG1 4.12Å; L808-I886 HydrophobicContact CD1-CG2 3.65Å; L808-D889 HydrophobicContact CB-CB 4.14Å
809	V	94.9	Very high	75.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	124.8	-177.6	-170.3	0	0	0	0	109.6	L672 N673 K676 E856 I858	L672-V809 HydrophobicContact CB-CG1 4.44Å; L672-V809 HydrophobicContact CB-CG2 4.11Å; N673-V809 HydrophobicContact CB-CG1 4.41Å; N673-V809 VanDerWaalsContact CG-CG1 3.49Å; N673-V809 WeakPolarHBondContact ND2-CG1 3.35Å; N673-V809 WeakPolarHBondContact OD1-CG1 3.36Å; K676-V809 HydrophobicContact CB-CG1 4.48Å; K676-V809 HydrophobicContact CD-CG1 4.19Å; V809-E856 PolarHBondContact N-O 3.31Å; V809-E856 PolarHBondContact O-N 3.11Å; V809-I858 HydrophobicContact CG2-CB 4.38Å; V809-I858 HydrophobicContact CG2-CD1 4.17Å; V809-I858 HydrophobicContact CG2-CG1 3.79Å; V809-I858 HydrophobicContact CG2-CG2 4.01Å
810	C	93	Very high	72.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.7	175.4	179.4	0	0	0	0	109.8	N673 F695 E854 E888 D889	N673-C810 PolarHBondContact ND2-O 3.11Å; N673-C810 PolarHBondContact OD1-O 3.27Å; F695-C810 WeakPolarHBondContact CZ-O 3.27Å; C810-E854 CarbonylContact C-O 3.58Å; C810-E854 WeakPolarHBondContact CA-O 3.45Å; C810-E888 HydrophobicContact CB-CB 4.05Å; C810-D889 HydrophobicContact CB-CB 3.91Å; C810-D889 WeakPolarHBondContact CB-OD2 3.26Å; C810-D889 PolarHBondContact N-OD2 2.94Å
811	S	89.9	Confident	69.7	Low	17 Å²	17	66.9 Å²	66.9	12%	0.119	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.1	176.8	-73.6	0	0	0	0	111.9	N673 K676 E854	N673-S811 PolarHBondContact OD1-OG 2.95Å; K676-S811 PolarHBondContact NZ-OG 2.98Å; S811-E854 PolarHBondContact N-O 3.37Å; S811-E854 PolarHBondContact O-N 2.85Å
812	Q	86	Confident	66.8	Low	29 Å²	29	73 Å²	73	14%	0.136	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	105.2	179.4	-174.4	175.9	-1.3	0	0	110	F695 D696 F853	F695-Q812 VanDerWaalsContact CA-OE1 3.24Å; F695-Q812 HydrophobicContact CD1-CB 3.9Å; F695-Q812 HydrophobicContact CE1-CB 4.16Å; D696-Q812 PolarHBondContact O-NE2 3.13Å; Q812-F853 HydrophobicContact CB-CD1 4.14Å; Q812-F853 HydrophobicContact CB-CE1 3.84Å; Q812-F853 HydrophobicContact CG-CD1 4.4Å; Q812-F853 HydrophobicContact CG-CE1 3.81Å; Q812-F853 HydrophobicContact CG-CZ 4.08Å
813	S	73.9	Confident	64.1	Low	28 Å²	28	79.3 Å²	79.3	20%	0.196	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132.4	-179.2	65.8	0	0	0	0	112.1	I815 Q851 T852 E854	S813-I815 PolarHBondContact O-N 3.16Å; S813-Q851 WeakPolarHBondContact O-CA 3.49Å; S813-T852 PolarHBondContact N-O 3.45Å; S813-T852 PolarHBondContact O-N 2.79Å; S813-T852 PolarHBondContact OG-O 2.81Å; S813-T852 PolarHBondContact OG-OG1 2.85Å; S813-E854 WeakPolarHBondContact CB-OE1 3.44Å; S813-E854 PolarHBondContact OG-OE1 3.23Å
814	K	64.1	Low	61.4	Low	112 Å²	112	81 Å²	81	49%	0.487	41%	0.405	S	S	.	.			trans	-86	92.1	172	-65.3	-163.5	178	-174	0	109	D696 L816 Q851	D696-K814 IonicContact OD2-NZ 3.56Å; D696-K814 PolarHBondContact OD2-NZ 2.83Å; K814-L816 VanDerWaalsContact C-N 3.34Å; K814-L816 PolarHBondContact O-N 3.23Å; K814-Q851 HydrophobicContact CG-CG 4.38Å
815	I	51.9	Low	58.5	Low	66 Å²	66	87.8 Å²	87.8	34%	0.338	44%	0.441	S	S	.	.			trans	-66.5	97.5	167.8	-58	-176.4	0	0	0	108.1	S813 L817 C849 T852	S813-I815 PolarHBondContact O-N 3.16Å; I815-L817 PolarHBondContact O-N 3.05Å; I815-L817 VanDerWaalsContact O-N 3.15Å; I815-C849 PolarHBondContact O-SG 2.79Å; I815-T852 HydrophobicContact CD1-CG2 3.73Å; I815-T852 VanDerWaalsContact CD1-OG1 3.28Å; I815-T852 WeakPolarHBondContact CD1-OG1 3.25Å
816	L	40.4	Very low	55.5	Low	150 Å²	150	95 Å²	95	79%	0.785	47%	0.471	S	S	*	.			trans	-62.3	110.2	154.2	-73.8	169.1	0	0	0	107	K814 K818	K814-L816 VanDerWaalsContact C-N 3.34Å; K814-L816 PolarHBondContact O-N 3.23Å; L816-K818 PolarHBondContact O-N 3.25Å
817	L	34.6	Very low	52.3	Low	104 Å²	104	101.6 Å²	101.6	55%	0.545	51%	0.505	S	S	.	.			trans	-54.7	112.9	168.8	-74	179.7	0	0	0	107.7	I815 E819 N848	I815-L817 PolarHBondContact O-N 3.05Å; I815-L817 VanDerWaalsContact O-N 3.15Å; L817-E819 PolarHBondContact O-N 2.86Å; L817-E819 VanDerWaalsContact O-N 3.11Å; L817-N848 HydrophobicContact CD1-CB 4.41Å; L817-N848 WeakPolarHBondContact CD1-O 3.43Å
818	K	30.8	Very low	49.1	Very low	203 Å²	203	108.6 Å²	108.6	88%	0.883	54%	0.541	S	S	*	.			trans	-65	114.2	167.2	-77.8	178.1	178.3	169.2	0	106.7	L816 S820	L816-K818 PolarHBondContact O-N 3.25Å; K818-S820 PolarHBondContact O-N 3.29Å; K818-S820 VanDerWaalsContact O-N 3.11Å
819	E	28.3	Very low	45.8	Very low	177 Å²	177	113.6 Å²	113.6	83%	0.827	58%	0.576	S	S	*	*			trans	-47.1	121.8	167.2	-65.2	-178.3	132.3	0	0	108.8	L817 K821	L817-E819 PolarHBondContact O-N 2.86Å; L817-E819 VanDerWaalsContact O-N 3.11Å; E819-K821 PolarHBondContact O-N 3.27Å
820	S	26.4	Very low	42.6	Very low	94 Å²	94	122.6 Å²	122.6	66%	0.657	62%	0.618	S	S	*	*			trans	-59.3	111.7	173.4	48.4	0	0	0	0	108.2	K818 D822	K818-S820 PolarHBondContact O-N 3.29Å; K818-S820 VanDerWaalsContact O-N 3.11Å; S820-D822 PolarHBondContact O-N 2.85Å
821	K	28.8	Very low	39.4	Very low	209 Å²	209	130.1 Å²	130.1	91%	0.909	66%	0.658	S	S	*	*			trans	-73.6	42.6	174.6	-78.1	-164.2	172.2	-173.5	0	113.1	E819 N823	E819-K821 PolarHBondContact O-N 3.27Å; K821-N823 PolarHBondContact O-N 3.5Å
822	D	27.5	Very low	36.4	Very low	134 Å²	134	136.5 Å²	136.5	72%	0.717	70%	0.696	S	S	*	*			trans	-87.8	90.5	161.2	-72.3	-48.8	0	0	0	108.7	S820	S820-D822 PolarHBondContact O-N 2.85Å
823	N	28.9	Very low	33.6	Very low	160 Å²	160	140.5 Å²	140.5	86%	0.856	72%	0.722	S	S	*	*				-167.7	135	121.9	-100.6	-56.1	0	0	0	112.1	K821	K821-N823 PolarHBondContact O-N 3.5Å
824	H	27.4	Very low	31.2	Very low	168 Å²	168	146.3 Å²	146.3	78%	0.778	75%	0.751	S	S	*	*			trans	-70.2	157.1	159.1	-95.7	-97	0	0	0	110.2
825	N	28.6	Very low	29.4	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	76%	0.76	S	S	*	*			trans	80.3	98.5	161.6	-52.5	-37.3	0	0	0	119
826	K	27.5	Very low	28.1	Very low	185 Å²	185	151.1 Å²	151.1	80%	0.804	79%	0.785	S	S	*	*				66	106.4	112.3	-147.4	-167.1	-171.1	-178.4	0	117.4
827	L	26.3	Very low	27.3	Very low	137 Å²	137	152.2 Å²	152.2	72%	0.717	79%	0.788	S	S	*	*				169.9	120.4	108.1	-86.2	163.3	0	0	0	113.9
828	I	27.8	Very low	26.8	Very low	150 Å²	150	152.8 Å²	152.8	77%	0.769	80%	0.795	S	S	*	*			trans	52.5	129.9	138.3	-59.2	176.5	0	0	0	120.9
829	C	25	Very low	26.4	Very low	118 Å²	118	147.7 Å²	147.7	80%	0.797	79%	0.785	S	S	*	*			trans	-91.4	151.3	168	-44.1	0	0	0	0	112.5
830	Q	27.5	Very low	26.3	Very low	190 Å²	190	146.2 Å²	146.2	89%	0.888	78%	0.783	S	S	*	*			trans	-159	150	154	-117.5	170.6	12.3	0	0	112.7
831	N	25.4	Very low	26.4	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	79%	0.789	S	S	*	*			trans	-105.5	141.3	-177.5	-59.7	-21.9	0	0	0	111.4
832	V	28.1	Very low	26.3	Very low	151 Å²	151	143.7 Å²	143.7	92%	0.915	78%	0.779	S	S	*	*			trans	-145	148.7	156.9	-173.6	0	0	0	0	109.8
833	T	26.5	Very low	26.2	Very low	113 Å²	113	147 Å²	147	69%	0.693	78%	0.783	S	S	*	*			trans	-114.6	139.8	-176.5	49.2	0	0	0	0	112.2
834	N	24.4	Very low	26.2	Very low	150 Å²	150	149 Å²	149	80%	0.802	78%	0.784	S	S	*	*				169	146.2	122.8	-88.9	-16.2	0	0	0	117.4
835	S	24.5	Very low	26.2	Very low	96 Å²	96	146 Å²	146	67%	0.671	78%	0.778	S	S	*	*			trans	50	116.6	143.7	66.5	0	0	0	0	124.2
836	Q	25.6	Very low	26.4	Very low	183 Å²	183	146.3 Å²	146.3	86%	0.855	78%	0.779	S	S	*	*				81.7	125.9	126.5	-71.1	-177.2	-15.4	0	0	123.3
837	M	23.2	Very low	26.7	Very low	173 Å²	173	145.5 Å²	145.5	85%	0.852	78%	0.779	S	S	*	*			trans	85.9	122.1	140.7	-87.2	-162.6	154.4	0	0	123.4
838	V	23.5	Very low	27.2	Very low	116 Å²	116	145.3 Å²	145.3	70%	0.703	78%	0.778	S	S	*	*			trans	87.6	113	137.6	174.1	0	0	0	0	120.1
839	S	23.5	Very low	27.7	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	76%	0.759	S	S	*	*			trans	45.7	105.6	153.5	67.5	0	0	0	0	121.4
840	N	26	Very low	28.8	Very low	147 Å²	147	138.2 Å²	138.2	79%	0.786	74%	0.743	S	S	*	*				-164.1	120.4	123	-118.7	-26.2	0	0	0	112.2	N842	N840-N842 PolarHBondContact O-N 3.46Å
841	P	28	Very low	30.3	Very low	118 Å²	118	130 Å²	130	77%	0.766	70%	0.704	S	S	*	*			trans	-95.7	65.2	173.2	37.1	-32.2	0	0	0	111.2
842	N	26.2	Very low	32.5	Very low	131 Å²	131	125 Å²	125	70%	0.701	68%	0.679	S	S	*	*			trans	-158.8	159.1	169.1	-94	-46.2	0	0	0	109	N840	N840-N842 PolarHBondContact O-N 3.46Å
843	Y	25.6	Very low	35.3	Very low	204 Å²	204	119.4 Å²	119.4	80%	0.8	64%	0.643	S	S	*	*			trans	69.9	69.5	-173.5	-58.4	-82.2	0	0	0	116.1	T845	Y843-T845 HydrophobicContact CD1-CG2 4.19Å
844	F	28.7	Very low	38.2	Very low	202 Å²	202	118.4 Å²	118.4	89%	0.886	63%	0.63	S	S	*	*				-108	118.5	118.5	-91.7	-87.1	0	0	0	108	D846	F844-D846 PolarHBondContact O-N 3.31Å
845	T	27.6	Very low	41.5	Very low	105 Å²	105	114.7 Å²	114.7	64%	0.644	61%	0.613	S	S	*	*			trans	-88.3	92	170.3	48.6	0	0	0	0	107.8	Y843 Q847	Y843-T845 HydrophobicContact CD1-CG2 4.19Å; T845-Q847 PolarHBondContact O-N 2.98Å
846	D	34.2	Very low	44.6	Very low	150 Å²	150	113.7 Å²	113.7	80%	0.802	60%	0.598	S	S	*	*			trans	-60	122.5	175.7	-81.7	-27.2	0	0	0	110.1	F844 N848	F844-D846 PolarHBondContact O-N 3.31Å; D846-N848 PolarHBondContact O-N 3.05Å; D846-N848 VanDerWaalsContact O-N 3.09Å
847	Q	34	Very low	47.7	Very low	169 Å²	169	107.4 Å²	107.4	79%	0.79	58%	0.577	S	S	*	*			trans	-81.1	93.2	-174.3	-69.3	-178.8	-17.2	0	0	110.9	T845 C849	T845-Q847 PolarHBondContact O-N 2.98Å; Q847-C849 PolarHBondContact O-N 2.83Å; Q847-C849 VanDerWaalsContact O-N 3.15Å
848	N	35.3	Very low	51	Low	132 Å²	132	100.5 Å²	100.5	71%	0.706	54%	0.544	S	S	*	.			trans	38.6	60	158.8	-65.8	1.7	0	0	0	116	L817 D846 S850	L817-N848 HydrophobicContact CD1-CB 4.41Å; L817-N848 WeakPolarHBondContact CD1-O 3.43Å; D846-N848 PolarHBondContact O-N 3.05Å; D846-N848 VanDerWaalsContact O-N 3.09Å; N848-S850 PolarHBondContact O-N 2.93Å
849	C	38.9	Very low	54.1	Low	54 Å²	54	95.8 Å²	95.8	37%	0.365	52%	0.516	S	S	.	.			trans	-72.5	76.7	165.2	-175	0	0	0	0	109.6	I815 Q847 Q851	I815-C849 PolarHBondContact O-SG 2.79Å; Q847-C849 PolarHBondContact O-N 2.83Å; Q847-C849 VanDerWaalsContact O-N 3.15Å; C849-Q851 PolarHBondContact O-N 2.86Å
850	S	48.3	Very low	57	Low	66 Å²	66	94.8 Å²	94.8	46%	0.462	50%	0.502	S	S	.	.			trans	-66.3	103.9	-179.9	58.6	0	0	0	0	110.3	N848	N848-S850 PolarHBondContact O-N 2.93Å
851	Q	58.2	Low	59.5	Low	17 Å²	17	94.3 Å²	94.3	8%	0.079	50%	0.495	C	S	.	.			trans	-80	143	179.9	-61	-174.6	24.7	0	0	110.7	L699 S813 K814 C849	L699-Q851 VanDerWaalsContact CB-NE2 3.32Å; S813-Q851 WeakPolarHBondContact O-CA 3.49Å; K814-Q851 HydrophobicContact CG-CG 4.38Å; C849-Q851 PolarHBondContact O-N 2.86Å
852	T	72.8	Confident	61.3	Low	52 Å²	52	95.8 Å²	95.8	32%	0.319	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.7	-179.1	38.4	0	0	0	0	110.6	S813 I815	S813-T852 PolarHBondContact N-O 3.45Å; S813-T852 PolarHBondContact O-N 2.79Å; S813-T852 PolarHBondContact OG-O 2.81Å; S813-T852 PolarHBondContact OG-OG1 2.85Å; I815-T852 HydrophobicContact CD1-CG2 3.73Å; I815-T852 VanDerWaalsContact CD1-OG1 3.28Å; I815-T852 WeakPolarHBondContact CD1-OG1 3.25Å
853	F	86.2	Confident	63	Low	34 Å²	34	93 Å²	93	15%	0.149	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	117.7	170.3	-68	-83.3	0	0	0	108.2	W662 F695 Q812 E888	W662-F853 HydrophobicContact CH2-CE1 4.16Å; W662-F853 HydrophobicContact CH2-CZ 4.16Å; W662-F853 HydrophobicContact CZ2-CE1 4.08Å; W662-F853 AromaticContact CZ2-CZ 3.96Å; W662-F853 HydrophobicContact CZ2-CZ 3.96Å; F695-F853 HydrophobicContact CD1-CE1 4.23Å; F695-F853 HydrophobicContact CE1-CE1 4.29Å; Q812-F853 HydrophobicContact CB-CD1 4.14Å; Q812-F853 HydrophobicContact CB-CE1 3.84Å; Q812-F853 HydrophobicContact CG-CD1 4.4Å; Q812-F853 HydrophobicContact CG-CE1 3.81Å; Q812-F853 HydrophobicContact CG-CZ 4.08Å; F853-E888 HydrophobicContact CB-CG 3.96Å
854	E	87.8	Confident	64.8	Low	92 Å²	92	91.4 Å²	91.4	43%	0.43	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	142.4	-176.3	-69.7	175.2	-142.7	0	0	110.7	C810 S811 S813	C810-E854 CarbonylContact C-O 3.58Å; C810-E854 WeakPolarHBondContact CA-O 3.45Å; S811-E854 PolarHBondContact N-O 3.37Å; S811-E854 PolarHBondContact O-N 2.85Å; S813-E854 WeakPolarHBondContact CB-OE1 3.44Å; S813-E854 PolarHBondContact OG-OE1 3.23Å
855	T	92.6	Very high	66.7	Low	71 Å²	71	85.6 Å²	85.6	44%	0.436	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.7	175.6	-64	0	0	0	0	110.2	I886 E888	T855-I886 HydrophobicContact CG2-CG2 3.9Å; T855-E888 WeakPolarHBondContact CB-O 3.3Å; T855-E888 VanDerWaalsContact CG2-O 3.24Å; T855-E888 WeakPolarHBondContact CG2-O 3.46Å; T855-E888 WeakPolarHBondContact OG1-CA 3.44Å; T855-E888 PolarHBondContact OG1-N 3.24Å; T855-E888 PolarHBondContact OG1-O 3.21Å
856	E	91.6	Very high	69.3	Low	76 Å²	76	86.7 Å²	86.7	36%	0.355	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	-178	172.2	-68.5	-178.9	-121.3	0	0	110.4	K676 L808 V809	K676-E856 WeakPolarHBondContact CE-OE2 3.23Å; K676-E856 IonicContact NZ-OE1 2.97Å; K676-E856 PolarHBondContact NZ-OE1 3.27Å; K676-E856 IonicContact NZ-OE2 3.18Å; K676-E856 PolarHBondContact NZ-OE2 3.38Å; L808-E856 WeakPolarHBondContact CA-O 3.41Å; V809-E856 PolarHBondContact N-O 3.31Å; V809-E856 PolarHBondContact O-N 3.11Å
857	A	90.6	Very high	72	Confident	51 Å²	51	80.5 Å²	80.5	42%	0.421	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152	174.4	0	0	0	0	0	111.8	H807 L808	H807-A857 CarbonylContact O-C 3.43Å; H807-A857 WeakPolarHBondContact O-CA 3.13Å; H807-A857 WeakPolarHBondContact O-CB 3.48Å; L808-A857 HydrophobicContact CD2-CB 4.28Å
858	I	91.6	Very high	74.9	Confident	28 Å²	28	72.9 Å²	72.9	14%	0.144	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	152.5	170	60	174.9	0	0	0	110	L672 K676 Y681 S806 H807 V809	L672-I858 HydrophobicContact CD2-CD1 4.05Å; K676-I858 HydrophobicContact CB-CG2 4.02Å; K676-I858 HydrophobicContact CG-CG2 4.2Å; Y681-I858 HydrophobicContact CD2-CB 4.46Å; Y681-I858 HydrophobicContact CD2-CD1 3.97Å; Y681-I858 HydrophobicContact CD2-CG1 3.97Å; Y681-I858 HydrophobicContact CE2-CD1 4.33Å; Y681-I858 HydrophobicContact CE2-CG1 4.05Å; S806-I858 CarbonylContact C-O 3.56Å; S806-I858 WeakPolarHBondContact CA-O 3.21Å; S806-I858 VanDerWaalsContact CB-O 3.23Å; S806-I858 WeakPolarHBondContact CB-O 3.46Å; H807-I858 HydrophobicContact CB-CG1 4.35Å; H807-I858 PolarHBondContact N-O 3.27Å; H807-I858 PolarHBondContact O-N 3.15Å; V809-I858 HydrophobicContact CG2-CB 4.38Å; V809-I858 HydrophobicContact CG2-CD1 4.17Å; V809-I858 HydrophobicContact CG2-CG1 3.79Å; V809-I858 HydrophobicContact CG2-CG2 4.01Å
859	S	89.6	Confident	77.7	Confident	17 Å²	17	66.6 Å²	66.6	12%	0.119	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	152.8	-179.6	176.8	0	0	0	0	111.4	D805 N862	D805-S859 VanDerWaalsContact O-CA 3.3Å; D805-S859 WeakPolarHBondContact O-CA 3.43Å; D805-S859 PolarHBondContact O-OG 2.85Å; S859-N862 PolarHBondContact OG-N 2.81Å
860	I	84.5	Confident	80.4	Confident	74 Å²	74	64.1 Å²	64.1	38%	0.379	33%	0.332	S	S	.	.	S	Bend	trans	-68	-35.9	178.4	-167.6	169.8	0	0	0	113.4	H636 Y681 D805	H636-I860 HydrophobicContact CB-CD1 4.13Å; H636-I860 WeakPolarHBondContact ND1-CD1 3.1Å; Y681-I860 HydrophobicContact CD1-CB 3.64Å; Y681-I860 HydrophobicContact CD1-CD1 4.21Å; Y681-I860 HydrophobicContact CD1-CG1 3.9Å; Y681-I860 HydrophobicContact CE1-CB 3.81Å; Y681-I860 HydrophobicContact CE1-CD1 4.42Å; Y681-I860 HydrophobicContact CE1-CG1 4.37Å; Y681-I860 HydrophobicContact CG-CB 4.17Å; D805-I860 HydrophobicContact CB-CG2 4.32Å; D805-I860 WeakPolarHBondContact O-CG2 3.3Å; D805-I860 PolarHBondContact O-N 2.88Å
861	E	76.9	Confident	82.7	Confident	138 Å²	138	61 Å²	61	65%	0.645	31%	0.311	S	S	*	.	S	Bend	trans	-121.6	-5.6	-174.9	-79.8	179.4	172.2	0	0	113.6	T863	E861-T863 HydrophobicContact CB-CG2 3.78Å; E861-T863 WeakPolarHBondContact CB-OG1 3.27Å; E861-T863 PolarHBondContact O-N 3.19Å; E861-T863 WeakPolarHBondContact OE2-CG2 3.45Å; E861-T863 PolarHBondContact OE2-OG1 2.85Å; E861-T863 VanDerWaalsContact OE2-OG1 3.09Å
862	N	67	Low	84.5	Confident	149 Å²	149	60.2 Å²	60.2	80%	0.797	31%	0.307	S	S	*	.	S	Bend	trans	55.6	25.5	-165.4	-60.3	-59.7	0	0	0	113.8	S859	S859-N862 PolarHBondContact OG-N 2.81Å
863	T	62	Low	85.6	Confident	72 Å²	72	57.7 Å²	57.7	44%	0.442	29%	0.292	S	S	.	.			trans	-84.3	-176.4	176.2	46.1	0	0	0	0	111.4	E861 L865	E861-T863 HydrophobicContact CB-CG2 3.78Å; E861-T863 WeakPolarHBondContact CB-OG1 3.27Å; E861-T863 PolarHBondContact O-N 3.19Å; E861-T863 WeakPolarHBondContact OE2-CG2 3.45Å; E861-T863 PolarHBondContact OE2-OG1 2.85Å; E861-T863 VanDerWaalsContact OE2-OG1 3.09Å; T863-L865 PolarHBondContact O-N 2.98Å
864	R	61.9	Low	86	Confident	171 Å²	171	56.1 Å²	56.1	65%	0.645	29%	0.285	S	S	*	.			trans	-70.4	121	176.9	-81.3	-170.9	173.9	-159.6	-1.3	110.1	K866	R864-K866 PolarHBondContact O-N 2.92Å
865	L	68.9	Low	86.3	Confident	80 Å²	80	51.8 Å²	51.8	42%	0.419	26%	0.264	S	S	.	.			trans	-54.9	128.5	178.9	-37.2	-173.3	0	0	0	110.7	T863	T863-L865 PolarHBondContact O-N 2.98Å
866	K	83.5	Confident	86.3	Confident	127 Å²	127	49 Å²	49	55%	0.552	25%	0.248	S	C	*	.	S	Bend	trans	-119	-37.8	173.6	-179.7	-160.1	169.6	-162.6	0	110.8	V747 D805 R864	V747-K866 PolarHBondContact N-O 3.22Å; D805-K866 PolarHBondContact OD1-N 3.17Å; D805-K866 WeakPolarHBondContact OD2-CA 3.2Å; D805-K866 VanDerWaalsContact OD2-CB 3.3Å; D805-K866 WeakPolarHBondContact OD2-CB 3.22Å; D805-K866 PolarHBondContact OD2-N 2.59Å; R864-K866 PolarHBondContact O-N 2.92Å
867	V	90.3	Very high	86.3	Confident	21 Å²	21	45.3 Å²	45.3	13%	0.127	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	98.6	179	-172.2	0	0	0	0	109.1	H744 L745 S804 D805 S806	H744-V867 HydrophobicContact CB-CG1 4.12Å; L745-V867 CarbonylContact O-C 3.57Å; L745-V867 WeakPolarHBondContact O-CA 3.37Å; S804-V867 CarbonylContact C-O 3.45Å; S804-V867 WeakPolarHBondContact CA-O 3.32Å; S804-V867 VanDerWaalsContact CB-O 3.27Å; S804-V867 WeakPolarHBondContact CB-O 3.34Å; D805-V867 PolarHBondContact N-O 2.69Å; D805-V867 PolarHBondContact OD2-N 3.48Å; S806-V867 PolarHBondContact N-O 3.24Å
868	T	94	Very high	86.1	Confident	9 Å²	9	49.4 Å²	49.4	6%	0.055	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	111.5	-177.5	-52.6	0	0	0	0	110.9	H744 L745 S806 L808	H744-T868 CarbonylContact C-O 3.54Å; H744-T868 VanDerWaalsContact CA-O 3.24Å; H744-T868 WeakPolarHBondContact CA-O 3.33Å; H744-T868 WeakPolarHBondContact CB-O 3.37Å; L745-T868 PolarHBondContact N-O 2.8Å; L745-T868 PolarHBondContact O-N 3.34Å; S806-T868 CarbonylContact O-C 3.48Å; S806-T868 WeakPolarHBondContact O-CA 3.5Å; S806-T868 WeakPolarHBondContact OG-CA 3.47Å; S806-T868 WeakPolarHBondContact OG-CB 3.3Å; S806-T868 PolarHBondContact OG-OG1 3.04Å; L808-T868 HydrophobicContact CD2-CG2 3.98Å; L808-T868 HydrophobicContact CG-CG2 4.08Å
869	G	95.4	Very high	85.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	149.8	174.9	0	0	0	0	0	113	A743 S804 S806 H807 L808	A743-G869 WeakPolarHBondContact O-CA 3.34Å; S804-G869 PolarHBondContact OG-N 2.87Å; S806-G869 PolarHBondContact O-N 2.92Å; H807-G869 WeakPolarHBondContact CA-O 3.22Å; L808-G869 PolarHBondContact N-O 3.36Å
870	V	95.9	Very high	85.7	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	27%	0.273	C	S	.	.			trans	-130.6	145.2	178.9	-53.2	0	0	0	0	110.4	A743 L808 V873 D889 I891	A743-V870 HydrophobicContact CB-CG2 3.57Å; A743-V870 PolarHBondContact O-N 2.82Å; L808-V870 HydrophobicContact CD1-CG1 3.71Å; L808-V870 HydrophobicContact CG-CG1 4.08Å; V870-V873 HydrophobicContact CG2-CG2 4.01Å; V870-D889 CarbonylContact C-O 3.56Å; V870-D889 WeakPolarHBondContact CA-O 3.49Å; V870-D889 WeakPolarHBondContact CB-O 3.49Å; V870-I891 HydrophobicContact CB-CG1 4.38Å; V870-I891 HydrophobicContact CG1-CD1 4Å; V870-I891 HydrophobicContact CG1-CG1 4.03Å; V870-I891 HydrophobicContact CG2-CD1 3.91Å; V870-I891 HydrophobicContact CG2-CG1 4.08Å
871	S	95.3	Very high	85.8	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.007	28%	0.282	C	S	.	.	S	Bend	trans	-83.4	-17.1	-171.3	-59.5	0	0	0	0	114.2	L672 A798 D889	L672-S871 WeakPolarHBondContact CD1-OG 3.44Å; A798-S871 PolarHBondContact N-O 3.23Å; S871-D889 PolarHBondContact N-O 3.38Å
872	F	95.4	Very high	86.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	160.5	172.6	72.5	-86.3	0	0	0	112.1	L666 F704 L705 L796 A874 V887 E888 D889 G890 I891	L666-F872 HydrophobicContact CD1-CB 4.44Å; L666-F872 HydrophobicContact CD2-CB 4.29Å; L666-F872 HydrophobicContact CD2-CD1 3.85Å; L666-F872 HydrophobicContact CD2-CG 4.46Å; F704-F872 AromaticContact CD1-CE2 3.85Å; F704-F872 HydrophobicContact CD1-CE2 3.85Å; F704-F872 AromaticContact CD1-CZ 3.86Å; F704-F872 HydrophobicContact CD1-CZ 3.86Å; F704-F872 AromaticContact CE1-CE2 3.93Å; F704-F872 HydrophobicContact CE1-CE2 3.93Å; F704-F872 HydrophobicContact CE1-CZ 4.36Å; L705-F872 HydrophobicContact CD1-CD1 4.23Å; L705-F872 HydrophobicContact CD1-CE1 4.21Å; L705-F872 HydrophobicContact CD2-CD1 4.11Å; L705-F872 HydrophobicContact CD2-CD2 3.97Å; L705-F872 HydrophobicContact CD2-CE1 4.26Å; L705-F872 HydrophobicContact CD2-CE2 4.15Å; L705-F872 HydrophobicContact CD2-CG 3.95Å; L705-F872 HydrophobicContact CD2-CZ 4.29Å; L705-F872 HydrophobicContact CG-CD1 4.44Å; L705-F872 HydrophobicContact CG-CE1 4.23Å; L705-F872 HydrophobicContact CG-CZ 4.37Å; L796-F872 CarbonylContact O-C 3.57Å; L796-F872 VanDerWaalsContact O-CA 3.27Å; L796-F872 WeakPolarHBondContact O-CA 3.31Å; L796-F872 WeakPolarHBondContact O-CB 3.28Å; F872-A874 HydrophobicContact CD2-CB 4.3Å; F872-A874 HydrophobicContact CE2-CB 4.21Å; F872-V887 WeakPolarHBondContact CZ-O 3.48Å; F872-E888 HydrophobicContact CE1-CB 4.32Å; F872-D889 WeakPolarHBondContact CD1-OD1 3.46Å; F872-D889 WeakPolarHBondContact CE1-OD1 3.47Å; F872-G890 VanDerWaalsContact CE1-CA 3.45Å; F872-G890 CarbonylContact O-C 3.55Å; F872-G890 WeakPolarHBondContact O-CA 3.39Å; F872-I891 PolarHBondContact O-N 3.23Å
873	V	96.3	Very high	87.6	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	123.8	170.1	-174.7	0	0	0	0	109.7	A743 L770 A795 L796 V870 F875 I891 I893	A743-V873 HydrophobicContact CB-CG2 3.51Å; L770-V873 HydrophobicContact CD2-CB 4.33Å; L770-V873 HydrophobicContact CD2-CG1 4.25Å; L770-V873 HydrophobicContact CD2-CG2 3.76Å; A795-V873 CarbonylContact C-O 3.59Å; A795-V873 VanDerWaalsContact CA-O 3.3Å; A795-V873 WeakPolarHBondContact CA-O 3.37Å; L796-V873 PolarHBondContact N-O 3.21Å; L796-V873 PolarHBondContact O-N 3.37Å; V870-V873 HydrophobicContact CG2-CG2 4.01Å; V873-F875 HydrophobicContact CB-CE2 4.23Å; V873-F875 HydrophobicContact CB-CZ 4.22Å; V873-F875 HydrophobicContact CG1-CE1 3.92Å; V873-F875 HydrophobicContact CG1-CE2 3.79Å; V873-F875 HydrophobicContact CG1-CZ 3.43Å; V873-F875 VanDerWaalsContact CG1-CZ 3.43Å; V873-I891 CarbonylContact C-O 3.48Å; V873-I891 WeakPolarHBondContact CA-O 3.32Å; V873-I893 HydrophobicContact CG1-CD1 3.5Å; V873-I893 VanDerWaalsContact CG1-CD1 3.5Å; V873-I893 HydrophobicContact CG1-CG1 4.09Å
874	A	94.8	Very high	89.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141	-179.1	0	0	0	0	0	111.1	F704 F708 F794 A795 F872 I891 Y892 I893	F704-A874 HydrophobicContact CE1-CB 3.95Å; F704-A874 HydrophobicContact CZ-CB 4.49Å; F708-A874 HydrophobicContact CE1-CB 4.04Å; F708-A874 HydrophobicContact CE2-CB 4.15Å; F708-A874 HydrophobicContact CZ-CB 3.66Å; F794-A874 CarbonylContact O-C 3.55Å; A795-A874 HydrophobicContact CB-CB 3.87Å; F872-A874 HydrophobicContact CD2-CB 4.3Å; F872-A874 HydrophobicContact CE2-CB 4.21Å; A874-I891 PolarHBondContact N-O 2.77Å; A874-Y892 HydrophobicContact CB-CD2 3.97Å; A874-I893 PolarHBondContact O-N 2.81Å
875	F	95	Very high	90.6	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	142.4	-174.3	-56.2	-87.4	0	0	0	111.3	L770 T793 F794 L796 V873 I893 M895 F900 L903	L770-F875 HydrophobicContact CD1-CE1 4.23Å; L770-F875 HydrophobicContact CD1-CZ 3.82Å; T793-F875 WeakPolarHBondContact CA-O 3.38Å; F794-F875 HydrophobicContact CD1-CB 4.44Å; F794-F875 HydrophobicContact CD2-CD2 4Å; F794-F875 HydrophobicContact CE1-CB 4.11Å; F794-F875 HydrophobicContact CE1-CD2 4.32Å; F794-F875 HydrophobicContact CE1-CG 4.44Å; F794-F875 AromaticContact CE2-CD2 3.44Å; F794-F875 HydrophobicContact CE2-CD2 3.44Å; F794-F875 VanDerWaalsContact CE2-CD2 3.44Å; F794-F875 AromaticContact CE2-CE2 3.87Å; F794-F875 HydrophobicContact CE2-CE2 3.87Å; F794-F875 HydrophobicContact CE2-CG 4.31Å; F794-F875 HydrophobicContact CZ-CB 4.22Å; F794-F875 AromaticContact CZ-CD2 3.62Å; F794-F875 HydrophobicContact CZ-CD2 3.62Å; F794-F875 HydrophobicContact CZ-CE2 4.21Å; F794-F875 HydrophobicContact CZ-CG 4.05Å; F794-F875 PolarHBondContact N-O 2.84Å; F794-F875 VanDerWaalsContact N-O 3.14Å; F794-F875 PolarHBondContact O-N 3.09Å; L796-F875 HydrophobicContact CD1-CE2 4.27Å; L796-F875 HydrophobicContact CG-CE2 4.36Å; V873-F875 HydrophobicContact CB-CE2 4.23Å; V873-F875 HydrophobicContact CB-CZ 4.22Å; V873-F875 HydrophobicContact CG1-CE1 3.92Å; V873-F875 HydrophobicContact CG1-CE2 3.79Å; V873-F875 HydrophobicContact CG1-CZ 3.43Å; V873-F875 VanDerWaalsContact CG1-CZ 3.43Å; F875-I893 WeakPolarHBondContact CA-O 3.35Å; F875-I893 HydrophobicContact CD1-CB 3.99Å; F875-I893 HydrophobicContact CD1-CD1 4.34Å; F875-I893 HydrophobicContact CD1-CG2 4.28Å; F875-I893 HydrophobicContact CE1-CB 4.35Å; F875-I893 HydrophobicContact CE1-CD1 3.81Å; F875-M895 HydrophobicContact CD1-SD 4.3Å; F875-F900 HydrophobicContact CB-CD2 4.47Å; F875-F900 HydrophobicContact CB-CE2 3.98Å; F875-L903 HydrophobicContact CB-CD2 4.43Å; F875-L903 HydrophobicContact CD1-CD2 3.33Å; F875-L903 HydrophobicContact CE1-CD2 3.55Å; F875-L903 HydrophobicContact CG-CD2 3.86Å; F875-L903 HydrophobicContact CZ-CD2 4.24Å
876	S	92.9	Very high	91.7	Very high	12 Å²	12	34.8 Å²	34.8	8%	0.084	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	130.8	172.1	177.8	0	0	0	0	111.6	Y892 I893 M895	S876-Y892 WeakPolarHBondContact CB-OH 3.3Å; S876-I893 PolarHBondContact N-O 2.82Å; S876-M895 PolarHBondContact O-N 3.29Å
877	G	91.5	Very high	92.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-95.3	9.2	-175.1	0	0	0	0	0	116.3	M792 M895 S897	M792-G877 PolarHBondContact O-N 2.86Å; G877-M895 CarbonylContact C-O 3.55Å; G877-M895 WeakPolarHBondContact CA-O 3.42Å; G877-S897 WeakPolarHBondContact O-CA 3.08Å; G877-S897 WeakPolarHBondContact O-CB 3.42Å; G877-S897 PolarHBondContact O-N 3.01Å
878	H	86.3	Confident	92.3	Very high	137 Å²	137	30.1 Å²	30.1	63%	0.634	16%	0.161	S	C	*	.			trans	-97.6	0.8	-172.7	-69.5	115.6	0	0	0	115.2	S791	S791-H878 PolarHBondContact O-CE1 3.37Å
879	A	86.1	Confident	92.3	Very high	21 Å²	21	29.7 Å²	29.7	17%	0.174	16%	0.159	C	C	.	.			trans	-86.2	145.7	-170	0	0	0	0	0	113.3	Y881 M895 T896	A879-Y881 VanDerWaalsContact C-N 3.3Å; A879-Y881 VanDerWaalsContact CB-O 3.29Å; A879-Y881 WeakPolarHBondContact CB-O 2.86Å; A879-Y881 PolarHBondContact O-N 2.97Å; A879-M895 PolarHBondContact N-O 2.98Å; A879-T896 VanDerWaalsContact O-CA 3.29Å; A879-T896 WeakPolarHBondContact O-CA 3.4Å; A879-T896 WeakPolarHBondContact O-CG2 3.49Å
880	P	85.6	Confident	92.2	Very high	117 Å²	117	29.7 Å²	29.7	76%	0.76	16%	0.159	S	C	*	.	S	Bend	trans	-73.2	-21	178.1	28.6	-34	0	0	0	113.4
881	Y	87.6	Confident	92.2	Very high	145 Å²	145	29.7 Å²	29.7	57%	0.569	16%	0.159	S	C	*	.	S	Bend	trans	-136.7	173.8	174.2	54.1	-98	0	0	0	109.8	A879	A879-Y881 VanDerWaalsContact C-N 3.3Å; A879-Y881 VanDerWaalsContact CB-O 3.29Å; A879-Y881 WeakPolarHBondContact CB-O 2.86Å; A879-Y881 PolarHBondContact O-N 2.97Å
882	C	90.3	Very high	92.2	Very high	11 Å²	11	32.5 Å²	32.5	7%	0.074	17%	0.17	C	C	.	.			trans	-95	138.4	177	-58.8	0	0	0	0	111	S894 K899 I917	C882-S894 VanDerWaalsContact CA-O 3.28Å; C882-S894 WeakPolarHBondContact CA-O 3.38Å; C882-K899 WeakPolarHBondContact SG-CD 3.31Å; C882-K899 PolarHBondContact SG-NZ 2.89Å; C882-I917 HydrophobicContact CB-CG2 4.17Å
883	S	91.6	Very high	92.2	Very high	19 Å²	19	32.7 Å²	32.7	13%	0.133	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	154.1	171.7	53.6	0	0	0	0	112.2	I893 S894 N949	S883-I893 CarbonylContact O-C 3.57Å; S883-I893 WeakPolarHBondContact O-CA 3.36Å; S883-S894 PolarHBondContact N-O 3.42Å; S883-S894 PolarHBondContact O-N 3.43Å; S883-S894 WeakPolarHBondContact OG-CB 3.42Å; S883-N949 WeakPolarHBondContact CA-OD1 3.33Å; S883-N949 WeakPolarHBondContact CB-OD1 3.21Å
884	A	92.4	Very high	92.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	122.3	173.9	0	0	0	0	0	109.3	I891 Y892 I893 I917 N949 V950 A951	A884-I891 HydrophobicContact CB-CG2 4.27Å; A884-Y892 WeakPolarHBondContact CA-O 3.4Å; A884-I893 HydrophobicContact CB-CG1 4.34Å; A884-I917 HydrophobicContact CB-CD1 3.6Å; A884-N949 PolarHBondContact N-OD1 3.2Å; A884-V950 PolarHBondContact O-N 3.02Å; A884-A951 HydrophobicContact CB-CB 4.37Å
885	V	93.1	Very high	92	Very high	56 Å²	56	33.5 Å²	33.5	34%	0.339	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.2	-172	-174.9	0	0	0	0	108.8	I891 Y892	V885-I891 WeakPolarHBondContact O-CA 3.24Å; V885-Y892 PolarHBondContact N-O 2.82Å; V885-Y892 PolarHBondContact O-N 2.9Å
886	I	93.5	Very high	91.9	Very high	53 Å²	53	35.2 Å²	35.2	27%	0.272	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	132.8	172.3	-69.1	164.6	0	0	0	109	L745 L808 T855 G890 V950	L745-I886 HydrophobicContact CD1-CD1 3.95Å; L745-I886 HydrophobicContact CD1-CG1 4.33Å; L808-I886 HydrophobicContact CD1-CD1 4.19Å; L808-I886 HydrophobicContact CD1-CG1 4.12Å; L808-I886 HydrophobicContact CD1-CG2 3.65Å; T855-I886 HydrophobicContact CG2-CG2 3.9Å; I886-G890 WeakPolarHBondContact CA-O 3.44Å; I886-V950 HydrophobicContact CD1-CG1 3.9Å; I886-V950 HydrophobicContact CD1-CG2 4.32Å; I886-V950 HydrophobicContact CG1-CG1 4.14Å; I886-V950 HydrophobicContact CG1-CG2 4.2Å
887	V	91.7	Very high	91.9	Very high	35 Å²	35	37.4 Å²	37.4	21%	0.212	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	123.2	176.3	-174.8	0	0	0	0	108.3	F704 F872 D889 G890	F704-V887 HydrophobicContact CB-CG1 3.74Å; F704-V887 HydrophobicContact CD1-CB 4.46Å; F704-V887 HydrophobicContact CD1-CG1 3.93Å; F704-V887 HydrophobicContact CD2-CG1 3.88Å; F704-V887 HydrophobicContact CE2-CG1 4.49Å; F704-V887 HydrophobicContact CG-CG1 3.57Å; F872-V887 WeakPolarHBondContact CZ-O 3.48Å; V887-D889 PolarHBondContact O-N 3.27Å; V887-G890 PolarHBondContact N-O 2.65Å; V887-G890 CarbonylContact O-C 3.58Å; V887-G890 PolarHBondContact O-N 3.11Å
888	E	92.7	Very high	92	Very high	14 Å²	14	43.2 Å²	43.2	7%	0.065	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	-117.1	-172.7	-62.5	180	-170.4	0	0	111.3	R669 S703 F704 C810 F853 T855 F872	R669-E888 IonicContact CZ-OE2 3.6Å; R669-E888 IonicContact NH1-OE2 3.91Å; R669-E888 PolarHBondContact NH1-OE2 2.95Å; R669-E888 IonicContact NH2-OE2 2.75Å; R669-E888 PolarHBondContact NH2-OE2 3.5Å; S703-E888 VanDerWaalsContact CA-OE1 3.24Å; S703-E888 WeakPolarHBondContact CA-OE1 3.24Å; S703-E888 VanDerWaalsContact CB-OE1 3.3Å; S703-E888 WeakPolarHBondContact CB-OE1 3.37Å; S703-E888 PolarHBondContact OG-OE1 3.03Å; S703-E888 PolarHBondContact OG-OE2 2.88Å; F704-E888 PolarHBondContact N-OE1 3.48Å; C810-E888 HydrophobicContact CB-CB 4.05Å; F853-E888 HydrophobicContact CB-CG 3.96Å; T855-E888 WeakPolarHBondContact CB-O 3.3Å; T855-E888 VanDerWaalsContact CG2-O 3.24Å; T855-E888 WeakPolarHBondContact CG2-O 3.46Å; T855-E888 WeakPolarHBondContact OG1-CA 3.44Å; T855-E888 PolarHBondContact OG1-N 3.24Å; T855-E888 PolarHBondContact OG1-O 3.21Å; F872-E888 HydrophobicContact CE1-CB 4.32Å
889	D	94.4	Very high	92.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	14.3	173	49.5	23.7	0	0	0	113.7	R669 L808 C810 V870 S871 F872 V887	R669-D889 WeakPolarHBondContact CG-OD2 2.97Å; R669-D889 IonicContact CZ-OD1 3.78Å; R669-D889 IonicContact CZ-OD2 3.79Å; R669-D889 IonicContact NE-OD1 3.72Å; R669-D889 PolarHBondContact NE-OD1 2.98Å; R669-D889 IonicContact NE-OD2 2.65Å; R669-D889 PolarHBondContact NE-OD2 3.18Å; R669-D889 IonicContact NH2-OD1 3.31Å; R669-D889 PolarHBondContact NH2-OD1 3.1Å; R669-D889 IonicContact NH2-OD2 2.6Å; R669-D889 PolarHBondContact NH2-OD2 3.07Å; L808-D889 HydrophobicContact CB-CB 4.14Å; C810-D889 HydrophobicContact CB-CB 3.91Å; C810-D889 WeakPolarHBondContact CB-OD2 3.26Å; C810-D889 PolarHBondContact N-OD2 2.94Å; V870-D889 CarbonylContact C-O 3.56Å; V870-D889 WeakPolarHBondContact CA-O 3.49Å; V870-D889 WeakPolarHBondContact CB-O 3.49Å; S871-D889 PolarHBondContact N-O 3.38Å; F872-D889 WeakPolarHBondContact CD1-OD1 3.46Å; F872-D889 WeakPolarHBondContact CE1-OD1 3.47Å; V887-D889 PolarHBondContact O-N 3.27Å
890	G	94.9	Very high	92.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	-173.4	-177.5	0	0	0	0	0	114.2	F872 I886 V887	F872-G890 VanDerWaalsContact CE1-CA 3.45Å; F872-G890 CarbonylContact O-C 3.55Å; F872-G890 WeakPolarHBondContact O-CA 3.39Å; I886-G890 WeakPolarHBondContact CA-O 3.44Å; V887-G890 PolarHBondContact N-O 2.65Å; V887-G890 CarbonylContact O-C 3.58Å; V887-G890 PolarHBondContact O-N 3.11Å
891	I	94.8	Very high	93.1	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.9	178	-53.8	169.2	0	0	0	109.3	L745 V768 V870 F872 V873 A874 A884 V885 I893	L745-I891 HydrophobicContact CD2-CD1 3.65Å; L745-I891 HydrophobicContact CG-CD1 3.99Å; V768-I891 HydrophobicContact CG1-CD1 3.82Å; V768-I891 HydrophobicContact CG2-CD1 4.05Å; V870-I891 HydrophobicContact CB-CG1 4.38Å; V870-I891 HydrophobicContact CG1-CD1 4Å; V870-I891 HydrophobicContact CG1-CG1 4.03Å; V870-I891 HydrophobicContact CG2-CD1 3.91Å; V870-I891 HydrophobicContact CG2-CG1 4.08Å; F872-I891 PolarHBondContact O-N 3.23Å; V873-I891 CarbonylContact C-O 3.48Å; V873-I891 WeakPolarHBondContact CA-O 3.32Å; A874-I891 PolarHBondContact N-O 2.77Å; A884-I891 HydrophobicContact CB-CG2 4.27Å; V885-I891 WeakPolarHBondContact O-CA 3.24Å; I891-I893 HydrophobicContact CG2-CD1 4.23Å; I891-I893 HydrophobicContact CG2-CG1 3.72Å
892	Y	95	Very high	93.4	Very high	60 Å²	60	33.9 Å²	33.9	24%	0.235	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	123.4	167.5	178.4	-120.6	0	0	0	110.5	F704 A874 S876 A884 V885 S894	F704-Y892 HydrophobicContact CE1-CD2 4.36Å; F704-Y892 AromaticContact CZ-CD2 3.65Å; F704-Y892 HydrophobicContact CZ-CD2 3.65Å; F704-Y892 HydrophobicContact CZ-CE2 4.23Å; F704-Y892 AromaticContact CZ-CG 3.83Å; F704-Y892 HydrophobicContact CZ-CG 3.83Å; A874-Y892 HydrophobicContact CB-CD2 3.97Å; S876-Y892 WeakPolarHBondContact CB-OH 3.3Å; A884-Y892 WeakPolarHBondContact CA-O 3.4Å; V885-Y892 PolarHBondContact N-O 2.82Å; V885-Y892 PolarHBondContact O-N 2.9Å; Y892-S894 WeakPolarHBondContact CE1-OG 3.06Å; Y892-S894 PolarHBondContact OH-OG 3.48Å
893	I	95.5	Very high	93.6	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	103.5	-174.5	-55.4	-177.9	0	0	0	108.8	V768 V873 A874 F875 S876 S883 A884 I891 M895 V954	V768-I893 HydrophobicContact CG1-CD1 4.32Å; V873-I893 HydrophobicContact CG1-CD1 3.5Å; V873-I893 VanDerWaalsContact CG1-CD1 3.5Å; V873-I893 HydrophobicContact CG1-CG1 4.09Å; A874-I893 PolarHBondContact O-N 2.81Å; F875-I893 WeakPolarHBondContact CA-O 3.35Å; F875-I893 HydrophobicContact CD1-CB 3.99Å; F875-I893 HydrophobicContact CD1-CD1 4.34Å; F875-I893 HydrophobicContact CD1-CG2 4.28Å; F875-I893 HydrophobicContact CE1-CB 4.35Å; F875-I893 HydrophobicContact CE1-CD1 3.81Å; S876-I893 PolarHBondContact N-O 2.82Å; S883-I893 CarbonylContact O-C 3.57Å; S883-I893 WeakPolarHBondContact O-CA 3.36Å; A884-I893 HydrophobicContact CB-CG1 4.34Å; I891-I893 HydrophobicContact CG2-CD1 4.23Å; I891-I893 HydrophobicContact CG2-CG1 3.72Å; I893-M895 HydrophobicContact CG2-CG 3.92Å; I893-M895 HydrophobicContact CG2-SD 4.33Å; I893-V954 HydrophobicContact CD1-CG1 4.18Å; I893-V954 HydrophobicContact CD1-CG2 3.99Å; I893-V954 HydrophobicContact CG2-CG2 4.18Å
894	S	93.6	Very high	93.7	Very high	14 Å²	14	32.7 Å²	32.7	10%	0.098	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	137.9	172.5	-68.7	0	0	0	0	110.4	C882 S883 Y892	C882-S894 VanDerWaalsContact CA-O 3.28Å; C882-S894 WeakPolarHBondContact CA-O 3.38Å; S883-S894 PolarHBondContact N-O 3.42Å; S883-S894 PolarHBondContact O-N 3.43Å; S883-S894 WeakPolarHBondContact OG-CB 3.42Å; Y892-S894 WeakPolarHBondContact CE1-OG 3.06Å; Y892-S894 PolarHBondContact OH-OG 3.48Å
895	M	93.2	Very high	93.7	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.015	20%	0.196	C	C	.	.			trans	-139.7	155.9	-171.1	-52.3	-173.3	82.5	0	0	111.4	F875 S876 G877 A879 I893 K899 F900 L903 I915	F875-M895 HydrophobicContact CD1-SD 4.3Å; S876-M895 PolarHBondContact O-N 3.29Å; G877-M895 CarbonylContact C-O 3.55Å; G877-M895 WeakPolarHBondContact CA-O 3.42Å; A879-M895 PolarHBondContact N-O 2.98Å; I893-M895 HydrophobicContact CG2-CG 3.92Å; I893-M895 HydrophobicContact CG2-SD 4.33Å; M895-K899 HydrophobicContact CE-CB 3.87Å; M895-F900 HydrophobicContact CB-CB 4.31Å; M895-F900 HydrophobicContact SD-CD2 4.42Å; M895-L903 HydrophobicContact CE-CB 4.41Å; M895-L903 HydrophobicContact CE-CD2 4.49Å; M895-L903 HydrophobicContact SD-CB 4.46Å; M895-L903 HydrophobicContact SD-CD2 3.77Å; M895-I915 HydrophobicContact CE-CD1 3.7Å; M895-I915 HydrophobicContact CE-CG1 4.32Å; M895-I915 HydrophobicContact CE-CG2 3.89Å
896	T	93.2	Very high	93.7	Very high	38 Å²	38	34 Å²	34	23%	0.233	18%	0.182	C	C	.	.			trans	-72.7	146.4	164.9	61.7	0	0	0	0	110	A879 L898 K899 F900	A879-T896 VanDerWaalsContact O-CA 3.29Å; A879-T896 WeakPolarHBondContact O-CA 3.4Å; A879-T896 WeakPolarHBondContact O-CG2 3.49Å; T896-L898 PolarHBondContact O-N 2.74Å; T896-L898 VanDerWaalsContact O-N 3.11Å; T896-K899 PolarHBondContact O-N 2.88Å; T896-F900 PolarHBondContact O-N 3.28Å
897	S	92.6	Very high	93.8	Very high	57 Å²	57	31.5 Å²	31.5	40%	0.399	17%	0.17	S	C	.	.	H	α-helix	trans	-49.2	-41.7	179.6	152.3	0	0	0	0	112.6	G877 K899 F900 H901	G877-S897 WeakPolarHBondContact O-CA 3.08Å; G877-S897 WeakPolarHBondContact O-CB 3.42Å; G877-S897 PolarHBondContact O-N 3.01Å; S897-K899 PolarHBondContact O-N 2.74Å; S897-F900 PolarHBondContact O-N 2.93Å; S897-H901 PolarHBondContact O-CD2 3.16Å; S897-H901 PolarHBondContact O-N 2.95Å; S897-H901 PolarHBondContact OG-CD2 3.42Å; S897-H901 PolarHBondContact OG-NE2 3.22Å
898	L	93.5	Very high	93.7	Very high	122 Å²	122	32.6 Å²	32.6	64%	0.639	17%	0.172	S	C	*	.	H	α-helix	trans	-56.1	-48.8	175.4	-178.2	66.5	0	0	0	112.7	T896 Q902	T896-L898 PolarHBondContact O-N 2.74Å; T896-L898 VanDerWaalsContact O-N 3.11Å; L898-Q902 WeakPolarHBondContact O-CG 3.47Å; L898-Q902 PolarHBondContact O-N 2.86Å; L898-Q902 VanDerWaalsContact O-N 3.11Å
899	K	94.2	Very high	93.4	Very high	47 Å²	47	33.3 Å²	33.3	20%	0.204	18%	0.182	C	C	.	.	H	α-helix	trans	-73.5	-30.2	179.3	-74.7	175.3	170.3	-175.2	0	112.5	C882 M895 T896 S897 Q902 L903 I915 P916	C882-K899 WeakPolarHBondContact SG-CD 3.31Å; C882-K899 PolarHBondContact SG-NZ 2.89Å; M895-K899 HydrophobicContact CE-CB 3.87Å; T896-K899 PolarHBondContact O-N 2.88Å; S897-K899 PolarHBondContact O-N 2.74Å; K899-Q902 WeakPolarHBondContact O-CB 3.32Å; K899-Q902 PolarHBondContact O-N 3.2Å; K899-L903 PolarHBondContact O-N 3.2Å; K899-I915 HydrophobicContact CD-CG2 3.85Å; K899-I915 HydrophobicContact CG-CG2 4.37Å; K899-P916 PolarHBondContact NZ-O 3.44Å
900	F	94.1	Very high	93.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-67.3	-42.4	173.9	-175.4	-89.6	0	0	0	111.5	M789 M792 F794 F875 M895 T896 S897 Q902 L903 V904	M789-F900 HydrophobicContact CE-CD1 4.34Å; M789-F900 HydrophobicContact CE-CE1 3.77Å; M792-F900 HydrophobicContact CB-CE1 4.14Å; M792-F900 HydrophobicContact CB-CZ 4.49Å; M792-F900 HydrophobicContact CE-CB 4.36Å; M792-F900 HydrophobicContact CE-CD1 3.57Å; M792-F900 HydrophobicContact CE-CE1 4.19Å; M792-F900 HydrophobicContact CE-CG 4.22Å; M792-F900 HydrophobicContact CG-CE1 4.44Å; M792-F900 WeakPolarHBondContact O-CE2 3.38Å; M792-F900 VanDerWaalsContact O-CZ 3.23Å; M792-F900 WeakPolarHBondContact O-CZ 3.31Å; M792-F900 HydrophobicContact SD-CD1 3.51Å; M792-F900 VanDerWaalsContact SD-CD1 3.51Å; M792-F900 HydrophobicContact SD-CE1 3.56Å; M792-F900 VanDerWaalsContact SD-CE1 3.56Å; F794-F900 AromaticContact CD1-CE2 3.99Å; F794-F900 HydrophobicContact CD1-CE2 3.99Å; F794-F900 AromaticContact CD1-CZ 3.71Å; F794-F900 HydrophobicContact CD1-CZ 3.71Å; F794-F900 AromaticContact CE1-CE2 3.69Å; F794-F900 HydrophobicContact CE1-CE2 3.69Å; F794-F900 AromaticContact CE1-CZ 3.62Å; F794-F900 HydrophobicContact CE1-CZ 3.62Å; F875-F900 HydrophobicContact CB-CD2 4.47Å; F875-F900 HydrophobicContact CB-CE2 3.98Å; M895-F900 HydrophobicContact CB-CB 4.31Å; M895-F900 HydrophobicContact SD-CD2 4.42Å; T896-F900 PolarHBondContact O-N 3.28Å; S897-F900 PolarHBondContact O-N 2.93Å; F900-Q902 VanDerWaalsContact C-N 3.32Å; F900-Q902 PolarHBondContact O-N 2.88Å; F900-L903 WeakPolarHBondContact O-CB 3.41Å; F900-L903 PolarHBondContact O-N 3.32Å; F900-V904 HydrophobicContact CD1-CG2 4.19Å; F900-V904 HydrophobicContact CE1-CG2 3.83Å; F900-V904 HydrophobicContact CZ-CG2 4.13Å; F900-V904 WeakPolarHBondContact O-CG2 3.49Å; F900-V904 PolarHBondContact O-N 3.32Å
901	H	93	Very high	93	Very high	87 Å²	87	41.5 Å²	41.5	40%	0.403	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-33.9	172.1	-68.3	-57.4	0	0	0	112.6	M792 S897 S905	M792-H901 WeakPolarHBondContact CE-NE2 3.46Å; M792-H901 PolarHBondContact SD-CE1 3.38Å; S897-H901 PolarHBondContact O-CD2 3.16Å; S897-H901 PolarHBondContact O-N 2.95Å; S897-H901 PolarHBondContact OG-CD2 3.42Å; S897-H901 PolarHBondContact OG-NE2 3.22Å; H901-S905 WeakPolarHBondContact O-CB 3.31Å; H901-S905 PolarHBondContact O-N 3.39Å; H901-S905 PolarHBondContact O-OG 2.91Å
902	Q	94.1	Very high	92.9	Very high	91 Å²	91	46.2 Å²	46.2	43%	0.425	24%	0.243	S	C	.	.	H	α-helix	trans	-65.3	-41.8	171.2	-72.7	170.8	-25.8	0	0	112.4	L898 K899 F900 S905 S906 L913	L898-Q902 WeakPolarHBondContact O-CG 3.47Å; L898-Q902 PolarHBondContact O-N 2.86Å; L898-Q902 VanDerWaalsContact O-N 3.11Å; K899-Q902 WeakPolarHBondContact O-CB 3.32Å; K899-Q902 PolarHBondContact O-N 3.2Å; F900-Q902 VanDerWaalsContact C-N 3.32Å; F900-Q902 PolarHBondContact O-N 2.88Å; Q902-S905 PolarHBondContact O-OG 2.76Å; Q902-S905 VanDerWaalsContact O-OG 3.1Å; Q902-S906 WeakPolarHBondContact O-CB 3.31Å; Q902-S906 PolarHBondContact O-N 3.47Å; Q902-L913 WeakPolarHBondContact O-CD2 3.23Å
903	L	95	Very high	92.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-51.3	173.6	177	66.3	0	0	0	111	F794 F875 M895 K899 F900 S905 S906 L907 I915 V956	F794-L903 HydrophobicContact CZ-CD2 4.36Å; F875-L903 HydrophobicContact CB-CD2 4.43Å; F875-L903 HydrophobicContact CD1-CD2 3.33Å; F875-L903 HydrophobicContact CE1-CD2 3.55Å; F875-L903 HydrophobicContact CG-CD2 3.86Å; F875-L903 HydrophobicContact CZ-CD2 4.24Å; M895-L903 HydrophobicContact CE-CB 4.41Å; M895-L903 HydrophobicContact CE-CD2 4.49Å; M895-L903 HydrophobicContact SD-CB 4.46Å; M895-L903 HydrophobicContact SD-CD2 3.77Å; K899-L903 PolarHBondContact O-N 3.2Å; F900-L903 WeakPolarHBondContact O-CB 3.41Å; F900-L903 PolarHBondContact O-N 3.32Å; L903-S905 VanDerWaalsContact C-N 3.32Å; L903-S905 PolarHBondContact O-N 3.23Å; L903-S906 WeakPolarHBondContact O-CB 3.48Å; L903-S906 PolarHBondContact O-N 2.97Å; L903-L907 HydrophobicContact CD1-CD1 3.96Å; L903-L907 HydrophobicContact CD1-CG 4.12Å; L903-L907 HydrophobicContact CD2-CD1 4.47Å; L903-L907 HydrophobicContact CG-CD1 3.86Å; L903-L907 HydrophobicContact CG-CG 4.37Å; L903-L907 WeakPolarHBondContact O-CB 3.39Å; L903-L907 VanDerWaalsContact O-CG 3.31Å; L903-L907 WeakPolarHBondContact O-CG 3.42Å; L903-L907 PolarHBondContact O-N 2.63Å; L903-I915 HydrophobicContact CB-CD1 4.23Å; L903-I915 HydrophobicContact CD1-CD1 4.15Å; L903-V956 HydrophobicContact CD1-CG2 3.71Å
904	V	93.5	Very high	92.9	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-32.4	-177.4	174.4	0	0	0	0	112.1	L784 M789 F794 F900 L907 K908	L784-V904 HydrophobicContact CB-CG1 4.35Å; L784-V904 HydrophobicContact CD1-CG1 4.35Å; M789-V904 HydrophobicContact CE-CB 4.11Å; M789-V904 HydrophobicContact CE-CG1 3.82Å; M789-V904 HydrophobicContact CE-CG2 3.98Å; M789-V904 HydrophobicContact SD-CG1 3.76Å; F794-V904 HydrophobicContact CE1-CG2 3.9Å; F794-V904 HydrophobicContact CZ-CG2 4.46Å; F900-V904 HydrophobicContact CD1-CG2 4.19Å; F900-V904 HydrophobicContact CE1-CG2 3.83Å; F900-V904 HydrophobicContact CZ-CG2 4.13Å; F900-V904 WeakPolarHBondContact O-CG2 3.49Å; F900-V904 PolarHBondContact O-N 3.32Å; V904-L907 PolarHBondContact O-N 3.07Å; V904-K908 HydrophobicContact CG1-CD 4.08Å; V904-K908 HydrophobicContact CG1-CG 4.37Å; V904-K908 WeakPolarHBondContact O-CB 3.33Å; V904-K908 VanDerWaalsContact O-CG 3.31Å; V904-K908 WeakPolarHBondContact O-CG 3.39Å; V904-K908 PolarHBondContact O-N 2.91Å
905	S	92.2	Very high	92.9	Very high	74 Å²	74	48.1 Å²	48.1	52%	0.517	26%	0.262	S	S	.	.	H	α-helix	trans	-72.3	-37.1	174.4	67	0	0	0	0	113	H901 Q902 L903 G909	H901-S905 WeakPolarHBondContact O-CB 3.31Å; H901-S905 PolarHBondContact O-N 3.39Å; H901-S905 PolarHBondContact O-OG 2.91Å; Q902-S905 PolarHBondContact O-OG 2.76Å; Q902-S905 VanDerWaalsContact O-OG 3.1Å; L903-S905 VanDerWaalsContact C-N 3.32Å; L903-S905 PolarHBondContact O-N 3.23Å; S905-G909 PolarHBondContact O-N 3.16Å
906	S	93.9	Very high	92.7	Very high	8 Å²	8	51.1 Å²	51.1	6%	0.056	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-47.2	168.7	150.9	0	0	0	0	111.5	Q902 L903 K908 G909 G910 Y911 L913	Q902-S906 WeakPolarHBondContact O-CB 3.31Å; Q902-S906 PolarHBondContact O-N 3.47Å; L903-S906 WeakPolarHBondContact O-CB 3.48Å; L903-S906 PolarHBondContact O-N 2.97Å; S906-K908 PolarHBondContact O-N 3.02Å; S906-G909 PolarHBondContact O-N 3.2Å; S906-G910 PolarHBondContact O-N 3.18Å; S906-Y911 PolarHBondContact O-N 2.84Å; S906-Y911 PolarHBondContact OG-O 3.41Å; S906-L913 WeakPolarHBondContact OG-CB 3.42Å
907	L	93.9	Very high	92.3	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-67.9	-33.8	-178.5	-69.8	175.6	0	0	0	113.3	I772 V780 L784 F794 L903 V904 V956 W958	I772-L907 HydrophobicContact CD1-CD2 3.32Å; V780-L907 HydrophobicContact CG1-CB 4.19Å; L784-L907 HydrophobicContact CD1-CB 3.52Å; L784-L907 HydrophobicContact CD1-CD1 4.1Å; L784-L907 HydrophobicContact CD1-CG 4.48Å; F794-L907 HydrophobicContact CE2-CD1 4.28Å; F794-L907 HydrophobicContact CZ-CD1 3.86Å; L903-L907 HydrophobicContact CD1-CD1 3.96Å; L903-L907 HydrophobicContact CD1-CG 4.12Å; L903-L907 HydrophobicContact CD2-CD1 4.47Å; L903-L907 HydrophobicContact CG-CD1 3.86Å; L903-L907 HydrophobicContact CG-CG 4.37Å; L903-L907 WeakPolarHBondContact O-CB 3.39Å; L903-L907 VanDerWaalsContact O-CG 3.31Å; L903-L907 WeakPolarHBondContact O-CG 3.42Å; L903-L907 PolarHBondContact O-N 2.63Å; V904-L907 PolarHBondContact O-N 3.07Å; L907-V956 HydrophobicContact CD2-CG1 4.07Å; L907-V956 HydrophobicContact CD2-CG2 4.46Å; L907-W958 HydrophobicContact CD2-CZ2 4.17Å; L907-W958 WeakPolarHBondContact O-CZ2 3.39Å
908	K	90.5	Very high	91	Very high	58 Å²	58	55.7 Å²	55.7	25%	0.252	29%	0.286	S	S	.	.	H	α-helix	trans	-76.3	-28.1	172.7	-72.6	-177.8	-178.8	-173.1	0	113.3	A781 L784 D785 V904 S906	A781-K908 HydrophobicContact CB-CG 4.42Å; L784-K908 HydrophobicContact CB-CD 4.39Å; L784-K908 HydrophobicContact CB-CG 4.15Å; L784-K908 HydrophobicContact CD1-CG 4.2Å; L784-K908 VanDerWaalsContact O-CE 3.26Å; L784-K908 WeakPolarHBondContact O-CE 3.39Å; L784-K908 PolarHBondContact O-NZ 3.05Å; D785-K908 VanDerWaalsContact OD1-CE 3.31Å; D785-K908 WeakPolarHBondContact OD1-CE 3.13Å; D785-K908 IonicContact OD1-NZ 3.82Å; D785-K908 PolarHBondContact OD1-NZ 3.18Å; V904-K908 HydrophobicContact CG1-CD 4.08Å; V904-K908 HydrophobicContact CG1-CG 4.37Å; V904-K908 WeakPolarHBondContact O-CB 3.33Å; V904-K908 VanDerWaalsContact O-CG 3.31Å; V904-K908 WeakPolarHBondContact O-CG 3.39Å; V904-K908 PolarHBondContact O-N 2.91Å; S906-K908 PolarHBondContact O-N 3.02Å
909	G	87.4	Confident	88.8	Confident	28 Å²	28	53.3 Å²	53.3	29%	0.289	28%	0.279	S	S	.	.	H	α-helix	trans	-86.2	-19.4	-178.2	0	0	0	0	0	115.1	S905 S906	S905-G909 PolarHBondContact O-N 3.16Å; S906-G909 PolarHBondContact O-N 3.2Å
910	G	88.5	Confident	86	Confident	10 Å²	10	54.4 Å²	54.4	10%	0.103	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	34.8	-172.5	0	0	0	0	0	112.9	S906	S906-G910 PolarHBondContact O-N 3.18Å
911	Y	91.2	Very high	83	Confident	163 Å²	163	58.4 Å²	58.4	64%	0.639	32%	0.32	S	S	*	.			trans	-118.1	138.7	-174.6	-52.5	-52.2	0	0	0	112.5	S906 W958	S906-Y911 PolarHBondContact O-N 2.84Å; S906-Y911 PolarHBondContact OG-O 3.41Å; Y911-W958 PolarHBondContact O-NE1 2.82Å
912	D	93.1	Very high	80.1	Confident	100 Å²	100	62 Å²	62	54%	0.535	34%	0.343	S	S	.	.			trans	-57.3	143.4	172.6	-80.4	26.4	0	0	0	112	V956 K957 W958	D912-V956 WeakPolarHBondContact CA-O 3.38Å; D912-K957 WeakPolarHBondContact OD1-CA 3.48Å; D912-W958 PolarHBondContact OD1-N 2.83Å
913	L	95.3	Very high	77.1	Confident	39 Å²	39	62 Å²	62	20%	0.204	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	136.5	-179.3	178.7	63.6	0	0	0	111.2	Q902 S906 I915 H955 V956	Q902-L913 WeakPolarHBondContact O-CD2 3.23Å; S906-L913 WeakPolarHBondContact OG-CB 3.42Å; L913-I915 HydrophobicContact CD1-CG1 4.48Å; L913-I915 HydrophobicContact CD2-CD1 3.57Å; L913-I915 HydrophobicContact CD2-CG1 3.92Å; L913-I915 HydrophobicContact CG-CD1 3.97Å; L913-I915 HydrophobicContact CG-CG1 3.95Å; L913-H955 CarbonylContact O-C 3.51Å; L913-H955 WeakPolarHBondContact O-CA 3.47Å; L913-V956 HydrophobicContact CB-CB 4.31Å; L913-V956 PolarHBondContact N-O 2.85Å; L913-V956 PolarHBondContact O-N 3.18Å
914	S	94.2	Very high	73.8	Confident	73 Å²	73	66 Å²	66	51%	0.51	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	115.1	174.8	-57.4	0	0	0	0	110.1	H955	S914-H955 PolarHBondContact OG-CE1 2.65Å; S914-H955 VanDerWaalsContact OG-CE1 3.29Å; S914-H955 PolarHBondContact OG-ND1 2.89Å
915	I	93.7	Very high	70.8	Confident	6 Å²	6	71.4 Å²	71.4	3%	0.031	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	113.4	-180	-63.4	139.8	0	0	0	109.2	M895 K899 L903 L913 I917 S953 V954	M895-I915 HydrophobicContact CE-CD1 3.7Å; M895-I915 HydrophobicContact CE-CG1 4.32Å; M895-I915 HydrophobicContact CE-CG2 3.89Å; K899-I915 HydrophobicContact CD-CG2 3.85Å; K899-I915 HydrophobicContact CG-CG2 4.37Å; L903-I915 HydrophobicContact CB-CD1 4.23Å; L903-I915 HydrophobicContact CD1-CD1 4.15Å; L913-I915 HydrophobicContact CD1-CG1 4.48Å; L913-I915 HydrophobicContact CD2-CD1 3.57Å; L913-I915 HydrophobicContact CD2-CG1 3.92Å; L913-I915 HydrophobicContact CG-CD1 3.97Å; L913-I915 HydrophobicContact CG-CG1 3.95Å; I915-I917 PolarHBondContact O-N 2.87Å; I915-S953 CarbonylContact O-C 3.59Å; I915-S953 WeakPolarHBondContact O-CA 3.2Å; I915-V954 PolarHBondContact N-O 2.72Å; I915-V954 PolarHBondContact O-N 3.49Å
916	P	90.4	Very high	67.8	Low	65 Å²	65	72.1 Å²	72.1	42%	0.422	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	131.1	171.8	28.2	-32.7	0	0	0	110.4	K899 R918	K899-P916 PolarHBondContact NZ-O 3.44Å; P916-R918 HydrophobicContact CB-CG 4.31Å
917	I	83.5	Confident	64.9	Low	9 Å²	9	75.2 Å²	75.2	5%	0.046	44%	0.436	C	S	.	.			trans	-80.5	-45.9	170.7	-62.7	162.8	0	0	0	108.9	C882 A884 I915 A951 S952 V954	C882-I917 HydrophobicContact CB-CG2 4.17Å; A884-I917 HydrophobicContact CB-CD1 3.6Å; I915-I917 PolarHBondContact O-N 2.87Å; I917-A951 HydrophobicContact CD1-CB 3.92Å; I917-A951 WeakPolarHBondContact CD1-O 3.38Å; I917-S952 WeakPolarHBondContact CA-O 3.17Å; I917-S952 WeakPolarHBondContact CB-O 3.27Å; I917-S952 PolarHBondContact N-O 3Å; I917-V954 HydrophobicContact CD1-CG2 3.75Å; I917-V954 HydrophobicContact CG1-CG2 4.03Å
918	R	65.6	Low	62	Low	182 Å²	182	80.7 Å²	80.7	69%	0.687	46%	0.464	S	S	*	.			trans	48.4	101.9	175.1	-98.6	-168.5	178.4	-166.9	1.4	115.7	P916 S920 S952	P916-R918 HydrophobicContact CB-CG 4.31Å; R918-S920 PolarHBondContact O-N 2.96Å; R918-S952 PolarHBondContact N-O 2.77Å
919	S	47.6	Very low	59.1	Low	72 Å²	72	83 Å²	83	50%	0.503	48%	0.483	S	S	.	.			trans	-72.5	41.2	163.8	-163.1	0	0	0	0	113.2	C921	S919-C921 VanDerWaalsContact C-N 3.33Å; S919-C921 PolarHBondContact O-N 2.89Å; S919-C921 VanDerWaalsContact O-N 3.13Å
920	S	34.7	Very low	56.4	Low	70 Å²	70	89.7 Å²	89.7	49%	0.49	51%	0.507	S	S	.	.			trans	-90.6	58	-171.8	66.4	0	0	0	0	112.7	R918 N922	R918-S920 PolarHBondContact O-N 2.96Å; S920-N922 PolarHBondContact O-N 3.26Å
921	C	32.2	Very low	53.6	Low	84 Å²	84	98 Å²	98	57%	0.568	54%	0.543	S	S	*	.			trans	-76.4	57.5	171.4	58.6	0	0	0	0	112.2	S919 I923	S919-C921 VanDerWaalsContact C-N 3.33Å; S919-C921 PolarHBondContact O-N 2.89Å; S919-C921 VanDerWaalsContact O-N 3.13Å; C921-I923 PolarHBondContact O-N 3.23Å
922	N	30.8	Very low	50.6	Low	164 Å²	164	97.5 Å²	97.5	88%	0.877	55%	0.549	S	S	*	.			trans	-77.2	42	160.5	-79.9	0.2	0	0	0	110.6	S920	S920-N922 PolarHBondContact O-N 3.26Å
923	I	31.6	Very low	47.4	Very low	91 Å²	91	98 Å²	98	47%	0.467	56%	0.561	S	S	.	*			trans	-96.5	122.3	174.2	-57.5	174.2	0	0	0	105.5	C921 A927 I928	C921-I923 PolarHBondContact O-N 3.23Å; I923-A927 HydrophobicContact CG2-CB 3.97Å; I923-I928 HydrophobicContact CD1-CD1 4.28Å; I923-I928 HydrophobicContact CG2-CD1 4.28Å; I923-I928 HydrophobicContact CG2-CG1 4.48Å
924	P	26.7	Very low	44.2	Very low	83 Å²	83	99 Å²	99	54%	0.539	58%	0.581	S	S	.	*			trans	-59.9	143.3	175.5	26	-33.5	0	0	0	109.6	S926 A927	P924-S926 PolarHBondContact O-N 3.03Å; P924-A927 PolarHBondContact O-N 3.41Å
925	P	29.6	Very low	41	Very low	119 Å²	119	102.3 Å²	102.3	77%	0.773	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	20.4	-167.1	29.6	-37.1	0	0	0	115.3
926	S	30.2	Very low	38	Very low	88 Å²	88	111.3 Å²	111.3	62%	0.615	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-20.3	176.6	48.3	0	0	0	0	114.1	P924	P924-S926 PolarHBondContact O-N 3.03Å
927	A	31.5	Very low	35.1	Very low	73 Å²	73	111.5 Å²	111.5	60%	0.603	65%	0.646	S	S	*	*	S	Bend	trans	-92.9	-0.1	-168.4	0	0	0	0	0	116.1	I923 P924	I923-A927 HydrophobicContact CG2-CB 3.97Å; P924-A927 PolarHBondContact O-N 3.41Å
928	I	33.8	Very low	32.5	Very low	117 Å²	117	118.3 Å²	118.3	60%	0.6	68%	0.683	S	S	*	*	S	Bend	trans	-115.6	-5.9	-174.5	-63.4	176	0	0	0	112	I923	I923-I928 HydrophobicContact CD1-CD1 4.28Å; I923-I928 HydrophobicContact CG2-CD1 4.28Å; I923-I928 HydrophobicContact CG2-CG1 4.48Å
929	V	30.4	Very low	30.7	Very low	106 Å²	106	116.8 Å²	116.8	64%	0.642	69%	0.688	S	S	*	*	S	Bend	trans	-88.2	-22.4	-171.3	-178.5	0	0	0	0	113.5	H931	V929-H931 PolarHBondContact O-N 3.29Å
930	E	29.1	Very low	29.7	Very low	170 Å²	170	122 Å²	122	79%	0.794	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	2.7	-171.7	-63.7	-167.8	136.7	0	0	115.6
931	H	30	Very low	29.4	Very low	183 Å²	183	123.4 Å²	123.4	85%	0.847	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	6.7	-177.5	-104.7	-61.5	0	0	0	115.9	V929	V929-H931 PolarHBondContact O-N 3.29Å
932	I	29	Very low	29.3	Very low	153 Å²	153	124.6 Å²	124.6	79%	0.785	72%	0.719	S	S	*	*			trans	-129.1	57.6	172.3	-44.1	-178.5	0	0	0	109.9
933	S	26.5	Very low	29.4	Very low	111 Å²	111	127.8 Å²	127.8	78%	0.776	72%	0.719	S	S	*	*			trans	-113.6	58.3	175.6	42.9	0	0	0	0	110.4
934	G	27.3	Very low	29.4	Very low	61 Å²	61	128.3 Å²	128.3	63%	0.629	72%	0.722	S	S	*	*	S	Bend	trans	-159.1	104.1	179.9	0	0	0	0	0	113
935	D	26.4	Very low	29.8	Very low	141 Å²	141	132 Å²	132	75%	0.754	74%	0.737	S	S	*	*	S	Bend	trans	44.2	73	156.5	-57.7	-12.1	0	0	0	119.4
936	F	30.9	Very low	30.2	Very low	195 Å²	195	132.2 Å²	132.2	86%	0.855	73%	0.731	S	S	*	*			trans	-150.2	135.3	131.1	-91.3	-65	0	0	0	110.4	L247	L247-F936 HydrophobicContact CD2-CE2 3.71Å; L247-F936 HydrophobicContact CD2-CZ 4.33Å
937	G	29.4	Very low	30.9	Very low	69 Å²	69	133.5 Å²	133.5	71%	0.711	73%	0.731	S	S	*	*			trans	-86.4	154.5	-173.7	0	0	0	0	0	114.8
938	D	28.8	Very low	32.1	Very low	153 Å²	153	132.2 Å²	132.2	82%	0.818	73%	0.725	S	S	*	*	S	Bend	trans	44.9	86	155.2	-56.9	-19.4	0	0	0	118.2
939	N	27.9	Very low	34.1	Very low	150 Å²	150	128.8 Å²	128.8	80%	0.802	71%	0.708	S	S	*	*				-177.9	85.1	115.8	-94.3	-60.8	0	0	0	111.2
940	I	28.1	Very low	36.7	Very low	180 Å²	180	126.2 Å²	126.2	92%	0.923	69%	0.692	S	S	*	*			trans	-101.1	87.1	176	-57.6	177.1	0	0	0	109.9
941	S	28.5	Very low	39.4	Very low	100 Å²	100	118.5 Å²	118.5	70%	0.699	66%	0.657	S	S	*	*			trans	-153.8	31.9	174.9	56.2	0	0	0	0	115.1
942	N	29.7	Very low	42.2	Very low	109 Å²	109	111.4 Å²	111.4	58%	0.583	63%	0.628	S	S	*	*			trans	-142.1	116.1	164.2	-118.8	-39	0	0	0	112.3	E25	E25-N942 PolarHBondContact OE1-ND2 2.82Å
943	R	31.4	Very low	45.1	Very low	231 Å²	231	104.8 Å²	104.8	87%	0.872	60%	0.595	S	S	*	*			trans	-96.7	-2.7	-171.5	-108.7	-179.3	176.9	172.4	-0.7	114.5	L945	R943-L945 PolarHBondContact O-N 2.84Å
944	D	32.1	Very low	48.4	Very low	102 Å²	102	99.6 Å²	99.6	55%	0.545	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-82.6	-7.3	-171.3	-77.8	-16.5	0	0	0	115.2	L946 N947	D944-L946 PolarHBondContact O-N 3.24Å; D944-N947 PolarHBondContact O-N 3.36Å
945	L	35.9	Very low	51.6	Low	161 Å²	161	98.6 Å²	98.6	84%	0.843	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-61.4	-13.9	-179.6	-89.9	154.5	0	0	0	115	R943	R943-L945 PolarHBondContact O-N 2.84Å
946	L	37.3	Very low	54.9	Low	123 Å²	123	92 Å²	92	64%	0.644	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-84.8	-11.2	173	-78.3	163	0	0	0	114	D944	D944-L946 PolarHBondContact O-N 3.24Å
947	N	44.6	Very low	57.9	Low	116 Å²	116	85.4 Å²	85.4	62%	0.62	47%	0.473	S	S	*	.			trans	-92.9	8.1	-179.4	-72.3	-36.4	0	0	0	113.8	D944 N949	D944-N947 PolarHBondContact O-N 3.36Å; N947-N949 PolarHBondContact O-N 2.76Å; N947-N949 VanDerWaalsContact O-N 3.12Å
948	G	56.3	Low	60.8	Low	46 Å²	46	83.3 Å²	83.3	47%	0.474	44%	0.444	S	S	.	.			trans	-73.8	6.6	-174.7	0	0	0	0	0	116.7
949	N	77.1	Confident	63.3	Low	45 Å²	45	78.7 Å²	78.7	24%	0.241	42%	0.417	C	S	.	.			trans	-83.2	119	-178.3	-91.6	-21.8	0	0	0	112	S883 A884 N947	S883-N949 WeakPolarHBondContact CA-OD1 3.33Å; S883-N949 WeakPolarHBondContact CB-OD1 3.21Å; A884-N949 PolarHBondContact N-OD1 3.2Å; N947-N949 PolarHBondContact O-N 2.76Å; N947-N949 VanDerWaalsContact O-N 3.12Å
950	V	84.3	Confident	65.1	Low	51 Å²	51	75.1 Å²	75.1	31%	0.309	39%	0.394	S	S	.	.	S	Bend	trans	-78	-25	-179.6	179	0	0	0	0	112.5	L745 V766 A884 I886	L745-V950 HydrophobicContact CD1-CG1 4.13Å; L745-V950 HydrophobicContact CD2-CG1 4.24Å; V766-V950 VanDerWaalsContact CB-O 3.31Å; V766-V950 WeakPolarHBondContact CB-O 3.29Å; V766-V950 WeakPolarHBondContact CG1-O 3.42Å; A884-V950 PolarHBondContact O-N 3.02Å; I886-V950 HydrophobicContact CD1-CG1 3.9Å; I886-V950 HydrophobicContact CD1-CG2 4.32Å; I886-V950 HydrophobicContact CG1-CG1 4.14Å; I886-V950 HydrophobicContact CG1-CG2 4.2Å
951	A	86.3	Confident	66.5	Low	8 Å²	8	68.2 Å²	68.2	7%	0.066	36%	0.36	C	S	.	.			trans	-136.9	152.8	-175.5	0	0	0	0	0	113.2	V766 V768 A884 I917	V766-A951 HydrophobicContact CG1-CB 4.41Å; V766-A951 CarbonylContact O-C 3.57Å; V766-A951 WeakPolarHBondContact O-CA 3.47Å; V766-A951 WeakPolarHBondContact O-CB 3.48Å; V768-A951 HydrophobicContact CG2-CB 3.62Å; A884-A951 HydrophobicContact CB-CB 4.37Å; I917-A951 HydrophobicContact CD1-CB 3.92Å; I917-A951 WeakPolarHBondContact CD1-O 3.38Å
952	S	88	Confident	67.1	Low	34 Å²	34	65.8 Å²	65.8	24%	0.238	34%	0.337	C	S	.	.	S	Bend	trans	-96.2	-21	179.5	61.5	0	0	0	0	114	D765 V766 I917 R918	D765-S952 WeakPolarHBondContact OD1-CB 3.39Å; D765-S952 PolarHBondContact OD1-OG 2.96Å; V766-S952 PolarHBondContact O-N 3.23Å; V766-S952 PolarHBondContact O-OG 3.46Å; I917-S952 WeakPolarHBondContact CA-O 3.17Å; I917-S952 WeakPolarHBondContact CB-O 3.27Å; I917-S952 PolarHBondContact N-O 3Å; R918-S952 PolarHBondContact N-O 2.77Å
953	S	91.5	Very high	67.6	Low	14 Å²	14	63.5 Å²	63.5	10%	0.098	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	163.2	171.6	60.9	0	0	0	0	113.6	V768 I915 H955	V768-S953 PolarHBondContact N-O 2.93Å; I915-S953 CarbonylContact O-C 3.59Å; I915-S953 WeakPolarHBondContact O-CA 3.2Å; S953-H955 WeakPolarHBondContact CB-NE2 3.27Å; S953-H955 PolarHBondContact OG-CD2 3.03Å; S953-H955 PolarHBondContact OG-NE2 2.66Å
954	V	94.1	Very high	67.7	Low	2 Å²	2	53.8 Å²	53.8	1%	0.012	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.8	169.9	-171.3	0	0	0	0	108.5	V768 L770 I893 I915 I917	V768-V954 HydrophobicContact CB-CG1 4.27Å; V768-V954 HydrophobicContact CB-CG2 4.38Å; V768-V954 HydrophobicContact CG1-CG1 4.41Å; V768-V954 CarbonylContact O-C 3.54Å; V768-V954 WeakPolarHBondContact O-CA 3.48Å; L770-V954 HydrophobicContact CD1-CG1 3.65Å; L770-V954 HydrophobicContact CG-CG1 4.25Å; I893-V954 HydrophobicContact CD1-CG1 4.18Å; I893-V954 HydrophobicContact CD1-CG2 3.99Å; I893-V954 HydrophobicContact CG2-CG2 4.18Å; I915-V954 PolarHBondContact N-O 2.72Å; I915-V954 PolarHBondContact O-N 3.49Å; I917-V954 HydrophobicContact CD1-CG2 3.75Å; I917-V954 HydrophobicContact CG1-CG2 4.03Å
955	H	95.2	Very high	67.6	Low	41 Å²	41	55.5 Å²	55.5	19%	0.19	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.5	-179.7	-69.8	-112.6	0	0	0	110.3	I767 V768 L770 L913 S914 S953	I767-H955 HydrophobicContact CG2-CB 4.48Å; I767-H955 WeakPolarHBondContact CG2-CD2 3.45Å; V768-H955 PolarHBondContact O-N 3.02Å; L770-H955 PolarHBondContact N-O 3.16Å; L913-H955 CarbonylContact O-C 3.51Å; L913-H955 WeakPolarHBondContact O-CA 3.47Å; S914-H955 PolarHBondContact OG-CE1 2.65Å; S914-H955 VanDerWaalsContact OG-CE1 3.29Å; S914-H955 PolarHBondContact OG-ND1 2.89Å; S953-H955 WeakPolarHBondContact CB-NE2 3.27Å; S953-H955 PolarHBondContact OG-CD2 3.03Å; S953-H955 PolarHBondContact OG-NE2 2.66Å
956	V	96.5	Very high	67.7	Low	1 Å²	1	49.9 Å²	49.9	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	125.1	166.1	179.4	0	0	0	0	108.1	L770 I772 L903 L907 D912 L913	L770-V956 HydrophobicContact CD1-CG2 4.05Å; I772-V956 HydrophobicContact CD1-CG1 3.86Å; L903-V956 HydrophobicContact CD1-CG2 3.71Å; L907-V956 HydrophobicContact CD2-CG1 4.07Å; L907-V956 HydrophobicContact CD2-CG2 4.46Å; D912-V956 WeakPolarHBondContact CA-O 3.38Å; L913-V956 HydrophobicContact CB-CB 4.31Å; L913-V956 PolarHBondContact N-O 2.85Å; L913-V956 PolarHBondContact O-N 3.18Å
957	K	93.8	Very high	67.4	Low	57 Å²	57	45.9 Å²	45.9	25%	0.248	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	119	176	-69.4	176.3	173.7	175.2	0	109.4	E769 L770 L771 I772 D912	E769-K957 WeakPolarHBondContact OE1-CE 3.42Å; E769-K957 IonicContact OE1-NZ 2.66Å; E769-K957 PolarHBondContact OE1-NZ 3.34Å; L770-K957 PolarHBondContact O-N 2.65Å; L771-K957 WeakPolarHBondContact CA-O 3.47Å; L771-K957 HydrophobicContact CD2-CB 3.93Å; L771-K957 HydrophobicContact CD2-CD 3.97Å; I772-K957 PolarHBondContact N-O 3.35Å; D912-K957 WeakPolarHBondContact OD1-CA 3.48Å
958	W	89.7	Confident	66.5	Low	25 Å²	25	43.5 Å²	43.5	10%	0.095	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	124.9	174.4	-72.5	86.4	0	0	0	109.7	I772 P773 M774 C777 V780 L907 Y911 D912	I772-W958 HydrophobicContact CB-CD2 4.09Å; I772-W958 HydrophobicContact CB-CE3 3.95Å; I772-W958 HydrophobicContact CB-CH2 4.29Å; I772-W958 HydrophobicContact CB-CZ2 4.38Å; I772-W958 HydrophobicContact CB-CZ3 4.06Å; I772-W958 HydrophobicContact CD1-CZ2 4.13Å; I772-W958 HydrophobicContact CG2-CD2 4.33Å; I772-W958 HydrophobicContact CG2-CE3 3.82Å; I772-W958 HydrophobicContact CG2-CH2 3.54Å; I772-W958 HydrophobicContact CG2-CZ2 4.05Å; I772-W958 HydrophobicContact CG2-CZ3 3.41Å; I772-W958 VanDerWaalsContact CG2-CZ3 3.41Å; I772-W958 WeakPolarHBondContact O-CA 3.48Å; P773-W958 WeakPolarHBondContact O-CZ3 3.39Å; M774-W958 HydrophobicContact CG-CB 4.3Å; M774-W958 HydrophobicContact SD-CB 3.74Å; M774-W958 HydrophobicContact SD-CD2 4.23Å; M774-W958 HydrophobicContact SD-CE3 3.84Å; M774-W958 HydrophobicContact SD-CG 4.23Å; C777-W958 HydrophobicContact CB-CE3 4.4Å; C777-W958 HydrophobicContact CB-CH2 3.92Å; C777-W958 HydrophobicContact CB-CZ3 3.6Å; V780-W958 HydrophobicContact CB-CH2 4.41Å; V780-W958 HydrophobicContact CG2-CH2 4.38Å; L907-W958 HydrophobicContact CD2-CZ2 4.17Å; L907-W958 WeakPolarHBondContact O-CZ2 3.39Å; Y911-W958 PolarHBondContact O-NE1 2.82Å; D912-W958 PolarHBondContact OD1-N 2.83Å
959	F	82	Confident	65.1	Low	57 Å²	57	43 Å²	43	25%	0.25	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145.6	179.6	74.6	-73.5	0	0	0	111	Y742 L771 I772 P773 M774 V961	Y742-F959 HydrophobicContact CD2-CZ 4.3Å; Y742-F959 HydrophobicContact CE2-CZ 4.28Å; L771-F959 HydrophobicContact CB-CD1 4.1Å; L771-F959 HydrophobicContact CB-CE1 3.93Å; I772-F959 VanDerWaalsContact O-CD1 3.3Å; I772-F959 WeakPolarHBondContact O-CD1 3.3Å; I772-F959 PolarHBondContact O-N 2.83Å; P773-F959 HydrophobicContact CG-CE1 4.04Å; P773-F959 HydrophobicContact CG-CZ 4.11Å; M774-F959 WeakPolarHBondContact CG-O 3.34Å; M774-F959 PolarHBondContact N-O 2.81Å; F959-V961 HydrophobicContact CD2-CG2 4.13Å; F959-V961 HydrophobicContact CE1-CG2 4.4Å; F959-V961 HydrophobicContact CE2-CB 4.42Å; F959-V961 HydrophobicContact CE2-CG2 3.36Å; F959-V961 HydrophobicContact CZ-CG2 3.52Å; F959-V961 PolarHBondContact O-N 2.87Å; F959-V961 VanDerWaalsContact O-N 3.09Å
960	K	65	Low	62.6	Low	74 Å²	74	43.2 Å²	43.2	32%	0.322	24%	0.237	S	C	.	.			trans	-64.9	109.8	161.8	-69.1	-176.6	-175	179.2	0	106.7	F962 D1047	K960-F962 HydrophobicContact CB-CD2 4.04Å; K960-F962 HydrophobicContact CB-CE2 3.84Å; K960-F962 HydrophobicContact CB-CZ 4.26Å; K960-F962 HydrophobicContact CD-CE1 4.12Å; K960-F962 HydrophobicContact CD-CE2 4.06Å; K960-F962 HydrophobicContact CD-CZ 3.66Å; K960-F962 PolarHBondContact O-N 2.86Å; K960-D1047 PolarHBondContact NZ-O 2.65Å; K960-D1047 IonicContact NZ-OD2 3.14Å; K960-D1047 PolarHBondContact NZ-OD2 3Å
961	V	56.3	Low	59.8	Low	35 Å²	35	47 Å²	47	21%	0.212	25%	0.25	C	C	.	.			trans	-66.6	98.5	149.5	171.8	0	0	0	0	104.9	P773 F959	P773-V961 HydrophobicContact CB-CB 4.33Å; P773-V961 HydrophobicContact CB-CG2 3.54Å; P773-V961 HydrophobicContact CG-CG2 3.68Å; F959-V961 HydrophobicContact CD2-CG2 4.13Å; F959-V961 HydrophobicContact CE1-CG2 4.4Å; F959-V961 HydrophobicContact CE2-CB 4.42Å; F959-V961 HydrophobicContact CE2-CG2 3.36Å; F959-V961 HydrophobicContact CZ-CG2 3.52Å; F959-V961 PolarHBondContact O-N 2.87Å; F959-V961 VanDerWaalsContact O-N 3.09Å
962	F	43	Very low	56.7	Low	49 Å²	49	50.4 Å²	50.4	22%	0.215	27%	0.273	C	S	.	.			trans	-68.7	128.4	146.8	-57.1	-89.9	0	0	0	105.9	K960 S964 F965 I991 T992 D1047	K960-F962 HydrophobicContact CB-CD2 4.04Å; K960-F962 HydrophobicContact CB-CE2 3.84Å; K960-F962 HydrophobicContact CB-CZ 4.26Å; K960-F962 HydrophobicContact CD-CE1 4.12Å; K960-F962 HydrophobicContact CD-CE2 4.06Å; K960-F962 HydrophobicContact CD-CZ 3.66Å; K960-F962 PolarHBondContact O-N 2.86Å; F962-S964 WeakPolarHBondContact CB-OG 3.44Å; F962-S964 PolarHBondContact O-N 2.89Å; F962-F965 PolarHBondContact O-N 3.02Å; F962-I991 WeakPolarHBondContact CB-O 3.5Å; F962-I991 HydrophobicContact CD1-CG2 3.65Å; F962-I991 VanDerWaalsContact CD1-O 3.26Å; F962-I991 WeakPolarHBondContact CD1-O 3.46Å; F962-I991 HydrophobicContact CE1-CG2 3.4Å; F962-I991 VanDerWaalsContact CE1-CG2 3.4Å; F962-I991 HydrophobicContact CZ-CG2 4.4Å; F962-T992 HydrophobicContact CD1-CG2 3.69Å; F962-T992 HydrophobicContact CE1-CG2 4.45Å; F962-D1047 VanDerWaalsContact CE1-OD1 3.29Å; F962-D1047 WeakPolarHBondContact CE1-OD1 3.41Å; F962-D1047 VanDerWaalsContact CZ-OD1 3.24Å; F962-D1047 WeakPolarHBondContact CZ-OD1 3.44Å
963	D	39.9	Very low	53.7	Low	61 Å²	61	52 Å²	52	33%	0.326	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-9.8	174.8	-64.1	-58.2	0	0	0	111.9	F965 L966 S967 T993	D963-F965 PolarHBondContact O-N 3.01Å; D963-L966 PolarHBondContact O-N 3.24Å; D963-S967 PolarHBondContact O-N 3.09Å; D963-T993 VanDerWaalsContact CB-O 3.25Å; D963-T993 WeakPolarHBondContact CB-O 3.44Å
964	S	32	Very low	50.6	Low	28 Å²	28	56.4 Å²	56.4	20%	0.196	31%	0.308	C	S	.	.	H	α-helix	trans	-58.3	-20.7	163.6	60.8	0	0	0	0	114	F962 L966 S967 S968 I991	F962-S964 WeakPolarHBondContact CB-OG 3.44Å; F962-S964 PolarHBondContact O-N 2.89Å; S964-L966 VanDerWaalsContact C-N 3.25Å; S964-L966 PolarHBondContact O-N 2.9Å; S964-S967 CarbonylContact O-C 3.58Å; S964-S967 PolarHBondContact O-N 2.83Å; S964-S968 WeakPolarHBondContact O-CA 3.36Å; S964-S968 WeakPolarHBondContact O-CB 3.44Å; S964-S968 PolarHBondContact O-N 3.49Å; S964-S968 PolarHBondContact O-OG 3.25Å; S964-I991 PolarHBondContact OG-O 2.87Å; S964-I991 VanDerWaalsContact OG-O 3.09Å
965	F	31.7	Very low	47.4	Very low	138 Å²	138	62.1 Å²	62.1	61%	0.605	34%	0.343	S	S	*	.	H	α-helix	trans	-75.2	-11.7	169.8	-111	-75.6	0	0	0	114.3	F962 D963	F962-F965 PolarHBondContact O-N 3.02Å; D963-F965 PolarHBondContact O-N 3.01Å
966	L	37.8	Very low	44.3	Very low	43 Å²	43	65.1 Å²	65.1	23%	0.225	36%	0.364	C	S	.	.	H	α-helix	trans	-99.6	-33.6	167.6	-61.6	179.1	0	0	0	110.7	D963 S964	D963-L966 PolarHBondContact O-N 3.24Å; S964-L966 VanDerWaalsContact C-N 3.25Å; S964-L966 PolarHBondContact O-N 2.9Å
967	S	30.6	Very low	41	Very low	39 Å²	39	68 Å²	68	27%	0.273	38%	0.383	S	S	.	.	H	α-helix	trans	-86.3	-1.8	178.4	-173.7	0	0	0	0	115.8	D963 S964	D963-S967 PolarHBondContact O-N 3.09Å; S964-S967 CarbonylContact O-C 3.58Å; S964-S967 PolarHBondContact O-N 2.83Å
968	S	26.3	Very low	37.8	Very low	65 Å²	65	67.3 Å²	67.3	46%	0.455	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	0	178.3	48	0	0	0	0	113.9	S964 S970	S964-S968 WeakPolarHBondContact O-CA 3.36Å; S964-S968 WeakPolarHBondContact O-CB 3.44Å; S964-S968 PolarHBondContact O-N 3.49Å; S964-S968 PolarHBondContact O-OG 3.25Å; S968-S970 PolarHBondContact O-N 3.09Å
969	A	25.8	Very low	34.9	Very low	35 Å²	35	71.3 Å²	71.3	29%	0.289	40%	0.401	S	S	.	.	S	Bend	trans	-66.9	99.7	165.1	0	0	0	0	0	109.9	P647	P647-A969 VanDerWaalsContact CB-O 3.23Å; P647-A969 WeakPolarHBondContact CB-O 3.33Å
970	S	25.3	Very low	32.2	Very low	51 Å²	51	74.1 Å²	74.1	36%	0.357	42%	0.422	S	S	.	.			trans	71	97.9	178.2	16.3	0	0	0	0	117.3	P647 S968	P647-S970 WeakPolarHBondContact CG-O 3.46Å; S968-S970 PolarHBondContact O-N 3.09Å
971	F	24	Very low	30.3	Very low	129 Å²	129	78.7 Å²	78.7	57%	0.566	45%	0.451	S	S	*	.			trans	-61.5	167.7	141.7	-86.6	-95.3	0	0	0	111.3	E989	F971-E989 HydrophobicContact CE1-CG 3.98Å; F971-E989 HydrophobicContact CE2-CG 4.4Å; F971-E989 HydrophobicContact CZ-CB 3.95Å; F971-E989 HydrophobicContact CZ-CG 3.47Å; F971-E989 VanDerWaalsContact CZ-CG 3.47Å
972	S	23	Very low	28.8	Very low	81 Å²	81	80.2 Å²	80.2	57%	0.566	46%	0.462	S	S	*	.			trans	83	42.3	174.6	-146.3	0	0	0	0	117.4
973	T	25.1	Very low	27.9	Very low	66 Å²	66	83.5 Å²	83.5	41%	0.405	50%	0.499	S	S	.	.				-99.8	129.8	113.7	54.1	0	0	0	0	106.5	V975	T973-V975 PolarHBondContact O-N 3.42Å
974	T	25.4	Very low	27.5	Very low	107 Å²	107	84 Å²	84	66%	0.656	51%	0.507	S	S	*	.				38.6	44.4	57.3	60.1	0	0	0	0	113.6	T976	T974-T976 PolarHBondContact O-N 3.38Å; T974-T976 VanDerWaalsContact O-N 3.1Å
975	V	27.1	Very low	27.5	Very low	122 Å²	122	89.4 Å²	89.4	74%	0.739	53%	0.532	S	S	*	.				-55.4	96.3	114	176.6	0	0	0	0	104.6	T973 P977	T973-V975 PolarHBondContact O-N 3.42Å; V975-P977 WeakPolarHBondContact O-CD 3.35Å
976	T	29.7	Very low	27.8	Very low	104 Å²	104	91 Å²	91	64%	0.638	54%	0.535	S	S	*	.			trans	-59.6	113.2	172.5	-57	0	0	0	0	105	T974 C978	T974-T976 PolarHBondContact O-N 3.38Å; T974-T976 VanDerWaalsContact O-N 3.1Å; T976-C978 PolarHBondContact O-N 3.34Å
977	P	26.6	Very low	28.4	Very low	61 Å²	61	96 Å²	96	40%	0.396	56%	0.561	S	S	.	*			trans	-58.9	141.3	178.2	-20.4	33.4	0	0	0	107.2	V975 Y979	V975-P977 WeakPolarHBondContact O-CD 3.35Å; P977-Y979 HydrophobicContact CB-CD1 4.23Å; P977-Y979 HydrophobicContact CB-CD2 3.31Å; P977-Y979 HydrophobicContact CB-CE1 4.34Å; P977-Y979 HydrophobicContact CB-CE2 3.44Å; P977-Y979 VanDerWaalsContact CB-CE2 3.44Å; P977-Y979 HydrophobicContact CB-CG 3.72Å; P977-Y979 HydrophobicContact CG-CD2 3.95Å; P977-Y979 HydrophobicContact CG-CE2 3.92Å; P977-Y979 PolarHBondContact O-N 3.43Å
978	C	28	Very low	29.5	Very low	43 Å²	43	96.6 Å²	96.6	29%	0.291	56%	0.561	S	S	.	*			trans	-75.7	41.2	177.8	-63.6	0	0	0	0	111.3	T976 T980 Q1113	T976-C978 PolarHBondContact O-N 3.34Å; C978-T980 PolarHBondContact O-N 3.09Å; C978-Q1113 PolarHBondContact SG-N 2.74Å
979	Y	28.7	Very low	30.8	Very low	110 Å²	110	99.6 Å²	99.6	43%	0.431	57%	0.568	S	S	.	*			trans	-78.9	85	-178.7	-68.2	-28.8	0	0	0	111.2	P977 N981	P977-Y979 HydrophobicContact CB-CD1 4.23Å; P977-Y979 HydrophobicContact CB-CD2 3.31Å; P977-Y979 HydrophobicContact CB-CE1 4.34Å; P977-Y979 HydrophobicContact CB-CE2 3.44Å; P977-Y979 VanDerWaalsContact CB-CE2 3.44Å; P977-Y979 HydrophobicContact CB-CG 3.72Å; P977-Y979 HydrophobicContact CG-CD2 3.95Å; P977-Y979 HydrophobicContact CG-CE2 3.92Å; P977-Y979 PolarHBondContact O-N 3.43Å; Y979-N981 VanDerWaalsContact C-N 3.31Å; Y979-N981 PolarHBondContact O-N 3Å
980	T	24.6	Very low	32.3	Very low	115 Å²	115	99.8 Å²	99.8	71%	0.706	57%	0.566	S	S	*	*	S	Bend	trans	-62	97.2	142.6	47	0	0	0	0	109.1	C978 S982	C978-T980 PolarHBondContact O-N 3.09Å; T980-S982 PolarHBondContact O-N 3.3Å
981	N	25	Very low	34	Very low	171 Å²	171	99.5 Å²	99.5	91%	0.914	56%	0.56	S	S	*	*	S	Bend	trans	34.9	63.7	160	-69.3	-19.5	0	0	0	118	Y979	Y979-N981 VanDerWaalsContact C-N 3.31Å; Y979-N981 PolarHBondContact O-N 3Å
982	S	24.9	Very low	35.8	Very low	66 Å²	66	94.5 Å²	94.5	46%	0.462	54%	0.541	S	S	.	.			trans	-137.2	115.7	151.2	60.4	0	0	0	0	110.9	T980 S984	T980-S982 PolarHBondContact O-N 3.3Å; S982-S984 PolarHBondContact O-N 2.78Å
983	A	25.5	Very low	37.8	Very low	118 Å²	118	91.3 Å²	91.3	98%	0.975	52%	0.518	S	S	*	.			trans	-89.6	75.9	-178.3	0	0	0	0	0	110.3
984	S	30	Very low	39.9	Very low	72 Å²	72	90.2 Å²	90.2	50%	0.503	51%	0.507	S	S	.	.			trans	-144.6	124.5	179.5	51	0	0	0	0	114.6	S982	S982-S984 PolarHBondContact O-N 2.78Å
985	I	31.9	Very low	41.9	Very low	142 Å²	142	86.3 Å²	86.3	73%	0.728	48%	0.482	S	S	*	.	S	Bend	trans	75.2	72.6	137.4	-69.2	174.6	0	0	0	115.2
986	W	39.2	Very low	44.1	Very low	172 Å²	172	80.5 Å²	80.5	65%	0.652	45%	0.447	S	S	*	.			trans	87.3	100.3	149.7	-44.2	96.7	0	0	0	120.5	L988	W986-L988 HydrophobicContact CB-CD1 3.92Å; W986-L988 HydrophobicContact CB-CG 3.99Å; W986-L988 HydrophobicContact CG-CD1 4.41Å; W986-L988 PolarHBondContact O-N 3.36Å
987	D	49.6	Very low	45.9	Very low	146 Å²	146	75.8 Å²	75.8	78%	0.781	42%	0.418	S	S	*	.			trans	-70.2	96.1	145.9	-56.2	-65.9	0	0	0	109.2
988	L	53.2	Low	48.1	Very low	52 Å²	52	73.6 Å²	73.6	27%	0.272	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-97.7	122.1	175.4	-86.2	156.3	0	0	0	110.7	W986 L1044 N1045	W986-L988 HydrophobicContact CB-CD1 3.92Å; W986-L988 HydrophobicContact CB-CG 3.99Å; W986-L988 HydrophobicContact CG-CD1 4.41Å; W986-L988 PolarHBondContact O-N 3.36Å; L988-L1044 HydrophobicContact CB-CB 4.32Å; L988-N1045 HydrophobicContact CD1-CB 4.24Å; L988-N1045 HydrophobicContact CD2-CB 4.29Å
989	E	53.6	Low	50	Low	128 Å²	128	73.1 Å²	73.1	60%	0.598	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-68	133.5	171.3	-52.4	-170.1	-176.6	0	0	110	F971 I991	F971-E989 HydrophobicContact CE1-CG 3.98Å; F971-E989 HydrophobicContact CE2-CG 4.4Å; F971-E989 HydrophobicContact CZ-CB 3.95Å; F971-E989 HydrophobicContact CZ-CG 3.47Å; F971-E989 VanDerWaalsContact CZ-CG 3.47Å; E989-I991 PolarHBondContact O-N 3.3Å
990	P	57.9	Low	52	Low	39 Å²	39	70 Å²	70	25%	0.253	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-68.4	118.4	-177.6	26.7	-34.1	0	0	0	111.8	H1042 L1044	P990-H1042 HydrophobicContact CB-CB 4.01Å; P990-L1044 HydrophobicContact CB-CD2 3.88Å
991	I	61.2	Low	54.5	Low	46 Å²	46	64.5 Å²	64.5	24%	0.236	35%	0.351	C	S	.	.	S	Bend	trans	-61.9	-45.5	176.2	-69	176.7	0	0	0	110.5	F962 S964 E989 V1043	F962-I991 WeakPolarHBondContact CB-O 3.5Å; F962-I991 HydrophobicContact CD1-CG2 3.65Å; F962-I991 VanDerWaalsContact CD1-O 3.26Å; F962-I991 WeakPolarHBondContact CD1-O 3.46Å; F962-I991 HydrophobicContact CE1-CG2 3.4Å; F962-I991 VanDerWaalsContact CE1-CG2 3.4Å; F962-I991 HydrophobicContact CZ-CG2 4.4Å; S964-I991 PolarHBondContact OG-O 2.87Å; S964-I991 VanDerWaalsContact OG-O 3.09Å; E989-I991 PolarHBondContact O-N 3.3Å; I991-V1043 PolarHBondContact N-O 2.98Å
992	T	61.4	Low	56.8	Low	24 Å²	24	58.5 Å²	58.5	15%	0.147	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.2	171.5	47.6	0	0	0	0	111.1	F962 F994 H1042 V1043	F962-T992 HydrophobicContact CD1-CG2 3.69Å; F962-T992 HydrophobicContact CE1-CG2 4.45Å; T992-F994 HydrophobicContact CG2-CE2 4.28Å; T992-F994 HydrophobicContact CG2-CZ 4.29Å; T992-F994 WeakPolarHBondContact OG1-CE2 3.27Å; T992-H1042 VanDerWaalsContact O-CA 3.22Å; T992-H1042 WeakPolarHBondContact O-CA 3.43Å; T992-V1043 PolarHBondContact N-O 3.25Å; T992-V1043 PolarHBondContact O-N 3.2Å; T992-V1043 VanDerWaalsContact O-N 3.09Å; T992-V1043 WeakPolarHBondContact OG1-CB 3.39Å; T992-V1043 WeakPolarHBondContact OG1-CG2 3.46Å
993	T	65.5	Low	59.1	Low	14 Å²	14	57.4 Å²	57.4	9%	0.086	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	116.2	176	-64.2	0	0	0	0	108.2	D963 F1041 H1042	D963-T993 VanDerWaalsContact CB-O 3.25Å; D963-T993 WeakPolarHBondContact CB-O 3.44Å; T993-F1041 CarbonylContact C-O 3.51Å; T993-H1042 WeakPolarHBondContact CG2-CE1 3.08Å; T993-H1042 PolarHBondContact OG1-CE1 3.01Å; T993-H1042 PolarHBondContact OG1-ND1 3.13Å
994	F	69.5	Low	61.5	Low	43 Å²	43	51.8 Å²	51.8	19%	0.189	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.2	178.4	-59.9	-89.7	0	0	0	109.7	F572 T992 R1040 F1041	F572-F994 HydrophobicContact CB-CB 4.33Å; F572-F994 HydrophobicContact CB-CD1 4.04Å; F572-F994 HydrophobicContact CD2-CB 3.67Å; F572-F994 AromaticContact CD2-CD1 3.56Å; F572-F994 HydrophobicContact CD2-CD1 3.56Å; F572-F994 HydrophobicContact CD2-CD2 4.33Å; F572-F994 HydrophobicContact CD2-CE1 4.23Å; F572-F994 AromaticContact CD2-CG 3.59Å; F572-F994 HydrophobicContact CD2-CG 3.59Å; F572-F994 HydrophobicContact CE2-CB 4.07Å; F572-F994 HydrophobicContact CE2-CD1 4.42Å; F572-F994 HydrophobicContact CE2-CD2 4.43Å; F572-F994 HydrophobicContact CE2-CG 4.07Å; F572-F994 HydrophobicContact CG-CB 4.04Å; F572-F994 HydrophobicContact CG-CD1 4.19Å; F572-F994 HydrophobicContact CG-CG 4.33Å; T992-F994 HydrophobicContact CG2-CE2 4.28Å; T992-F994 HydrophobicContact CG2-CZ 4.29Å; T992-F994 WeakPolarHBondContact OG1-CE2 3.27Å; F994-R1040 CarbonylContact O-C 3.52Å; F994-R1040 WeakPolarHBondContact O-CA 3.36Å; F994-F1041 HydrophobicContact CB-CB 4.46Å; F994-F1041 HydrophobicContact CB-CD1 4.33Å; F994-F1041 AromaticContact CD2-CD1 3.56Å; F994-F1041 HydrophobicContact CD2-CD1 3.56Å; F994-F1041 AromaticContact CD2-CE1 3.88Å; F994-F1041 HydrophobicContact CD2-CE1 3.88Å; F994-F1041 HydrophobicContact CE2-CD1 4.27Å; F994-F1041 HydrophobicContact CE2-CE1 4.17Å; F994-F1041 HydrophobicContact CG-CD1 4.3Å; F994-F1041 PolarHBondContact N-O 3.36Å; F994-F1041 PolarHBondContact O-N 3.45Å
995	L	67.7	Low	63.7	Low	24 Å²	24	49.9 Å²	49.9	13%	0.126	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	137.4	166.3	-80.5	162.7	0	0	0	109.6	Y511 E516 A575 P997 R1040	Y511-L995 HydrophobicContact CD1-CD2 3.59Å; Y511-L995 HydrophobicContact CE1-CD1 4.35Å; Y511-L995 HydrophobicContact CE1-CD2 3.78Å; E516-L995 HydrophobicContact CG-CD1 3.83Å; A575-L995 HydrophobicContact CB-CD1 4.18Å; L995-P997 WeakPolarHBondContact O-CD 3.3Å; L995-R1040 HydrophobicContact CD2-CG 3.97Å
996	V	72.2	Confident	65.6	Low	1 Å²	1	46.4 Å²	46.4	1%	0.006	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-91.7	116.9	-176.2	-178.8	0	0	0	0	109.7	G514 F572 Q1001 W1038 I1039	G514-V996 WeakPolarHBondContact CA-O 3.35Å; F572-V996 HydrophobicContact CE1-CG2 4.49Å; V996-Q1001 HydrophobicContact CG1-CG 4.3Å; V996-W1038 HydrophobicContact CB-CD2 4.43Å; V996-W1038 WeakPolarHBondContact CB-O 3.47Å; V996-W1038 HydrophobicContact CG1-CD2 4.02Å; V996-W1038 HydrophobicContact CG1-CE3 3.87Å; V996-W1038 HydrophobicContact CG1-CG 4.35Å; V996-W1038 HydrophobicContact CG1-CZ3 4.43Å; V996-W1038 WeakPolarHBondContact CG1-O 3.38Å; V996-W1038 HydrophobicContact CG2-CD2 3.61Å; V996-W1038 HydrophobicContact CG2-CE3 4.18Å; V996-W1038 HydrophobicContact CG2-CG 3.83Å; V996-W1038 HydrophobicContact CG2-CZ2 4.08Å; V996-I1039 PolarHBondContact N-O 2.79Å
997	P	68	Low	66.9	Low	4 Å²	4	40.2 Å²	40.2	3%	0.026	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-66.6	142.9	178.6	-22.9	35.3	0	0	0	112.4	G573 L995 H999 Y1000	G573-P997 WeakPolarHBondContact O-CG 3.46Å; L995-P997 WeakPolarHBondContact O-CD 3.3Å; P997-H999 WeakPolarHBondContact CB-CE1 3.38Å; P997-H999 PolarHBondContact O-N 3.36Å; P997-Y1000 HydrophobicContact CB-CD2 4.18Å; P997-Y1000 HydrophobicContact CG-CD2 4.16Å; P997-Y1000 HydrophobicContact CG-CE2 4.39Å; P997-Y1000 WeakPolarHBondContact O-CB 3.19Å; P997-Y1000 PolarHBondContact O-N 3.29Å
998	V	72.6	Confident	67.6	Low	16 Å²	16	33.9 Å²	33.9	10%	0.097	17%	0.166	C	C	.	.	H	α-helix	trans	-51.5	-29.8	179.8	-171.7	0	0	0	0	113.5	F513 A550 Y1000 Q1001 L1002	F513-V998 VanDerWaalsContact C-CG2 3.43Å; F513-V998 HydrophobicContact CB-CG2 3.93Å; F513-V998 HydrophobicContact CD1-CG2 4.45Å; F513-V998 WeakPolarHBondContact O-CG2 3.4Å; A550-V998 HydrophobicContact CB-CB 3.7Å; A550-V998 HydrophobicContact CB-CG1 3.93Å; V998-Y1000 VanDerWaalsContact C-N 3.31Å; V998-Y1000 PolarHBondContact O-N 3.26Å; V998-Q1001 WeakPolarHBondContact O-CB 3.04Å; V998-Q1001 PolarHBondContact O-N 3.13Å; V998-L1002 HydrophobicContact CG1-CD1 3.99Å; V998-L1002 HydrophobicContact CG1-CG 4.12Å; V998-L1002 WeakPolarHBondContact O-CB 3.46Å; V998-L1002 VanDerWaalsContact O-CG 3.29Å; V998-L1002 WeakPolarHBondContact O-CG 3.48Å; V998-L1002 PolarHBondContact O-N 2.67Å
999	H	68.4	Low	67.5	Low	32 Å²	32	36.5 Å²	36.5	15%	0.148	18%	0.181	C	C	.	.	H	α-helix	trans	-66.6	-28	177.9	60.3	-99	0	0	0	113.9	Q553 V554 P997 W1003	Q553-H999 HydrophobicContact CB-CB 4.08Å; V554-H999 HydrophobicContact CG2-CB 3.68Å; P997-H999 WeakPolarHBondContact CB-CE1 3.38Å; P997-H999 PolarHBondContact O-N 3.36Å; H999-W1003 WeakPolarHBondContact O-CB 3.49Å; H999-W1003 PolarHBondContact O-N 2.71Å
1000	Y	71.2	Confident	66.9	Low	44 Å²	44	37.7 Å²	37.7	17%	0.173	19%	0.186	C	C	.	.	H	α-helix	trans	-71.5	-43.4	170.5	-75.9	-96.1	0	0	0	111.3	P997 V998 L1002 W1003 H1004 N1067	P997-Y1000 HydrophobicContact CB-CD2 4.18Å; P997-Y1000 HydrophobicContact CG-CD2 4.16Å; P997-Y1000 HydrophobicContact CG-CE2 4.39Å; P997-Y1000 WeakPolarHBondContact O-CB 3.19Å; P997-Y1000 PolarHBondContact O-N 3.29Å; V998-Y1000 VanDerWaalsContact C-N 3.31Å; V998-Y1000 PolarHBondContact O-N 3.26Å; Y1000-L1002 PolarHBondContact O-N 3.26Å; Y1000-W1003 WeakPolarHBondContact O-CB 3.45Å; Y1000-W1003 PolarHBondContact O-N 3.04Å; Y1000-H1004 PolarHBondContact O-N 3.45Å; Y1000-H1004 VanDerWaalsContact O-N 3.13Å; Y1000-H1004 PolarHBondContact O-ND1 2.7Å; Y1000-N1067 WeakPolarHBondContact CD1-OD1 3.22Å
1001	Q	76.4	Confident	66	Low	1 Å²	1	38.8 Å²	38.8	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-59.5	-46.9	175.1	-56.7	171.5	-12.9	0	0	111.4	Q512 V996 V998 W1003 H1004 W1005 A1037 W1038	Q512-Q1001 PolarHBondContact O-NE2 3.11Å; Q512-Q1001 PolarHBondContact O-OE1 3.1Å; V996-Q1001 HydrophobicContact CG1-CG 4.3Å; V998-Q1001 WeakPolarHBondContact O-CB 3.04Å; V998-Q1001 PolarHBondContact O-N 3.13Å; Q1001-W1003 VanDerWaalsContact C-N 3.32Å; Q1001-W1003 PolarHBondContact O-N 2.81Å; Q1001-H1004 PolarHBondContact O-N 3.34Å; Q1001-W1005 HydrophobicContact CB-CH2 4.16Å; Q1001-W1005 HydrophobicContact CB-CZ2 4.01Å; Q1001-W1005 VanDerWaalsContact O-CD2 3.29Å; Q1001-W1005 PolarHBondContact O-N 2.86Å; Q1001-W1005 VanDerWaalsContact O-N 3.09Å; Q1001-A1037 HydrophobicContact CG-CB 4.43Å; Q1001-W1038 WeakPolarHBondContact CG-O 3.4Å; Q1001-W1038 PolarHBondContact NE2-O 3.49Å
1002	L	73.8	Confident	64.7	Low	44 Å²	44	42 Å²	42	23%	0.23	21%	0.211	C	C	.	.	H	α-helix	trans	-58.5	-42.1	174.7	-73.7	167.2	0	0	0	111.7	A550 V554 V998 Y1000 W1005 I1006	A550-L1002 HydrophobicContact CB-CD1 3.99Å; V554-L1002 HydrophobicContact CG2-CB 4.46Å; V554-L1002 HydrophobicContact CG2-CD1 4.34Å; V998-L1002 HydrophobicContact CG1-CD1 3.99Å; V998-L1002 HydrophobicContact CG1-CG 4.12Å; V998-L1002 WeakPolarHBondContact O-CB 3.46Å; V998-L1002 VanDerWaalsContact O-CG 3.29Å; V998-L1002 WeakPolarHBondContact O-CG 3.48Å; V998-L1002 PolarHBondContact O-N 2.67Å; Y1000-L1002 PolarHBondContact O-N 3.26Å; L1002-W1005 HydrophobicContact CD2-CE3 3.96Å; L1002-W1005 HydrophobicContact CD2-CZ3 4.1Å; L1002-W1005 PolarHBondContact O-N 2.91Å; L1002-I1006 WeakPolarHBondContact O-CD1 3.25Å; L1002-I1006 VanDerWaalsContact O-CG1 3.27Å; L1002-I1006 WeakPolarHBondContact O-CG1 3.33Å; L1002-I1006 PolarHBondContact O-N 3.31Å
1003	W	71.5	Confident	63	Low	43 Å²	43	48.9 Å²	48.9	16%	0.163	25%	0.245	C	C	.	.	H	α-helix	trans	-59.8	-46.6	178.5	-176.8	93.8	0	0	0	111.6	H999 Y1000 Q1001 W1005 I1006 H1007 N1067 E1071	H999-W1003 WeakPolarHBondContact O-CB 3.49Å; H999-W1003 PolarHBondContact O-N 2.71Å; Y1000-W1003 WeakPolarHBondContact O-CB 3.45Å; Y1000-W1003 PolarHBondContact O-N 3.04Å; Q1001-W1003 VanDerWaalsContact C-N 3.32Å; Q1001-W1003 PolarHBondContact O-N 2.81Å; W1003-W1005 PolarHBondContact O-N 3.25Å; W1003-I1006 PolarHBondContact O-N 3.17Å; W1003-H1007 AromaticContact CD1-CE1 3.44Å; W1003-H1007 VanDerWaalsContact CD1-CE1 3.44Å; W1003-H1007 AromaticContact CD1-ND1 3.87Å; W1003-H1007 AromaticContact CD2-CE1 3.95Å; W1003-H1007 AromaticContact CD2-ND1 3.68Å; W1003-H1007 AromaticContact CE2-CE1 3.43Å; W1003-H1007 VanDerWaalsContact CE2-CE1 3.43Å; W1003-H1007 AromaticContact CE2-ND1 3.49Å; W1003-H1007 AromaticContact CG-CE1 3.92Å; W1003-H1007 AromaticContact CG-ND1 3.88Å; W1003-H1007 AromaticContact CZ2-CE1 3.98Å; W1003-H1007 AromaticContact CZ2-ND1 3.93Å; W1003-H1007 AromaticContact NE1-CE1 3.11Å; W1003-H1007 PolarHBondContact NE1-CE1 3.38Å; W1003-H1007 AromaticContact NE1-ND1 3.64Å; W1003-H1007 AromaticContact NE1-NE2 3.93Å; W1003-H1007 PolarHBondContact O-N 3.22Å; W1003-H1007 PolarHBondContact O-ND1 3.45Å; W1003-N1067 WeakPolarHBondContact CZ3-ND2 3.42Å; W1003-E1071 WeakPolarHBondContact CH2-OE2 3.19Å; W1003-E1071 WeakPolarHBondContact CZ3-OE2 3.41Å
1004	H	76.6	Confident	61.1	Low	1 Å²	1	53 Å²	53	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-47.5	173.8	-67.5	131.2	0	0	0	111.6	Y1000 Q1001 I1006 H1007 L1008 N1067 I1074	Y1000-H1004 PolarHBondContact O-N 3.45Å; Y1000-H1004 VanDerWaalsContact O-N 3.13Å; Y1000-H1004 PolarHBondContact O-ND1 2.7Å; Q1001-H1004 PolarHBondContact O-N 3.34Å; H1004-I1006 VanDerWaalsContact C-N 3.26Å; H1004-I1006 PolarHBondContact O-N 3.2Å; H1004-H1007 PolarHBondContact O-N 3.48Å; H1004-L1008 WeakPolarHBondContact O-CB 3.11Å; H1004-L1008 VanDerWaalsContact O-CD1 3.26Å; H1004-L1008 WeakPolarHBondContact O-CD1 3.29Å; H1004-L1008 WeakPolarHBondContact O-CG 3.4Å; H1004-L1008 PolarHBondContact O-N 3.08Å; H1004-L1008 VanDerWaalsContact O-N 3.13Å; H1004-N1067 PolarHBondContact CE1-OD1 2.95Å; H1004-N1067 PolarHBondContact NE2-O 3.34Å; H1004-N1067 VanDerWaalsContact NE2-O 3.14Å; H1004-N1067 PolarHBondContact NE2-OD1 3.15Å; H1004-I1074 HydrophobicContact CB-CD1 3.93Å
1005	W	76.9	Confident	59	Low	32 Å²	32	57 Å²	57	12%	0.121	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-24.2	-178	-57.5	-20.9	0	0	0	114.7	Q1001 L1002 W1003 R1035 L1036 A1037 L1197	Q1001-W1005 HydrophobicContact CB-CH2 4.16Å; Q1001-W1005 HydrophobicContact CB-CZ2 4.01Å; Q1001-W1005 VanDerWaalsContact O-CD2 3.29Å; Q1001-W1005 PolarHBondContact O-N 2.86Å; Q1001-W1005 VanDerWaalsContact O-N 3.09Å; L1002-W1005 HydrophobicContact CD2-CE3 3.96Å; L1002-W1005 HydrophobicContact CD2-CZ3 4.1Å; L1002-W1005 PolarHBondContact O-N 2.91Å; W1003-W1005 PolarHBondContact O-N 3.25Å; W1005-R1035 HydrophobicContact CD2-CB 4.24Å; W1005-R1035 VanDerWaalsContact CD2-CD 3.43Å; W1005-R1035 HydrophobicContact CD2-CG 4.43Å; W1005-R1035 VanDerWaalsContact CE3-NH1 3.34Å; W1005-R1035 HydrophobicContact CZ2-CB 3.87Å; W1005-L1036 PolarHBondContact NE1-O 3.32Å; W1005-A1037 HydrophobicContact CZ2-CB 3.96Å; W1005-L1197 HydrophobicContact CH2-CD1 3.85Å; W1005-L1197 HydrophobicContact CZ2-CD1 4.06Å
1006	I	72.2	Confident	57.1	Low	68 Å²	68	60 Å²	60	35%	0.349	33%	0.329	S	S	.	.	H	α-helix	trans	-76.5	-56	175.5	-70.1	162.6	0	0	0	110.2	L1002 W1003 H1004 L1008 N1009	L1002-I1006 WeakPolarHBondContact O-CD1 3.25Å; L1002-I1006 VanDerWaalsContact O-CG1 3.27Å; L1002-I1006 WeakPolarHBondContact O-CG1 3.33Å; L1002-I1006 PolarHBondContact O-N 3.31Å; W1003-I1006 PolarHBondContact O-N 3.17Å; H1004-I1006 VanDerWaalsContact C-N 3.26Å; H1004-I1006 PolarHBondContact O-N 3.2Å; I1006-L1008 PolarHBondContact O-N 3.06Å; I1006-N1009 PolarHBondContact O-N 2.89Å
1007	H	66.1	Low	54.9	Low	42 Å²	42	70.1 Å²	70.1	19%	0.194	38%	0.376	C	S	.	.	H	α-helix	trans	-68.6	-20	-174.9	-62.2	88.8	0	0	0	113.6	F560 W1003 H1004 N1009 E1010 S1011	F560-H1007 AromaticContact CE1-CE1 3.7Å; F560-H1007 AromaticContact CE1-NE2 3.92Å; W1003-H1007 AromaticContact CD1-CE1 3.44Å; W1003-H1007 VanDerWaalsContact CD1-CE1 3.44Å; W1003-H1007 AromaticContact CD1-ND1 3.87Å; W1003-H1007 AromaticContact CD2-CE1 3.95Å; W1003-H1007 AromaticContact CD2-ND1 3.68Å; W1003-H1007 AromaticContact CE2-CE1 3.43Å; W1003-H1007 VanDerWaalsContact CE2-CE1 3.43Å; W1003-H1007 AromaticContact CE2-ND1 3.49Å; W1003-H1007 AromaticContact CG-CE1 3.92Å; W1003-H1007 AromaticContact CG-ND1 3.88Å; W1003-H1007 AromaticContact CZ2-CE1 3.98Å; W1003-H1007 AromaticContact CZ2-ND1 3.93Å; W1003-H1007 AromaticContact NE1-CE1 3.11Å; W1003-H1007 PolarHBondContact NE1-CE1 3.38Å; W1003-H1007 AromaticContact NE1-ND1 3.64Å; W1003-H1007 AromaticContact NE1-NE2 3.93Å; W1003-H1007 PolarHBondContact O-N 3.22Å; W1003-H1007 PolarHBondContact O-ND1 3.45Å; H1004-H1007 PolarHBondContact O-N 3.48Å; H1007-N1009 PolarHBondContact O-N 2.99Å; H1007-E1010 PolarHBondContact O-N 2.95Å; H1007-S1011 PolarHBondContact O-N 3.1Å; H1007-S1011 PolarHBondContact O-OG 3.38Å
1008	L	62.8	Low	53	Low	13 Å²	13	74.5 Å²	74.5	7%	0.068	41%	0.407	C	S	.	.	H	α-helix	trans	-61.6	-18.7	168.6	-81.7	164.4	0	0	0	114.1	H1004 I1006 I1074 K1075 R1078	H1004-L1008 WeakPolarHBondContact O-CB 3.11Å; H1004-L1008 VanDerWaalsContact O-CD1 3.26Å; H1004-L1008 WeakPolarHBondContact O-CD1 3.29Å; H1004-L1008 WeakPolarHBondContact O-CG 3.4Å; H1004-L1008 PolarHBondContact O-N 3.08Å; H1004-L1008 VanDerWaalsContact O-N 3.13Å; I1006-L1008 PolarHBondContact O-N 3.06Å; L1008-I1074 HydrophobicContact CD1-CB 4.46Å; L1008-I1074 HydrophobicContact CD1-CG2 3.44Å; L1008-I1074 VanDerWaalsContact CD1-CG2 3.44Å; L1008-K1075 HydrophobicContact CD2-CB 4.43Å; L1008-K1075 HydrophobicContact CD2-CG 3.53Å; L1008-R1078 PolarHBondContact O-NH1 2.65Å
1009	N	51.9	Low	50.8	Low	107 Å²	107	85 Å²	85	57%	0.572	45%	0.445	S	S	*	.	H	α-helix	trans	-95.9	-19.6	176.5	-70.4	-18.3	0	0	0	113.5	I1006 H1007 R1078	I1006-N1009 PolarHBondContact O-N 2.89Å; H1007-N1009 PolarHBondContact O-N 2.99Å; N1009-R1078 PolarHBondContact OD1-NH2 3.41Å
1010	E	41.9	Very low	49	Very low	153 Å²	153	91.8 Å²	91.8	72%	0.715	48%	0.481	S	S	*	.	H	α-helix	trans	-86.8	-20	179.1	-60.7	-167.8	150.3	0	0	113.3	H1007 I1012	H1007-E1010 PolarHBondContact O-N 2.95Å; E1010-I1012 PolarHBondContact O-N 3.32Å
1011	S	39.4	Very low	46.8	Very low	63 Å²	63	95.4 Å²	95.4	44%	0.441	51%	0.513	S	S	.	.	S	Bend	trans	-85.5	2.7	-171	38.2	0	0	0	0	115.5	H1007	H1007-S1011 PolarHBondContact O-N 3.1Å; H1007-S1011 PolarHBondContact O-OG 3.38Å
1012	I	31.9	Very low	44.5	Very low	113 Å²	113	100.5 Å²	100.5	58%	0.579	55%	0.549	S	S	*	.			trans	-105.4	65.6	-173.5	-46.7	179.7	0	0	0	112.4	E1010	E1010-I1012 PolarHBondContact O-N 3.32Å
1013	I	25.7	Very low	42.4	Very low	168 Å²	168	105.3 Å²	105.3	86%	0.862	57%	0.574	S	S	*	*			trans	-140.7	84.1	143.9	-48.9	179.9	0	0	0	110.8
1014	P	25.8	Very low	40.3	Very low	100 Å²	100	108.8 Å²	108.8	65%	0.649	60%	0.602	S	S	*	*			trans	-109.1	129.3	145.8	-6.3	26.3	0	0	0	110.6	S1016	P1014-S1016 PolarHBondContact O-N 3.49Å; P1014-S1016 VanDerWaalsContact O-N 3.07Å
1015	S	26.2	Very low	37.9	Very low	127 Å²	127	115.1 Å²	115.1	89%	0.888	64%	0.641	S	S	*	*			trans	-79.2	89	-175	57.9	0	0	0	0	113
1016	S	27	Very low	35.7	Very low	89 Å²	89	120.2 Å²	120.2	62%	0.622	68%	0.676	S	S	*	*			trans	-153.4	63.7	170.9	62.5	0	0	0	0	114.4	P1014 S1018	P1014-S1016 PolarHBondContact O-N 3.49Å; P1014-S1016 VanDerWaalsContact O-N 3.07Å; S1016-S1018 PolarHBondContact O-N 2.9Å
1017	E	26.9	Very low	33.5	Very low	212 Å²	212	126.1 Å²	126.1	99%	0.991	70%	0.699	S	S	*	*			trans	-69.6	68.4	166	-66.9	-174.1	126.6	0	0	111.6
1018	S	27	Very low	31.8	Very low	96 Å²	96	129.6 Å²	129.6	67%	0.671	73%	0.728	S	S	*	*			trans	-155.9	39.3	-175.5	58.3	0	0	0	0	115.9	S1016	S1016-S1018 PolarHBondContact O-N 2.9Å
1019	R	27.1	Very low	30.2	Very low	237 Å²	237	134 Å²	134	89%	0.894	76%	0.76	S	S	*	*	S	Bend	trans	-153.4	-3.5	167.5	-138.4	166.2	-89.9	-149.7	-2.8	119.2
1020	L	29.9	Very low	29.3	Very low	174 Å²	174	136.9 Å²	136.9	91%	0.911	78%	0.775	S	S	*	*			trans	-107.6	84.2	177.4	-80.6	162.8	0	0	0	111.3
1021	S	25.8	Very low	29	Very low	121 Å²	121	133.7 Å²	133.7	85%	0.846	77%	0.768	S	S	*	*			trans	-134.7	39	179.5	68.9	0	0	0	0	112.8
1022	S	28.2	Very low	29.4	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	76%	0.764	S	S	*	*			trans	-151.5	39.4	-176.4	58.6	0	0	0	0	113.6
1023	L	29.1	Very low	31.1	Very low	145 Å²	145	135.9 Å²	135.9	76%	0.759	77%	0.771	S	S	*	*	S	Bend	trans	-134.1	137.6	169.3	-136.7	71.2	0	0	0	108.6	T1025	L1023-T1025 PolarHBondContact O-N 2.91Å; L1023-T1025 VanDerWaalsContact O-N 3.14Å
1024	P	27.8	Very low	33.5	Very low	117 Å²	117	129.7 Å²	129.7	76%	0.76	74%	0.74	S	S	*	*			trans	-69.1	112.1	-177.5	26.4	-34.1	0	0	0	111.2	T1026	P1024-T1026 PolarHBondContact O-N 2.92Å
1025	T	25.9	Very low	36.2	Very low	133 Å²	133	129.5 Å²	129.5	82%	0.816	73%	0.726	S	S	*	*			trans	-74	86.2	-179.4	41.2	0	0	0	0	111.9	L1023 K1027	L1023-T1025 PolarHBondContact O-N 2.91Å; L1023-T1025 VanDerWaalsContact O-N 3.14Å; T1025-K1027 PolarHBondContact O-N 3.38Å
1026	T	30.1	Very low	39	Very low	139 Å²	139	123.5 Å²	123.5	85%	0.853	68%	0.684	S	S	*	*			trans	-60.1	122.8	166.3	43.9	0	0	0	0	109.6	P1024	P1024-T1026 PolarHBondContact O-N 2.92Å
1027	K	27.3	Very low	41.7	Very low	192 Å²	192	119.3 Å²	119.3	84%	0.835	65%	0.654	S	S	*	*			trans	-79.6	131.8	-170.4	-67.7	-177.2	-177.3	-179	0	112.3	T1025	T1025-K1027 PolarHBondContact O-N 3.38Å
1028	S	29.7	Very low	44.4	Very low	115 Å²	115	109.2 Å²	109.2	80%	0.804	61%	0.607	S	S	*	*			trans	51.5	83.2	146.2	63.7	0	0	0	0	118.1
1029	S	30.3	Very low	46.8	Very low	106 Å²	106	105 Å²	105	74%	0.741	58%	0.577	S	S	*	*			trans	-155.1	113.7	133.4	60.3	0	0	0	0	108.1	P1031	S1029-P1031 WeakPolarHBondContact O-CD 3.33Å; S1029-P1031 VanDerWaalsContact O-N 3.15Å
1030	D	32.2	Very low	49.2	Very low	168 Å²	168	96.1 Å²	96.1	90%	0.898	54%	0.544	S	S	*	.			trans	-64.6	113.1	175.8	-65.6	-53.5	0	0	0	109.1
1031	P	35.3	Very low	51.6	Low	85 Å²	85	87.9 Å²	87.9	55%	0.552	50%	0.5	S	S	*	.			trans	-70.1	148.9	175.2	31.4	-33.2	0	0	0	108.9	S1029 F1033	S1029-P1031 WeakPolarHBondContact O-CD 3.33Å; S1029-P1031 VanDerWaalsContact O-N 3.15Å; P1031-F1033 PolarHBondContact O-N 3.17Å; P1031-F1033 VanDerWaalsContact O-N 3.16Å
1032	P	48.1	Very low	54	Low	56 Å²	56	82.9 Å²	82.9	36%	0.364	46%	0.464	S	S	.	.	S	Bend	trans	-55.4	126.5	172.9	25.3	-33.5	0	0	0	109.1	L1034	P1032-L1034 PolarHBondContact O-N 3.35Å
1033	F	67.3	Low	56.3	Low	167 Å²	167	78.1 Å²	78.1	73%	0.732	43%	0.43	S	S	*	.			trans	-42.2	96	-163.4	-65.6	-91.3	0	0	0	115	P1031 R1035	P1031-F1033 PolarHBondContact O-N 3.17Å; P1031-F1033 VanDerWaalsContact O-N 3.16Å; F1033-R1035 WeakPolarHBondContact O-CG 3.42Å
1034	L	75.6	Confident	58.5	Low	38 Å²	38	71.4 Å²	71.4	20%	0.199	40%	0.395	C	S	.	.			trans	-58.5	136.3	169.6	-63.5	-179.1	0	0	0	110	P1032 L1081 L1085 N1198	P1032-L1034 PolarHBondContact O-N 3.35Å; L1034-L1081 HydrophobicContact CB-CB 4.29Å; L1034-L1081 HydrophobicContact CB-CD1 4.48Å; L1034-L1081 HydrophobicContact CD1-CB 4.39Å; L1034-L1085 HydrophobicContact CD1-CD2 3.85Å; L1034-L1085 HydrophobicContact CD2-CD2 3.69Å; L1034-L1085 HydrophobicContact CG-CD2 4.45Å; L1034-N1198 WeakPolarHBondContact CD2-OD1 3.17Å
1035	R	82.7	Confident	60.6	Low	96 Å²	96	68.1 Å²	68.1	36%	0.362	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.8	179	-49.6	-164.5	-177.8	-157.6	-1.9	111	W1005 F1033 I1196 L1197	W1005-R1035 HydrophobicContact CD2-CB 4.24Å; W1005-R1035 VanDerWaalsContact CD2-CD 3.43Å; W1005-R1035 HydrophobicContact CD2-CG 4.43Å; W1005-R1035 VanDerWaalsContact CE3-NH1 3.34Å; W1005-R1035 HydrophobicContact CZ2-CB 3.87Å; F1033-R1035 WeakPolarHBondContact O-CG 3.42Å; R1035-I1196 WeakPolarHBondContact O-CA 3.44Å; R1035-L1197 PolarHBondContact N-O 3.04Å; R1035-L1197 PolarHBondContact O-N 2.9Å
1036	L	86.9	Confident	62.5	Low	1 Å²	1	62.5 Å²	62.5	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	117.3	167.4	-165.6	70.7	0	0	0	108.5	W1005 V1073 I1074 L1077 L1081 I1092 F1194 I1196	W1005-L1036 PolarHBondContact NE1-O 3.32Å; L1036-V1073 HydrophobicContact CD2-CG1 4.42Å; L1036-I1074 HydrophobicContact CB-CG1 4.35Å; L1036-I1074 HydrophobicContact CB-CG2 4.27Å; L1036-I1074 HydrophobicContact CD2-CG1 4.08Å; L1036-I1074 HydrophobicContact CG-CG1 4.44Å; L1036-L1077 HydrophobicContact CD2-CB 4.14Å; L1036-L1077 HydrophobicContact CD2-CD1 4.03Å; L1036-L1081 HydrophobicContact CB-CD1 4.23Å; L1036-L1081 HydrophobicContact CB-CD2 3.97Å; L1036-L1081 HydrophobicContact CD1-CD2 4.08Å; L1036-L1081 HydrophobicContact CG-CD2 4.43Å; L1036-I1092 HydrophobicContact CD1-CD1 4.08Å; L1036-F1194 HydrophobicContact CD1-CB 3.83Å; L1036-F1194 HydrophobicContact CD2-CB 4.19Å; L1036-F1194 HydrophobicContact CD2-CD1 3.86Å; L1036-F1194 HydrophobicContact CD2-CG 4.19Å; L1036-F1194 HydrophobicContact CG-CB 3.95Å; L1036-F1194 HydrophobicContact CG-CD1 4.04Å; L1036-F1194 HydrophobicContact CG-CG 4.35Å; L1036-I1196 HydrophobicContact CD1-CG1 3.91Å
1037	A	82.8	Confident	63.6	Low	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.4	169.6	0	0	0	0	0	109.3	Q1001 W1005 I1039 F1194 C1195 L1197	Q1001-A1037 HydrophobicContact CG-CB 4.43Å; W1005-A1037 HydrophobicContact CZ2-CB 3.96Å; A1037-I1039 HydrophobicContact CB-CG2 4.03Å; A1037-F1194 CarbonylContact O-C 3.58Å; A1037-F1194 WeakPolarHBondContact O-CA 3.36Å; A1037-F1194 WeakPolarHBondContact O-CB 3.41Å; A1037-C1195 PolarHBondContact N-O 3.02Å; A1037-C1195 PolarHBondContact O-N 3.33Å; A1037-L1197 HydrophobicContact CB-CD1 3.68Å; A1037-L1197 HydrophobicContact CB-CD2 4.49Å; A1037-L1197 HydrophobicContact CB-CG 3.97Å
1038	W	84.5	Confident	65	Low	1 Å²	1	54.4 Å²	54.4	0%	0.004	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	126.7	159	173.6	32.8	0	0	0	108	F572 V996 Q1001 R1040 F1041 S1066 N1067 A1070 F1192 F1194	F572-W1038 AromaticContact CE1-CH2 3.5Å; F572-W1038 HydrophobicContact CE1-CH2 3.5Å; F572-W1038 VanDerWaalsContact CE1-CH2 3.5Å; F572-W1038 AromaticContact CE1-CZ2 3.91Å; F572-W1038 HydrophobicContact CE1-CZ2 3.91Å; F572-W1038 HydrophobicContact CE1-CZ3 4.14Å; F572-W1038 AromaticContact CZ-CH2 3.48Å; F572-W1038 HydrophobicContact CZ-CH2 3.48Å; F572-W1038 VanDerWaalsContact CZ-CH2 3.48Å; F572-W1038 AromaticContact CZ-CZ2 3.7Å; F572-W1038 HydrophobicContact CZ-CZ2 3.7Å; V996-W1038 HydrophobicContact CB-CD2 4.43Å; V996-W1038 WeakPolarHBondContact CB-O 3.47Å; V996-W1038 HydrophobicContact CG1-CD2 4.02Å; V996-W1038 HydrophobicContact CG1-CE3 3.87Å; V996-W1038 HydrophobicContact CG1-CG 4.35Å; V996-W1038 HydrophobicContact CG1-CZ3 4.43Å; V996-W1038 WeakPolarHBondContact CG1-O 3.38Å; V996-W1038 HydrophobicContact CG2-CD2 3.61Å; V996-W1038 HydrophobicContact CG2-CE3 4.18Å; V996-W1038 HydrophobicContact CG2-CG 3.83Å; V996-W1038 HydrophobicContact CG2-CZ2 4.08Å; Q1001-W1038 WeakPolarHBondContact CG-O 3.4Å; Q1001-W1038 PolarHBondContact NE2-O 3.49Å; W1038-R1040 VanDerWaalsContact CD1-O 3.31Å; W1038-R1040 PolarHBondContact NE1-O 2.71Å; W1038-F1041 HydrophobicContact CZ2-CB 3.76Å; W1038-F1041 HydrophobicContact CZ2-CD2 4.47Å; W1038-F1041 HydrophobicContact CZ2-CG 4.16Å; W1038-S1066 VanDerWaalsContact CH2-C 3.44Å; W1038-S1066 WeakPolarHBondContact CH2-O 3.46Å; W1038-N1067 HydrophobicContact CZ3-CB 4.49Å; W1038-A1070 HydrophobicContact CB-CB 4.31Å; W1038-A1070 HydrophobicContact CD2-CB 3.53Å; W1038-A1070 HydrophobicContact CE3-CB 3.24Å; W1038-A1070 HydrophobicContact CG-CB 4.04Å; W1038-A1070 HydrophobicContact CH2-CB 4.26Å; W1038-A1070 HydrophobicContact CZ3-CB 3.65Å; W1038-F1192 AromaticContact CE2-CD1 3.64Å; W1038-F1192 AromaticContact CE2-CE1 3.99Å; W1038-F1192 HydrophobicContact CH2-CE1 4.35Å; W1038-F1192 AromaticContact CZ2-CD1 3.79Å; W1038-F1192 HydrophobicContact CZ2-CD1 3.79Å; W1038-F1192 AromaticContact CZ2-CE1 3.64Å; W1038-F1192 HydrophobicContact CZ2-CE1 3.64Å; W1038-F1192 AromaticContact NE1-CD1 3.45Å; W1038-F1194 HydrophobicContact CB-CD1 3.77Å; W1038-F1194 HydrophobicContact CB-CE1 3.71Å; W1038-F1194 HydrophobicContact CG-CD1 4.44Å; W1038-F1194 HydrophobicContact CG-CE1 4.11Å
1039	I	76.8	Confident	66.3	Low	6 Å²	6	50.1 Å²	50.1	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-36.7	-169.1	60.2	153	0	0	0	113.6	V996 A1037 D1193 C1195	V996-I1039 PolarHBondContact N-O 2.79Å; A1037-I1039 HydrophobicContact CB-CG2 4.03Å; I1039-D1193 HydrophobicContact CD1-CB 4.12Å; I1039-D1193 HydrophobicContact CG1-CB 3.72Å; I1039-D1193 VanDerWaalsContact CG1-O 3.3Å; I1039-D1193 WeakPolarHBondContact CG1-O 3.49Å; I1039-D1193 PolarHBondContact N-O 3.01Å; I1039-C1195 VanDerWaalsContact CD1-SG 3.6Å; I1039-C1195 HydrophobicContact CG2-CB 4.15Å
1040	R	77.4	Confident	67.4	Low	52 Å²	52	48.1 Å²	48.1	20%	0.196	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	156.9	179.2	-57.7	173.8	176.7	176.6	-5.5	110.9	F994 L995 W1038 D1193	F994-R1040 CarbonylContact O-C 3.52Å; F994-R1040 WeakPolarHBondContact O-CA 3.36Å; L995-R1040 HydrophobicContact CD2-CG 3.97Å; W1038-R1040 VanDerWaalsContact CD1-O 3.31Å; W1038-R1040 PolarHBondContact NE1-O 2.71Å; R1040-D1193 HydrophobicContact CB-CB 4.06Å; R1040-D1193 WeakPolarHBondContact CD-OD2 3.29Å; R1040-D1193 PolarHBondContact O-N 3.02Å
1041	F	79.2	Confident	68.5	Low	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	135.3	175.4	169.6	-94.3	0	0	0	110.7	F572 T993 F994 W1038 V1043 F1062 M1190 E1191 F1192	F572-F1041 HydrophobicContact CE2-CD1 4.08Å; F572-F1041 HydrophobicContact CZ-CD1 4.43Å; T993-F1041 CarbonylContact C-O 3.51Å; F994-F1041 HydrophobicContact CB-CB 4.46Å; F994-F1041 HydrophobicContact CB-CD1 4.33Å; F994-F1041 AromaticContact CD2-CD1 3.56Å; F994-F1041 HydrophobicContact CD2-CD1 3.56Å; F994-F1041 AromaticContact CD2-CE1 3.88Å; F994-F1041 HydrophobicContact CD2-CE1 3.88Å; F994-F1041 HydrophobicContact CE2-CD1 4.27Å; F994-F1041 HydrophobicContact CE2-CE1 4.17Å; F994-F1041 HydrophobicContact CG-CD1 4.3Å; F994-F1041 PolarHBondContact N-O 3.36Å; F994-F1041 PolarHBondContact O-N 3.45Å; W1038-F1041 HydrophobicContact CZ2-CB 3.76Å; W1038-F1041 HydrophobicContact CZ2-CD2 4.47Å; W1038-F1041 HydrophobicContact CZ2-CG 4.16Å; F1041-V1043 HydrophobicContact CE1-CG2 3.66Å; F1041-V1043 HydrophobicContact CZ-CG2 3.77Å; F1041-F1062 HydrophobicContact CD1-CD1 4.18Å; F1041-F1062 AromaticContact CD1-CE1 3.54Å; F1041-F1062 HydrophobicContact CD1-CE1 3.54Å; F1041-F1062 HydrophobicContact CD1-CZ 4.31Å; F1041-F1062 HydrophobicContact CD2-CE1 4.35Å; F1041-F1062 AromaticContact CE1-CD1 3.74Å; F1041-F1062 HydrophobicContact CE1-CD1 3.74Å; F1041-F1062 AromaticContact CE1-CE1 2.96Å; F1041-F1062 HydrophobicContact CE1-CE1 2.96Å; F1041-F1062 HydrophobicContact CE1-CE2 4.34Å; F1041-F1062 AromaticContact CE1-CZ 3.36Å; F1041-F1062 HydrophobicContact CE1-CZ 3.36Å; F1041-F1062 AromaticContact CE2-CE1 3.85Å; F1041-F1062 HydrophobicContact CE2-CE1 3.85Å; F1041-F1062 AromaticContact CE2-CZ 3.8Å; F1041-F1062 HydrophobicContact CE2-CZ 3.8Å; F1041-F1062 HydrophobicContact CG-CE1 4.24Å; F1041-F1062 HydrophobicContact CZ-CD1 4.31Å; F1041-F1062 AromaticContact CZ-CE1 3.17Å; F1041-F1062 HydrophobicContact CZ-CE1 3.17Å; F1041-F1062 HydrophobicContact CZ-CE2 4.13Å; F1041-F1062 AromaticContact CZ-CZ 3.06Å; F1041-F1062 HydrophobicContact CZ-CZ 3.06Å; F1041-M1190 HydrophobicContact CE2-CB 3.94Å; F1041-M1190 HydrophobicContact CZ-CB 4.09Å; F1041-M1190 HydrophobicContact CZ-CG 4.43Å; F1041-E1191 CarbonylContact C-O 3.55Å; F1041-E1191 WeakPolarHBondContact CA-O 3.47Å; F1041-E1191 WeakPolarHBondContact CD2-O 3.47Å; F1041-E1191 WeakPolarHBondContact CE2-O 3.32Å; F1041-F1192 AromaticContact CD2-CD1 3.8Å; F1041-F1192 HydrophobicContact CD2-CD1 3.8Å; F1041-F1192 AromaticContact CD2-CD2 3.74Å; F1041-F1192 HydrophobicContact CD2-CD2 3.74Å; F1041-F1192 AromaticContact CD2-CE1 3.64Å; F1041-F1192 HydrophobicContact CD2-CE1 3.64Å; F1041-F1192 AromaticContact CD2-CE2 3.57Å; F1041-F1192 HydrophobicContact CD2-CE2 3.57Å; F1041-F1192 AromaticContact CD2-CG 3.83Å; F1041-F1192 HydrophobicContact CD2-CG 3.83Å; F1041-F1192 AromaticContact CD2-CZ 3.51Å; F1041-F1192 HydrophobicContact CD2-CZ 3.51Å; F1041-F1192 AromaticContact CE2-CD2 3.85Å; F1041-F1192 HydrophobicContact CE2-CD2 3.85Å; F1041-F1192 HydrophobicContact CE2-CE1 4.23Å; F1041-F1192 AromaticContact CE2-CE2 3.4Å; F1041-F1192 HydrophobicContact CE2-CE2 3.4Å; F1041-F1192 HydrophobicContact CE2-CG 4.41Å; F1041-F1192 AromaticContact CE2-CZ 3.61Å; F1041-F1192 HydrophobicContact CE2-CZ 3.61Å; F1041-F1192 HydrophobicContact CG-CE1 4.49Å
1042	H	77.6	Confident	69.4	Low	16 Å²	16	38.6 Å²	38.6	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.9	-176.9	-52	-95.7	0	0	0	112.9	P990 T992 T993 L1044 M1190 E1191 D1193	P990-H1042 HydrophobicContact CB-CB 4.01Å; T992-H1042 VanDerWaalsContact O-CA 3.22Å; T992-H1042 WeakPolarHBondContact O-CA 3.43Å; T993-H1042 WeakPolarHBondContact CG2-CE1 3.08Å; T993-H1042 PolarHBondContact OG1-CE1 3.01Å; T993-H1042 PolarHBondContact OG1-ND1 3.13Å; H1042-L1044 HydrophobicContact CB-CD2 3.9Å; H1042-M1190 CarbonylContact O-C 3.47Å; H1042-M1190 VanDerWaalsContact O-CA 3.27Å; H1042-M1190 WeakPolarHBondContact O-CA 3.45Å; H1042-E1191 HydrophobicContact CB-CB 4.22Å; H1042-E1191 PolarHBondContact N-O 3.49Å; H1042-E1191 PolarHBondContact O-N 3.45Å; H1042-D1193 IonicContact NE2-OD2 3.17Å
1043	V	75.9	Confident	69.4	Low	8 Å²	8	37 Å²	37	5%	0.048	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122.7	161.4	-168.2	0	0	0	0	107.8	I991 T992 F1041 V1046 F1062	I991-V1043 PolarHBondContact N-O 2.98Å; T992-V1043 PolarHBondContact N-O 3.25Å; T992-V1043 PolarHBondContact O-N 3.2Å; T992-V1043 VanDerWaalsContact O-N 3.09Å; T992-V1043 WeakPolarHBondContact OG1-CB 3.39Å; T992-V1043 WeakPolarHBondContact OG1-CG2 3.46Å; F1041-V1043 HydrophobicContact CE1-CG2 3.66Å; F1041-V1043 HydrophobicContact CZ-CG2 3.77Å; V1043-V1046 WeakPolarHBondContact CG1-O 3.47Å; V1043-F1062 HydrophobicContact CG2-CD2 4.45Å; V1043-F1062 HydrophobicContact CG2-CE2 4.01Å; V1043-F1062 HydrophobicContact CG2-CZ 4.2Å
1044	L	75.2	Confident	68.5	Low	4 Å²	4	34.7 Å²	34.7	2%	0.021	18%	0.176	C	C	.	.			trans	-92.1	-30.8	-168.3	-57.9	-175.1	0	0	0	114	L988 P990 H1042 R1095 Q1189 E1191	L988-L1044 HydrophobicContact CB-CB 4.32Å; P990-L1044 HydrophobicContact CB-CD2 3.88Å; H1042-L1044 HydrophobicContact CB-CD2 3.9Å; L1044-R1095 HydrophobicContact CD1-CG 4.49Å; L1044-Q1189 HydrophobicContact CB-CB 4.07Å; L1044-Q1189 HydrophobicContact CD1-CB 4.23Å; L1044-Q1189 PolarHBondContact N-O 3.22Å; L1044-E1191 HydrophobicContact CD1-CB 4.41Å; L1044-E1191 HydrophobicContact CD2-CB 4.49Å
1045	N	72.6	Confident	67.4	Low	48 Å²	48	38.2 Å²	38.2	26%	0.257	20%	0.204	S	C	.	.	S	Bend	trans	-146.9	6.8	-166.8	69.5	-12.1	0	0	0	117.1	L988 V1187 Q1189	L988-N1045 HydrophobicContact CD1-CB 4.24Å; L988-N1045 HydrophobicContact CD2-CB 4.29Å; N1045-V1187 PolarHBondContact ND2-O 3.16Å; N1045-Q1189 PolarHBondContact OD1-N 3.12Å
1046	V	65.3	Low	65.7	Low	15 Å²	15	36.2 Å²	36.2	9%	0.091	21%	0.205	C	C	.	.			trans	-130.7	129.2	175.2	-175.7	0	0	0	0	112.1	V1043 Q1048 V1049 I1188	V1043-V1046 WeakPolarHBondContact CG1-O 3.47Å; V1046-Q1048 WeakPolarHBondContact CG1-O 3.45Å; V1046-V1049 HydrophobicContact CB-CG2 3.98Å; V1046-V1049 HydrophobicContact CG1-CG2 3.58Å; V1046-I1188 HydrophobicContact CB-CG2 4.22Å; V1046-I1188 HydrophobicContact CG2-CB 4.28Å; V1046-I1188 HydrophobicContact CG2-CG1 4.14Å; V1046-I1188 HydrophobicContact CG2-CG2 3.87Å
1047	D	53.7	Low	63.8	Low	84 Å²	84	42.2 Å²	42.2	45%	0.449	25%	0.247	S	C	.	.	S	Bend	trans	-81.9	-24.8	-170.3	-142	61.4	0	0	0	114.4	K960 F962	K960-D1047 PolarHBondContact NZ-O 2.65Å; K960-D1047 IonicContact NZ-OD2 3.14Å; K960-D1047 PolarHBondContact NZ-OD2 3Å; F962-D1047 VanDerWaalsContact CE1-OD1 3.29Å; F962-D1047 WeakPolarHBondContact CE1-OD1 3.41Å; F962-D1047 VanDerWaalsContact CZ-OD1 3.24Å; F962-D1047 WeakPolarHBondContact CZ-OD1 3.44Å
1048	Q	55.5	Low	61.8	Low	76 Å²	76	47.2 Å²	47.2	36%	0.355	27%	0.268	S	S	.	.			trans	-152.2	124.3	171.5	-68.3	-160.9	-41.2	0	0	111.1	V1046	V1046-Q1048 WeakPolarHBondContact CG1-O 3.45Å
1049	V	56.8	Low	60.1	Low	26 Å²	26	49.9 Å²	49.9	16%	0.158	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.7	169.9	-178.3	0	0	0	0	107.7	V1046 F1051 L1159 I1188	V1046-V1049 HydrophobicContact CB-CG2 3.98Å; V1046-V1049 HydrophobicContact CG1-CG2 3.58Å; V1049-F1051 HydrophobicContact CG1-CD2 4.36Å; V1049-F1051 HydrophobicContact CG1-CE2 4.12Å; V1049-F1051 HydrophobicContact CG1-CZ 4.23Å; V1049-L1159 HydrophobicContact CG1-CD2 3.32Å; V1049-I1188 HydrophobicContact CG1-CD1 4.18Å; V1049-I1188 HydrophobicContact CG2-CD1 4.02Å; V1049-I1188 HydrophobicContact CG2-CG2 4.09Å
1050	E	54.5	Low	59	Low	63 Å²	63	51.3 Å²	51.3	29%	0.294	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	105.9	172.4	-71.3	-176.1	-153.3	0	0	108.7	I1052 K1160 V1162 K1167	E1050-I1052 PolarHBondContact O-N 2.96Å; E1050-K1160 PolarHBondContact N-O 2.79Å; E1050-K1160 VanDerWaalsContact N-O 3.1Å; E1050-K1160 PolarHBondContact O-N 3.3Å; E1050-K1160 VanDerWaalsContact O-N 3.13Å; E1050-K1160 VanDerWaalsContact O-O 3.14Å; E1050-V1162 HydrophobicContact CB-CG2 3.88Å; E1050-V1162 HydrophobicContact CG-CG2 3.95Å; E1050-K1167 IonicContact OE1-NZ 2.67Å; E1050-K1167 PolarHBondContact OE1-NZ 2.75Å
1051	F	55	Low	58.2	Low	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	126.3	169.5	-60	-88	0	0	0	108.8	V1049 A1059 V1060 F1062 F1065 W1155 C1158 L1159 M1190	V1049-F1051 HydrophobicContact CG1-CD2 4.36Å; V1049-F1051 HydrophobicContact CG1-CE2 4.12Å; V1049-F1051 HydrophobicContact CG1-CZ 4.23Å; F1051-A1059 WeakPolarHBondContact O-CA 3.35Å; F1051-V1060 HydrophobicContact CB-CB 4.24Å; F1051-V1060 PolarHBondContact O-N 2.96Å; F1051-F1062 HydrophobicContact CE2-CD2 4.06Å; F1051-F1062 HydrophobicContact CE2-CE2 4.35Å; F1051-F1065 HydrophobicContact CD2-CB 4.49Å; F1051-F1065 HydrophobicContact CE1-CB 4.38Å; F1051-F1065 HydrophobicContact CE1-CD2 4.12Å; F1051-F1065 HydrophobicContact CE1-CG 4.19Å; F1051-F1065 HydrophobicContact CE2-CB 3.85Å; F1051-F1065 HydrophobicContact CE2-CD1 4.46Å; F1051-F1065 HydrophobicContact CE2-CG 4.14Å; F1051-F1065 HydrophobicContact CZ-CB 3.78Å; F1051-F1065 AromaticContact CZ-CD1 3.95Å; F1051-F1065 HydrophobicContact CZ-CD1 3.95Å; F1051-F1065 AromaticContact CZ-CD2 3.97Å; F1051-F1065 HydrophobicContact CZ-CD2 3.97Å; F1051-F1065 AromaticContact CZ-CG 3.59Å; F1051-F1065 HydrophobicContact CZ-CG 3.59Å; F1051-W1155 HydrophobicContact CB-CE3 4.26Å; F1051-W1155 HydrophobicContact CB-CZ3 3.79Å; F1051-W1155 AromaticContact CD1-CE3 3.4Å; F1051-W1155 HydrophobicContact CD1-CE3 3.4Å; F1051-W1155 AromaticContact CD1-CZ3 3.72Å; F1051-W1155 HydrophobicContact CD1-CZ3 3.72Å; F1051-W1155 HydrophobicContact CD2-CZ3 4.22Å; F1051-W1155 AromaticContact CE1-CE3 3.71Å; F1051-W1155 HydrophobicContact CE1-CE3 3.71Å; F1051-W1155 HydrophobicContact CE1-CZ3 4.24Å; F1051-W1155 AromaticContact CG-CE3 3.88Å; F1051-W1155 HydrophobicContact CG-CE3 3.88Å; F1051-W1155 AromaticContact CG-CZ3 3.68Å; F1051-W1155 HydrophobicContact CG-CZ3 3.68Å; F1051-W1155 HydrophobicContact CZ-CE3 4.46Å; F1051-C1158 CarbonylContact C-O 3.53Å; F1051-C1158 WeakPolarHBondContact CA-O 3.12Å; F1051-L1159 HydrophobicContact CD1-CD2 3.55Å; F1051-L1159 HydrophobicContact CD1-CG 4.06Å; F1051-L1159 HydrophobicContact CE1-CD2 3.25Å; F1051-L1159 HydrophobicContact CE1-CG 3.88Å; F1051-L1159 HydrophobicContact CG-CD2 4.44Å; F1051-L1159 HydrophobicContact CZ-CD2 3.92Å; F1051-M1190 HydrophobicContact CZ-CE 4.38Å
1052	I	53.6	Low	57.6	Low	54 Å²	54	52.5 Å²	52.5	28%	0.277	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	110.5	177.5	-53.1	-169.4	0	0	0	108.4	E1050 T1054 C1158 K1160	E1050-I1052 PolarHBondContact O-N 2.96Å; I1052-T1054 PolarHBondContact O-N 3.09Å; I1052-C1158 PolarHBondContact N-O 3.44Å; I1052-K1160 HydrophobicContact CD1-CD 3.9Å; I1052-K1160 HydrophobicContact CD1-CG 4.5Å; I1052-K1160 HydrophobicContact CG1-CD 4.5Å
1053	S	47.8	Very low	57.1	Low	23 Å²	23	52.3 Å²	52.3	16%	0.161	31%	0.312	C	S	.	.			trans	-59	128.6	173.6	169.8	0	0	0	0	110.2	S1055 S1056	S1053-S1055 VanDerWaalsContact C-N 3.27Å; S1053-S1055 PolarHBondContact O-N 3.24Å; S1053-S1055 PolarHBondContact OG-N 2.97Å; S1053-S1055 PolarHBondContact OG-OG 2.71Å; S1053-S1056 WeakPolarHBondContact CB-O 3.35Å; S1053-S1056 PolarHBondContact OG-N 2.93Å
1054	T	49.1	Very low	56.8	Low	118 Å²	118	54.4 Å²	54.4	72%	0.724	32%	0.321	S	S	*	.	S	Bend	trans	-73	-21.6	178	53.3	0	0	0	0	112.7	I1052	I1052-T1054 PolarHBondContact O-N 3.09Å
1055	S	51.6	Low	57.1	Low	111 Å²	111	54.2 Å²	54.2	78%	0.776	32%	0.32	S	S	*	.	S	Bend	trans	-96.4	-18.5	-178.2	59.4	0	0	0	0	114.2	S1053	S1053-S1055 VanDerWaalsContact C-N 3.27Å; S1053-S1055 PolarHBondContact O-N 3.24Å; S1053-S1055 PolarHBondContact OG-N 2.97Å; S1053-S1055 PolarHBondContact OG-OG 2.71Å
1056	S	47.8	Very low	57.4	Low	55 Å²	55	51.9 Å²	51.9	39%	0.385	31%	0.308	S	S	.	.	S	Bend	trans	-142.9	133.4	170.4	74.7	0	0	0	0	110.8	S1053 K1058	S1053-S1056 WeakPolarHBondContact CB-O 3.35Å; S1053-S1056 PolarHBondContact OG-N 2.93Å; S1056-K1058 PolarHBondContact O-N 3.41Å
1057	S	46.1	Very low	58	Low	126 Å²	126	51.7 Å²	51.7	88%	0.881	31%	0.306	S	S	*	.	S	Bend	trans	-75.4	42.9	-175	68.1	0	0	0	0	113.8
1058	K	42.5	Very low	59.5	Low	105 Å²	105	50.4 Å²	50.4	46%	0.457	30%	0.298	S	S	.	.			trans	-104.9	130.2	173.7	-69.6	173.9	170.8	177.9	0	108	S565 S1056 V1060	S565-K1058 WeakPolarHBondContact OG-CD 3.32Å; S565-K1058 WeakPolarHBondContact OG-CE 3.34Å; S565-K1058 PolarHBondContact OG-NZ 3.41Å; S1056-K1058 PolarHBondContact O-N 3.41Å; K1058-V1060 PolarHBondContact O-N 3.35Å
1059	A	48.1	Very low	61	Low	58 Å²	58	46.8 Å²	46.8	48%	0.479	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	129.4	162	0	0	0	0	0	108.1	F1051	F1051-A1059 WeakPolarHBondContact O-CA 3.35Å
1060	V	54.4	Low	62.5	Low	35 Å²	35	45.6 Å²	45.6	21%	0.212	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	131.4	177	-166	0	0	0	0	107.5	F1051 K1058 H1064 W1155	F1051-V1060 HydrophobicContact CB-CB 4.24Å; F1051-V1060 PolarHBondContact O-N 2.96Å; K1058-V1060 PolarHBondContact O-N 3.35Å; V1060-H1064 HydrophobicContact CG1-CB 3.82Å; V1060-W1155 HydrophobicContact CB-CH2 4.27Å; V1060-W1155 HydrophobicContact CB-CZ3 4.29Å; V1060-W1155 HydrophobicContact CG1-CH2 3.63Å; V1060-W1155 HydrophobicContact CG1-CZ3 4.13Å
1061	T	59.8	Low	64	Low	40 Å²	40	44.4 Å²	44.4	25%	0.245	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-77.7	154.9	-173.2	44.3	0	0	0	0	112.6	Y568 N569 G1063 H1064	Y568-T1061 PolarHBondContact O-OG1 2.89Å; N569-T1061 HydrophobicContact CB-CG2 4.32Å; T1061-G1063 PolarHBondContact O-N 2.87Å; T1061-H1064 PolarHBondContact O-N 2.83Å
1062	F	66.3	Low	65.6	Low	38 Å²	38	45 Å²	45	17%	0.167	27%	0.272	C	S	.	.	H	α-helix	trans	-51	-39.7	174.3	-164.8	-77.4	0	0	0	112.9	F572 F1041 V1043 F1051 H1064 F1065 S1066 M1190	F572-F1062 HydrophobicContact CE2-CD1 4.26Å; F1041-F1062 HydrophobicContact CD1-CD1 4.18Å; F1041-F1062 AromaticContact CD1-CE1 3.54Å; F1041-F1062 HydrophobicContact CD1-CE1 3.54Å; F1041-F1062 HydrophobicContact CD1-CZ 4.31Å; F1041-F1062 HydrophobicContact CD2-CE1 4.35Å; F1041-F1062 AromaticContact CE1-CD1 3.74Å; F1041-F1062 HydrophobicContact CE1-CD1 3.74Å; F1041-F1062 AromaticContact CE1-CE1 2.96Å; F1041-F1062 HydrophobicContact CE1-CE1 2.96Å; F1041-F1062 HydrophobicContact CE1-CE2 4.34Å; F1041-F1062 AromaticContact CE1-CZ 3.36Å; F1041-F1062 HydrophobicContact CE1-CZ 3.36Å; F1041-F1062 AromaticContact CE2-CE1 3.85Å; F1041-F1062 HydrophobicContact CE2-CE1 3.85Å; F1041-F1062 AromaticContact CE2-CZ 3.8Å; F1041-F1062 HydrophobicContact CE2-CZ 3.8Å; F1041-F1062 HydrophobicContact CG-CE1 4.24Å; F1041-F1062 HydrophobicContact CZ-CD1 4.31Å; F1041-F1062 AromaticContact CZ-CE1 3.17Å; F1041-F1062 HydrophobicContact CZ-CE1 3.17Å; F1041-F1062 HydrophobicContact CZ-CE2 4.13Å; F1041-F1062 AromaticContact CZ-CZ 3.06Å; F1041-F1062 HydrophobicContact CZ-CZ 3.06Å; V1043-F1062 HydrophobicContact CG2-CD2 4.45Å; V1043-F1062 HydrophobicContact CG2-CE2 4.01Å; V1043-F1062 HydrophobicContact CG2-CZ 4.2Å; F1051-F1062 HydrophobicContact CE2-CD2 4.06Å; F1051-F1062 HydrophobicContact CE2-CE2 4.35Å; F1062-H1064 PolarHBondContact O-N 3.44Å; F1062-F1065 HydrophobicContact CE1-CD1 4.38Å; F1062-F1065 HydrophobicContact CE2-CD1 4.26Å; F1062-F1065 AromaticContact CZ-CD1 3.86Å; F1062-F1065 HydrophobicContact CZ-CD1 3.86Å; F1062-F1065 HydrophobicContact CZ-CE1 4.21Å; F1062-F1065 PolarHBondContact O-N 3.47Å; F1062-S1066 PolarHBondContact O-N 2.95Å; F1062-S1066 VanDerWaalsContact O-N 3.09Å; F1062-S1066 PolarHBondContact O-OG 2.61Å; F1062-M1190 HydrophobicContact CE2-CE 3.8Å; F1062-M1190 HydrophobicContact CE2-SD 3.62Å; F1062-M1190 HydrophobicContact CZ-CE 4.35Å; F1062-M1190 HydrophobicContact CZ-SD 3.54Å; F1062-M1190 VanDerWaalsContact CZ-SD 3.54Å
1063	G	67.2	Low	67.4	Low	11 Å²	11	42.5 Å²	42.5	11%	0.113	26%	0.259	C	S	.	.	H	α-helix	trans	-61.4	-25.8	178.4	0	0	0	0	0	114.6	T1061 S1066 N1067	T1061-G1063 PolarHBondContact O-N 2.87Å; G1063-S1066 WeakPolarHBondContact CA-OG 3.44Å; G1063-S1066 PolarHBondContact O-OG 3.42Å; G1063-N1067 WeakPolarHBondContact O-CB 3.18Å; G1063-N1067 PolarHBondContact O-N 3.14Å; G1063-N1067 VanDerWaalsContact O-N 3.15Å
1064	H	70.5	Confident	69.4	Low	52 Å²	52	41.6 Å²	41.6	24%	0.241	25%	0.252	C	S	.	.	H	α-helix	trans	-77.8	-47.9	175.6	-172.2	-49.8	0	0	0	111.7	Y568 V1060 T1061 F1062 S1066 N1067 E1068 W1155	Y568-H1064 HydrophobicContact CD1-CB 4.22Å; Y568-H1064 AromaticContact CD1-CD2 3.7Å; Y568-H1064 AromaticContact CE1-CD2 3.96Å; Y568-H1064 AromaticContact CG-CD2 3.87Å; V1060-H1064 HydrophobicContact CG1-CB 3.82Å; T1061-H1064 PolarHBondContact O-N 2.83Å; F1062-H1064 PolarHBondContact O-N 3.44Å; H1064-S1066 VanDerWaalsContact C-N 3.3Å; H1064-S1066 PolarHBondContact O-N 3.41Å; H1064-N1067 PolarHBondContact O-N 3.08Å; H1064-E1068 IonicContact CE1-OE2 2.67Å; H1064-E1068 IonicContact ND1-OE2 2.74Å; H1064-E1068 PolarHBondContact O-N 3.5Å; H1064-E1068 VanDerWaalsContact O-N 3.08Å; H1064-W1155 HydrophobicContact CB-CH2 4.39Å; H1064-W1155 AromaticContact ND1-CH2 3.83Å; H1064-W1155 AromaticContact ND1-CZ2 3.49Å; H1064-W1155 WeakPolarHBondContact ND1-CZ2 3.33Å
1065	F	80	Confident	71.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-53.3	-51.4	175.8	162.7	-99.4	0	0	0	110.5	F1051 F1062 N1067 E1068 V1069 L1098 L1152 W1155 M1190 F1192	F1051-F1065 HydrophobicContact CD2-CB 4.49Å; F1051-F1065 HydrophobicContact CE1-CB 4.38Å; F1051-F1065 HydrophobicContact CE1-CD2 4.12Å; F1051-F1065 HydrophobicContact CE1-CG 4.19Å; F1051-F1065 HydrophobicContact CE2-CB 3.85Å; F1051-F1065 HydrophobicContact CE2-CD1 4.46Å; F1051-F1065 HydrophobicContact CE2-CG 4.14Å; F1051-F1065 HydrophobicContact CZ-CB 3.78Å; F1051-F1065 AromaticContact CZ-CD1 3.95Å; F1051-F1065 HydrophobicContact CZ-CD1 3.95Å; F1051-F1065 AromaticContact CZ-CD2 3.97Å; F1051-F1065 HydrophobicContact CZ-CD2 3.97Å; F1051-F1065 AromaticContact CZ-CG 3.59Å; F1051-F1065 HydrophobicContact CZ-CG 3.59Å; F1062-F1065 HydrophobicContact CE1-CD1 4.38Å; F1062-F1065 HydrophobicContact CE2-CD1 4.26Å; F1062-F1065 AromaticContact CZ-CD1 3.86Å; F1062-F1065 HydrophobicContact CZ-CD1 3.86Å; F1062-F1065 HydrophobicContact CZ-CE1 4.21Å; F1062-F1065 PolarHBondContact O-N 3.47Å; F1065-N1067 PolarHBondContact O-N 3.32Å; F1065-E1068 PolarHBondContact O-N 3.4Å; F1065-V1069 HydrophobicContact CD2-CG2 4.23Å; F1065-V1069 HydrophobicContact CE1-CG2 4.09Å; F1065-V1069 HydrophobicContact CE2-CG2 3.72Å; F1065-V1069 HydrophobicContact CZ-CG2 3.64Å; F1065-V1069 WeakPolarHBondContact O-CG2 3.26Å; F1065-V1069 PolarHBondContact O-N 3.5Å; F1065-L1098 HydrophobicContact CE2-CD1 4.02Å; F1065-L1098 HydrophobicContact CZ-CD1 3.85Å; F1065-L1152 HydrophobicContact CE2-CD2 3.78Å; F1065-L1152 HydrophobicContact CZ-CD2 3.89Å; F1065-W1155 HydrophobicContact CB-CD2 4.25Å; F1065-W1155 HydrophobicContact CB-CE3 4.08Å; F1065-W1155 HydrophobicContact CB-CH2 3.94Å; F1065-W1155 HydrophobicContact CB-CZ2 4.16Å; F1065-W1155 HydrophobicContact CB-CZ3 3.92Å; F1065-W1155 HydrophobicContact CD2-CB 3.94Å; F1065-W1155 AromaticContact CD2-CD2 3.67Å; F1065-W1155 HydrophobicContact CD2-CD2 3.67Å; F1065-W1155 HydrophobicContact CD2-CE3 4.05Å; F1065-W1155 AromaticContact CD2-CG 3.62Å; F1065-W1155 HydrophobicContact CD2-CG 3.62Å; F1065-W1155 HydrophobicContact CE2-CB 4.05Å; F1065-W1155 HydrophobicContact CE2-CG 4.12Å; F1065-W1155 HydrophobicContact CG-CD2 4.45Å; F1065-M1190 HydrophobicContact CD1-SD 4.1Å; F1065-M1190 HydrophobicContact CE1-CE 4.34Å; F1065-M1190 HydrophobicContact CE1-SD 3.38Å; F1065-M1190 WeakPolarHBondContact CE1-SD 3.17Å; F1065-M1190 HydrophobicContact CZ-SD 4.04Å; F1065-F1192 HydrophobicContact CE1-CZ 4.2Å
1066	S	79.8	Confident	73.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.3	-34.1	-176.6	48.6	0	0	0	0	113.4	F572 W1038 F1062 G1063 H1064 A1070 F1192	F572-S1066 VanDerWaalsContact CZ-OG 3.29Å; F572-S1066 WeakPolarHBondContact CZ-OG 3.48Å; W1038-S1066 VanDerWaalsContact CH2-C 3.44Å; W1038-S1066 WeakPolarHBondContact CH2-O 3.46Å; F1062-S1066 PolarHBondContact O-N 2.95Å; F1062-S1066 VanDerWaalsContact O-N 3.09Å; F1062-S1066 PolarHBondContact O-OG 2.61Å; G1063-S1066 WeakPolarHBondContact CA-OG 3.44Å; G1063-S1066 PolarHBondContact O-OG 3.42Å; H1064-S1066 VanDerWaalsContact C-N 3.3Å; H1064-S1066 PolarHBondContact O-N 3.41Å; S1066-A1070 WeakPolarHBondContact O-CB 3.46Å; S1066-A1070 PolarHBondContact O-N 2.73Å; S1066-F1192 WeakPolarHBondContact O-CE1 3.33Å
1067	N	78.6	Confident	75.1	Confident	11 Å²	11	31.8 Å²	31.8	6%	0.059	18%	0.179	C	C	.	.	H	α-helix	trans	-65.1	-40.6	172.9	-171.5	83.8	0	0	0	112.8	Y1000 W1003 H1004 W1038 G1063 H1064 F1065 A1070 E1071	Y1000-N1067 WeakPolarHBondContact CD1-OD1 3.22Å; W1003-N1067 WeakPolarHBondContact CZ3-ND2 3.42Å; H1004-N1067 PolarHBondContact CE1-OD1 2.95Å; H1004-N1067 PolarHBondContact NE2-O 3.34Å; H1004-N1067 VanDerWaalsContact NE2-O 3.14Å; H1004-N1067 PolarHBondContact NE2-OD1 3.15Å; W1038-N1067 HydrophobicContact CZ3-CB 4.49Å; G1063-N1067 WeakPolarHBondContact O-CB 3.18Å; G1063-N1067 PolarHBondContact O-N 3.14Å; G1063-N1067 VanDerWaalsContact O-N 3.15Å; H1064-N1067 PolarHBondContact O-N 3.08Å; F1065-N1067 PolarHBondContact O-N 3.32Å; N1067-A1070 PolarHBondContact O-N 3.17Å; N1067-E1071 WeakPolarHBondContact O-CB 3.46Å; N1067-E1071 PolarHBondContact O-N 3.09Å
1068	E	83.6	Confident	77.1	Confident	57 Å²	57	30 Å²	30	27%	0.266	15%	0.153	S	C	.	.	H	α-helix	trans	-68.5	-41.1	178.4	-164.7	179.8	162.8	0	0	111.4	H1064 F1065 E1071 C1072 V1151 W1155	H1064-E1068 IonicContact CE1-OE2 2.67Å; H1064-E1068 IonicContact ND1-OE2 2.74Å; H1064-E1068 PolarHBondContact O-N 3.5Å; H1064-E1068 VanDerWaalsContact O-N 3.08Å; F1065-E1068 PolarHBondContact O-N 3.4Å; E1068-E1071 PolarHBondContact O-N 2.66Å; E1068-C1072 PolarHBondContact O-N 2.78Å; E1068-C1072 VanDerWaalsContact O-N 3.07Å; E1068-C1072 PolarHBondContact O-SG 2.99Å; E1068-V1151 HydrophobicContact CG-CG1 3.94Å; E1068-W1155 VanDerWaalsContact OE2-CZ2 3.25Å; E1068-W1155 WeakPolarHBondContact OE2-CZ2 3.5Å; E1068-W1155 PolarHBondContact OE2-NE1 3.43Å
1069	V	88.5	Confident	79.2	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.7	-51.5	170.7	165	0	0	0	0	111.5	F1065 E1071 C1072 V1073 I1096 L1148 L1152 F1192	F1065-V1069 HydrophobicContact CD2-CG2 4.23Å; F1065-V1069 HydrophobicContact CE1-CG2 4.09Å; F1065-V1069 HydrophobicContact CE2-CG2 3.72Å; F1065-V1069 HydrophobicContact CZ-CG2 3.64Å; F1065-V1069 WeakPolarHBondContact O-CG2 3.26Å; F1065-V1069 PolarHBondContact O-N 3.5Å; V1069-E1071 VanDerWaalsContact C-N 3.32Å; V1069-E1071 PolarHBondContact O-N 3.02Å; V1069-C1072 WeakPolarHBondContact O-CB 3.41Å; V1069-C1072 PolarHBondContact O-N 3.12Å; V1069-C1072 VanDerWaalsContact O-N 3.16Å; V1069-V1073 HydrophobicContact CG1-CG2 4.48Å; V1069-V1073 WeakPolarHBondContact O-CG2 3.18Å; V1069-V1073 PolarHBondContact O-N 3.45Å; V1069-I1096 HydrophobicContact CG1-CD1 3.53Å; V1069-I1096 HydrophobicContact CG2-CD1 4.36Å; V1069-L1148 HydrophobicContact CB-CD1 4.43Å; V1069-L1148 HydrophobicContact CG1-CD1 4.07Å; V1069-L1148 HydrophobicContact CG2-CD1 4.29Å; V1069-L1152 HydrophobicContact CG2-CD2 3.66Å; V1069-F1192 HydrophobicContact CB-CE1 4.06Å; V1069-F1192 HydrophobicContact CB-CZ 3.95Å; V1069-F1192 HydrophobicContact CG1-CD1 4.17Å; V1069-F1192 HydrophobicContact CG1-CD2 4.39Å; V1069-F1192 HydrophobicContact CG1-CE1 3.68Å; V1069-F1192 HydrophobicContact CG1-CE2 3.95Å; V1069-F1192 HydrophobicContact CG1-CZ 3.57Å; V1069-F1192 HydrophobicContact CG2-CZ 4.49Å
1070	A	87	Confident	81.1	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-37.6	-179.2	0	0	0	0	0	112.1	W1038 S1066 N1067 C1072 V1073 I1074 F1194	W1038-A1070 HydrophobicContact CB-CB 4.31Å; W1038-A1070 HydrophobicContact CD2-CB 3.53Å; W1038-A1070 HydrophobicContact CE3-CB 3.24Å; W1038-A1070 HydrophobicContact CG-CB 4.04Å; W1038-A1070 HydrophobicContact CH2-CB 4.26Å; W1038-A1070 HydrophobicContact CZ3-CB 3.65Å; S1066-A1070 WeakPolarHBondContact O-CB 3.46Å; S1066-A1070 PolarHBondContact O-N 2.73Å; N1067-A1070 PolarHBondContact O-N 3.17Å; A1070-C1072 VanDerWaalsContact C-N 3.32Å; A1070-C1072 PolarHBondContact O-N 3.35Å; A1070-V1073 PolarHBondContact O-N 3.26Å; A1070-I1074 WeakPolarHBondContact O-CB 3.38Å; A1070-I1074 WeakPolarHBondContact O-CD1 3.37Å; A1070-I1074 WeakPolarHBondContact O-CG1 3.49Å; A1070-I1074 PolarHBondContact O-N 3.15Å; A1070-F1194 HydrophobicContact CB-CE1 4.24Å; A1070-F1194 HydrophobicContact CB-CZ 4.41Å
1071	E	86.2	Confident	82.6	Confident	39 Å²	39	28.7 Å²	28.7	18%	0.182	14%	0.144	C	C	.	.	H	α-helix	trans	-60.1	-41.9	173.8	-168.8	-179.7	159.1	0	0	111.7	W1003 N1067 E1068 V1069 K1075	W1003-E1071 WeakPolarHBondContact CH2-OE2 3.19Å; W1003-E1071 WeakPolarHBondContact CZ3-OE2 3.41Å; N1067-E1071 WeakPolarHBondContact O-CB 3.46Å; N1067-E1071 PolarHBondContact O-N 3.09Å; E1068-E1071 PolarHBondContact O-N 2.66Å; V1069-E1071 VanDerWaalsContact C-N 3.32Å; V1069-E1071 PolarHBondContact O-N 3.02Å; E1071-K1075 HydrophobicContact CG-CD 4.33Å; E1071-K1075 WeakPolarHBondContact O-CB 3.42Å; E1071-K1075 VanDerWaalsContact O-CG 3.25Å; E1071-K1075 WeakPolarHBondContact O-CG 3.35Å; E1071-K1075 PolarHBondContact O-N 3.27Å; E1071-K1075 VanDerWaalsContact OE1-CE 3.25Å; E1071-K1075 WeakPolarHBondContact OE1-CE 3.26Å; E1071-K1075 IonicContact OE1-NZ 2.69Å; E1071-K1075 PolarHBondContact OE1-NZ 3.08Å
1072	C	89.9	Confident	83.6	Confident	12 Å²	12	28.3 Å²	28.3	8%	0.081	15%	0.147	C	C	.	.	H	α-helix	trans	-64.2	-45.9	176.5	-67.3	0	0	0	0	112.3	E1068 V1069 A1070 K1075 A1076 I1147 L1148	E1068-C1072 PolarHBondContact O-N 2.78Å; E1068-C1072 VanDerWaalsContact O-N 3.07Å; E1068-C1072 PolarHBondContact O-SG 2.99Å; V1069-C1072 WeakPolarHBondContact O-CB 3.41Å; V1069-C1072 PolarHBondContact O-N 3.12Å; V1069-C1072 VanDerWaalsContact O-N 3.16Å; A1070-C1072 VanDerWaalsContact C-N 3.32Å; A1070-C1072 PolarHBondContact O-N 3.35Å; C1072-K1075 PolarHBondContact O-N 3.48Å; C1072-A1076 WeakPolarHBondContact O-CB 3.34Å; C1072-A1076 PolarHBondContact O-N 2.79Å; C1072-I1147 HydrophobicContact CB-CG2 3.87Å; C1072-L1148 HydrophobicContact CB-CD1 4.16Å
1073	V	91	Very high	84.4	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-43.9	179.2	176.8	0	0	0	0	111.4	L1036 V1069 A1070 K1075 A1076 L1077 L1094 L1144 L1148 F1194	L1036-V1073 HydrophobicContact CD2-CG1 4.42Å; V1069-V1073 HydrophobicContact CG1-CG2 4.48Å; V1069-V1073 WeakPolarHBondContact O-CG2 3.18Å; V1069-V1073 PolarHBondContact O-N 3.45Å; A1070-V1073 PolarHBondContact O-N 3.26Å; V1073-K1075 VanDerWaalsContact C-N 3.34Å; V1073-K1075 PolarHBondContact O-N 2.81Å; V1073-A1076 PolarHBondContact O-N 3.14Å; V1073-L1077 HydrophobicContact CG1-CD1 3.81Å; V1073-L1077 HydrophobicContact CG1-CG 4.35Å; V1073-L1077 WeakPolarHBondContact O-CB 3.29Å; V1073-L1077 WeakPolarHBondContact O-CG 3.25Å; V1073-L1077 PolarHBondContact O-N 3.31Å; V1073-L1094 HydrophobicContact CG2-CD2 3.4Å; V1073-L1144 HydrophobicContact CG1-CD2 4.48Å; V1073-L1144 HydrophobicContact CG2-CD2 4.28Å; V1073-L1148 HydrophobicContact CG2-CD1 4.48Å; V1073-L1148 HydrophobicContact CG2-CD2 4.29Å; V1073-F1194 HydrophobicContact CB-CE1 4.12Å; V1073-F1194 HydrophobicContact CB-CE2 4.4Å; V1073-F1194 HydrophobicContact CB-CZ 3.74Å; V1073-F1194 HydrophobicContact CG1-CD1 4.46Å; V1073-F1194 HydrophobicContact CG1-CD2 4.37Å; V1073-F1194 HydrophobicContact CG1-CE1 3.91Å; V1073-F1194 HydrophobicContact CG1-CE2 3.82Å; V1073-F1194 HydrophobicContact CG1-CZ 3.57Å; V1073-F1194 HydrophobicContact CG2-CZ 4.09Å
1074	I	89.4	Confident	85.2	Confident	3 Å²	3	30 Å²	30	2%	0.015	15%	0.153	C	C	.	.	H	α-helix	trans	-66.9	-36.5	178.3	-60.4	162.2	0	0	0	110.4	H1004 L1008 L1036 A1070 R1078 F1194	H1004-I1074 HydrophobicContact CB-CD1 3.93Å; L1008-I1074 HydrophobicContact CD1-CB 4.46Å; L1008-I1074 HydrophobicContact CD1-CG2 3.44Å; L1008-I1074 VanDerWaalsContact CD1-CG2 3.44Å; L1036-I1074 HydrophobicContact CB-CG1 4.35Å; L1036-I1074 HydrophobicContact CB-CG2 4.27Å; L1036-I1074 HydrophobicContact CD2-CG1 4.08Å; L1036-I1074 HydrophobicContact CG-CG1 4.44Å; A1070-I1074 WeakPolarHBondContact O-CB 3.38Å; A1070-I1074 WeakPolarHBondContact O-CD1 3.37Å; A1070-I1074 WeakPolarHBondContact O-CG1 3.49Å; A1070-I1074 PolarHBondContact O-N 3.15Å; I1074-R1078 WeakPolarHBondContact O-CB 3.37Å; I1074-R1078 PolarHBondContact O-N 2.88Å; I1074-R1078 VanDerWaalsContact O-N 3.16Å; I1074-F1194 HydrophobicContact CG1-CD1 4.36Å; I1074-F1194 HydrophobicContact CG1-CE1 4.11Å
1075	K	88.2	Confident	85.5	Confident	74 Å²	74	29.5 Å²	29.5	32%	0.322	15%	0.151	S	C	.	.	H	α-helix	trans	-61.5	-50.1	171.6	-78.1	170.9	-176	169.2	0	112.1	L1008 E1071 C1072 V1073	L1008-K1075 HydrophobicContact CD2-CB 4.43Å; L1008-K1075 HydrophobicContact CD2-CG 3.53Å; E1071-K1075 HydrophobicContact CG-CD 4.33Å; E1071-K1075 WeakPolarHBondContact O-CB 3.42Å; E1071-K1075 VanDerWaalsContact O-CG 3.25Å; E1071-K1075 WeakPolarHBondContact O-CG 3.35Å; E1071-K1075 PolarHBondContact O-N 3.27Å; E1071-K1075 VanDerWaalsContact OE1-CE 3.25Å; E1071-K1075 WeakPolarHBondContact OE1-CE 3.26Å; E1071-K1075 IonicContact OE1-NZ 2.69Å; E1071-K1075 PolarHBondContact OE1-NZ 3.08Å; C1072-K1075 PolarHBondContact O-N 3.48Å; V1073-K1075 VanDerWaalsContact C-N 3.34Å; V1073-K1075 PolarHBondContact O-N 2.81Å
1076	A	90.2	Very high	85.3	Confident	3 Å²	3	35.9 Å²	35.9	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-45	-178.3	0	0	0	0	0	112.9	C1072 V1073 P1079 A1143 L1144 I1147	C1072-A1076 WeakPolarHBondContact O-CB 3.34Å; C1072-A1076 PolarHBondContact O-N 2.79Å; V1073-A1076 PolarHBondContact O-N 3.14Å; A1076-P1079 WeakPolarHBondContact O-CD 3.41Å; A1076-A1143 VanDerWaalsContact CB-O 3.3Å; A1076-A1143 WeakPolarHBondContact CB-O 3.24Å; A1076-L1144 HydrophobicContact CB-CD2 3.72Å; A1076-L1144 HydrophobicContact CB-CG 4.17Å; A1076-I1147 HydrophobicContact CB-CD1 4.12Å
1077	L	89.8	Confident	85.1	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-86	-13.4	-173.9	-63.6	-177.2	0	0	0	114.4	L1036 V1073 P1079 Y1080 L1081 I1092 M1108 L1144	L1036-L1077 HydrophobicContact CD2-CB 4.14Å; L1036-L1077 HydrophobicContact CD2-CD1 4.03Å; V1073-L1077 HydrophobicContact CG1-CD1 3.81Å; V1073-L1077 HydrophobicContact CG1-CG 4.35Å; V1073-L1077 WeakPolarHBondContact O-CB 3.29Å; V1073-L1077 WeakPolarHBondContact O-CG 3.25Å; V1073-L1077 PolarHBondContact O-N 3.31Å; L1077-P1079 VanDerWaalsContact C-CD 3.44Å; L1077-Y1080 PolarHBondContact O-N 3.37Å; L1077-L1081 HydrophobicContact CB-CD2 4.39Å; L1077-L1081 WeakPolarHBondContact O-CD2 3.43Å; L1077-L1081 WeakPolarHBondContact O-CG 3.2Å; L1077-L1081 PolarHBondContact O-N 3.14Å; L1077-I1092 HydrophobicContact CD1-CD1 4.06Å; L1077-I1092 HydrophobicContact CD1-CG2 4.43Å; L1077-M1108 HydrophobicContact CD1-SD 4.14Å; L1077-M1108 HydrophobicContact CD2-SD 4.38Å; L1077-L1144 HydrophobicContact CD2-CD1 4.45Å
1078	R	87.3	Confident	84.8	Confident	90 Å²	90	45.9 Å²	45.9	34%	0.34	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-50.5	-44.1	-179.1	-175.6	-178.5	-173.5	179.7	9.8	114.8	L1008 N1009 I1074 Y1080	L1008-R1078 PolarHBondContact O-NH1 2.65Å; N1009-R1078 PolarHBondContact OD1-NH2 3.41Å; I1074-R1078 WeakPolarHBondContact O-CB 3.37Å; I1074-R1078 PolarHBondContact O-N 2.88Å; I1074-R1078 VanDerWaalsContact O-N 3.16Å; R1078-Y1080 PolarHBondContact O-N 2.77Å
1079	P	87.1	Confident	84.3	Confident	103 Å²	103	44.6 Å²	44.6	67%	0.669	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-65.5	-24.9	179.5	-20.1	34.2	0	0	0	113.1	A1076 L1077	A1076-P1079 WeakPolarHBondContact O-CD 3.41Å; L1077-P1079 VanDerWaalsContact C-CD 3.44Å
1080	Y	87.7	Confident	83.6	Confident	59 Å²	59	47.4 Å²	47.4	23%	0.231	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-99	-7.5	-168.8	-56.4	-65.2	0	0	0	114	L1077 R1078 G1082 H1083 L1084 T1139 Y1140 A1143	L1077-Y1080 PolarHBondContact O-N 3.37Å; R1078-Y1080 PolarHBondContact O-N 2.77Å; Y1080-G1082 VanDerWaalsContact C-N 3.27Å; Y1080-G1082 PolarHBondContact O-N 3.37Å; Y1080-G1082 VanDerWaalsContact O-N 3.17Å; Y1080-H1083 WeakPolarHBondContact O-CA 3.45Å; Y1080-H1083 WeakPolarHBondContact O-CB 3.32Å; Y1080-H1083 PolarHBondContact O-N 2.84Å; Y1080-L1084 PolarHBondContact O-N 2.97Å; Y1080-T1139 PolarHBondContact OH-O 3.29Å; Y1080-Y1140 HydrophobicContact CD1-CD1 4.04Å; Y1080-Y1140 AromaticContact CD1-CE1 3.95Å; Y1080-Y1140 HydrophobicContact CD1-CE1 3.95Å; Y1080-Y1140 AromaticContact CD2-CD1 3.91Å; Y1080-Y1140 HydrophobicContact CD2-CD1 3.91Å; Y1080-Y1140 HydrophobicContact CE1-CD1 4.5Å; Y1080-Y1140 HydrophobicContact CE2-CD1 4.36Å; Y1080-Y1140 AromaticContact CG-CD1 3.71Å; Y1080-Y1140 HydrophobicContact CG-CD1 3.71Å; Y1080-Y1140 AromaticContact CG-CE1 3.86Å; Y1080-Y1140 HydrophobicContact CG-CE1 3.86Å; Y1080-A1143 HydrophobicContact CE2-CB 3.81Å
1081	L	85.5	Confident	83.2	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-55.5	-38.1	-173.9	-58.6	-177.5	0	0	0	113.7	L1034 L1036 L1077 L1084 L1085 I1196	L1034-L1081 HydrophobicContact CB-CB 4.29Å; L1034-L1081 HydrophobicContact CB-CD1 4.48Å; L1034-L1081 HydrophobicContact CD1-CB 4.39Å; L1036-L1081 HydrophobicContact CB-CD1 4.23Å; L1036-L1081 HydrophobicContact CB-CD2 3.97Å; L1036-L1081 HydrophobicContact CD1-CD2 4.08Å; L1036-L1081 HydrophobicContact CG-CD2 4.43Å; L1077-L1081 HydrophobicContact CB-CD2 4.39Å; L1077-L1081 WeakPolarHBondContact O-CD2 3.43Å; L1077-L1081 WeakPolarHBondContact O-CG 3.2Å; L1077-L1081 PolarHBondContact O-N 3.14Å; L1081-L1084 HydrophobicContact CD2-CD1 4.49Å; L1081-L1084 PolarHBondContact O-N 3.29Å; L1081-L1085 VanDerWaalsContact O-CB 3.27Å; L1081-L1085 WeakPolarHBondContact O-CB 3.45Å; L1081-L1085 PolarHBondContact O-N 2.94Å; L1081-I1196 HydrophobicContact CD2-CD1 4.31Å; L1081-I1196 HydrophobicContact CD2-CG1 4.33Å
1082	G	81.1	Confident	83.1	Confident	31 Å²	31	50.2 Å²	50.2	32%	0.32	26%	0.262	S	S	.	.	H	α-helix	trans	-66.8	-35.6	175.5	0	0	0	0	0	113.2	Y1080 N1086	Y1080-G1082 VanDerWaalsContact C-N 3.27Å; Y1080-G1082 PolarHBondContact O-N 3.37Å; Y1080-G1082 VanDerWaalsContact O-N 3.17Å; G1082-N1086 WeakPolarHBondContact O-CB 3.46Å; G1082-N1086 PolarHBondContact O-N 2.93Å; G1082-N1086 VanDerWaalsContact O-N 3.08Å; G1082-N1086 PolarHBondContact O-ND2 2.69Å; G1082-N1086 PolarHBondContact O-OD1 2.73Å
1083	H	83.7	Confident	82.8	Confident	79 Å²	79	51.7 Å²	51.7	37%	0.366	27%	0.271	S	S	.	.	H	α-helix	trans	-73.3	-41.2	175.7	-172.6	-115.9	0	0	0	111.6	Y1080 N1086 N1087 Y1140	Y1080-H1083 WeakPolarHBondContact O-CA 3.45Å; Y1080-H1083 WeakPolarHBondContact O-CB 3.32Å; Y1080-H1083 PolarHBondContact O-N 2.84Å; H1083-N1086 PolarHBondContact O-N 2.88Å; H1083-N1087 PolarHBondContact CD2-ND2 3.48Å; H1083-N1087 PolarHBondContact CE1-ND2 2.89Å; H1083-N1087 VanDerWaalsContact CE1-ND2 3.27Å; H1083-N1087 PolarHBondContact NE2-ND2 2.87Å; H1083-N1087 VanDerWaalsContact NE2-ND2 3.15Å; H1083-N1087 PolarHBondContact O-N 3.23Å; H1083-N1087 VanDerWaalsContact O-N 3.17Å; H1083-N1087 PolarHBondContact O-ND2 3.34Å; H1083-Y1140 PolarHBondContact CE1-OH 2.88Å; H1083-Y1140 AromaticContact ND1-CZ 3.98Å; H1083-Y1140 PolarHBondContact ND1-OH 3.1Å
1084	L	83.2	Confident	82.7	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-45.4	175.7	-68.8	162.2	0	0	0	111.2	Y1080 L1081 N1087 N1088 R1089 I1092 Y1140 I1196	Y1080-L1084 PolarHBondContact O-N 2.97Å; L1081-L1084 HydrophobicContact CD2-CD1 4.49Å; L1081-L1084 PolarHBondContact O-N 3.29Å; L1084-N1087 CarbonylContact O-C 3.59Å; L1084-N1087 PolarHBondContact O-N 3.23Å; L1084-N1088 PolarHBondContact O-N 2.78Å; L1084-R1089 HydrophobicContact CB-CB 4.35Å; L1084-R1089 HydrophobicContact CD2-CB 4.14Å; L1084-R1089 WeakPolarHBondContact O-CA 3.14Å; L1084-R1089 WeakPolarHBondContact O-CB 3.4Å; L1084-R1089 PolarHBondContact O-N 3.31Å; L1084-I1092 HydrophobicContact CD1-CD1 3.92Å; L1084-Y1140 HydrophobicContact CD2-CE1 4.36Å; L1084-Y1140 HydrophobicContact CD2-CE2 4.34Å; L1084-I1196 HydrophobicContact CB-CD1 3.66Å
1085	L	77.5	Confident	82.5	Confident	41 Å²	41	54.7 Å²	54.7	22%	0.215	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-45.6	174.8	-179	62.5	0	0	0	112.4	L1034 L1081 N1087 N1088 T1090	L1034-L1085 HydrophobicContact CD1-CD2 3.85Å; L1034-L1085 HydrophobicContact CD2-CD2 3.69Å; L1034-L1085 HydrophobicContact CG-CD2 4.45Å; L1081-L1085 VanDerWaalsContact O-CB 3.27Å; L1081-L1085 WeakPolarHBondContact O-CB 3.45Å; L1081-L1085 PolarHBondContact O-N 2.94Å; L1085-N1087 PolarHBondContact O-N 2.94Å; L1085-N1088 PolarHBondContact O-N 2.98Å; L1085-T1090 HydrophobicContact CD1-CG2 3.8Å
1086	N	76.7	Confident	82.5	Confident	134 Å²	134	51.2 Å²	51.2	72%	0.717	27%	0.267	S	S	*	.	H	α-helix	trans	-62.4	-24.2	178	-73.6	-14.4	0	0	0	113.4	G1082 H1083	G1082-N1086 WeakPolarHBondContact O-CB 3.46Å; G1082-N1086 PolarHBondContact O-N 2.93Å; G1082-N1086 VanDerWaalsContact O-N 3.08Å; G1082-N1086 PolarHBondContact O-ND2 2.69Å; G1082-N1086 PolarHBondContact O-OD1 2.73Å; H1083-N1086 PolarHBondContact O-N 2.88Å
1087	N	75.5	Confident	82.4	Confident	84 Å²	84	52.4 Å²	52.4	45%	0.449	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	16.9	175.2	-69.6	-66.4	0	0	0	112.9	H1083 L1084 L1085 R1089	H1083-N1087 PolarHBondContact CD2-ND2 3.48Å; H1083-N1087 PolarHBondContact CE1-ND2 2.89Å; H1083-N1087 VanDerWaalsContact CE1-ND2 3.27Å; H1083-N1087 PolarHBondContact NE2-ND2 2.87Å; H1083-N1087 VanDerWaalsContact NE2-ND2 3.15Å; H1083-N1087 PolarHBondContact O-N 3.23Å; H1083-N1087 VanDerWaalsContact O-N 3.17Å; H1083-N1087 PolarHBondContact O-ND2 3.34Å; L1084-N1087 CarbonylContact O-C 3.59Å; L1084-N1087 PolarHBondContact O-N 3.23Å; L1085-N1087 PolarHBondContact O-N 2.94Å; N1087-R1089 HydrophobicContact CB-CG 4.43Å; N1087-R1089 PolarHBondContact O-N 3Å
1088	N	71.8	Confident	82.2	Confident	137 Å²	137	52.4 Å²	52.4	73%	0.733	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	15.5	-175	-68.5	-20	0	0	0	115.4	L1084 L1085 T1090	L1084-N1088 PolarHBondContact O-N 2.78Å; L1085-N1088 PolarHBondContact O-N 2.98Å; N1088-T1090 PolarHBondContact O-N 2.92Å
1089	R	72.2	Confident	82	Confident	31 Å²	31	49.7 Å²	49.7	12%	0.117	26%	0.264	C	S	.	.			trans	-82.6	63	177.1	-67.5	-179	178.5	-172.6	0.2	110.3	L1084 N1087 A1110 E1137 I1196	L1084-R1089 HydrophobicContact CB-CB 4.35Å; L1084-R1089 HydrophobicContact CD2-CB 4.14Å; L1084-R1089 WeakPolarHBondContact O-CA 3.14Å; L1084-R1089 WeakPolarHBondContact O-CB 3.4Å; L1084-R1089 PolarHBondContact O-N 3.31Å; N1087-R1089 HydrophobicContact CB-CG 4.43Å; N1087-R1089 PolarHBondContact O-N 3Å; R1089-A1110 HydrophobicContact CB-CB 3.81Å; R1089-A1110 HydrophobicContact CG-CB 3.85Å; R1089-E1137 IonicContact CZ-OE1 3.47Å; R1089-E1137 IonicContact NH1-OE1 3.5Å; R1089-E1137 PolarHBondContact NH1-OE1 2.86Å; R1089-E1137 IonicContact NH2-OE1 3.99Å; R1089-E1137 PolarHBondContact NH2-OE1 3.01Å; R1089-I1196 WeakPolarHBondContact O-CD1 3.49Å
1090	T	74.5	Confident	81.2	Confident	58 Å²	58	45.7 Å²	45.7	36%	0.356	24%	0.238	S	C	.	.			trans	-81.1	-23.2	-174.9	54.1	0	0	0	0	114.2	L1085 N1088 C1195 I1196	L1085-T1090 HydrophobicContact CD1-CG2 3.8Å; N1088-T1090 PolarHBondContact O-N 2.92Å; T1090-C1195 CarbonylContact O-C 3.58Å; T1090-C1195 WeakPolarHBondContact O-CA 3.39Å; T1090-I1196 PolarHBondContact O-N 3.16Å
1091	Q	79	Confident	80.1	Confident	95 Å²	95	46.9 Å²	46.9	44%	0.444	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.7	173.7	-95.2	173.5	-12.2	0	0	109	A1110 S1111 F1194 C1195	Q1091-A1110 VanDerWaalsContact O-CA 3.29Å; Q1091-A1110 WeakPolarHBondContact O-CA 3.49Å; Q1091-A1110 WeakPolarHBondContact O-CB 3.43Å; Q1091-S1111 WeakPolarHBondContact CB-OG 3.42Å; Q1091-S1111 PolarHBondContact O-N 3.07Å; Q1091-S1111 PolarHBondContact OE1-OG 3.07Å; Q1091-F1194 WeakPolarHBondContact CA-O 3.33Å; Q1091-C1195 VanDerWaalsContact CG-SG 3.51Å
1092	I	83.3	Confident	79.6	Confident	4 Å²	4	53 Å²	53	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	126.2	-175	-51	175.9	0	0	0	107.7	L1036 L1077 L1084 M1108 G1109 A1110 F1194	L1036-I1092 HydrophobicContact CD1-CD1 4.08Å; L1077-I1092 HydrophobicContact CD1-CD1 4.06Å; L1077-I1092 HydrophobicContact CD1-CG2 4.43Å; L1084-I1092 HydrophobicContact CD1-CD1 3.92Å; I1092-M1108 HydrophobicContact CG2-CG 3.76Å; I1092-M1108 HydrophobicContact CG2-SD 3.79Å; I1092-G1109 CarbonylContact C-O 3.55Å; I1092-G1109 WeakPolarHBondContact CA-O 3.35Å; I1092-A1110 HydrophobicContact CG1-CB 4.43Å; I1092-F1194 HydrophobicContact CB-CB 4.39Å; I1092-F1194 PolarHBondContact N-O 2.92Å; I1092-F1194 PolarHBondContact O-N 2.98Å
1093	T	85	Confident	79.5	Confident	42 Å²	42	54.6 Å²	54.6	26%	0.258	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.5	179.6	-59.3	0	0	0	0	109.4	M1108 G1109 E1191 F1192 D1193	T1093-M1108 WeakPolarHBondContact O-CA 3.42Å; T1093-G1109 PolarHBondContact N-O 3.05Å; T1093-G1109 PolarHBondContact O-N 2.76Å; T1093-E1191 HydrophobicContact CG2-CG 3.44Å; T1093-E1191 VanDerWaalsContact CG2-CG 3.44Å; T1093-F1192 WeakPolarHBondContact CA-O 3.3Å; T1093-D1193 WeakPolarHBondContact CG2-OD1 3.43Å; T1093-D1193 PolarHBondContact OG1-OD1 3.16Å
1094	L	87.5	Confident	79.6	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	111	-179.7	178	73.9	0	0	0	109.7	V1073 I1096 Y1106 R1107 M1108 L1148 E1191 F1192 F1194	V1073-L1094 HydrophobicContact CG2-CD2 3.4Å; L1094-I1096 HydrophobicContact CD2-CD1 3.96Å; L1094-I1096 HydrophobicContact CD2-CG1 4.21Å; L1094-I1096 HydrophobicContact CG-CD1 4.36Å; L1094-I1096 HydrophobicContact CG-CG1 4.08Å; L1094-Y1106 HydrophobicContact CD1-CD2 3.5Å; L1094-Y1106 HydrophobicContact CD1-CE2 4.32Å; L1094-Y1106 HydrophobicContact CD1-CG 4.13Å; L1094-R1107 WeakPolarHBondContact CA-O 3.4Å; L1094-M1108 HydrophobicContact CD1-CB 4.25Å; L1094-L1148 HydrophobicContact CD2-CD2 3.96Å; L1094-E1191 CarbonylContact O-C 3.6Å; L1094-E1191 WeakPolarHBondContact O-CA 3.4Å; L1094-F1192 HydrophobicContact CB-CB 4.37Å; L1094-F1192 PolarHBondContact N-O 2.99Å; L1094-F1192 PolarHBondContact O-N 3.13Å; L1094-F1194 HydrophobicContact CB-CE2 4.19Å
1095	R	85.8	Confident	79.7	Confident	67 Å²	67	51.5 Å²	51.5	25%	0.253	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.8	172.8	-172	174.6	-67	-169.9	-1.5	109.7	L1044 Y1106 R1107 M1190 E1191	L1044-R1095 HydrophobicContact CD1-CG 4.49Å; R1095-Y1106 CarbonylContact O-C 3.54Å; R1095-Y1106 WeakPolarHBondContact O-CA 3.25Å; R1095-R1107 PolarHBondContact N-O 3.19Å; R1095-R1107 PolarHBondContact O-N 2.67Å; R1095-M1190 CarbonylContact C-O 3.54Å; R1095-M1190 WeakPolarHBondContact CA-O 3.46Å; R1095-E1191 IonicContact CZ-OE2 3.69Å; R1095-E1191 IonicContact NE-OE2 2.73Å; R1095-E1191 PolarHBondContact NE-OE2 3.09Å; R1095-E1191 IonicContact NH2-OE1 3.72Å; R1095-E1191 IonicContact NH2-OE2 3.62Å; R1095-E1191 PolarHBondContact NH2-OE2 3.1Å
1096	I	88.9	Confident	80.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	138.1	-179	-64.9	172.6	0	0	0	109.2	V1069 L1094 L1098 L1152 Q1189 M1190 F1192	V1069-I1096 HydrophobicContact CG1-CD1 3.53Å; V1069-I1096 HydrophobicContact CG2-CD1 4.36Å; L1094-I1096 HydrophobicContact CD2-CD1 3.96Å; L1094-I1096 HydrophobicContact CD2-CG1 4.21Å; L1094-I1096 HydrophobicContact CG-CD1 4.36Å; L1094-I1096 HydrophobicContact CG-CG1 4.08Å; I1096-L1098 HydrophobicContact CG2-CD2 3.76Å; I1096-L1098 HydrophobicContact CG2-CG 3.94Å; I1096-L1152 HydrophobicContact CD1-CD1 4.38Å; I1096-L1152 HydrophobicContact CD1-CD2 4.19Å; I1096-L1152 HydrophobicContact CG1-CD1 4.48Å; I1096-L1152 HydrophobicContact CG2-CD1 3.96Å; I1096-L1152 HydrophobicContact CG2-CD2 4.12Å; I1096-Q1189 WeakPolarHBondContact O-CA 3.35Å; I1096-M1190 PolarHBondContact N-O 2.82Å; I1096-M1190 PolarHBondContact O-N 2.87Å; I1096-F1192 HydrophobicContact CD1-CD2 4.03Å; I1096-F1192 HydrophobicContact CD1-CE2 3.74Å
1097	L	87.5	Confident	80.4	Confident	29 Å²	29	47.1 Å²	47.1	15%	0.152	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.6	178.3	-57.2	94.5	0	0	0	109.1	G1105 V1187 I1188 Q1189	L1097-G1105 PolarHBondContact N-O 3.1Å; L1097-G1105 PolarHBondContact O-N 2.84Å; L1097-V1187 HydrophobicContact CB-CG1 4.06Å; L1097-V1187 HydrophobicContact CD2-CG1 4.23Å; L1097-I1188 WeakPolarHBondContact CA-O 3.27Å; L1097-Q1189 HydrophobicContact CD2-CG 4.19Å; L1097-Q1189 HydrophobicContact CG-CG 4.28Å
1098	L	86.1	Confident	80.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	114.7	179	-54.9	-178.8	0	0	0	109	F1065 I1096 V1104 L1152 T1156 L1159 I1188 M1190	F1065-L1098 HydrophobicContact CE2-CD1 4.02Å; F1065-L1098 HydrophobicContact CZ-CD1 3.85Å; I1096-L1098 HydrophobicContact CG2-CD2 3.76Å; I1096-L1098 HydrophobicContact CG2-CG 3.94Å; L1098-V1104 HydrophobicContact CD2-CG1 4.26Å; L1098-L1152 HydrophobicContact CD2-CB 4.32Å; L1098-L1152 HydrophobicContact CD2-CD2 4.38Å; L1098-T1156 HydrophobicContact CB-CG2 4.07Å; L1098-T1156 HydrophobicContact CD2-CG2 3.87Å; L1098-T1156 HydrophobicContact CG-CG2 4.42Å; L1098-L1159 HydrophobicContact CB-CD1 3.87Å; L1098-L1159 HydrophobicContact CD1-CD1 4.08Å; L1098-I1188 HydrophobicContact CB-CB 4.45Å; L1098-I1188 PolarHBondContact N-O 3.45Å; L1098-I1188 PolarHBondContact O-N 2.68Å; L1098-M1190 HydrophobicContact CD1-CE 4.1Å
1099	Q	81.6	Confident	80.8	Confident	34 Å²	34	37.9 Å²	37.9	16%	0.159	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	104.6	175	178.8	178.1	-17	0	0	109.3	Q1103 V1187	Q1099-Q1103 HydrophobicContact CB-CB 3.9Å; Q1099-Q1103 HydrophobicContact CG-CB 4.49Å; Q1099-Q1103 PolarHBondContact N-O 3.4Å; Q1099-Q1103 PolarHBondContact O-N 3.46Å; Q1099-V1187 HydrophobicContact CB-CG2 4.22Å; Q1099-V1187 HydrophobicContact CG-CG2 4.33Å
1100	P	70.4	Confident	80.8	Confident	18 Å²	18	36.8 Å²	36.8	12%	0.117	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	145.8	179.2	-24	33.9	0	0	0	112.7	L1159	P1100-L1159 HydrophobicContact CG-CB 3.96Å; P1100-L1159 HydrophobicContact CG-CD1 3.83Å
1101	P	66.2	Low	79.9	Confident	84 Å²	84	37.1 Å²	37.1	55%	0.545	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.2	-33.7	2.2	30.9	-32.1	0	0	0	114.3	T1156	P1101-T1156 WeakPolarHBondContact O-CB 3.3Å; P1101-T1156 PolarHBondContact O-OG1 3.18Å
1102	D	73.4	Confident	78.2	Confident	138 Å²	138	38.3 Å²	38.3	74%	0.738	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.6	-10.3	-157.8	-54.6	-32.3	0	0	0	114.6
1103	Q	80.5	Confident	76.1	Confident	63 Å²	63	42.7 Å²	42.7	29%	0.294	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.9	-172.6	-82.7	-173.4	-63.1	0	0	112.6	Q1099 N1120 Q1121	Q1099-Q1103 HydrophobicContact CB-CB 3.9Å; Q1099-Q1103 HydrophobicContact CG-CB 4.49Å; Q1099-Q1103 PolarHBondContact N-O 3.4Å; Q1099-Q1103 PolarHBondContact O-N 3.46Å; Q1103-N1120 PolarHBondContact NE2-O 3.33Å; Q1103-N1120 VanDerWaalsContact NE2-O 3.1Å; Q1103-Q1121 PolarHBondContact NE2-O 2.88Å
1104	V	85.3	Confident	74	Confident	16 Å²	16	44.2 Å²	44.2	10%	0.097	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.7	-177.5	-174.7	0	0	0	0	108.7	L1098 L1149 L1152 T1156	L1098-V1104 HydrophobicContact CD2-CG1 4.26Å; V1104-L1149 HydrophobicContact CG1-CD2 4.18Å; V1104-L1152 HydrophobicContact CG1-CB 3.51Å; V1104-L1152 HydrophobicContact CG1-CD1 3.93Å; V1104-L1152 HydrophobicContact CG1-CG 4.39Å; V1104-T1156 HydrophobicContact CG2-CG2 3.71Å
1105	G	85.5	Confident	72.1	Confident	4 Å²	4	44.8 Å²	44.8	4%	0.041	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	162	169	0	0	0	0	0	111.8	L1097	L1097-G1105 PolarHBondContact N-O 3.1Å; L1097-G1105 PolarHBondContact O-N 2.84Å
1106	Y	88.1	Confident	70.2	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	161.5	170.7	72	-87.8	0	0	0	110.9	L1094 R1095 Y1116 L1118 L1144 D1145 L1148 L1149	L1094-Y1106 HydrophobicContact CD1-CD2 3.5Å; L1094-Y1106 HydrophobicContact CD1-CE2 4.32Å; L1094-Y1106 HydrophobicContact CD1-CG 4.13Å; R1095-Y1106 CarbonylContact O-C 3.54Å; R1095-Y1106 WeakPolarHBondContact O-CA 3.25Å; Y1106-Y1116 AromaticContact CE2-CD1 3.88Å; Y1106-Y1116 HydrophobicContact CE2-CD1 3.88Å; Y1106-Y1116 HydrophobicContact CE2-CE1 4.41Å; Y1106-Y1116 AromaticContact CZ-CD1 3.92Å; Y1106-Y1116 AromaticContact CZ-CE1 4Å; Y1106-Y1116 WeakPolarHBondContact OH-CE1 3.38Å; Y1106-L1118 HydrophobicContact CE1-CB 4.34Å; Y1106-L1118 HydrophobicContact CE1-CD2 4.33Å; Y1106-L1118 PolarHBondContact O-N 2.98Å; Y1106-L1144 HydrophobicContact CE2-CB 4.23Å; Y1106-L1144 HydrophobicContact CE2-CD1 4.03Å; Y1106-L1144 WeakPolarHBondContact OH-CB 3.45Å; Y1106-D1145 WeakPolarHBondContact CE1-OD1 3.44Å; Y1106-D1145 VanDerWaalsContact CZ-OD1 3.27Å; Y1106-D1145 PolarHBondContact OH-OD1 3.03Å; Y1106-L1148 HydrophobicContact CD1-CD2 4.38Å; Y1106-L1148 HydrophobicContact CG-CD2 4.38Å; Y1106-L1149 HydrophobicContact CD1-CD2 3.92Å; Y1106-L1149 HydrophobicContact CE1-CD2 3.89Å; Y1106-L1149 HydrophobicContact CE1-CG 4.18Å
1107	R	81.3	Confident	68.1	Low	83 Å²	83	47.8 Å²	47.8	31%	0.313	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	136.5	170.4	-59.2	-168.7	179.8	-164.6	6.2	109.1	L1094 R1095 E1114 Y1116 T1117 H1119	L1094-R1107 WeakPolarHBondContact CA-O 3.4Å; R1095-R1107 PolarHBondContact N-O 3.19Å; R1095-R1107 PolarHBondContact O-N 2.67Å; R1107-E1114 IonicContact NH1-OE1 3.04Å; R1107-E1114 PolarHBondContact NH1-OE1 2.67Å; R1107-Y1116 CarbonylContact C-O 3.57Å; R1107-Y1116 WeakPolarHBondContact CA-O 3.39Å; R1107-T1117 HydrophobicContact CB-CG2 4.12Å; R1107-T1117 HydrophobicContact CG-CG2 3.74Å; R1107-H1119 PolarHBondContact NE-CE1 3.48Å; R1107-H1119 PolarHBondContact NH2-NE2 3.23Å
1108	M	81.8	Confident	66	Low	8 Å²	8	47.5 Å²	47.5	4%	0.039	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.1	174.8	-175.1	177.5	64.1	0	0	110	L1077 I1092 T1093 L1094 V1115 Y1116 Y1140 L1144	L1077-M1108 HydrophobicContact CD1-SD 4.14Å; L1077-M1108 HydrophobicContact CD2-SD 4.38Å; I1092-M1108 HydrophobicContact CG2-CG 3.76Å; I1092-M1108 HydrophobicContact CG2-SD 3.79Å; T1093-M1108 WeakPolarHBondContact O-CA 3.42Å; L1094-M1108 HydrophobicContact CD1-CB 4.25Å; M1108-V1115 HydrophobicContact CE-CB 4.23Å; M1108-V1115 HydrophobicContact CE-CG1 3.99Å; M1108-V1115 PolarHBondContact O-N 3.13Å; M1108-Y1116 PolarHBondContact N-O 3.5Å; M1108-Y1116 PolarHBondContact O-N 2.93Å; M1108-Y1116 VanDerWaalsContact O-N 3.13Å; M1108-Y1140 HydrophobicContact CE-CD2 4.39Å; M1108-Y1140 HydrophobicContact CE-CG 4.48Å; M1108-L1144 HydrophobicContact CE-CD1 3.96Å; M1108-L1144 HydrophobicContact SD-CD1 3.71Å
1109	G	73.9	Confident	64.1	Low	20 Å²	20	52.3 Å²	52.3	21%	0.206	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	158.2	168	0	0	0	0	0	111.2	I1092 T1093	I1092-G1109 CarbonylContact C-O 3.55Å; I1092-G1109 WeakPolarHBondContact CA-O 3.35Å; T1093-G1109 PolarHBondContact N-O 3.05Å; T1093-G1109 PolarHBondContact O-N 2.76Å
1110	A	70.9	Confident	61.8	Low	7 Å²	7	55.4 Å²	55.4	6%	0.058	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	155.3	164.1	0	0	0	0	0	108	R1089 Q1091 I1092 C1112 Q1113 V1115	R1089-A1110 HydrophobicContact CB-CB 3.81Å; R1089-A1110 HydrophobicContact CG-CB 3.85Å; Q1091-A1110 VanDerWaalsContact O-CA 3.29Å; Q1091-A1110 WeakPolarHBondContact O-CA 3.49Å; Q1091-A1110 WeakPolarHBondContact O-CB 3.43Å; I1092-A1110 HydrophobicContact CG1-CB 4.43Å; A1110-C1112 PolarHBondContact O-N 3.06Å; A1110-Q1113 PolarHBondContact N-O 2.79Å; A1110-Q1113 VanDerWaalsContact N-O 3.1Å; A1110-Q1113 PolarHBondContact O-N 3.49Å; A1110-V1115 HydrophobicContact CB-CG2 4.2Å
1111	S	56.3	Low	60	Low	66 Å²	66	62.6 Å²	62.6	46%	0.462	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	12.9	-153.5	-54.8	0	0	0	0	120.6	Q1091	Q1091-S1111 WeakPolarHBondContact CB-OG 3.42Å; Q1091-S1111 PolarHBondContact O-N 3.07Å; Q1091-S1111 PolarHBondContact OE1-OG 3.07Å
1112	C	43.5	Very low	58.1	Low	119 Å²	119	64.7 Å²	64.7	80%	0.804	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.4	-0.3	165	-69.2	0	0	0	0	115	A1110	A1110-C1112 PolarHBondContact O-N 3.06Å
1113	Q	38.2	Very low	55.9	Low	96 Å²	96	65.7 Å²	65.7	45%	0.449	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	145.5	-179.3	-128.6	164.1	-21.5	0	0	113.1	C978 A1110	C978-Q1113 PolarHBondContact SG-N 2.74Å; A1110-Q1113 PolarHBondContact N-O 2.79Å; A1110-Q1113 VanDerWaalsContact N-O 3.1Å; A1110-Q1113 PolarHBondContact O-N 3.49Å
1114	E	40.6	Very low	53.3	Low	74 Å²	74	67.6 Å²	67.6	35%	0.346	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	134.7	155.7	-79.2	-166	135.2	0	0	107.7	R1107	R1107-E1114 IonicContact NH1-OE1 3.04Å; R1107-E1114 PolarHBondContact NH1-OE1 2.67Å
1115	V	48.8	Very low	50.5	Low	14 Å²	14	71.2 Å²	71.2	9%	0.085	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-35.4	-173.7	-175	0	0	0	0	111.4	M1108 A1110 E1137 Y1140	M1108-V1115 HydrophobicContact CE-CB 4.23Å; M1108-V1115 HydrophobicContact CE-CG1 3.99Å; M1108-V1115 PolarHBondContact O-N 3.13Å; A1110-V1115 HydrophobicContact CB-CG2 4.2Å; V1115-E1137 HydrophobicContact CG1-CB 4.15Å; V1115-E1137 HydrophobicContact CG1-CG 4.37Å; V1115-Y1140 HydrophobicContact CG1-CD2 3.72Å; V1115-Y1140 HydrophobicContact CG1-CE2 4.04Å
1116	Y	45.7	Very low	47.8	Very low	65 Å²	65	79.1 Å²	79.1	26%	0.255	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	146.6	175.5	-170.3	-113.7	0	0	0	113.1	Y1106 R1107 M1108 L1118 A1141	Y1106-Y1116 AromaticContact CE2-CD1 3.88Å; Y1106-Y1116 HydrophobicContact CE2-CD1 3.88Å; Y1106-Y1116 HydrophobicContact CE2-CE1 4.41Å; Y1106-Y1116 AromaticContact CZ-CD1 3.92Å; Y1106-Y1116 AromaticContact CZ-CE1 4Å; Y1106-Y1116 WeakPolarHBondContact OH-CE1 3.38Å; R1107-Y1116 CarbonylContact C-O 3.57Å; R1107-Y1116 WeakPolarHBondContact CA-O 3.39Å; M1108-Y1116 PolarHBondContact N-O 3.5Å; M1108-Y1116 PolarHBondContact O-N 2.93Å; M1108-Y1116 VanDerWaalsContact O-N 3.13Å; Y1116-L1118 HydrophobicContact CE1-CB 3.88Å; Y1116-L1118 HydrophobicContact CE1-CD1 4.38Å; Y1116-L1118 WeakPolarHBondContact OH-CD1 3.41Å; Y1116-A1141 HydrophobicContact CD1-CB 3.61Å; Y1116-A1141 HydrophobicContact CD2-CB 3.44Å; Y1116-A1141 VanDerWaalsContact CD2-CB 3.44Å; Y1116-A1141 HydrophobicContact CE1-CB 3.64Å; Y1116-A1141 HydrophobicContact CE2-CB 3.47Å; Y1116-A1141 VanDerWaalsContact CE2-CB 3.47Å; Y1116-A1141 HydrophobicContact CG-CB 3.51Å
1117	T	44.7	Very low	44.8	Very low	65 Å²	65	86.7 Å²	86.7	40%	0.399	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	115.7	175.3	64.4	0	0	0	0	111.8	R1107	R1107-T1117 HydrophobicContact CB-CG2 4.12Å; R1107-T1117 HydrophobicContact CG-CG2 3.74Å
1118	L	43.1	Very low	42.5	Very low	23 Å²	23	90.8 Å²	90.8	12%	0.12	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	119.5	172	-167.5	79.9	0	0	0	110.6	Y1106 Y1116 L1149	Y1106-L1118 HydrophobicContact CE1-CB 4.34Å; Y1106-L1118 HydrophobicContact CE1-CD2 4.33Å; Y1106-L1118 PolarHBondContact O-N 2.98Å; Y1116-L1118 HydrophobicContact CE1-CB 3.88Å; Y1116-L1118 HydrophobicContact CE1-CD1 4.38Å; Y1116-L1118 WeakPolarHBondContact OH-CD1 3.41Å; L1118-L1149 HydrophobicContact CD2-CD1 3.68Å; L1118-L1149 HydrophobicContact CD2-CD2 3.76Å; L1118-L1149 HydrophobicContact CD2-CG 4.31Å
1119	H	46	Very low	39.9	Very low	102 Å²	102	99.1 Å²	99.1	47%	0.472	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	95.7	175.1	-85.2	15	0	0	0	111.2	R1107 Q1121	R1107-H1119 PolarHBondContact NE-CE1 3.48Å; R1107-H1119 PolarHBondContact NH2-NE2 3.23Å; H1119-Q1121 PolarHBondContact O-N 2.99Å; H1119-Q1121 VanDerWaalsContact O-N 3.09Å
1120	N	34.2	Very low	37.8	Very low	98 Å²	98	105 Å²	105	52%	0.524	57%	0.567	S	S	.	*			trans	-78	94	174.5	-85.8	-49.2	0	0	0	111.6	Q1103	Q1103-N1120 PolarHBondContact NE2-O 3.33Å; Q1103-N1120 VanDerWaalsContact NE2-O 3.1Å
1121	Q	31.2	Very low	35.6	Very low	169 Å²	169	110.4 Å²	110.4	79%	0.79	60%	0.6	S	S	*	*	S	Bend	trans	66.6	89	167.7	-55.9	-176.9	6.2	0	0	116.6	Q1103 H1119	Q1103-Q1121 PolarHBondContact NE2-O 2.88Å; H1119-Q1121 PolarHBondContact O-N 2.99Å; H1119-Q1121 VanDerWaalsContact O-N 3.09Å
1122	L	28.1	Very low	34.3	Very low	128 Å²	128	112.4 Å²	112.4	67%	0.67	61%	0.614	S	S	*	*	S	Bend	trans	-155.9	108	144.9	-110.7	164	0	0	0	110.1
1123	D	27	Very low	33.9	Very low	160 Å²	160	110.5 Å²	110.5	86%	0.856	60%	0.601	S	S	*	*			trans	58.7	171.8	177.1	-64.1	-19.2	0	0	0	118.4
1124	S	25.7	Very low	34	Very low	102 Å²	102	111.1 Å²	111.1	71%	0.713	60%	0.604	S	S	*	*			trans	-125.9	149.2	-143.2	60.3	0	0	0	0	115.8
1125	S	26.5	Very low	34.2	Very low	93 Å²	93	114 Å²	114	65%	0.65	62%	0.622	S	S	*	*			trans	53.5	108.4	154.8	62.9	0	0	0	0	118.1
1126	N	27.5	Very low	34.2	Very low	169 Å²	169	116.3 Å²	116.3	90%	0.904	64%	0.638	S	S	*	*			trans	-151.2	106.6	133.6	-93.7	-39.8	0	0	0	108.2
1127	D	26.8	Very low	34.7	Very low	160 Å²	160	114.6 Å²	114.6	86%	0.856	63%	0.632	S	S	*	*			trans	-72.7	126.3	169.7	-53.6	-71.7	0	0	0	109
1128	L	32	Very low	35.4	Very low	168 Å²	168	116.9 Å²	116.9	88%	0.88	64%	0.638	S	S	*	*			trans	-142.8	122.4	160.9	-159.9	72.4	0	0	0	109.7	N1130	L1128-N1130 PolarHBondContact O-N 2.88Å
1129	E	27.1	Very low	36.9	Very low	184 Å²	184	118.1 Å²	118.1	86%	0.86	65%	0.647	S	S	*	*			trans	-66.3	128.2	-174.7	-56.7	171.3	133	0	0	111
1130	N	29.7	Very low	38.6	Very low	142 Å²	142	113.4 Å²	113.4	76%	0.759	63%	0.625	S	S	*	*			trans	-128.7	101.5	169.5	-115.2	-11.3	0	0	0	108.2	L1128	L1128-N1130 PolarHBondContact O-N 2.88Å
1131	T	25.8	Very low	40.7	Very low	121 Å²	121	108.8 Å²	108.8	74%	0.742	60%	0.601	S	S	*	*			trans	-83.8	140.8	-169.2	36.9	0	0	0	0	113.4
1132	S	28.2	Very low	43.2	Very low	109 Å²	109	105.9 Å²	105.9	76%	0.762	59%	0.59	S	S	*	*	S	Bend	trans	74.8	44.4	156.4	66	0	0	0	0	119.1	E1134	S1132-E1134 PolarHBondContact N-OE2 2.82Å
1133	C	34.5	Very low	46.1	Very low	79 Å²	79	100.6 Å²	100.6	53%	0.534	57%	0.565	S	S	.	*			trans	-132.4	-2	160	-143.3	0	0	0	0	114.6	N1135	C1133-N1135 PolarHBondContact O-N 3.02Å
1134	E	40.1	Very low	49	Very low	108 Å²	108	93 Å²	93	51%	0.505	53%	0.525	S	S	.	.	H	α-helix	trans	-63.1	-48.4	-156.8	-65.2	134.2	125.1	0	0	114.9	S1132 C1136 E1137 E1138	S1132-E1134 PolarHBondContact N-OE2 2.82Å; E1134-C1136 PolarHBondContact O-N 3.44Å; E1134-E1137 PolarHBondContact O-N 3.26Å; E1134-E1138 PolarHBondContact O-N 2.98Å
1135	N	46.8	Very low	51.9	Low	136 Å²	136	90 Å²	90	73%	0.727	50%	0.501	S	S	*	.	H	α-helix	trans	-57	-12.2	-165.8	-67.3	15.5	0	0	0	117.7	C1133	C1133-N1135 PolarHBondContact O-N 3.02Å
1136	C	48.7	Very low	54.8	Low	61 Å²	61	92.2 Å²	92.2	41%	0.412	51%	0.505	S	S	.	.	H	α-helix	trans	-108.5	-26.9	178.1	-71.7	0	0	0	0	113.1	E1134 T1139 Y1140	E1134-C1136 PolarHBondContact O-N 3.44Å; C1136-T1139 PolarHBondContact O-N 3.06Å; C1136-T1139 PolarHBondContact O-OG1 3.45Å; C1136-Y1140 WeakPolarHBondContact O-CE2 3.47Å
1137	E	54.7	Low	57.8	Low	29 Å²	29	87 Å²	87	14%	0.136	48%	0.477	C	S	.	.	H	α-helix	trans	-82	-33.9	-174.9	-52.7	-160.7	110.9	0	0	111.2	R1089 V1115 E1134 T1139 Y1140 A1141	R1089-E1137 IonicContact CZ-OE1 3.47Å; R1089-E1137 IonicContact NH1-OE1 3.5Å; R1089-E1137 PolarHBondContact NH1-OE1 2.86Å; R1089-E1137 IonicContact NH2-OE1 3.99Å; R1089-E1137 PolarHBondContact NH2-OE1 3.01Å; V1115-E1137 HydrophobicContact CG1-CB 4.15Å; V1115-E1137 HydrophobicContact CG1-CG 4.37Å; E1134-E1137 PolarHBondContact O-N 3.26Å; E1137-T1139 PolarHBondContact O-N 2.86Å; E1137-Y1140 PolarHBondContact O-N 3.26Å; E1137-A1141 PolarHBondContact O-N 2.97Å
1138	E	60.5	Low	60.8	Low	113 Å²	113	79.4 Å²	79.4	53%	0.528	44%	0.436	S	S	.	.	H	α-helix	trans	-54.4	-38.7	167.7	-64.6	-177.9	144.5	0	0	112.2	E1134 Y1140 A1141 D1142	E1134-E1138 PolarHBondContact O-N 2.98Å; E1138-Y1140 VanDerWaalsContact C-N 3.28Å; E1138-Y1140 PolarHBondContact O-N 3.17Å; E1138-A1141 WeakPolarHBondContact O-CA 3.49Å; E1138-A1141 VanDerWaalsContact O-CB 3.31Å; E1138-A1141 WeakPolarHBondContact O-CB 3.44Å; E1138-A1141 PolarHBondContact O-N 2.75Å; E1138-D1142 PolarHBondContact O-N 2.75Å
1139	T	73.2	Confident	63.5	Low	49 Å²	49	72.9 Å²	72.9	30%	0.301	40%	0.402	S	S	.	.	H	α-helix	trans	-69.1	-21.2	-174.7	67.7	0	0	0	0	114.8	Y1080 C1136 E1137	Y1080-T1139 PolarHBondContact OH-O 3.29Å; C1136-T1139 PolarHBondContact O-N 3.06Å; C1136-T1139 PolarHBondContact O-OG1 3.45Å; E1137-T1139 PolarHBondContact O-N 2.86Å
1140	Y	81.8	Confident	66.4	Low	3 Å²	3	67.9 Å²	67.9	1%	0.012	39%	0.385	C	S	.	.	H	α-helix	trans	-81.2	-35.5	169.6	-41	-53.5	0	0	0	111.3	Y1080 H1083 L1084 M1108 V1115 C1136 E1137 E1138 A1143 L1144	Y1080-Y1140 HydrophobicContact CD1-CD1 4.04Å; Y1080-Y1140 AromaticContact CD1-CE1 3.95Å; Y1080-Y1140 HydrophobicContact CD1-CE1 3.95Å; Y1080-Y1140 AromaticContact CD2-CD1 3.91Å; Y1080-Y1140 HydrophobicContact CD2-CD1 3.91Å; Y1080-Y1140 HydrophobicContact CE1-CD1 4.5Å; Y1080-Y1140 HydrophobicContact CE2-CD1 4.36Å; Y1080-Y1140 AromaticContact CG-CD1 3.71Å; Y1080-Y1140 HydrophobicContact CG-CD1 3.71Å; Y1080-Y1140 AromaticContact CG-CE1 3.86Å; Y1080-Y1140 HydrophobicContact CG-CE1 3.86Å; H1083-Y1140 PolarHBondContact CE1-OH 2.88Å; H1083-Y1140 AromaticContact ND1-CZ 3.98Å; H1083-Y1140 PolarHBondContact ND1-OH 3.1Å; L1084-Y1140 HydrophobicContact CD2-CE1 4.36Å; L1084-Y1140 HydrophobicContact CD2-CE2 4.34Å; M1108-Y1140 HydrophobicContact CE-CD2 4.39Å; M1108-Y1140 HydrophobicContact CE-CG 4.48Å; V1115-Y1140 HydrophobicContact CG1-CD2 3.72Å; V1115-Y1140 HydrophobicContact CG1-CE2 4.04Å; C1136-Y1140 WeakPolarHBondContact O-CE2 3.47Å; E1137-Y1140 PolarHBondContact O-N 3.26Å; E1138-Y1140 VanDerWaalsContact C-N 3.28Å; E1138-Y1140 PolarHBondContact O-N 3.17Å; Y1140-A1143 PolarHBondContact O-N 2.9Å; Y1140-L1144 WeakPolarHBondContact O-CG 3.25Å; Y1140-L1144 PolarHBondContact O-N 3.4Å
1141	A	79.8	Confident	69.2	Low	2 Å²	2	62.2 Å²	62.2	2%	0.017	36%	0.356	C	S	.	.	H	α-helix	trans	-64.3	-51.1	179.1	0	0	0	0	0	110.8	Y1116 E1137 E1138 A1143 L1144 D1145	Y1116-A1141 HydrophobicContact CD1-CB 3.61Å; Y1116-A1141 HydrophobicContact CD2-CB 3.44Å; Y1116-A1141 VanDerWaalsContact CD2-CB 3.44Å; Y1116-A1141 HydrophobicContact CE1-CB 3.64Å; Y1116-A1141 HydrophobicContact CE2-CB 3.47Å; Y1116-A1141 VanDerWaalsContact CE2-CB 3.47Å; Y1116-A1141 HydrophobicContact CG-CB 3.51Å; E1137-A1141 PolarHBondContact O-N 2.97Å; E1138-A1141 WeakPolarHBondContact O-CA 3.49Å; E1138-A1141 VanDerWaalsContact O-CB 3.31Å; E1138-A1141 WeakPolarHBondContact O-CB 3.44Å; E1138-A1141 PolarHBondContact O-N 2.75Å; A1141-A1143 VanDerWaalsContact C-N 3.27Å; A1141-A1143 PolarHBondContact O-N 3.39Å; A1141-L1144 CarbonylContact O-C 3.59Å; A1141-L1144 PolarHBondContact O-N 3.26Å; A1141-D1145 WeakPolarHBondContact O-CB 3.37Å; A1141-D1145 PolarHBondContact O-N 3.01Å
1142	D	83.5	Confident	72.1	Confident	107 Å²	107	56.4 Å²	56.4	57%	0.572	32%	0.32	S	S	*	.	H	α-helix	trans	-52.3	-45.9	174.8	-72.4	-19.9	0	0	0	111.6	E1138 L1144 D1145 D1146	E1138-D1142 PolarHBondContact O-N 2.75Å; D1142-L1144 VanDerWaalsContact C-N 3.34Å; D1142-L1144 PolarHBondContact O-N 3.02Å; D1142-D1145 PolarHBondContact O-N 2.8Å; D1142-D1146 WeakPolarHBondContact O-CB 3.44Å; D1142-D1146 PolarHBondContact O-N 2.83Å
1143	A	87.4	Confident	74.9	Confident	17 Å²	17	54.1 Å²	54.1	14%	0.14	30%	0.304	C	S	.	.	H	α-helix	trans	-70.4	-26.3	-178.8	0	0	0	0	0	113.8	A1076 Y1080 Y1140 A1141 I1147	A1076-A1143 VanDerWaalsContact CB-O 3.3Å; A1076-A1143 WeakPolarHBondContact CB-O 3.24Å; Y1080-A1143 HydrophobicContact CE2-CB 3.81Å; Y1140-A1143 PolarHBondContact O-N 2.9Å; A1141-A1143 VanDerWaalsContact C-N 3.27Å; A1141-A1143 PolarHBondContact O-N 3.39Å; A1143-I1147 WeakPolarHBondContact O-CG1 3.33Å
1144	L	88.2	Confident	77.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-81.6	-39.4	171.4	-77	167.5	0	0	0	111.1	V1073 A1076 L1077 Y1106 M1108 Y1140 A1141 D1142 I1147 L1148	V1073-L1144 HydrophobicContact CG1-CD2 4.48Å; V1073-L1144 HydrophobicContact CG2-CD2 4.28Å; A1076-L1144 HydrophobicContact CB-CD2 3.72Å; A1076-L1144 HydrophobicContact CB-CG 4.17Å; L1077-L1144 HydrophobicContact CD2-CD1 4.45Å; Y1106-L1144 HydrophobicContact CE2-CB 4.23Å; Y1106-L1144 HydrophobicContact CE2-CD1 4.03Å; Y1106-L1144 WeakPolarHBondContact OH-CB 3.45Å; M1108-L1144 HydrophobicContact CE-CD1 3.96Å; M1108-L1144 HydrophobicContact SD-CD1 3.71Å; Y1140-L1144 WeakPolarHBondContact O-CG 3.25Å; Y1140-L1144 PolarHBondContact O-N 3.4Å; A1141-L1144 CarbonylContact O-C 3.59Å; A1141-L1144 PolarHBondContact O-N 3.26Å; D1142-L1144 VanDerWaalsContact C-N 3.34Å; D1142-L1144 PolarHBondContact O-N 3.02Å; L1144-I1147 PolarHBondContact O-N 3.36Å; L1144-L1148 HydrophobicContact CD2-CD2 4.44Å; L1144-L1148 WeakPolarHBondContact O-CA 3.21Å; L1144-L1148 WeakPolarHBondContact O-CB 3.47Å; L1144-L1148 PolarHBondContact O-N 3.13Å
1145	D	88	Confident	79.1	Confident	40 Å²	40	49.4 Å²	49.4	21%	0.214	28%	0.281	C	S	.	.	H	α-helix	trans	-64.5	-41.6	178.8	-84.9	19.5	0	0	0	111.9	Y1106 A1141 D1142 I1147 L1149	Y1106-D1145 WeakPolarHBondContact CE1-OD1 3.44Å; Y1106-D1145 VanDerWaalsContact CZ-OD1 3.27Å; Y1106-D1145 PolarHBondContact OH-OD1 3.03Å; A1141-D1145 WeakPolarHBondContact O-CB 3.37Å; A1141-D1145 PolarHBondContact O-N 3.01Å; D1142-D1145 PolarHBondContact O-N 2.8Å; D1145-I1147 VanDerWaalsContact C-N 3.26Å; D1145-I1147 PolarHBondContact O-N 3.34Å; D1145-L1149 HydrophobicContact CB-CD1 3.81Å; D1145-L1149 HydrophobicContact CB-CG 4.46Å; D1145-L1149 WeakPolarHBondContact OD1-CD1 3.43Å
1146	D	87.7	Confident	80.5	Confident	139 Å²	139	43.3 Å²	43.3	74%	0.743	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.1	176.2	-97.7	-9	0	0	0	113.6	D1142	D1142-D1146 WeakPolarHBondContact O-CB 3.44Å; D1142-D1146 PolarHBondContact O-N 2.83Å
1147	I	88.9	Confident	81.6	Confident	59 Å²	59	44 Å²	44	30%	0.303	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-45	-168	-56.4	-178.6	0	0	0	112.9	C1072 A1076 A1143 L1144 D1145	C1072-I1147 HydrophobicContact CB-CG2 3.87Å; A1076-I1147 HydrophobicContact CB-CD1 4.12Å; A1143-I1147 WeakPolarHBondContact O-CG1 3.33Å; L1144-I1147 PolarHBondContact O-N 3.36Å; D1145-I1147 VanDerWaalsContact C-N 3.26Å; D1145-I1147 PolarHBondContact O-N 3.34Å
1148	L	91.2	Very high	82.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-86	-43.8	-173.2	-179.6	63.6	0	0	0	112.8	V1069 C1072 V1073 L1094 Y1106 L1144 V1151 L1152	V1069-L1148 HydrophobicContact CB-CD1 4.43Å; V1069-L1148 HydrophobicContact CG1-CD1 4.07Å; V1069-L1148 HydrophobicContact CG2-CD1 4.29Å; C1072-L1148 HydrophobicContact CB-CD1 4.16Å; V1073-L1148 HydrophobicContact CG2-CD1 4.48Å; V1073-L1148 HydrophobicContact CG2-CD2 4.29Å; L1094-L1148 HydrophobicContact CD2-CD2 3.96Å; Y1106-L1148 HydrophobicContact CD1-CD2 4.38Å; Y1106-L1148 HydrophobicContact CG-CD2 4.38Å; L1144-L1148 HydrophobicContact CD2-CD2 4.44Å; L1144-L1148 WeakPolarHBondContact O-CA 3.21Å; L1144-L1148 WeakPolarHBondContact O-CB 3.47Å; L1144-L1148 PolarHBondContact O-N 3.13Å; L1148-V1151 PolarHBondContact O-N 3.19Å; L1148-L1152 HydrophobicContact CD1-CD1 4.13Å; L1148-L1152 HydrophobicContact CD1-CD2 4.18Å; L1148-L1152 HydrophobicContact CD1-CG 3.91Å; L1148-L1152 HydrophobicContact CD2-CD1 4.16Å; L1148-L1152 HydrophobicContact CG-CD1 3.78Å; L1148-L1152 HydrophobicContact CG-CG 3.98Å; L1148-L1152 WeakPolarHBondContact O-CG 3.43Å; L1148-L1152 PolarHBondContact O-N 2.86Å
1149	L	87.5	Confident	82.7	Confident	31 Å²	31	38.5 Å²	38.5	16%	0.162	23%	0.231	C	C	.	.	H	α-helix	trans	-59.2	-40.5	-177.6	-68.9	178.3	0	0	0	114.3	V1104 Y1106 L1118 D1145 V1151 L1152 S1153	V1104-L1149 HydrophobicContact CG1-CD2 4.18Å; Y1106-L1149 HydrophobicContact CD1-CD2 3.92Å; Y1106-L1149 HydrophobicContact CE1-CD2 3.89Å; Y1106-L1149 HydrophobicContact CE1-CG 4.18Å; L1118-L1149 HydrophobicContact CD2-CD1 3.68Å; L1118-L1149 HydrophobicContact CD2-CD2 3.76Å; L1118-L1149 HydrophobicContact CD2-CG 4.31Å; D1145-L1149 HydrophobicContact CB-CD1 3.81Å; D1145-L1149 HydrophobicContact CB-CG 4.46Å; D1145-L1149 WeakPolarHBondContact OD1-CD1 3.43Å; L1149-V1151 VanDerWaalsContact C-N 3.29Å; L1149-V1151 PolarHBondContact O-N 2.96Å; L1149-L1152 PolarHBondContact O-N 3.17Å; L1149-S1153 VanDerWaalsContact O-CB 3.32Å; L1149-S1153 WeakPolarHBondContact O-CB 3.47Å; L1149-S1153 PolarHBondContact O-N 3.49Å; L1149-S1153 PolarHBondContact O-OG 3.1Å
1150	P	88.2	Confident	82.1	Confident	80 Å²	80	40 Å²	40	52%	0.519	23%	0.233	S	C	.	.	H	α-helix	trans	-61.1	-38	176.7	-24.2	35.3	0	0	0	112.5	S1154	P1150-S1154 PolarHBondContact O-N 3.1Å; P1150-S1154 VanDerWaalsContact O-N 3.1Å
1151	V	87.7	Confident	81.1	Confident	22 Å²	22	42.2 Å²	42.2	13%	0.133	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-53	176.6	172.4	0	0	0	0	110.1	E1068 L1148 L1149 S1153 S1154 W1155	E1068-V1151 HydrophobicContact CG-CG1 3.94Å; L1148-V1151 PolarHBondContact O-N 3.19Å; L1149-V1151 VanDerWaalsContact C-N 3.29Å; L1149-V1151 PolarHBondContact O-N 2.96Å; V1151-S1153 VanDerWaalsContact C-N 3.27Å; V1151-S1153 PolarHBondContact O-N 3.34Å; V1151-S1154 WeakPolarHBondContact O-CA 3.21Å; V1151-S1154 WeakPolarHBondContact O-CB 3.46Å; V1151-S1154 PolarHBondContact O-N 3.24Å; V1151-W1155 VanDerWaalsContact O-CD1 3.23Å; V1151-W1155 PolarHBondContact O-N 2.92Å
1152	L	88.1	Confident	79.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.8	-39.4	179.7	-64.9	-176.9	0	0	0	112.6	F1065 V1069 I1096 L1098 V1104 L1148 L1149 W1155 T1156	F1065-L1152 HydrophobicContact CE2-CD2 3.78Å; F1065-L1152 HydrophobicContact CZ-CD2 3.89Å; V1069-L1152 HydrophobicContact CG2-CD2 3.66Å; I1096-L1152 HydrophobicContact CD1-CD1 4.38Å; I1096-L1152 HydrophobicContact CD1-CD2 4.19Å; I1096-L1152 HydrophobicContact CG1-CD1 4.48Å; I1096-L1152 HydrophobicContact CG2-CD1 3.96Å; I1096-L1152 HydrophobicContact CG2-CD2 4.12Å; L1098-L1152 HydrophobicContact CD2-CB 4.32Å; L1098-L1152 HydrophobicContact CD2-CD2 4.38Å; V1104-L1152 HydrophobicContact CG1-CB 3.51Å; V1104-L1152 HydrophobicContact CG1-CD1 3.93Å; V1104-L1152 HydrophobicContact CG1-CG 4.39Å; L1148-L1152 HydrophobicContact CD1-CD1 4.13Å; L1148-L1152 HydrophobicContact CD1-CD2 4.18Å; L1148-L1152 HydrophobicContact CD1-CG 3.91Å; L1148-L1152 HydrophobicContact CD2-CD1 4.16Å; L1148-L1152 HydrophobicContact CG-CD1 3.78Å; L1148-L1152 HydrophobicContact CG-CG 3.98Å; L1148-L1152 WeakPolarHBondContact O-CG 3.43Å; L1148-L1152 PolarHBondContact O-N 2.86Å; L1149-L1152 PolarHBondContact O-N 3.17Å; L1152-W1155 PolarHBondContact O-N 3.24Å; L1152-T1156 PolarHBondContact O-N 3.44Å
1153	S	86	Confident	78.1	Confident	60 Å²	60	41.6 Å²	41.6	42%	0.42	24%	0.242	S	C	.	.	H	α-helix	trans	-68.7	-30.3	176.6	-52.7	0	0	0	0	113.2	L1149 V1151 T1156	L1149-S1153 VanDerWaalsContact O-CB 3.32Å; L1149-S1153 WeakPolarHBondContact O-CB 3.47Å; L1149-S1153 PolarHBondContact O-N 3.49Å; L1149-S1153 PolarHBondContact O-OG 3.1Å; V1151-S1153 VanDerWaalsContact C-N 3.27Å; V1151-S1153 PolarHBondContact O-N 3.34Å; S1153-T1156 PolarHBondContact O-OG1 3.21Å
1154	S	83.1	Confident	76.1	Confident	70 Å²	70	45 Å²	45	49%	0.49	26%	0.262	S	S	.	.	H	α-helix	trans	-66.5	-43.4	169.3	-178.6	0	0	0	0	110.5	P1150 V1151 S1157	P1150-S1154 PolarHBondContact O-N 3.1Å; P1150-S1154 VanDerWaalsContact O-N 3.1Å; V1151-S1154 WeakPolarHBondContact O-CA 3.21Å; V1151-S1154 WeakPolarHBondContact O-CB 3.46Å; V1151-S1154 PolarHBondContact O-N 3.24Å; S1154-S1157 PolarHBondContact O-N 3.47Å; S1154-S1157 PolarHBondContact O-OG 3.42Å
1155	W	79.4	Confident	73.8	Confident	19 Å²	19	50.7 Å²	50.7	7%	0.072	29%	0.293	C	S	.	.	H	α-helix	trans	-71.3	-33.2	-176.9	-80.7	99.4	0	0	0	114.5	F1051 V1060 H1064 F1065 E1068 V1151 L1152 S1157 C1158 L1159	F1051-W1155 HydrophobicContact CB-CE3 4.26Å; F1051-W1155 HydrophobicContact CB-CZ3 3.79Å; F1051-W1155 AromaticContact CD1-CE3 3.4Å; F1051-W1155 HydrophobicContact CD1-CE3 3.4Å; F1051-W1155 AromaticContact CD1-CZ3 3.72Å; F1051-W1155 HydrophobicContact CD1-CZ3 3.72Å; F1051-W1155 HydrophobicContact CD2-CZ3 4.22Å; F1051-W1155 AromaticContact CE1-CE3 3.71Å; F1051-W1155 HydrophobicContact CE1-CE3 3.71Å; F1051-W1155 HydrophobicContact CE1-CZ3 4.24Å; F1051-W1155 AromaticContact CG-CE3 3.88Å; F1051-W1155 HydrophobicContact CG-CE3 3.88Å; F1051-W1155 AromaticContact CG-CZ3 3.68Å; F1051-W1155 HydrophobicContact CG-CZ3 3.68Å; F1051-W1155 HydrophobicContact CZ-CE3 4.46Å; V1060-W1155 HydrophobicContact CB-CH2 4.27Å; V1060-W1155 HydrophobicContact CB-CZ3 4.29Å; V1060-W1155 HydrophobicContact CG1-CH2 3.63Å; V1060-W1155 HydrophobicContact CG1-CZ3 4.13Å; H1064-W1155 HydrophobicContact CB-CH2 4.39Å; H1064-W1155 AromaticContact ND1-CH2 3.83Å; H1064-W1155 AromaticContact ND1-CZ2 3.49Å; H1064-W1155 WeakPolarHBondContact ND1-CZ2 3.33Å; F1065-W1155 HydrophobicContact CB-CD2 4.25Å; F1065-W1155 HydrophobicContact CB-CE3 4.08Å; F1065-W1155 HydrophobicContact CB-CH2 3.94Å; F1065-W1155 HydrophobicContact CB-CZ2 4.16Å; F1065-W1155 HydrophobicContact CB-CZ3 3.92Å; F1065-W1155 HydrophobicContact CD2-CB 3.94Å; F1065-W1155 AromaticContact CD2-CD2 3.67Å; F1065-W1155 HydrophobicContact CD2-CD2 3.67Å; F1065-W1155 HydrophobicContact CD2-CE3 4.05Å; F1065-W1155 AromaticContact CD2-CG 3.62Å; F1065-W1155 HydrophobicContact CD2-CG 3.62Å; F1065-W1155 HydrophobicContact CE2-CB 4.05Å; F1065-W1155 HydrophobicContact CE2-CG 4.12Å; F1065-W1155 HydrophobicContact CG-CD2 4.45Å; E1068-W1155 VanDerWaalsContact OE2-CZ2 3.25Å; E1068-W1155 WeakPolarHBondContact OE2-CZ2 3.5Å; E1068-W1155 PolarHBondContact OE2-NE1 3.43Å; V1151-W1155 VanDerWaalsContact O-CD1 3.23Å; V1151-W1155 PolarHBondContact O-N 2.92Å; L1152-W1155 PolarHBondContact O-N 3.24Å; W1155-S1157 VanDerWaalsContact C-N 3.28Å; W1155-S1157 PolarHBondContact O-N 3.05Å; W1155-C1158 PolarHBondContact O-N 2.95Å; W1155-L1159 PolarHBondContact O-N 3.23Å
1156	T	77.7	Confident	71.6	Confident	8 Å²	8	53.5 Å²	53.5	5%	0.049	31%	0.306	C	S	.	.	H	α-helix	trans	-61.1	-36.7	174.9	51.2	0	0	0	0	112.8	L1098 P1101 V1104 L1152 S1153 C1158 L1159	L1098-T1156 HydrophobicContact CB-CG2 4.07Å; L1098-T1156 HydrophobicContact CD2-CG2 3.87Å; L1098-T1156 HydrophobicContact CG-CG2 4.42Å; P1101-T1156 WeakPolarHBondContact O-CB 3.3Å; P1101-T1156 PolarHBondContact O-OG1 3.18Å; V1104-T1156 HydrophobicContact CG2-CG2 3.71Å; L1152-T1156 PolarHBondContact O-N 3.44Å; S1153-T1156 PolarHBondContact O-OG1 3.21Å; T1156-C1158 PolarHBondContact O-N 2.84Å; T1156-C1158 VanDerWaalsContact O-N 3.12Å; T1156-L1159 HydrophobicContact CG2-CD1 4.31Å; T1156-L1159 PolarHBondContact O-N 3.06Å
1157	S	70.4	Confident	69.3	Low	75 Å²	75	51.2 Å²	51.2	52%	0.524	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-16.3	175	80.9	0	0	0	0	114.4	S1154 W1155	S1154-S1157 PolarHBondContact O-N 3.47Å; S1154-S1157 PolarHBondContact O-OG 3.42Å; W1155-S1157 VanDerWaalsContact C-N 3.28Å; W1155-S1157 PolarHBondContact O-N 3.05Å
1158	C	69.1	Low	66.8	Low	20 Å²	20	56.3 Å²	56.3	14%	0.135	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	1.6	-179.5	-65.8	0	0	0	0	113.6	F1051 I1052 W1155 T1156	F1051-C1158 CarbonylContact C-O 3.53Å; F1051-C1158 WeakPolarHBondContact CA-O 3.12Å; I1052-C1158 PolarHBondContact N-O 3.44Å; W1155-C1158 PolarHBondContact O-N 2.95Å; T1156-C1158 PolarHBondContact O-N 2.84Å; T1156-C1158 VanDerWaalsContact O-N 3.12Å
1159	L	68.8	Low	64.2	Low	6 Å²	6	62.9 Å²	62.9	3%	0.031	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.9	179.5	-84.2	171.6	0	0	0	112.5	V1049 F1051 L1098 P1100 W1155 T1156 I1188	V1049-L1159 HydrophobicContact CG1-CD2 3.32Å; F1051-L1159 HydrophobicContact CD1-CD2 3.55Å; F1051-L1159 HydrophobicContact CD1-CG 4.06Å; F1051-L1159 HydrophobicContact CE1-CD2 3.25Å; F1051-L1159 HydrophobicContact CE1-CG 3.88Å; F1051-L1159 HydrophobicContact CG-CD2 4.44Å; F1051-L1159 HydrophobicContact CZ-CD2 3.92Å; L1098-L1159 HydrophobicContact CB-CD1 3.87Å; L1098-L1159 HydrophobicContact CD1-CD1 4.08Å; P1100-L1159 HydrophobicContact CG-CB 3.96Å; P1100-L1159 HydrophobicContact CG-CD1 3.83Å; W1155-L1159 PolarHBondContact O-N 3.23Å; T1156-L1159 HydrophobicContact CG2-CD1 4.31Å; T1156-L1159 PolarHBondContact O-N 3.06Å; L1159-I1188 HydrophobicContact CD1-CD1 3.92Å; L1159-I1188 HydrophobicContact CD2-CD1 3.76Å; L1159-I1188 HydrophobicContact CG-CD1 4.44Å
1160	K	62.5	Low	61.8	Low	81 Å²	81	68.2 Å²	68.2	35%	0.352	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125.3	155.5	-64.4	-164.5	-169.4	174.5	0	111.2	E1050 I1052	E1050-K1160 PolarHBondContact N-O 2.79Å; E1050-K1160 VanDerWaalsContact N-O 3.1Å; E1050-K1160 PolarHBondContact O-N 3.3Å; E1050-K1160 VanDerWaalsContact O-N 3.13Å; E1050-K1160 VanDerWaalsContact O-O 3.14Å; I1052-K1160 HydrophobicContact CD1-CD 3.9Å; I1052-K1160 HydrophobicContact CD1-CG 4.5Å; I1052-K1160 HydrophobicContact CG1-CD 4.5Å
1161	I	59.3	Low	59.4	Low	50 Å²	50	73 Å²	73	26%	0.256	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.6	164.2	-57.4	174.4	0	0	0	106.7	E1186 I1188	I1161-E1186 HydrophobicContact CD1-CB 3.87Å; I1161-E1186 HydrophobicContact CD1-CG 4.21Å; I1161-I1188 HydrophobicContact CD1-CD1 4.35Å; I1161-I1188 HydrophobicContact CD1-CG1 4.38Å; I1161-I1188 HydrophobicContact CG1-CD1 4.08Å
1162	V	53.2	Low	56.9	Low	28 Å²	28	82.8 Å²	82.8	17%	0.17	42%	0.415	C	S	.	.			trans	-110.9	104.9	-178.8	176.6	0	0	0	0	108.3	E1050 P1164 K1167	E1050-V1162 HydrophobicContact CB-CG2 3.88Å; E1050-V1162 HydrophobicContact CG-CG2 3.95Å; V1162-P1164 VanDerWaalsContact O-CD 3.3Å; V1162-P1164 WeakPolarHBondContact O-CD 3.35Å; V1162-P1164 VanDerWaalsContact O-N 3.15Å; V1162-K1167 HydrophobicContact CG1-CD 4.33Å
1163	D	48.4	Very low	54.1	Low	67 Å²	67	91.8 Å²	91.8	36%	0.358	45%	0.449	S	S	.	.			trans	-59.8	114.7	171.4	176.2	1.7	0	0	0	109	N1165 M1166	D1163-N1165 PolarHBondContact O-N 2.93Å; D1163-N1165 VanDerWaalsContact O-N 3.1Å; D1163-N1165 WeakPolarHBondContact OD1-CB 3.34Å; D1163-N1165 PolarHBondContact OD1-N 3.41Å; D1163-N1165 PolarHBondContact OD1-ND2 3.35Å; D1163-M1166 HydrophobicContact CB-CG 4.18Å; D1163-M1166 PolarHBondContact O-N 2.96Å; D1163-M1166 VanDerWaalsContact O-N 3.1Å
1164	P	43.9	Very low	51.4	Low	88 Å²	88	93.7 Å²	93.7	57%	0.571	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-61.6	-22.9	-176.5	25.1	-34.2	0	0	0	112.6	V1162 M1166	V1162-P1164 VanDerWaalsContact O-CD 3.3Å; V1162-P1164 WeakPolarHBondContact O-CD 3.35Å; V1162-P1164 VanDerWaalsContact O-N 3.15Å; P1164-M1166 VanDerWaalsContact C-N 3.32Å; P1164-M1166 PolarHBondContact O-N 3.01Å
1165	N	39.9	Very low	48.9	Very low	122 Å²	122	97.3 Å²	97.3	65%	0.652	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-75.9	-16.8	-179.8	-54.7	-79.2	0	0	0	113.3	D1163	D1163-N1165 PolarHBondContact O-N 2.93Å; D1163-N1165 VanDerWaalsContact O-N 3.1Å; D1163-N1165 WeakPolarHBondContact OD1-CB 3.34Å; D1163-N1165 PolarHBondContact OD1-N 3.41Å; D1163-N1165 PolarHBondContact OD1-ND2 3.35Å
1166	M	42.3	Very low	46.5	Very low	99 Å²	99	99.3 Å²	99.3	49%	0.488	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-83.9	-20.5	-176.8	-77.9	-69.9	167.8	0	0	114.2	D1163 P1164 E1168 F1169 E1170	D1163-M1166 HydrophobicContact CB-CG 4.18Å; D1163-M1166 PolarHBondContact O-N 2.96Å; D1163-M1166 VanDerWaalsContact O-N 3.1Å; P1164-M1166 VanDerWaalsContact C-N 3.32Å; P1164-M1166 PolarHBondContact O-N 3.01Å; M1166-E1168 PolarHBondContact O-N 2.57Å; M1166-F1169 PolarHBondContact O-N 2.78Å; M1166-E1170 PolarHBondContact O-N 2.98Å
1167	K	40.1	Very low	44.3	Very low	90 Å²	90	104.3 Å²	104.3	39%	0.391	54%	0.542	S	S	.	.	H	α-helix	trans	-64.2	-22.4	-176.2	-82.7	175.3	172	163.9	0	114.1	E1050 V1162	E1050-K1167 IonicContact OE1-NZ 2.67Å; E1050-K1167 PolarHBondContact OE1-NZ 2.75Å; V1162-K1167 HydrophobicContact CG1-CD 4.33Å
1168	E	36	Very low	42.5	Very low	167 Å²	167	106.4 Å²	106.4	78%	0.78	56%	0.556	S	S	*	*	H	α-helix	trans	-75.4	-27.7	169.6	-69.5	-158.1	137.2	0	0	113.7	M1166	M1166-E1168 PolarHBondContact O-N 2.57Å
1169	F	35.8	Very low	40.8	Very low	138 Å²	138	112.3 Å²	112.3	61%	0.605	59%	0.586	S	S	*	*	H	α-helix	trans	-85.6	-31.3	-176.2	-95.3	-84.9	0	0	0	113.5	M1166 Q1171 R1172	M1166-F1169 PolarHBondContact O-N 2.78Å; F1169-Q1171 VanDerWaalsContact C-N 3.34Å; F1169-Q1171 PolarHBondContact O-N 3.1Å; F1169-R1172 PolarHBondContact O-N 2.96Å
1170	E	38.6	Very low	39.2	Very low	143 Å²	143	114.9 Å²	114.9	67%	0.668	61%	0.605	S	S	*	*	H	α-helix	trans	-65.5	-33.9	-178.1	-67.8	-158.2	129	0	0	113.1	M1166 R1172 R1173	M1166-E1170 PolarHBondContact O-N 2.98Å; E1170-R1172 PolarHBondContact O-N 2.89Å; E1170-R1173 PolarHBondContact O-N 2.81Å
1171	Q	37.6	Very low	38	Very low	180 Å²	180	116.3 Å²	116.3	84%	0.841	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-10.5	176.8	-67.3	-166.7	3.9	0	0	114.3	F1169	F1169-Q1171 VanDerWaalsContact C-N 3.34Å; F1169-Q1171 PolarHBondContact O-N 3.1Å
1172	R	35.7	Very low	37.2	Very low	228 Å²	228	120.8 Å²	120.8	86%	0.86	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	2.8	177.2	-63.2	-169.9	-176.3	-170.2	4.2	114.5	F1169 E1170	F1169-R1172 PolarHBondContact O-N 2.96Å; E1170-R1172 PolarHBondContact O-N 2.89Å
1173	R	28.6	Very low	37.2	Very low	188 Å²	188	126.2 Å²	126.2	71%	0.709	66%	0.662	S	S	*	*	S	Bend	trans	-104.5	135.6	175.9	-68.8	-168.8	180	-177.1	4.8	111.5	E1170	E1170-R1173 PolarHBondContact O-N 2.81Å
1174	S	30.2	Very low	37.4	Very low	101 Å²	101	127.1 Å²	127.1	71%	0.706	67%	0.671	S	S	*	*			trans	-66.2	150.7	169.6	40.3	0	0	0	0	110.7	G1176	S1174-G1176 VanDerWaalsContact C-N 3.34Å; S1174-G1176 PolarHBondContact O-N 2.73Å
1175	P	30.3	Very low	38	Very low	146 Å²	146	129.3 Å²	129.3	95%	0.948	68%	0.678	S	S	*	*	S	Bend	trans	-71.9	85.7	-177.4	29.3	-35.4	0	0	0	110.8
1176	G	28.9	Very low	39.3	Very low	61 Å²	61	127.8 Å²	127.8	63%	0.629	67%	0.667	S	S	*	*			trans	-177.1	38.6	-170.3	0	0	0	0	0	116.4	S1174	S1174-G1176 VanDerWaalsContact C-N 3.34Å; S1174-G1176 PolarHBondContact O-N 2.73Å
1177	T	31.1	Very low	41	Very low	113 Å²	113	125 Å²	125	69%	0.693	66%	0.656	S	S	*	*			trans	-171.4	92.1	157.3	9.1	0	0	0	0	110.4	N1179	T1177-N1179 VanDerWaalsContact C-N 3.27Å; T1177-N1179 PolarHBondContact O-N 2.93Å
1178	S	31.5	Very low	42.8	Very low	119 Å²	119	120.8 Å²	120.8	83%	0.832	64%	0.637	S	S	*	*			trans	-83.7	60.4	-177.8	58.4	0	0	0	0	112.9	S1180	S1178-S1180 PolarHBondContact O-N 3.17Å
1179	N	33.4	Very low	45.1	Very low	144 Å²	144	113.9 Å²	113.9	77%	0.77	61%	0.605	S	S	*	*			trans	-86.6	90.7	168	-77	17.3	0	0	0	108.8	T1177 C1181	T1177-N1179 VanDerWaalsContact C-N 3.27Å; T1177-N1179 PolarHBondContact O-N 2.93Å; N1179-C1181 PolarHBondContact O-N 2.99Å
1180	S	37	Very low	47.5	Very low	59 Å²	59	107.3 Å²	107.3	41%	0.413	58%	0.576	S	S	.	*			trans	-65.9	113.4	171.6	49.2	0	0	0	0	110.1	S1178 Y1182	S1178-S1180 PolarHBondContact O-N 3.17Å; S1180-Y1182 VanDerWaalsContact C-N 3.29Å; S1180-Y1182 WeakPolarHBondContact O-CD2 3.31Å; S1180-Y1182 PolarHBondContact O-N 3.31Å; S1180-Y1182 WeakPolarHBondContact OG-CE2 3.46Å
1181	C	37.2	Very low	49.7	Very low	112 Å²	112	102 Å²	102	76%	0.757	55%	0.551	S	S	*	*			trans	-72.3	81.8	174.2	-67.8	0	0	0	0	110.6	N1179	N1179-C1181 PolarHBondContact O-N 2.99Å
1182	Y	42.6	Very low	52.1	Low	143 Å²	143	93.4 Å²	93.4	56%	0.561	51%	0.511	S	S	*	.			trans	-63	133.9	162.3	-61.7	-79	0	0	0	109.4	S1180 P1184	S1180-Y1182 VanDerWaalsContact C-N 3.29Å; S1180-Y1182 WeakPolarHBondContact O-CD2 3.31Å; S1180-Y1182 PolarHBondContact O-N 3.31Å; S1180-Y1182 WeakPolarHBondContact OG-CE2 3.46Å; Y1182-P1184 WeakPolarHBondContact O-CD 3.49Å
1183	H	51.6	Low	54.4	Low	143 Å²	143	83.8 Å²	83.8	66%	0.662	48%	0.477	S	S	*	.			trans	-88.8	102.5	155	-96.8	-94.2	0	0	0	107.1	N1185	H1183-N1185 PolarHBondContact O-N 3.18Å
1184	P	52.5	Low	57.2	Low	86 Å²	86	74.9 Å²	74.9	56%	0.558	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	10.9	-162.6	30.1	-35	0	0	0	115.4	Y1182	Y1182-P1184 WeakPolarHBondContact O-CD 3.49Å
1185	N	57.6	Low	59.7	Low	134 Å²	134	70.2 Å²	70.2	72%	0.717	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128	4.1	-169.9	-68.4	42.9	0	0	0	113.3	H1183	H1183-N1185 PolarHBondContact O-N 3.18Å
1186	E	67.6	Low	62.2	Low	89 Å²	89	63.6 Å²	63.6	42%	0.416	37%	0.367	S	S	.	.			trans	-94.4	106.2	-172.8	-162.6	156.9	-120	0	0	110.6	I1161	I1161-E1186 HydrophobicContact CD1-CB 3.87Å; I1161-E1186 HydrophobicContact CD1-CG 4.21Å
1187	V	76.5	Confident	64.5	Low	42 Å²	42	61 Å²	61	26%	0.255	34%	0.339	S	S	.	.			trans	-77.9	119	177.7	-173.2	0	0	0	0	109	N1045 L1097 Q1099 Q1189	N1045-V1187 PolarHBondContact ND2-O 3.16Å; L1097-V1187 HydrophobicContact CB-CG1 4.06Å; L1097-V1187 HydrophobicContact CD2-CG1 4.23Å; Q1099-V1187 HydrophobicContact CB-CG2 4.22Å; Q1099-V1187 HydrophobicContact CG-CG2 4.33Å; V1187-Q1189 HydrophobicContact CG1-CG 4.2Å
1188	I	79.1	Confident	66.2	Low	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	121.1	173	-42.7	-174.9	0	0	0	108.5	V1046 V1049 L1097 L1098 L1159 I1161 M1190	V1046-I1188 HydrophobicContact CB-CG2 4.22Å; V1046-I1188 HydrophobicContact CG2-CB 4.28Å; V1046-I1188 HydrophobicContact CG2-CG1 4.14Å; V1046-I1188 HydrophobicContact CG2-CG2 3.87Å; V1049-I1188 HydrophobicContact CG1-CD1 4.18Å; V1049-I1188 HydrophobicContact CG2-CD1 4.02Å; V1049-I1188 HydrophobicContact CG2-CG2 4.09Å; L1097-I1188 WeakPolarHBondContact CA-O 3.27Å; L1098-I1188 HydrophobicContact CB-CB 4.45Å; L1098-I1188 PolarHBondContact N-O 3.45Å; L1098-I1188 PolarHBondContact O-N 2.68Å; L1159-I1188 HydrophobicContact CD1-CD1 3.92Å; L1159-I1188 HydrophobicContact CD2-CD1 3.76Å; L1159-I1188 HydrophobicContact CG-CD1 4.44Å; I1161-I1188 HydrophobicContact CD1-CD1 4.35Å; I1161-I1188 HydrophobicContact CD1-CG1 4.38Å; I1161-I1188 HydrophobicContact CG1-CD1 4.08Å; I1188-M1190 HydrophobicContact CB-CE 4.3Å; I1188-M1190 HydrophobicContact CG2-CE 3.41Å; I1188-M1190 VanDerWaalsContact CG2-CE 3.41Å; I1188-M1190 HydrophobicContact CG2-CG 4.38Å
1189	Q	83.7	Confident	67.9	Low	22 Å²	22	56.5 Å²	56.5	10%	0.103	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.4	178.6	-65	-171.5	12.2	0	0	111.5	L1044 N1045 I1096 L1097 V1187	L1044-Q1189 HydrophobicContact CB-CB 4.07Å; L1044-Q1189 HydrophobicContact CD1-CB 4.23Å; L1044-Q1189 PolarHBondContact N-O 3.22Å; N1045-Q1189 PolarHBondContact OD1-N 3.12Å; I1096-Q1189 WeakPolarHBondContact O-CA 3.35Å; L1097-Q1189 HydrophobicContact CD2-CG 4.19Å; L1097-Q1189 HydrophobicContact CG-CG 4.28Å; V1187-Q1189 HydrophobicContact CG1-CG 4.2Å
1190	M	85.6	Confident	69.7	Low	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	152.2	-175.1	-54.4	-178.6	-167.5	0	0	109.8	F1041 H1042 F1051 F1062 F1065 R1095 I1096 L1098 I1188 F1192	F1041-M1190 HydrophobicContact CE2-CB 3.94Å; F1041-M1190 HydrophobicContact CZ-CB 4.09Å; F1041-M1190 HydrophobicContact CZ-CG 4.43Å; H1042-M1190 CarbonylContact O-C 3.47Å; H1042-M1190 VanDerWaalsContact O-CA 3.27Å; H1042-M1190 WeakPolarHBondContact O-CA 3.45Å; F1051-M1190 HydrophobicContact CZ-CE 4.38Å; F1062-M1190 HydrophobicContact CE2-CE 3.8Å; F1062-M1190 HydrophobicContact CE2-SD 3.62Å; F1062-M1190 HydrophobicContact CZ-CE 4.35Å; F1062-M1190 HydrophobicContact CZ-SD 3.54Å; F1062-M1190 VanDerWaalsContact CZ-SD 3.54Å; F1065-M1190 HydrophobicContact CD1-SD 4.1Å; F1065-M1190 HydrophobicContact CE1-CE 4.34Å; F1065-M1190 HydrophobicContact CE1-SD 3.38Å; F1065-M1190 WeakPolarHBondContact CE1-SD 3.17Å; F1065-M1190 HydrophobicContact CZ-SD 4.04Å; R1095-M1190 CarbonylContact C-O 3.54Å; R1095-M1190 WeakPolarHBondContact CA-O 3.46Å; I1096-M1190 PolarHBondContact N-O 2.82Å; I1096-M1190 PolarHBondContact O-N 2.87Å; L1098-M1190 HydrophobicContact CD1-CE 4.1Å; I1188-M1190 HydrophobicContact CB-CE 4.3Å; I1188-M1190 HydrophobicContact CG2-CE 3.41Å; I1188-M1190 VanDerWaalsContact CG2-CE 3.41Å; I1188-M1190 HydrophobicContact CG2-CG 4.38Å; M1190-F1192 HydrophobicContact CB-CE2 4.44Å
1191	E	85.6	Confident	71.5	Confident	32 Å²	32	51.5 Å²	51.5	15%	0.15	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140.7	-176.1	-171.2	157.5	93.8	0	0	112.1	F1041 H1042 L1044 T1093 L1094 R1095	F1041-E1191 CarbonylContact C-O 3.55Å; F1041-E1191 WeakPolarHBondContact CA-O 3.47Å; F1041-E1191 WeakPolarHBondContact CD2-O 3.47Å; F1041-E1191 WeakPolarHBondContact CE2-O 3.32Å; H1042-E1191 HydrophobicContact CB-CB 4.22Å; H1042-E1191 PolarHBondContact N-O 3.49Å; H1042-E1191 PolarHBondContact O-N 3.45Å; L1044-E1191 HydrophobicContact CD1-CB 4.41Å; L1044-E1191 HydrophobicContact CD2-CB 4.49Å; T1093-E1191 HydrophobicContact CG2-CG 3.44Å; T1093-E1191 VanDerWaalsContact CG2-CG 3.44Å; L1094-E1191 CarbonylContact O-C 3.6Å; L1094-E1191 WeakPolarHBondContact O-CA 3.4Å; R1095-E1191 IonicContact CZ-OE2 3.69Å; R1095-E1191 IonicContact NE-OE2 2.73Å; R1095-E1191 PolarHBondContact NE-OE2 3.09Å; R1095-E1191 IonicContact NH2-OE1 3.72Å; R1095-E1191 IonicContact NH2-OE2 3.62Å; R1095-E1191 PolarHBondContact NH2-OE2 3.1Å
1192	F	88.3	Confident	73.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	120.9	-176.4	-67.9	-113.2	0	0	0	109.6	W1038 F1041 F1065 S1066 V1069 T1093 L1094 I1096 M1190 F1194	W1038-F1192 AromaticContact CE2-CD1 3.64Å; W1038-F1192 AromaticContact CE2-CE1 3.99Å; W1038-F1192 HydrophobicContact CH2-CE1 4.35Å; W1038-F1192 AromaticContact CZ2-CD1 3.79Å; W1038-F1192 HydrophobicContact CZ2-CD1 3.79Å; W1038-F1192 AromaticContact CZ2-CE1 3.64Å; W1038-F1192 HydrophobicContact CZ2-CE1 3.64Å; W1038-F1192 AromaticContact NE1-CD1 3.45Å; F1041-F1192 AromaticContact CD2-CD1 3.8Å; F1041-F1192 HydrophobicContact CD2-CD1 3.8Å; F1041-F1192 AromaticContact CD2-CD2 3.74Å; F1041-F1192 HydrophobicContact CD2-CD2 3.74Å; F1041-F1192 AromaticContact CD2-CE1 3.64Å; F1041-F1192 HydrophobicContact CD2-CE1 3.64Å; F1041-F1192 AromaticContact CD2-CE2 3.57Å; F1041-F1192 HydrophobicContact CD2-CE2 3.57Å; F1041-F1192 AromaticContact CD2-CG 3.83Å; F1041-F1192 HydrophobicContact CD2-CG 3.83Å; F1041-F1192 AromaticContact CD2-CZ 3.51Å; F1041-F1192 HydrophobicContact CD2-CZ 3.51Å; F1041-F1192 AromaticContact CE2-CD2 3.85Å; F1041-F1192 HydrophobicContact CE2-CD2 3.85Å; F1041-F1192 HydrophobicContact CE2-CE1 4.23Å; F1041-F1192 AromaticContact CE2-CE2 3.4Å; F1041-F1192 HydrophobicContact CE2-CE2 3.4Å; F1041-F1192 HydrophobicContact CE2-CG 4.41Å; F1041-F1192 AromaticContact CE2-CZ 3.61Å; F1041-F1192 HydrophobicContact CE2-CZ 3.61Å; F1041-F1192 HydrophobicContact CG-CE1 4.49Å; F1065-F1192 HydrophobicContact CE1-CZ 4.2Å; S1066-F1192 WeakPolarHBondContact O-CE1 3.33Å; V1069-F1192 HydrophobicContact CB-CE1 4.06Å; V1069-F1192 HydrophobicContact CB-CZ 3.95Å; V1069-F1192 HydrophobicContact CG1-CD1 4.17Å; V1069-F1192 HydrophobicContact CG1-CD2 4.39Å; V1069-F1192 HydrophobicContact CG1-CE1 3.68Å; V1069-F1192 HydrophobicContact CG1-CE2 3.95Å; V1069-F1192 HydrophobicContact CG1-CZ 3.57Å; V1069-F1192 HydrophobicContact CG2-CZ 4.49Å; T1093-F1192 WeakPolarHBondContact CA-O 3.3Å; L1094-F1192 HydrophobicContact CB-CB 4.37Å; L1094-F1192 PolarHBondContact N-O 2.99Å; L1094-F1192 PolarHBondContact O-N 3.13Å; I1096-F1192 HydrophobicContact CD1-CD2 4.03Å; I1096-F1192 HydrophobicContact CD1-CE2 3.74Å; M1190-F1192 HydrophobicContact CB-CE2 4.44Å; F1192-F1194 HydrophobicContact CB-CD2 4.34Å; F1192-F1194 HydrophobicContact CB-CE2 3.53Å; F1192-F1194 HydrophobicContact CB-CZ 4.04Å; F1192-F1194 HydrophobicContact CD1-CZ 4.46Å
1193	D	84.3	Confident	75.5	Confident	25 Å²	25	42 Å²	42	13%	0.134	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	132.9	173.6	-75.2	-26.1	0	0	0	111.2	I1039 R1040 H1042 T1093	I1039-D1193 HydrophobicContact CD1-CB 4.12Å; I1039-D1193 HydrophobicContact CG1-CB 3.72Å; I1039-D1193 VanDerWaalsContact CG1-O 3.3Å; I1039-D1193 WeakPolarHBondContact CG1-O 3.49Å; I1039-D1193 PolarHBondContact N-O 3.01Å; R1040-D1193 HydrophobicContact CB-CB 4.06Å; R1040-D1193 WeakPolarHBondContact CD-OD2 3.29Å; R1040-D1193 PolarHBondContact O-N 3.02Å; H1042-D1193 IonicContact NE2-OD2 3.17Å; T1093-D1193 WeakPolarHBondContact CG2-OD1 3.43Å; T1093-D1193 PolarHBondContact OG1-OD1 3.16Å
1194	F	86.3	Confident	77.1	Confident	1 Å²	1	35.3 Å²	35.3	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	152.2	175	-56.5	-100.2	0	0	0	111.6	L1036 A1037 W1038 A1070 V1073 I1074 Q1091 I1092 L1094 F1192	L1036-F1194 HydrophobicContact CD1-CB 3.83Å; L1036-F1194 HydrophobicContact CD2-CB 4.19Å; L1036-F1194 HydrophobicContact CD2-CD1 3.86Å; L1036-F1194 HydrophobicContact CD2-CG 4.19Å; L1036-F1194 HydrophobicContact CG-CB 3.95Å; L1036-F1194 HydrophobicContact CG-CD1 4.04Å; L1036-F1194 HydrophobicContact CG-CG 4.35Å; A1037-F1194 CarbonylContact O-C 3.58Å; A1037-F1194 WeakPolarHBondContact O-CA 3.36Å; A1037-F1194 WeakPolarHBondContact O-CB 3.41Å; W1038-F1194 HydrophobicContact CB-CD1 3.77Å; W1038-F1194 HydrophobicContact CB-CE1 3.71Å; W1038-F1194 HydrophobicContact CG-CD1 4.44Å; W1038-F1194 HydrophobicContact CG-CE1 4.11Å; A1070-F1194 HydrophobicContact CB-CE1 4.24Å; A1070-F1194 HydrophobicContact CB-CZ 4.41Å; V1073-F1194 HydrophobicContact CB-CE1 4.12Å; V1073-F1194 HydrophobicContact CB-CE2 4.4Å; V1073-F1194 HydrophobicContact CB-CZ 3.74Å; V1073-F1194 HydrophobicContact CG1-CD1 4.46Å; V1073-F1194 HydrophobicContact CG1-CD2 4.37Å; V1073-F1194 HydrophobicContact CG1-CE1 3.91Å; V1073-F1194 HydrophobicContact CG1-CE2 3.82Å; V1073-F1194 HydrophobicContact CG1-CZ 3.57Å; V1073-F1194 HydrophobicContact CG2-CZ 4.09Å; I1074-F1194 HydrophobicContact CG1-CD1 4.36Å; I1074-F1194 HydrophobicContact CG1-CE1 4.11Å; Q1091-F1194 WeakPolarHBondContact CA-O 3.33Å; I1092-F1194 HydrophobicContact CB-CB 4.39Å; I1092-F1194 PolarHBondContact N-O 2.92Å; I1092-F1194 PolarHBondContact O-N 2.98Å; L1094-F1194 HydrophobicContact CB-CE2 4.19Å; F1192-F1194 HydrophobicContact CB-CD2 4.34Å; F1192-F1194 HydrophobicContact CB-CE2 3.53Å; F1192-F1194 HydrophobicContact CB-CZ 4.04Å; F1192-F1194 HydrophobicContact CD1-CZ 4.46Å
1195	C	83.3	Confident	78.8	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.02	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.6	174.5	-78.6	0	0	0	0	111	Q512 A1037 I1039 T1090 Q1091 L1197	Q512-C1195 HydrophobicContact CG-CB 4.19Å; A1037-C1195 PolarHBondContact N-O 3.02Å; A1037-C1195 PolarHBondContact O-N 3.33Å; I1039-C1195 VanDerWaalsContact CD1-SG 3.6Å; I1039-C1195 HydrophobicContact CG2-CB 4.15Å; T1090-C1195 CarbonylContact O-C 3.58Å; T1090-C1195 WeakPolarHBondContact O-CA 3.39Å; Q1091-C1195 VanDerWaalsContact CG-SG 3.51Å; C1195-L1197 HydrophobicContact CB-CD2 4.15Å
1196	I	82.7	Confident	80.5	Confident	7 Å²	7	23.8 Å²	23.8	4%	0.036	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.8	169.2	-54.1	-178.3	0	0	0	108.8	R1035 L1036 L1081 L1084 R1089 T1090	R1035-I1196 WeakPolarHBondContact O-CA 3.44Å; L1036-I1196 HydrophobicContact CD1-CG1 3.91Å; L1081-I1196 HydrophobicContact CD2-CD1 4.31Å; L1081-I1196 HydrophobicContact CD2-CG1 4.33Å; L1084-I1196 HydrophobicContact CB-CD1 3.66Å; R1089-I1196 WeakPolarHBondContact O-CD1 3.49Å; T1090-I1196 PolarHBondContact O-N 3.16Å
1197	L	76.5	Confident	81.5	Confident	8 Å²	8	18.3 Å²	18.3	4%	0.042	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	144	-178.1	-52.6	-171.4	0	0	0	111.9	Q512 W1005 R1035 A1037 C1195	Q512-L1197 HydrophobicContact CB-CD2 3.79Å; Q512-L1197 VanDerWaalsContact CD-CD2 3.43Å; Q512-L1197 HydrophobicContact CG-CD2 3.8Å; Q512-L1197 VanDerWaalsContact OE1-CD2 3.25Å; W1005-L1197 HydrophobicContact CH2-CD1 3.85Å; W1005-L1197 HydrophobicContact CZ2-CD1 4.06Å; R1035-L1197 PolarHBondContact N-O 3.04Å; R1035-L1197 PolarHBondContact O-N 2.9Å; A1037-L1197 HydrophobicContact CB-CD1 3.68Å; A1037-L1197 HydrophobicContact CB-CD2 4.49Å; A1037-L1197 HydrophobicContact CB-CG 3.97Å; C1195-L1197 HydrophobicContact CB-CD2 4.15Å
1198	N	66.5	Low	82	Confident	80 Å²	80	16.2 Å²	16.2	43%	0.428	8%	0.083	S	C	.	.			trans	-108.9	0	-179.5	-65.5	-66.2	0	0	0	113.9	R483 N484 L1034	R483-N1198 HydrophobicContact CB-CB 4.18Å; R483-N1198 WeakPolarHBondContact CD-OXT 3.45Å; R483-N1198 HydrophobicContact CG-CB 4.49Å; R483-N1198 PolarHBondContact NH1-OXT 2.88Å; N484-N1198 PolarHBondContact ND2-O 3.32Å; N484-N1198 PolarHBondContact OD1-N 3.41Å; L1034-N1198 WeakPolarHBondContact CD2-OD1 3.17Å

Retrieved 1,198 of 1,198 residues in 332.3 ms (Link to these results)

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