A0A5K4F0V6_SCHMA Loading...

Recombining binding protein suppressor of hairless

AlphaFold DB , UniProt , Accession A0A5K4F0V6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,190 aa.

						>A0A5K4F0V6_SCHMA|A0A5K4F0V6
MASTDQMNFMTTNTNGSYGNYYPPHYQHHQTTNSQSDFSHLFHSNITYPSLLLTPSVSNPASPIFPPPPLPPVNTNSGNIFMSSSHTTNPTASGVYPVAAAAAAVAAASFQSLSSSVYDQFYSAISSNNLTTVNNNSSTNMHQHLTHNYNSHCTSQQAEDSAHNESISSSYRNPNLTGYSEITRTTYPLMSTHLFNQQRQTSLFPTSSYGTDNKLENQSIPDRLLLDQQLSKIIDKEEQILQQQERANNSDHIDFFNTRVQPSKNLVNHLSVDNQFAPRSSLSSESSSSSTSSSCSETYMNSSLQQVDRNANEHNSSKQLSNDFTQFSKTFQLSTCESGNYHTNHNNPLILSSLKEFQLDQNRLFNLSNHLLINNSNCQYTIKTTINNGTISTTTTTTTVTATSTTNNTNNNKLYRESLNSLNLPVFDENYDQINRSRIDQRETTNNIQLDILQPTSLILKAEENLLNFPSSSSSSTLLSNRSKETDSSYIATMSSGESDGGIVAVPANTGCCESLGILTRDMMRAYLVDRRDQILIILHAKVAQKSYGTEKRFFCPPPCVYLRGEGWGLQYNQTSHDESKLSSSHEHVDQTDLVSYSTNNVRTYSLQNNSSCSTATPIPGPSHLSSSFTGEQSQILAFMGIGGSTTPVEMIQLNLDDGRDYSNAKTLFISDSDKRKYFMLTLKMFYKNGKDLGQFYSRRIKVISKPSKKKQSLKNTDLCIASGTKIALFNRLRSQTVSTRYLHVEDASFHASSSRWGSFTINLLADDQDEAEQFTVQDGYIHYGHTVKLVCSETGMALPRLIVRKVDKTTVLLDADDPVSQLHKCAFHLKDTDRMYLCLSQDKIVQLPSTPCDENPLREKINDAAAWTIISTDRAEYRWFEPSHLPSTYRTKDGQIKPITPPPPCLTPVTPVPIVRDMRVNGGGDVAMLEIIGENFSPRHQVWFGDVPAQTFYRCEELILCFVPDISEFHRDWTYIQKTLEVPISLVRQDGIIYASGLTFTYHPESGPRQHCQPALEIIRAASIAAVAAAAAAASAVTSSNSLSTSEELLLEPSCSSRSGIVVSSSTIECNNVVPQQSSEFNLSQHNKDSMCLDNNHNSFLASVSSSYQMISRLNNCNNTTSGYYEDETFNQQHNYSHPHHQEHQLQQSHQQHHYAVDTQEHHLLRNNNNNSNSLTTTDRLFYIPVNTS
					

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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	29.4	Very low	34.5	Very low	256 Å²	256	142.1 Å²	142.1	100%	1.261	77%	0.773	S	S	*	*				0	161.8	0	-73.5	170.7	166.8	0	0	108.3
2	A	31.7	Very low	34.5	Very low	92 Å²	92	142 Å²	142	76%	0.76	78%	0.781	S	S	*	*			trans	-115.3	149.1	-168.4	0	0	0	0	0	113.3
3	S	33	Very low	34.3	Very low	108 Å²	108	142.8 Å²	142.8	76%	0.755	78%	0.783	S	S	*	*			trans	70.2	154.2	156.6	-60.7	0	0	0	0	120.9
4	T	39.4	Very low	34.4	Very low	128 Å²	128	143.4 Å²	143.4	79%	0.785	79%	0.793	S	S	*	*			trans	65.6	133.8	162.7	31	0	0	0	0	115.8
5	D	39.1	Very low	34.2	Very low	123 Å²	123	145.1 Å²	145.1	66%	0.658	80%	0.801	S	S	*	*			cis	-174	175.5	23.6	-141.6	-0.6	0	0	0	111.7
6	Q	36.7	Very low	34.3	Very low	148 Å²	148	140.9 Å²	140.9	69%	0.692	80%	0.801	S	S	*	*			trans	64.1	105.6	149.5	-69.9	166.5	55.2	0	0	123
7	M	34.8	Very low	34.4	Very low	155 Å²	155	138.2 Å²	138.2	76%	0.764	79%	0.793	S	S	*	*				44.8	137.1	115.4	-89.1	-166.9	-72.2	0	0	124.1
8	N	35.9	Very low	34.5	Very low	121 Å²	121	143.6 Å²	143.6	65%	0.647	80%	0.8	S	S	*	*			trans	87.8	123.2	136.1	-69.2	-14	0	0	0	123.4
9	F	33.9	Very low	34.7	Very low	164 Å²	164	140.1 Å²	140.1	72%	0.719	80%	0.8	S	S	*	*			trans	72.5	122.9	134.3	-83.9	-112.5	0	0	0	123.3
10	M	33.2	Very low	34.6	Very low	151 Å²	151	140.4 Å²	140.4	74%	0.744	80%	0.799	S	S	*	*			trans	65.7	113.8	135.3	-75.5	-174.1	175.9	0	0	123
11	T	32.7	Very low	34.7	Very low	117 Å²	117	145.1 Å²	145.1	72%	0.718	81%	0.806	S	S	*	*			trans	49.3	127.4	130.8	62.7	0	0	0	0	121.6
12	T	34.5	Very low	34.9	Very low	141 Å²	141	143.1 Å²	143.1	87%	0.865	79%	0.786	S	S	*	*				-178.4	165.6	103.8	26.8	0	0	0	0	112.6
13	N	31.1	Very low	35.3	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	79%	0.786	S	S	*	*			trans	-88	158.7	177.1	-65.5	-30.9	0	0	0	112.5
14	T	36.1	Very low	35.7	Very low	151 Å²	151	145 Å²	145	93%	0.926	79%	0.787	S	S	*	*				-170.3	165.2	128.6	14.3	0	0	0	0	112.7
15	N	31.7	Very low	35.5	Very low	170 Å²	170	147.2 Å²	147.2	91%	0.909	79%	0.789	S	S	*	*			trans	-112.8	156.6	-167	-78.3	-25.7	0	0	0	114.9
16	G	36.3	Very low	35.3	Very low	77 Å²	77	151.8 Å²	151.8	79%	0.794	80%	0.798	S	S	*	*			trans	120	161.5	149.7	0	0	0	0	0	116.6
17	S	35.1	Very low	35.1	Very low	95 Å²	95	151.7 Å²	151.7	66%	0.664	80%	0.798	S	S	*	*			cis	-169.8	161.6	-20	-161.1	0	0	0	0	111.5
18	Y	36.4	Very low	35.2	Very low	235 Å²	235	150.8 Å²	150.8	92%	0.922	79%	0.791	S	S	*	*			trans	66.1	141.5	163.5	-64.8	-69	0	0	0	121.6
19	G	38.7	Very low	35.2	Very low	78 Å²	78	151.3 Å²	151.3	80%	0.804	79%	0.789	S	S	*	*			trans	153.2	85.4	162.2	0	0	0	0	0	116.3
20	N	32.9	Very low	35.2	Very low	146 Å²	146	150.8 Å²	150.8	78%	0.781	79%	0.79	S	S	*	*			trans	-107.6	148.2	177	-86.9	-17.7	0	0	0	112.7
21	Y	35.3	Very low	35.1	Very low	240 Å²	240	149.5 Å²	149.5	94%	0.941	79%	0.79	S	S	*	*			trans	-154.8	145	150.6	-96.7	-72.4	0	0	0	112.4
22	Y	33.4	Very low	35.1	Very low	214 Å²	214	150 Å²	150	84%	0.839	79%	0.793	S	S	*	*			trans	-141.3	155.3	-177.4	-101.9	-83.5	0	0	0	109.3
23	P	42	Very low	34.8	Very low	117 Å²	117	151 Å²	151	76%	0.76	79%	0.793	S	S	*	*				-159.6	-164.4	110.1	39	-17.6	0	0	0	114.9
24	P	40	Very low	34.8	Very low	122 Å²	122	149.6 Å²	149.6	79%	0.792	80%	0.796	S	S	*	*				-130.4	-165.7	-54.7	38.1	-19.6	0	0	0	115.7
25	H	35.2	Very low	34.5	Very low	175 Å²	175	151.8 Å²	151.8	81%	0.81	80%	0.795	S	S	*	*			trans	-93.9	171.2	-169.8	-76	-97.5	0	0	0	118.5
26	Y	34.9	Very low	34.4	Very low	218 Å²	218	148.8 Å²	148.8	86%	0.855	79%	0.787	S	S	*	*				-175.7	-176.8	118.9	-96.3	-66.2	0	0	0	113.7
27	Q	33.4	Very low	34	Very low	147 Å²	147	152.1 Å²	152.1	69%	0.687	79%	0.787	S	S	*	*				-147	170.8	-119	-163	-179.2	0.9	0	0	117.8
28	H	36	Very low	33.7	Very low	136 Å²	136	157.2 Å²	157.2	63%	0.63	80%	0.798	S	S	*	*			trans	77.4	153.6	166.7	-76.4	-78.4	0	0	0	119.1
29	H	35.6	Very low	33.2	Very low	131 Å²	131	149.7 Å²	149.7	61%	0.606	78%	0.78	S	S	*	*			cis	-159.9	149.4	1.7	-130.8	-38.1	0	0	0	113.2
30	Q	34.5	Very low	32.7	Very low	154 Å²	154	152.8 Å²	152.8	72%	0.72	77%	0.773	S	S	*	*			trans	58.7	150.7	147.6	-83.8	160.9	2.2	0	0	120.5
31	T	32.1	Very low	32.6	Very low	124 Å²	124	152.6 Å²	152.6	76%	0.761	77%	0.771	S	S	*	*			cis	-168.2	-179.6	-25.1	16.6	0	0	0	0	106
32	T	32.6	Very low	32.3	Very low	127 Å²	127	151.1 Å²	151.1	78%	0.779	77%	0.77	S	S	*	*			cis	-137.5	-158.8	17.8	52.6	0	0	0	0	111.4
33	N	28	Very low	32	Very low	161 Å²	161	147.9 Å²	147.9	86%	0.861	76%	0.762	S	S	*	*			trans	-115.8	151.5	-178.4	-52.8	-31	0	0	0	114
34	S	31.7	Very low	31.5	Very low	124 Å²	124	147.3 Å²	147.3	87%	0.867	76%	0.761	S	S	*	*			trans	-159.8	148.1	134.5	56.1	0	0	0	0	110.6
35	Q	28.5	Very low	30.8	Very low	196 Å²	196	148.3 Å²	148.3	92%	0.916	76%	0.76	S	S	*	*			trans	-97.6	139.7	-179.4	-60.7	158.8	-92.7	0	0	111.1
36	S	30.8	Very low	30.5	Very low	107 Å²	107	146.6 Å²	146.6	75%	0.748	76%	0.755	S	S	*	*			trans	-171.1	148.9	138.7	59.5	0	0	0	0	110.6
37	D	26.4	Very low	30.1	Very low	148 Å²	148	141.5 Å²	141.5	79%	0.791	75%	0.747	S	S	*	*			trans	-58.1	154.5	157	-46.5	-95.9	0	0	0	110.4
38	F	29	Very low	29.9	Very low	201 Å²	201	142 Å²	142	88%	0.882	74%	0.744	S	S	*	*			trans	-170.1	149	133	-109	-67.9	0	0	0	112.4
39	S	26.3	Very low	29.7	Very low	78 Å²	78	140.3 Å²	140.3	55%	0.545	75%	0.745	S	S	.	*			trans	-86.4	-178.9	175.5	46.1	0	0	0	0	112.7
40	H	28.7	Very low	29.3	Very low	142 Å²	142	139.1 Å²	139.1	66%	0.657	75%	0.751	S	S	*	*			trans	72.6	111.9	173.9	-45	-85.9	0	0	0	116.3
41	L	29.7	Very low	29	Very low	142 Å²	142	139.2 Å²	139.2	74%	0.743	76%	0.756	S	S	*	*				176.3	85.3	106.1	-91.5	170.5	0	0	0	111.8	H43	L41-H43 HydrophobicContact CD2-CB 4.12Å
42	F	29	Very low	28.8	Very low	209 Å²	209	140.6 Å²	140.6	92%	0.917	76%	0.757	S	S	*	*			trans	-118.7	91.1	138	-89.5	-79.2	0	0	0	106.8
43	H	27.5	Very low	28.5	Very low	147 Å²	147	142.2 Å²	142.2	68%	0.681	76%	0.76	S	S	*	*			trans	-118.2	107.8	169.8	-86.5	17.2	0	0	0	107.7	L41	L41-H43 HydrophobicContact CD2-CB 4.12Å
44	S	31.4	Very low	28.4	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	75%	0.745	S	S	*	*			trans	-130.7	106	169.5	51.5	0	0	0	0	107	I46	S44-I46 PolarHBondContact O-N 3.44Å
45	N	25.2	Very low	28.1	Very low	144 Å²	144	138.2 Å²	138.2	77%	0.77	74%	0.739	S	S	*	*			trans	-62.9	123.8	-167.2	-56.3	-43.6	0	0	0	112.1
46	I	28.9	Very low	28	Very low	138 Å²	138	134 Å²	134	71%	0.708	73%	0.731	S	S	*	*			trans	-114.8	85.2	155.2	-58	-177.1	0	0	0	107.2	S44 Y48	S44-I46 PolarHBondContact O-N 3.44Å; I46-Y48 HydrophobicContact CG2-CD2 3.84Å; I46-Y48 HydrophobicContact CG2-CE2 3.62Å; I46-Y48 PolarHBondContact O-N 3.39Å; I46-Y48 VanDerWaalsContact O-N 3.15Å
47	T	27	Very low	27.8	Very low	112 Å²	112	134.5 Å²	134.5	69%	0.687	73%	0.729	S	S	*	*			trans	-76.5	94.9	171.1	-53.4	0	0	0	0	108.4	P49	T47-P49 WeakPolarHBondContact O-CD 3.41Å
48	Y	29.8	Very low	28	Very low	158 Å²	158	132.5 Å²	132.5	62%	0.62	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-65.5	125.6	166.1	-87	-76.9	0	0	0	109.4	I46	I46-Y48 HydrophobicContact CG2-CD2 3.84Å; I46-Y48 HydrophobicContact CG2-CE2 3.62Å; I46-Y48 PolarHBondContact O-N 3.39Å; I46-Y48 VanDerWaalsContact O-N 3.15Å
49	P	31.6	Very low	28	Very low	100 Å²	100	129 Å²	129	65%	0.649	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-68.8	144.7	169.2	30.2	-33.4	0	0	0	109.6	T47	T47-P49 WeakPolarHBondContact O-CD 3.41Å
50	S	27.1	Very low	28.2	Very low	106 Å²	106	131.4 Å²	131.4	74%	0.741	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-62.7	167.6	170.4	-48	0	0	0	0	111.8
51	L	27.5	Very low	28.3	Very low	156 Å²	156	127.3 Å²	127.3	82%	0.817	72%	0.722	S	S	*	*			trans	72.2	92.8	169.6	-50	173.8	0	0	0	115.9
52	L	27.7	Very low	28.4	Very low	152 Å²	152	125.4 Å²	125.4	80%	0.796	72%	0.72	S	S	*	*				-144.2	83.2	118.5	-97.3	178.6	0	0	0	109.3	T54	L52-T54 HydrophobicContact CD2-CG2 3.92Å; L52-T54 PolarHBondContact O-N 3.35Å
53	L	26.1	Very low	28.7	Very low	161 Å²	161	119.7 Å²	119.7	84%	0.843	70%	0.704	S	S	*	*			trans	-72.4	81.9	147.5	-84.5	86.8	0	0	0	106.7	P55	L53-P55 WeakPolarHBondContact O-CD 3.24Å
54	T	26.4	Very low	29	Very low	89 Å²	89	120.7 Å²	120.7	55%	0.546	71%	0.713	S	S	.	*			trans	-66.5	121.5	156	48.6	0	0	0	0	107	L52 S56	L52-T54 HydrophobicContact CD2-CG2 3.92Å; L52-T54 PolarHBondContact O-N 3.35Å; T54-S56 PolarHBondContact O-N 2.97Å
55	P	25.1	Very low	29.2	Very low	112 Å²	112	121.5 Å²	121.5	73%	0.727	70%	0.704	S	S	*	*			trans	-67.7	101.3	166.9	28.7	-31.9	0	0	0	107.2	L53 V57	L53-P55 WeakPolarHBondContact O-CD 3.24Å; P55-V57 HydrophobicContact CB-CG2 4.27Å; P55-V57 PolarHBondContact O-N 3.34Å
56	S	26.7	Very low	29.8	Very low	108 Å²	108	119.8 Å²	119.8	76%	0.755	70%	0.7	S	S	*	*			trans	-73.5	68.8	172.1	36.1	0	0	0	0	109.8	T54	T54-S56 PolarHBondContact O-N 2.97Å
57	V	27.2	Very low	30.5	Very low	118 Å²	118	118.8 Å²	118.8	72%	0.715	70%	0.703	S	S	*	*			trans	-54.1	145.3	169	178.3	0	0	0	0	108.8	P55	P55-V57 HydrophobicContact CB-CG2 4.27Å; P55-V57 PolarHBondContact O-N 3.34Å
58	S	29.5	Very low	31.4	Very low	105 Å²	105	118.9 Å²	118.9	73%	0.734	71%	0.705	S	S	*	*			trans	69.8	78	178.2	73.3	0	0	0	0	116.6	P60	S58-P60 VanDerWaalsContact C-CD 3.46Å; S58-P60 WeakPolarHBondContact O-CD 3.38Å
59	N	30.6	Very low	31.9	Very low	129 Å²	129	117.4 Å²	117.4	69%	0.69	72%	0.715	S	S	*	*			trans	-110.1	84.8	145	-170.7	-6.9	0	0	0	110.1	A61	N59-A61 PolarHBondContact O-N 2.96Å; N59-A61 WeakPolarHBondContact OD1-CB 3.42Å
60	P	29.4	Very low	32.7	Very low	127 Å²	127	120.4 Å²	120.4	83%	0.825	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	53.5	-176.5	34.7	-37.1	0	0	0	112.2	S58	S58-P60 VanDerWaalsContact C-CD 3.46Å; S58-P60 WeakPolarHBondContact O-CD 3.38Å
61	A	31.2	Very low	33.6	Very low	56 Å²	56	120.3 Å²	120.3	46%	0.463	72%	0.722	S	S	.	*	T	Hydrogen-bonded Turn	trans	-136.9	17.6	-176.1	0	0	0	0	0	114.5	N59	N59-A61 PolarHBondContact O-N 2.96Å; N59-A61 WeakPolarHBondContact OD1-CB 3.42Å
62	S	30.9	Very low	34.1	Very low	102 Å²	102	119 Å²	119	71%	0.713	72%	0.722	S	S	*	*			trans	-97.3	115.5	168.6	-72.6	0	0	0	0	110	I64	S62-I64 PolarHBondContact O-N 3.4Å; S62-I64 VanDerWaalsContact O-N 3.12Å
63	P	36	Very low	34.6	Very low	90 Å²	90	118 Å²	118	58%	0.584	72%	0.722	S	S	*	*			trans	-72.3	109.3	172.6	-3.8	19.1	0	0	0	108.6	F65	P63-F65 HydrophobicContact CB-CD2 4.32Å; P63-F65 HydrophobicContact CB-CE2 3.76Å; P63-F65 HydrophobicContact CB-CZ 4.29Å; P63-F65 HydrophobicContact CG-CE2 4.15Å; P63-F65 WeakPolarHBondContact O-CD2 3.33Å; P63-F65 WeakPolarHBondContact O-CE2 3.34Å; P63-F65 PolarHBondContact O-N 3.22Å
64	I	34	Very low	35	Very low	168 Å²	168	117.1 Å²	117.1	86%	0.862	72%	0.719	S	S	*	*			trans	-65.4	113.2	165.4	-61.6	174.8	0	0	0	106.5	S62	S62-I64 PolarHBondContact O-N 3.4Å; S62-I64 VanDerWaalsContact O-N 3.12Å
65	F	35.8	Very low	35.2	Very low	121 Å²	121	118.7 Å²	118.7	53%	0.531	73%	0.728	S	S	.	*	P	Polyproline II helix	trans	-84.6	128.3	176.5	-78.7	-94.6	0	0	0	109	P63	P63-F65 HydrophobicContact CB-CD2 4.32Å; P63-F65 HydrophobicContact CB-CE2 3.76Å; P63-F65 HydrophobicContact CB-CZ 4.29Å; P63-F65 HydrophobicContact CG-CE2 4.15Å; P63-F65 WeakPolarHBondContact O-CD2 3.33Å; P63-F65 WeakPolarHBondContact O-CE2 3.34Å; P63-F65 PolarHBondContact O-N 3.22Å
66	P	38.2	Very low	35.8	Very low	108 Å²	108	120.6 Å²	120.6	70%	0.701	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-63.3	149.6	163.9	29.6	-34	0	0	0	109.2
67	P	42.6	Very low	36	Very low	116 Å²	116	121.5 Å²	121.5	75%	0.753	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-60.1	145.1	177.5	25.4	-34.2	0	0	0	110.9
68	P	46.7	Very low	36.5	Very low	115 Å²	115	119.5 Å²	119.5	75%	0.747	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-65.3	142.6	177.2	28.3	-34.3	0	0	0	110.6	L70	P68-L70 PolarHBondContact O-N 2.9Å
69	P	39.1	Very low	36.5	Very low	126 Å²	126	121.7 Å²	121.7	82%	0.818	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-66.6	132.8	178.6	27.7	-34.1	0	0	0	110.9
70	L	49.5	Very low	36.5	Very low	163 Å²	163	121.8 Å²	121.8	85%	0.853	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-64.1	141.7	173.3	-71.9	165	0	0	0	110.7	P68	P68-L70 PolarHBondContact O-N 2.9Å
71	P	45.5	Very low	36.6	Very low	105 Å²	105	124 Å²	124	68%	0.682	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-68.5	144.5	173.7	29.7	-34.3	0	0	0	110.8	V73	P71-V73 PolarHBondContact O-N 3.19Å
72	P	37.4	Very low	36.5	Very low	128 Å²	128	129 Å²	129	83%	0.831	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-71.5	117.5	-176.8	28.1	-34.2	0	0	0	111.7	N74	P72-N74 PolarHBondContact O-N 2.96Å
73	V	38.4	Very low	36.5	Very low	130 Å²	130	129.4 Å²	129.4	79%	0.788	76%	0.76	S	S	*	*			trans	-78.7	110.7	170.5	179.5	0	0	0	0	108.6	P71 T75	P71-V73 PolarHBondContact O-N 3.19Å; V73-T75 HydrophobicContact CG1-CG2 4.35Å; V73-T75 PolarHBondContact O-N 3.21Å
74	N	35.5	Very low	36.3	Very low	144 Å²	144	130 Å²	130	77%	0.77	77%	0.766	S	S	*	*			trans	-88.8	94	-171.4	-159.3	14.2	0	0	0	111.4	P72 N76	P72-N74 PolarHBondContact O-N 2.96Å; N74-N76 PolarHBondContact O-N 2.94Å
75	T	30.8	Very low	36.3	Very low	122 Å²	122	127 Å²	127	75%	0.748	76%	0.76	S	S	*	*			trans	-87.6	96	-177.5	53.4	0	0	0	0	112.2	V73	V73-T75 HydrophobicContact CG1-CG2 4.35Å; V73-T75 PolarHBondContact O-N 3.21Å
76	N	36.3	Very low	36.3	Very low	152 Å²	152	129 Å²	129	81%	0.813	77%	0.771	S	S	*	*			trans	-106.8	102.4	175.9	-112.8	-2.1	0	0	0	111.8	N74	N74-N76 PolarHBondContact O-N 2.94Å
77	S	31.5	Very low	35.9	Very low	127 Å²	127	129 Å²	129	89%	0.888	77%	0.769	S	S	*	*			trans	-91.6	102.9	167.1	54.7	0	0	0	0	109.9
78	G	36.9	Very low	35.6	Very low	76 Å²	76	130.6 Å²	130.6	78%	0.784	78%	0.777	S	S	*	*			trans	-143.9	97.7	-173.5	0	0	0	0	0	112.4
79	N	31	Very low	34.9	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	78%	0.783	S	S	*	*			trans	-74.8	156.2	-167.6	-131	-7.1	0	0	0	114.5
80	I	30.1	Very low	34.8	Very low	132 Å²	132	132.1 Å²	132.1	68%	0.677	78%	0.778	S	S	*	*			trans	91.2	138.2	144.1	-70.1	163.7	0	0	0	122
81	F	30.7	Very low	34	Very low	172 Å²	172	131.3 Å²	131.3	75%	0.754	78%	0.78	S	S	*	*			trans	66	97	164.4	-79.3	-55.1	0	0	0	123.8
82	M	28.9	Very low	33.4	Very low	162 Å²	162	131.4 Å²	131.4	80%	0.798	79%	0.79	S	S	*	*				47.2	127.5	125.2	-75.8	-175.8	168.4	0	0	122.4
83	S	32.6	Very low	33.1	Very low	110 Å²	110	131.5 Å²	131.5	77%	0.769	79%	0.793	S	S	*	*				154.8	120.6	100.5	52.4	0	0	0	0	114.9
84	S	31.8	Very low	32.9	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	79%	0.787	S	S	*	*			trans	50.3	112.4	147.6	55.9	0	0	0	0	123.2
85	S	33.2	Very low	32.8	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	79%	0.791	S	S	*	*			trans	76.8	155.4	135.1	82.6	0	0	0	0	119.3
86	H	34.9	Very low	33.1	Very low	162 Å²	162	132.7 Å²	132.7	75%	0.75	80%	0.796	S	S	*	*			cis	-143.7	129.6	8.9	-130.8	-66.4	0	0	0	112.7
87	T	30.1	Very low	33.6	Very low	109 Å²	109	129.9 Å²	129.9	67%	0.669	79%	0.786	S	S	*	*			trans	24.5	123.2	150.2	53.7	0	0	0	0	122.6
88	T	35.9	Very low	34	Very low	149 Å²	149	129.8 Å²	129.8	91%	0.914	78%	0.78	S	S	*	*				-157.6	160.6	123.7	4.8	0	0	0	0	110.7
89	N	32.6	Very low	33.9	Very low	163 Å²	163	129.6 Å²	129.6	87%	0.872	77%	0.771	S	S	*	*			trans	-91.1	157.8	-152.9	-94.9	1.5	0	0	0	117.7
90	P	36.1	Very low	34.2	Very low	110 Å²	110	125.9 Å²	125.9	71%	0.714	76%	0.761	S	S	*	*			trans	-105.8	169.3	-179.8	41.6	-35.5	0	0	0	114.2
91	T	32.8	Very low	34.4	Very low	145 Å²	145	122.6 Å²	122.6	89%	0.89	75%	0.753	S	S	*	*			trans	-170	116	146.5	29.1	0	0	0	0	111.2
92	A	33.9	Very low	34.4	Very low	108 Å²	108	117.4 Å²	117.4	89%	0.893	74%	0.743	S	S	*	*			trans	170.3	91	151.3	0	0	0	0	0	110
93	S	30.9	Very low	34.8	Very low	129 Å²	129	112.7 Å²	112.7	90%	0.902	73%	0.729	S	S	*	*			trans	-88.2	134.3	176.2	39.5	0	0	0	0	111.7
94	G	34.1	Very low	35	Very low	64 Å²	64	110.3 Å²	110.3	66%	0.66	72%	0.716	S	S	*	*			trans	-138.5	118.9	171.5	0	0	0	0	0	109.8
95	V	34.3	Very low	35.2	Very low	142 Å²	142	110 Å²	110	86%	0.861	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-83.5	122.2	-173.5	179.7	0	0	0	0	110.2
96	Y	36.9	Very low	35.3	Very low	215 Å²	215	107.3 Å²	107.3	84%	0.843	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-83.5	127.5	169.3	-79.8	-88.2	0	0	0	110.4
97	P	46.3	Very low	35.4	Very low	93 Å²	93	101.2 Å²	101.2	60%	0.604	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-76.9	129.8	-179.9	29.8	-33.9	0	0	0	112	A99 A100	P97-A99 PolarHBondContact O-N 2.96Å; P97-A99 VanDerWaalsContact O-N 3.09Å; P97-A100 PolarHBondContact O-N 3Å
98	V	39.5	Very low	35.7	Very low	125 Å²	125	98.6 Å²	98.6	76%	0.758	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	-23.2	-178.2	177.9	0	0	0	0	113.1	A100 A101	V98-A100 PolarHBondContact O-N 3.05Å; V98-A100 VanDerWaalsContact O-N 3.14Å; V98-A101 PolarHBondContact O-N 2.89Å; V98-A101 VanDerWaalsContact O-N 3.1Å
99	A	35.2	Very low	35.6	Very low	72 Å²	72	94.4 Å²	94.4	60%	0.595	64%	0.638	S	S	*	*	H	α-helix	trans	-53.9	-32.9	179.1	0	0	0	0	0	114.5	P97 A101 A102 A103	P97-A99 PolarHBondContact O-N 2.96Å; P97-A99 VanDerWaalsContact O-N 3.09Å; A99-A101 VanDerWaalsContact C-N 3.31Å; A99-A101 PolarHBondContact O-N 2.93Å; A99-A102 PolarHBondContact O-N 3Å; A99-A103 PolarHBondContact O-N 3.33Å; A99-A103 VanDerWaalsContact O-N 3.12Å
100	A	36.6	Very low	35.9	Very low	73 Å²	73	91.7 Å²	91.7	60%	0.603	62%	0.619	S	S	*	*	H	α-helix	trans	-64.8	-33.7	179.9	0	0	0	0	0	112.9	P97 V98 A104	P97-A100 PolarHBondContact O-N 3Å; V98-A100 PolarHBondContact O-N 3.05Å; V98-A100 VanDerWaalsContact O-N 3.14Å; A100-A104 PolarHBondContact O-N 3.43Å
101	A	34.3	Very low	36.1	Very low	62 Å²	62	91.4 Å²	91.4	51%	0.512	61%	0.607	S	S	.	*	H	α-helix	trans	-73.2	-40.6	176.7	0	0	0	0	0	111.7	V98 A99 A103 A104 V105	V98-A101 PolarHBondContact O-N 2.89Å; V98-A101 VanDerWaalsContact O-N 3.1Å; A99-A101 VanDerWaalsContact C-N 3.31Å; A99-A101 PolarHBondContact O-N 2.93Å; A101-A103 PolarHBondContact O-N 3Å; A101-A104 PolarHBondContact O-N 3.08Å; A101-V105 WeakPolarHBondContact O-CG2 3.23Å; A101-V105 PolarHBondContact O-N 3.39Å; A101-V105 VanDerWaalsContact O-N 3.09Å
102	A	32.5	Very low	36.2	Very low	64 Å²	64	87.9 Å²	87.9	53%	0.529	59%	0.589	S	S	.	*	H	α-helix	trans	-61.6	-43.3	177.8	0	0	0	0	0	112	A99 A104 V105 A106	A99-A102 PolarHBondContact O-N 3Å; A102-A104 VanDerWaalsContact C-N 3.33Å; A102-A104 PolarHBondContact O-N 3.11Å; A102-V105 PolarHBondContact O-N 3.12Å; A102-A106 WeakPolarHBondContact O-CB 3.35Å; A102-A106 PolarHBondContact O-N 3.49Å
103	A	36.2	Very low	36.4	Very low	62 Å²	62	87.9 Å²	87.9	51%	0.512	57%	0.573	S	S	.	*	H	α-helix	trans	-61.5	-38.8	176.3	0	0	0	0	0	112.7	A99 A101 A107	A99-A103 PolarHBondContact O-N 3.33Å; A99-A103 VanDerWaalsContact O-N 3.12Å; A101-A103 PolarHBondContact O-N 3Å; A103-A107 WeakPolarHBondContact O-CB 3.14Å; A103-A107 PolarHBondContact O-N 2.75Å
104	A	36.3	Very low	37	Very low	61 Å²	61	83.1 Å²	83.1	50%	0.504	54%	0.54	S	S	.	.	H	α-helix	trans	-67.1	-41.6	176.8	0	0	0	0	0	112.6	A100 A101 A102 A107 A108	A100-A104 PolarHBondContact O-N 3.43Å; A101-A104 PolarHBondContact O-N 3.08Å; A102-A104 VanDerWaalsContact C-N 3.33Å; A102-A104 PolarHBondContact O-N 3.11Å; A104-A107 PolarHBondContact O-N 3.12Å; A104-A108 WeakPolarHBondContact O-CB 3.01Å; A104-A108 PolarHBondContact O-N 3.27Å
105	V	37.2	Very low	37.4	Very low	97 Å²	97	82.6 Å²	82.6	59%	0.588	53%	0.526	S	S	*	.	H	α-helix	trans	-66.5	-39.1	176.3	174	0	0	0	0	111.6	A101 A102 S109	A101-V105 WeakPolarHBondContact O-CG2 3.23Å; A101-V105 PolarHBondContact O-N 3.39Å; A101-V105 VanDerWaalsContact O-N 3.09Å; A102-V105 PolarHBondContact O-N 3.12Å; V105-S109 WeakPolarHBondContact O-CB 3.18Å; V105-S109 PolarHBondContact O-N 3.43Å; V105-S109 VanDerWaalsContact O-N 3.07Å; V105-S109 PolarHBondContact O-OG 3.34Å
106	A	35.5	Very low	37.8	Very low	48 Å²	48	78.4 Å²	78.4	40%	0.397	50%	0.503	S	S	.	.	H	α-helix	trans	-63.3	-47.4	173.6	0	0	0	0	0	111.3	A102 A108 S109 F110	A102-A106 WeakPolarHBondContact O-CB 3.35Å; A102-A106 PolarHBondContact O-N 3.49Å; A106-A108 PolarHBondContact O-N 2.75Å; A106-S109 WeakPolarHBondContact O-CB 3.34Å; A106-S109 PolarHBondContact O-N 3.32Å; A106-S109 VanDerWaalsContact O-N 3.1Å; A106-F110 WeakPolarHBondContact O-CD2 3.28Å; A106-F110 PolarHBondContact O-N 2.82Å
107	A	36.3	Very low	38.4	Very low	35 Å²	35	71.1 Å²	71.1	29%	0.289	48%	0.481	S	S	.	.	H	α-helix	trans	-60.8	-40.4	177.6	0	0	0	0	0	113	A103 A104 S109 F110 Q111	A103-A107 WeakPolarHBondContact O-CB 3.14Å; A103-A107 PolarHBondContact O-N 2.75Å; A104-A107 PolarHBondContact O-N 3.12Å; A107-S109 VanDerWaalsContact C-N 3.3Å; A107-S109 PolarHBondContact O-N 2.88Å; A107-F110 PolarHBondContact O-N 3.4Å; A107-Q111 WeakPolarHBondContact O-CG 3.16Å; A107-Q111 PolarHBondContact O-N 3.46Å
108	A	35.8	Very low	38.5	Very low	54 Å²	54	70.1 Å²	70.1	45%	0.446	47%	0.465	S	S	.	.	H	α-helix	trans	-64.3	-34.9	174.3	0	0	0	0	0	112.4	A104 A106 Q111 S112	A104-A108 WeakPolarHBondContact O-CB 3.01Å; A104-A108 PolarHBondContact O-N 3.27Å; A106-A108 PolarHBondContact O-N 2.75Å; A108-Q111 PolarHBondContact O-N 3.33Å; A108-S112 PolarHBondContact O-N 3.07Å; A108-S112 VanDerWaalsContact O-N 3.14Å
109	S	35.6	Very low	39	Very low	60 Å²	60	69 Å²	69	42%	0.42	46%	0.456	S	S	.	.	H	α-helix	trans	-72.7	-36.3	177.3	-54.8	0	0	0	0	112.1	V105 A106 A107 Q111 S112 L113	V105-S109 WeakPolarHBondContact O-CB 3.18Å; V105-S109 PolarHBondContact O-N 3.43Å; V105-S109 VanDerWaalsContact O-N 3.07Å; V105-S109 PolarHBondContact O-OG 3.34Å; A106-S109 WeakPolarHBondContact O-CB 3.34Å; A106-S109 PolarHBondContact O-N 3.32Å; A106-S109 VanDerWaalsContact O-N 3.1Å; A107-S109 VanDerWaalsContact C-N 3.3Å; A107-S109 PolarHBondContact O-N 2.88Å; S109-Q111 VanDerWaalsContact C-N 3.35Å; S109-S112 PolarHBondContact O-OG 3.44Å; S109-L113 WeakPolarHBondContact O-CG 3.34Å; S109-L113 PolarHBondContact O-N 3.37Å
110	F	37	Very low	39.7	Very low	107 Å²	107	72 Å²	72	47%	0.469	46%	0.457	S	S	.	.	H	α-helix	trans	-62	-41.3	167.8	-87.7	-74.8	0	0	0	111.8	A106 A107 S114 A1030	A106-F110 WeakPolarHBondContact O-CD2 3.28Å; A106-F110 PolarHBondContact O-N 2.82Å; A107-F110 PolarHBondContact O-N 3.4Å; F110-S114 VanDerWaalsContact O-CB 3.27Å; F110-S114 WeakPolarHBondContact O-CB 3.4Å; F110-S114 PolarHBondContact O-N 2.94Å; F110-S114 PolarHBondContact O-OG 2.72Å; F110-A1030 HydrophobicContact CE1-CB 3.61Å; F110-A1030 HydrophobicContact CZ-CB 3.51Å
111	Q	40.8	Very low	40.2	Very low	103 Å²	103	69.2 Å²	69.2	48%	0.481	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-47.3	-180	-75.6	172.9	8.3	0	0	112.4	A107 A108 S109 L113 S114 S115	A107-Q111 WeakPolarHBondContact O-CG 3.16Å; A107-Q111 PolarHBondContact O-N 3.46Å; A108-Q111 PolarHBondContact O-N 3.33Å; S109-Q111 VanDerWaalsContact C-N 3.35Å; Q111-L113 PolarHBondContact O-N 2.68Å; Q111-S114 PolarHBondContact O-N 3.16Å; Q111-S114 VanDerWaalsContact O-N 3.15Å; Q111-S114 PolarHBondContact O-OG 3.25Å; Q111-S115 PolarHBondContact O-N 2.79Å
112	S	36.2	Very low	41	Very low	71 Å²	71	70.5 Å²	70.5	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-66.6	-36	-179.7	61.5	0	0	0	0	113.6	A108 S109 S115 S116	A108-S112 PolarHBondContact O-N 3.07Å; A108-S112 VanDerWaalsContact O-N 3.14Å; S109-S112 PolarHBondContact O-OG 3.44Å; S112-S115 PolarHBondContact O-OG 2.87Å; S112-S116 PolarHBondContact O-N 2.7Å; S112-S116 PolarHBondContact O-OG 3.05Å
113	L	38	Very low	41.7	Very low	108 Å²	108	70.7 Å²	70.7	57%	0.565	42%	0.421	S	S	*	.	H	α-helix	trans	-66.5	-39.7	170.5	-70.1	168.7	0	0	0	111.5	S109 Q111 S115 S116 V117	S109-L113 WeakPolarHBondContact O-CG 3.34Å; S109-L113 PolarHBondContact O-N 3.37Å; Q111-L113 PolarHBondContact O-N 2.68Å; L113-S115 VanDerWaalsContact C-N 3.28Å; L113-S115 PolarHBondContact O-N 3.16Å; L113-S116 PolarHBondContact O-OG 3.41Å; L113-V117 WeakPolarHBondContact O-CG2 3.32Å; L113-V117 PolarHBondContact O-N 3.44Å
114	S	42.1	Very low	41.8	Very low	30 Å²	30	69.1 Å²	69.1	21%	0.21	41%	0.408	C	S	.	.	H	α-helix	trans	-70.5	-19	179.7	80.2	0	0	0	0	114.4	F110 Q111 Y118 R955	F110-S114 VanDerWaalsContact O-CB 3.27Å; F110-S114 WeakPolarHBondContact O-CB 3.4Å; F110-S114 PolarHBondContact O-N 2.94Å; F110-S114 PolarHBondContact O-OG 2.72Å; Q111-S114 PolarHBondContact O-N 3.16Å; Q111-S114 VanDerWaalsContact O-N 3.15Å; Q111-S114 PolarHBondContact O-OG 3.25Å; S114-Y118 VanDerWaalsContact O-CB 3.25Å; S114-Y118 WeakPolarHBondContact O-CB 3.45Å; S114-R955 PolarHBondContact O-NH1 2.91Å; S114-R955 PolarHBondContact O-NH2 3.35Å; S114-R955 VanDerWaalsContact O-NH2 3.12Å
115	S	42.7	Very low	42.1	Very low	53 Å²	53	69.1 Å²	69.1	37%	0.371	40%	0.399	S	S	.	.	H	α-helix	trans	-89.2	-45.3	175.5	74.7	0	0	0	0	112	Q111 S112 L113 V117 Y118 D119	Q111-S115 PolarHBondContact O-N 2.79Å; S112-S115 PolarHBondContact O-OG 2.87Å; L113-S115 VanDerWaalsContact C-N 3.28Å; L113-S115 PolarHBondContact O-N 3.16Å; S115-V117 VanDerWaalsContact C-N 3.33Å; S115-V117 PolarHBondContact O-N 3.04Å; S115-Y118 WeakPolarHBondContact O-CA 3.28Å; S115-Y118 WeakPolarHBondContact O-CB 3.4Å; S115-Y118 PolarHBondContact O-N 3.47Å; S115-D119 PolarHBondContact O-N 2.97Å
116	S	43.9	Very low	42.2	Very low	53 Å²	53	68.5 Å²	68.5	37%	0.371	40%	0.399	S	S	.	.	H	α-helix	trans	-63	-38.8	179.5	62.2	0	0	0	0	112.6	S112 L113 Y118 Q120	S112-S116 PolarHBondContact O-N 2.7Å; S112-S116 PolarHBondContact O-OG 3.05Å; L113-S116 PolarHBondContact O-OG 3.41Å; S116-Y118 VanDerWaalsContact C-N 3.32Å; S116-Q120 VanDerWaalsContact O-CG 3.32Å; S116-Q120 WeakPolarHBondContact O-CG 3.49Å; S116-Q120 PolarHBondContact O-N 3.37Å; S116-Q120 VanDerWaalsContact O-N 3.17Å
117	V	48	Very low	42.3	Very low	62 Å²	62	69.8 Å²	69.8	38%	0.376	41%	0.405	S	S	.	.	H	α-helix	trans	-66	-34.9	171.6	175.5	0	0	0	0	111.3	L113 S115 Q120 F121	L113-V117 WeakPolarHBondContact O-CG2 3.32Å; L113-V117 PolarHBondContact O-N 3.44Å; S115-V117 VanDerWaalsContact C-N 3.33Å; S115-V117 PolarHBondContact O-N 3.04Å; V117-Q120 PolarHBondContact O-N 3.2Å; V117-F121 VanDerWaalsContact O-CB 3.32Å; V117-F121 WeakPolarHBondContact O-CB 3.45Å; V117-F121 PolarHBondContact O-N 3.35Å
118	Y	48.3	Very low	42.3	Very low	72 Å²	72	73.7 Å²	73.7	28%	0.282	42%	0.421	S	S	.	.	H	α-helix	trans	-71	-41.9	179.8	-176.7	-97.8	0	0	0	112.7	S114 S115 S116 Q120 F121 Y122 L961	S114-Y118 VanDerWaalsContact O-CB 3.25Å; S114-Y118 WeakPolarHBondContact O-CB 3.45Å; S115-Y118 WeakPolarHBondContact O-CA 3.28Å; S115-Y118 WeakPolarHBondContact O-CB 3.4Å; S115-Y118 PolarHBondContact O-N 3.47Å; S116-Y118 VanDerWaalsContact C-N 3.32Å; Y118-Q120 VanDerWaalsContact C-N 3.31Å; Y118-Q120 PolarHBondContact O-N 3.22Å; Y118-F121 WeakPolarHBondContact O-CB 3.4Å; Y118-F121 PolarHBondContact O-N 3.1Å; Y118-F121 VanDerWaalsContact O-N 3.14Å; Y118-Y122 HydrophobicContact CD1-CD2 4.18Å; Y118-Y122 HydrophobicContact CD2-CD2 4.04Å; Y118-Y122 AromaticContact CD2-CE2 3.97Å; Y118-Y122 HydrophobicContact CD2-CE2 3.97Å; Y118-Y122 AromaticContact CE1-CD2 3.91Å; Y118-Y122 HydrophobicContact CE1-CD2 3.91Å; Y118-Y122 HydrophobicContact CE1-CE2 4.02Å; Y118-Y122 AromaticContact CE2-CD2 3.8Å; Y118-Y122 HydrophobicContact CE2-CD2 3.8Å; Y118-Y122 AromaticContact CE2-CE2 3.32Å; Y118-Y122 HydrophobicContact CE2-CE2 3.32Å; Y118-Y122 HydrophobicContact CG-CD2 4.25Å; Y118-Y122 AromaticContact CZ-CD2 3.73Å; Y118-Y122 AromaticContact CZ-CE2 3.35Å; Y118-Y122 PolarHBondContact O-N 3.25Å; Y118-L961 HydrophobicContact CD2-CD1 4.43Å; Y118-L961 HydrophobicContact CE2-CD1 3.84Å
119	D	50.1	Low	42.1	Very low	103 Å²	103	77.7 Å²	77.7	55%	0.551	44%	0.435	S	S	*	.	H	α-helix	trans	-64.2	-38.6	174.5	-63.3	-33.3	0	0	0	110.9	S115 S123	S115-D119 PolarHBondContact O-N 2.97Å; D119-S123 VanDerWaalsContact O-CB 3.32Å; D119-S123 WeakPolarHBondContact O-CB 3.5Å; D119-S123 PolarHBondContact O-N 3.42Å; D119-S123 PolarHBondContact O-OG 3.3Å
120	Q	49.6	Very low	41.7	Very low	134 Å²	134	82.1 Å²	82.1	63%	0.626	45%	0.453	S	S	*	.	H	α-helix	trans	-65.1	-39.4	170.6	-72.8	177.3	-2	0	0	112.3	S116 V117 Y118 S123 A124	S116-Q120 VanDerWaalsContact O-CG 3.32Å; S116-Q120 WeakPolarHBondContact O-CG 3.49Å; S116-Q120 PolarHBondContact O-N 3.37Å; S116-Q120 VanDerWaalsContact O-N 3.17Å; V117-Q120 PolarHBondContact O-N 3.2Å; Y118-Q120 VanDerWaalsContact C-N 3.31Å; Y118-Q120 PolarHBondContact O-N 3.22Å; Q120-S123 WeakPolarHBondContact CA-OG 3.47Å; Q120-S123 PolarHBondContact O-OG 3.01Å; Q120-S123 VanDerWaalsContact O-OG 3.13Å; Q120-A124 WeakPolarHBondContact O-CB 3.47Å; Q120-A124 PolarHBondContact O-N 2.81Å
121	F	48.7	Very low	41.3	Very low	14 Å²	14	82.2 Å²	82.2	6%	0.061	46%	0.463	C	S	.	.	H	α-helix	trans	-67.2	-47.3	178.9	-150.6	-111.4	0	0	0	112.1	V117 Y118 A124 I125 V927 M929 F963 I1019	V117-F121 VanDerWaalsContact O-CB 3.32Å; V117-F121 WeakPolarHBondContact O-CB 3.45Å; V117-F121 PolarHBondContact O-N 3.35Å; Y118-F121 WeakPolarHBondContact O-CB 3.4Å; Y118-F121 PolarHBondContact O-N 3.1Å; Y118-F121 VanDerWaalsContact O-N 3.14Å; F121-A124 PolarHBondContact O-N 2.99Å; F121-I125 HydrophobicContact CD1-CD1 3.6Å; F121-I125 HydrophobicContact CE1-CD1 3.62Å; F121-I125 HydrophobicContact CG-CD1 4.43Å; F121-I125 HydrophobicContact CZ-CD1 4.45Å; F121-I125 WeakPolarHBondContact O-CG1 3.5Å; F121-I125 PolarHBondContact O-N 2.77Å; F121-V927 HydrophobicContact CE1-CG1 3.88Å; F121-V927 HydrophobicContact CE2-CG1 4.3Å; F121-V927 HydrophobicContact CZ-CG1 3.42Å; F121-V927 VanDerWaalsContact CZ-CG1 3.42Å; F121-M929 HydrophobicContact CD1-CE 3.93Å; F121-M929 HydrophobicContact CD1-SD 4.26Å; F121-M929 HydrophobicContact CE1-CE 3.71Å; F121-M929 HydrophobicContact CE1-CG 4.44Å; F121-M929 HydrophobicContact CE1-SD 3.74Å; F121-F963 HydrophobicContact CE1-CE1 4.31Å; F121-F963 HydrophobicContact CE2-CZ 4.32Å; F121-F963 AromaticContact CZ-CE1 3.75Å; F121-F963 HydrophobicContact CZ-CE1 3.75Å; F121-F963 AromaticContact CZ-CZ 3.96Å; F121-F963 HydrophobicContact CZ-CZ 3.96Å; F121-I1019 HydrophobicContact CD2-CG2 3.78Å; F121-I1019 HydrophobicContact CE2-CB 4.44Å; F121-I1019 HydrophobicContact CE2-CG2 3.67Å
122	Y	50.9	Low	40.7	Very low	90 Å²	90	83.5 Å²	83.5	35%	0.353	48%	0.477	S	S	.	.	H	α-helix	trans	-69	-35.6	178.8	-93.6	-99.9	0	0	0	112.4	Y118 S126 M929	Y118-Y122 HydrophobicContact CD1-CD2 4.18Å; Y118-Y122 HydrophobicContact CD2-CD2 4.04Å; Y118-Y122 AromaticContact CD2-CE2 3.97Å; Y118-Y122 HydrophobicContact CD2-CE2 3.97Å; Y118-Y122 AromaticContact CE1-CD2 3.91Å; Y118-Y122 HydrophobicContact CE1-CD2 3.91Å; Y118-Y122 HydrophobicContact CE1-CE2 4.02Å; Y118-Y122 AromaticContact CE2-CD2 3.8Å; Y118-Y122 HydrophobicContact CE2-CD2 3.8Å; Y118-Y122 AromaticContact CE2-CE2 3.32Å; Y118-Y122 HydrophobicContact CE2-CE2 3.32Å; Y118-Y122 HydrophobicContact CG-CD2 4.25Å; Y118-Y122 AromaticContact CZ-CD2 3.73Å; Y118-Y122 AromaticContact CZ-CE2 3.35Å; Y118-Y122 PolarHBondContact O-N 3.25Å; Y122-S126 VanDerWaalsContact O-CB 3.23Å; Y122-S126 WeakPolarHBondContact O-CB 3.32Å; Y122-S126 PolarHBondContact O-N 3.48Å; Y122-S126 PolarHBondContact O-OG 3.18Å; Y122-M929 HydrophobicContact CE2-CE 4.5Å
123	S	45.6	Very low	40.4	Very low	68 Å²	68	86.7 Å²	86.7	48%	0.476	49%	0.494	S	S	.	.	H	α-helix	trans	-70.3	-36.2	173.1	54.6	0	0	0	0	112.6	D119 Q120 S127	D119-S123 VanDerWaalsContact O-CB 3.32Å; D119-S123 WeakPolarHBondContact O-CB 3.5Å; D119-S123 PolarHBondContact O-N 3.42Å; D119-S123 PolarHBondContact O-OG 3.3Å; Q120-S123 WeakPolarHBondContact CA-OG 3.47Å; Q120-S123 PolarHBondContact O-OG 3.01Å; Q120-S123 VanDerWaalsContact O-OG 3.13Å; S123-S127 WeakPolarHBondContact O-CB 3.35Å; S123-S127 PolarHBondContact O-N 2.75Å; S123-S127 PolarHBondContact O-OG 2.78Å
124	A	39.2	Very low	39.8	Very low	29 Å²	29	88.6 Å²	88.6	24%	0.24	51%	0.505	C	S	.	.	H	α-helix	trans	-65.8	-42.4	172.4	0	0	0	0	0	112.6	Q120 F121 S127 N128	Q120-A124 WeakPolarHBondContact O-CB 3.47Å; Q120-A124 PolarHBondContact O-N 2.81Å; F121-A124 PolarHBondContact O-N 2.99Å; A124-S127 PolarHBondContact O-OG 3.2Å; A124-N128 WeakPolarHBondContact O-CB 3.45Å; A124-N128 PolarHBondContact O-N 3.34Å; A124-N128 PolarHBondContact O-ND2 3.1Å
125	I	43.2	Very low	39.2	Very low	61 Å²	61	93.4 Å²	93.4	31%	0.313	53%	0.528	S	S	.	.	H	α-helix	trans	-68	-41.3	176.2	-69.3	170.3	0	0	0	110.9	F121 S127 V927	F121-I125 HydrophobicContact CD1-CD1 3.6Å; F121-I125 HydrophobicContact CE1-CD1 3.62Å; F121-I125 HydrophobicContact CG-CD1 4.43Å; F121-I125 HydrophobicContact CZ-CD1 4.45Å; F121-I125 WeakPolarHBondContact O-CG1 3.5Å; F121-I125 PolarHBondContact O-N 2.77Å; I125-S127 PolarHBondContact O-N 3.25Å; I125-V927 HydrophobicContact CD1-CG1 4.25Å
126	S	37.9	Very low	38.5	Very low	83 Å²	83	97.6 Å²	97.6	58%	0.58	55%	0.546	S	S	*	.	H	α-helix	trans	-67.8	-32.2	179.7	-57.5	0	0	0	0	113.2	Y122	Y122-S126 VanDerWaalsContact O-CB 3.23Å; Y122-S126 WeakPolarHBondContact O-CB 3.32Å; Y122-S126 PolarHBondContact O-N 3.48Å; Y122-S126 PolarHBondContact O-OG 3.18Å
127	S	37.3	Very low	37.8	Very low	76 Å²	76	100.5 Å²	100.5	53%	0.531	57%	0.567	S	S	.	*	H	α-helix	trans	-81.2	-28.1	179.3	49	0	0	0	0	113.7	S123 A124 I125 N129	S123-S127 WeakPolarHBondContact O-CB 3.35Å; S123-S127 PolarHBondContact O-N 2.75Å; S123-S127 PolarHBondContact O-OG 2.78Å; A124-S127 PolarHBondContact O-OG 3.2Å; I125-S127 PolarHBondContact O-N 3.25Å; S127-N129 VanDerWaalsContact C-N 3.34Å; S127-N129 PolarHBondContact O-N 3.14Å
128	N	36.4	Very low	36.7	Very low	116 Å²	116	102.4 Å²	102.4	62%	0.62	58%	0.583	S	S	*	*	H	α-helix	trans	-78.8	-11	179.8	-77.7	-54.9	0	0	0	114.7	A124 L130	A124-N128 WeakPolarHBondContact O-CB 3.45Å; A124-N128 PolarHBondContact O-N 3.34Å; A124-N128 PolarHBondContact O-ND2 3.1Å; N128-L130 VanDerWaalsContact C-N 3.28Å; N128-L130 PolarHBondContact O-N 3.07Å
129	N	32.9	Very low	35.7	Very low	139 Å²	139	104.6 Å²	104.6	74%	0.743	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	13	176.5	-88.6	-24.8	0	0	0	114.6	S127	S127-N129 VanDerWaalsContact C-N 3.34Å; S127-N129 PolarHBondContact O-N 3.14Å
130	L	27.8	Very low	34.5	Very low	153 Å²	153	106.6 Å²	106.6	80%	0.801	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.5	31.2	-171	-145.6	79.4	0	0	0	116.6	N128	N128-L130 VanDerWaalsContact C-N 3.28Å; N128-L130 PolarHBondContact O-N 3.07Å
131	T	27.5	Very low	33.5	Very low	109 Å²	109	106.9 Å²	106.9	67%	0.669	62%	0.617	S	S	*	*			trans	-140.2	148.9	170.7	58.7	0	0	0	0	114.8
132	T	27.7	Very low	32.5	Very low	129 Å²	129	112.6 Å²	112.6	79%	0.791	64%	0.644	S	S	*	*			trans	66.6	99.5	165.8	-37.1	0	0	0	0	115.6
133	V	30	Very low	31.2	Very low	138 Å²	138	115.5 Å²	115.5	84%	0.836	66%	0.661	S	S	*	*				-135.5	138.7	61.8	177.4	0	0	0	0	111.5
134	N	26.1	Very low	30.3	Very low	149 Å²	149	120 Å²	120	80%	0.797	67%	0.674	S	S	*	*			trans	-144.8	132.1	173.3	-168.5	2.3	0	0	0	109.9
135	N	30.2	Very low	29.6	Very low	131 Å²	131	125.1 Å²	125.1	70%	0.701	70%	0.697	S	S	*	*			trans	-163.4	111.3	170.5	-106.9	-39.7	0	0	0	112.6
136	N	26.1	Very low	28.7	Very low	140 Å²	140	128.7 Å²	128.7	75%	0.749	72%	0.721	S	S	*	*			trans	62	76.3	143.4	-51.4	-29.3	0	0	0	120.3
137	S	29.1	Very low	28.2	Very low	115 Å²	115	132.5 Å²	132.5	80%	0.804	73%	0.73	S	S	*	*				175.2	142.4	110.5	61.7	0	0	0	0	110.7
138	S	25.4	Very low	27.5	Very low	102 Å²	102	136.3 Å²	136.3	71%	0.713	74%	0.744	S	S	*	*			cis	177.8	148.7	-14.6	-94.9	0	0	0	0	105.6
139	T	27.1	Very low	27.1	Very low	118 Å²	118	139.8 Å²	139.8	72%	0.724	75%	0.75	S	S	*	*			trans	59.5	105.7	163.1	52.6	0	0	0	0	120.7
140	N	26.6	Very low	26.8	Very low	145 Å²	145	140 Å²	140	78%	0.775	75%	0.751	S	S	*	*				77.7	143.8	128.3	-57.4	-9.9	0	0	0	120.8
141	M	26.8	Very low	26.7	Very low	139 Å²	139	138.1 Å²	138.1	69%	0.685	75%	0.751	S	S	*	*			cis	-166.7	133.4	-15.7	-112.5	-67.5	-83.1	0	0	109.3
142	H	27.7	Very low	26.8	Very low	134 Å²	134	141.3 Å²	141.3	62%	0.62	76%	0.758	S	S	*	*			trans	54	134.3	160.3	-82.6	55.9	0	0	0	118.7
143	Q	24.1	Very low	26.7	Very low	151 Å²	151	140.5 Å²	140.5	71%	0.706	76%	0.756	S	S	*	*				49.7	134.2	79.6	-56.3	-175.4	6.7	0	0	113.3
144	H	26.7	Very low	26.5	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.755	75%	0.75	S	S	*	*			cis	-150.8	170.5	32.4	-157.6	-91	0	0	0	113.1
145	L	24	Very low	26.6	Very low	137 Å²	137	137.1 Å²	137.1	72%	0.717	75%	0.745	S	S	*	*			trans	-79.7	145.5	177.8	-63	74.7	0	0	0	112.4
146	T	24.5	Very low	26.4	Very low	135 Å²	135	138.3 Å²	138.3	83%	0.828	75%	0.747	S	S	*	*				165.3	163.5	110.1	39.3	0	0	0	0	114.3
147	H	27.9	Very low	26.4	Very low	164 Å²	164	139.6 Å²	139.6	76%	0.759	75%	0.749	S	S	*	*			trans	-54	155.5	-174.3	-58.9	-96	0	0	0	117.8
148	N	23.9	Very low	26.2	Very low	156 Å²	156	137.6 Å²	137.6	83%	0.834	74%	0.739	S	S	*	*				-158	174.6	108.4	-123.9	-46.9	0	0	0	116.6
149	Y	27.1	Very low	26.2	Very low	188 Å²	188	141.2 Å²	141.2	74%	0.737	74%	0.744	S	S	*	*			trans	-91.4	163.2	-163.4	-98.3	-95.5	0	0	0	117.5
150	N	26.5	Very low	26.2	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	75%	0.746	S	S	*	*			trans	68.4	144.7	151.2	-71.2	-24.3	0	0	0	118.4
151	S	26.4	Very low	26.2	Very low	115 Å²	115	140 Å²	140	80%	0.804	74%	0.741	S	S	*	*				-163.7	-177.3	51.4	44.6	0	0	0	0	114.9
152	H	29.8	Very low	26.2	Very low	176 Å²	176	137.2 Å²	137.2	82%	0.815	74%	0.74	S	S	*	*			trans	-53.8	162.1	-178.6	-60	-48.6	0	0	0	115.4
153	C	25.1	Very low	26.2	Very low	112 Å²	112	138.9 Å²	138.9	76%	0.757	75%	0.748	S	S	*	*				177.3	163.5	78.1	-100.3	0	0	0	0	110
154	T	26	Very low	26.3	Very low	114 Å²	114	137 Å²	137	70%	0.699	74%	0.743	S	S	*	*			cis	-172.8	178.6	-19.9	21.9	0	0	0	0	107.6
155	S	27.2	Very low	26.3	Very low	101 Å²	101	136.6 Å²	136.6	71%	0.706	74%	0.741	S	S	*	*			trans	81.5	145.6	155.5	84.1	0	0	0	0	117.1
156	Q	26.3	Very low	26.3	Very low	157 Å²	157	134.4 Å²	134.4	73%	0.734	74%	0.738	S	S	*	*			cis	-166.4	151	-15	-119.9	163.9	-19.6	0	0	109.6
157	Q	25.5	Very low	26.4	Very low	167 Å²	167	135.6 Å²	135.6	78%	0.78	74%	0.737	S	S	*	*			trans	46.3	144.1	140.8	-76.3	163.3	-37.1	0	0	121.2
158	A	25.9	Very low	26.2	Very low	72 Å²	72	132.2 Å²	132.2	60%	0.595	73%	0.732	S	S	*	*			cis	-156.5	175.2	-0.8	0	0	0	0	0	111.3
159	E	25.4	Very low	26.3	Very low	178 Å²	178	129.8 Å²	129.8	83%	0.832	73%	0.727	S	S	*	*			trans	9.7	143.1	137	-61.9	142	172.9	0	0	117.9
160	D	27.7	Very low	26.2	Very low	141 Å²	141	124.5 Å²	124.5	75%	0.754	72%	0.718	S	S	*	*				-164.5	154.5	50.6	-144.7	-13.7	0	0	0	117.2
161	S	25.8	Very low	26.2	Very low	96 Å²	96	128 Å²	128	67%	0.671	72%	0.722	S	S	*	*			trans	26.3	111.7	147.1	-65.4	0	0	0	0	125.1
162	A	26.9	Very low	26.2	Very low	82 Å²	82	133.8 Å²	133.8	68%	0.678	73%	0.726	S	S	*	*				76	157.5	106	0	0	0	0	0	124.2
163	H	28.4	Very low	26.1	Very low	168 Å²	168	132.3 Å²	132.3	78%	0.778	72%	0.724	S	S	*	*			trans	70.6	147.8	158	-69.4	-39.7	0	0	0	119.6
164	N	24.8	Very low	26.7	Very low	112 Å²	112	130.9 Å²	130.9	60%	0.599	71%	0.713	S	S	*	*			cis	-159.6	174.1	-25.8	-127.8	32.4	0	0	0	109.5
165	E	27.4	Very low	26.7	Very low	154 Å²	154	132.3 Å²	132.3	72%	0.72	72%	0.717	S	S	*	*			trans	54.1	112	154.1	-70.1	155.3	-121.7	0	0	118.5
166	S	24.7	Very low	26.8	Very low	92 Å²	92	134.5 Å²	134.5	64%	0.643	72%	0.72	S	S	*	*				74.5	155.6	60.9	89.5	0	0	0	0	115.1
167	I	25.8	Very low	27	Very low	160 Å²	160	133.1 Å²	133.1	82%	0.821	72%	0.722	S	S	*	*			trans	71.9	134.3	169.4	-67.1	164.9	0	0	0	114
168	S	24.7	Very low	27	Very low	92 Å²	92	128 Å²	128	64%	0.643	72%	0.715	S	S	*	*			cis	-173.5	140.6	-9.7	174.2	0	0	0	0	112
169	S	25.6	Very low	27.2	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	73%	0.733	S	S	*	*			trans	65.2	-179.2	149.6	88.1	0	0	0	0	117.2
170	S	25	Very low	27.2	Very low	77 Å²	77	132.5 Å²	132.5	54%	0.538	73%	0.725	S	S	.	*			cis	-169.1	158.9	-42.3	52.3	0	0	0	0	110.2
171	Y	25	Very low	27.3	Very low	217 Å²	217	134.8 Å²	134.8	85%	0.851	73%	0.731	S	S	*	*			trans	65.1	164.4	175.8	-53	-73.9	0	0	0	114.1
172	R	27.4	Very low	27.3	Very low	236 Å²	236	137.1 Å²	137.1	89%	0.891	74%	0.735	S	S	*	*			cis	-148.3	145.3	14.6	-148.4	-177.7	-134.6	168.8	3.1	112.1
173	N	28.5	Very low	27.4	Very low	145 Å²	145	139.6 Å²	139.6	78%	0.775	74%	0.741	S	S	*	*			trans	-82.8	-167	161.9	-139.1	-2.8	0	0	0	108.2
174	P	36.6	Very low	27.3	Very low	82 Å²	82	142.3 Å²	142.3	53%	0.532	75%	0.745	S	S	.	*			cis	-141.5	-168.3	-14.1	42.5	-23.3	0	0	0	115.4
175	N	26.7	Very low	27.6	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	75%	0.754	S	S	*	*			trans	68.7	156	154.7	-58.9	-17.7	0	0	0	117.5
176	L	29.8	Very low	27.6	Very low	147 Å²	147	141.8 Å²	141.8	77%	0.77	76%	0.757	S	S	*	*			cis	-150.8	164.2	36	-111.1	99.8	0	0	0	113.9
177	T	28.5	Very low	27.7	Very low	128 Å²	128	146.9 Å²	146.9	79%	0.785	76%	0.763	S	S	*	*			trans	11.1	142.7	151.4	58.6	0	0	0	0	121.3
178	G	25.9	Very low	27.9	Very low	61 Å²	61	145.2 Å²	145.2	63%	0.629	76%	0.763	S	S	*	*			cis	115.5	137.8	10.6	0	0	0	0	0	113
179	Y	31.3	Very low	28	Very low	247 Å²	247	147.1 Å²	147.1	97%	0.969	77%	0.765	S	S	*	*			trans	-165.5	168	166	-104.3	-67.5	0	0	0	112
180	S	25.2	Very low	28.1	Very low	97 Å²	97	149.9 Å²	149.9	68%	0.678	77%	0.768	S	S	*	*			trans	-157.2	136.5	-168.4	59.9	0	0	0	0	115.2
181	E	29.9	Very low	28.3	Very low	189 Å²	189	151 Å²	151	88%	0.883	78%	0.776	S	S	*	*			trans	-160.7	135.3	162	-104.8	162.2	-173.6	0	0	106.8
182	I	24.9	Very low	28.4	Very low	145 Å²	145	146.7 Å²	146.7	74%	0.744	77%	0.772	S	S	*	*			cis	85.4	81.1	27.2	-49.8	176.8	0	0	0	114.9
183	T	30	Very low	28.4	Very low	133 Å²	133	143.5 Å²	143.5	82%	0.816	77%	0.767	S	S	*	*				-174.2	135.6	129.7	21.5	0	0	0	0	107.5
184	R	25.2	Very low	28.4	Very low	226 Å²	226	143.2 Å²	143.2	85%	0.853	77%	0.765	S	S	*	*			cis	103.8	143.6	31.3	-165.5	-176	-134.2	-141.2	6.6	110.9
185	T	30.6	Very low	28	Very low	129 Å²	129	147 Å²	147	79%	0.791	77%	0.774	S	S	*	*			trans	90.9	142.7	178.4	71	0	0	0	0	116.8
186	T	29.4	Very low	28.1	Very low	126 Å²	126	144.4 Å²	144.4	77%	0.773	76%	0.759	S	S	*	*			cis	-154.1	147.9	-33.4	-60.1	0	0	0	0	108.1
187	Y	24.9	Very low	28.1	Very low	198 Å²	198	140.7 Å²	140.7	78%	0.776	74%	0.738	S	S	*	*			trans	-70.7	168.9	170.6	-72.5	-88.7	0	0	0	112.7
188	P	31.5	Very low	28.1	Very low	126 Å²	126	138.9 Å²	138.9	82%	0.818	72%	0.721	S	S	*	*				-137.1	146.5	99.4	36.2	-25.5	0	0	0	114.6
189	L	25.9	Very low	28.2	Very low	132 Å²	132	142 Å²	142	69%	0.691	71%	0.713	S	S	*	*			trans	-85.2	154.9	158.6	-57.4	100.4	0	0	0	109.4
190	M	27.7	Very low	28.1	Very low	164 Å²	164	135.6 Å²	135.6	81%	0.808	69%	0.692	S	S	*	*				172.9	165.7	114.7	-96.9	-64.7	150.9	0	0	114.9
191	S	28.9	Very low	28.2	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	69%	0.688	S	S	*	*			trans	68	92.5	155.7	-61.5	0	0	0	0	120
192	T	27.6	Very low	28.2	Very low	125 Å²	125	131.8 Å²	131.8	77%	0.767	68%	0.683	S	S	*	*			trans	-8.2	157.2	131.5	50.6	0	0	0	0	120.6
193	H	27.7	Very low	28.5	Very low	169 Å²	169	132.6 Å²	132.6	78%	0.782	69%	0.688	S	S	*	*			trans	105.5	126.5	156.2	-90	-89.3	0	0	0	120.5
194	L	27.7	Very low	28.3	Very low	139 Å²	139	135.1 Å²	135.1	73%	0.728	69%	0.688	S	S	*	*			trans	73.1	113.5	147.3	-73.6	160.5	0	0	0	121.3
195	F	28.5	Very low	28.6	Very low	163 Å²	163	130.4 Å²	130.4	72%	0.715	69%	0.687	S	S	*	*			trans	66.3	119.2	131.6	-103	-120.6	0	0	0	121.3
196	N	28.2	Very low	28.4	Very low	87 Å²	87	130.6 Å²	130.6	47%	0.465	69%	0.688	S	S	.	*			trans	57	108.5	133.3	-98.5	-13.1	0	0	0	120	T399	N196-T399 PolarHBondContact ND2-OG1 3.33Å; N196-T399 VanDerWaalsContact ND2-OG1 3.16Å
197	Q	30	Very low	28.4	Very low	69 Å²	69	130.4 Å²	130.4	32%	0.322	69%	0.692	S	S	.	*				96.6	151.2	113	-92.6	177.1	53.1	0	0	123.4	T397 T398 T399	Q197-T397 HydrophobicContact CG-CG2 4.21Å; Q197-T397 VanDerWaalsContact OE1-CB 3.3Å; Q197-T398 PolarHBondContact OE1-OG1 3.39Å; Q197-T399 VanDerWaalsContact NE2-CG2 3.28Å; Q197-T399 PolarHBondContact NE2-OG1 3.29Å
198	Q	29.3	Very low	28.4	Very low	90 Å²	90	125.3 Å²	125.3	42%	0.421	69%	0.685	S	S	.	*			trans	66	99.5	159.8	-66.9	175.8	53.1	0	0	114.7	T396 T397 T398	Q198-T396 VanDerWaalsContact OE1-CG2 3.32Å; Q198-T397 WeakPolarHBondContact CG-OG1 3.05Å; Q198-T398 PolarHBondContact NE2-OG1 2.93Å
199	R	28.4	Very low	28.4	Very low	126 Å²	126	130.2 Å²	130.2	48%	0.475	69%	0.689	S	S	.	*				89.9	150.8	68	-84	179.5	-163.8	-145	18.7	110.7	T395 T396 T397	R199-T395 WeakPolarHBondContact CD-O 3.3Å; R199-T395 WeakPolarHBondContact CD-OG1 3.41Å; R199-T395 HydrophobicContact CG-CG2 4.37Å; R199-T396 PolarHBondContact NH1-O 2.88Å; R199-T396 PolarHBondContact NH2-O 2.98Å; R199-T397 VanDerWaalsContact CZ-OG1 3.25Å; R199-T397 PolarHBondContact NE-OG1 3.25Å; R199-T397 PolarHBondContact NH2-OG1 3.06Å
200	Q	29.2	Very low	28.5	Very low	113 Å²	113	127.4 Å²	127.4	53%	0.528	69%	0.692	S	S	.	*			trans	72	143.3	173.3	-61.6	179.2	42.1	0	0	115.3	T395	Q200-T395 VanDerWaalsContact CG-OG1 3.27Å; Q200-T395 WeakPolarHBondContact CG-OG1 3.19Å; Q200-T395 PolarHBondContact NE2-O 2.92Å
201	T	27.9	Very low	28.4	Very low	95 Å²	95	126.3 Å²	126.3	58%	0.583	69%	0.694	S	S	*	*			cis	-173.3	-179	-37.5	13.5	0	0	0	0	106.4
202	S	29.1	Very low	28.6	Very low	112 Å²	112	129.5 Å²	129.5	78%	0.783	70%	0.704	S	S	*	*			trans	75.1	144.7	171.4	82.5	0	0	0	0	115.4
203	L	30	Very low	28.5	Very low	161 Å²	161	131 Å²	131	84%	0.843	71%	0.707	S	S	*	*			cis	-153.5	147	-10.6	-120.4	167.4	0	0	0	108.7
204	F	26.6	Very low	28.7	Very low	186 Å²	186	132.1 Å²	132.1	82%	0.816	71%	0.709	S	S	*	*			trans	-71.4	159.2	165.7	-77.1	-88.3	0	0	0	110.5
205	P	31.3	Very low	28.7	Very low	127 Å²	127	132 Å²	132	83%	0.825	71%	0.709	S	S	*	*				-131.6	148.5	114.1	36.9	-30.4	0	0	0	114
206	T	25.8	Very low	28.8	Very low	133 Å²	133	133.4 Å²	133.4	82%	0.816	72%	0.718	S	S	*	*			trans	-88.2	143.5	170	50.4	0	0	0	0	111.5
207	S	30.2	Very low	28.6	Very low	122 Å²	122	135.6 Å²	135.6	85%	0.853	73%	0.729	S	S	*	*			trans	-146.2	137.3	155.9	57.7	0	0	0	0	110.8
208	S	25.1	Very low	28.6	Very low	91 Å²	91	141.2 Å²	141.2	64%	0.636	76%	0.756	S	S	*	*			trans	-92.9	-159.4	178.9	54.2	0	0	0	0	111.6
209	Y	30.4	Very low	28.7	Very low	230 Å²	230	142 Å²	142	90%	0.902	77%	0.771	S	S	*	*			trans	73.8	138.1	-174	-48.7	-80	0	0	0	114.1
210	G	29.2	Very low	28.8	Very low	73 Å²	73	143.4 Å²	143.4	75%	0.753	79%	0.787	S	S	*	*			cis	-162.4	162	-4.2	0	0	0	0	0	111.6
211	T	26.3	Very low	29	Very low	140 Å²	140	142.7 Å²	142.7	86%	0.859	79%	0.792	S	S	*	*			trans	-79.2	134.4	178.1	48.2	0	0	0	0	111.7
212	D	31.4	Very low	29.3	Very low	169 Å²	169	144.9 Å²	144.9	90%	0.904	80%	0.8	S	S	*	*			trans	-133.8	135.1	158.4	-110.3	-44.6	0	0	0	109.4
213	N	26.4	Very low	29.6	Very low	157 Å²	157	149.7 Å²	149.7	84%	0.84	80%	0.801	S	S	*	*			trans	-145.6	107.3	-168.5	-138.7	-2.3	0	0	0	110.5
214	K	30.9	Very low	30.1	Very low	191 Å²	191	148.1 Å²	148.1	83%	0.83	79%	0.792	S	S	*	*			trans	-152.6	109.7	167.1	-103	172.4	176.5	175.9	0	107.5
215	L	28.5	Very low	30.7	Very low	137 Å²	137	144.4 Å²	144.4	72%	0.717	78%	0.78	S	S	*	*				64.8	101.3	86.4	-81	160.8	0	0	0	113.2
216	E	30	Very low	31.3	Very low	193 Å²	193	143.3 Å²	143.3	90%	0.902	77%	0.767	S	S	*	*				-152	164.7	100.5	-118.5	-177.5	148.5	0	0	111.9
217	N	25	Very low	32.1	Very low	132 Å²	132	141.9 Å²	141.9	71%	0.706	76%	0.755	S	S	*	*			trans	-102.8	148.6	-170.8	-63	-69.7	0	0	0	112.6
218	Q	29.8	Very low	32.9	Very low	188 Å²	188	141.2 Å²	141.2	88%	0.879	74%	0.738	S	S	*	*			trans	-160.6	136.8	139	-118.5	151.3	90.4	0	0	116.4
219	S	32	Very low	33.9	Very low	107 Å²	107	141.9 Å²	141.9	75%	0.748	73%	0.731	S	S	*	*			trans	52.5	107.8	155.4	55.7	0	0	0	0	121.6
220	I	29.6	Very low	34.9	Very low	155 Å²	155	135.1 Å²	135.1	80%	0.795	71%	0.71	S	S	*	*			trans	-79.2	144.9	155.4	-64.5	154.8	0	0	0	109.4
221	P	33.5	Very low	35.9	Very low	98 Å²	98	134.1 Å²	134.1	64%	0.636	69%	0.692	S	S	*	*			trans	-149	23	132.2	37.4	-18.9	0	0	0	118.9
222	D	35.1	Very low	37.1	Very low	141 Å²	141	133 Å²	133	75%	0.754	68%	0.675	S	S	*	*	S	Bend	trans	-82.6	-23.5	-178.6	-80.5	-52.5	0	0	0	116.2	L224	D222-L224 PolarHBondContact O-N 2.97Å
223	R	35.5	Very low	38.5	Very low	212 Å²	212	129.6 Å²	129.6	80%	0.8	66%	0.656	S	S	*	*	H	α-helix	trans	-74.8	-21.8	-174.1	-119.1	-175.8	-177.1	-148.6	-1.6	115.1
224	L	39.1	Very low	40.4	Very low	128 Å²	128	127.2 Å²	127.2	67%	0.67	64%	0.642	S	S	*	*	H	α-helix	trans	-79.6	-16.7	-177.5	-82.8	162.6	0	0	0	114	D222 Q228	D222-L224 PolarHBondContact O-N 2.97Å; L224-Q228 WeakPolarHBondContact O-CG 3.23Å
225	L	40.2	Very low	41.7	Very low	108 Å²	108	121.8 Å²	121.8	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-77.8	-37.6	178.8	-168.2	68	0	0	0	111.7	Q228 Q229	L225-Q228 PolarHBondContact O-N 3.31Å; L225-Q229 WeakPolarHBondContact O-CG 3.13Å; L225-Q229 PolarHBondContact O-N 3.45Å; L225-Q229 VanDerWaalsContact O-N 3.07Å
226	L	42.6	Very low	43.4	Very low	105 Å²	105	122 Å²	122	55%	0.55	62%	0.617	S	S	.	*	H	α-helix	trans	-70.3	-43.4	-175.5	-159.8	70.5	0	0	0	111.8	Q228 Q229 L230	L226-Q228 VanDerWaalsContact C-N 3.3Å; L226-Q228 PolarHBondContact O-N 3.39Å; L226-Q229 PolarHBondContact O-N 2.99Å; L226-L230 WeakPolarHBondContact O-CG 3.32Å; L226-L230 PolarHBondContact O-N 3.25Å
227	D	42.8	Very low	45.1	Very low	103 Å²	103	119 Å²	119	55%	0.551	60%	0.603	S	S	*	*	H	α-helix	trans	-63.1	-36.8	176	-66.3	-21.3	0	0	0	111.7	Q229 L230 S231	D227-Q229 VanDerWaalsContact C-N 3.3Å; D227-Q229 PolarHBondContact O-N 2.98Å; D227-L230 PolarHBondContact O-N 3.44Å; D227-S231 PolarHBondContact O-N 3.48Å
228	Q	47.6	Very low	47	Very low	107 Å²	107	118.1 Å²	118.1	50%	0.5	59%	0.594	S	S	.	*	H	α-helix	trans	-73.3	-16	172.8	-75	-164.6	18.7	0	0	114.5	L224 L225 L226 K232	L224-Q228 WeakPolarHBondContact O-CG 3.23Å; L225-Q228 PolarHBondContact O-N 3.31Å; L226-Q228 VanDerWaalsContact C-N 3.3Å; L226-Q228 PolarHBondContact O-N 3.39Å; Q228-K232 WeakPolarHBondContact O-CD 3.22Å; Q228-K232 WeakPolarHBondContact O-CE 3.01Å; Q228-K232 VanDerWaalsContact O-CG 3.31Å; Q228-K232 WeakPolarHBondContact O-CG 3.47Å
229	Q	47.2	Very low	48.2	Very low	105 Å²	105	114.7 Å²	114.7	49%	0.491	58%	0.579	S	S	.	*	H	α-helix	trans	-86.1	-37.7	170.4	-76.5	-179.5	-40.4	0	0	110.8	L225 L226 D227 K232 I233	L225-Q229 WeakPolarHBondContact O-CG 3.13Å; L225-Q229 PolarHBondContact O-N 3.45Å; L225-Q229 VanDerWaalsContact O-N 3.07Å; L226-Q229 PolarHBondContact O-N 2.99Å; D227-Q229 VanDerWaalsContact C-N 3.3Å; D227-Q229 PolarHBondContact O-N 2.98Å; Q229-K232 PolarHBondContact O-N 3.02Å; Q229-I233 WeakPolarHBondContact O-CG1 3.45Å; Q229-I233 PolarHBondContact O-N 3.45Å
230	L	50.2	Low	49.7	Very low	89 Å²	89	114.5 Å²	114.5	47%	0.466	57%	0.568	S	S	.	*	H	α-helix	trans	-63.9	-44.9	175.4	-73.6	165.7	0	0	0	112.1	L226 D227 K232 I233 I234	L226-L230 WeakPolarHBondContact O-CG 3.32Å; L226-L230 PolarHBondContact O-N 3.25Å; D227-L230 PolarHBondContact O-N 3.44Å; L230-K232 VanDerWaalsContact C-N 3.32Å; L230-K232 PolarHBondContact O-N 3.04Å; L230-I233 PolarHBondContact O-N 3.25Å; L230-I233 VanDerWaalsContact O-N 3.12Å; L230-I234 WeakPolarHBondContact O-CG1 3.42Å; L230-I234 PolarHBondContact O-N 3.33Å; L230-I234 VanDerWaalsContact O-N 3.12Å
231	S	50	Low	51.1	Low	52 Å²	52	112.3 Å²	112.3	36%	0.364	56%	0.557	S	S	.	*	H	α-helix	trans	-58.4	-44.8	176.3	91.8	0	0	0	0	111.5	D227 I233 I234 D235	D227-S231 PolarHBondContact O-N 3.48Å; S231-I233 PolarHBondContact O-N 3.14Å; S231-I233 VanDerWaalsContact O-N 3.14Å; S231-I234 PolarHBondContact O-N 3.38Å; S231-I234 VanDerWaalsContact O-N 3.08Å; S231-D235 WeakPolarHBondContact O-CB 3.42Å; S231-D235 PolarHBondContact O-N 3.03Å; S231-D235 VanDerWaalsContact O-OD2 3.11Å
232	K	52	Low	52.1	Low	117 Å²	117	111.9 Å²	111.9	51%	0.509	55%	0.547	S	S	.	.	H	α-helix	trans	-69.7	-8.6	-179.7	-68	172.9	-168	150.2	0	114.5	Q228 Q229 L230	Q228-K232 WeakPolarHBondContact O-CD 3.22Å; Q228-K232 WeakPolarHBondContact O-CE 3.01Å; Q228-K232 VanDerWaalsContact O-CG 3.31Å; Q228-K232 WeakPolarHBondContact O-CG 3.47Å; Q229-K232 PolarHBondContact O-N 3.02Å; L230-K232 VanDerWaalsContact C-N 3.32Å; L230-K232 PolarHBondContact O-N 3.04Å
233	I	60.9	Low	52.9	Low	97 Å²	97	111.8 Å²	111.8	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-89.7	-46.2	169.2	-69.1	164.7	0	0	0	109.1	Q229 L230 S231 K236 E237	Q229-I233 WeakPolarHBondContact O-CG1 3.45Å; Q229-I233 PolarHBondContact O-N 3.45Å; L230-I233 PolarHBondContact O-N 3.25Å; L230-I233 VanDerWaalsContact O-N 3.12Å; S231-I233 PolarHBondContact O-N 3.14Å; S231-I233 VanDerWaalsContact O-N 3.14Å; I233-K236 WeakPolarHBondContact O-CA 3.34Å; I233-K236 VanDerWaalsContact O-CB 3.24Å; I233-K236 WeakPolarHBondContact O-CB 3.17Å; I233-K236 PolarHBondContact O-N 3.39Å; I233-E237 PolarHBondContact O-N 3.12Å
234	I	66.6	Low	53.4	Low	106 Å²	106	107.7 Å²	107.7	54%	0.544	53%	0.532	S	S	.	.	H	α-helix	trans	-59.7	-49.4	176.3	-63.6	164	0	0	0	110.9	L230 S231 K236 E237 E238	L230-I234 WeakPolarHBondContact O-CG1 3.42Å; L230-I234 PolarHBondContact O-N 3.33Å; L230-I234 VanDerWaalsContact O-N 3.12Å; S231-I234 PolarHBondContact O-N 3.38Å; S231-I234 VanDerWaalsContact O-N 3.08Å; I234-K236 PolarHBondContact O-N 3.14Å; I234-E237 PolarHBondContact O-N 3.1Å; I234-E238 PolarHBondContact O-N 3.09Å
235	D	58.3	Low	53.8	Low	77 Å²	77	107.2 Å²	107.2	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-53.1	-26.9	174.4	-63.8	-34	0	0	0	112.4	S231 Q239	S231-D235 WeakPolarHBondContact O-CB 3.42Å; S231-D235 PolarHBondContact O-N 3.03Å; S231-D235 VanDerWaalsContact O-OD2 3.11Å; D235-Q239 WeakPolarHBondContact O-CB 3.42Å; D235-Q239 VanDerWaalsContact O-CG 3.23Å; D235-Q239 WeakPolarHBondContact O-CG 3.49Å; D235-Q239 PolarHBondContact O-N 3.09Å
236	K	63.6	Low	53.8	Low	143 Å²	143	110.9 Å²	110.9	62%	0.622	53%	0.533	S	S	*	.	H	α-helix	trans	-87.5	-40.5	-177	-119.3	177.8	-178	176.2	0	112.7	I233 I234 E238 I240	I233-K236 WeakPolarHBondContact O-CA 3.34Å; I233-K236 VanDerWaalsContact O-CB 3.24Å; I233-K236 WeakPolarHBondContact O-CB 3.17Å; I233-K236 PolarHBondContact O-N 3.39Å; I234-K236 PolarHBondContact O-N 3.14Å; K236-E238 VanDerWaalsContact C-N 3.35Å; K236-I240 WeakPolarHBondContact O-CD1 3.37Å; K236-I240 VanDerWaalsContact O-CG1 3.27Å; K236-I240 WeakPolarHBondContact O-CG1 3.23Å; K236-I240 PolarHBondContact O-N 3.21Å; K236-I240 VanDerWaalsContact O-N 3.11Å
237	E	64.8	Low	53.8	Low	128 Å²	128	109.2 Å²	109.2	60%	0.598	53%	0.534	S	S	*	.	H	α-helix	trans	-66.4	-40.4	172.9	-68.7	-167.3	112.2	0	0	110.7	I233 I234 Q239 I240 L241	I233-E237 PolarHBondContact O-N 3.12Å; I234-E237 PolarHBondContact O-N 3.1Å; E237-Q239 PolarHBondContact O-N 2.82Å; E237-I240 PolarHBondContact O-N 3.24Å; E237-L241 WeakPolarHBondContact O-CG 3.25Å; E237-L241 PolarHBondContact O-N 3.26Å
238	E	65.7	Low	53.6	Low	114 Å²	114	110.2 Å²	110.2	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-65.1	-39.5	177.5	-161	173	-134.4	0	0	112.2	I234 K236 I240 L241 Q242	I234-E238 PolarHBondContact O-N 3.09Å; K236-E238 VanDerWaalsContact C-N 3.35Å; E238-I240 PolarHBondContact O-N 3.34Å; E238-L241 PolarHBondContact O-N 3.34Å; E238-Q242 WeakPolarHBondContact O-CG 3.44Å; E238-Q242 PolarHBondContact O-N 2.87Å
239	Q	56	Low	52.9	Low	117 Å²	117	112 Å²	112	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-65.5	-35.1	172	-78.5	177.6	36.3	0	0	113.5	D235 E237 Q243	D235-Q239 WeakPolarHBondContact O-CB 3.42Å; D235-Q239 VanDerWaalsContact O-CG 3.23Å; D235-Q239 WeakPolarHBondContact O-CG 3.49Å; D235-Q239 PolarHBondContact O-N 3.09Å; E237-Q239 PolarHBondContact O-N 2.82Å; Q239-Q243 WeakPolarHBondContact O-CG 3.47Å; Q239-Q243 PolarHBondContact O-N 2.89Å
240	I	62	Low	52.2	Low	102 Å²	102	111.1 Å²	111.1	52%	0.523	56%	0.558	S	S	.	*	H	α-helix	trans	-68.2	-43.8	176.2	-72.1	165.9	0	0	0	110.2	K236 E237 E238 Q243 Q244	K236-I240 WeakPolarHBondContact O-CD1 3.37Å; K236-I240 VanDerWaalsContact O-CG1 3.27Å; K236-I240 WeakPolarHBondContact O-CG1 3.23Å; K236-I240 PolarHBondContact O-N 3.21Å; K236-I240 VanDerWaalsContact O-N 3.11Å; E237-I240 PolarHBondContact O-N 3.24Å; E238-I240 PolarHBondContact O-N 3.34Å; I240-Q243 PolarHBondContact O-N 3.35Å; I240-Q244 WeakPolarHBondContact O-CB 3.46Å; I240-Q244 PolarHBondContact O-N 3.08Å
241	L	58.7	Low	51.4	Low	110 Å²	110	114.7 Å²	114.7	58%	0.576	58%	0.577	S	S	*	*	H	α-helix	trans	-59.3	-48.4	174.1	-72.7	164.2	0	0	0	111.3	E237 E238 Q243 Q244 E245	E237-L241 WeakPolarHBondContact O-CG 3.25Å; E237-L241 PolarHBondContact O-N 3.26Å; E238-L241 PolarHBondContact O-N 3.34Å; L241-Q243 VanDerWaalsContact C-N 3.31Å; L241-Q243 PolarHBondContact O-N 3.39Å; L241-Q244 CarbonylContact O-C 3.59Å; L241-Q244 PolarHBondContact O-N 3.5Å; L241-E245 PolarHBondContact O-N 3.47Å
242	Q	54.3	Low	50.4	Low	88 Å²	88	120.8 Å²	120.8	41%	0.411	60%	0.599	S	S	.	*	H	α-helix	trans	-64.1	-29.4	177.5	-72.5	-175.7	29.3	0	0	114.2	E238 R246	E238-Q242 WeakPolarHBondContact O-CG 3.44Å; E238-Q242 PolarHBondContact O-N 2.87Å; Q242-R246 WeakPolarHBondContact O-CB 3.07Å; Q242-R246 WeakPolarHBondContact O-CG 3.42Å; Q242-R246 PolarHBondContact O-N 2.9Å
243	Q	51.9	Low	49.4	Very low	139 Å²	139	122.2 Å²	122.2	65%	0.65	61%	0.611	S	S	*	*	H	α-helix	trans	-72.4	-36.6	170.8	-76.1	-175.1	14.7	0	0	111.7	Q239 I240 L241 R246 A247	Q239-Q243 WeakPolarHBondContact O-CG 3.47Å; Q239-Q243 PolarHBondContact O-N 2.89Å; I240-Q243 PolarHBondContact O-N 3.35Å; L241-Q243 VanDerWaalsContact C-N 3.31Å; L241-Q243 PolarHBondContact O-N 3.39Å; Q243-R246 PolarHBondContact O-N 2.73Å; Q243-A247 PolarHBondContact O-N 3.01Å; Q243-A247 VanDerWaalsContact O-N 3.16Å
244	Q	47.4	Very low	48.1	Very low	127 Å²	127	123.8 Å²	123.8	59%	0.593	62%	0.621	S	S	*	*	H	α-helix	trans	-76.7	-24.9	-178.3	-159.4	156.3	-15.5	0	0	112.8	I240 L241 N248	I240-Q244 WeakPolarHBondContact O-CB 3.46Å; I240-Q244 PolarHBondContact O-N 3.08Å; L241-Q244 CarbonylContact O-C 3.59Å; L241-Q244 PolarHBondContact O-N 3.5Å; Q244-N248 PolarHBondContact O-ND2 3.18Å
245	E	46.3	Very low	46.3	Very low	117 Å²	117	127.1 Å²	127.1	55%	0.547	63%	0.631	S	S	.	*	H	α-helix	trans	-78.6	-37	167.6	-67.5	-167.1	135.8	0	0	113	L241 A247 N248 N249	L241-E245 PolarHBondContact O-N 3.47Å; E245-A247 PolarHBondContact O-N 2.7Å; E245-N248 PolarHBondContact O-N 2.94Å; E245-N249 PolarHBondContact O-ND2 3.11Å
246	R	41.6	Very low	44.7	Very low	186 Å²	186	131 Å²	131	70%	0.702	65%	0.645	S	S	*	*	H	α-helix	trans	-63.1	-24.3	172.6	-81.9	-176.4	173.2	102.1	-4	113.4	Q242 Q243	Q242-R246 WeakPolarHBondContact O-CB 3.07Å; Q242-R246 WeakPolarHBondContact O-CG 3.42Å; Q242-R246 PolarHBondContact O-N 2.9Å; Q243-R246 PolarHBondContact O-N 2.73Å
247	A	41.2	Very low	43.1	Very low	70 Å²	70	131.2 Å²	131.2	58%	0.579	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-11.1	179.1	0	0	0	0	0	115	Q243 E245	Q243-A247 PolarHBondContact O-N 3.01Å; Q243-A247 VanDerWaalsContact O-N 3.16Å; E245-A247 PolarHBondContact O-N 2.7Å
248	N	38.2	Very low	41.3	Very low	124 Å²	124	130.6 Å²	130.6	66%	0.663	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	6.2	-173.1	-70.2	-34	0	0	0	114.2	Q244 E245	Q244-N248 PolarHBondContact O-ND2 3.18Å; E245-N248 PolarHBondContact O-N 2.94Å
249	N	32.8	Very low	39.4	Very low	144 Å²	144	136 Å²	136	77%	0.77	67%	0.674	S	S	*	*	S	Bend	trans	-120	33.1	-171	-81.4	-48.3	0	0	0	113.8	E245	E245-N249 PolarHBondContact O-ND2 3.11Å
250	S	32.6	Very low	38.1	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	69%	0.686	S	S	*	*			trans	-135.8	145.5	173.1	57.2	0	0	0	0	112.1
251	D	34.3	Very low	36.6	Very low	163 Å²	163	140.3 Å²	140.3	87%	0.872	70%	0.7	S	S	*	*			trans	73.1	72.3	165.6	-53.6	-14.9	0	0	0	118
252	H	28.4	Very low	35.4	Very low	180 Å²	180	140.3 Å²	140.3	83%	0.833	71%	0.707	S	S	*	*			trans	-142.1	109.4	148.5	-174.1	-62.2	0	0	0	110.7
253	I	31.4	Very low	34.2	Very low	147 Å²	147	140.6 Å²	140.6	75%	0.754	72%	0.719	S	S	*	*			trans	-168.1	141.5	161.8	-111	156.6	0	0	0	111.1
254	D	33.9	Very low	33.1	Very low	131 Å²	131	142.4 Å²	142.4	70%	0.701	72%	0.724	S	S	*	*			trans	60	150.8	159.8	-67.5	1.2	0	0	0	123.8
255	F	28.1	Very low	32.3	Very low	175 Å²	175	142.6 Å²	142.6	77%	0.768	73%	0.729	S	S	*	*			cis	-162.8	170.6	-41.6	-139.9	-109.8	0	0	0	109.1
256	F	25.9	Very low	31.5	Very low	158 Å²	158	143.5 Å²	143.5	69%	0.693	74%	0.738	S	S	*	*			trans	-39.8	136.7	178.2	-69.2	-121.7	0	0	0	115
257	N	28.7	Very low	30.9	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	73%	0.732	S	S	*	*				-178.9	166.6	86.9	-99.9	-64.9	0	0	0	115.8
258	T	28.1	Very low	30.2	Very low	115 Å²	115	141.6 Å²	141.6	71%	0.706	74%	0.735	S	S	*	*			trans	-74.2	143.9	176.1	57.3	0	0	0	0	114.8
259	R	25.5	Very low	29.9	Very low	227 Å²	227	142.6 Å²	142.6	86%	0.857	74%	0.735	S	S	*	*				168.3	141.9	113.1	-95.5	-175.1	-178	-158.3	-0.1	116.3
260	V	29	Very low	29.6	Very low	132 Å²	132	142.7 Å²	142.7	80%	0.8	74%	0.735	S	S	*	*			trans	74.3	121.7	136.8	172.3	0	0	0	0	120.8
261	Q	30	Very low	29.3	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	74%	0.736	S	S	*	*			trans	-67	172.1	162.5	-84.7	-170.3	6.6	0	0	112.7
262	P	32.7	Very low	29	Very low	111 Å²	111	140.8 Å²	140.8	72%	0.721	73%	0.729	S	S	*	*			cis	-147.3	-178.6	29.5	42.8	-21.5	0	0	0	118.9
263	S	29.5	Very low	28.9	Very low	94 Å²	94	138 Å²	138	66%	0.657	72%	0.72	S	S	*	*			trans	-43.7	156	165.4	59.6	0	0	0	0	117.2
264	K	30	Very low	28.8	Very low	176 Å²	176	136.5 Å²	136.5	77%	0.765	71%	0.714	S	S	*	*				176.8	154.7	111.3	-103.1	171.3	-174.5	175.2	0	116.2
265	N	29.9	Very low	28.6	Very low	131 Å²	131	136.6 Å²	136.6	70%	0.701	71%	0.71	S	S	*	*			trans	71.7	150.6	145.3	-65.6	3.3	0	0	0	119.3
266	L	29.6	Very low	28.7	Very low	137 Å²	137	136.9 Å²	136.9	72%	0.717	71%	0.711	S	S	*	*			cis	-157.3	144.7	-11.2	-142.2	78.4	0	0	0	113
267	V	29	Very low	29	Very low	98 Å²	98	133.3 Å²	133.3	59%	0.594	71%	0.711	S	S	*	*			trans	59.4	110.3	133	157.6	0	0	0	0	123.8
268	N	27.6	Very low	29.5	Very low	118 Å²	118	131.3 Å²	131.3	63%	0.631	71%	0.706	S	S	*	*				62.8	153.9	121.3	-49.1	-0.1	0	0	0	126.5
269	H	30.7	Very low	29.5	Very low	144 Å²	144	137.1 Å²	137.1	67%	0.667	72%	0.715	S	S	*	*			trans	96.8	118.7	137.6	-72.5	-49.9	0	0	0	120
270	L	26.2	Very low	30	Very low	147 Å²	147	131.6 Å²	131.6	77%	0.77	71%	0.712	S	S	*	*				58.4	140	125	-61.1	171.6	0	0	0	118.7
271	S	25.9	Very low	30.2	Very low	90 Å²	90	129.6 Å²	129.6	63%	0.629	70%	0.703	S	S	*	*			cis	-174.2	173.8	-8.8	-130.5	0	0	0	0	109.7
272	V	28.3	Very low	30.4	Very low	119 Å²	119	128.9 Å²	128.9	72%	0.721	70%	0.704	S	S	*	*			trans	68.5	112.8	141.7	165.1	0	0	0	0	119.4
273	D	27.6	Very low	30.4	Very low	122 Å²	122	127.8 Å²	127.8	65%	0.652	70%	0.699	S	S	*	*			trans	86.3	139.3	133.4	-83.8	28.7	0	0	0	125.8
274	N	29	Very low	30.5	Very low	116 Å²	116	127.9 Å²	127.9	62%	0.62	70%	0.7	S	S	*	*			trans	73	149.9	137.1	-66.2	-20.2	0	0	0	120.9
275	Q	29.2	Very low	30.6	Very low	133 Å²	133	127.9 Å²	127.9	62%	0.621	70%	0.703	S	S	*	*			cis	-169.5	177.7	-26.3	-119	-179.6	60	0	0	108.4
276	F	30.6	Very low	30.8	Very low	180 Å²	180	126.1 Å²	126.1	79%	0.789	70%	0.701	S	S	*	*			trans	66.6	126.7	171.5	-58.4	-79.5	0	0	0	117.3
277	A	31.2	Very low	31	Very low	83 Å²	83	124.8 Å²	124.8	69%	0.686	70%	0.703	S	S	*	*			cis	87.7	168.3	36.7	0	0	0	0	0	114.1
278	P	39.2	Very low	31.3	Very low	108 Å²	108	125.1 Å²	125.1	70%	0.701	71%	0.709	S	S	*	*				-143	-176.7	-55.7	41.9	-26.7	0	0	0	115.2
279	R	28.9	Very low	31.6	Very low	237 Å²	237	124.6 Å²	124.6	89%	0.894	72%	0.715	S	S	*	*			trans	70.1	147.1	165.1	-61	171.7	174.1	179.9	-3.4	114.5
280	S	35.3	Very low	31.8	Very low	111 Å²	111	122.4 Å²	122.4	78%	0.776	72%	0.716	S	S	*	*				-175.1	174.3	50.6	52.7	0	0	0	0	110.1
281	S	34.8	Very low	31.8	Very low	90 Å²	90	121.5 Å²	121.5	63%	0.629	72%	0.717	S	S	*	*			cis	-177.2	149.4	-31.5	60.2	0	0	0	0	111.5
282	L	32.8	Very low	32.1	Very low	162 Å²	162	123.3 Å²	123.3	85%	0.848	73%	0.729	S	S	*	*			trans	69.1	156.1	157.8	-60.9	162.4	0	0	0	118.1
283	S	33.1	Very low	32.2	Very low	87 Å²	87	123.3 Å²	123.3	61%	0.608	73%	0.734	S	S	*	*			cis	-171.6	165.2	-21.1	54.2	0	0	0	0	110.7
284	S	32.1	Very low	32.1	Very low	97 Å²	97	122.8 Å²	122.8	68%	0.678	74%	0.741	S	S	*	*			trans	59.4	148.4	149.2	52.4	0	0	0	0	119.8
285	E	31.7	Very low	32	Very low	176 Å²	176	122.7 Å²	122.7	82%	0.822	75%	0.748	S	S	*	*			cis	-161.6	162.9	-1	-126.6	165.8	-146.1	0	0	113.4
286	S	33.2	Very low	31.9	Very low	94 Å²	94	121.7 Å²	121.7	66%	0.657	76%	0.755	S	S	*	*			trans	40.7	115.6	149.1	67.9	0	0	0	0	124
287	S	34.8	Very low	31.8	Very low	109 Å²	109	122.2 Å²	122.2	76%	0.762	76%	0.76	S	S	*	*				114.5	136.3	110.6	74.1	0	0	0	0	122.9
288	S	35	Very low	31.6	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	76%	0.758	S	S	*	*			trans	79	124.3	150.7	74	0	0	0	0	121.6
289	S	33.8	Very low	31.2	Very low	108 Å²	108	128.9 Å²	128.9	76%	0.755	77%	0.767	S	S	*	*			trans	44.5	138.9	144.4	44.4	0	0	0	0	122.1
290	S	34.3	Very low	31.3	Very low	98 Å²	98	124.8 Å²	124.8	69%	0.685	76%	0.76	S	S	*	*			cis	-169.2	156.9	-0.9	44.3	0	0	0	0	112.6
291	T	28.1	Very low	31.1	Very low	128 Å²	128	126.6 Å²	126.6	79%	0.785	76%	0.761	S	S	*	*			trans	48.6	108.1	152.2	53.4	0	0	0	0	119.8
292	S	31.2	Very low	31	Very low	128 Å²	128	128.5 Å²	128.5	90%	0.895	77%	0.774	S	S	*	*				-172.3	160.5	104.4	40.4	0	0	0	0	112.5
293	S	29.6	Very low	31	Very low	118 Å²	118	125.3 Å²	125.3	83%	0.825	77%	0.765	S	S	*	*			trans	-85.6	144.3	-164.6	51.2	0	0	0	0	115.8
294	S	27.2	Very low	31.1	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	77%	0.773	S	S	*	*			trans	-161.4	159.8	140.7	59.5	0	0	0	0	113.2
295	C	26.6	Very low	31.2	Very low	114 Å²	114	130.8 Å²	130.8	77%	0.77	77%	0.774	S	S	*	*			trans	72.7	130	166.2	-69.7	0	0	0	0	121.4
296	S	26.8	Very low	31.3	Very low	111 Å²	111	130 Å²	130	78%	0.776	77%	0.771	S	S	*	*			trans	62	114	146.5	-54.6	0	0	0	0	120.8
297	E	27.9	Very low	31.4	Very low	191 Å²	191	131.2 Å²	131.2	89%	0.893	77%	0.774	S	S	*	*				-171.7	159.6	105.8	-106.9	-178.1	-175.1	0	0	116.7
298	T	27	Very low	31.5	Very low	106 Å²	106	132.5 Å²	132.5	65%	0.65	77%	0.772	S	S	*	*			trans	-40.4	137.3	168.2	-50	0	0	0	0	118.1
299	Y	31.5	Very low	31.4	Very low	225 Å²	225	137.4 Å²	137.4	88%	0.882	78%	0.775	S	S	*	*			trans	-156.5	116.4	140.3	-94.4	-85.2	0	0	0	107.5
300	M	29.9	Very low	31.3	Very low	152 Å²	152	139.7 Å²	139.7	75%	0.749	78%	0.779	S	S	*	*				67.3	117.9	74.9	-75.8	-74.2	-147.3	0	0	115.2
301	N	32.2	Very low	31.4	Very low	149 Å²	149	138.8 Å²	138.8	80%	0.797	78%	0.777	S	S	*	*			trans	-178.8	123.7	131.2	-98.9	-29.3	0	0	0	113.1
302	S	31.6	Very low	31.5	Very low	129 Å²	129	139.3 Å²	139.3	90%	0.902	78%	0.775	S	S	*	*			trans	-167.9	120.4	157.7	-79.2	0	0	0	0	107.2
303	S	34.4	Very low	31.7	Very low	95 Å²	95	140 Å²	140	66%	0.664	76%	0.764	S	S	*	*			trans	-126.6	138.2	-159.2	-63.8	0	0	0	0	114.3
304	L	33.7	Very low	32	Very low	147 Å²	147	141.3 Å²	141.3	77%	0.77	76%	0.757	S	S	*	*			trans	81.4	136.3	146.6	-74.1	164.5	0	0	0	121.5
305	Q	34.4	Very low	32.2	Very low	152 Å²	152	142.7 Å²	142.7	71%	0.71	76%	0.756	S	S	*	*			trans	74	138.7	155.1	-65.2	162.9	48.8	0	0	116.3
306	Q	34.5	Very low	32.5	Very low	159 Å²	159	142.5 Å²	142.5	74%	0.743	76%	0.756	S	S	*	*			cis	-151.9	147.7	7.3	-130.3	166.8	-14.8	0	0	111.4
307	V	36.1	Very low	32.8	Very low	120 Å²	120	142.1 Å²	142.1	73%	0.727	75%	0.753	S	S	*	*			trans	35	133.8	130.8	176.7	0	0	0	0	118.5
308	D	34.9	Very low	32.9	Very low	136 Å²	136	142.5 Å²	142.5	73%	0.727	75%	0.752	S	S	*	*			cis	-146.4	-162.3	32	-141.8	-39.3	0	0	0	115
309	R	33.4	Very low	33.1	Very low	207 Å²	207	145.9 Å²	145.9	78%	0.781	76%	0.76	S	S	*	*			trans	-101.1	174.3	-160.1	-62.4	158.7	168.4	153.7	-5.9	117.7
310	N	33.1	Very low	32.8	Very low	156 Å²	156	142.8 Å²	142.8	83%	0.834	76%	0.758	S	S	*	*			trans	88.6	147.5	157.7	-53	-28.4	0	0	0	117.5
311	A	35	Very low	32.7	Very low	79 Å²	79	139.8 Å²	139.8	65%	0.653	75%	0.752	S	S	*	*			cis	-169.6	139	-28.2	0	0	0	0	0	109.8
312	N	30.5	Very low	32.4	Very low	140 Å²	140	139.6 Å²	139.6	75%	0.749	75%	0.751	S	S	*	*			trans	60.2	160.6	165.1	-64.5	21.3	0	0	0	116.5
313	E	34.8	Very low	32.4	Very low	141 Å²	141	140.5 Å²	140.5	66%	0.659	75%	0.746	S	S	*	*			cis	-151.9	167.5	2.1	-137.6	150	-120.9	0	0	111.9
314	H	36.2	Very low	32	Very low	146 Å²	146	145 Å²	145	68%	0.676	75%	0.754	S	S	*	*			trans	54	110.1	164.1	-67.7	-48.8	0	0	0	119.8
315	N	30.9	Very low	31.7	Very low	141 Å²	141	143.4 Å²	143.4	75%	0.754	75%	0.75	S	S	*	*				91.6	105	67.4	-83.2	-4.3	0	0	0	114.9
316	S	33.6	Very low	31.5	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	76%	0.757	S	S	*	*				-177	140.5	106.4	-75	0	0	0	0	112.9
317	S	33	Very low	31	Very low	103 Å²	103	146.4 Å²	146.4	72%	0.72	76%	0.762	S	S	*	*			trans	17.2	120.7	157.7	51.9	0	0	0	0	119.8
318	K	29.3	Very low	30.4	Very low	199 Å²	199	146.1 Å²	146.1	87%	0.865	77%	0.765	S	S	*	*				55	131.8	58	-56	-177	177.7	179.6	0	111.7
319	Q	31.8	Very low	29.9	Very low	176 Å²	176	149 Å²	149	82%	0.822	77%	0.771	S	S	*	*			cis	-158.1	147.3	42.6	-125.8	153.9	-42.8	0	0	107.5
320	L	26	Very low	29.5	Very low	161 Å²	161	145.4 Å²	145.4	84%	0.843	77%	0.772	S	S	*	*				47.2	129.3	66.9	-72.9	167.4	0	0	0	113.9
321	S	27.5	Very low	29.1	Very low	89 Å²	89	147 Å²	147	62%	0.622	77%	0.772	S	S	*	*			cis	-171.1	157.8	8.4	49.8	0	0	0	0	111.4
322	N	26.7	Very low	28.7	Very low	144 Å²	144	152.3 Å²	152.3	77%	0.77	78%	0.784	S	S	*	*			trans	56.2	155.4	155.7	-57.5	5.6	0	0	0	118
323	D	31.5	Very low	28.4	Very low	148 Å²	148	152.6 Å²	152.6	79%	0.791	78%	0.784	S	S	*	*			cis	-151.4	-177.3	33.9	-112.7	-48.3	0	0	0	114.7
324	F	24.8	Very low	28	Very low	190 Å²	190	151 Å²	151	83%	0.833	79%	0.789	S	S	*	*			trans	-63.3	164.7	167.7	-84.7	-134.2	0	0	0	111.3
325	T	28.1	Very low	27.4	Very low	114 Å²	114	150.2 Å²	150.2	70%	0.699	79%	0.794	S	S	*	*			cis	-171.7	165.1	48.7	-36	0	0	0	0	112.3
326	Q	30.1	Very low	27.2	Very low	182 Å²	182	149.2 Å²	149.2	85%	0.85	80%	0.797	S	S	*	*			trans	67.3	164.6	167.8	-51.1	-170.6	11.5	0	0	117.1
327	F	23.3	Very low	26.9	Very low	191 Å²	191	152.4 Å²	152.4	84%	0.838	80%	0.8	S	S	*	*			cis	169	150.9	-45.5	-144.7	-88.9	0	0	0	105.1
328	S	24.4	Very low	26.6	Very low	114 Å²	114	153 Å²	153	80%	0.797	80%	0.804	S	S	*	*			trans	88.5	156.5	170.6	-58.5	0	0	0	0	119.4
329	K	24.5	Very low	26.6	Very low	196 Å²	196	147.3 Å²	147.3	85%	0.852	80%	0.801	S	S	*	*			trans	-68.8	161.9	-170	-55.9	163.2	178.7	172.4	0	111.5
330	T	24.9	Very low	26.3	Very low	132 Å²	132	145.7 Å²	145.7	81%	0.81	80%	0.799	S	S	*	*				-171.8	161.2	76.4	-75	0	0	0	0	112.2
331	F	24.9	Very low	26.6	Very low	189 Å²	189	149.6 Å²	149.6	83%	0.829	80%	0.804	S	S	*	*			trans	-60.6	139.4	170.2	-101.4	-106.5	0	0	0	112.4
332	Q	25.3	Very low	26.5	Very low	192 Å²	192	153.1 Å²	153.1	90%	0.897	81%	0.81	S	S	*	*			trans	-146.6	146.3	141.8	-82.2	-153.8	-29.9	0	0	111.3
333	L	24.2	Very low	26.8	Very low	146 Å²	146	153.1 Å²	153.1	76%	0.764	82%	0.816	S	S	*	*			trans	-78.7	151.4	160	-89.7	64.1	0	0	0	109
334	S	26	Very low	26.5	Very low	108 Å²	108	151.9 Å²	151.9	76%	0.755	81%	0.809	S	S	*	*			trans	-134.7	93.8	165.5	62.1	0	0	0	0	110.5
335	T	24.1	Very low	27	Very low	129 Å²	129	152 Å²	152	79%	0.791	81%	0.812	S	S	*	*			trans	-81.9	132.2	165.5	44.2	0	0	0	0	109.8
336	C	27.7	Very low	27	Very low	120 Å²	120	152.8 Å²	152.8	81%	0.811	81%	0.812	S	S	*	*			trans	-123.8	80.9	179.7	-62.5	0	0	0	0	111.6
337	E	25.8	Very low	27.2	Very low	177 Å²	177	152 Å²	152	83%	0.827	81%	0.813	S	S	*	*			trans	33.7	126.9	138	-69.7	-166	168.7	0	0	123.1
338	S	26.7	Very low	27.5	Very low	116 Å²	116	147.4 Å²	147.4	81%	0.811	80%	0.802	S	S	*	*				82.8	112.9	124.9	-62.7	0	0	0	0	121.4
339	G	30.7	Very low	28	Very low	79 Å²	79	149.8 Å²	149.8	81%	0.814	81%	0.805	S	S	*	*			trans	-162.9	94.9	162	0	0	0	0	0	110.8
340	N	24.7	Very low	28.2	Very low	143 Å²	143	146.7 Å²	146.7	77%	0.765	80%	0.797	S	S	*	*			trans	-73	146.5	-176.6	-70.6	-35	0	0	0	112.9
341	Y	31.7	Very low	28.3	Very low	243 Å²	243	147.4 Å²	147.4	95%	0.953	80%	0.795	S	S	*	*				-158.1	139	124.1	-91.8	-62.9	0	0	0	110.9
342	H	26.2	Very low	28.4	Very low	162 Å²	162	142.5 Å²	142.5	75%	0.75	78%	0.784	S	S	*	*			trans	-89.9	147.8	176.5	-87	-87.3	0	0	0	111.9
343	T	32.6	Very low	28.4	Very low	145 Å²	145	138.7 Å²	138.7	89%	0.89	78%	0.779	S	S	*	*				-156.4	146.2	121.7	20.6	0	0	0	0	110.3
344	N	26.2	Very low	28.5	Very low	122 Å²	122	139.5 Å²	139.5	65%	0.652	78%	0.783	S	S	*	*			trans	-94.2	157.2	177.6	-57.1	-25.3	0	0	0	110.2
345	H	35.3	Very low	28.6	Very low	192 Å²	192	143.6 Å²	143.6	89%	0.889	79%	0.787	S	S	*	*				-160	136.2	124.8	-105.9	-66.8	0	0	0	113.1
346	N	28.7	Very low	28.6	Very low	131 Å²	131	145.7 Å²	145.7	70%	0.701	79%	0.788	S	S	*	*			trans	-63.7	148	-168.9	-44	-29.2	0	0	0	114.9
347	N	32.3	Very low	28.6	Very low	165 Å²	165	149.4 Å²	149.4	88%	0.882	79%	0.791	S	S	*	*				-153.9	144	117.8	-105.9	-25	0	0	0	111.2
348	P	31.6	Very low	28.6	Very low	94 Å²	94	150.1 Å²	150.1	61%	0.61	79%	0.794	S	S	*	*			trans	-109.4	141.4	-166.3	38.2	-31	0	0	0	115.2	I350	P348-I350 HydrophobicContact CB-CD1 4.34Å
349	L	34.7	Very low	28.5	Very low	164 Å²	164	151.3 Å²	151.3	86%	0.859	79%	0.791	S	S	*	*			trans	-163.4	108.2	138.8	-94	176	0	0	0	104.9
350	I	26.9	Very low	28.3	Very low	132 Å²	132	152 Å²	152	68%	0.677	78%	0.775	S	S	*	*				69.6	118.2	56.5	-58.8	176	0	0	0	109.9	P348	P348-I350 HydrophobicContact CB-CD1 4.34Å
351	L	27.5	Very low	28.5	Very low	146 Å²	146	154.1 Å²	154.1	76%	0.764	78%	0.781	S	S	*	*			cis	-146.9	166	13.6	-163.9	69.3	0	0	0	112.5
352	S	26.9	Very low	28.3	Very low	87 Å²	87	150.2 Å²	150.2	61%	0.608	78%	0.776	S	S	*	*			trans	51.9	113.2	150.9	49.6	0	0	0	0	119.4
353	S	25	Very low	28.3	Very low	112 Å²	112	151.2 Å²	151.2	78%	0.783	77%	0.774	S	S	*	*				65.4	115.7	77.1	-59.1	0	0	0	0	112.5
354	L	28.1	Very low	27.9	Very low	162 Å²	162	151.8 Å²	151.8	85%	0.848	77%	0.771	S	S	*	*				-150.6	157.9	66.7	-92.2	161.6	0	0	0	114.1
355	K	27.2	Very low	28	Very low	194 Å²	194	155.8 Å²	155.8	84%	0.843	78%	0.783	S	S	*	*			trans	-90.8	111.1	158.4	-68.6	175.6	-179.5	175.4	0	107.9
356	E	24.5	Very low	27.5	Very low	174 Å²	174	154.1 Å²	154.1	81%	0.813	78%	0.78	S	S	*	*			trans	-177.1	115.3	153.3	-109	152.2	-156.1	0	0	110.1
357	F	27.3	Very low	27.4	Very low	198 Å²	198	155.6 Å²	155.6	87%	0.868	79%	0.787	S	S	*	*			trans	178.2	72.5	136.6	-105.4	-69.8	0	0	0	108.9
358	Q	26.5	Very low	27.1	Very low	192 Å²	192	152.7 Å²	152.7	90%	0.897	78%	0.78	S	S	*	*			trans	-119.5	50.7	169.1	-163.7	-175.2	-18.5	0	0	109.7
359	L	24.5	Very low	26.8	Very low	140 Å²	140	155.4 Å²	155.4	73%	0.733	79%	0.789	S	S	*	*	S	Bend	trans	-151.6	156	171.9	-135.6	72.8	0	0	0	110.2
360	D	25.3	Very low	26.4	Very low	93 Å²	93	155.9 Å²	155.9	50%	0.497	79%	0.787	S	S	.	*			trans	51	77.7	165.2	-68.6	-10.1	0	0	0	120.5	R363	D360-R363 HydrophobicContact CB-CB 4.23Å; D360-R363 VanDerWaalsContact OD2-CD 3.28Å; D360-R363 WeakPolarHBondContact OD2-CD 3.48Å
361	Q	29.7	Very low	26.3	Very low	189 Å²	189	157.1 Å²	157.1	88%	0.883	79%	0.794	S	S	*	*	S	Bend	trans	-98.6	4.1	138.8	-85.4	-88.7	-43.1	0	0	112.4
362	N	28.1	Very low	26.4	Very low	160 Å²	160	157.8 Å²	157.8	86%	0.856	80%	0.797	S	S	*	*	S	Bend	trans	-105.4	13.2	-177.8	-76.2	-26	0	0	0	114.2
363	R	25.2	Very low	26.3	Very low	183 Å²	183	160.7 Å²	160.7	69%	0.691	81%	0.805	S	S	*	*	S	Bend	trans	-128.9	16.5	-175.4	-94.4	-174.4	164.4	-117.5	-6.5	116.1	D360	D360-R363 HydrophobicContact CB-CB 4.23Å; D360-R363 VanDerWaalsContact OD2-CD 3.28Å; D360-R363 WeakPolarHBondContact OD2-CD 3.48Å
364	L	25.4	Very low	26.3	Very low	158 Å²	158	163 Å²	163	83%	0.827	81%	0.808	S	S	*	*	S	Bend	trans	-116.5	5.6	173.9	-90.4	168.5	0	0	0	115.5
365	F	27.3	Very low	26.2	Very low	206 Å²	206	162.3 Å²	162.3	90%	0.904	81%	0.805	S	S	*	*	S	Bend	trans	-111.7	55.6	168.6	-86.3	-78.7	0	0	0	111.8
366	N	24.1	Very low	26.3	Very low	157 Å²	157	158.3 Å²	158.3	84%	0.84	80%	0.801	S	S	*	*			trans	-163.3	88.6	157.2	-116.6	-28.6	0	0	0	110.9
367	L	26.4	Very low	26.2	Very low	161 Å²	161	157.9 Å²	157.9	84%	0.843	81%	0.805	S	S	*	*			trans	-140.6	85.6	167.1	-121.2	149.1	0	0	0	110.1
368	S	26.1	Very low	26.1	Very low	104 Å²	104	153.7 Å²	153.7	73%	0.727	80%	0.799	S	S	*	*			trans	53.9	102.8	150.3	-55.5	0	0	0	0	119.4	H370	S368-H370 PolarHBondContact O-N 3.39Å
369	N	25.7	Very low	26	Very low	152 Å²	152	152.4 Å²	152.4	81%	0.813	79%	0.793	S	S	*	*			trans	-38.2	125.8	141.2	-57.9	-57.6	0	0	0	111.9
370	H	26.5	Very low	26.1	Very low	174 Å²	174	155.8 Å²	155.8	81%	0.806	80%	0.798	S	S	*	*				166.8	111.1	122.6	-106.2	-98.6	0	0	0	110.9	S368	S368-H370 PolarHBondContact O-N 3.39Å
371	L	26.1	Very low	26	Very low	158 Å²	158	155.4 Å²	155.4	83%	0.827	80%	0.799	S	S	*	*	S	Bend		176.5	155.8	121.7	-104.6	133.7	0	0	0	111.4
372	L	27.6	Very low	25.8	Very low	160 Å²	160	152.8 Å²	152.8	84%	0.838	79%	0.789	S	S	*	*			trans	60.5	70.9	167.2	-64.6	170	0	0	0	117.3	N374	L372-N374 PolarHBondContact O-N 3.11Å
373	I	25.1	Very low	25.6	Very low	148 Å²	148	153.7 Å²	153.7	76%	0.759	79%	0.786	S	S	*	*			trans	-35.3	131.8	139.6	-62.7	156.3	0	0	0	111.1
374	N	26.4	Very low	25.8	Very low	160 Å²	160	150.1 Å²	150.1	86%	0.856	78%	0.784	S	S	*	*			trans	-153.1	124	140.3	-121.2	-20.4	0	0	0	112	L372	L372-N374 PolarHBondContact O-N 3.11Å
375	N	24.8	Very low	25.8	Very low	148 Å²	148	147.9 Å²	147.9	79%	0.791	78%	0.777	S	S	*	*			trans	-79.3	139.7	176.4	-80	-42.4	0	0	0	110.8
376	S	29.1	Very low	26.1	Very low	109 Å²	109	144.9 Å²	144.9	76%	0.762	77%	0.769	S	S	*	*			trans	-150.2	107.3	159.5	-75.5	0	0	0	0	110.1	C378	S376-C378 PolarHBondContact O-N 2.94Å
377	N	23.8	Very low	26.4	Very low	166 Å²	166	144.2 Å²	144.2	89%	0.888	77%	0.765	S	S	*	*			trans	-68.2	118.7	170.3	-75.4	-33.6	0	0	0	109.6
378	C	25.4	Very low	26.4	Very low	110 Å²	110	144.6 Å²	144.6	74%	0.743	77%	0.768	S	S	*	*			trans	-111.1	78.6	170.2	-76.9	0	0	0	0	110.7	S376 Y380	S376-C378 PolarHBondContact O-N 2.94Å; C378-Y380 PolarHBondContact O-N 2.84Å
379	Q	24.1	Very low	26.7	Very low	165 Å²	165	143.2 Å²	143.2	77%	0.771	77%	0.771	S	S	*	*			trans	-65.7	120.7	163.4	-70.2	-177.9	-28.4	0	0	109.6	T381	Q379-T381 PolarHBondContact O-N 2.96Å
380	Y	25.6	Very low	26.7	Very low	211 Å²	211	141.8 Å²	141.8	83%	0.827	77%	0.768	S	S	*	*			trans	-78.1	69.9	163.9	-91.7	-76.8	0	0	0	111	C378 I382	C378-Y380 PolarHBondContact O-N 2.84Å; Y380-I382 PolarHBondContact O-N 3.44Å; Y380-I382 VanDerWaalsContact O-N 3.13Å
381	T	23.5	Very low	26.9	Very low	85 Å²	85	141.2 Å²	141.2	52%	0.521	77%	0.769	S	S	.	*			trans	-76.4	95.9	172.9	-53.2	0	0	0	0	109.7	Q379 K383	Q379-T381 PolarHBondContact O-N 2.96Å; T381-K383 VanDerWaalsContact C-N 3.28Å; T381-K383 HydrophobicContact CG2-CG 4Å; T381-K383 PolarHBondContact O-N 3.3Å
382	I	26.6	Very low	27	Very low	134 Å²	134	137.8 Å²	137.8	69%	0.687	76%	0.758	S	S	*	*			trans	-70.8	87.2	168.9	-58.6	-179.2	0	0	0	108.8	Y380 T384	Y380-I382 PolarHBondContact O-N 3.44Å; Y380-I382 VanDerWaalsContact O-N 3.13Å; I382-T384 PolarHBondContact O-N 3.3Å
383	K	23.6	Very low	27	Very low	179 Å²	179	135.1 Å²	135.1	78%	0.778	75%	0.749	S	S	*	*			trans	-72.8	85.3	169.9	-87	179.3	174.4	172.4	0	110.3	T381 T385	T381-K383 VanDerWaalsContact C-N 3.28Å; T381-K383 HydrophobicContact CG2-CG 4Å; T381-K383 PolarHBondContact O-N 3.3Å; K383-T385 PolarHBondContact O-N 3.4Å; K383-T385 VanDerWaalsContact O-N 3.17Å
384	T	28.2	Very low	27.2	Very low	107 Å²	107	133.6 Å²	133.6	66%	0.656	75%	0.747	S	S	*	*			trans	-82.1	85.9	166.1	-51.2	0	0	0	0	109.6	I382 I386	I382-T384 PolarHBondContact O-N 3.3Å; T384-I386 HydrophobicContact CG2-CD1 4.3Å; T384-I386 HydrophobicContact CG2-CG1 4.19Å; T384-I386 PolarHBondContact O-N 3.09Å
385	T	25.7	Very low	27.2	Very low	112 Å²	112	128.5 Å²	128.5	69%	0.687	72%	0.721	S	S	*	*			trans	-71.1	106.6	174.1	-54.4	0	0	0	0	110.1	K383	K383-T385 PolarHBondContact O-N 3.4Å; K383-T385 VanDerWaalsContact O-N 3.17Å
386	I	33.2	Very low	27.5	Very low	143 Å²	143	126.2 Å²	126.2	73%	0.733	71%	0.713	S	S	*	*			trans	-112.9	124.9	164.3	-60.6	-179.8	0	0	0	107.4	T384	T384-I386 HydrophobicContact CG2-CD1 4.3Å; T384-I386 HydrophobicContact CG2-CG1 4.19Å; T384-I386 PolarHBondContact O-N 3.09Å
387	N	30.3	Very low	27.4	Very low	142 Å²	142	124 Å²	124	76%	0.759	70%	0.695	S	S	*	*			trans	-76.2	146.1	-175	-71.5	-33.9	0	0	0	111.9	G389	N387-G389 PolarHBondContact O-N 3.18Å
388	N	27.9	Very low	27.6	Very low	169 Å²	169	120.8 Å²	120.8	90%	0.904	68%	0.681	S	S	*	*			trans	-62.8	131.9	177.8	-69.4	-40.7	0	0	0	112.2
389	G	30.8	Very low	27.7	Very low	76 Å²	76	119.2 Å²	119.2	78%	0.784	67%	0.668	S	S	*	*			trans	-133.5	112.6	168.3	0	0	0	0	0	110.2	N387	N387-G389 PolarHBondContact O-N 3.18Å
390	T	26.5	Very low	27.9	Very low	121 Å²	121	116.8 Å²	116.8	74%	0.742	67%	0.665	S	S	*	*			trans	-77.1	140.3	-171.9	-48.2	0	0	0	0	113
391	I	30.7	Very low	28	Very low	162 Å²	162	112.6 Å²	112.6	83%	0.831	66%	0.661	S	S	*	*			trans	173.3	100.8	143.2	-89	148.6	0	0	0	105.9
392	S	27.5	Very low	28.2	Very low	87 Å²	87	112.4 Å²	112.4	61%	0.608	67%	0.668	S	S	*	*				77.6	81.9	72.7	-65.2	0	0	0	0	115.4
393	T	27.9	Very low	28.2	Very low	103 Å²	103	111.9 Å²	111.9	63%	0.632	67%	0.671	S	S	*	*			trans	27.3	127.6	133.2	55.8	0	0	0	0	120.3
394	T	29.7	Very low	28.5	Very low	117 Å²	117	108.4 Å²	108.4	72%	0.718	67%	0.669	S	S	*	*				-164.1	171	108.7	17	0	0	0	0	111.8
395	T	26.7	Very low	28.6	Very low	52 Å²	52	108.5 Å²	108.5	32%	0.319	67%	0.67	S	S	.	*			trans	-162.9	113.1	-132.3	90.4	0	0	0	0	112.2	R199 Q200	R199-T395 WeakPolarHBondContact CD-O 3.3Å; R199-T395 WeakPolarHBondContact CD-OG1 3.41Å; R199-T395 HydrophobicContact CG-CG2 4.37Å; Q200-T395 VanDerWaalsContact CG-OG1 3.27Å; Q200-T395 WeakPolarHBondContact CG-OG1 3.19Å; Q200-T395 PolarHBondContact NE2-O 2.92Å
396	T	30.1	Very low	28.9	Very low	101 Å²	101	108.6 Å²	108.6	62%	0.62	67%	0.671	S	S	*	*			trans	-147	159.8	173.3	46.4	0	0	0	0	113.6	Q198 R199	Q198-T396 VanDerWaalsContact OE1-CG2 3.32Å; R199-T396 PolarHBondContact NH1-O 2.88Å; R199-T396 PolarHBondContact NH2-O 2.98Å
397	T	27.7	Very low	28.9	Very low	63 Å²	63	108.4 Å²	108.4	39%	0.387	67%	0.671	S	S	.	*			trans	-132.5	-153.1	-165.6	-31	0	0	0	0	113.1	Q197 Q198 R199	Q197-T397 HydrophobicContact CG-CG2 4.21Å; Q197-T397 VanDerWaalsContact OE1-CB 3.3Å; Q198-T397 WeakPolarHBondContact CG-OG1 3.05Å; R199-T397 VanDerWaalsContact CZ-OG1 3.25Å; R199-T397 PolarHBondContact NE-OG1 3.25Å; R199-T397 PolarHBondContact NH2-OG1 3.06Å
398	T	28.9	Very low	28.9	Very low	97 Å²	97	108 Å²	108	60%	0.595	67%	0.669	S	S	*	*			trans	91	116.3	-177.6	-21.5	0	0	0	0	114.4	Q197 Q198	Q197-T398 PolarHBondContact OE1-OG1 3.39Å; Q198-T398 PolarHBondContact NE2-OG1 2.93Å
399	T	27.5	Very low	29.1	Very low	77 Å²	77	105 Å²	105	47%	0.472	66%	0.657	S	S	.	*			cis	94.1	139	20.7	74	0	0	0	0	117.7	N196 Q197	N196-T399 PolarHBondContact ND2-OG1 3.33Å; N196-T399 VanDerWaalsContact ND2-OG1 3.16Å; Q197-T399 VanDerWaalsContact NE2-CG2 3.28Å; Q197-T399 PolarHBondContact NE2-OG1 3.29Å
400	V	28	Very low	29.3	Very low	115 Å²	115	107.7 Å²	107.7	70%	0.697	65%	0.654	S	S	*	*			trans	85.5	145.9	172.7	-170.3	0	0	0	0	115
401	T	26.5	Very low	29.4	Very low	122 Å²	122	108.5 Å²	108.5	75%	0.748	65%	0.653	S	S	*	*			cis	177.3	153.6	-44.9	-79.2	0	0	0	0	107.2
402	A	28.3	Very low	29.4	Very low	81 Å²	81	108.1 Å²	108.1	67%	0.669	65%	0.653	S	S	*	*			trans	70.7	158.1	160.3	0	0	0	0	0	119.5
403	T	27.2	Very low	29.4	Very low	124 Å²	124	112.4 Å²	112.4	76%	0.761	66%	0.661	S	S	*	*			cis	-166.4	171.9	-30.3	30.4	0	0	0	0	109.4
404	S	29.3	Very low	29.5	Very low	105 Å²	105	115 Å²	115	73%	0.734	67%	0.669	S	S	*	*			trans	78.8	162.4	153.3	77.9	0	0	0	0	117.9
405	T	30.4	Very low	29.4	Very low	110 Å²	110	121.1 Å²	121.1	68%	0.675	68%	0.681	S	S	*	*			cis	-153	166.2	12.2	-23.9	0	0	0	0	112.4
406	T	31.6	Very low	29.4	Very low	114 Å²	114	129.4 Å²	129.4	70%	0.699	71%	0.707	S	S	*	*			trans	64.3	146	155.5	48.9	0	0	0	0	118.3
407	N	32.4	Very low	29.2	Very low	139 Å²	139	133.8 Å²	133.8	74%	0.743	72%	0.72	S	S	*	*			cis	-155.3	170.2	4.9	-96.5	-31.8	0	0	0	107.4
408	N	30.7	Very low	29.2	Very low	133 Å²	133	136.3 Å²	136.3	71%	0.711	74%	0.74	S	S	*	*			cis	-173.3	169.8	-29.2	-168.6	0.8	0	0	0	107.3
409	T	33.7	Very low	29.2	Very low	106 Å²	106	139.5 Å²	139.5	65%	0.65	75%	0.753	S	S	*	*			trans	73.2	116.2	163.7	60.6	0	0	0	0	122.2
410	N	33.4	Very low	29.1	Very low	133 Å²	133	144 Å²	144	71%	0.711	77%	0.774	S	S	*	*				80.8	99.9	128.4	-58.6	-5.9	0	0	0	123.3
411	N	30	Very low	29	Very low	137 Å²	137	143.7 Å²	143.7	73%	0.733	78%	0.777	S	S	*	*				72.9	124	127.4	-58.5	-15.5	0	0	0	122.3
412	N	29.4	Very low	29	Very low	154 Å²	154	143.1 Å²	143.1	82%	0.824	77%	0.769	S	S	*	*			trans	82.2	138.1	157.8	-56.8	-40.4	0	0	0	119.4
413	K	29	Very low	28.9	Very low	178 Å²	178	147.5 Å²	147.5	77%	0.774	78%	0.781	S	S	*	*			trans	74.7	164.6	174	-58.6	-175.6	174.4	-177.4	0	117.3
414	L	29.8	Very low	28.9	Very low	156 Å²	156	147.2 Å²	147.2	82%	0.817	77%	0.774	S	S	*	*			trans	72.9	80.5	166.7	-55.8	178.7	0	0	0	118.5	R416	L414-R416 PolarHBondContact O-N 3.38Å; L414-R416 VanDerWaalsContact O-N 3.16Å
415	Y	25.7	Very low	28.9	Very low	246 Å²	246	146.5 Å²	146.5	97%	0.965	77%	0.767	S	S	*	*			trans	-72	91.8	148	-100.1	-87.1	0	0	0	109.3
416	R	27.3	Very low	28.8	Very low	226 Å²	226	146.6 Å²	146.6	85%	0.853	77%	0.767	S	S	*	*			trans	-149.8	44.8	173.4	-153.3	-170.6	-169.6	174.9	5.4	114	L414	L414-R416 PolarHBondContact O-N 3.38Å; L414-R416 VanDerWaalsContact O-N 3.16Å
417	E	27.2	Very low	28.8	Very low	194 Å²	194	149.2 Å²	149.2	91%	0.907	77%	0.769	S	S	*	*			trans	-142.1	63.3	179.6	-121.9	165.9	-132.7	0	0	111.3
418	S	27.7	Very low	28.8	Very low	115 Å²	115	147.1 Å²	147.1	80%	0.804	76%	0.758	S	S	*	*			trans	-155.2	40.8	174.7	-66.1	0	0	0	0	111.8
419	L	28.1	Very low	28.7	Very low	165 Å²	165	147 Å²	147	86%	0.864	75%	0.753	S	S	*	*			trans	-140.3	80.2	174.5	-73.1	176.1	0	0	0	109.1
420	N	26.3	Very low	28.6	Very low	171 Å²	171	147.2 Å²	147.2	91%	0.914	75%	0.75	S	S	*	*	S	Bend	trans	-166.1	43.6	168.9	-106.3	-21	0	0	0	112.5
421	S	25.9	Very low	28.6	Very low	109 Å²	109	144.6 Å²	144.6	76%	0.762	73%	0.731	S	S	*	*	S	Bend	trans	-152.5	151.3	166.8	-75.5	0	0	0	0	107.4
422	L	26.6	Very low	28.8	Very low	110 Å²	110	143 Å²	143	58%	0.576	72%	0.722	S	S	*	*			trans	68.9	50.1	178.5	-56.1	157.7	0	0	0	115.9	L424 D747	L422-L424 PolarHBondContact O-N 3.04Å; L422-D747 WeakPolarHBondContact CD1-OD1 3.36Å
423	N	25.2	Very low	28.9	Very low	173 Å²	173	141.3 Å²	141.3	93%	0.925	71%	0.71	S	S	*	*			trans	-70.9	101	147.1	-80.7	-8.3	0	0	0	108.2
424	L	28.1	Very low	29.1	Very low	118 Å²	118	138.1 Å²	138.1	62%	0.618	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-98.4	128.5	164.1	-85.2	160.9	0	0	0	108	L422 V426	L422-L424 PolarHBondContact O-N 3.04Å; L424-V426 PolarHBondContact O-N 2.83Å
425	P	27.6	Very low	29.2	Very low	90 Å²	90	136.3 Å²	136.3	58%	0.584	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-67.2	126.6	-174.7	26.7	-33.5	0	0	0	110.8	F427	P425-F427 PolarHBondContact O-N 3.11Å
426	V	29.7	Very low	29.5	Very low	111 Å²	111	135 Å²	135	67%	0.673	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-74.5	124.5	166.2	177.1	0	0	0	0	107.4	L424 D428	L424-V426 PolarHBondContact O-N 2.83Å; V426-D428 PolarHBondContact O-N 2.78Å; V426-D428 VanDerWaalsContact O-N 3.07Å
427	F	30	Very low	29.6	Very low	170 Å²	170	129 Å²	129	75%	0.746	68%	0.677	S	S	*	*	S	Bend	trans	-53	108.1	-172.1	-67.8	-95.4	0	0	0	114.3	P425	P425-F427 PolarHBondContact O-N 3.11Å
428	D	32.8	Very low	29.7	Very low	94 Å²	94	130.6 Å²	130.6	50%	0.503	67%	0.674	S	S	.	*			trans	-152.4	35.3	142	-149.4	-10.8	0	0	0	111.8	V426 N430	V426-D428 PolarHBondContact O-N 2.78Å; V426-D428 VanDerWaalsContact O-N 3.07Å; D428-N430 PolarHBondContact O-N 2.95Å
429	E	30.1	Very low	29.8	Very low	132 Å²	132	132.7 Å²	132.7	62%	0.617	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	66.3	174.7	-74.8	-154.3	177.1	0	0	112.3	Q433	E429-Q433 PolarHBondContact OE2-NE2 3.46Å
430	N	31.2	Very low	29.8	Very low	110 Å²	110	132.3 Å²	132.3	59%	0.588	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.7	-17.9	156	-88.3	-58.6	0	0	0	112.9	D428 D432	D428-N430 PolarHBondContact O-N 2.95Å; N430-D432 PolarHBondContact O-N 3.33Å
431	Y	33.4	Very low	29.9	Very low	77 Å²	77	133.5 Å²	133.5	30%	0.302	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-21.3	-168	-118.4	-84	0	0	0	117	P984 T1000	Y431-P984 HydrophobicContact CE1-CG 4.32Å; Y431-P984 WeakPolarHBondContact OH-CB 3.11Å; Y431-P984 WeakPolarHBondContact OH-CD 3.41Å; Y431-P984 VanDerWaalsContact OH-N 3.12Å; Y431-T1000 HydrophobicContact CE2-CG2 3.7Å; Y431-T1000 WeakPolarHBondContact OH-CG2 3.26Å
432	D	33.9	Very low	30	Very low	103 Å²	103	139.3 Å²	139.3	55%	0.551	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.6	-6.3	-177.7	-93.5	-51.3	0	0	0	115.5	N430 K893	N430-D432 PolarHBondContact O-N 3.33Å; D432-K893 IonicContact OD1-NZ 3.45Å
433	Q	31	Very low	30.2	Very low	120 Å²	120	141.8 Å²	141.8	56%	0.561	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-23.4	-178.9	-66	-167.9	28	0	0	113.9	E429 N435	E429-Q433 PolarHBondContact OE2-NE2 3.46Å; Q433-N435 VanDerWaalsContact C-N 3.29Å; Q433-N435 PolarHBondContact O-N 3.06Å
434	I	33.1	Very low	30.5	Very low	111 Å²	111	140.7 Å²	140.7	57%	0.569	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-9.6	-173.5	-68.1	173.1	0	0	0	113.6
435	N	32.8	Very low	30.5	Very low	117 Å²	117	140.1 Å²	140.1	63%	0.626	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	6.2	180	-80.8	-55.4	0	0	0	116	Q433 K979	Q433-N435 VanDerWaalsContact C-N 3.29Å; Q433-N435 PolarHBondContact O-N 3.06Å; N435-K979 PolarHBondContact OD1-NZ 3.28Å
436	R	32.5	Very low	30.7	Very low	219 Å²	219	142.5 Å²	142.5	83%	0.826	70%	0.697	S	S	*	*	S	Bend	trans	-109.4	11.3	178.3	-75.2	-168.9	179.8	-98.3	4.2	115.4
437	S	28.8	Very low	30.7	Very low	99 Å²	99	143.5 Å²	143.5	69%	0.692	70%	0.699	S	S	*	*	S	Bend	trans	-110.1	26.5	-174.1	52.9	0	0	0	0	114.8
438	R	29.1	Very low	30.7	Very low	228 Å²	228	143 Å²	143	86%	0.86	70%	0.702	S	S	*	*	S	Bend	trans	-141.3	150.6	165.1	-71.4	-171.3	177.6	176.6	0.4	109.8
439	I	30.2	Very low	30.5	Very low	159 Å²	159	145.8 Å²	145.8	82%	0.815	71%	0.712	S	S	*	*	S	Bend	trans	71.6	81.4	-170	-46.5	167.9	0	0	0	111.9
440	D	27.4	Very low	30.5	Very low	158 Å²	158	145.9 Å²	145.9	85%	0.845	72%	0.716	S	S	*	*			trans	-174.9	78.3	136.1	-96.8	-16	0	0	0	110.5
441	Q	27.7	Very low	30.3	Very low	196 Å²	196	146.2 Å²	146.2	92%	0.916	72%	0.718	S	S	*	*			trans	-147.1	82.1	163.4	-79.5	-160.9	0	0	0	110.6
442	R	28.5	Very low	30.2	Very low	231 Å²	231	149 Å²	149	87%	0.872	74%	0.736	S	S	*	*			trans	-161.1	157.3	149.4	-116.3	171.6	-166.6	-170.3	1.7	112.5
443	E	31.7	Very low	30.1	Very low	162 Å²	162	150.7 Å²	150.7	76%	0.757	75%	0.745	S	S	*	*			trans	65.6	66.5	162.5	-69.5	165.7	-136.3	0	0	117.2
444	T	31.4	Very low	30.1	Very low	150 Å²	150	153.2 Å²	153.2	92%	0.92	76%	0.757	S	S	*	*			trans	-89.2	109.8	134	-34	0	0	0	0	108.2
445	T	28.7	Very low	30.1	Very low	106 Å²	106	153.7 Å²	153.7	65%	0.65	77%	0.767	S	S	*	*			trans	-86.2	147.1	176.2	45	0	0	0	0	111.3
446	N	31.8	Very low	30.1	Very low	139 Å²	139	155.2 Å²	155.2	74%	0.743	78%	0.78	S	S	*	*			trans	-173	100.6	144.4	-100.3	-49.8	0	0	0	113
447	N	28.2	Very low	30	Very low	133 Å²	133	149.2 Å²	149.2	71%	0.711	77%	0.772	S	S	*	*			trans	68.7	153.8	141.7	-48.6	-38	0	0	0	121.6
448	I	31.7	Very low	30	Very low	160 Å²	160	153 Å²	153	82%	0.821	78%	0.784	S	S	*	*			trans	74.1	130.2	167.6	-57.7	162.8	0	0	0	115.1
449	Q	28.7	Very low	29.9	Very low	152 Å²	152	149 Å²	149	71%	0.71	78%	0.778	S	S	*	*			cis	-174.1	137.8	-17.5	168.1	167	-22	0	0	109.1
450	L	29	Very low	30	Very low	134 Å²	134	148.2 Å²	148.2	70%	0.702	78%	0.775	S	S	*	*			trans	65.6	152.9	173.1	-61.9	161.6	0	0	0	114.8
451	D	27.6	Very low	30	Very low	117 Å²	117	149.6 Å²	149.6	63%	0.626	77%	0.773	S	S	*	*			cis	-160.1	164.8	0.6	-129.4	-19.3	0	0	0	113
452	I	30	Very low	30.3	Very low	134 Å²	134	145 Å²	145	69%	0.687	77%	0.768	S	S	*	*			trans	52.7	114.1	142.6	-71.6	163.8	0	0	0	117.8
453	L	32.4	Very low	30.6	Very low	139 Å²	139	142.2 Å²	142.2	73%	0.728	77%	0.765	S	S	*	*			cis	-154.2	135.4	30.6	-89.4	150.4	0	0	0	116.1
454	Q	30.6	Very low	30.7	Very low	174 Å²	174	142 Å²	142	81%	0.813	76%	0.764	S	S	*	*			trans	45.7	124.8	134.1	-70.3	-178.2	-22.9	0	0	124.9
455	P	32.9	Very low	30.6	Very low	121 Å²	121	140.8 Å²	140.8	79%	0.786	75%	0.752	S	S	*	*			trans	-109.2	-176.8	159.8	41.5	-32.7	0	0	0	113.3
456	T	33.6	Very low	30.9	Very low	148 Å²	148	142.9 Å²	142.9	91%	0.908	76%	0.759	S	S	*	*			trans	-150.9	152.4	163.8	-38	0	0	0	0	112.7
457	S	30.3	Very low	30.9	Very low	94 Å²	94	142.9 Å²	142.9	66%	0.657	76%	0.758	S	S	*	*			trans	-111.4	156.4	-168.6	56.9	0	0	0	0	114.8
458	L	29.5	Very low	30.9	Very low	178 Å²	178	142.9 Å²	142.9	93%	0.932	76%	0.758	S	S	*	*			trans	-143	157.4	145.7	-82.6	-173.1	0	0	0	111.9
459	I	26.1	Very low	30.9	Very low	145 Å²	145	145.6 Å²	145.6	74%	0.744	76%	0.764	S	S	*	*			trans	-141.6	150.6	-173.1	-60	170.4	0	0	0	107.7
460	L	31.7	Very low	30.9	Very low	141 Å²	141	143.7 Å²	143.7	74%	0.738	77%	0.765	S	S	*	*			trans	152.9	128.9	134.8	-82.1	165.8	0	0	0	114.9
461	K	28.9	Very low	31	Very low	188 Å²	188	142.8 Å²	142.8	82%	0.817	77%	0.77	S	S	*	*			trans	61	150.5	146.2	-63.5	177.6	175.1	-174	0	118.1
462	A	34	Very low	31.1	Very low	98 Å²	98	142.2 Å²	142.2	81%	0.81	78%	0.775	S	S	*	*			cis	-144	-169.3	29.5	0	0	0	0	0	113.8
463	E	33.2	Very low	30.9	Very low	173 Å²	173	141.5 Å²	141.5	81%	0.808	78%	0.782	S	S	*	*			trans	-119.1	161.5	-162	-67.4	160.8	119.9	0	0	114.9
464	E	33.9	Very low	30.8	Very low	158 Å²	158	140.1 Å²	140.1	74%	0.738	78%	0.784	S	S	*	*			trans	76.2	136	145	-90.5	-171.5	-158.5	0	0	124.7
465	N	29.5	Very low	30.7	Very low	124 Å²	124	137.8 Å²	137.8	66%	0.663	79%	0.787	S	S	*	*			trans	59.6	121.7	150.4	-53.3	-35.4	0	0	0	119.1
466	L	34.3	Very low	30.6	Very low	151 Å²	151	137.5 Å²	137.5	79%	0.791	79%	0.788	S	S	*	*				-166.1	144.5	67.3	-85.1	166	0	0	0	114.4
467	L	33.4	Very low	30.6	Very low	139 Å²	139	136.9 Å²	136.9	73%	0.728	78%	0.784	S	S	*	*			trans	60.9	115.7	144.2	-66.2	168	0	0	0	123.4
468	N	27.5	Very low	30.7	Very low	133 Å²	133	140.4 Å²	140.4	71%	0.711	80%	0.795	S	S	*	*			trans	39.7	121.9	132.5	-70.6	-0.8	0	0	0	122.2
469	F	31	Very low	30.6	Very low	216 Å²	216	139.3 Å²	139.3	95%	0.947	79%	0.789	S	S	*	*				-157.5	122.6	117.3	-104.8	-69.3	0	0	0	111.4
470	P	28.4	Very low	30.9	Very low	113 Å²	113	138.2 Å²	138.2	73%	0.734	79%	0.794	S	S	*	*			trans	-116.8	138.2	172.7	36.9	-26.7	0	0	0	113.5
471	S	31.4	Very low	30.8	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	80%	0.798	S	S	*	*			trans	-159.7	141.7	165.4	50.7	0	0	0	0	109.6
472	S	30.2	Very low	30.9	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	80%	0.803	S	S	*	*			cis	173.2	109.7	-22.3	42.8	0	0	0	0	103.8
473	S	26.2	Very low	30.7	Very low	119 Å²	119	141.8 Å²	141.8	83%	0.832	80%	0.799	S	S	*	*			trans	-77.2	142.9	171.2	46.4	0	0	0	0	110.2
474	S	30.6	Very low	30.8	Very low	110 Å²	110	141.1 Å²	141.1	77%	0.769	79%	0.793	S	S	*	*			trans	-139.1	93.8	174.2	-72.4	0	0	0	0	110.9
475	S	27.5	Very low	30.8	Very low	126 Å²	126	140.2 Å²	140.2	88%	0.881	79%	0.789	S	S	*	*			trans	-95.5	123.5	155	-57.7	0	0	0	0	107.6
476	S	31.2	Very low	31.1	Very low	115 Å²	115	139.7 Å²	139.7	80%	0.804	79%	0.79	S	S	*	*			trans	-116.3	93.8	-176.6	42.4	0	0	0	0	112
477	T	32.7	Very low	31.1	Very low	135 Å²	135	139.5 Å²	139.5	83%	0.828	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.9	142.9	163.8	46.7	0	0	0	0	110.8
478	L	32.8	Very low	31.2	Very low	168 Å²	168	137.6 Å²	137.6	88%	0.88	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.2	157.9	173.3	-77.8	169.8	0	0	0	112.6
479	L	28.2	Very low	31.6	Very low	154 Å²	154	135.5 Å²	135.5	81%	0.806	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-82.1	152.3	-162.2	-61.4	78	0	0	0	113.7
480	S	32	Very low	31.8	Very low	122 Å²	122	134.8 Å²	134.8	85%	0.853	78%	0.777	S	S	*	*			trans	-143.1	137.5	141.7	57.2	0	0	0	0	112.2
481	N	30.4	Very low	32	Very low	155 Å²	155	135.7 Å²	135.7	83%	0.829	77%	0.774	S	S	*	*			trans	-61.2	138	-164.7	-52.6	-49.4	0	0	0	115.9
482	R	30.4	Very low	31.9	Very low	246 Å²	246	134.4 Å²	134.4	93%	0.928	77%	0.77	S	S	*	*				-160.1	150.3	117.2	-125.8	175.5	173.8	177.8	-2.5	115.1
483	S	30.7	Very low	32.1	Very low	102 Å²	102	135.5 Å²	135.5	71%	0.713	77%	0.773	S	S	*	*			trans	-79.8	151.6	-174.7	46.8	0	0	0	0	115
484	K	34.7	Very low	32.2	Very low	159 Å²	159	138.2 Å²	138.2	69%	0.691	77%	0.774	S	S	*	*				-176.2	138.1	117.3	-101	178.7	168.6	-74.8	0	112.8
485	E	33.6	Very low	32.3	Very low	139 Å²	139	138 Å²	138	65%	0.65	77%	0.773	S	S	*	*			trans	42.7	136.5	132.3	-66	149.3	-158.8	0	0	120.3
486	T	34.9	Very low	32.7	Very low	112 Å²	112	138 Å²	138	69%	0.687	77%	0.773	S	S	*	*			cis	-169	162.6	3.1	8.9	0	0	0	0	111.1
487	D	35.2	Very low	32.8	Very low	147 Å²	147	135.8 Å²	135.8	79%	0.786	77%	0.768	S	S	*	*			trans	66.3	144.1	152.5	-59.4	-15.4	0	0	0	120.8
488	S	36.7	Very low	32.8	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	77%	0.77	S	S	*	*			cis	-157.3	139	-9.6	-137.7	0	0	0	0	115.3
489	S	35.1	Very low	32.8	Very low	89 Å²	89	135.8 Å²	135.8	62%	0.622	77%	0.767	S	S	*	*			trans	34.3	127.3	142.3	68.2	0	0	0	0	124.3
490	Y	34.6	Very low	33.1	Very low	201 Å²	201	136.8 Å²	136.8	79%	0.788	77%	0.773	S	S	*	*				-178.3	116.8	95.7	-116.1	-99.7	0	0	0	115.6
491	I	32.9	Very low	33.1	Very low	132 Å²	132	134 Å²	134	68%	0.677	76%	0.763	S	S	*	*			trans	42.9	104.8	136.8	-55.6	-166.3	0	0	0	119.8
492	A	30.3	Very low	33	Very low	87 Å²	87	130.5 Å²	130.5	72%	0.719	76%	0.764	S	S	*	*				86	141.2	87.5	0	0	0	0	0	115.9
493	T	32.9	Very low	33.1	Very low	129 Å²	129	126.6 Å²	126.6	79%	0.791	76%	0.76	S	S	*	*				-166.1	139.6	68.6	-62.3	0	0	0	0	114.7
494	M	28.6	Very low	33.1	Very low	176 Å²	176	128.1 Å²	128.1	87%	0.867	76%	0.764	S	S	*	*			trans	2.1	133.4	160.1	-51.2	-61	-170.9	0	0	122.8
495	S	34.1	Very low	32.9	Very low	105 Å²	105	124.9 Å²	124.9	73%	0.734	77%	0.767	S	S	*	*				-178.8	129.1	113.7	60.3	0	0	0	0	114.1
496	S	35.6	Very low	32.8	Very low	127 Å²	127	124.3 Å²	124.3	89%	0.888	77%	0.773	S	S	*	*			trans	50.9	143.4	161	54.3	0	0	0	0	120.4
497	G	32.8	Very low	32.5	Very low	67 Å²	67	124.6 Å²	124.6	69%	0.691	78%	0.777	S	S	*	*			cis	168.8	152.3	-3.8	0	0	0	0	0	110.6
498	E	33.3	Very low	32	Very low	189 Å²	189	122.6 Å²	122.6	88%	0.883	78%	0.781	S	S	*	*			trans	45.7	97.8	162.1	-62.4	168.5	162.9	0	0	117.9
499	S	31	Very low	31.6	Very low	115 Å²	115	124.5 Å²	124.5	80%	0.804	78%	0.783	S	S	*	*				75.1	88.1	66.8	78	0	0	0	0	116.3
500	D	35	Very low	31.4	Very low	174 Å²	174	126.1 Å²	126.1	93%	0.93	79%	0.789	S	S	*	*			trans	-146.9	167.3	158	-159.4	3.3	0	0	0	111.1
501	G	32.3	Very low	31	Very low	63 Å²	63	120.9 Å²	120.9	65%	0.649	80%	0.797	S	S	*	*			trans	-72.9	130.3	-166.7	0	0	0	0	0	115.8	I503	G501-I503 PolarHBondContact O-N 3.03Å
502	G	29	Very low	30.8	Very low	82 Å²	82	118.4 Å²	118.4	85%	0.845	79%	0.79	S	S	*	*			trans	-75.9	112.4	-178.8	0	0	0	0	0	114.4
503	I	31.6	Very low	31	Very low	165 Å²	165	116.5 Å²	116.5	85%	0.846	77%	0.771	S	S	*	*			trans	-86.3	129.8	162.4	-61.5	176	0	0	0	108.5	G501 A505	G501-I503 PolarHBondContact O-N 3.03Å; I503-A505 PolarHBondContact O-N 2.91Å
504	V	31.9	Very low	31.3	Very low	133 Å²	133	118.5 Å²	118.5	81%	0.806	77%	0.771	S	S	*	*			trans	-76.8	114.2	178.7	179.2	0	0	0	0	110.1
505	A	29.1	Very low	32.3	Very low	91 Å²	91	111.9 Å²	111.9	75%	0.752	74%	0.743	S	S	*	*			trans	-78.8	124.4	173.6	0	0	0	0	0	111.2	I503	I503-A505 PolarHBondContact O-N 2.91Å
506	V	31.5	Very low	33.2	Very low	128 Å²	128	111.9 Å²	111.9	78%	0.776	73%	0.734	S	S	*	*			trans	-86.1	129.7	169.6	-179.8	0	0	0	0	108.6	A508	V506-A508 PolarHBondContact O-N 3.36Å
507	P	29.4	Very low	34.6	Very low	118 Å²	118	106.8 Å²	106.8	77%	0.766	70%	0.701	S	S	*	*			trans	-72.1	113.5	179.1	28.5	-33.6	0	0	0	110.8	N509	P507-N509 PolarHBondContact O-N 3.47Å
508	A	25.3	Very low	37.1	Very low	105 Å²	105	108.2 Å²	108.2	87%	0.868	69%	0.692	S	S	*	*			trans	-71.2	116.9	172.7	0	0	0	0	0	110.4	V506	V506-A508 PolarHBondContact O-N 3.36Å
509	N	28.2	Very low	39.9	Very low	138 Å²	138	99.3 Å²	99.3	74%	0.738	65%	0.651	S	S	*	*			trans	-146.1	127.8	171	-162.6	9.1	0	0	0	111.7	P507	P507-N509 PolarHBondContact O-N 3.47Å
510	T	29.1	Very low	42.8	Very low	123 Å²	123	97 Å²	97	76%	0.755	63%	0.632	S	S	*	*			trans	43.6	104.4	172.9	46.9	0	0	0	0	117.3	C512	T510-C512 PolarHBondContact O-N 2.91Å
511	G	26.4	Very low	45.6	Very low	92 Å²	92	91.5 Å²	91.5	95%	0.948	60%	0.598	S	S	*	*			trans	-63.6	121.8	175	0	0	0	0	0	113.1
512	C	29.5	Very low	48.4	Very low	79 Å²	79	90.8 Å²	90.8	53%	0.534	58%	0.579	S	S	.	*			trans	-112.2	146.4	157.6	-177.6	0	0	0	0	106.5	T510 E514	T510-C512 PolarHBondContact O-N 2.91Å; C512-E514 PolarHBondContact O-N 2.8Å
513	C	35.4	Very low	51.5	Low	47 Å²	47	87.5 Å²	87.5	32%	0.318	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-69.8	116.3	166.4	72.8	0	0	0	0	108.3	S515 P949	C513-S515 PolarHBondContact O-N 2.96Å; C513-P949 PolarHBondContact SG-O 3.33Å; C513-P949 VanDerWaalsContact SG-O 3.35Å
514	E	38.4	Very low	54.5	Low	171 Å²	171	79.6 Å²	79.6	80%	0.799	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-67.8	130.8	170.7	-67	-168.7	130.3	0	0	108	C512 L516	C512-E514 PolarHBondContact O-N 2.8Å; E514-L516 PolarHBondContact O-N 3.38Å
515	S	48.7	Very low	57.4	Low	38 Å²	38	76.8 Å²	76.8	27%	0.266	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-67.5	131.1	-176	-170.4	0	0	0	0	110	C513 G517 Q942	C513-S515 PolarHBondContact O-N 2.96Å; S515-G517 PolarHBondContact O-N 3.18Å; S515-G517 VanDerWaalsContact O-N 3.1Å; S515-G517 PolarHBondContact OG-N 2.92Å; S515-Q942 PolarHBondContact OG-OE1 3.21Å; S515-Q942 VanDerWaalsContact OG-OE1 3.06Å
516	L	53.2	Low	60.4	Low	104 Å²	104	72.7 Å²	72.7	55%	0.545	44%	0.443	S	S	.	.	S	Bend	trans	-64.2	-7	172.5	-93.5	163.2	0	0	0	113.5	E514 Q990 A1031	E514-L516 PolarHBondContact O-N 3.38Å; L516-Q990 WeakPolarHBondContact O-CG 3.36Å; L516-Q990 PolarHBondContact O-NE2 2.93Å; L516-Q990 VanDerWaalsContact O-NE2 3.14Å; L516-A1031 HydrophobicContact CD2-CB 3.59Å; L516-A1031 HydrophobicContact CG-CB 4.44Å
517	G	66	Low	63.4	Low	20 Å²	20	66.6 Å²	66.6	21%	0.206	41%	0.406	C	S	.	.	S	Bend	trans	-128.7	174.3	-178.8	0	0	0	0	0	114.2	S515 L519 Q990	S515-G517 PolarHBondContact O-N 3.18Å; S515-G517 VanDerWaalsContact O-N 3.1Å; S515-G517 PolarHBondContact OG-N 2.92Å; G517-L519 PolarHBondContact O-N 2.91Å; G517-Q990 WeakPolarHBondContact CA-O 3.33Å
518	I	85.4	Confident	66.4	Low	97 Å²	97	63 Å²	63	50%	0.497	38%	0.38	S	S	.	.	S	Bend	trans	-72.8	-14.4	-168.7	-53.1	173	0	0	0	112.9	P903 Q990	I518-P903 HydrophobicContact CG2-CB 3.68Å; I518-P903 HydrophobicContact CG2-CG 4.36Å; I518-Q990 PolarHBondContact N-O 3.45Å
519	L	91.7	Very high	69.6	Low	3 Å²	3	61.6 Å²	61.6	2%	0.016	36%	0.36	C	S	.	.			trans	-79.2	120.1	-176.5	-169.9	76.4	0	0	0	112.3	G517 M523 M524 P883 W944 V988 I994	G517-L519 PolarHBondContact O-N 2.91Å; L519-M523 HydrophobicContact CD1-CB 3.59Å; L519-M523 HydrophobicContact CD1-SD 4.22Å; L519-M523 HydrophobicContact CG-CB 4.32Å; L519-M524 HydrophobicContact CD2-CB 4.15Å; L519-M524 HydrophobicContact CD2-CG 4.5Å; L519-M524 HydrophobicContact CD2-SD 3.95Å; L519-P883 HydrophobicContact CD1-CB 4.14Å; L519-P883 HydrophobicContact CD1-CG 3.79Å; L519-W944 HydrophobicContact CB-CZ2 4.38Å; L519-W944 HydrophobicContact CD2-CH2 4.2Å; L519-W944 HydrophobicContact CD2-CZ2 4.08Å; L519-W944 HydrophobicContact CG-CH2 4.37Å; L519-W944 HydrophobicContact CG-CZ2 4.43Å; L519-W944 WeakPolarHBondContact O-CH2 3.24Å; L519-V988 HydrophobicContact CB-CG1 4.07Å; L519-V988 HydrophobicContact CD2-CB 4.39Å; L519-V988 HydrophobicContact CD2-CG1 3.69Å; L519-V988 HydrophobicContact CD2-CG2 3.75Å; L519-I994 HydrophobicContact CD1-CD1 3.98Å; L519-I994 HydrophobicContact CD1-CG1 4.39Å; L519-I994 HydrophobicContact CD2-CD1 3.86Å; L519-I994 HydrophobicContact CD2-CG1 3.94Å
520	T	92.3	Very high	72.4	Confident	67 Å²	67	58.2 Å²	58.2	41%	0.411	34%	0.342	S	S	.	.			trans	-89.4	160	174.5	71.9	0	0	0	0	112.4	D522 M523 M524	T520-D522 PolarHBondContact O-N 3.24Å; T520-M523 HydrophobicContact CG2-CE 4.34Å; T520-M523 HydrophobicContact CG2-SD 4.16Å; T520-M523 PolarHBondContact N-SD 3.4Å; T520-M523 WeakPolarHBondContact O-CB 3.23Å; T520-M523 PolarHBondContact O-N 2.8Å; T520-M523 VanDerWaalsContact O-N 3.1Å; T520-M523 WeakPolarHBondContact OG1-CG 3.32Å; T520-M523 PolarHBondContact OG1-N 2.96Å; T520-M524 PolarHBondContact O-N 2.95Å
521	R	92.9	Very high	75.2	Confident	58 Å²	58	56.2 Å²	56.2	22%	0.219	32%	0.321	C	S	.	.	H	α-helix	trans	-55.9	-37.2	174.5	-65	-166.8	61.1	168.9	-4.6	112.4	M524 R525 W944 D947 V948 E969	R521-M524 PolarHBondContact O-N 2.7Å; R521-R525 VanDerWaalsContact O-CG 3.25Å; R521-R525 WeakPolarHBondContact O-CG 3.32Å; R521-R525 PolarHBondContact O-N 3.01Å; R521-W944 HydrophobicContact CG-CZ3 4.28Å; R521-D947 WeakPolarHBondContact CD-O 3.41Å; R521-D947 WeakPolarHBondContact CG-O 3.18Å; R521-D947 IonicContact CZ-OD1 3.66Å; R521-D947 IonicContact CZ-OD2 3.22Å; R521-D947 PolarHBondContact NE-O 2.97Å; R521-D947 IonicContact NE-OD2 3.43Å; R521-D947 PolarHBondContact NE-OD2 3.12Å; R521-D947 VanDerWaalsContact NE-OD2 3.11Å; R521-D947 IonicContact NH2-OD1 3.09Å; R521-D947 PolarHBondContact NH2-OD1 2.83Å; R521-D947 IonicContact NH2-OD2 2.68Å; R521-D947 PolarHBondContact NH2-OD2 3.1Å; R521-V948 VanDerWaalsContact NH2-CG2 3.28Å; R521-E969 PolarHBondContact NH2-O 3.32Å; R521-E969 VanDerWaalsContact NH2-O 3.11Å
522	D	92	Very high	78.2	Confident	47 Å²	47	56.1 Å²	56.1	25%	0.251	29%	0.292	S	S	.	.	H	α-helix	trans	-73.8	-29.3	177.7	-73.6	-62.4	0	0	0	113.3	T520 R525 A526 Y890 K898 I900	T520-D522 PolarHBondContact O-N 3.24Å; D522-R525 VanDerWaalsContact CG-NH1 3.29Å; D522-R525 IonicContact OD1-CZ 2.8Å; D522-R525 IonicContact OD1-NH1 2.72Å; D522-R525 PolarHBondContact OD1-NH1 2.66Å; D522-R525 IonicContact OD2-NH1 3.41Å; D522-R525 PolarHBondContact OD2-NH1 3.42Å; D522-A526 PolarHBondContact O-N 3.21Å; D522-Y890 HydrophobicContact CB-CE1 4.14Å; D522-Y890 WeakPolarHBondContact O-CE1 3.43Å; D522-Y890 PolarHBondContact OD1-OH 2.94Å; D522-K898 IonicContact OD1-NZ 2.79Å; D522-K898 PolarHBondContact OD1-NZ 3.02Å; D522-K898 IonicContact OD2-NZ 3.93Å; D522-I900 HydrophobicContact CB-CG2 4.06Å
523	M	93.2	Very high	81.3	Confident	13 Å²	13	52.8 Å²	52.8	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-66.6	-43.7	167.4	-68.8	166.6	177.8	0	0	111.7	L519 T520 R525 A526 Y527 L886 T901	L519-M523 HydrophobicContact CD1-CB 3.59Å; L519-M523 HydrophobicContact CD1-SD 4.22Å; L519-M523 HydrophobicContact CG-CB 4.32Å; T520-M523 HydrophobicContact CG2-CE 4.34Å; T520-M523 HydrophobicContact CG2-SD 4.16Å; T520-M523 PolarHBondContact N-SD 3.4Å; T520-M523 WeakPolarHBondContact O-CB 3.23Å; T520-M523 PolarHBondContact O-N 2.8Å; T520-M523 VanDerWaalsContact O-N 3.1Å; T520-M523 WeakPolarHBondContact OG1-CG 3.32Å; T520-M523 PolarHBondContact OG1-N 2.96Å; M523-R525 VanDerWaalsContact C-N 3.33Å; M523-R525 PolarHBondContact O-N 3.49Å; M523-A526 WeakPolarHBondContact O-CB 3.41Å; M523-A526 PolarHBondContact O-N 3.26Å; M523-Y527 PolarHBondContact O-N 2.97Å; M523-L886 HydrophobicContact CB-CD1 3.79Å; M523-L886 HydrophobicContact CG-CD1 4.12Å; M523-T901 WeakPolarHBondContact CE-O 3.32Å
524	M	94.5	Very high	84.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-40.2	176.6	-171.4	60.7	173.5	0	0	111.2	L519 T520 R521 A526 Y527 L528 W944 G946 D947 I994	L519-M524 HydrophobicContact CD2-CB 4.15Å; L519-M524 HydrophobicContact CD2-CG 4.5Å; L519-M524 HydrophobicContact CD2-SD 3.95Å; T520-M524 PolarHBondContact O-N 2.95Å; R521-M524 PolarHBondContact O-N 2.7Å; M524-A526 PolarHBondContact O-N 3.39Å; M524-Y527 HydrophobicContact CE-CD1 4.26Å; M524-Y527 HydrophobicContact CE-CE1 4.33Å; M524-Y527 PolarHBondContact O-N 3.48Å; M524-Y527 HydrophobicContact SD-CD1 3.77Å; M524-Y527 HydrophobicContact SD-CE1 4.36Å; M524-L528 HydrophobicContact CE-CD1 4.21Å; M524-L528 HydrophobicContact CE-CD2 4.26Å; M524-L528 HydrophobicContact CE-CG 4.25Å; M524-L528 HydrophobicContact CG-CD1 3.99Å; M524-L528 HydrophobicContact CG-CG 4.39Å; M524-L528 WeakPolarHBondContact O-CB 3.45Å; M524-L528 VanDerWaalsContact O-CG 3.23Å; M524-L528 WeakPolarHBondContact O-CG 3.45Å; M524-L528 PolarHBondContact O-N 2.97Å; M524-L528 HydrophobicContact SD-CG 4.48Å; M524-W944 HydrophobicContact CB-CE3 4.03Å; M524-W944 HydrophobicContact CB-CH2 4.39Å; M524-W944 HydrophobicContact CB-CZ3 3.64Å; M524-W944 HydrophobicContact CE-CB 4.26Å; M524-W944 HydrophobicContact CG-CE3 3.69Å; M524-W944 HydrophobicContact CG-CZ3 3.86Å; M524-G946 WeakPolarHBondContact CE-O 3.39Å; M524-G946 VanDerWaalsContact CG-O 3.3Å; M524-G946 WeakPolarHBondContact CG-O 3.42Å; M524-D947 HydrophobicContact CG-CB 4.49Å; M524-I994 HydrophobicContact CE-CG2 4.36Å; M524-I994 HydrophobicContact SD-CD1 3.83Å; M524-I994 HydrophobicContact SD-CG2 4.35Å
525	R	93.9	Very high	86.8	Confident	73 Å²	73	43.2 Å²	43.2	28%	0.275	22%	0.22	S	C	.	.	H	α-helix	trans	-59.5	-43.7	171.3	-72.3	167.3	-167.7	148.7	3.9	112.5	R521 D522 M523 L528 V529 Y890 D947	R521-R525 VanDerWaalsContact O-CG 3.25Å; R521-R525 WeakPolarHBondContact O-CG 3.32Å; R521-R525 PolarHBondContact O-N 3.01Å; D522-R525 VanDerWaalsContact CG-NH1 3.29Å; D522-R525 IonicContact OD1-CZ 2.8Å; D522-R525 IonicContact OD1-NH1 2.72Å; D522-R525 PolarHBondContact OD1-NH1 2.66Å; D522-R525 IonicContact OD2-NH1 3.41Å; D522-R525 PolarHBondContact OD2-NH1 3.42Å; M523-R525 VanDerWaalsContact C-N 3.33Å; M523-R525 PolarHBondContact O-N 3.49Å; R525-L528 PolarHBondContact O-N 3.09Å; R525-V529 WeakPolarHBondContact O-CG2 3.24Å; R525-V529 PolarHBondContact O-N 3.02Å; R525-V529 VanDerWaalsContact O-N 3.08Å; R525-Y890 HydrophobicContact CB-CE2 3.85Å; R525-Y890 WeakPolarHBondContact CB-OH 3.41Å; R525-Y890 WeakPolarHBondContact CD-OH 3.45Å; R525-D947 HydrophobicContact CG-CB 3.76Å; R525-D947 IonicContact CZ-OD2 3.92Å; R525-D947 IonicContact NE-OD2 2.83Å; R525-D947 PolarHBondContact NE-OD2 2.86Å; R525-D947 IonicContact NH2-OD2 2.85Å; R525-D947 PolarHBondContact NH2-OD2 2.84Å
526	A	92.5	Very high	89.1	Confident	5 Å²	5	41.4 Å²	41.4	4%	0.041	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-46.2	177.8	0	0	0	0	0	111.8	D522 M523 M524 V529 D530 L886 Y890 I900	D522-A526 PolarHBondContact O-N 3.21Å; M523-A526 WeakPolarHBondContact O-CB 3.41Å; M523-A526 PolarHBondContact O-N 3.26Å; M524-A526 PolarHBondContact O-N 3.39Å; A526-V529 PolarHBondContact O-N 2.9Å; A526-D530 PolarHBondContact O-N 2.94Å; A526-L886 HydrophobicContact CB-CD2 3.94Å; A526-Y890 HydrophobicContact CB-CD1 3.82Å; A526-Y890 HydrophobicContact CB-CD2 4.02Å; A526-Y890 HydrophobicContact CB-CE1 4.46Å; A526-Y890 HydrophobicContact CB-CG 3.56Å; A526-I900 HydrophobicContact CB-CD1 3.7Å
527	Y	94	Very high	91.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-42.3	173.9	162.6	-103.8	0	0	0	113.1	M523 M524 V529 D530 R531 D533 F881 I994	M523-Y527 PolarHBondContact O-N 2.97Å; M524-Y527 HydrophobicContact CE-CD1 4.26Å; M524-Y527 HydrophobicContact CE-CE1 4.33Å; M524-Y527 PolarHBondContact O-N 3.48Å; M524-Y527 HydrophobicContact SD-CD1 3.77Å; M524-Y527 HydrophobicContact SD-CE1 4.36Å; Y527-V529 VanDerWaalsContact C-N 3.25Å; Y527-V529 PolarHBondContact O-N 3.41Å; Y527-D530 CarbonylContact O-C 3.46Å; Y527-D530 PolarHBondContact O-N 3.39Å; Y527-R531 HydrophobicContact CE2-CG 4.5Å; Y527-R531 WeakPolarHBondContact O-CA 3.2Å; Y527-R531 WeakPolarHBondContact O-CG 3.41Å; Y527-R531 PolarHBondContact O-N 3.33Å; Y527-R531 PolarHBondContact OH-NH1 3.19Å; Y527-D533 VanDerWaalsContact CE2-OD1 3.27Å; Y527-D533 WeakPolarHBondContact CE2-OD1 3.39Å; Y527-D533 PolarHBondContact OH-OD1 2.56Å; Y527-F881 HydrophobicContact CD2-CB 3.99Å; Y527-F881 AromaticContact CD2-CD1 3.45Å; Y527-F881 HydrophobicContact CD2-CD1 3.45Å; Y527-F881 VanDerWaalsContact CD2-CD1 3.45Å; Y527-F881 HydrophobicContact CD2-CD2 4.17Å; Y527-F881 AromaticContact CD2-CE1 3.89Å; Y527-F881 HydrophobicContact CD2-CE1 3.89Å; Y527-F881 AromaticContact CD2-CG 3.59Å; Y527-F881 HydrophobicContact CD2-CG 3.59Å; Y527-F881 HydrophobicContact CD2-CZ 4.43Å; Y527-F881 HydrophobicContact CE2-CB 3.65Å; Y527-F881 HydrophobicContact CE2-CD1 4.03Å; Y527-F881 HydrophobicContact CE2-CD2 4.37Å; Y527-F881 AromaticContact CE2-CG 3.76Å; Y527-F881 HydrophobicContact CE2-CG 3.76Å; Y527-F881 HydrophobicContact CG-CD1 4.12Å; Y527-F881 HydrophobicContact CG-CE1 4.4Å; Y527-I994 HydrophobicContact CD1-CD1 3.65Å; Y527-I994 HydrophobicContact CD1-CG2 4.23Å; Y527-I994 HydrophobicContact CD2-CD1 4.23Å; Y527-I994 HydrophobicContact CE1-CD1 4.21Å; Y527-I994 HydrophobicContact CE1-CG2 3.74Å; Y527-I994 HydrophobicContact CG-CD1 3.67Å
528	L	93	Very high	92.7	Very high	42 Å²	42	36 Å²	36	22%	0.22	17%	0.174	C	C	.	.	H	α-helix	trans	-70.6	-18.2	179.7	-72.5	172.4	0	0	0	113.9	M524 R525 G946 D947 P984	M524-L528 HydrophobicContact CE-CD1 4.21Å; M524-L528 HydrophobicContact CE-CD2 4.26Å; M524-L528 HydrophobicContact CE-CG 4.25Å; M524-L528 HydrophobicContact CG-CD1 3.99Å; M524-L528 HydrophobicContact CG-CG 4.39Å; M524-L528 WeakPolarHBondContact O-CB 3.45Å; M524-L528 VanDerWaalsContact O-CG 3.23Å; M524-L528 WeakPolarHBondContact O-CG 3.45Å; M524-L528 PolarHBondContact O-N 2.97Å; M524-L528 HydrophobicContact SD-CG 4.48Å; R525-L528 PolarHBondContact O-N 3.09Å; L528-G946 VanDerWaalsContact CD1-C 3.42Å; L528-D947 HydrophobicContact CD1-CB 4.45Å; L528-P984 HydrophobicContact CD2-CG 3.89Å
529	V	90.9	Very high	93.3	Very high	77 Å²	77	31.6 Å²	31.6	47%	0.467	15%	0.151	S	C	.	.	H	α-helix	trans	-84.2	-30	171.5	168.6	0	0	0	0	111.8	R525 A526 Y527	R525-V529 WeakPolarHBondContact O-CG2 3.24Å; R525-V529 PolarHBondContact O-N 3.02Å; R525-V529 VanDerWaalsContact O-N 3.08Å; A526-V529 PolarHBondContact O-N 2.9Å; Y527-V529 VanDerWaalsContact C-N 3.25Å; Y527-V529 PolarHBondContact O-N 3.41Å
530	D	87.1	Confident	93.6	Very high	67 Å²	67	31.4 Å²	31.4	36%	0.358	15%	0.15	S	C	.	.	S	Bend	trans	-140.9	78.9	-174.5	-166.7	-13.1	0	0	0	110.4	A526 Y527 R532	A526-D530 PolarHBondContact O-N 2.94Å; Y527-D530 CarbonylContact O-C 3.46Å; Y527-D530 PolarHBondContact O-N 3.39Å; D530-R532 VanDerWaalsContact C-N 3.3Å; D530-R532 VanDerWaalsContact CG-NE 3.25Å; D530-R532 PolarHBondContact O-N 3.18Å; D530-R532 WeakPolarHBondContact OD1-CG 3.14Å; D530-R532 IonicContact OD1-CZ 2.75Å; D530-R532 IonicContact OD1-NE 3.31Å; D530-R532 PolarHBondContact OD1-NE 3.06Å; D530-R532 IonicContact OD1-NH2 3.67Å; D530-R532 IonicContact OD2-CZ 3.73Å; D530-R532 VanDerWaalsContact OD2-CZ 3.31Å; D530-R532 IonicContact OD2-NE 2.81Å; D530-R532 PolarHBondContact OD2-NE 3.29Å; D530-R532 VanDerWaalsContact OD2-NE 3.09Å; D530-R532 IonicContact OD2-NH2 2.7Å; D530-R532 PolarHBondContact OD2-NH2 3.18Å
531	R	88.5	Confident	93.8	Very high	81 Å²	81	28.6 Å²	28.6	31%	0.306	13%	0.134	S	C	.	.			trans	-75.6	70.5	-171.8	-70.5	-178.1	175.1	-95.9	16	113.1	Y527 D533	Y527-R531 HydrophobicContact CE2-CG 4.5Å; Y527-R531 WeakPolarHBondContact O-CA 3.2Å; Y527-R531 WeakPolarHBondContact O-CG 3.41Å; Y527-R531 PolarHBondContact O-N 3.33Å; Y527-R531 PolarHBondContact OH-NH1 3.19Å; R531-D533 PolarHBondContact O-N 3.08Å
532	R	89.6	Confident	94.1	Very high	89 Å²	89	29.6 Å²	29.6	34%	0.336	14%	0.14	S	C	.	.			trans	-81.1	54.2	177	-52.1	-166.5	-168.4	-164.5	5.8	112.6	D530 E566 G567 L570 F881	D530-R532 VanDerWaalsContact C-N 3.3Å; D530-R532 VanDerWaalsContact CG-NE 3.25Å; D530-R532 PolarHBondContact O-N 3.18Å; D530-R532 WeakPolarHBondContact OD1-CG 3.14Å; D530-R532 IonicContact OD1-CZ 2.75Å; D530-R532 IonicContact OD1-NE 3.31Å; D530-R532 PolarHBondContact OD1-NE 3.06Å; D530-R532 IonicContact OD1-NH2 3.67Å; D530-R532 IonicContact OD2-CZ 3.73Å; D530-R532 VanDerWaalsContact OD2-CZ 3.31Å; D530-R532 IonicContact OD2-NE 2.81Å; D530-R532 PolarHBondContact OD2-NE 3.29Å; D530-R532 VanDerWaalsContact OD2-NE 3.09Å; D530-R532 IonicContact OD2-NH2 2.7Å; D530-R532 PolarHBondContact OD2-NH2 3.18Å; R532-E566 HydrophobicContact CB-CB 4.34Å; R532-E566 HydrophobicContact CG-CB 4.33Å; R532-G567 WeakPolarHBondContact O-CA 3.48Å; R532-G567 PolarHBondContact O-N 3.26Å; R532-L570 HydrophobicContact CB-CD1 3.99Å; R532-F881 HydrophobicContact CB-CE2 4.42Å; R532-F881 WeakPolarHBondContact O-CD2 3.38Å
533	D	93.4	Very high	94.3	Very high	9 Å²	9	27.7 Å²	27.7	5%	0.048	13%	0.13	C	C	.	.			trans	-56.2	141.7	176.5	-73.6	-29.2	0	0	0	111.1	Y527 R531 I535 G565 G567	Y527-D533 VanDerWaalsContact CE2-OD1 3.27Å; Y527-D533 WeakPolarHBondContact CE2-OD1 3.39Å; Y527-D533 PolarHBondContact OH-OD1 2.56Å; R531-D533 PolarHBondContact O-N 3.08Å; D533-I535 HydrophobicContact CB-CD1 4.46Å; D533-I535 HydrophobicContact CB-CG1 3.91Å; D533-G565 CarbonylContact O-C 3.53Å; D533-G565 WeakPolarHBondContact O-CA 3.35Å; D533-G567 PolarHBondContact O-N 2.68Å
534	Q	94.6	Very high	94.5	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.019	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	107.7	159.9	-73.8	177	0.5	0	0	107.4	G567 W568 W880	Q534-G567 PolarHBondContact NE2-O 2.77Å; Q534-W568 HydrophobicContact CB-CD2 4.26Å; Q534-W568 HydrophobicContact CB-CZ2 4.1Å; Q534-W568 HydrophobicContact CG-CD2 4.06Å; Q534-W568 HydrophobicContact CG-CE3 4.27Å; Q534-W568 HydrophobicContact CG-CG 4.37Å; Q534-W880 HydrophobicContact CB-CD2 4.23Å; Q534-W880 HydrophobicContact CB-CZ2 3.87Å; Q534-W880 PolarHBondContact N-O 3.37Å; Q534-W880 PolarHBondContact O-N 2.78Å; Q534-W880 VanDerWaalsContact O-N 3.12Å
535	I	95.6	Very high	94.5	Very high	13 Å²	13	28.9 Å²	28.9	7%	0.067	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.6	179.5	-49.8	178.6	0	0	0	108.9	D533 I537 R564 W568 E877 Y878 R879	D533-I535 HydrophobicContact CB-CD1 4.46Å; D533-I535 HydrophobicContact CB-CG1 3.91Å; I535-I537 HydrophobicContact CG2-CG1 4.11Å; I535-R564 WeakPolarHBondContact CA-O 3.19Å; I535-R564 HydrophobicContact CB-CB 3.9Å; I535-R564 VanDerWaalsContact CB-O 3.26Å; I535-R564 WeakPolarHBondContact CB-O 3.34Å; I535-R564 HydrophobicContact CG2-CB 4.13Å; I535-R564 PolarHBondContact N-O 3.49Å; I535-R564 PolarHBondContact O-N 2.97Å; I535-R564 VanDerWaalsContact O-O 3.09Å; I535-W568 PolarHBondContact O-NE1 3.18Å; I535-E877 HydrophobicContact CG2-CG 4.15Å; I535-Y878 WeakPolarHBondContact CA-O 3.48Å; I535-R879 HydrophobicContact CB-CG 4.49Å; I535-R879 HydrophobicContact CG1-CG 4.03Å; I535-R879 HydrophobicContact CG2-CG 4.15Å
536	L	96.6	Very high	94.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.4	176.7	175.6	68.4	0	0	0	109.3	V561 L563 W568 L683 M685 F696 E877 Y878 W880	L536-V561 HydrophobicContact CD1-CG1 3.49Å; L536-V561 VanDerWaalsContact CD1-CG1 3.49Å; L536-L563 HydrophobicContact CD1-CD2 3.83Å; L536-W568 HydrophobicContact CB-CZ2 4.3Å; L536-L683 HydrophobicContact CD1-CD2 4.24Å; L536-L683 HydrophobicContact CD2-CD2 4.26Å; L536-M685 HydrophobicContact CD1-CE 4.05Å; L536-M685 HydrophobicContact CD1-SD 3.67Å; L536-M685 HydrophobicContact CD2-SD 3.6Å; L536-M685 VanDerWaalsContact CD2-SD 3.6Å; L536-M685 HydrophobicContact CG-SD 4.3Å; L536-F696 HydrophobicContact CD2-CB 4.02Å; L536-F696 HydrophobicContact CD2-CD1 3.55Å; L536-F696 HydrophobicContact CD2-CD2 3.54Å; L536-F696 HydrophobicContact CD2-CE1 3.78Å; L536-F696 HydrophobicContact CD2-CE2 3.8Å; L536-F696 HydrophobicContact CD2-CG 3.41Å; L536-F696 VanDerWaalsContact CD2-CG 3.41Å; L536-F696 HydrophobicContact CD2-CZ 3.91Å; L536-E877 WeakPolarHBondContact O-CA 3.47Å; L536-Y878 HydrophobicContact CD2-CD2 4.25Å; L536-Y878 PolarHBondContact N-O 2.93Å; L536-Y878 PolarHBondContact O-N 2.79Å; L536-W880 HydrophobicContact CB-CH2 3.93Å; L536-W880 HydrophobicContact CB-CZ3 3.88Å; L536-W880 HydrophobicContact CD2-CH2 4.3Å; L536-W880 HydrophobicContact CD2-CZ3 4.41Å
537	I	96.9	Very high	94.7	Very high	10 Å²	10	26.6 Å²	26.6	5%	0.051	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.6	179.5	-52.8	175.9	0	0	0	109.4	I535 L539 V561 Y562 R564 R875 A876 E877	I535-I537 HydrophobicContact CG2-CG1 4.11Å; I537-L539 HydrophobicContact CG2-CD2 3.58Å; I537-L539 HydrophobicContact CG2-CG 4.04Å; I537-V561 CarbonylContact O-C 3.55Å; I537-V561 VanDerWaalsContact O-CA 3.3Å; I537-V561 WeakPolarHBondContact O-CA 3.3Å; I537-Y562 PolarHBondContact N-O 3.37Å; I537-Y562 PolarHBondContact O-N 2.96Å; I537-R564 HydrophobicContact CD1-CB 4.47Å; I537-R564 HydrophobicContact CD1-CG 3.89Å; I537-R875 HydrophobicContact CG2-CG 3.93Å; I537-A876 WeakPolarHBondContact CA-O 3.5Å; I537-E877 HydrophobicContact CG1-CG 4.29Å
538	I	97.6	Very high	94.7	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	109.9	171.7	-50.5	176.2	0	0	0	108.1	C560 M640 L683 F696 A876 Y878	I538-C560 WeakPolarHBondContact CA-O 3.35Å; I538-M640 HydrophobicContact CG2-CE 4.05Å; I538-L683 HydrophobicContact CD1-CB 3.98Å; I538-L683 HydrophobicContact CD1-CD2 3.66Å; I538-L683 HydrophobicContact CD1-CG 4.48Å; I538-L683 HydrophobicContact CG1-CD2 3.91Å; I538-F696 HydrophobicContact CD1-CB 4.17Å; I538-A876 HydrophobicContact CB-CB 4.35Å; I538-A876 PolarHBondContact N-O 2.95Å; I538-A876 PolarHBondContact O-N 3.28Å; I538-Y878 HydrophobicContact CD1-CE2 4.36Å
539	L	97.8	Very high	94.8	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.021	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.3	172.9	-53.7	-171.3	0	0	0	110.8	I537 P559 C560 Y562 W757 D874 R875	I537-L539 HydrophobicContact CG2-CD2 3.58Å; I537-L539 HydrophobicContact CG2-CG 4.04Å; L539-P559 WeakPolarHBondContact O-CA 3.47Å; L539-C560 PolarHBondContact N-O 3.47Å; L539-C560 PolarHBondContact O-N 2.84Å; L539-Y562 HydrophobicContact CD1-CD2 4.44Å; L539-Y562 HydrophobicContact CD1-CE2 3.72Å; L539-Y562 HydrophobicContact CG-CD2 4.37Å; L539-Y562 HydrophobicContact CG-CE2 4.04Å; L539-W757 HydrophobicContact CB-CH2 3.58Å; L539-W757 HydrophobicContact CB-CZ2 3.65Å; L539-W757 HydrophobicContact CB-CZ3 4.49Å; L539-W757 HydrophobicContact CD1-CH2 4.41Å; L539-D874 WeakPolarHBondContact CA-O 3.47Å; L539-R875 HydrophobicContact CD2-CB 3.66Å; L539-R875 HydrophobicContact CD2-CG 3.67Å
540	H	98.1	Very high	94.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	172.4	-179.4	63	97.6	0	0	0	112.2	P559 L681 S698 R699 I701 T873 D874	H540-P559 HydrophobicContact CB-CB 4.26Å; H540-P559 HydrophobicContact CB-CG 4.45Å; H540-L681 HydrophobicContact CB-CD1 4.1Å; H540-S698 WeakPolarHBondContact NE2-CB 3.34Å; H540-R699 PolarHBondContact CE1-O 3.35Å; H540-R699 PolarHBondContact NE2-N 3.48Å; H540-R699 VanDerWaalsContact NE2-N 3.11Å; H540-I701 HydrophobicContact CB-CD1 4.28Å; H540-I701 WeakPolarHBondContact ND1-CD1 3.37Å; H540-I701 WeakPolarHBondContact ND1-CG1 3.17Å; H540-T873 CarbonylContact O-C 3.52Å; H540-T873 VanDerWaalsContact O-CA 3.25Å; H540-T873 WeakPolarHBondContact O-CA 3.32Å; H540-T873 WeakPolarHBondContact O-CB 3.33Å; H540-D874 PolarHBondContact N-O 2.95Å; H540-D874 VanDerWaalsContact N-O 3.14Å; H540-D874 PolarHBondContact O-N 2.84Å
541	A	98.2	Very high	95.2	Very high	8 Å²	8	35.9 Å²	35.9	7%	0.066	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	148.3	168.4	0	0	0	0	0	111.7	V543 I871	A541-V543 VanDerWaalsContact C-N 3.29Å; A541-V543 WeakPolarHBondContact CB-O 3.44Å; A541-I871 HydrophobicContact CB-CD1 3.56Å; A541-I871 HydrophobicContact CB-CG1 4.1Å
542	K	97.5	Very high	95.4	Very high	78 Å²	78	38 Å²	38	34%	0.339	20%	0.197	S	C	.	.	S	Bend	trans	-74.6	-16.2	173.8	-70.4	-174.5	-171.8	-95.7	0	113.3	I701 K702 S872 T873 D874	K542-I701 WeakPolarHBondContact O-CA 3.39Å; K542-K702 PolarHBondContact O-N 3.48Å; K542-S872 PolarHBondContact N-O 2.84Å; K542-T873 WeakPolarHBondContact CE-O 3.5Å; K542-D874 WeakPolarHBondContact CE-OD2 3.46Å; K542-D874 HydrophobicContact CG-CB 3.85Å; K542-D874 IonicContact NZ-OD1 2.68Å; K542-D874 PolarHBondContact NZ-OD1 3.15Å; K542-D874 IonicContact NZ-OD2 2.82Å; K542-D874 PolarHBondContact NZ-OD2 3.02Å
543	V	96.8	Very high	95.6	Very high	7 Å²	7	37.3 Å²	37.3	4%	0.042	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	152.1	174.9	-50.5	0	0	0	0	112.1	A541 K702 I704 L719 Q822 I871	A541-V543 VanDerWaalsContact C-N 3.29Å; A541-V543 WeakPolarHBondContact CB-O 3.44Å; V543-K702 CarbonylContact C-O 3.53Å; V543-K702 VanDerWaalsContact CA-O 3.3Å; V543-K702 WeakPolarHBondContact CA-O 3.49Å; V543-K702 HydrophobicContact CG1-CB 4.2Å; V543-I704 HydrophobicContact CB-CD1 4.2Å; V543-I704 HydrophobicContact CB-CG1 4.48Å; V543-I704 HydrophobicContact CG2-CD1 3.85Å; V543-L719 HydrophobicContact CG1-CD2 4.34Å; V543-Q822 HydrophobicContact CG1-CB 4.36Å; V543-Q822 HydrophobicContact CG1-CG 3.91Å; V543-Q822 HydrophobicContact CG2-CB 3.88Å; V543-Q822 HydrophobicContact CG2-CG 4.25Å; V543-I871 HydrophobicContact CG2-CD1 3.69Å; V543-I871 HydrophobicContact CG2-CG1 4.03Å
544	A	96.7	Very high	95.7	Very high	5 Å²	5	40.9 Å²	40.9	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	133.6	173.8	0	0	0	0	0	111	F555 F679 I701 K702 I704	A544-F555 HydrophobicContact CB-CD1 3.86Å; A544-F555 HydrophobicContact CB-CE1 3.6Å; A544-F555 HydrophobicContact CB-CZ 4.08Å; A544-F679 HydrophobicContact CB-CE1 3.89Å; A544-F679 HydrophobicContact CB-CZ 3.76Å; A544-I701 HydrophobicContact CB-CG2 3.75Å; A544-K702 PolarHBondContact N-O 2.93Å; A544-I704 WeakPolarHBondContact O-CG1 3.47Å; A544-I704 PolarHBondContact O-N 2.91Å
545	Q	95.7	Very high	95.8	Very high	33 Å²	33	41.5 Å²	41.5	15%	0.154	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	127.4	174.9	-161.5	-170.9	-0.9	0	0	110.7	S547 I704 S705	Q545-S547 PolarHBondContact O-N 2.87Å; Q545-I704 WeakPolarHBondContact CA-O 3.27Å; Q545-S705 WeakPolarHBondContact CG-O 3.39Å; Q545-S705 PolarHBondContact NE2-O 3.36Å
546	K	94.7	Very high	95.8	Very high	29 Å²	29	42.1 Å²	42.1	13%	0.126	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-62.6	128	171.1	172.2	160.8	-80.1	-158.6	0	111.6	Y548 R553 S671 D672 D674 V703 I704	K546-Y548 HydrophobicContact CB-CE2 4.26Å; K546-Y548 HydrophobicContact CD-CE1 4.24Å; K546-Y548 HydrophobicContact CG-CD2 4.38Å; K546-Y548 HydrophobicContact CG-CE1 4.33Å; K546-Y548 HydrophobicContact CG-CE2 3.95Å; K546-Y548 WeakPolarHBondContact O-CD2 3.17Å; K546-Y548 WeakPolarHBondContact O-CE2 3.43Å; K546-R553 WeakPolarHBondContact O-CD 3.32Å; K546-S671 WeakPolarHBondContact CE-O 3.39Å; K546-D672 HydrophobicContact CD-CB 3.65Å; K546-D672 HydrophobicContact CG-CB 3.85Å; K546-D674 PolarHBondContact NZ-O 2.97Å; K546-V703 HydrophobicContact CB-CG1 4.13Å; K546-I704 WeakPolarHBondContact CB-O 3.38Å; K546-I704 PolarHBondContact N-O 2.83Å
547	S	94.8	Very high	95.9	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.007	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-77.6	150.8	167	-51.3	0	0	0	0	110	Q545 E551 R553 I670 S671 D672	Q545-S547 PolarHBondContact O-N 2.87Å; S547-E551 VanDerWaalsContact CB-O 3.3Å; S547-E551 WeakPolarHBondContact CB-O 3.37Å; S547-R553 WeakPolarHBondContact OG-CB 3.21Å; S547-R553 PolarHBondContact OG-N 3.09Å; S547-I670 WeakPolarHBondContact CB-O 3.39Å; S547-I670 PolarHBondContact N-O 2.91Å; S547-I670 PolarHBondContact OG-O 3.12Å; S547-S671 CarbonylContact O-C 3.56Å; S547-D672 WeakPolarHBondContact O-CB 3.32Å; S547-D672 PolarHBondContact O-N 2.72Å
548	Y	95	Very high	95.9	Very high	89 Å²	89	41.9 Å²	41.9	35%	0.349	22%	0.216	S	C	.	.			trans	-125.6	126.7	-177.1	-74.3	-86.5	0	0	0	111.7	K546 T550 E551 D672 S705	K546-Y548 HydrophobicContact CB-CE2 4.26Å; K546-Y548 HydrophobicContact CD-CE1 4.24Å; K546-Y548 HydrophobicContact CG-CD2 4.38Å; K546-Y548 HydrophobicContact CG-CE1 4.33Å; K546-Y548 HydrophobicContact CG-CE2 3.95Å; K546-Y548 WeakPolarHBondContact O-CD2 3.17Å; K546-Y548 WeakPolarHBondContact O-CE2 3.43Å; Y548-T550 PolarHBondContact O-N 2.84Å; Y548-E551 WeakPolarHBondContact O-CB 3.26Å; Y548-E551 PolarHBondContact O-N 2.86Å; Y548-E551 VanDerWaalsContact O-N 3.15Å; Y548-D672 WeakPolarHBondContact CA-OD1 3.38Å; Y548-D672 HydrophobicContact CD1-CB 3.69Å; Y548-D672 HydrophobicContact CE1-CB 3.98Å; Y548-D672 HydrophobicContact CG-CB 4.36Å; Y548-S705 WeakPolarHBondContact OH-CB 3.35Å
549	G	94.3	Very high	95.9	Very high	60 Å²	60	41.9 Å²	41.9	62%	0.619	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	62	-116	-179.8	0	0	0	0	0	111.8	D672	G549-D672 PolarHBondContact N-OD1 2.81Å
550	T	93.8	Very high	95.8	Very high	146 Å²	146	41.7 Å²	41.7	90%	0.896	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-4.7	179	53.8	0	0	0	0	114.2	Y548	Y548-T550 PolarHBondContact O-N 2.84Å
551	E	92.6	Very high	95.8	Very high	87 Å²	87	41.7 Å²	41.7	41%	0.407	22%	0.216	S	C	.	.			trans	-63.9	145.3	172.6	-171.9	179.1	-149	0	0	110.1	S547 Y548 R553	S547-E551 VanDerWaalsContact CB-O 3.3Å; S547-E551 WeakPolarHBondContact CB-O 3.37Å; Y548-E551 WeakPolarHBondContact O-CB 3.26Å; Y548-E551 PolarHBondContact O-N 2.86Å; Y548-E551 VanDerWaalsContact O-N 3.15Å; E551-R553 VanDerWaalsContact CD-NE 3.32Å; E551-R553 HydrophobicContact CG-CG 4.11Å; E551-R553 IonicContact OE1-CZ 3.72Å; E551-R553 VanDerWaalsContact OE1-CZ 3.3Å; E551-R553 IonicContact OE1-NE 3.34Å; E551-R553 PolarHBondContact OE1-NE 2.84Å; E551-R553 IonicContact OE1-NH2 2.85Å; E551-R553 PolarHBondContact OE1-NH2 2.91Å; E551-R553 IonicContact OE2-CZ 3.2Å; E551-R553 VanDerWaalsContact OE2-CZ 3.22Å; E551-R553 IonicContact OE2-NE 3.65Å; E551-R553 PolarHBondContact OE2-NE 2.99Å; E551-R553 IonicContact OE2-NH2 3.58Å; E551-R553 PolarHBondContact OE2-NH2 3.26Å
552	K	93.1	Very high	95.6	Very high	124 Å²	124	41.6 Å²	41.6	54%	0.539	21%	0.213	S	C	.	.			trans	-119.6	102.4	171.1	-65.3	-172.3	178.6	-176	0	110.3	F554 F669	K552-F554 HydrophobicContact CB-CD1 4.49Å; K552-F554 HydrophobicContact CB-CE1 3.91Å; K552-F554 HydrophobicContact CB-CZ 4.1Å; K552-F554 HydrophobicContact CD-CE1 4.4Å; K552-F554 PolarHBondContact O-N 2.87Å; K552-F669 HydrophobicContact CB-CD1 4.45Å; K552-F669 HydrophobicContact CB-CD2 4.36Å; K552-F669 HydrophobicContact CB-CG 4.22Å; K552-F669 HydrophobicContact CD-CD1 4.13Å; K552-F669 HydrophobicContact CD-CE1 3.78Å; K552-F669 HydrophobicContact CD-CE2 4.34Å; K552-F669 HydrophobicContact CD-CZ 3.9Å; K552-F669 HydrophobicContact CG-CD1 4.3Å; K552-F669 HydrophobicContact CG-CD2 4.08Å; K552-F669 HydrophobicContact CG-CE1 4.22Å; K552-F669 HydrophobicContact CG-CE2 3.99Å; K552-F669 HydrophobicContact CG-CG 4.25Å; K552-F669 HydrophobicContact CG-CZ 4.08Å
553	R	93.6	Very high	95.5	Very high	76 Å²	76	38.8 Å²	38.8	29%	0.287	20%	0.202	S	C	.	.			trans	-90.9	91	175	-63.9	-174	175.4	-94.7	-20.9	108.9	K546 S547 E551 F669	K546-R553 WeakPolarHBondContact O-CD 3.32Å; S547-R553 WeakPolarHBondContact OG-CB 3.21Å; S547-R553 PolarHBondContact OG-N 3.09Å; E551-R553 VanDerWaalsContact CD-NE 3.32Å; E551-R553 HydrophobicContact CG-CG 4.11Å; E551-R553 IonicContact OE1-CZ 3.72Å; E551-R553 VanDerWaalsContact OE1-CZ 3.3Å; E551-R553 IonicContact OE1-NE 3.34Å; E551-R553 PolarHBondContact OE1-NE 2.84Å; E551-R553 IonicContact OE1-NH2 2.85Å; E551-R553 PolarHBondContact OE1-NH2 2.91Å; E551-R553 IonicContact OE2-CZ 3.2Å; E551-R553 VanDerWaalsContact OE2-CZ 3.22Å; E551-R553 IonicContact OE2-NE 3.65Å; E551-R553 PolarHBondContact OE2-NE 2.99Å; E551-R553 IonicContact OE2-NH2 3.58Å; E551-R553 PolarHBondContact OE2-NH2 3.26Å; R553-F669 WeakPolarHBondContact O-CB 3.49Å
554	F	95.2	Very high	95.3	Very high	84 Å²	84	41.8 Å²	41.8	37%	0.368	21%	0.213	S	C	.	.			trans	-62.4	144.4	178.2	-55.6	-51.6	0	0	0	111.8	K552 C556 T667 L668 F669	K552-F554 HydrophobicContact CB-CD1 4.49Å; K552-F554 HydrophobicContact CB-CE1 3.91Å; K552-F554 HydrophobicContact CB-CZ 4.1Å; K552-F554 HydrophobicContact CD-CE1 4.4Å; K552-F554 PolarHBondContact O-N 2.87Å; F554-C556 PolarHBondContact O-N 2.81Å; F554-T667 VanDerWaalsContact CD1-C 3.5Å; F554-T667 VanDerWaalsContact CD1-O 3.3Å; F554-T667 WeakPolarHBondContact CD1-O 3.37Å; F554-T667 HydrophobicContact CE1-CG2 4.38Å; F554-T667 WeakPolarHBondContact CE1-O 3.43Å; F554-T667 HydrophobicContact CZ-CG2 4.43Å; F554-L668 CarbonylContact C-O 3.57Å; F554-L668 VanDerWaalsContact CA-O 3.24Å; F554-L668 WeakPolarHBondContact CA-O 3.47Å; F554-F669 HydrophobicContact CD1-CB 4.21Å; F554-F669 HydrophobicContact CD1-CD1 4.49Å; F554-F669 HydrophobicContact CE1-CD1 4.32Å
555	F	96.4	Very high	94.9	Very high	17 Å²	17	43.4 Å²	43.4	8%	0.075	23%	0.23	C	C	.	.			trans	-63.2	134	178.5	-60.5	-16	0	0	0	111	A544 P557 P558 P559 I642 L668 I670 F679 L681	A544-F555 HydrophobicContact CB-CD1 3.86Å; A544-F555 HydrophobicContact CB-CE1 3.6Å; A544-F555 HydrophobicContact CB-CZ 4.08Å; F555-P557 CarbonylContact C-O 3.57Å; F555-P557 CarbonylContact O-C 3.51Å; F555-P558 WeakPolarHBondContact O-CA 3.47Å; F555-P559 HydrophobicContact CB-CG 4.34Å; F555-P559 HydrophobicContact CD2-CG 4Å; F555-I642 HydrophobicContact CE2-CD1 3.89Å; F555-I642 HydrophobicContact CE2-CG1 4.07Å; F555-I642 HydrophobicContact CZ-CD1 3.57Å; F555-I642 HydrophobicContact CZ-CG1 4.17Å; F555-L668 HydrophobicContact CD2-CB 3.61Å; F555-L668 HydrophobicContact CD2-CD1 4.35Å; F555-L668 HydrophobicContact CE2-CB 3.84Å; F555-L668 HydrophobicContact CG-CB 4.27Å; F555-L668 PolarHBondContact N-O 3.32Å; F555-I670 HydrophobicContact CE1-CB 4.16Å; F555-I670 HydrophobicContact CE1-CG2 4.03Å; F555-I670 HydrophobicContact CZ-CB 4.09Å; F555-I670 HydrophobicContact CZ-CG2 4.35Å; F555-F679 HydrophobicContact CE1-CZ 4.35Å; F555-F679 AromaticContact CE2-CE2 3.94Å; F555-F679 HydrophobicContact CE2-CE2 3.94Å; F555-F679 AromaticContact CE2-CZ 3.81Å; F555-F679 HydrophobicContact CE2-CZ 3.81Å; F555-F679 HydrophobicContact CZ-CE1 4.44Å; F555-F679 HydrophobicContact CZ-CE2 4.02Å; F555-F679 AromaticContact CZ-CZ 3.52Å; F555-F679 HydrophobicContact CZ-CZ 3.52Å; F555-L681 HydrophobicContact CE2-CD2 4.08Å
556	C	96.5	Very high	94.5	Very high	26 Å²	26	48.2 Å²	48.2	18%	0.176	25%	0.253	C	S	.	.	S	Bend	trans	-141.1	115.1	-173	-168.8	0	0	0	0	109.8	F554 F730	F554-C556 PolarHBondContact O-N 2.81Å; C556-F730 HydrophobicContact CB-CZ 4.23Å; C556-F730 WeakPolarHBondContact SG-CE2 3.49Å; C556-F730 VanDerWaalsContact SG-CZ 3.56Å
557	P	97.7	Very high	94.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.247	C	C	.	.	S	Bend	cis	-61.4	153.6	-2	29.3	-38.3	0	0	0	113.3	F555 A728 Y742 W757 T873	F555-P557 CarbonylContact C-O 3.57Å; F555-P557 CarbonylContact O-C 3.51Å; P557-A728 HydrophobicContact CG-CB 3.94Å; P557-Y742 HydrophobicContact CB-CD1 4.08Å; P557-Y742 HydrophobicContact CB-CE1 3.84Å; P557-W757 HydrophobicContact CB-CB 4.35Å; P557-W757 HydrophobicContact CB-CD2 3.68Å; P557-W757 HydrophobicContact CB-CE3 4.33Å; P557-W757 HydrophobicContact CB-CG 3.7Å; P557-W757 HydrophobicContact CB-CZ2 4.26Å; P557-W757 HydrophobicContact CG-CD2 3.99Å; P557-W757 HydrophobicContact CG-CE3 4.19Å; P557-W757 HydrophobicContact CG-CG 4.5Å; P557-W757 HydrophobicContact CG-CH2 4.24Å; P557-W757 HydrophobicContact CG-CZ2 4.05Å; P557-W757 HydrophobicContact CG-CZ3 4.34Å; P557-T873 HydrophobicContact CG-CG2 4.35Å
558	P	97.4	Very high	93.8	Very high	4 Å²	4	49 Å²	49	3%	0.026	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-67.8	132.5	178.1	29	-34.9	0	0	0	109.4	F555 C560 K666 Y742 W757	F555-P558 WeakPolarHBondContact O-CA 3.47Å; P558-C560 PolarHBondContact O-N 2.9Å; P558-K666 HydrophobicContact CB-CG 4.19Å; P558-K666 HydrophobicContact CG-CG 4.42Å; P558-Y742 WeakPolarHBondContact CD-OH 3.48Å; P558-W757 PolarHBondContact O-NE1 3.03Å
559	P	97.7	Very high	92.8	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.013	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-54.9	139.8	173.1	-25	34.3	0	0	0	110.9	L539 H540 F555 M640 N664 A665 L668 L681	L539-P559 WeakPolarHBondContact O-CA 3.47Å; H540-P559 HydrophobicContact CB-CB 4.26Å; H540-P559 HydrophobicContact CB-CG 4.45Å; F555-P559 HydrophobicContact CB-CG 4.34Å; F555-P559 HydrophobicContact CD2-CG 4Å; P559-M640 HydrophobicContact CB-SD 3.85Å; P559-N664 CarbonylContact O-C 3.51Å; P559-N664 WeakPolarHBondContact O-CA 3.22Å; P559-A665 PolarHBondContact O-N 2.95Å; P559-L668 HydrophobicContact CB-CD1 4.44Å; P559-L668 HydrophobicContact CG-CD1 4.05Å; P559-L681 HydrophobicContact CB-CD1 3.46Å; P559-L681 VanDerWaalsContact CB-CD1 3.46Å; P559-L681 HydrophobicContact CG-CD1 3.62Å
560	C	96.8	Very high	91.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	156.2	-174.7	64.6	0	0	0	0	112	I538 L539 P558 Y662 S663 N664 W757	I538-C560 WeakPolarHBondContact CA-O 3.35Å; L539-C560 PolarHBondContact N-O 3.47Å; L539-C560 PolarHBondContact O-N 2.84Å; P558-C560 PolarHBondContact O-N 2.9Å; C560-Y662 HydrophobicContact CB-CE2 3.52Å; C560-S663 CarbonylContact C-O 3.59Å; C560-S663 VanDerWaalsContact CA-O 3.28Å; C560-S663 WeakPolarHBondContact CA-O 3.45Å; C560-S663 WeakPolarHBondContact CB-O 3.46Å; C560-N664 HydrophobicContact CB-CB 3.66Å; C560-W757 PolarHBondContact SG-NE1 3.33Å
561	V	96.6	Very high	90.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.6	-177	-178.5	0	0	0	0	108	L536 I537 M640 L654 Y662 S663 L683	L536-V561 HydrophobicContact CD1-CG1 3.49Å; L536-V561 VanDerWaalsContact CD1-CG1 3.49Å; I537-V561 CarbonylContact O-C 3.55Å; I537-V561 VanDerWaalsContact O-CA 3.3Å; I537-V561 WeakPolarHBondContact O-CA 3.3Å; V561-M640 HydrophobicContact CG2-CE 3.49Å; V561-M640 VanDerWaalsContact CG2-CE 3.49Å; V561-L654 HydrophobicContact CB-CD1 4.16Å; V561-L654 HydrophobicContact CG2-CD1 3.53Å; V561-Y662 WeakPolarHBondContact O-CA 3.46Å; V561-Y662 WeakPolarHBondContact O-CD2 3.43Å; V561-S663 PolarHBondContact N-O 3.33Å; V561-S663 PolarHBondContact O-N 2.67Å; V561-L683 HydrophobicContact CG1-CD2 4.01Å; V561-L683 HydrophobicContact CG2-CD1 4.23Å; V561-L683 HydrophobicContact CG2-CD2 3.7Å
562	Y	95.3	Very high	88.5	Confident	5 Å²	5	42.1 Å²	42.1	2%	0.02	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.3	168.2	-58.7	-96.6	0	0	0	110	I537 L539 D661 Y662	I537-Y562 PolarHBondContact N-O 3.37Å; I537-Y562 PolarHBondContact O-N 2.96Å; L539-Y562 HydrophobicContact CD1-CD2 4.44Å; L539-Y562 HydrophobicContact CD1-CE2 3.72Å; L539-Y562 HydrophobicContact CG-CD2 4.37Å; L539-Y562 HydrophobicContact CG-CE2 4.04Å; Y562-D661 CarbonylContact C-O 3.58Å; Y562-D661 VanDerWaalsContact CA-O 3.32Å; Y562-D661 WeakPolarHBondContact CA-O 3.45Å; Y562-Y662 AromaticContact CD1-CD2 3.45Å; Y562-Y662 HydrophobicContact CD1-CD2 3.45Å; Y562-Y662 VanDerWaalsContact CD1-CD2 3.45Å; Y562-Y662 HydrophobicContact CD1-CE2 4.21Å; Y562-Y662 HydrophobicContact CD1-CG 4.25Å; Y562-Y662 HydrophobicContact CD2-CD2 4.25Å; Y562-Y662 HydrophobicContact CD2-CE2 4.45Å; Y562-Y662 AromaticContact CE1-CD2 3.18Å; Y562-Y662 HydrophobicContact CE1-CD2 3.18Å; Y562-Y662 AromaticContact CE1-CE2 3.58Å; Y562-Y662 HydrophobicContact CE1-CE2 3.58Å; Y562-Y662 HydrophobicContact CE1-CG 4.06Å; Y562-Y662 HydrophobicContact CE2-CD2 4.04Å; Y562-Y662 AromaticContact CE2-CE2 3.86Å; Y562-Y662 HydrophobicContact CE2-CE2 3.86Å; Y562-Y662 AromaticContact CG-CD2 3.99Å; Y562-Y662 HydrophobicContact CG-CD2 3.99Å; Y562-Y662 AromaticContact CZ-CD2 3.52Å; Y562-Y662 AromaticContact CZ-CE2 3.39Å
563	L	94.5	Very high	86.1	Confident	19 Å²	19	41.4 Å²	41.4	10%	0.099	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.5	163.9	-51.5	-176.9	0	0	0	107.6	L536 W568 I636 L656 D661 M685	L536-L563 HydrophobicContact CD1-CD2 3.83Å; L563-W568 HydrophobicContact CB-CD2 4.33Å; L563-W568 HydrophobicContact CB-CG 4.23Å; L563-W568 HydrophobicContact CD2-CD2 4.48Å; L563-W568 HydrophobicContact CD2-CH2 4.09Å; L563-W568 HydrophobicContact CD2-CZ2 3.78Å; L563-I636 HydrophobicContact CD1-CD1 3.62Å; L563-L656 HydrophobicContact CD1-CD1 4.31Å; L563-L656 HydrophobicContact CD1-CD2 4.44Å; L563-D661 PolarHBondContact N-O 2.74Å; L563-M685 HydrophobicContact CD2-CE 3.89Å
564	R	92	Very high	83.7	Confident	70 Å²	70	42.7 Å²	42.7	26%	0.264	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	160.8	-174.8	-71	-71.2	174.6	-95.4	16	110.3	I535 I537 W568 D661	I535-R564 WeakPolarHBondContact CA-O 3.19Å; I535-R564 HydrophobicContact CB-CB 3.9Å; I535-R564 VanDerWaalsContact CB-O 3.26Å; I535-R564 WeakPolarHBondContact CB-O 3.34Å; I535-R564 HydrophobicContact CG2-CB 4.13Å; I535-R564 PolarHBondContact N-O 3.49Å; I535-R564 PolarHBondContact O-N 2.97Å; I535-R564 VanDerWaalsContact O-O 3.09Å; I537-R564 HydrophobicContact CD1-CB 4.47Å; I537-R564 HydrophobicContact CD1-CG 3.89Å; R564-W568 PolarHBondContact O-NE1 3.31Å; R564-D661 IonicContact CZ-OD2 2.7Å; R564-D661 VanDerWaalsContact CZ-OD2 3.25Å; R564-D661 IonicContact NH1-OD2 3.78Å; R564-D661 PolarHBondContact NH1-OD2 2.84Å; R564-D661 IonicContact NH2-OD2 3.78Å; R564-D661 PolarHBondContact NH2-OD2 2.85Å
565	G	89.1	Confident	80.7	Confident	40 Å²	40	45 Å²	45	41%	0.412	25%	0.251	S	S	.	.	S	Bend	trans	78.9	152.4	-173.7	0	0	0	0	0	112.9	D533 G567	D533-G565 CarbonylContact O-C 3.53Å; D533-G565 WeakPolarHBondContact O-CA 3.35Å; G565-G567 PolarHBondContact O-N 2.89Å
566	E	86.5	Confident	77.5	Confident	133 Å²	133	49.1 Å²	49.1	62%	0.621	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-72.4	-14.5	-173.9	-59.7	-166.6	174.1	0	0	113.6	R532 W568 G569	R532-E566 HydrophobicContact CB-CB 4.34Å; R532-E566 HydrophobicContact CG-CB 4.33Å; E566-W568 PolarHBondContact O-N 2.74Å; E566-W568 VanDerWaalsContact O-N 3.09Å; E566-G569 PolarHBondContact O-N 3.47Å
567	G	87.3	Confident	74.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-58.4	-24.4	-177.9	0	0	0	0	0	114.6	R532 D533 Q534 G565 G569 L570	R532-G567 WeakPolarHBondContact O-CA 3.48Å; R532-G567 PolarHBondContact O-N 3.26Å; D533-G567 PolarHBondContact O-N 2.68Å; Q534-G567 PolarHBondContact NE2-O 2.77Å; G565-G567 PolarHBondContact O-N 2.89Å; G567-G569 VanDerWaalsContact C-N 3.27Å; G567-G569 PolarHBondContact O-N 3.03Å; G567-L570 PolarHBondContact O-N 2.68Å
568	W	87.5	Confident	71.3	Confident	46 Å²	46	61.5 Å²	61.5	17%	0.174	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-73.4	-15.3	176.2	-62	108.1	0	0	0	113.8	Q534 I535 L536 L563 R564 E566 I636 M685 L693 W880	Q534-W568 HydrophobicContact CB-CD2 4.26Å; Q534-W568 HydrophobicContact CB-CZ2 4.1Å; Q534-W568 HydrophobicContact CG-CD2 4.06Å; Q534-W568 HydrophobicContact CG-CE3 4.27Å; Q534-W568 HydrophobicContact CG-CG 4.37Å; I535-W568 PolarHBondContact O-NE1 3.18Å; L536-W568 HydrophobicContact CB-CZ2 4.3Å; L563-W568 HydrophobicContact CB-CD2 4.33Å; L563-W568 HydrophobicContact CB-CG 4.23Å; L563-W568 HydrophobicContact CD2-CD2 4.48Å; L563-W568 HydrophobicContact CD2-CH2 4.09Å; L563-W568 HydrophobicContact CD2-CZ2 3.78Å; R564-W568 PolarHBondContact O-NE1 3.31Å; E566-W568 PolarHBondContact O-N 2.74Å; E566-W568 VanDerWaalsContact O-N 3.09Å; W568-I636 HydrophobicContact CD2-CD1 4.38Å; W568-I636 HydrophobicContact CE3-CD1 3.45Å; W568-I636 VanDerWaalsContact CE3-CD1 3.45Å; W568-I636 HydrophobicContact CZ3-CD1 3.58Å; W568-I636 HydrophobicContact CZ3-CG1 4.47Å; W568-M685 HydrophobicContact CH2-CE 3.89Å; W568-M685 HydrophobicContact CZ3-CE 4.39Å; W568-L693 HydrophobicContact CH2-CD1 4.45Å; W568-L693 HydrophobicContact CZ3-CD1 4.07Å; W568-W880 AromaticContact CH2-CH2 3.65Å; W568-W880 HydrophobicContact CH2-CH2 3.65Å; W568-W880 AromaticContact CH2-CZ2 3.48Å; W568-W880 HydrophobicContact CH2-CZ2 3.48Å; W568-W880 VanDerWaalsContact CH2-CZ2 3.48Å; W568-W880 AromaticContact CZ2-CH2 3.79Å; W568-W880 HydrophobicContact CZ2-CH2 3.79Å; W568-W880 AromaticContact CZ2-CZ2 3.85Å; W568-W880 HydrophobicContact CZ2-CZ2 3.85Å; W568-W880 HydrophobicContact CZ3-CZ2 4.27Å
569	G	74.4	Confident	68.4	Low	67 Å²	67	71.2 Å²	71.2	69%	0.691	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-88.5	-5	175.6	0	0	0	0	0	114.4	E566 G567	E566-G569 PolarHBondContact O-N 3.47Å; G567-G569 VanDerWaalsContact C-N 3.27Å; G567-G569 PolarHBondContact O-N 3.03Å
570	L	73.3	Confident	65.3	Low	36 Å²	36	75.9 Å²	75.9	19%	0.188	42%	0.418	C	S	.	.	S	Bend	trans	-80.9	121.7	-175.5	-56.6	178	0	0	0	110.1	R532 G567 Y572 F881 H885	R532-L570 HydrophobicContact CB-CD1 3.99Å; G567-L570 PolarHBondContact O-N 2.68Å; L570-Y572 PolarHBondContact O-N 3.45Å; L570-F881 HydrophobicContact CD1-CE2 4.43Å; L570-H885 HydrophobicContact CB-CB 4.33Å; L570-H885 HydrophobicContact CD1-CB 3.74Å
571	Q	59.4	Low	62.3	Low	122 Å²	122	84 Å²	84	57%	0.57	45%	0.453	S	S	*	.			trans	-63.3	129.1	-174.9	-70.8	-177.9	-9.3	0	0	111.8	N573	Q571-N573 PolarHBondContact O-N 2.95Å; Q571-N573 PolarHBondContact OE1-ND2 2.83Å
572	Y	57.5	Low	59.1	Low	13 Å²	13	92.2 Å²	92.2	5%	0.051	50%	0.497	C	S	.	.			trans	-82.8	68.1	172	-162.4	-95.3	0	0	0	111.2	L570 Q574 N689 K691 P905	L570-Y572 PolarHBondContact O-N 3.45Å; Y572-Q574 HydrophobicContact CD1-CG 4.11Å; Y572-Q574 HydrophobicContact CE1-CG 3.69Å; Y572-Q574 PolarHBondContact O-N 2.84Å; Y572-Q574 VanDerWaalsContact O-N 3.12Å; Y572-N689 VanDerWaalsContact CD1-ND2 3.28Å; Y572-N689 WeakPolarHBondContact CD1-ND2 3.4Å; Y572-K691 HydrophobicContact CE1-CD 4.13Å; Y572-K691 HydrophobicContact CE2-CD 3.78Å; Y572-K691 VanDerWaalsContact CZ-CD 3.46Å; Y572-K691 VanDerWaalsContact OH-CD 3.22Å; Y572-K691 WeakPolarHBondContact OH-CD 3.5Å; Y572-K691 PolarHBondContact OH-NZ 3.32Å; Y572-P905 HydrophobicContact CE2-CB 3.8Å; Y572-P905 HydrophobicContact CE2-CG 4.4Å; Y572-P905 WeakPolarHBondContact OH-CB 3.42Å
573	N	43.7	Very low	56	Low	110 Å²	110	97.2 Å²	97.2	59%	0.588	53%	0.532	S	S	*	.			trans	-77	95.9	178.2	-69.9	-30.5	0	0	0	110.1	Q571	Q571-N573 PolarHBondContact O-N 2.95Å; Q571-N573 PolarHBondContact OE1-ND2 2.83Å
574	Q	43	Very low	52.9	Low	103 Å²	103	101.6 Å²	101.6	48%	0.481	57%	0.565	S	S	.	*			trans	-62.7	134.8	162.8	-70.1	-177.6	-10	0	0	109.3	Y572 S576	Y572-Q574 HydrophobicContact CD1-CG 4.11Å; Y572-Q574 HydrophobicContact CE1-CG 3.69Å; Y572-Q574 PolarHBondContact O-N 2.84Å; Y572-Q574 VanDerWaalsContact O-N 3.12Å; Q574-S576 PolarHBondContact O-N 3.3Å
575	T	31.7	Very low	50	Low	133 Å²	133	103.8 Å²	103.8	82%	0.816	59%	0.59	S	S	*	*			trans	-77.2	66.9	173.2	49	0	0	0	0	110.7	H577	T575-H577 PolarHBondContact O-N 3.19Å
576	S	29.9	Very low	47.4	Very low	103 Å²	103	110 Å²	110	72%	0.72	61%	0.609	S	S	*	*			trans	-80	52.2	177.2	48.5	0	0	0	0	112.5	Q574	Q574-S576 PolarHBondContact O-N 3.3Å
577	H	32.9	Very low	44.9	Very low	156 Å²	156	111.1 Å²	111.1	72%	0.722	61%	0.614	S	S	*	*			trans	-140.3	99.3	173.7	-106.8	-82.6	0	0	0	108.6	T575	T575-H577 PolarHBondContact O-N 3.19Å
578	D	31.7	Very low	42.4	Very low	129 Å²	129	118.7 Å²	118.7	69%	0.69	65%	0.649	S	S	*	*	S	Bend	trans	174.5	-17.5	135	-89.2	-14	0	0	0	114.3	S580 K581	D578-S580 PolarHBondContact O-N 3.04Å; D578-K581 PolarHBondContact O-N 3.34Å
579	E	35.8	Very low	40	Very low	208 Å²	208	123.3 Å²	123.3	97%	0.972	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-9.1	177.7	-70.3	-166.8	125.7	0	0	115.2
580	S	33.4	Very low	38	Very low	101 Å²	101	126.5 Å²	126.5	71%	0.706	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	13.5	-176.1	58	0	0	0	0	115.2	D578	D578-S580 PolarHBondContact O-N 3.04Å
581	K	31.7	Very low	36.3	Very low	169 Å²	169	132.9 Å²	132.9	74%	0.735	71%	0.712	S	S	*	*	S	Bend	trans	-129	2.3	-174.7	-93	-175	174.1	-179.1	0	117.7	D578	D578-K581 PolarHBondContact O-N 3.34Å
582	L	30.5	Very low	34.9	Very low	174 Å²	174	132.3 Å²	132.3	91%	0.911	72%	0.717	S	S	*	*	S	Bend	trans	-106.1	38.6	-173.5	-139.4	77.8	0	0	0	115
583	S	29.5	Very low	33.8	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	75%	0.75	S	S	*	*			trans	-151.8	51.2	-174.3	52.8	0	0	0	0	115.1
584	S	29.6	Very low	33.3	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	76%	0.76	S	S	*	*			trans	-149.3	60.8	178.7	57.9	0	0	0	0	116.6
585	S	32.6	Very low	32.8	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	77%	0.772	S	S	*	*			trans	-160.1	77.2	169.4	62.1	0	0	0	0	116.1
586	H	34.1	Very low	32.6	Very low	171 Å²	171	139 Å²	139	79%	0.792	76%	0.762	S	S	*	*				-171	162.5	129.5	-116.3	-41.4	0	0	0	113.4
587	E	34.5	Very low	32.8	Very low	156 Å²	156	145.1 Å²	145.1	73%	0.729	77%	0.771	S	S	*	*			trans	-39.2	137.3	178.1	-74	123.3	-119.7	0	0	116.5
588	H	34.3	Very low	32.7	Very low	160 Å²	160	142.5 Å²	142.5	74%	0.741	77%	0.77	S	S	*	*				86.4	76.5	50.2	-167.9	-48.1	0	0	0	114
589	V	36.3	Very low	32.9	Very low	143 Å²	143	142.3 Å²	142.3	87%	0.867	77%	0.774	S	S	*	*			trans	-138.1	150.3	155.6	-177.2	0	0	0	0	108.5
590	D	32.8	Very low	33	Very low	133 Å²	133	138.5 Å²	138.5	71%	0.711	76%	0.76	S	S	*	*			trans	-81.5	174	-164.6	-59.1	-89.5	0	0	0	117.2
591	Q	36.6	Very low	33.1	Very low	171 Å²	171	140 Å²	140	80%	0.799	76%	0.76	S	S	*	*			trans	101.1	86.2	134.3	-150.5	141.7	46.8	0	0	120.7
592	T	31.4	Very low	33.3	Very low	110 Å²	110	137.7 Å²	137.7	68%	0.675	76%	0.76	S	S	*	*			trans	62.2	136.9	132.8	57.7	0	0	0	0	123.6
593	D	32.9	Very low	33.3	Very low	140 Å²	140	138.9 Å²	138.9	75%	0.749	75%	0.752	S	S	*	*			trans	89	136.2	136.1	-75.7	1	0	0	0	123.5
594	L	33.9	Very low	33.2	Very low	151 Å²	151	140.1 Å²	140.1	79%	0.791	76%	0.755	S	S	*	*			trans	62.7	111.2	157.5	-61.1	165.4	0	0	0	118.1
595	V	33.2	Very low	33.3	Very low	122 Å²	122	144.8 Å²	144.8	74%	0.739	76%	0.757	S	S	*	*				87.8	112.9	59.9	169	0	0	0	0	114.2
596	S	27.8	Very low	33.1	Very low	86 Å²	86	144.5 Å²	144.5	60%	0.601	76%	0.755	S	S	*	*			trans	64.3	133.1	160.3	71.8	0	0	0	0	119.8
597	Y	32.8	Very low	33.2	Very low	232 Å²	232	144.9 Å²	144.9	91%	0.91	76%	0.762	S	S	*	*				-153.2	153.8	103.6	-96.6	-69.1	0	0	0	110.1
598	S	31.2	Very low	32.9	Very low	101 Å²	101	145.8 Å²	145.8	71%	0.706	77%	0.766	S	S	*	*			trans	-149.5	136	-167.4	59.2	0	0	0	0	113.2
599	T	36.9	Very low	32.9	Very low	125 Å²	125	145.7 Å²	145.7	77%	0.767	77%	0.772	S	S	*	*			trans	175.6	153.6	157.4	17.6	0	0	0	0	108.3
600	N	36.7	Very low	32.7	Very low	128 Å²	128	145.5 Å²	145.5	68%	0.684	77%	0.765	S	S	*	*			cis	-135.7	138.3	4.7	-96.2	-55.1	0	0	0	108.9
601	N	35.8	Very low	33	Very low	131 Å²	131	144.6 Å²	144.6	70%	0.701	77%	0.77	S	S	*	*				48.6	115.2	90.5	-60.4	-50.7	0	0	0	113.2
602	V	36.2	Very low	33	Very low	121 Å²	121	141.7 Å²	141.7	73%	0.733	77%	0.768	S	S	*	*				-176.3	143	77.7	150.6	0	0	0	0	106.8
603	R	30.9	Very low	33.1	Very low	199 Å²	199	141.6 Å²	141.6	75%	0.751	77%	0.771	S	S	*	*			cis	-160.9	167.9	-5.7	-110.4	177.4	-170.1	145.1	-1.2	108.1
604	T	26.9	Very low	33.2	Very low	135 Å²	135	139.8 Å²	139.8	83%	0.828	77%	0.769	S	S	*	*			trans	-149.5	147.4	163.9	-50.1	0	0	0	0	110
605	Y	31.2	Very low	33.2	Very low	211 Å²	211	138.9 Å²	138.9	83%	0.827	77%	0.77	S	S	*	*			trans	-107.6	131.6	170	-72.1	-71.3	0	0	0	110.4
606	S	29.6	Very low	33.5	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	77%	0.772	S	S	*	*			trans	-142.9	147	166.8	64	0	0	0	0	109.3
607	L	34.7	Very low	33.9	Very low	179 Å²	179	139.8 Å²	139.8	94%	0.937	78%	0.782	S	S	*	*			trans	-133.3	106.3	173.8	-87.4	166.6	0	0	0	108
608	Q	29.6	Very low	34.1	Very low	174 Å²	174	134.2 Å²	134.2	81%	0.813	78%	0.775	S	S	*	*			trans	-82.3	155.5	166.2	-67.3	174.2	-42.3	0	0	109.6
609	N	33.6	Very low	34.6	Very low	159 Å²	159	136.9 Å²	136.9	85%	0.85	78%	0.779	S	S	*	*			trans	-149.6	154.4	147.8	-133.3	-26.2	0	0	0	111.5
610	N	32.5	Very low	34.7	Very low	138 Å²	138	137 Å²	137	74%	0.738	78%	0.782	S	S	*	*			trans	-97.6	157.6	-159.8	-60.8	-64	0	0	0	114.3
611	S	38.1	Very low	34.5	Very low	115 Å²	115	134 Å²	134	80%	0.804	78%	0.781	S	S	*	*				-178.5	147.7	117.7	35.9	0	0	0	0	115.4
612	S	37.7	Very low	34.6	Very low	110 Å²	110	134.2 Å²	134.2	77%	0.769	79%	0.79	S	S	*	*			trans	-20.9	163.4	163.1	58.8	0	0	0	0	120
613	C	32.1	Very low	34.4	Very low	108 Å²	108	133.7 Å²	133.7	73%	0.73	79%	0.791	S	S	*	*			cis	-169.1	155.1	34.1	-152.9	0	0	0	0	114
614	S	35.6	Very low	34.6	Very low	102 Å²	102	132.7 Å²	132.7	71%	0.713	80%	0.795	S	S	*	*			trans	31.3	154.4	142.3	-64.2	0	0	0	0	123.5
615	T	35.1	Very low	34.7	Very low	131 Å²	131	134.6 Å²	134.6	80%	0.804	80%	0.799	S	S	*	*			cis	-175.3	144.9	-12.7	-90.2	0	0	0	0	108.3
616	A	39.1	Very low	34.8	Very low	94 Å²	94	129.5 Å²	129.5	78%	0.777	80%	0.795	S	S	*	*			trans	147.2	135.4	147	0	0	0	0	0	112.8
617	T	36.1	Very low	34.8	Very low	133 Å²	133	129.7 Å²	129.7	82%	0.816	80%	0.796	S	S	*	*			trans	-116.3	165.7	171	55.3	0	0	0	0	110.1
618	P	37.5	Very low	34.6	Very low	116 Å²	116	124.9 Å²	124.9	75%	0.753	78%	0.777	S	S	*	*				-147.4	136.4	100.5	35.3	-18.5	0	0	0	116.6
619	I	40.2	Very low	34.7	Very low	156 Å²	156	125.1 Å²	125.1	80%	0.8	78%	0.776	S	S	*	*			trans	49.1	126.1	134.6	-51.3	-179	0	0	0	119.6
620	P	38.8	Very low	34.7	Very low	127 Å²	127	122.7 Å²	122.7	83%	0.825	77%	0.767	S	S	*	*			trans	-97.9	165	-168.7	39.5	-37.8	0	0	0	116.2
621	G	33.6	Very low	35	Very low	65 Å²	65	118.5 Å²	118.5	67%	0.67	76%	0.756	S	S	*	*			trans	-117.1	153.6	159.4	0	0	0	0	0	111.4
622	P	36.9	Very low	35.2	Very low	137 Å²	137	119.3 Å²	119.3	89%	0.89	75%	0.747	S	S	*	*			trans	-93.5	132.4	-168.1	34.5	-33.9	0	0	0	114.3
623	S	33.6	Very low	35.6	Very low	109 Å²	109	119.5 Å²	119.5	76%	0.762	74%	0.736	S	S	*	*			trans	-156.2	125.8	166.1	58.2	0	0	0	0	113.3
624	H	34.8	Very low	37	Very low	179 Å²	179	116.5 Å²	116.5	83%	0.829	72%	0.716	S	S	*	*			trans	49.9	116.4	159.6	-76.1	-92.7	0	0	0	120.9
625	L	29	Very low	39	Very low	174 Å²	174	112.7 Å²	112.7	91%	0.911	69%	0.687	S	S	*	*			trans	-66.5	133.5	147.3	-73.7	74.2	0	0	0	108.9
626	S	32.2	Very low	41.6	Very low	105 Å²	105	107.2 Å²	107.2	73%	0.734	65%	0.653	S	S	*	*			trans	-141.4	137.2	164.7	61.8	0	0	0	0	110	S628	S626-S628 PolarHBondContact O-N 3.48Å
627	S	29.1	Very low	44	Very low	112 Å²	112	104.4 Å²	104.4	78%	0.783	63%	0.625	S	S	*	*			trans	-61.9	123.9	-171.6	51.2	0	0	0	0	113.2
628	S	31.3	Very low	46.7	Very low	79 Å²	79	98.1 Å²	98.1	55%	0.552	59%	0.586	S	S	*	*			trans	-143	29.6	172.1	79.5	0	0	0	0	114.9	S626	S626-S628 PolarHBondContact O-N 3.48Å
629	F	31.7	Very low	49.4	Very low	179 Å²	179	94.9 Å²	94.9	79%	0.785	56%	0.56	S	S	*	*	S	Bend	trans	-118.4	-0.6	179.7	-87.4	-75.5	0	0	0	114.6
630	T	34	Very low	52	Low	108 Å²	108	87.5 Å²	87.5	66%	0.663	52%	0.522	S	S	*	.	S	Bend	trans	-97.9	-1.1	-174.1	46.2	0	0	0	0	114.7
631	G	39.3	Very low	54.6	Low	49 Å²	49	81.5 Å²	81.5	51%	0.505	48%	0.483	S	S	.	.	S	Bend	trans	-84.3	-44.8	-176.7	0	0	0	0	0	114.8	Q633	G631-Q633 PolarHBondContact O-N 3.16Å
632	E	42.2	Very low	57.4	Low	133 Å²	133	79.5 Å²	79.5	62%	0.621	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-66.7	-17.6	-161.6	-58.7	-171.2	138.2	0	0	115.3	K688	E632-K688 WeakPolarHBondContact O-CD 3.34Å
633	Q	44.8	Very low	59.2	Low	114 Å²	114	73.5 Å²	73.5	53%	0.533	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-75.5	-23.1	-172.6	-61.4	-170.8	10.6	0	0	114	G631	G631-Q633 PolarHBondContact O-N 3.16Å
634	S	62.8	Low	60.7	Low	45 Å²	45	71.5 Å²	71.5	32%	0.315	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-91.7	-1.4	-177.3	-61.6	0	0	0	0	114.2	I636	S634-I636 PolarHBondContact O-N 3.25Å
635	Q	77.5	Confident	61.9	Low	22 Å²	22	63.7 Å²	63.7	10%	0.103	38%	0.382	C	S	.	.			trans	-63.4	135.7	-179.7	-165.8	-176.4	-14.4	0	0	111.2	L656 D657 D658 K688	Q635-L656 PolarHBondContact NE2-O 3.28Å; Q635-D657 PolarHBondContact NE2-OD1 3.07Å; Q635-D658 VanDerWaalsContact CB-OD1 3.23Å; Q635-D658 WeakPolarHBondContact CB-OD1 3.37Å; Q635-D658 VanDerWaalsContact CG-OD1 3.26Å; Q635-D658 WeakPolarHBondContact CG-OD1 3.4Å; Q635-K688 HydrophobicContact CB-CD 3.88Å; Q635-K688 HydrophobicContact CB-CG 4.15Å; Q635-K688 PolarHBondContact O-N 2.91Å
636	I	88.6	Confident	63	Low	15 Å²	15	61.7 Å²	61.7	8%	0.077	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	132.3	179.5	-62.1	158.4	0	0	0	110	L563 W568 S634 L656 M685 Y687	L563-I636 HydrophobicContact CD1-CD1 3.62Å; W568-I636 HydrophobicContact CD2-CD1 4.38Å; W568-I636 HydrophobicContact CE3-CD1 3.45Å; W568-I636 VanDerWaalsContact CE3-CD1 3.45Å; W568-I636 HydrophobicContact CZ3-CD1 3.58Å; W568-I636 HydrophobicContact CZ3-CG1 4.47Å; S634-I636 PolarHBondContact O-N 3.25Å; I636-L656 HydrophobicContact CG2-CD1 4.24Å; I636-M685 HydrophobicContact CG2-CE 3.72Å; I636-Y687 HydrophobicContact CD1-CE1 4.43Å; I636-Y687 HydrophobicContact CG1-CD1 3.94Å; I636-Y687 HydrophobicContact CG1-CE1 3.78Å
637	L	90.6	Very high	64.2	Low	36 Å²	36	59.9 Å²	59.9	19%	0.188	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	128.2	169.7	-64.1	175.1	0	0	0	108.8	F639 M685 F686 K688	L637-F639 HydrophobicContact CB-CE2 4.24Å; L637-M685 WeakPolarHBondContact O-CA 3.35Å; L637-F686 HydrophobicContact CB-CD2 4.07Å; L637-F686 HydrophobicContact CB-CE1 4.29Å; L637-F686 HydrophobicContact CB-CE2 3.81Å; L637-F686 HydrophobicContact CB-CG 4.44Å; L637-F686 HydrophobicContact CB-CZ 3.93Å; L637-F686 HydrophobicContact CD1-CD2 4.17Å; L637-F686 HydrophobicContact CD1-CE2 3.53Å; L637-F686 HydrophobicContact CD1-CZ 4.13Å; L637-F686 HydrophobicContact CG-CE2 4.3Å; L637-F686 PolarHBondContact N-O 3.05Å; L637-F686 PolarHBondContact O-N 3.49Å; L637-K688 HydrophobicContact CD1-CG 4.01Å; L637-K688 HydrophobicContact CG-CG 4.14Å
638	A	93.5	Very high	65.7	Low	0 Å²	0	59.3 Å²	59.3	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.8	-175.8	0	0	0	0	0	111.3	L654 L656 L683 K684 M685	A638-L654 HydrophobicContact CB-CB 4.16Å; A638-L654 HydrophobicContact CB-CD1 4.27Å; A638-L654 PolarHBondContact O-N 3.02Å; A638-L656 HydrophobicContact CB-CD1 3.73Å; A638-L683 HydrophobicContact CB-CD1 4.17Å; A638-K684 CarbonylContact C-O 3.52Å; A638-K684 WeakPolarHBondContact CA-O 3.38Å; A638-M685 HydrophobicContact CB-CG 3.91Å
639	F	93.6	Very high	66.9	Low	48 Å²	48	62.1 Å²	62.1	21%	0.211	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.7	-175.5	-69.1	-99.1	0	0	0	109.5	L637 M651 Q653 L683 K684 F686	L637-F639 HydrophobicContact CB-CE2 4.24Å; F639-M651 HydrophobicContact CB-CB 4.03Å; F639-M651 HydrophobicContact CB-SD 4.34Å; F639-Q653 HydrophobicContact CD1-CB 3.93Å; F639-Q653 HydrophobicContact CD1-CG 4.35Å; F639-Q653 HydrophobicContact CE1-CB 3.63Å; F639-Q653 HydrophobicContact CE1-CG 3.85Å; F639-Q653 HydrophobicContact CE2-CG 4.4Å; F639-Q653 HydrophobicContact CZ-CB 4.19Å; F639-Q653 HydrophobicContact CZ-CG 3.87Å; F639-L683 WeakPolarHBondContact O-CA 3.45Å; F639-K684 PolarHBondContact N-O 3.08Å; F639-K684 PolarHBondContact O-N 3.48Å; F639-F686 AromaticContact CD2-CE1 3.67Å; F639-F686 HydrophobicContact CD2-CE1 3.67Å; F639-F686 HydrophobicContact CD2-CZ 4.18Å; F639-F686 AromaticContact CE2-CE1 3.57Å; F639-F686 HydrophobicContact CE2-CE1 3.57Å; F639-F686 AromaticContact CE2-CZ 3.58Å; F639-F686 HydrophobicContact CE2-CZ 3.58Å; F639-F686 HydrophobicContact CZ-CZ 4.47Å
640	M	94.9	Very high	69	Low	1 Å²	1	60 Å²	60	1%	0.005	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	122	-178.9	-170.1	177.9	-81.8	0	0	111.2	I538 P559 V561 I652 L654 A665 L668 L681 T682 L683	I538-M640 HydrophobicContact CG2-CE 4.05Å; P559-M640 HydrophobicContact CB-SD 3.85Å; V561-M640 HydrophobicContact CG2-CE 3.49Å; V561-M640 VanDerWaalsContact CG2-CE 3.49Å; M640-I652 PolarHBondContact N-O 3.45Å; M640-I652 PolarHBondContact O-N 2.82Å; M640-L654 HydrophobicContact CB-CD1 4.33Å; M640-L654 HydrophobicContact CB-CD2 4.2Å; M640-L654 HydrophobicContact CB-CG 4.26Å; M640-L654 HydrophobicContact CE-CD1 4.38Å; M640-A665 HydrophobicContact SD-CB 3.77Å; M640-L668 HydrophobicContact CG-CD1 4Å; M640-L668 HydrophobicContact SD-CD1 3.7Å; M640-L681 HydrophobicContact CG-CB 4.45Å; M640-L681 HydrophobicContact SD-CD1 4.02Å; M640-T682 CarbonylContact C-O 3.57Å; M640-T682 WeakPolarHBondContact CA-O 3.5Å; M640-L683 HydrophobicContact CB-CD1 4.23Å; M640-L683 HydrophobicContact CE-CD1 4.25Å
641	G	93.2	Very high	71.5	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	174.4	174.5	0	0	0	0	0	112.8	L681 T682	G641-L681 WeakPolarHBondContact O-CA 3.46Å; G641-T682 PolarHBondContact N-O 2.87Å; G641-T682 PolarHBondContact O-N 2.97Å
642	I	92.2	Very high	74	Confident	24 Å²	24	56.1 Å²	56.1	12%	0.123	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.5	166.2	-69	163.5	0	0	0	105.9	F555 S645 L668 F669 I670 F679 L681	F555-I642 HydrophobicContact CE2-CD1 3.89Å; F555-I642 HydrophobicContact CE2-CG1 4.07Å; F555-I642 HydrophobicContact CZ-CD1 3.57Å; F555-I642 HydrophobicContact CZ-CG1 4.17Å; I642-S645 PolarHBondContact O-N 3.07Å; I642-S645 PolarHBondContact O-OG 3.31Å; I642-L668 HydrophobicContact CD1-CD2 4.49Å; I642-L668 HydrophobicContact CG1-CD2 4.19Å; I642-F669 WeakPolarHBondContact CD1-O 3.44Å; I642-I670 HydrophobicContact CD1-CB 4.18Å; I642-F679 HydrophobicContact CG1-CD2 4.44Å; I642-F679 HydrophobicContact CG1-CE2 4.18Å; I642-F679 HydrophobicContact CG2-CB 4.26Å; I642-F679 HydrophobicContact CG2-CD2 3.7Å; I642-F679 HydrophobicContact CG2-CE2 4.2Å; I642-F679 HydrophobicContact CG2-CG 4.01Å; I642-L681 HydrophobicContact CG1-CD2 4.3Å
643	G	74.5	Confident	76.4	Confident	11 Å²	11	55.3 Å²	55.3	11%	0.113	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	147.7	-170.6	0	0	0	0	0	112.7	R676 M680 T682	G643-R676 PolarHBondContact O-NH1 3.38Å; G643-R676 PolarHBondContact O-NH2 2.92Å; G643-M680 PolarHBondContact N-O 2.92Å; G643-T682 VanDerWaalsContact CA-OG1 3.28Å; G643-T682 WeakPolarHBondContact CA-OG1 3.27Å
644	G	64.6	Low	78.6	Confident	66 Å²	66	50.1 Å²	50.1	68%	0.68	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.4	-26.1	-167.9	0	0	0	0	0	113.2	T646	G644-T646 PolarHBondContact O-N 3.19Å; G644-T646 VanDerWaalsContact O-N 3.09Å
645	S	60.7	Low	79.9	Confident	15 Å²	15	51.3 Å²	51.3	11%	0.105	30%	0.299	C	S	.	.			trans	-71.9	94	159.3	63.8	0	0	0	0	109.2	I642 T647 E650 M651	I642-S645 PolarHBondContact O-N 3.07Å; I642-S645 PolarHBondContact O-OG 3.31Å; S645-T647 VanDerWaalsContact C-N 3.28Å; S645-E650 VanDerWaalsContact CB-OE2 3.24Å; S645-E650 WeakPolarHBondContact CB-OE2 3.46Å; S645-M651 WeakPolarHBondContact O-CE 3.3Å
646	T	52.9	Low	80.3	Confident	132 Å²	132	50.6 Å²	50.6	81%	0.81	30%	0.296	S	S	*	.			trans	-77.9	-16.4	173.9	51.5	0	0	0	0	112.6	G644	G644-T646 PolarHBondContact O-N 3.19Å; G644-T646 VanDerWaalsContact O-N 3.09Å
647	T	57.3	Low	79.9	Confident	68 Å²	68	53 Å²	53	42%	0.417	31%	0.308	S	S	.	.	S	Bend	trans	-81.9	124.9	176.8	42.9	0	0	0	0	110.9	S645 V649 E650	S645-T647 VanDerWaalsContact C-N 3.28Å; T647-V649 PolarHBondContact O-N 3.39Å; T647-V649 VanDerWaalsContact O-N 3.07Å; T647-E650 PolarHBondContact O-N 2.97Å
648	P	59.4	Low	78.9	Confident	99 Å²	99	56 Å²	56	64%	0.643	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-58.7	-22.7	175.4	-26.6	35.6	0	0	0	114	E650 M651	P648-E650 PolarHBondContact O-N 3.05Å; P648-M651 PolarHBondContact O-N 3.2Å
649	V	57.8	Low	77.9	Confident	138 Å²	138	60.2 Å²	60.2	84%	0.836	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-59.6	-25.4	-178.8	-173.6	0	0	0	0	113.3	T647	T647-V649 PolarHBondContact O-N 3.39Å; T647-V649 VanDerWaalsContact O-N 3.07Å
650	E	75.5	Confident	77.5	Confident	135 Å²	135	63.9 Å²	63.9	63%	0.631	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-95.4	-5.1	177.9	-61.3	-168.8	155.4	0	0	113.7	S645 T647 P648	S645-E650 VanDerWaalsContact CB-OE2 3.24Å; S645-E650 WeakPolarHBondContact CB-OE2 3.46Å; T647-E650 PolarHBondContact O-N 2.97Å; P648-E650 PolarHBondContact O-N 3.05Å
651	M	86.8	Confident	77.2	Confident	30 Å²	30	66.3 Å²	66.3	15%	0.148	39%	0.394	C	S	.	.	S	Bend	trans	-86.8	136.9	-179.3	-57.9	-167.4	178.8	0	0	111.6	F639 S645 P648 T682	F639-M651 HydrophobicContact CB-CB 4.03Å; F639-M651 HydrophobicContact CB-SD 4.34Å; S645-M651 WeakPolarHBondContact O-CE 3.3Å; P648-M651 PolarHBondContact O-N 3.2Å; M651-T682 HydrophobicContact CE-CG2 4.37Å
652	I	90.6	Very high	77.2	Confident	45 Å²	45	67.4 Å²	67.4	23%	0.231	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	122	177.4	-70.8	157.1	0	0	0	109.1	M640 L654 T667 L668	M640-I652 PolarHBondContact N-O 3.45Å; M640-I652 PolarHBondContact O-N 2.82Å; I652-L654 PolarHBondContact O-N 3.1Å; I652-T667 WeakPolarHBondContact CD1-OG1 3.4Å; I652-L668 HydrophobicContact CD1-CB 4.49Å; I652-L668 HydrophobicContact CD1-CD2 3.79Å; I652-L668 HydrophobicContact CD1-CG 3.86Å
653	Q	91.9	Very high	77.4	Confident	117 Å²	117	66.7 Å²	66.7	55%	0.547	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	130.6	171.5	-171.1	176.9	-8.8	0	0	110.4	F639	F639-Q653 HydrophobicContact CD1-CB 3.93Å; F639-Q653 HydrophobicContact CD1-CG 4.35Å; F639-Q653 HydrophobicContact CE1-CB 3.63Å; F639-Q653 HydrophobicContact CE1-CG 3.85Å; F639-Q653 HydrophobicContact CE2-CG 4.4Å; F639-Q653 HydrophobicContact CZ-CB 4.19Å; F639-Q653 HydrophobicContact CZ-CG 3.87Å
654	L	92.9	Very high	78.3	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.021	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	140.5	171.3	-63.1	-171.3	0	0	0	109.5	V561 A638 M640 I652 L656 S663 A665 L683	V561-L654 HydrophobicContact CB-CD1 4.16Å; V561-L654 HydrophobicContact CG2-CD1 3.53Å; A638-L654 HydrophobicContact CB-CB 4.16Å; A638-L654 HydrophobicContact CB-CD1 4.27Å; A638-L654 PolarHBondContact O-N 3.02Å; M640-L654 HydrophobicContact CB-CD1 4.33Å; M640-L654 HydrophobicContact CB-CD2 4.2Å; M640-L654 HydrophobicContact CB-CG 4.26Å; M640-L654 HydrophobicContact CE-CD1 4.38Å; I652-L654 PolarHBondContact O-N 3.1Å; L654-L656 PolarHBondContact O-N 2.76Å; L654-S663 WeakPolarHBondContact CB-OG 3.34Å; L654-A665 HydrophobicContact CD2-CB 4Å; L654-L683 HydrophobicContact CD1-CD1 3.66Å
655	N	89.4	Confident	79.8	Confident	71 Å²	71	64.6 Å²	64.6	38%	0.38	37%	0.366	S	S	.	.			trans	-86.7	99.7	172.8	-173.8	-58	0	0	0	110.2	D657 R660 S663	N655-D657 VanDerWaalsContact CG-OD2 3.25Å; N655-D657 PolarHBondContact ND2-OD2 2.7Å; N655-D657 PolarHBondContact OD1-N 3.42Å; N655-D657 PolarHBondContact OD1-OD2 3.26Å; N655-R660 PolarHBondContact OD1-NE 2.83Å; N655-R660 PolarHBondContact OD1-NH2 2.86Å; N655-S663 PolarHBondContact N-OG 3.07Å; N655-S663 WeakPolarHBondContact O-CB 3.36Å; N655-S663 PolarHBondContact O-OG 3.14Å
656	L	86.4	Confident	81.3	Confident	7 Å²	7	68.9 Å²	68.9	4%	0.037	38%	0.383	C	S	.	.			trans	-113.9	64.9	167.2	-63.3	171.5	0	0	0	107.9	L563 Q635 I636 A638 L654	L563-L656 HydrophobicContact CD1-CD1 4.31Å; L563-L656 HydrophobicContact CD1-CD2 4.44Å; Q635-L656 PolarHBondContact NE2-O 3.28Å; I636-L656 HydrophobicContact CG2-CD1 4.24Å; A638-L656 HydrophobicContact CB-CD1 3.73Å; L654-L656 PolarHBondContact O-N 2.76Å
657	D	79.2	Confident	83.3	Confident	64 Å²	64	66 Å²	66	34%	0.342	37%	0.365	S	S	.	.			trans	-64.7	155.9	170.2	-65.2	-27.7	0	0	0	111.4	Q635 N655 G659 R660	Q635-D657 PolarHBondContact NE2-OD1 3.07Å; N655-D657 VanDerWaalsContact CG-OD2 3.25Å; N655-D657 PolarHBondContact ND2-OD2 2.7Å; N655-D657 PolarHBondContact OD1-N 3.42Å; N655-D657 PolarHBondContact OD1-OD2 3.26Å; D657-G659 PolarHBondContact O-N 3.04Å; D657-R660 HydrophobicContact CB-CG 4.47Å; D657-R660 WeakPolarHBondContact O-CB 3.48Å; D657-R660 PolarHBondContact O-N 3.2Å; D657-R660 IonicContact OD2-CZ 3.43Å; D657-R660 IonicContact OD2-NE 3.11Å; D657-R660 IonicContact OD2-NH2 2.94Å; D657-R660 PolarHBondContact OD2-NH2 2.7Å
658	D	69.4	Low	85	Confident	101 Å²	101	63.1 Å²	63.1	54%	0.54	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	121.6	-174.9	-66.2	-28	0	0	0	112.2	Q635	Q635-D658 VanDerWaalsContact CB-OD1 3.23Å; Q635-D658 WeakPolarHBondContact CB-OD1 3.37Å; Q635-D658 VanDerWaalsContact CG-OD1 3.26Å; Q635-D658 WeakPolarHBondContact CG-OD1 3.4Å
659	G	72.9	Confident	86.7	Confident	88 Å²	88	61.5 Å²	61.5	91%	0.907	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	-3.3	-176.4	0	0	0	0	0	115.9	D657	D657-G659 PolarHBondContact O-N 3.04Å
660	R	84.3	Confident	88.4	Confident	125 Å²	125	55 Å²	55	47%	0.472	29%	0.29	S	S	.	.			trans	-81.2	117.4	169.4	-64.4	-159.2	-137.3	-99.9	1.6	111.4	N655 D657 Y662	N655-R660 PolarHBondContact OD1-NE 2.83Å; N655-R660 PolarHBondContact OD1-NH2 2.86Å; D657-R660 HydrophobicContact CB-CG 4.47Å; D657-R660 WeakPolarHBondContact O-CB 3.48Å; D657-R660 PolarHBondContact O-N 3.2Å; D657-R660 IonicContact OD2-CZ 3.43Å; D657-R660 IonicContact OD2-NE 3.11Å; D657-R660 IonicContact OD2-NH2 2.94Å; D657-R660 PolarHBondContact OD2-NH2 2.7Å; R660-Y662 VanDerWaalsContact C-N 3.25Å; R660-Y662 PolarHBondContact O-N 3.34Å
661	D	90.2	Very high	89.3	Confident	52 Å²	52	50.2 Å²	50.2	28%	0.278	27%	0.272	S	S	.	.			trans	-77.1	-9.7	171	78.2	-46.7	0	0	0	113.5	Y562 L563 R564 R756	Y562-D661 CarbonylContact C-O 3.58Å; Y562-D661 VanDerWaalsContact CA-O 3.32Å; Y562-D661 WeakPolarHBondContact CA-O 3.45Å; L563-D661 PolarHBondContact N-O 2.74Å; R564-D661 IonicContact CZ-OD2 2.7Å; R564-D661 VanDerWaalsContact CZ-OD2 3.25Å; R564-D661 IonicContact NH1-OD2 3.78Å; R564-D661 PolarHBondContact NH1-OD2 2.84Å; R564-D661 IonicContact NH2-OD2 3.78Å; R564-D661 PolarHBondContact NH2-OD2 2.85Å; D661-R756 IonicContact OD1-NH2 3.72Å; D661-R756 PolarHBondContact OD1-NH2 3.1Å; D661-R756 VanDerWaalsContact OD1-NH2 3.09Å; D661-R756 IonicContact OD2-NH2 2.8Å; D661-R756 PolarHBondContact OD2-NH2 3.09Å
662	Y	93.3	Very high	89.6	Confident	23 Å²	23	51.2 Å²	51.2	9%	0.09	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	138.7	-160.9	175	-104.7	0	0	0	113.5	C560 V561 Y562 R660 N664 S755 R756	C560-Y662 HydrophobicContact CB-CE2 3.52Å; V561-Y662 WeakPolarHBondContact O-CA 3.46Å; V561-Y662 WeakPolarHBondContact O-CD2 3.43Å; Y562-Y662 AromaticContact CD1-CD2 3.45Å; Y562-Y662 HydrophobicContact CD1-CD2 3.45Å; Y562-Y662 VanDerWaalsContact CD1-CD2 3.45Å; Y562-Y662 HydrophobicContact CD1-CE2 4.21Å; Y562-Y662 HydrophobicContact CD1-CG 4.25Å; Y562-Y662 HydrophobicContact CD2-CD2 4.25Å; Y562-Y662 HydrophobicContact CD2-CE2 4.45Å; Y562-Y662 AromaticContact CE1-CD2 3.18Å; Y562-Y662 HydrophobicContact CE1-CD2 3.18Å; Y562-Y662 AromaticContact CE1-CE2 3.58Å; Y562-Y662 HydrophobicContact CE1-CE2 3.58Å; Y562-Y662 HydrophobicContact CE1-CG 4.06Å; Y562-Y662 HydrophobicContact CE2-CD2 4.04Å; Y562-Y662 AromaticContact CE2-CE2 3.86Å; Y562-Y662 HydrophobicContact CE2-CE2 3.86Å; Y562-Y662 AromaticContact CG-CD2 3.99Å; Y562-Y662 HydrophobicContact CG-CD2 3.99Å; Y562-Y662 AromaticContact CZ-CD2 3.52Å; Y562-Y662 AromaticContact CZ-CE2 3.39Å; R660-Y662 VanDerWaalsContact C-N 3.25Å; R660-Y662 PolarHBondContact O-N 3.34Å; Y662-N664 WeakPolarHBondContact CE1-ND2 3.32Å; Y662-N664 PolarHBondContact OH-ND2 3Å; Y662-S755 PolarHBondContact OH-O 3.35Å; Y662-R756 HydrophobicContact CD1-CG 4.21Å; Y662-R756 HydrophobicContact CE1-CG 3.74Å; Y662-R756 HydrophobicContact CE2-CG 4.46Å
663	S	95	Very high	89.6	Confident	10 Å²	10	53.2 Å²	53.2	7%	0.07	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	160.1	169.2	-177.5	0	0	0	0	112	C560 V561 L654 N655	C560-S663 CarbonylContact C-O 3.59Å; C560-S663 VanDerWaalsContact CA-O 3.28Å; C560-S663 WeakPolarHBondContact CA-O 3.45Å; C560-S663 WeakPolarHBondContact CB-O 3.46Å; V561-S663 PolarHBondContact N-O 3.33Å; V561-S663 PolarHBondContact O-N 2.67Å; L654-S663 WeakPolarHBondContact CB-OG 3.34Å; N655-S663 PolarHBondContact N-OG 3.07Å; N655-S663 WeakPolarHBondContact O-CB 3.36Å; N655-S663 PolarHBondContact O-OG 3.14Å
664	N	94.6	Very high	89.6	Confident	31 Å²	31	49.1 Å²	49.1	17%	0.166	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	149	176.1	58.2	37.3	0	0	0	114.7	P559 C560 Y662 K666 S755	P559-N664 CarbonylContact O-C 3.51Å; P559-N664 WeakPolarHBondContact O-CA 3.22Å; C560-N664 HydrophobicContact CB-CB 3.66Å; Y662-N664 WeakPolarHBondContact CE1-ND2 3.32Å; Y662-N664 PolarHBondContact OH-ND2 3Å; N664-K666 PolarHBondContact O-N 2.93Å; N664-K666 WeakPolarHBondContact OD1-CE 3.44Å; N664-K666 VanDerWaalsContact OD1-CG 3.32Å; N664-K666 WeakPolarHBondContact OD1-CG 3.36Å; N664-S755 PolarHBondContact ND2-O 2.83Å
665	A	94.6	Very high	89.5	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.008	31%	0.31	C	S	.	.			trans	-99.3	66.5	-171.3	0	0	0	0	0	111.5	P559 M640 L654 T667 L668	P559-A665 PolarHBondContact O-N 2.95Å; M640-A665 HydrophobicContact SD-CB 3.77Å; L654-A665 HydrophobicContact CD2-CB 4Å; A665-T667 PolarHBondContact O-N 3.23Å; A665-L668 HydrophobicContact CB-CD1 3.42Å; A665-L668 VanDerWaalsContact CB-CD1 3.42Å; A665-L668 HydrophobicContact CB-CG 3.88Å; A665-L668 PolarHBondContact O-N 3.07Å
666	K	93.4	Very high	89.7	Confident	106 Å²	106	57.8 Å²	57.8	46%	0.461	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-12	-172.9	-62.4	-173.9	179.9	-172.5	0	115.8	P558 N664	P558-K666 HydrophobicContact CB-CG 4.19Å; P558-K666 HydrophobicContact CG-CG 4.42Å; N664-K666 PolarHBondContact O-N 2.93Å; N664-K666 WeakPolarHBondContact OD1-CE 3.44Å; N664-K666 VanDerWaalsContact OD1-CG 3.32Å; N664-K666 WeakPolarHBondContact OD1-CG 3.36Å
667	T	93.6	Very high	90.1	Very high	71 Å²	71	65.4 Å²	65.4	44%	0.436	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	4.7	-172.3	45	0	0	0	0	114.5	F554 I652 A665	F554-T667 VanDerWaalsContact CD1-C 3.5Å; F554-T667 VanDerWaalsContact CD1-O 3.3Å; F554-T667 WeakPolarHBondContact CD1-O 3.37Å; F554-T667 HydrophobicContact CE1-CG2 4.38Å; F554-T667 WeakPolarHBondContact CE1-O 3.43Å; F554-T667 HydrophobicContact CZ-CG2 4.43Å; I652-T667 WeakPolarHBondContact CD1-OG1 3.4Å; A665-T667 PolarHBondContact O-N 3.23Å
668	L	94.5	Very high	90.8	Very high	7 Å²	7	66.7 Å²	66.7	4%	0.037	34%	0.342	C	S	.	.			trans	-67	133.3	172.6	-76.1	169.2	0	0	0	111.5	F554 F555 P559 M640 I642 I652 A665 L681	F554-L668 CarbonylContact C-O 3.57Å; F554-L668 VanDerWaalsContact CA-O 3.24Å; F554-L668 WeakPolarHBondContact CA-O 3.47Å; F555-L668 HydrophobicContact CD2-CB 3.61Å; F555-L668 HydrophobicContact CD2-CD1 4.35Å; F555-L668 HydrophobicContact CE2-CB 3.84Å; F555-L668 HydrophobicContact CG-CB 4.27Å; F555-L668 PolarHBondContact N-O 3.32Å; P559-L668 HydrophobicContact CB-CD1 4.44Å; P559-L668 HydrophobicContact CG-CD1 4.05Å; M640-L668 HydrophobicContact CG-CD1 4Å; M640-L668 HydrophobicContact SD-CD1 3.7Å; I642-L668 HydrophobicContact CD1-CD2 4.49Å; I642-L668 HydrophobicContact CG1-CD2 4.19Å; I652-L668 HydrophobicContact CD1-CB 4.49Å; I652-L668 HydrophobicContact CD1-CD2 3.79Å; I652-L668 HydrophobicContact CD1-CG 3.86Å; A665-L668 HydrophobicContact CB-CD1 3.42Å; A665-L668 VanDerWaalsContact CB-CD1 3.42Å; A665-L668 HydrophobicContact CB-CG 3.88Å; A665-L668 PolarHBondContact O-N 3.07Å; L668-L681 HydrophobicContact CD1-CD2 3.98Å
669	F	94.5	Very high	92	Very high	65 Å²	65	62.2 Å²	62.2	29%	0.285	32%	0.318	S	S	.	.			trans	-147.4	150.4	174.8	70.9	-76.9	0	0	0	109.6	K552 R553 F554 I642	K552-F669 HydrophobicContact CB-CD1 4.45Å; K552-F669 HydrophobicContact CB-CD2 4.36Å; K552-F669 HydrophobicContact CB-CG 4.22Å; K552-F669 HydrophobicContact CD-CD1 4.13Å; K552-F669 HydrophobicContact CD-CE1 3.78Å; K552-F669 HydrophobicContact CD-CE2 4.34Å; K552-F669 HydrophobicContact CD-CZ 3.9Å; K552-F669 HydrophobicContact CG-CD1 4.3Å; K552-F669 HydrophobicContact CG-CD2 4.08Å; K552-F669 HydrophobicContact CG-CE1 4.22Å; K552-F669 HydrophobicContact CG-CE2 3.99Å; K552-F669 HydrophobicContact CG-CG 4.25Å; K552-F669 HydrophobicContact CG-CZ 4.08Å; R553-F669 WeakPolarHBondContact O-CB 3.49Å; F554-F669 HydrophobicContact CD1-CB 4.21Å; F554-F669 HydrophobicContact CD1-CD1 4.49Å; F554-F669 HydrophobicContact CE1-CD1 4.32Å; I642-F669 WeakPolarHBondContact CD1-O 3.44Å
670	I	94	Very high	93.1	Very high	3 Å²	3	61.7 Å²	61.7	2%	0.015	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-107.6	130.6	172.9	-166.4	169.6	0	0	0	110.4	S547 F555 I642 D674 F679 V703	S547-I670 WeakPolarHBondContact CB-O 3.39Å; S547-I670 PolarHBondContact N-O 2.91Å; S547-I670 PolarHBondContact OG-O 3.12Å; F555-I670 HydrophobicContact CE1-CB 4.16Å; F555-I670 HydrophobicContact CE1-CG2 4.03Å; F555-I670 HydrophobicContact CZ-CB 4.09Å; F555-I670 HydrophobicContact CZ-CG2 4.35Å; I642-I670 HydrophobicContact CD1-CB 4.18Å; I670-D674 HydrophobicContact CD1-CB 4.18Å; I670-D674 HydrophobicContact CG1-CB 3.98Å; I670-F679 HydrophobicContact CD1-CD1 3.68Å; I670-F679 HydrophobicContact CD1-CE1 3.82Å; I670-F679 HydrophobicContact CD1-CG 4.39Å; I670-V703 HydrophobicContact CD1-CG2 3.82Å; I670-V703 HydrophobicContact CG2-CG1 4.47Å
671	S	92.9	Very high	93.7	Very high	34 Å²	34	55.8 Å²	55.8	24%	0.238	27%	0.271	C	S	.	.			trans	-77.2	160.4	-179.6	179.8	0	0	0	0	112.6	K546 S547 S673 D674	K546-S671 WeakPolarHBondContact CE-O 3.39Å; S547-S671 CarbonylContact O-C 3.56Å; S671-S673 VanDerWaalsContact C-N 3.27Å; S671-S673 VanDerWaalsContact CB-OG 3.28Å; S671-S673 WeakPolarHBondContact CB-OG 3.32Å; S671-S673 PolarHBondContact OG-N 3.48Å; S671-S673 VanDerWaalsContact OG-N 3.17Å; S671-S673 PolarHBondContact OG-OG 3.09Å; S671-D674 PolarHBondContact O-N 2.96Å
672	D	93	Very high	93.9	Very high	51 Å²	51	53.6 Å²	53.6	27%	0.273	26%	0.26	S	S	.	.	S	Bend	trans	-77.3	-13.2	169.2	71.1	-56.5	0	0	0	113.7	K546 S547 Y548 G549 D674 K675	K546-D672 HydrophobicContact CD-CB 3.65Å; K546-D672 HydrophobicContact CG-CB 3.85Å; S547-D672 WeakPolarHBondContact O-CB 3.32Å; S547-D672 PolarHBondContact O-N 2.72Å; Y548-D672 WeakPolarHBondContact CA-OD1 3.38Å; Y548-D672 HydrophobicContact CD1-CB 3.69Å; Y548-D672 HydrophobicContact CE1-CB 3.98Å; Y548-D672 HydrophobicContact CG-CB 4.36Å; G549-D672 PolarHBondContact N-OD1 2.81Å; D672-D674 VanDerWaalsContact C-N 3.3Å; D672-K675 PolarHBondContact O-NZ 2.86Å
673	S	91.5	Very high	94	Very high	86 Å²	86	52.6 Å²	52.6	60%	0.601	26%	0.255	S	S	*	.	S	Bend	trans	-59.9	-37.7	165.2	59.8	0	0	0	0	112.3	S671 K675	S671-S673 VanDerWaalsContact C-N 3.27Å; S671-S673 VanDerWaalsContact CB-OG 3.28Å; S671-S673 WeakPolarHBondContact CB-OG 3.32Å; S671-S673 PolarHBondContact OG-N 3.48Å; S671-S673 VanDerWaalsContact OG-N 3.17Å; S671-S673 PolarHBondContact OG-OG 3.09Å; S673-K675 WeakPolarHBondContact O-CD 3.21Å; S673-K675 WeakPolarHBondContact O-CE 3.16Å; S673-K675 WeakPolarHBondContact O-CG 3.47Å; S673-K675 PolarHBondContact O-N 2.84Å
674	D	91.3	Very high	94	Very high	31 Å²	31	55.4 Å²	55.4	17%	0.166	27%	0.267	C	S	.	.			trans	-68.1	122.8	174.8	-167.9	-29.6	0	0	0	110.3	K546 I670 S671 D672 R676	K546-D674 PolarHBondContact NZ-O 2.97Å; I670-D674 HydrophobicContact CD1-CB 4.18Å; I670-D674 HydrophobicContact CG1-CB 3.98Å; S671-D674 PolarHBondContact O-N 2.96Å; D672-D674 VanDerWaalsContact C-N 3.3Å; D674-R676 VanDerWaalsContact OD1-CB 3.28Å; D674-R676 WeakPolarHBondContact OD1-CB 3.48Å; D674-R676 VanDerWaalsContact OD1-CG 3.26Å; D674-R676 WeakPolarHBondContact OD1-CG 3.3Å; D674-R676 PolarHBondContact OD1-N 2.87Å; D674-R676 IonicContact OD1-NE 2.87Å; D674-R676 PolarHBondContact OD1-NE 2.87Å; D674-R676 IonicContact OD2-CZ 3.48Å; D674-R676 VanDerWaalsContact OD2-CZ 3.25Å; D674-R676 IonicContact OD2-NE 2.72Å; D674-R676 PolarHBondContact OD2-NE 3.39Å; D674-R676 IonicContact OD2-NH2 3.09Å; D674-R676 PolarHBondContact OD2-NH2 2.94Å
675	K	92.4	Very high	93.9	Very high	163 Å²	163	54 Å²	54	71%	0.709	26%	0.259	S	S	*	.			trans	-97.7	0.6	-176.1	-51	-51.4	178.2	-169.3	0	113.7	D672 S673	D672-K675 PolarHBondContact O-NZ 2.86Å; S673-K675 WeakPolarHBondContact O-CD 3.21Å; S673-K675 WeakPolarHBondContact O-CE 3.16Å; S673-K675 WeakPolarHBondContact O-CG 3.47Å; S673-K675 PolarHBondContact O-N 2.84Å
676	R	92.7	Very high	93.7	Very high	95 Å²	95	56.5 Å²	56.5	36%	0.358	27%	0.27	S	S	.	.			trans	-71.1	143	-177.3	-61.7	176.6	-66.2	170.7	-4.6	111.5	G643 D674 V703	G643-R676 PolarHBondContact O-NH1 3.38Å; G643-R676 PolarHBondContact O-NH2 2.92Å; D674-R676 VanDerWaalsContact OD1-CB 3.28Å; D674-R676 WeakPolarHBondContact OD1-CB 3.48Å; D674-R676 VanDerWaalsContact OD1-CG 3.26Å; D674-R676 WeakPolarHBondContact OD1-CG 3.3Å; D674-R676 PolarHBondContact OD1-N 2.87Å; D674-R676 IonicContact OD1-NE 2.87Å; D674-R676 PolarHBondContact OD1-NE 2.87Å; D674-R676 IonicContact OD2-CZ 3.48Å; D674-R676 VanDerWaalsContact OD2-CZ 3.25Å; D674-R676 IonicContact OD2-NE 2.72Å; D674-R676 PolarHBondContact OD2-NE 3.39Å; D674-R676 IonicContact OD2-NH2 3.09Å; D674-R676 PolarHBondContact OD2-NH2 2.94Å; R676-V703 WeakPolarHBondContact O-CG2 3.26Å
677	K	94	Very high	93.5	Very high	167 Å²	167	52.1 Å²	52.1	73%	0.726	25%	0.25	S	S	*	.	S	Bend	trans	-80.3	-26.5	174.5	-63.2	179.8	-178	175.7	0	112.3	V703	K677-V703 PolarHBondContact O-N 3.01Å
678	Y	95.2	Very high	93.1	Very high	90 Å²	90	53.2 Å²	53.2	35%	0.353	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.3	-178.7	-60.8	-83.7	0	0	0	109.9	I701 K702	Y678-I701 VanDerWaalsContact CA-O 3.28Å; Y678-I701 WeakPolarHBondContact CA-O 3.3Å; Y678-K702 HydrophobicContact CD1-CB 3.85Å; Y678-K702 HydrophobicContact CD1-CG 4.07Å; Y678-K702 HydrophobicContact CE1-CB 3.57Å; Y678-K702 HydrophobicContact CE1-CD 3.77Å; Y678-K702 HydrophobicContact CE1-CG 3.47Å; Y678-K702 VanDerWaalsContact CE1-CG 3.47Å; Y678-K702 WeakPolarHBondContact OH-CE 3.19Å
679	F	95.2	Very high	92.6	Very high	7 Å²	7	55.4 Å²	55.4	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	174.7	168.9	65.2	-84.7	0	0	0	110.2	A544 F555 I642 I670 L681 I701 V703	A544-F679 HydrophobicContact CB-CE1 3.89Å; A544-F679 HydrophobicContact CB-CZ 3.76Å; F555-F679 HydrophobicContact CE1-CZ 4.35Å; F555-F679 AromaticContact CE2-CE2 3.94Å; F555-F679 HydrophobicContact CE2-CE2 3.94Å; F555-F679 AromaticContact CE2-CZ 3.81Å; F555-F679 HydrophobicContact CE2-CZ 3.81Å; F555-F679 HydrophobicContact CZ-CE1 4.44Å; F555-F679 HydrophobicContact CZ-CE2 4.02Å; F555-F679 AromaticContact CZ-CZ 3.52Å; F555-F679 HydrophobicContact CZ-CZ 3.52Å; I642-F679 HydrophobicContact CG1-CD2 4.44Å; I642-F679 HydrophobicContact CG1-CE2 4.18Å; I642-F679 HydrophobicContact CG2-CB 4.26Å; I642-F679 HydrophobicContact CG2-CD2 3.7Å; I642-F679 HydrophobicContact CG2-CE2 4.2Å; I642-F679 HydrophobicContact CG2-CG 4.01Å; I670-F679 HydrophobicContact CD1-CD1 3.68Å; I670-F679 HydrophobicContact CD1-CE1 3.82Å; I670-F679 HydrophobicContact CD1-CG 4.39Å; F679-L681 HydrophobicContact CE2-CD2 3.92Å; F679-I701 HydrophobicContact CD1-CB 4.36Å; F679-I701 HydrophobicContact CD2-CB 4.37Å; F679-I701 HydrophobicContact CE1-CB 3.96Å; F679-I701 HydrophobicContact CE1-CG2 3.82Å; F679-I701 HydrophobicContact CE2-CB 3.99Å; F679-I701 HydrophobicContact CE2-CD1 3.84Å; F679-I701 HydrophobicContact CE2-CG1 4.32Å; F679-I701 HydrophobicContact CE2-CG2 4.28Å; F679-I701 HydrophobicContact CZ-CB 3.77Å; F679-I701 HydrophobicContact CZ-CD1 4.12Å; F679-I701 HydrophobicContact CZ-CG1 4.48Å; F679-I701 HydrophobicContact CZ-CG2 3.61Å; F679-I701 PolarHBondContact N-O 3.15Å; F679-I701 PolarHBondContact O-N 3.11Å; F679-V703 HydrophobicContact CD1-CG2 3.63Å; F679-V703 HydrophobicContact CE1-CG2 3.85Å
680	M	95.4	Very high	92.2	Very high	77 Å²	77	55 Å²	55	38%	0.379	28%	0.275	S	S	.	.			trans	-125	150.1	164.4	-61.5	-176.7	-56.6	0	0	107.4	G643 Y697 R700	G643-M680 PolarHBondContact N-O 2.92Å; M680-Y697 HydrophobicContact CE-CD1 4.31Å; M680-Y697 HydrophobicContact CE-CG 4.39Å; M680-R700 HydrophobicContact CG-CG 3.94Å; M680-R700 HydrophobicContact SD-CG 4.31Å
681	L	96	Very high	91.9	Very high	1 Å²	1	56 Å²	56	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	146.7	165.8	-54.3	169.5	0	0	0	108.2	H540 F555 P559 M640 G641 I642 L668 F679 Y697 S698 I701	H540-L681 HydrophobicContact CB-CD1 4.1Å; F555-L681 HydrophobicContact CE2-CD2 4.08Å; P559-L681 HydrophobicContact CB-CD1 3.46Å; P559-L681 VanDerWaalsContact CB-CD1 3.46Å; P559-L681 HydrophobicContact CG-CD1 3.62Å; M640-L681 HydrophobicContact CG-CB 4.45Å; M640-L681 HydrophobicContact SD-CD1 4.02Å; G641-L681 WeakPolarHBondContact O-CA 3.46Å; I642-L681 HydrophobicContact CG1-CD2 4.3Å; L668-L681 HydrophobicContact CD1-CD2 3.98Å; F679-L681 HydrophobicContact CE2-CD2 3.92Å; L681-Y697 WeakPolarHBondContact O-CA 3.45Å; L681-S698 PolarHBondContact N-OG 2.74Å; L681-S698 PolarHBondContact O-N 3.23Å; L681-I701 HydrophobicContact CD1-CD1 4.04Å; L681-I701 HydrophobicContact CD2-CD1 4.33Å; L681-I701 HydrophobicContact CG-CD1 3.86Å
682	T	95.2	Very high	91.8	Very high	7 Å²	7	56.7 Å²	56.7	4%	0.043	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	123.6	173.8	-62.8	0	0	0	0	107.6	M640 G641 G643 M651 Q695 Y697	M640-T682 CarbonylContact C-O 3.57Å; M640-T682 WeakPolarHBondContact CA-O 3.5Å; G641-T682 PolarHBondContact N-O 2.87Å; G641-T682 PolarHBondContact O-N 2.97Å; G643-T682 VanDerWaalsContact CA-OG1 3.28Å; G643-T682 WeakPolarHBondContact CA-OG1 3.27Å; M651-T682 HydrophobicContact CE-CG2 4.37Å; T682-Q695 VanDerWaalsContact CG2-CD 3.45Å; T682-Q695 HydrophobicContact CG2-CG 3.51Å; T682-Y697 HydrophobicContact CG2-CE1 4.22Å
683	L	95.2	Very high	91.8	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	106.4	177.4	177.3	65.6	0	0	0	108.3	L536 I538 V561 A638 F639 M640 L654 M685 F696	L536-L683 HydrophobicContact CD1-CD2 4.24Å; L536-L683 HydrophobicContact CD2-CD2 4.26Å; I538-L683 HydrophobicContact CD1-CB 3.98Å; I538-L683 HydrophobicContact CD1-CD2 3.66Å; I538-L683 HydrophobicContact CD1-CG 4.48Å; I538-L683 HydrophobicContact CG1-CD2 3.91Å; V561-L683 HydrophobicContact CG1-CD2 4.01Å; V561-L683 HydrophobicContact CG2-CD1 4.23Å; V561-L683 HydrophobicContact CG2-CD2 3.7Å; A638-L683 HydrophobicContact CB-CD1 4.17Å; F639-L683 WeakPolarHBondContact O-CA 3.45Å; M640-L683 HydrophobicContact CB-CD1 4.23Å; M640-L683 HydrophobicContact CE-CD1 4.25Å; L654-L683 HydrophobicContact CD1-CD1 3.66Å; L683-M685 HydrophobicContact CD1-CG 4.4Å; L683-M685 HydrophobicContact CD2-CG 4.35Å; L683-M685 HydrophobicContact CD2-SD 3.88Å; L683-M685 HydrophobicContact CG-CG 4Å; L683-M685 HydrophobicContact CG-SD 4.18Å; L683-F696 HydrophobicContact CB-CB 4.37Å; L683-F696 PolarHBondContact N-O 2.85Å; L683-F696 PolarHBondContact O-N 3.17Å
684	K	93.9	Very high	91.9	Very high	70 Å²	70	50.4 Å²	50.4	30%	0.304	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	134.6	170.3	-179.1	161.1	-174.9	159.4	0	109.8	A638 F639 D692 G694	A638-K684 CarbonylContact C-O 3.52Å; A638-K684 WeakPolarHBondContact CA-O 3.38Å; F639-K684 PolarHBondContact N-O 3.08Å; F639-K684 PolarHBondContact O-N 3.48Å; K684-D692 VanDerWaalsContact CE-OD1 3.24Å; K684-D692 WeakPolarHBondContact CE-OD1 3.49Å; K684-D692 WeakPolarHBondContact CE-OD2 3.34Å; K684-D692 IonicContact NZ-OD1 2.71Å; K684-D692 IonicContact NZ-OD2 3.76Å; K684-D692 PolarHBondContact NZ-OD2 3.44Å; K684-G694 WeakPolarHBondContact CA-O 3.37Å
685	M	93.3	Very high	92.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141.4	-180	-63.8	176.8	64.7	0	0	111.3	L536 L563 W568 I636 L637 A638 L683 L693 G694 F696	L536-M685 HydrophobicContact CD1-CE 4.05Å; L536-M685 HydrophobicContact CD1-SD 3.67Å; L536-M685 HydrophobicContact CD2-SD 3.6Å; L536-M685 VanDerWaalsContact CD2-SD 3.6Å; L536-M685 HydrophobicContact CG-SD 4.3Å; L563-M685 HydrophobicContact CD2-CE 3.89Å; W568-M685 HydrophobicContact CH2-CE 3.89Å; W568-M685 HydrophobicContact CZ3-CE 4.39Å; I636-M685 HydrophobicContact CG2-CE 3.72Å; L637-M685 WeakPolarHBondContact O-CA 3.35Å; A638-M685 HydrophobicContact CB-CG 3.91Å; L683-M685 HydrophobicContact CD1-CG 4.4Å; L683-M685 HydrophobicContact CD2-CG 4.35Å; L683-M685 HydrophobicContact CD2-SD 3.88Å; L683-M685 HydrophobicContact CG-CG 4Å; L683-M685 HydrophobicContact CG-SD 4.18Å; M685-L693 HydrophobicContact CB-CB 4.06Å; M685-L693 HydrophobicContact CB-CD1 4.12Å; M685-L693 HydrophobicContact CE-CD1 4.38Å; M685-L693 WeakPolarHBondContact O-CB 3.33Å; M685-L693 PolarHBondContact O-N 2.85Å; M685-G694 PolarHBondContact N-O 2.91Å; M685-G694 PolarHBondContact O-N 3.36Å; M685-F696 HydrophobicContact CB-CE2 4.24Å; M685-F696 HydrophobicContact CG-CD2 4.33Å; M685-F696 HydrophobicContact CG-CE2 4.34Å; M685-F696 HydrophobicContact SD-CD2 4.01Å; M685-F696 HydrophobicContact SD-CE2 3.95Å
686	F	90.5	Very high	92.3	Very high	55 Å²	55	44.7 Å²	44.7	24%	0.241	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	152.4	174.2	55.2	-83.7	0	0	0	110.6	L637 F639 K691	L637-F686 HydrophobicContact CB-CD2 4.07Å; L637-F686 HydrophobicContact CB-CE1 4.29Å; L637-F686 HydrophobicContact CB-CE2 3.81Å; L637-F686 HydrophobicContact CB-CG 4.44Å; L637-F686 HydrophobicContact CB-CZ 3.93Å; L637-F686 HydrophobicContact CD1-CD2 4.17Å; L637-F686 HydrophobicContact CD1-CE2 3.53Å; L637-F686 HydrophobicContact CD1-CZ 4.13Å; L637-F686 HydrophobicContact CG-CE2 4.3Å; L637-F686 PolarHBondContact N-O 3.05Å; L637-F686 PolarHBondContact O-N 3.49Å; F639-F686 AromaticContact CD2-CE1 3.67Å; F639-F686 HydrophobicContact CD2-CE1 3.67Å; F639-F686 HydrophobicContact CD2-CZ 4.18Å; F639-F686 AromaticContact CE2-CE1 3.57Å; F639-F686 HydrophobicContact CE2-CE1 3.57Å; F639-F686 AromaticContact CE2-CZ 3.58Å; F639-F686 HydrophobicContact CE2-CZ 3.58Å; F639-F686 HydrophobicContact CZ-CZ 4.47Å; F686-K691 CarbonylContact C-O 3.59Å; F686-K691 VanDerWaalsContact CA-O 3.32Å; F686-K691 WeakPolarHBondContact CA-O 3.33Å; F686-K691 WeakPolarHBondContact CB-O 3.38Å
687	Y	89.1	Confident	92.4	Very high	13 Å²	13	44.3 Å²	44.3	5%	0.051	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	153	171.1	-67.6	-71.7	0	0	0	110.5	I636 N689 G690 K691 L693	I636-Y687 HydrophobicContact CD1-CE1 4.43Å; I636-Y687 HydrophobicContact CG1-CD1 3.94Å; I636-Y687 HydrophobicContact CG1-CE1 3.78Å; Y687-N689 VanDerWaalsContact CB-OD1 3.32Å; Y687-N689 WeakPolarHBondContact CB-OD1 3.3Å; Y687-N689 PolarHBondContact O-N 2.91Å; Y687-N689 VanDerWaalsContact O-N 3.07Å; Y687-G690 PolarHBondContact O-N 2.89Å; Y687-K691 HydrophobicContact CD2-CB 4.15Å; Y687-K691 HydrophobicContact CD2-CD 4.4Å; Y687-K691 HydrophobicContact CD2-CG 4.12Å; Y687-K691 PolarHBondContact N-O 2.93Å; Y687-L693 HydrophobicContact CD2-CD1 4.31Å; Y687-L693 HydrophobicContact CD2-CD2 4.31Å; Y687-L693 HydrophobicContact CD2-CG 4.05Å; Y687-L693 HydrophobicContact CE1-CD1 4.43Å; Y687-L693 HydrophobicContact CE2-CD1 3.96Å; Y687-L693 HydrophobicContact CE2-CD2 3.52Å; Y687-L693 HydrophobicContact CE2-CG 3.72Å
688	K	84.9	Confident	92.5	Very high	95 Å²	95	36.5 Å²	36.5	41%	0.413	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-27.7	175.6	-91.5	-169.8	-173.2	163.9	0	114.4	E632 Q635 L637 G690	E632-K688 WeakPolarHBondContact O-CD 3.34Å; Q635-K688 HydrophobicContact CB-CD 3.88Å; Q635-K688 HydrophobicContact CB-CG 4.15Å; Q635-K688 PolarHBondContact O-N 2.91Å; L637-K688 HydrophobicContact CD1-CG 4.01Å; L637-K688 HydrophobicContact CG-CG 4.14Å; K688-G690 PolarHBondContact O-N 2.77Å
689	N	84.5	Confident	92.6	Very high	52 Å²	52	35.6 Å²	35.6	28%	0.278	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-2.5	176.1	68.1	14.2	0	0	0	114.4	Y572 Y687 K691	Y572-N689 VanDerWaalsContact CD1-ND2 3.28Å; Y572-N689 WeakPolarHBondContact CD1-ND2 3.4Å; Y687-N689 VanDerWaalsContact CB-OD1 3.32Å; Y687-N689 WeakPolarHBondContact CB-OD1 3.3Å; Y687-N689 PolarHBondContact O-N 2.91Å; Y687-N689 VanDerWaalsContact O-N 3.07Å; N689-K691 WeakPolarHBondContact OD1-CB 3.38Å; N689-K691 PolarHBondContact OD1-N 3.32Å
690	G	85.8	Confident	92.6	Very high	57 Å²	57	41.5 Å²	41.5	59%	0.588	20%	0.199	S	C	*	.	S	Bend	trans	94.3	-5.1	178.9	0	0	0	0	0	115.4	Y687 K688 D692	Y687-G690 PolarHBondContact O-N 2.89Å; K688-G690 PolarHBondContact O-N 2.77Å; G690-D692 PolarHBondContact O-N 3.27Å; G690-D692 VanDerWaalsContact O-N 3.14Å
691	K	88	Confident	92.6	Very high	24 Å²	24	38 Å²	38	10%	0.104	18%	0.182	C	C	.	.			trans	-65.9	113.4	171.9	171.4	163.1	168.8	164	0	110	Y572 F686 Y687 N689 L693 E882 C906	Y572-K691 HydrophobicContact CE1-CD 4.13Å; Y572-K691 HydrophobicContact CE2-CD 3.78Å; Y572-K691 VanDerWaalsContact CZ-CD 3.46Å; Y572-K691 VanDerWaalsContact OH-CD 3.22Å; Y572-K691 WeakPolarHBondContact OH-CD 3.5Å; Y572-K691 PolarHBondContact OH-NZ 3.32Å; F686-K691 CarbonylContact C-O 3.59Å; F686-K691 VanDerWaalsContact CA-O 3.32Å; F686-K691 WeakPolarHBondContact CA-O 3.33Å; F686-K691 WeakPolarHBondContact CB-O 3.38Å; Y687-K691 HydrophobicContact CD2-CB 4.15Å; Y687-K691 HydrophobicContact CD2-CD 4.4Å; Y687-K691 HydrophobicContact CD2-CG 4.12Å; Y687-K691 PolarHBondContact N-O 2.93Å; N689-K691 WeakPolarHBondContact OD1-CB 3.38Å; N689-K691 PolarHBondContact OD1-N 3.32Å; K691-L693 PolarHBondContact O-N 2.85Å; K691-E882 IonicContact NZ-OE1 2.66Å; K691-E882 PolarHBondContact NZ-OE1 3.17Å; K691-E882 IonicContact NZ-OE2 3.15Å; K691-E882 PolarHBondContact NZ-OE2 2.88Å; K691-C906 WeakPolarHBondContact CE-O 3.38Å; K691-C906 PolarHBondContact NZ-O 3.37Å
692	D	91.5	Very high	92.7	Very high	49 Å²	49	39.7 Å²	39.7	26%	0.262	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	116.7	173.4	-159.5	-12.2	0	0	0	109.4	K684 G690 G694 P909	K684-D692 VanDerWaalsContact CE-OD1 3.24Å; K684-D692 WeakPolarHBondContact CE-OD1 3.49Å; K684-D692 WeakPolarHBondContact CE-OD2 3.34Å; K684-D692 IonicContact NZ-OD1 2.71Å; K684-D692 IonicContact NZ-OD2 3.76Å; K684-D692 PolarHBondContact NZ-OD2 3.44Å; G690-D692 PolarHBondContact O-N 3.27Å; G690-D692 VanDerWaalsContact O-N 3.14Å; D692-G694 VanDerWaalsContact C-N 3.35Å; D692-G694 WeakPolarHBondContact OD1-CA 3.27Å; D692-G694 PolarHBondContact OD1-N 2.88Å; D692-P909 HydrophobicContact CB-CG 4.29Å
693	L	92.6	Very high	92.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-36.8	170.8	-78.4	163.5	0	0	0	109.3	W568 M685 Y687 K691 W880 P909 V910	W568-L693 HydrophobicContact CH2-CD1 4.45Å; W568-L693 HydrophobicContact CZ3-CD1 4.07Å; M685-L693 HydrophobicContact CB-CB 4.06Å; M685-L693 HydrophobicContact CB-CD1 4.12Å; M685-L693 HydrophobicContact CE-CD1 4.38Å; M685-L693 WeakPolarHBondContact O-CB 3.33Å; M685-L693 PolarHBondContact O-N 2.85Å; Y687-L693 HydrophobicContact CD2-CD1 4.31Å; Y687-L693 HydrophobicContact CD2-CD2 4.31Å; Y687-L693 HydrophobicContact CD2-CG 4.05Å; Y687-L693 HydrophobicContact CE1-CD1 4.43Å; Y687-L693 HydrophobicContact CE2-CD1 3.96Å; Y687-L693 HydrophobicContact CE2-CD2 3.52Å; Y687-L693 HydrophobicContact CE2-CG 3.72Å; K691-L693 PolarHBondContact O-N 2.85Å; L693-W880 HydrophobicContact CD2-CZ2 4.34Å; L693-P909 WeakPolarHBondContact O-CB 3.4Å; L693-V910 WeakPolarHBondContact O-CG2 3.39Å; L693-V910 PolarHBondContact O-N 3.3Å
694	G	93.6	Very high	92.6	Very high	3 Å²	3	41.2 Å²	41.2	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128.4	-159.2	173	0	0	0	0	0	114.3	K684 M685 D692 T911	K684-G694 WeakPolarHBondContact CA-O 3.37Å; M685-G694 PolarHBondContact N-O 2.91Å; M685-G694 PolarHBondContact O-N 3.36Å; D692-G694 VanDerWaalsContact C-N 3.35Å; D692-G694 WeakPolarHBondContact OD1-CA 3.27Å; D692-G694 PolarHBondContact OD1-N 2.88Å; G694-T911 VanDerWaalsContact CA-OG1 3.3Å; G694-T911 WeakPolarHBondContact CA-OG1 3.39Å
695	Q	94.4	Very high	92.6	Very high	74 Å²	74	41 Å²	41	35%	0.346	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	112.8	-172.3	-173.2	166.5	-60.5	0	0	111.7	T682 Y697 T911	T682-Q695 VanDerWaalsContact CG2-CD 3.45Å; T682-Q695 HydrophobicContact CG2-CG 3.51Å; Q695-Y697 HydrophobicContact CG-CE1 4.45Å; Q695-Y697 PolarHBondContact NE2-OH 2.84Å; Q695-T911 PolarHBondContact N-OG1 3.47Å; Q695-T911 VanDerWaalsContact N-OG1 3.07Å
696	F	96.3	Very high	92.2	Very high	1 Å²	1	47.5 Å²	47.5	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	158	-178	-54.2	-89.6	0	0	0	110.6	L536 I538 L683 M685 Y878 W880 V910 T911 V913	L536-F696 HydrophobicContact CD2-CB 4.02Å; L536-F696 HydrophobicContact CD2-CD1 3.55Å; L536-F696 HydrophobicContact CD2-CD2 3.54Å; L536-F696 HydrophobicContact CD2-CE1 3.78Å; L536-F696 HydrophobicContact CD2-CE2 3.8Å; L536-F696 HydrophobicContact CD2-CG 3.41Å; L536-F696 VanDerWaalsContact CD2-CG 3.41Å; L536-F696 HydrophobicContact CD2-CZ 3.91Å; I538-F696 HydrophobicContact CD1-CB 4.17Å; L683-F696 HydrophobicContact CB-CB 4.37Å; L683-F696 PolarHBondContact N-O 2.85Å; L683-F696 PolarHBondContact O-N 3.17Å; M685-F696 HydrophobicContact CB-CE2 4.24Å; M685-F696 HydrophobicContact CG-CD2 4.33Å; M685-F696 HydrophobicContact CG-CE2 4.34Å; M685-F696 HydrophobicContact SD-CD2 4.01Å; M685-F696 HydrophobicContact SD-CE2 3.95Å; F696-Y878 HydrophobicContact CB-CD2 4.18Å; F696-Y878 HydrophobicContact CB-CE2 3.78Å; F696-Y878 HydrophobicContact CD1-CD1 4.22Å; F696-Y878 AromaticContact CD1-CD2 3.64Å; F696-Y878 HydrophobicContact CD1-CD2 3.64Å; F696-Y878 HydrophobicContact CD1-CE1 4.48Å; F696-Y878 AromaticContact CD1-CE2 3.97Å; F696-Y878 HydrophobicContact CD1-CE2 3.97Å; F696-Y878 AromaticContact CD1-CG 3.76Å; F696-Y878 HydrophobicContact CD1-CG 3.76Å; F696-Y878 HydrophobicContact CE1-CD2 4.5Å; F696-Y878 HydrophobicContact CE1-CG 4.28Å; F696-Y878 HydrophobicContact CG-CD2 4.3Å; F696-Y878 HydrophobicContact CG-CE2 4.35Å; F696-W880 HydrophobicContact CE1-CE3 4.23Å; F696-W880 AromaticContact CE1-CH2 3.88Å; F696-W880 HydrophobicContact CE1-CH2 3.88Å; F696-W880 AromaticContact CE1-CZ3 3.49Å; F696-W880 HydrophobicContact CE1-CZ3 3.49Å; F696-W880 VanDerWaalsContact CE1-CZ3 3.49Å; F696-W880 HydrophobicContact CE2-CH2 4.49Å; F696-W880 AromaticContact CZ-CH2 3.56Å; F696-W880 HydrophobicContact CZ-CH2 3.56Å; F696-W880 HydrophobicContact CZ-CZ2 4.33Å; F696-W880 AromaticContact CZ-CZ3 3.68Å; F696-W880 HydrophobicContact CZ-CZ3 3.68Å; F696-V910 HydrophobicContact CE1-CG2 4.15Å; F696-V910 HydrophobicContact CZ-CG2 3.77Å; F696-T911 HydrophobicContact CD1-CG2 3.73Å; F696-T911 HydrophobicContact CD2-CG2 4.2Å; F696-T911 HydrophobicContact CE1-CG2 3.45Å; F696-T911 VanDerWaalsContact CE1-CG2 3.45Å; F696-T911 HydrophobicContact CE2-CG2 3.94Å; F696-T911 HydrophobicContact CG-CG2 4.11Å; F696-T911 HydrophobicContact CZ-CG2 3.57Å; F696-V913 HydrophobicContact CE1-CG2 3.96Å
697	Y	95.7	Very high	92	Very high	86 Å²	86	47 Å²	47	34%	0.337	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153	-176.2	-61	-76.8	0	0	0	112.5	M680 L681 T682 Q695 A876 Y878	M680-Y697 HydrophobicContact CE-CD1 4.31Å; M680-Y697 HydrophobicContact CE-CG 4.39Å; L681-Y697 WeakPolarHBondContact O-CA 3.45Å; T682-Y697 HydrophobicContact CG2-CE1 4.22Å; Q695-Y697 HydrophobicContact CG-CE1 4.45Å; Q695-Y697 PolarHBondContact NE2-OH 2.84Å; Y697-A876 VanDerWaalsContact O-CB 3.27Å; Y697-A876 WeakPolarHBondContact O-CB 3.49Å; Y697-Y878 PolarHBondContact N-OH 2.63Å; Y697-Y878 VanDerWaalsContact N-OH 3.1Å; Y697-Y878 PolarHBondContact O-OH 3.42Å
698	S	96.9	Very high	91.5	Very high	4 Å²	4	48.3 Å²	48.3	3%	0.028	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-80.2	167.8	164.8	78.3	0	0	0	0	111.4	H540 L681	H540-S698 WeakPolarHBondContact NE2-CB 3.34Å; L681-S698 PolarHBondContact N-OG 2.74Å; L681-S698 PolarHBondContact O-N 3.23Å
699	R	96	Very high	91.1	Very high	71 Å²	71	53.6 Å²	53.6	27%	0.268	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-64.9	163.6	160.9	-61	-54.2	-166.2	170.1	5.7	110	H540 I701 D874 E935	H540-R699 PolarHBondContact CE1-O 3.35Å; H540-R699 PolarHBondContact NE2-N 3.48Å; H540-R699 VanDerWaalsContact NE2-N 3.11Å; R699-I701 PolarHBondContact O-N 3.42Å; R699-D874 HydrophobicContact CB-CB 4.2Å; R699-D874 WeakPolarHBondContact CB-OD2 3.31Å; R699-E935 IonicContact CZ-OE1 3.46Å; R699-E935 IonicContact NH1-OE1 3.22Å; R699-E935 PolarHBondContact NH1-OE1 2.95Å; R699-E935 IonicContact NH1-OE2 2.7Å; R699-E935 PolarHBondContact NH1-OE2 2.64Å; R699-E935 IonicContact NH2-OE1 3.69Å; R699-E935 PolarHBondContact NH2-OE1 3.06Å
700	R	95.4	Very high	90.7	Very high	131 Å²	131	59.4 Å²	59.4	49%	0.494	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-62	133.4	-176.4	-99.9	-174.4	-75.7	-158.7	-1.4	112	M680	M680-R700 HydrophobicContact CG-CG 3.94Å; M680-R700 HydrophobicContact SD-CG 4.31Å
701	I	96.8	Very high	90.3	Very high	3 Å²	3	62.9 Å²	62.9	2%	0.015	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125.9	176.7	-52.6	-174.1	0	0	0	109	H540 K542 A544 Y678 F679 L681 R699	H540-I701 HydrophobicContact CB-CD1 4.28Å; H540-I701 WeakPolarHBondContact ND1-CD1 3.37Å; H540-I701 WeakPolarHBondContact ND1-CG1 3.17Å; K542-I701 WeakPolarHBondContact O-CA 3.39Å; A544-I701 HydrophobicContact CB-CG2 3.75Å; Y678-I701 VanDerWaalsContact CA-O 3.28Å; Y678-I701 WeakPolarHBondContact CA-O 3.3Å; F679-I701 HydrophobicContact CD1-CB 4.36Å; F679-I701 HydrophobicContact CD2-CB 4.37Å; F679-I701 HydrophobicContact CE1-CB 3.96Å; F679-I701 HydrophobicContact CE1-CG2 3.82Å; F679-I701 HydrophobicContact CE2-CB 3.99Å; F679-I701 HydrophobicContact CE2-CD1 3.84Å; F679-I701 HydrophobicContact CE2-CG1 4.32Å; F679-I701 HydrophobicContact CE2-CG2 4.28Å; F679-I701 HydrophobicContact CZ-CB 3.77Å; F679-I701 HydrophobicContact CZ-CD1 4.12Å; F679-I701 HydrophobicContact CZ-CG1 4.48Å; F679-I701 HydrophobicContact CZ-CG2 3.61Å; F679-I701 PolarHBondContact N-O 3.15Å; F679-I701 PolarHBondContact O-N 3.11Å; L681-I701 HydrophobicContact CD1-CD1 4.04Å; L681-I701 HydrophobicContact CD2-CD1 4.33Å; L681-I701 HydrophobicContact CG-CD1 3.86Å; R699-I701 PolarHBondContact O-N 3.42Å
702	K	96.3	Very high	89.8	Confident	37 Å²	37	62.4 Å²	62.4	16%	0.161	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	130.8	178.7	-170	170.2	-176.3	174.9	0	111.4	K542 V543 A544 Y678 D718 L719	K542-K702 PolarHBondContact O-N 3.48Å; V543-K702 CarbonylContact C-O 3.53Å; V543-K702 VanDerWaalsContact CA-O 3.3Å; V543-K702 WeakPolarHBondContact CA-O 3.49Å; V543-K702 HydrophobicContact CG1-CB 4.2Å; A544-K702 PolarHBondContact N-O 2.93Å; Y678-K702 HydrophobicContact CD1-CB 3.85Å; Y678-K702 HydrophobicContact CD1-CG 4.07Å; Y678-K702 HydrophobicContact CE1-CB 3.57Å; Y678-K702 HydrophobicContact CE1-CD 3.77Å; Y678-K702 HydrophobicContact CE1-CG 3.47Å; Y678-K702 VanDerWaalsContact CE1-CG 3.47Å; Y678-K702 WeakPolarHBondContact OH-CE 3.19Å; K702-D718 HydrophobicContact CD-CB 4.4Å; K702-D718 VanDerWaalsContact NZ-CG 3.31Å; K702-D718 IonicContact NZ-OD2 2.7Å; K702-D718 PolarHBondContact NZ-OD2 3.33Å; K702-L719 HydrophobicContact CD-CD2 4.29Å
703	V	95.6	Very high	89	Confident	23 Å²	23	63 Å²	63	14%	0.139	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	122.8	177	-174.7	0	0	0	0	109.5	K546 I670 R676 K677 F679	K546-V703 HydrophobicContact CB-CG1 4.13Å; I670-V703 HydrophobicContact CD1-CG2 3.82Å; I670-V703 HydrophobicContact CG2-CG1 4.47Å; R676-V703 WeakPolarHBondContact O-CG2 3.26Å; K677-V703 PolarHBondContact O-N 3.01Å; F679-V703 HydrophobicContact CD1-CG2 3.63Å; F679-V703 HydrophobicContact CE1-CG2 3.85Å
704	I	94.4	Very high	88.4	Confident	16 Å²	16	67.4 Å²	67.4	8%	0.082	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	144.7	176.2	61.9	172.3	0	0	0	111.3	V543 A544 Q545 K546 L719 L823	V543-I704 HydrophobicContact CB-CD1 4.2Å; V543-I704 HydrophobicContact CB-CG1 4.48Å; V543-I704 HydrophobicContact CG2-CD1 3.85Å; A544-I704 WeakPolarHBondContact O-CG1 3.47Å; A544-I704 PolarHBondContact O-N 2.91Å; Q545-I704 WeakPolarHBondContact CA-O 3.27Å; K546-I704 WeakPolarHBondContact CB-O 3.38Å; K546-I704 PolarHBondContact N-O 2.83Å; I704-L719 HydrophobicContact CG2-CD2 3.94Å; I704-L823 HydrophobicContact CD1-CD1 4.16Å
705	S	92.6	Very high	87.6	Confident	67 Å²	67	76.8 Å²	76.8	47%	0.469	36%	0.361	S	S	.	.	S	Bend	trans	-73.2	-56.7	179.8	48.8	0	0	0	0	111.8	Q545 Y548	Q545-S705 WeakPolarHBondContact CG-O 3.39Å; Q545-S705 PolarHBondContact NE2-O 3.36Å; Y548-S705 WeakPolarHBondContact OH-CB 3.35Å
706	K	85.9	Confident	86.9	Confident	136 Å²	136	76.2 Å²	76.2	59%	0.591	36%	0.36	S	S	*	.	S	Bend	trans	-148.1	154.9	176	-61.3	-174.5	179.2	174.7	0	108.7
707	P	85.4	Confident	86.4	Confident	43 Å²	43	78.6 Å²	78.6	28%	0.279	38%	0.375	S	S	.	.			trans	-56.9	147.8	170.3	-21.7	33.4	0	0	0	111.1	K709 L823	P707-K709 PolarHBondContact O-N 3.27Å; P707-L823 HydrophobicContact CB-CB 3.97Å; P707-L823 HydrophobicContact CG-CB 3.61Å; P707-L823 HydrophobicContact CG-CD1 4.14Å
708	S	78.9	Confident	85.9	Confident	41 Å²	41	78.6 Å²	78.6	29%	0.287	38%	0.381	S	S	.	.			trans	-66.8	132	178.7	-169.5	0	0	0	0	110.5	K710	S708-K710 PolarHBondContact OG-O 3.34Å
709	K	77.5	Confident	85.6	Confident	207 Å²	207	79.6 Å²	79.6	90%	0.9	39%	0.386	S	S	*	.			trans	-101.1	-13.3	171.1	-74.3	-165.5	173.3	-166.1	0	113.5	P707	P707-K709 PolarHBondContact O-N 3.27Å
710	K	75.6	Confident	85.6	Confident	173 Å²	173	76.6 Å²	76.6	75%	0.752	38%	0.376	S	S	*	.	S	Bend	trans	-84.1	158	176	-64.9	-175.2	175.4	-174.7	0	108.6	S708 Q712	S708-K710 PolarHBondContact OG-O 3.34Å; K710-Q712 PolarHBondContact O-N 3.36Å; K710-Q712 VanDerWaalsContact O-N 3.15Å
711	K	77.8	Confident	85.6	Confident	131 Å²	131	70.4 Å²	70.4	57%	0.57	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-48	125.6	165.2	-78.1	-162.8	173.9	-168.5	0	107.9	S713 D817 D818	K711-S713 PolarHBondContact O-N 3.25Å; K711-D817 WeakPolarHBondContact CE-OD1 3.34Å; K711-D817 IonicContact NZ-OD1 2.61Å; K711-D817 PolarHBondContact NZ-OD1 2.69Å; K711-D817 IonicContact NZ-OD2 2.82Å; K711-D817 PolarHBondContact NZ-OD2 2.92Å; K711-D818 HydrophobicContact CB-CB 3.92Å; K711-D818 HydrophobicContact CD-CB 4.06Å; K711-D818 HydrophobicContact CG-CB 3.86Å
712	Q	77.2	Confident	85.6	Confident	13 Å²	13	71.6 Å²	71.6	6%	0.061	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-67.6	128	-176.7	-179.4	62.3	13.3	0	0	108.8	K710 N716 P819	K710-Q712 PolarHBondContact O-N 3.36Å; K710-Q712 VanDerWaalsContact O-N 3.15Å; Q712-N716 PolarHBondContact NE2-O 3.38Å; Q712-P819 HydrophobicContact CB-CB 4.2Å; Q712-P819 HydrophobicContact CB-CG 4.45Å; Q712-P819 HydrophobicContact CG-CB 4.26Å; Q712-P819 VanDerWaalsContact O-CD 3.3Å; Q712-P819 WeakPolarHBondContact O-CD 3.46Å
713	S	75	Confident	85.6	Confident	63 Å²	63	70.3 Å²	70.3	44%	0.441	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-89.5	135	175.7	-173.4	0	0	0	0	109.7	K711 K715 N716	K711-S713 PolarHBondContact O-N 3.25Å; S713-K715 PolarHBondContact O-N 2.9Å; S713-K715 PolarHBondContact OG-N 3.22Å; S713-N716 PolarHBondContact O-N 3.09Å
714	L	78.8	Confident	85.6	Confident	92 Å²	92	71.2 Å²	71.2	48%	0.482	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-59.5	-12.1	174.1	-157	65.8	0	0	0	113	N716 T717 Y781	L714-N716 PolarHBondContact O-N 3.31Å; L714-N716 VanDerWaalsContact O-N 3.13Å; L714-T717 WeakPolarHBondContact O-CG2 3.1Å; L714-Y781 HydrophobicContact CD1-CD2 3.65Å; L714-Y781 HydrophobicContact CD1-CE2 4.03Å; L714-Y781 HydrophobicContact CD1-CG 4.06Å
715	K	77.2	Confident	85.8	Confident	200 Å²	200	72.6 Å²	72.6	87%	0.87	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-65	-3.9	168.3	-63.5	-178.8	177.3	-177.5	0	114.6	S713	S713-K715 PolarHBondContact O-N 2.9Å; S713-K715 PolarHBondContact OG-N 3.22Å
716	N	79.8	Confident	86	Confident	63 Å²	63	73.2 Å²	73.2	34%	0.337	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-137.3	65.6	175.4	-176.4	10.4	0	0	0	109	Q712 S713 L714 D718 L719	Q712-N716 PolarHBondContact NE2-O 3.38Å; S713-N716 PolarHBondContact O-N 3.09Å; L714-N716 PolarHBondContact O-N 3.31Å; L714-N716 VanDerWaalsContact O-N 3.13Å; N716-D718 VanDerWaalsContact C-N 3.26Å; N716-D718 PolarHBondContact O-N 2.95Å; N716-L719 WeakPolarHBondContact ND2-CD1 3.29Å; N716-L719 PolarHBondContact O-N 3.02Å
717	T	85.5	Confident	86.6	Confident	50 Å²	50	66.7 Å²	66.7	31%	0.307	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-53.3	-38	178.6	43.4	0	0	0	0	113	L714 L719 C720 Y781	L714-T717 WeakPolarHBondContact O-CG2 3.1Å; T717-L719 PolarHBondContact O-N 3.45Å; T717-C720 WeakPolarHBondContact O-CB 3.35Å; T717-C720 PolarHBondContact O-N 2.92Å; T717-Y781 WeakPolarHBondContact CB-OH 3.23Å; T717-Y781 HydrophobicContact CG2-CE1 4.45Å; T717-Y781 HydrophobicContact CG2-CE2 4.15Å; T717-Y781 VanDerWaalsContact CG2-OH 3.28Å; T717-Y781 WeakPolarHBondContact CG2-OH 3.36Å
718	D	85	Confident	87.3	Confident	87 Å²	87	64.7 Å²	64.7	47%	0.465	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-50.5	-22.2	177.3	-63.4	12.5	0	0	0	115.5	K702 N716	K702-D718 HydrophobicContact CD-CB 4.4Å; K702-D718 VanDerWaalsContact NZ-CG 3.31Å; K702-D718 IonicContact NZ-OD2 2.7Å; K702-D718 PolarHBondContact NZ-OD2 3.33Å; N716-D718 VanDerWaalsContact C-N 3.26Å; N716-D718 PolarHBondContact O-N 2.95Å
719	L	91.9	Very high	88.2	Confident	25 Å²	25	62.8 Å²	62.8	13%	0.131	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-109.1	-3.8	178.9	-60.7	-174.4	0	0	0	113.5	V543 K702 I704 N716 T717 S821 Q822	V543-L719 HydrophobicContact CG1-CD2 4.34Å; K702-L719 HydrophobicContact CD-CD2 4.29Å; I704-L719 HydrophobicContact CG2-CD2 3.94Å; N716-L719 WeakPolarHBondContact ND2-CD1 3.29Å; N716-L719 PolarHBondContact O-N 3.02Å; T717-L719 PolarHBondContact O-N 3.45Å; L719-S821 WeakPolarHBondContact O-CA 3.33Å; L719-S821 WeakPolarHBondContact O-CB 3.2Å; L719-S821 PolarHBondContact O-OG 2.79Å; L719-Q822 HydrophobicContact CB-CG 4.48Å; L719-Q822 HydrophobicContact CD2-CG 4.27Å; L719-Q822 WeakPolarHBondContact O-CG 3.48Å; L719-Q822 PolarHBondContact O-N 3Å
720	C	94.2	Very high	89.1	Confident	8 Å²	8	53.5 Å²	53.5	5%	0.054	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-76.1	173.9	169.8	-60.4	0	0	0	0	110.5	T717 Y781 V820 Q822	T717-C720 WeakPolarHBondContact O-CB 3.35Å; T717-C720 PolarHBondContact O-N 2.92Å; C720-Y781 HydrophobicContact CB-CD1 3.41Å; C720-Y781 VanDerWaalsContact CB-CD1 3.41Å; C720-Y781 HydrophobicContact CB-CE1 3.8Å; C720-Y781 HydrophobicContact CB-CG 4.27Å; C720-V820 CarbonylContact C-O 3.59Å; C720-V820 WeakPolarHBondContact CA-O 3.28Å; C720-Q822 PolarHBondContact O-NE2 3.11Å
721	I	96.3	Very high	90.1	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	25%	0.245	C	C	.	.			trans	-116.5	128.2	170.7	-60	-179.9	0	0	0	107.7	I727 I762 Y781 I782 V820 I870	I721-I727 HydrophobicContact CD1-CG2 4.26Å; I721-I727 HydrophobicContact CG2-CG2 3.97Å; I721-I762 HydrophobicContact CG2-CG2 3.81Å; I721-Y781 WeakPolarHBondContact O-CA 3.43Å; I721-I782 HydrophobicContact CG2-CG1 4.23Å; I721-I782 PolarHBondContact O-N 3.33Å; I721-V820 HydrophobicContact CD1-CG1 4.09Å; I721-V820 PolarHBondContact N-O 2.81Å; I721-V820 VanDerWaalsContact N-O 3.1Å; I721-I870 HydrophobicContact CD1-CB 4.47Å; I721-I870 HydrophobicContact CD1-CD1 3.55Å; I721-I870 HydrophobicContact CD1-CG1 3.59Å; I721-I870 HydrophobicContact CD1-CG2 4.13Å
722	A	96.3	Very high	90.8	Very high	27 Å²	27	42.9 Å²	42.9	22%	0.223	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-100.5	155	177.7	0	0	0	0	0	111.5	T725 G780 Y781	A722-T725 HydrophobicContact CB-CG2 3.84Å; A722-T725 WeakPolarHBondContact O-CB 3.4Å; A722-T725 WeakPolarHBondContact O-CG2 3.1Å; A722-T725 PolarHBondContact O-N 3.21Å; A722-T725 PolarHBondContact O-OG1 3.26Å; A722-G780 CarbonylContact C-O 3.59Å; A722-G780 WeakPolarHBondContact CA-O 3.32Å; A722-Y781 HydrophobicContact CB-CD1 4.09Å; A722-Y781 HydrophobicContact CB-CE1 4.15Å
723	S	97.5	Very high	91.3	Very high	11 Å²	11	44.9 Å²	44.9	8%	0.077	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	150.5	169.8	-165.6	0	0	0	0	111.1	T725 I762 L764 V777 Q778 G780	S723-T725 PolarHBondContact O-N 2.87Å; S723-I762 CarbonylContact C-O 3.59Å; S723-I762 WeakPolarHBondContact CA-O 3.27Å; S723-L764 WeakPolarHBondContact OG-CB 3.49Å; S723-L764 PolarHBondContact OG-N 3.29Å; S723-V777 WeakPolarHBondContact OG-CG1 3.4Å; S723-Q778 WeakPolarHBondContact CB-O 3.48Å; S723-Q778 PolarHBondContact OG-O 3.05Å; S723-G780 PolarHBondContact N-O 3.16Å
724	G	95.7	Very high	91.7	Very high	41 Å²	41	51.7 Å²	51.7	42%	0.423	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	-7.3	-176.7	0	0	0	0	0	115.1	T761 I762	G724-T761 WeakPolarHBondContact O-CG2 3.5Å; G724-I762 PolarHBondContact N-O 2.97Å
725	T	97.2	Very high	91.8	Very high	45 Å²	45	51.8 Å²	51.8	28%	0.276	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	159.6	176	71.3	0	0	0	0	111.9	A722 S723 T761 I762	A722-T725 HydrophobicContact CB-CG2 3.84Å; A722-T725 WeakPolarHBondContact O-CB 3.4Å; A722-T725 WeakPolarHBondContact O-CG2 3.1Å; A722-T725 PolarHBondContact O-N 3.21Å; A722-T725 PolarHBondContact O-OG1 3.26Å; S723-T725 PolarHBondContact O-N 2.87Å; T725-T761 WeakPolarHBondContact O-CA 3.24Å; T725-I762 PolarHBondContact O-N 3.48Å
726	K	98.1	Very high	92.2	Very high	80 Å²	80	48.1 Å²	48.1	35%	0.348	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	139.7	179.8	-57.6	-169.4	-170.7	-57.7	0	111.3	F760 T761 S872 T873	K726-F760 CarbonylContact C-O 3.58Å; K726-F760 WeakPolarHBondContact CA-O 3.38Å; K726-T761 PolarHBondContact NZ-OG1 3.14Å; K726-S872 CarbonylContact O-C 3.53Å; K726-S872 VanDerWaalsContact O-CA 3.28Å; K726-S872 WeakPolarHBondContact O-CA 3.42Å; K726-T873 PolarHBondContact O-N 3.17Å; K726-T873 PolarHBondContact O-OG1 3.49Å
727	I	98.4	Very high	92.5	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	158.6	179.5	60.3	164.7	0	0	0	111.4	I721 L729 F760 I762 L790 I870 I871 T873	I721-I727 HydrophobicContact CD1-CG2 4.26Å; I721-I727 HydrophobicContact CG2-CG2 3.97Å; I727-L729 HydrophobicContact CD1-CD2 4.11Å; I727-L729 HydrophobicContact CD1-CG 4.22Å; I727-F760 HydrophobicContact CG1-CB 4.34Å; I727-F760 WeakPolarHBondContact CG1-O 3.33Å; I727-F760 PolarHBondContact N-O 3.12Å; I727-F760 PolarHBondContact O-N 3.11Å; I727-I762 HydrophobicContact CD1-CB 3.97Å; I727-I762 HydrophobicContact CD1-CD1 4.11Å; I727-I762 HydrophobicContact CD1-CG2 4.19Å; I727-I762 HydrophobicContact CG1-CB 4.24Å; I727-I762 HydrophobicContact CG1-CG2 4.2Å; I727-I762 HydrophobicContact CG2-CG2 3.84Å; I727-L790 HydrophobicContact CD1-CD2 3.93Å; I727-I870 HydrophobicContact CB-CG1 4.32Å; I727-I870 HydrophobicContact CD1-CD1 3.64Å; I727-I870 HydrophobicContact CD1-CG1 3.96Å; I727-I870 HydrophobicContact CG2-CD1 4.36Å; I727-I870 HydrophobicContact CG2-CG1 4.24Å; I727-I871 CarbonylContact C-O 3.49Å; I727-I871 VanDerWaalsContact CA-O 3.22Å; I727-I871 WeakPolarHBondContact CA-O 3.37Å; I727-I871 WeakPolarHBondContact CB-O 3.43Å; I727-T873 PolarHBondContact N-OG1 2.84Å
728	A	98.5	Very high	92.7	Very high	1 Å²	1	53 Å²	53	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	150.2	157.4	0	0	0	0	0	109.9	P557 W757 I871 T873	P557-A728 HydrophobicContact CG-CB 3.94Å; A728-W757 HydrophobicContact CB-CE3 3.87Å; A728-W757 HydrophobicContact CB-CZ3 4.17Å; A728-I871 HydrophobicContact CB-CG2 4.37Å; A728-I871 PolarHBondContact N-O 3.2Å; A728-I871 PolarHBondContact O-N 3.04Å; A728-T873 HydrophobicContact CB-CG2 3.64Å
729	L	98.3	Very high	93	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.8	174.4	-65.8	178.3	0	0	0	109.6	I727 Y742 L743 L790 F828 W868 I870	I727-L729 HydrophobicContact CD1-CD2 4.11Å; I727-L729 HydrophobicContact CD1-CG 4.22Å; L729-Y742 WeakPolarHBondContact O-CA 3.49Å; L729-L743 HydrophobicContact CB-CB 4.08Å; L729-L743 HydrophobicContact CB-CD2 4.49Å; L729-L743 HydrophobicContact CD1-CD2 3.95Å; L729-L743 PolarHBondContact O-N 2.95Å; L729-L790 HydrophobicContact CD1-CD1 3.72Å; L729-F828 HydrophobicContact CD1-CD2 4.26Å; L729-F828 HydrophobicContact CD1-CE2 3.5Å; L729-F828 VanDerWaalsContact CD1-CE2 3.5Å; L729-F828 HydrophobicContact CD1-CZ 3.82Å; L729-F828 HydrophobicContact CD2-CE2 3.74Å; L729-F828 HydrophobicContact CD2-CZ 3.84Å; L729-F828 HydrophobicContact CG-CE2 4.28Å; L729-W868 HydrophobicContact CB-CE3 4.04Å; L729-W868 HydrophobicContact CD2-CB 4.49Å; L729-I870 HydrophobicContact CD2-CB 3.77Å; L729-I870 HydrophobicContact CD2-CD1 4.17Å; L729-I870 HydrophobicContact CD2-CG1 3.76Å
730	F	97.3	Very high	93.1	Very high	12 Å²	12	49.5 Å²	49.5	5%	0.053	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.9	176.3	70.3	-91.3	0	0	0	113.8	C556 T740 R741 Y742 L823 T869 I871	C556-F730 HydrophobicContact CB-CZ 4.23Å; C556-F730 WeakPolarHBondContact SG-CE2 3.49Å; C556-F730 VanDerWaalsContact SG-CZ 3.56Å; F730-T740 HydrophobicContact CB-CG2 4.44Å; F730-T740 HydrophobicContact CD2-CG2 4.07Å; F730-R741 CarbonylContact C-O 3.56Å; F730-R741 WeakPolarHBondContact CA-O 3.34Å; F730-R741 WeakPolarHBondContact CB-O 3.32Å; F730-Y742 HydrophobicContact CB-CD1 3.5Å; F730-Y742 HydrophobicContact CB-CE1 3.75Å; F730-Y742 HydrophobicContact CB-CG 4.36Å; F730-Y742 HydrophobicContact CG-CD1 4.38Å; F730-Y742 HydrophobicContact CG-CE1 4.21Å; F730-L823 HydrophobicContact CE1-CD2 3.93Å; F730-L823 HydrophobicContact CZ-CD2 3.8Å; F730-T869 HydrophobicContact CE1-CG2 3.94Å; F730-T869 HydrophobicContact CE2-CG2 3.99Å; F730-T869 HydrophobicContact CZ-CG2 3.54Å; F730-T869 PolarHBondContact N-O 3.13Å; F730-T869 WeakPolarHBondContact O-CA 3.3Å; F730-T869 VanDerWaalsContact O-CB 3.3Å; F730-T869 WeakPolarHBondContact O-CB 3.43Å; F730-T869 PolarHBondContact O-N 2.85Å; F730-T869 PolarHBondContact O-OG1 2.82Å; F730-T869 VanDerWaalsContact O-OG1 3.1Å; F730-I871 HydrophobicContact CD1-CG2 4.36Å; F730-I871 HydrophobicContact CE1-CG2 4.05Å
731	N	96.1	Very high	93.3	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.011	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	153	168.4	-162.1	-51.9	0	0	0	109.4	T740 R741 L840 D864 A865 W868	N731-T740 CarbonylContact O-C 3.59Å; N731-T740 VanDerWaalsContact O-CA 3.32Å; N731-T740 WeakPolarHBondContact O-CA 3.49Å; N731-T740 WeakPolarHBondContact O-CG2 3.34Å; N731-R741 PolarHBondContact N-O 2.83Å; N731-R741 PolarHBondContact O-N 2.66Å; N731-L840 HydrophobicContact CB-CD2 3.34Å; N731-D864 PolarHBondContact ND2-O 3.2Å; N731-A865 PolarHBondContact ND2-O 3.47Å; N731-W868 HydrophobicContact CB-CE3 4.2Å; N731-W868 HydrophobicContact CB-CZ3 4.24Å
732	R	92.4	Very high	93.3	Very high	79 Å²	79	52.7 Å²	52.7	30%	0.298	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	83.1	179.8	-172.9	177.1	163.4	129.1	1.5	109.7	R734 S735 Q736 T737 T740	R732-R734 PolarHBondContact O-N 3.07Å; R732-S735 VanDerWaalsContact CZ-O 3.28Å; R732-S735 VanDerWaalsContact NE-C 3.35Å; R732-S735 PolarHBondContact NE-O 2.7Å; R732-S735 PolarHBondContact NH2-O 3.49Å; R732-S735 PolarHBondContact O-N 2.63Å; R732-Q736 VanDerWaalsContact CG-O 3.24Å; R732-Q736 WeakPolarHBondContact CG-O 3.28Å; R732-T737 PolarHBondContact NH1-OG1 3.47Å; R732-T737 PolarHBondContact NH2-OG1 3.38Å; R732-T740 HydrophobicContact CB-CG2 4.48Å
733	L	87	Confident	93.4	Very high	54 Å²	54	51.4 Å²	51.4	28%	0.283	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-55.8	136.4	-176	-68.9	80.9	0	0	0	111.1	S735 Q736 S739 L840	L733-S735 PolarHBondContact O-N 3.17Å; L733-Q736 PolarHBondContact O-N 2.73Å; L733-S739 PolarHBondContact O-OG 3Å; L733-L840 HydrophobicContact CD1-CD1 4.44Å; L733-L840 HydrophobicContact CD1-CD2 4.33Å
734	R	83.8	Confident	93.4	Very high	206 Å²	206	51.5 Å²	51.5	78%	0.777	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	48.3	28.8	177.5	-63	178	-74	168.2	-4.4	114.4	R732 Q736	R732-R734 PolarHBondContact O-N 3.07Å; R734-Q736 PolarHBondContact O-N 2.8Å; R734-Q736 VanDerWaalsContact O-N 3.13Å
735	S	81	Confident	93.4	Very high	94 Å²	94	50.1 Å²	50.1	66%	0.657	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	58.9	14.2	-176.6	-59.2	0	0	0	0	116.2	R732 L733	R732-S735 VanDerWaalsContact CZ-O 3.28Å; R732-S735 VanDerWaalsContact NE-C 3.35Å; R732-S735 PolarHBondContact NE-O 2.7Å; R732-S735 PolarHBondContact NH2-O 3.49Å; R732-S735 PolarHBondContact O-N 2.63Å; L733-S735 PolarHBondContact O-N 3.17Å
736	Q	85.4	Confident	93.1	Very high	123 Å²	123	51.4 Å²	51.4	58%	0.575	26%	0.255	S	S	*	.			trans	-83	137.1	-178.2	-65.6	-61.5	-21.8	0	0	112.5	R732 L733 R734 V738 S739	R732-Q736 VanDerWaalsContact CG-O 3.24Å; R732-Q736 WeakPolarHBondContact CG-O 3.28Å; L733-Q736 PolarHBondContact O-N 2.73Å; R734-Q736 PolarHBondContact O-N 2.8Å; R734-Q736 VanDerWaalsContact O-N 3.13Å; Q736-V738 PolarHBondContact O-N 3.03Å; Q736-S739 WeakPolarHBondContact CB-OG 3.43Å; Q736-S739 PolarHBondContact O-N 3.46Å; Q736-S739 PolarHBondContact O-OG 3.5Å
737	T	86.7	Confident	92.6	Very high	77 Å²	77	52.9 Å²	52.9	47%	0.472	27%	0.267	S	S	.	.	S	Bend	trans	-66.5	-38.7	-177	-51.5	0	0	0	0	112	R732 S739 T740	R732-T737 PolarHBondContact NH1-OG1 3.47Å; R732-T737 PolarHBondContact NH2-OG1 3.38Å; T737-S739 VanDerWaalsContact C-N 3.3Å; T737-S739 PolarHBondContact O-N 3.16Å; T737-T740 WeakPolarHBondContact O-CB 2.98Å; T737-T740 PolarHBondContact O-N 2.75Å; T737-T740 VanDerWaalsContact O-N 3.12Å; T737-T740 PolarHBondContact O-OG1 3.18Å
738	V	89.7	Confident	92.1	Very high	138 Å²	138	56.7 Å²	56.7	84%	0.836	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-26.2	-176.8	-175.8	0	0	0	0	112.7	Q736 T740 R741	Q736-V738 PolarHBondContact O-N 3.03Å; V738-T740 VanDerWaalsContact C-N 3.31Å; V738-R741 PolarHBondContact O-NH1 2.8Å
739	S	90.9	Very high	91.8	Very high	32 Å²	32	59.3 Å²	59.3	22%	0.224	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	18.8	173.8	59.6	0	0	0	0	113.4	L733 Q736 T737	L733-S739 PolarHBondContact O-OG 3Å; Q736-S739 WeakPolarHBondContact CB-OG 3.43Å; Q736-S739 PolarHBondContact O-N 3.46Å; Q736-S739 PolarHBondContact O-OG 3.5Å; T737-S739 VanDerWaalsContact C-N 3.3Å; T737-S739 PolarHBondContact O-N 3.16Å
740	T	95.2	Very high	91.7	Very high	8 Å²	8	61.1 Å²	61.1	5%	0.049	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	137.4	168.2	-45	0	0	0	0	108.9	F730 N731 R732 T737 V738 Y742	F730-T740 HydrophobicContact CB-CG2 4.44Å; F730-T740 HydrophobicContact CD2-CG2 4.07Å; N731-T740 CarbonylContact O-C 3.59Å; N731-T740 VanDerWaalsContact O-CA 3.32Å; N731-T740 WeakPolarHBondContact O-CA 3.49Å; N731-T740 WeakPolarHBondContact O-CG2 3.34Å; R732-T740 HydrophobicContact CB-CG2 4.48Å; T737-T740 WeakPolarHBondContact O-CB 2.98Å; T737-T740 PolarHBondContact O-N 2.75Å; T737-T740 VanDerWaalsContact O-N 3.12Å; T737-T740 PolarHBondContact O-OG1 3.18Å; V738-T740 VanDerWaalsContact C-N 3.31Å; T740-Y742 HydrophobicContact CG2-CE1 4Å; T740-Y742 HydrophobicContact CG2-CE2 4.07Å; T740-Y742 WeakPolarHBondContact CG2-OH 3.21Å
741	R	96.6	Very high	91.6	Very high	53 Å²	53	62 Å²	62	20%	0.2	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	137.5	174.4	-69.1	-58.3	-170.1	-91	3.6	110.2	F730 N731 V738 A752 S753 L840 D843	F730-R741 CarbonylContact C-O 3.56Å; F730-R741 WeakPolarHBondContact CA-O 3.34Å; F730-R741 WeakPolarHBondContact CB-O 3.32Å; N731-R741 PolarHBondContact N-O 2.83Å; N731-R741 PolarHBondContact O-N 2.66Å; V738-R741 PolarHBondContact O-NH1 2.8Å; R741-A752 HydrophobicContact CB-CB 4.18Å; R741-A752 WeakPolarHBondContact CD-O 3.36Å; R741-S753 CarbonylContact C-O 3.56Å; R741-S753 WeakPolarHBondContact CA-O 3.45Å; R741-S753 WeakPolarHBondContact CD-O 3.42Å; R741-L840 HydrophobicContact CB-CD2 4.29Å; R741-D843 IonicContact CZ-OD1 2.66Å; R741-D843 VanDerWaalsContact CZ-OD1 3.22Å; R741-D843 IonicContact NE-OD1 3.3Å; R741-D843 PolarHBondContact NE-OD1 2.79Å; R741-D843 IonicContact NH2-OD1 3.41Å; R741-D843 PolarHBondContact NH2-OD1 3.18Å
742	Y	97.7	Very high	91.6	Very high	22 Å²	22	61.9 Å²	61.9	9%	0.086	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138	-179.1	-52.9	-84.8	0	0	0	109.2	P557 P558 L729 F730 T740 H744 A752 S753 W757	P557-Y742 HydrophobicContact CB-CD1 4.08Å; P557-Y742 HydrophobicContact CB-CE1 3.84Å; P558-Y742 WeakPolarHBondContact CD-OH 3.48Å; L729-Y742 WeakPolarHBondContact O-CA 3.49Å; F730-Y742 HydrophobicContact CB-CD1 3.5Å; F730-Y742 HydrophobicContact CB-CE1 3.75Å; F730-Y742 HydrophobicContact CB-CG 4.36Å; F730-Y742 HydrophobicContact CG-CD1 4.38Å; F730-Y742 HydrophobicContact CG-CE1 4.21Å; T740-Y742 HydrophobicContact CG2-CE1 4Å; T740-Y742 HydrophobicContact CG2-CE2 4.07Å; T740-Y742 WeakPolarHBondContact CG2-OH 3.21Å; Y742-H744 PolarHBondContact O-N 2.81Å; Y742-A752 CarbonylContact O-C 3.57Å; Y742-A752 WeakPolarHBondContact O-CA 3.25Å; Y742-S753 PolarHBondContact N-O 2.91Å; Y742-S753 PolarHBondContact O-N 3.03Å; Y742-W757 VanDerWaalsContact CB-CB 3.46Å; Y742-W757 HydrophobicContact CD1-CB 3.83Å; Y742-W757 HydrophobicContact CD2-CB 4.28Å; Y742-W757 HydrophobicContact CG-CB 3.59Å
743	L	97.8	Very high	91.7	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	129.3	166.2	-173.1	66.8	0	0	0	107.9	L729 F750 G758 F760 L799 I845 W868	L729-L743 HydrophobicContact CB-CB 4.08Å; L729-L743 HydrophobicContact CB-CD2 4.49Å; L729-L743 HydrophobicContact CD1-CD2 3.95Å; L729-L743 PolarHBondContact O-N 2.95Å; L743-F750 HydrophobicContact CD1-CD1 4.2Å; L743-F750 HydrophobicContact CG-CD1 4.5Å; L743-G758 WeakPolarHBondContact O-CA 3.36Å; L743-G758 PolarHBondContact O-N 3.46Å; L743-F760 HydrophobicContact CB-CE2 3.9Å; L743-F760 HydrophobicContact CB-CZ 4.24Å; L743-F760 HydrophobicContact CD2-CD2 4.23Å; L743-F760 HydrophobicContact CD2-CE1 4.29Å; L743-F760 HydrophobicContact CD2-CE2 3.78Å; L743-F760 HydrophobicContact CD2-CZ 3.83Å; L743-F760 HydrophobicContact CG-CE1 4.46Å; L743-F760 HydrophobicContact CG-CE2 3.75Å; L743-F760 HydrophobicContact CG-CZ 3.65Å; L743-F760 WeakPolarHBondContact O-CE2 3.3Å; L743-L799 HydrophobicContact CD2-CD1 4.25Å; L743-I845 HydrophobicContact CD1-CD1 3.53Å; L743-I845 HydrophobicContact CD1-CG1 3.64Å; L743-W868 HydrophobicContact CB-CZ3 4.26Å
744	H	97.2	Very high	92	Very high	12 Å²	12	59 Å²	59	6%	0.056	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	163.7	-177.7	-176.1	-116.4	0	0	0	109.4	Y742 E746 H751	Y742-H744 PolarHBondContact O-N 2.81Å; H744-E746 IonicContact CE1-OE1 3.19Å; H744-H751 VanDerWaalsContact C-CE1 3.49Å; H744-H751 AromaticContact CG-CE1 3.71Å; H744-H751 AromaticContact CG-NE2 3.58Å; H744-H751 PolarHBondContact N-O 2.84Å; H744-H751 AromaticContact ND1-CE1 3.06Å; H744-H751 PolarHBondContact ND1-CE1 2.83Å; H744-H751 AromaticContact ND1-NE2 2.94Å; H744-H751 PolarHBondContact ND1-NE2 2.93Å; H744-H751 PolarHBondContact O-N 2.95Å; H744-H751 PolarHBondContact O-ND1 2.98Å
745	V	95.7	Very high	92.4	Very high	12 Å²	12	51.7 Å²	51.7	7%	0.073	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.6	-178.6	174.3	0	0	0	0	108.7	S749 F750 F760 C792 T795 M797	V745-S749 WeakPolarHBondContact CA-O 3.27Å; V745-F750 HydrophobicContact CG2-CD1 3.57Å; V745-F750 HydrophobicContact CG2-CE1 3.59Å; V745-F750 HydrophobicContact CG2-CG 4.11Å; V745-F750 HydrophobicContact CG2-CZ 4.13Å; V745-F760 HydrophobicContact CG2-CE1 3.88Å; V745-F760 HydrophobicContact CG2-CZ 4.19Å; V745-C792 HydrophobicContact CG2-CB 4.14Å; V745-T795 HydrophobicContact CG1-CG2 3.94Å; V745-M797 HydrophobicContact CG1-CE 3.58Å; V745-M797 HydrophobicContact CG1-SD 3.35Å; V745-M797 WeakPolarHBondContact CG1-SD 3.04Å; V745-M797 HydrophobicContact CG2-CE 4.35Å
746	E	90.9	Very high	93	Very high	72 Å²	72	49.9 Å²	49.9	34%	0.336	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	144.7	-177	-161.4	154.2	-121.8	0	0	106.1	H744 A748 S749 H751 R756	H744-E746 IonicContact CE1-OE1 3.19Å; E746-A748 VanDerWaalsContact C-N 3.29Å; E746-A748 PolarHBondContact O-N 2.82Å; E746-S749 PolarHBondContact N-O 2.9Å; E746-S749 VanDerWaalsContact N-O 3.15Å; E746-S749 WeakPolarHBondContact O-CA 3.32Å; E746-S749 PolarHBondContact O-N 2.94Å; E746-S749 VanDerWaalsContact O-O 3.13Å; E746-S749 PolarHBondContact O-OG 3.49Å; E746-H751 WeakPolarHBondContact CB-CE1 3.48Å; E746-H751 PolarHBondContact N-CE1 3.17Å; E746-H751 IonicContact OE2-CE1 3.04Å; E746-H751 IonicContact OE2-NE2 3.01Å; E746-R756 IonicContact OE1-CZ 2.72Å; E746-R756 IonicContact OE1-NH1 2.74Å; E746-R756 PolarHBondContact OE1-NH1 3.01Å
747	D	88.6	Confident	93.6	Very high	111 Å²	111	44.1 Å²	44.1	59%	0.594	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	44	-178.5	-53.9	-6.7	0	0	0	114	L422 S749	L422-D747 WeakPolarHBondContact CD1-OD1 3.36Å; D747-S749 PolarHBondContact O-N 3.31Å; D747-S749 VanDerWaalsContact O-N 3.14Å
748	A	87.3	Confident	94	Very high	80 Å²	80	40.7 Å²	40.7	66%	0.661	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	24.1	-173.9	0	0	0	0	0	115	E746 M797	E746-A748 VanDerWaalsContact C-N 3.29Å; E746-A748 PolarHBondContact O-N 2.82Å; A748-M797 VanDerWaalsContact C-CE 3.41Å; A748-M797 VanDerWaalsContact C-SD 3.52Å; A748-M797 VanDerWaalsContact CA-SD 3.55Å; A748-M797 HydrophobicContact CB-SD 4.28Å; A748-M797 WeakPolarHBondContact O-CE 3.27Å
749	S	93.2	Very high	94.4	Very high	57 Å²	57	34.4 Å²	34.4	40%	0.399	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	141.6	-174.4	77.7	0	0	0	0	114	V745 E746 D747 H751	V745-S749 WeakPolarHBondContact CA-O 3.27Å; E746-S749 PolarHBondContact N-O 2.9Å; E746-S749 VanDerWaalsContact N-O 3.15Å; E746-S749 WeakPolarHBondContact O-CA 3.32Å; E746-S749 PolarHBondContact O-N 2.94Å; E746-S749 VanDerWaalsContact O-O 3.13Å; E746-S749 PolarHBondContact O-OG 3.49Å; D747-S749 PolarHBondContact O-N 3.31Å; D747-S749 VanDerWaalsContact O-N 3.14Å; S749-H751 PolarHBondContact O-ND1 2.87Å
750	F	95.3	Very high	94.7	Very high	39 Å²	39	32.9 Å²	32.9	17%	0.171	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.5	172.1	-74.4	-89.9	0	0	0	110.9	L743 V745 F760 M797 A798 L799 I845	L743-F750 HydrophobicContact CD1-CD1 4.2Å; L743-F750 HydrophobicContact CG-CD1 4.5Å; V745-F750 HydrophobicContact CG2-CD1 3.57Å; V745-F750 HydrophobicContact CG2-CE1 3.59Å; V745-F750 HydrophobicContact CG2-CG 4.11Å; V745-F750 HydrophobicContact CG2-CZ 4.13Å; F750-F760 HydrophobicContact CD1-CE1 4.34Å; F750-F760 HydrophobicContact CE1-CD1 4.39Å; F750-F760 AromaticContact CE1-CE1 3.7Å; F750-F760 HydrophobicContact CE1-CE1 3.7Å; F750-F760 HydrophobicContact CE1-CZ 4.47Å; F750-M797 HydrophobicContact CD2-CE 3.62Å; F750-M797 HydrophobicContact CE2-CB 4.09Å; F750-M797 HydrophobicContact CE2-CE 3.54Å; F750-M797 HydrophobicContact CG-CE 4.45Å; F750-M797 HydrophobicContact CZ-CB 4.14Å; F750-M797 HydrophobicContact CZ-CE 4.3Å; F750-A798 WeakPolarHBondContact CE2-O 3.19Å; F750-L799 HydrophobicContact CD1-CD1 4.46Å; F750-L799 HydrophobicContact CD1-CD2 3.93Å; F750-L799 HydrophobicContact CD1-CG 4.12Å; F750-L799 HydrophobicContact CD2-CD2 3.8Å; F750-L799 HydrophobicContact CE1-CD1 4.21Å; F750-L799 HydrophobicContact CE1-CD2 3.93Å; F750-L799 HydrophobicContact CE1-CG 3.68Å; F750-L799 HydrophobicContact CE2-CD2 3.82Å; F750-L799 HydrophobicContact CE2-CG 4.12Å; F750-L799 HydrophobicContact CG-CD2 3.86Å; F750-L799 HydrophobicContact CZ-CD2 3.9Å; F750-L799 HydrophobicContact CZ-CG 3.7Å; F750-I845 HydrophobicContact CB-CB 4.41Å; F750-I845 HydrophobicContact CB-CG1 4.23Å
751	H	94.5	Very high	94.9	Very high	29 Å²	29	33.5 Å²	33.5	13%	0.134	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	173.3	-180	66.9	-79.4	0	0	0	110.6	H744 E746 S749 D843	H744-H751 VanDerWaalsContact C-CE1 3.49Å; H744-H751 AromaticContact CG-CE1 3.71Å; H744-H751 AromaticContact CG-NE2 3.58Å; H744-H751 PolarHBondContact N-O 2.84Å; H744-H751 AromaticContact ND1-CE1 3.06Å; H744-H751 PolarHBondContact ND1-CE1 2.83Å; H744-H751 AromaticContact ND1-NE2 2.94Å; H744-H751 PolarHBondContact ND1-NE2 2.93Å; H744-H751 PolarHBondContact O-N 2.95Å; H744-H751 PolarHBondContact O-ND1 2.98Å; E746-H751 WeakPolarHBondContact CB-CE1 3.48Å; E746-H751 PolarHBondContact N-CE1 3.17Å; E746-H751 IonicContact OE2-CE1 3.04Å; E746-H751 IonicContact OE2-NE2 3.01Å; S749-H751 PolarHBondContact O-ND1 2.87Å; H751-D843 WeakPolarHBondContact CB-O 3.48Å
752	A	95.6	Very high	94.9	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	88.3	-176.9	0	0	0	0	0	109.7	R741 Y742 L840 D843 I845	R741-A752 HydrophobicContact CB-CB 4.18Å; R741-A752 WeakPolarHBondContact CD-O 3.36Å; Y742-A752 CarbonylContact O-C 3.57Å; Y742-A752 WeakPolarHBondContact O-CA 3.25Å; A752-L840 HydrophobicContact CB-CB 4.08Å; A752-D843 PolarHBondContact N-O 2.93Å; A752-D843 WeakPolarHBondContact O-CA 3.47Å; A752-I845 HydrophobicContact CB-CD1 4.03Å
753	S	95.7	Very high	94.9	Very high	10 Å²	10	30.7 Å²	30.7	7%	0.07	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	149.8	-174.1	-170.9	0	0	0	0	113.1	R741 Y742 S755 R756	R741-S753 CarbonylContact C-O 3.56Å; R741-S753 WeakPolarHBondContact CA-O 3.45Å; R741-S753 WeakPolarHBondContact CD-O 3.42Å; Y742-S753 PolarHBondContact N-O 2.91Å; Y742-S753 PolarHBondContact O-N 3.03Å; S753-S755 PolarHBondContact OG-N 2.83Å; S753-S755 PolarHBondContact OG-OG 3.45Å; S753-R756 WeakPolarHBondContact CB-O 3.32Å; S753-R756 PolarHBondContact OG-N 3.07Å; S753-R756 VanDerWaalsContact OG-N 3.16Å
754	S	93.7	Very high	94.9	Very high	63 Å²	63	31.1 Å²	31.1	44%	0.441	19%	0.185	S	C	.	.	S	Bend	trans	-101.1	-5.7	171.7	65.1	0	0	0	0	113.6
755	S	91.4	Very high	94.8	Very high	53 Å²	53	30.7 Å²	30.7	37%	0.371	18%	0.183	S	C	.	.	S	Bend	trans	-119.4	-54.1	-173	54.7	0	0	0	0	112.1	Y662 N664 S753	Y662-S755 PolarHBondContact OH-O 3.35Å; N664-S755 PolarHBondContact ND2-O 2.83Å; S753-S755 PolarHBondContact OG-N 2.83Å; S753-S755 PolarHBondContact OG-OG 3.45Å
756	R	94.5	Very high	94.7	Very high	55 Å²	55	31 Å²	31	21%	0.208	19%	0.187	C	C	.	.			trans	-97.2	169.8	177.7	-70.4	177.2	168.2	161.4	-7.4	110.7	D661 Y662 E746 S753	D661-R756 IonicContact OD1-NH2 3.72Å; D661-R756 PolarHBondContact OD1-NH2 3.1Å; D661-R756 VanDerWaalsContact OD1-NH2 3.09Å; D661-R756 IonicContact OD2-NH2 2.8Å; D661-R756 PolarHBondContact OD2-NH2 3.09Å; Y662-R756 HydrophobicContact CD1-CG 4.21Å; Y662-R756 HydrophobicContact CE1-CG 3.74Å; Y662-R756 HydrophobicContact CE2-CG 4.46Å; E746-R756 IonicContact OE1-CZ 2.72Å; E746-R756 IonicContact OE1-NH1 2.74Å; E746-R756 PolarHBondContact OE1-NH1 3.01Å; S753-R756 WeakPolarHBondContact CB-O 3.32Å; S753-R756 PolarHBondContact OG-N 3.07Å; S753-R756 VanDerWaalsContact OG-N 3.16Å
757	W	97.1	Very high	94.6	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.008	20%	0.198	C	C	.	.			trans	-147.4	135.4	175.3	59.4	-95.8	0	0	0	109.6	L539 P557 P558 C560 A728 Y742 T873	L539-W757 HydrophobicContact CB-CH2 3.58Å; L539-W757 HydrophobicContact CB-CZ2 3.65Å; L539-W757 HydrophobicContact CB-CZ3 4.49Å; L539-W757 HydrophobicContact CD1-CH2 4.41Å; P557-W757 HydrophobicContact CB-CB 4.35Å; P557-W757 HydrophobicContact CB-CD2 3.68Å; P557-W757 HydrophobicContact CB-CE3 4.33Å; P557-W757 HydrophobicContact CB-CG 3.7Å; P557-W757 HydrophobicContact CB-CZ2 4.26Å; P557-W757 HydrophobicContact CG-CD2 3.99Å; P557-W757 HydrophobicContact CG-CE3 4.19Å; P557-W757 HydrophobicContact CG-CG 4.5Å; P557-W757 HydrophobicContact CG-CH2 4.24Å; P557-W757 HydrophobicContact CG-CZ2 4.05Å; P557-W757 HydrophobicContact CG-CZ3 4.34Å; P558-W757 PolarHBondContact O-NE1 3.03Å; C560-W757 PolarHBondContact SG-NE1 3.33Å; A728-W757 HydrophobicContact CB-CE3 3.87Å; A728-W757 HydrophobicContact CB-CZ3 4.17Å; Y742-W757 VanDerWaalsContact CB-CB 3.46Å; Y742-W757 HydrophobicContact CD1-CB 3.83Å; Y742-W757 HydrophobicContact CD2-CB 4.28Å; Y742-W757 HydrophobicContact CG-CB 3.59Å; W757-T873 HydrophobicContact CE3-CG2 4.44Å; W757-T873 HydrophobicContact CH2-CG2 3.77Å; W757-T873 HydrophobicContact CZ3-CG2 3.51Å
758	G	95.9	Very high	94.7	Very high	6 Å²	6	33.4 Å²	33.4	6%	0.062	20%	0.202	C	C	.	.			trans	-84.3	143	-179.9	0	0	0	0	0	111.6	L743 F760	L743-G758 WeakPolarHBondContact O-CA 3.36Å; L743-G758 PolarHBondContact O-N 3.46Å; G758-F760 VanDerWaalsContact C-CE2 3.44Å; G758-F760 WeakPolarHBondContact O-CD2 3.36Å; G758-F760 VanDerWaalsContact O-CE2 3.28Å; G758-F760 WeakPolarHBondContact O-CE2 3.28Å
759	S	97	Very high	94.7	Very high	5 Å²	5	31.9 Å²	31.9	4%	0.035	18%	0.181	C	C	.	.			trans	-98.7	124.6	167.3	-160.9	0	0	0	0	108.4	S793 T873	S759-S793 PolarHBondContact O-N 2.94Å; S759-S793 PolarHBondContact O-OG 3.04Å; S759-T873 PolarHBondContact OG-OG1 3.05Å
760	F	98.2	Very high	94.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	127.8	-174.6	-57.4	-85.1	0	0	0	109.7	K726 I727 L743 V745 F750 G758 I762 V791 C792	K726-F760 CarbonylContact C-O 3.58Å; K726-F760 WeakPolarHBondContact CA-O 3.38Å; I727-F760 HydrophobicContact CG1-CB 4.34Å; I727-F760 WeakPolarHBondContact CG1-O 3.33Å; I727-F760 PolarHBondContact N-O 3.12Å; I727-F760 PolarHBondContact O-N 3.11Å; L743-F760 HydrophobicContact CB-CE2 3.9Å; L743-F760 HydrophobicContact CB-CZ 4.24Å; L743-F760 HydrophobicContact CD2-CD2 4.23Å; L743-F760 HydrophobicContact CD2-CE1 4.29Å; L743-F760 HydrophobicContact CD2-CE2 3.78Å; L743-F760 HydrophobicContact CD2-CZ 3.83Å; L743-F760 HydrophobicContact CG-CE1 4.46Å; L743-F760 HydrophobicContact CG-CE2 3.75Å; L743-F760 HydrophobicContact CG-CZ 3.65Å; L743-F760 WeakPolarHBondContact O-CE2 3.3Å; V745-F760 HydrophobicContact CG2-CE1 3.88Å; V745-F760 HydrophobicContact CG2-CZ 4.19Å; F750-F760 HydrophobicContact CD1-CE1 4.34Å; F750-F760 HydrophobicContact CE1-CD1 4.39Å; F750-F760 AromaticContact CE1-CE1 3.7Å; F750-F760 HydrophobicContact CE1-CE1 3.7Å; F750-F760 HydrophobicContact CE1-CZ 4.47Å; G758-F760 VanDerWaalsContact C-CE2 3.44Å; G758-F760 WeakPolarHBondContact O-CD2 3.36Å; G758-F760 VanDerWaalsContact O-CE2 3.28Å; G758-F760 WeakPolarHBondContact O-CE2 3.28Å; F760-I762 PolarHBondContact O-N 2.82Å; F760-V791 CarbonylContact C-O 3.57Å; F760-V791 VanDerWaalsContact CA-O 3.26Å; F760-V791 WeakPolarHBondContact CA-O 3.44Å; F760-C792 HydrophobicContact CD1-CB 4.02Å; F760-C792 HydrophobicContact CE1-CB 3.89Å
761	T	98	Very high	94.3	Very high	22 Å²	22	37.7 Å²	37.7	14%	0.135	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	125.9	166.6	-45	0	0	0	0	108.1	G724 T725 K726 N763 V791	G724-T761 WeakPolarHBondContact O-CG2 3.5Å; T725-T761 WeakPolarHBondContact O-CA 3.24Å; K726-T761 PolarHBondContact NZ-OG1 3.14Å; T761-N763 WeakPolarHBondContact CG2-OD1 3.41Å; T761-V791 PolarHBondContact N-O 3.08Å; T761-V791 PolarHBondContact O-N 3.43Å
762	I	98.2	Very high	94	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	113	174	-179.6	166	0	0	0	109.7	I721 S723 G724 T725 I727 F760 I782 V788 L790 I870	I721-I762 HydrophobicContact CG2-CG2 3.81Å; S723-I762 CarbonylContact C-O 3.59Å; S723-I762 WeakPolarHBondContact CA-O 3.27Å; G724-I762 PolarHBondContact N-O 2.97Å; T725-I762 PolarHBondContact O-N 3.48Å; I727-I762 HydrophobicContact CD1-CB 3.97Å; I727-I762 HydrophobicContact CD1-CD1 4.11Å; I727-I762 HydrophobicContact CD1-CG2 4.19Å; I727-I762 HydrophobicContact CG1-CB 4.24Å; I727-I762 HydrophobicContact CG1-CG2 4.2Å; I727-I762 HydrophobicContact CG2-CG2 3.84Å; F760-I762 PolarHBondContact O-N 2.82Å; I762-I782 HydrophobicContact CD1-CG1 4.15Å; I762-I782 HydrophobicContact CD1-CG2 4.22Å; I762-I782 HydrophobicContact CG1-CD1 4.37Å; I762-I782 HydrophobicContact CG1-CG1 4.29Å; I762-V788 HydrophobicContact CD1-CB 4.39Å; I762-V788 HydrophobicContact CD1-CG1 4.32Å; I762-V788 HydrophobicContact CD1-CG2 4.35Å; I762-V788 HydrophobicContact CG1-CB 4.18Å; I762-V788 HydrophobicContact CG1-CG1 4.3Å; I762-L790 HydrophobicContact CB-CD2 3.69Å; I762-L790 HydrophobicContact CD1-CD2 3.95Å; I762-L790 HydrophobicContact CG1-CD2 3.69Å; I762-I870 HydrophobicContact CD1-CD1 4.43Å
763	N	97.6	Very high	93.6	Very high	15 Å²	15	47.6 Å²	47.6	8%	0.08	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	128.6	-177.9	-64.6	-23.2	0	0	0	109.7	T761 F775 V777 V788 K789	T761-N763 WeakPolarHBondContact CG2-OD1 3.41Å; N763-F775 HydrophobicContact CB-CE2 4.05Å; N763-F775 WeakPolarHBondContact ND2-CE2 3.49Å; N763-V777 HydrophobicContact CB-CG1 4.11Å; N763-V777 HydrophobicContact CB-CG2 4.05Å; N763-V788 CarbonylContact O-C 3.35Å; N763-V788 WeakPolarHBondContact O-CA 3.15Å; N763-V788 WeakPolarHBondContact O-CB 3.47Å; N763-K789 PolarHBondContact N-O 3.23Å; N763-K789 PolarHBondContact O-N 2.87Å
764	L	97	Very high	93.3	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.052	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	136.7	168	-178.5	60.3	0	0	0	109.7	S723 Q778 I782 H786	S723-L764 WeakPolarHBondContact OG-CB 3.49Å; S723-L764 PolarHBondContact OG-N 3.29Å; L764-Q778 HydrophobicContact CB-CB 4.26Å; L764-Q778 HydrophobicContact CD2-CB 4.02Å; L764-Q778 HydrophobicContact CG-CB 3.98Å; L764-Q778 PolarHBondContact O-N 2.84Å; L764-I782 HydrophobicContact CB-CD1 3.81Å; L764-I782 HydrophobicContact CD1-CD1 4.42Å; L764-H786 HydrophobicContact CD1-CB 3.69Å; L764-H786 WeakPolarHBondContact CD1-ND1 3.49Å
765	L	95.9	Very high	93.1	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.016	28%	0.278	C	S	.	.			trans	-121.3	152.2	174.7	-55.7	-179.1	0	0	0	109.5	Q769 F775 T776 T787 K789 R801	L765-Q769 HydrophobicContact CB-CB 4.34Å; L765-Q769 HydrophobicContact CB-CG 4.33Å; L765-F775 HydrophobicContact CD2-CB 4.27Å; L765-F775 HydrophobicContact CD2-CD2 3.42Å; L765-F775 VanDerWaalsContact CD2-CD2 3.42Å; L765-F775 HydrophobicContact CD2-CE2 4.09Å; L765-F775 HydrophobicContact CD2-CG 4.1Å; L765-T776 WeakPolarHBondContact CD2-O 3.35Å; L765-T787 HydrophobicContact CB-CG2 4.04Å; L765-T787 HydrophobicContact CD1-CG2 4.12Å; L765-T787 PolarHBondContact N-O 3.14Å; L765-T787 VanDerWaalsContact N-O 3.09Å; L765-K789 HydrophobicContact CD1-CB 3.87Å; L765-K789 HydrophobicContact CD1-CD 4.43Å; L765-K789 HydrophobicContact CG-CB 4.36Å; L765-R801 HydrophobicContact CD1-CG 3.77Å
766	A	93.2	Very high	93.1	Very high	18 Å²	18	54.5 Å²	54.5	15%	0.149	28%	0.284	C	S	.	.			trans	-66.8	150.1	166.1	0	0	0	0	0	110.6	D768 Q769	A766-D768 WeakPolarHBondContact CB-OD1 3.48Å; A766-D768 PolarHBondContact O-N 3.13Å; A766-Q769 HydrophobicContact CB-CG 4.08Å; A766-Q769 WeakPolarHBondContact O-CB 3.28Å; A766-Q769 PolarHBondContact O-N 3.48Å; A766-Q769 VanDerWaalsContact O-N 3.09Å
767	D	89.3	Confident	93	Very high	106 Å²	106	55.2 Å²	55.2	57%	0.567	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.4	-174.2	-73.9	-41.3	0	0	0	114	T787 K831	D767-T787 VanDerWaalsContact OD1-CB 3.29Å; D767-T787 WeakPolarHBondContact OD1-CB 3.46Å; D767-T787 PolarHBondContact OD1-N 3.1Å; D767-T787 PolarHBondContact OD1-OG1 2.81Å; D767-K831 PolarHBondContact O-NZ 3.44Å
768	D	89.1	Confident	92.9	Very high	129 Å²	129	59.3 Å²	59.3	69%	0.69	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.3	171.1	66.4	-20.4	0	0	0	114.1	A766 D770	A766-D768 WeakPolarHBondContact CB-OD1 3.48Å; A766-D768 PolarHBondContact O-N 3.13Å; D768-D770 PolarHBondContact O-N 2.9Å
769	Q	87.8	Confident	92.8	Very high	47 Å²	47	66 Å²	66	22%	0.22	35%	0.348	C	S	.	.			trans	-69.4	125	179.4	-69.1	-67.7	-71.3	0	0	112.5	L765 A766 T776 R801	L765-Q769 HydrophobicContact CB-CB 4.34Å; L765-Q769 HydrophobicContact CB-CG 4.33Å; A766-Q769 HydrophobicContact CB-CG 4.08Å; A766-Q769 WeakPolarHBondContact O-CB 3.28Å; A766-Q769 PolarHBondContact O-N 3.48Å; A766-Q769 VanDerWaalsContact O-N 3.09Å; Q769-T776 PolarHBondContact OE1-OG1 3.17Å; Q769-R801 WeakPolarHBondContact O-CD 3.19Å; Q769-R801 PolarHBondContact O-NH1 2.93Å
770	D	89.6	Confident	92.6	Very high	133 Å²	133	67.5 Å²	67.5	71%	0.711	36%	0.364	S	S	*	.			trans	-70.6	170	171.2	-78.6	-44.1	0	0	0	113.3	D768 A772 R801	D768-D770 PolarHBondContact O-N 2.9Å; D770-A772 PolarHBondContact O-N 3.03Å; D770-R801 WeakPolarHBondContact O-CD 3.35Å
771	E	91.2	Very high	92.5	Very high	86 Å²	86	70.7 Å²	70.7	40%	0.402	38%	0.377	S	S	.	.	S	Bend	trans	-80	95.2	176.8	-164.8	64.4	-124	0	0	111.7	K789 R801	E771-K789 IonicContact OE1-NZ 3.36Å; E771-K789 PolarHBondContact OE1-NZ 3.15Å; E771-R801 PolarHBondContact OE1-N 3Å; E771-R801 WeakPolarHBondContact OE2-CB 3.47Å; E771-R801 VanDerWaalsContact OE2-CG 3.24Å; E771-R801 WeakPolarHBondContact OE2-CG 3.35Å; E771-R801 IonicContact OE2-CZ 3.37Å; E771-R801 PolarHBondContact OE2-N 3.39Å; E771-R801 IonicContact OE2-NE 3.15Å; E771-R801 PolarHBondContact OE2-NE 2.91Å; E771-R801 IonicContact OE2-NH2 2.73Å
772	A	88.5	Confident	92.5	Very high	44 Å²	44	69.7 Å²	69.7	36%	0.364	37%	0.371	S	S	.	.			trans	-124.9	154.1	176.2	0	0	0	0	0	112.6	D770 Q774 K789	D770-A772 PolarHBondContact O-N 3.03Å; A772-Q774 WeakPolarHBondContact CB-O 3.42Å; A772-K789 PolarHBondContact O-NZ 3.43Å
773	E	87.5	Confident	92.4	Very high	193 Å²	193	72 Å²	72	90%	0.902	38%	0.381	S	S	*	.	S	Bend	trans	-68.8	-43.4	173.7	-64.7	-174.2	159.4	0	0	111.4	F775	E773-F775 VanDerWaalsContact O-CD1 3.28Å; E773-F775 WeakPolarHBondContact O-CD1 3.37Å; E773-F775 WeakPolarHBondContact O-CE1 3.36Å
774	Q	88.4	Confident	92.4	Very high	146 Å²	146	71.7 Å²	71.7	68%	0.682	38%	0.379	S	S	*	.	S	Bend	trans	-97.2	126.9	168.3	-172.6	174.7	11.1	0	0	109.2	A772	A772-Q774 WeakPolarHBondContact CB-O 3.42Å
775	F	90.4	Very high	92.3	Very high	44 Å²	44	72.2 Å²	72.2	19%	0.193	39%	0.387	C	S	.	.			trans	-143.5	156.4	-173.4	51.7	-92.8	0	0	0	110.3	N763 L765 E773 V777 K789 V791	N763-F775 HydrophobicContact CB-CE2 4.05Å; N763-F775 WeakPolarHBondContact ND2-CE2 3.49Å; L765-F775 HydrophobicContact CD2-CB 4.27Å; L765-F775 HydrophobicContact CD2-CD2 3.42Å; L765-F775 VanDerWaalsContact CD2-CD2 3.42Å; L765-F775 HydrophobicContact CD2-CE2 4.09Å; L765-F775 HydrophobicContact CD2-CG 4.1Å; E773-F775 VanDerWaalsContact O-CD1 3.28Å; E773-F775 WeakPolarHBondContact O-CD1 3.37Å; E773-F775 WeakPolarHBondContact O-CE1 3.36Å; F775-V777 HydrophobicContact CD2-CG2 4.18Å; F775-V777 HydrophobicContact CE2-CG2 3.85Å; F775-K789 HydrophobicContact CD1-CD 3.89Å; F775-K789 HydrophobicContact CE1-CD 3.78Å; F775-K789 HydrophobicContact CE1-CG 4.33Å; F775-K789 HydrophobicContact CG-CD 4.43Å; F775-K789 HydrophobicContact CZ-CD 4.21Å; F775-K789 HydrophobicContact CZ-CG 4.34Å; F775-V791 HydrophobicContact CZ-CG2 4.01Å
776	T	90.2	Very high	92.3	Very high	81 Å²	81	74.9 Å²	74.9	50%	0.497	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-80.5	130.3	175	56.5	0	0	0	0	110.4	L765 Q769	L765-T776 WeakPolarHBondContact CD2-O 3.35Å; Q769-T776 PolarHBondContact OE1-OG1 3.17Å
777	V	92.5	Very high	92.5	Very high	70 Å²	70	74.1 Å²	74.1	42%	0.424	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-91.2	131.2	171.9	-177.1	0	0	0	0	108.4	S723 N763 F775	S723-V777 WeakPolarHBondContact OG-CG1 3.4Å; N763-V777 HydrophobicContact CB-CG1 4.11Å; N763-V777 HydrophobicContact CB-CG2 4.05Å; F775-V777 HydrophobicContact CD2-CG2 4.18Å; F775-V777 HydrophobicContact CE2-CG2 3.85Å
778	Q	94.6	Very high	92.9	Very high	87 Å²	87	69 Å²	69	41%	0.407	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-92.9	145.3	167.7	-68.2	-172	-35.4	0	0	110.7	S723 L764	S723-Q778 WeakPolarHBondContact CB-O 3.48Å; S723-Q778 PolarHBondContact OG-O 3.05Å; L764-Q778 HydrophobicContact CB-CB 4.26Å; L764-Q778 HydrophobicContact CD2-CB 4.02Å; L764-Q778 HydrophobicContact CG-CB 3.98Å; L764-Q778 PolarHBondContact O-N 2.84Å
779	D	94.7	Very high	93.3	Very high	147 Å²	147	63.3 Å²	63.3	79%	0.786	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-82.2	162.1	171	-76.8	-52.5	0	0	0	112.5
780	G	93.7	Very high	93.8	Very high	36 Å²	36	61.1 Å²	61.1	37%	0.371	32%	0.324	S	S	.	.	S	Bend	trans	119.6	-168.3	176.2	0	0	0	0	0	114.1	A722 S723	A722-G780 CarbonylContact C-O 3.59Å; A722-G780 WeakPolarHBondContact CA-O 3.32Å; S723-G780 PolarHBondContact N-O 3.16Å
781	Y	96	Very high	94.1	Very high	68 Å²	68	55.9 Å²	55.9	27%	0.267	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-94.8	138.5	-178.2	-65.6	-83	0	0	0	111.9	L714 T717 C720 I721 A722 H783	L714-Y781 HydrophobicContact CD1-CD2 3.65Å; L714-Y781 HydrophobicContact CD1-CE2 4.03Å; L714-Y781 HydrophobicContact CD1-CG 4.06Å; T717-Y781 WeakPolarHBondContact CB-OH 3.23Å; T717-Y781 HydrophobicContact CG2-CE1 4.45Å; T717-Y781 HydrophobicContact CG2-CE2 4.15Å; T717-Y781 VanDerWaalsContact CG2-OH 3.28Å; T717-Y781 WeakPolarHBondContact CG2-OH 3.36Å; C720-Y781 HydrophobicContact CB-CD1 3.41Å; C720-Y781 VanDerWaalsContact CB-CD1 3.41Å; C720-Y781 HydrophobicContact CB-CE1 3.8Å; C720-Y781 HydrophobicContact CB-CG 4.27Å; I721-Y781 WeakPolarHBondContact O-CA 3.43Å; A722-Y781 HydrophobicContact CB-CD1 4.09Å; A722-Y781 HydrophobicContact CB-CE1 4.15Å; Y781-H783 PolarHBondContact O-CE1 2.68Å; Y781-H783 PolarHBondContact O-N 2.92Å; Y781-H783 PolarHBondContact O-ND1 2.88Å
782	I	96.6	Very high	94.4	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	28%	0.281	C	S	.	.			trans	-71.9	120.3	175.6	-50.1	-55.2	0	0	0	108.6	I721 I762 L764 V788 V804 V820	I721-I782 HydrophobicContact CG2-CG1 4.23Å; I721-I782 PolarHBondContact O-N 3.33Å; I762-I782 HydrophobicContact CD1-CG1 4.15Å; I762-I782 HydrophobicContact CD1-CG2 4.22Å; I762-I782 HydrophobicContact CG1-CD1 4.37Å; I762-I782 HydrophobicContact CG1-CG1 4.29Å; L764-I782 HydrophobicContact CB-CD1 3.81Å; L764-I782 HydrophobicContact CD1-CD1 4.42Å; I782-V788 HydrophobicContact CD1-CG1 4.12Å; I782-V788 HydrophobicContact CG2-CG1 3.95Å; I782-V804 HydrophobicContact CG2-CG1 3.82Å; I782-V820 HydrophobicContact CB-CG2 4.44Å; I782-V820 HydrophobicContact CG2-CB 4.47Å; I782-V820 HydrophobicContact CG2-CG2 3.91Å; I782-V820 WeakPolarHBondContact O-CG2 3.41Å; I782-V820 PolarHBondContact O-N 3.22Å
783	H	96.4	Very high	94.6	Very high	49 Å²	49	51.9 Å²	51.9	23%	0.227	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-107.4	159.2	172.4	-64.2	68.4	0	0	0	110	Y781 H786 V804 D817	Y781-H783 PolarHBondContact O-CE1 2.68Å; Y781-H783 PolarHBondContact O-N 2.92Å; Y781-H783 PolarHBondContact O-ND1 2.88Å; H783-H786 AromaticContact ND1-CE1 3.82Å; H783-H786 PolarHBondContact O-N 2.96Å; H783-V804 WeakPolarHBondContact O-CG1 3.39Å; H783-D817 PolarHBondContact CD2-O 3.27Å
784	Y	97	Very high	94.8	Very high	7 Å²	7	46.2 Å²	46.2	3%	0.027	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	141.3	169.6	-67.6	-64.5	0	0	0	110.7	V804 K806 A816 D818 V820 H824 C826	Y784-V804 HydrophobicContact CD1-CG2 4.23Å; Y784-V804 HydrophobicContact CE1-CG2 4.29Å; Y784-K806 HydrophobicContact CD1-CB 3.73Å; Y784-K806 HydrophobicContact CD2-CB 3.89Å; Y784-K806 HydrophobicContact CD2-CD 3.75Å; Y784-K806 HydrophobicContact CD2-CG 4.1Å; Y784-K806 HydrophobicContact CE1-CB 3.76Å; Y784-K806 HydrophobicContact CE1-CG 4.19Å; Y784-K806 HydrophobicContact CE2-CB 3.93Å; Y784-K806 HydrophobicContact CE2-CD 3.57Å; Y784-K806 HydrophobicContact CE2-CG 3.73Å; Y784-K806 HydrophobicContact CG-CB 3.79Å; Y784-K806 HydrophobicContact CG-CD 4.47Å; Y784-K806 HydrophobicContact CG-CG 4.48Å; Y784-A816 CarbonylContact C-O 3.33Å; Y784-A816 WeakPolarHBondContact CB-O 3.38Å; Y784-A816 HydrophobicContact CD2-CB 4.35Å; Y784-A816 HydrophobicContact CG-CB 4.22Å; Y784-D818 WeakPolarHBondContact CD2-O 3.47Å; Y784-D818 PolarHBondContact N-O 2.86Å; Y784-V820 HydrophobicContact CD1-CG2 3.88Å; Y784-V820 HydrophobicContact CD2-CG2 4.41Å; Y784-V820 HydrophobicContact CE1-CG1 4.35Å; Y784-V820 HydrophobicContact CE1-CG2 3.8Å; Y784-V820 HydrophobicContact CE2-CG2 4.33Å; Y784-V820 HydrophobicContact CG-CG2 4.2Å; Y784-H824 AromaticContact CE2-CE1 3.12Å; Y784-H824 WeakPolarHBondContact CE2-CE1 3.47Å; Y784-H824 AromaticContact CE2-ND1 3.89Å; Y784-H824 AromaticContact CZ-CE1 3.03Å; Y784-H824 AromaticContact CZ-ND1 3.83Å; Y784-H824 VanDerWaalsContact OH-CB 3.25Å; Y784-H824 WeakPolarHBondContact OH-CB 3.43Å; Y784-H824 PolarHBondContact OH-CE1 3.3Å; Y784-H824 PolarHBondContact OH-ND1 3.37Å; Y784-C826 HydrophobicContact CE1-CB 4.15Å
785	G	95.5	Very high	95	Very high	22 Å²	22	42 Å²	42	23%	0.227	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	-19.3	-174.5	0	0	0	0	0	115.2	I803 V804	G785-I803 WeakPolarHBondContact O-CG2 3.34Å; G785-V804 PolarHBondContact N-O 2.86Å
786	H	97.1	Very high	95.1	Very high	59 Å²	59	42.1 Å²	42.1	27%	0.273	25%	0.247	S	C	.	.			trans	-69	144.9	-179.7	-72.5	-161.8	0	0	0	113.3	L764 H783 V804	L764-H786 HydrophobicContact CD1-CB 3.69Å; L764-H786 WeakPolarHBondContact CD1-ND1 3.49Å; H783-H786 AromaticContact ND1-CE1 3.82Å; H783-H786 PolarHBondContact O-N 2.96Å; H786-V804 PolarHBondContact O-N 3.33Å
787	T	97.2	Very high	95.3	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.4	163.1	-58.8	0	0	0	0	110.5	L765 D767 R801 K831	L765-T787 HydrophobicContact CB-CG2 4.04Å; L765-T787 HydrophobicContact CD1-CG2 4.12Å; L765-T787 PolarHBondContact N-O 3.14Å; L765-T787 VanDerWaalsContact N-O 3.09Å; D767-T787 VanDerWaalsContact OD1-CB 3.29Å; D767-T787 WeakPolarHBondContact OD1-CB 3.46Å; D767-T787 PolarHBondContact OD1-N 3.1Å; D767-T787 PolarHBondContact OD1-OG1 2.81Å; T787-R801 HydrophobicContact CG2-CB 4.15Å; T787-R801 HydrophobicContact CG2-CG 4.31Å; T787-K831 HydrophobicContact CG2-CD 3.78Å; T787-K831 PolarHBondContact OG1-NZ 3.17Å
788	V	97.6	Very high	95.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	155.4	177.7	-62.4	0	0	0	0	112	I762 N763 I782 L802 V804 F828	I762-V788 HydrophobicContact CD1-CB 4.39Å; I762-V788 HydrophobicContact CD1-CG1 4.32Å; I762-V788 HydrophobicContact CD1-CG2 4.35Å; I762-V788 HydrophobicContact CG1-CB 4.18Å; I762-V788 HydrophobicContact CG1-CG1 4.3Å; N763-V788 CarbonylContact O-C 3.35Å; N763-V788 WeakPolarHBondContact O-CA 3.15Å; N763-V788 WeakPolarHBondContact O-CB 3.47Å; I782-V788 HydrophobicContact CD1-CG1 4.12Å; I782-V788 HydrophobicContact CG2-CG1 3.95Å; V788-L802 HydrophobicContact CG2-CB 4.34Å; V788-L802 WeakPolarHBondContact CG2-O 3.46Å; V788-L802 PolarHBondContact N-O 2.81Å; V788-L802 PolarHBondContact O-N 2.83Å; V788-L802 VanDerWaalsContact O-O 3.11Å; V788-V804 HydrophobicContact CG1-CG1 4.41Å; V788-V804 HydrophobicContact CG2-CB 4.35Å; V788-F828 HydrophobicContact CG2-CE1 4.46Å
789	K	96.8	Very high	95.5	Very high	9 Å²	9	35.3 Å²	35.3	4%	0.039	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.7	171.8	-166.8	152.3	178.6	165.6	0	110.3	N763 L765 E771 A772 F775 A798 L799	N763-K789 PolarHBondContact N-O 3.23Å; N763-K789 PolarHBondContact O-N 2.87Å; L765-K789 HydrophobicContact CD1-CB 3.87Å; L765-K789 HydrophobicContact CD1-CD 4.43Å; L765-K789 HydrophobicContact CG-CB 4.36Å; E771-K789 IonicContact OE1-NZ 3.36Å; E771-K789 PolarHBondContact OE1-NZ 3.15Å; A772-K789 PolarHBondContact O-NZ 3.43Å; F775-K789 HydrophobicContact CD1-CD 3.89Å; F775-K789 HydrophobicContact CE1-CD 3.78Å; F775-K789 HydrophobicContact CE1-CG 4.33Å; F775-K789 HydrophobicContact CG-CD 4.43Å; F775-K789 HydrophobicContact CZ-CD 4.21Å; F775-K789 HydrophobicContact CZ-CG 4.34Å; K789-A798 HydrophobicContact CG-CB 4.45Å; K789-L799 WeakPolarHBondContact CE-O 3.28Å; K789-L799 WeakPolarHBondContact CG-O 3.42Å
790	L	97.6	Very high	95.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.4	-175.2	-62.3	-177.2	0	0	0	109.9	I727 L729 I762 A798 L799 L802 F828	I727-L790 HydrophobicContact CD1-CD2 3.93Å; L729-L790 HydrophobicContact CD1-CD1 3.72Å; I762-L790 HydrophobicContact CB-CD2 3.69Å; I762-L790 HydrophobicContact CD1-CD2 3.95Å; I762-L790 HydrophobicContact CG1-CD2 3.69Å; L790-A798 CarbonylContact O-C 3.57Å; L790-A798 VanDerWaalsContact O-CA 3.29Å; L790-A798 WeakPolarHBondContact O-CA 3.13Å; L790-L799 HydrophobicContact CB-CD1 4.37Å; L790-L799 HydrophobicContact CD1-CD1 4.21Å; L790-L799 PolarHBondContact O-N 3.24Å; L790-L802 HydrophobicContact CD1-CD1 3.82Å; L790-L802 HydrophobicContact CG-CD1 4.16Å; L790-F828 HydrophobicContact CD1-CD1 4.46Å; L790-F828 HydrophobicContact CD1-CE1 4.18Å; L790-F828 HydrophobicContact CD1-CZ 4.35Å
791	V	97.1	Very high	95.7	Very high	24 Å²	24	30.3 Å²	30.3	15%	0.145	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.9	-174.8	-172.4	0	0	0	0	110.5	F760 T761 F775 S793 G796 A798	F760-V791 CarbonylContact C-O 3.57Å; F760-V791 VanDerWaalsContact CA-O 3.26Å; F760-V791 WeakPolarHBondContact CA-O 3.44Å; T761-V791 PolarHBondContact N-O 3.08Å; T761-V791 PolarHBondContact O-N 3.43Å; F775-V791 HydrophobicContact CZ-CG2 4.01Å; V791-S793 PolarHBondContact O-N 3.06Å; V791-G796 WeakPolarHBondContact CG1-O 3.24Å; V791-A798 HydrophobicContact CG2-CB 4.13Å
792	C	96.5	Very high	95.7	Very high	8 Å²	8	27.1 Å²	27.1	5%	0.054	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	126.6	177.6	-173.9	0	0	0	0	110.8	V745 F760 E794 G796 M797	V745-C792 HydrophobicContact CG2-CB 4.14Å; F760-C792 HydrophobicContact CD1-CB 4.02Å; F760-C792 HydrophobicContact CE1-CB 3.89Å; C792-E794 PolarHBondContact O-N 3.39Å; C792-G796 WeakPolarHBondContact O-CA 3.32Å; C792-G796 PolarHBondContact O-N 2.68Å; C792-M797 HydrophobicContact CB-CB 4.49Å; C792-M797 PolarHBondContact N-O 3.16Å
793	S	93.6	Very high	95.8	Very high	37 Å²	37	28.2 Å²	28.2	26%	0.259	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	4.1	-175.8	71.9	0	0	0	0	115.2	S759 V791	S759-S793 PolarHBondContact O-N 2.94Å; S759-S793 PolarHBondContact O-OG 3.04Å; V791-S793 PolarHBondContact O-N 3.06Å
794	E	90.4	Very high	95.8	Very high	75 Å²	75	25.9 Å²	25.9	35%	0.35	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	-39.5	-179.9	-65	-176.3	-170.9	0	0	112.1	C792	C792-E794 PolarHBondContact O-N 3.39Å
795	T	92.8	Very high	95.8	Very high	56 Å²	56	28 Å²	28	34%	0.344	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	-6	179.5	65.2	0	0	0	0	114.6	V745 M797	V745-T795 HydrophobicContact CG1-CG2 3.94Å; T795-M797 PolarHBondContact O-N 3.2Å; T795-M797 VanDerWaalsContact O-N 3.08Å; T795-M797 WeakPolarHBondContact OG1-CG 3.42Å; T795-M797 PolarHBondContact OG1-N 2.85Å
796	G	93	Very high	95.9	Very high	47 Å²	47	28.8 Å²	28.8	49%	0.485	17%	0.167	S	C	.	.			trans	70.2	-6.3	-173.7	0	0	0	0	0	115.2	V791 C792 A798	V791-G796 WeakPolarHBondContact CG1-O 3.24Å; C792-G796 WeakPolarHBondContact O-CA 3.32Å; C792-G796 PolarHBondContact O-N 2.68Å; G796-A798 PolarHBondContact O-N 2.87Å
797	M	95	Very high	95.7	Very high	41 Å²	41	26.6 Å²	26.6	20%	0.202	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-62.3	130.6	-178.5	-73.2	169.8	47.6	0	0	112.5	V745 A748 F750 C792 T795	V745-M797 HydrophobicContact CG1-CE 3.58Å; V745-M797 HydrophobicContact CG1-SD 3.35Å; V745-M797 WeakPolarHBondContact CG1-SD 3.04Å; V745-M797 HydrophobicContact CG2-CE 4.35Å; A748-M797 VanDerWaalsContact C-CE 3.41Å; A748-M797 VanDerWaalsContact C-SD 3.52Å; A748-M797 VanDerWaalsContact CA-SD 3.55Å; A748-M797 HydrophobicContact CB-SD 4.28Å; A748-M797 WeakPolarHBondContact O-CE 3.27Å; F750-M797 HydrophobicContact CD2-CE 3.62Å; F750-M797 HydrophobicContact CE2-CB 4.09Å; F750-M797 HydrophobicContact CE2-CE 3.54Å; F750-M797 HydrophobicContact CG-CE 4.45Å; F750-M797 HydrophobicContact CZ-CB 4.14Å; F750-M797 HydrophobicContact CZ-CE 4.3Å; C792-M797 HydrophobicContact CB-CB 4.49Å; C792-M797 PolarHBondContact N-O 3.16Å; T795-M797 PolarHBondContact O-N 3.2Å; T795-M797 VanDerWaalsContact O-N 3.08Å; T795-M797 WeakPolarHBondContact OG1-CG 3.42Å; T795-M797 PolarHBondContact OG1-N 2.85Å
798	A	95.7	Very high	95.5	Very high	41 Å²	41	30.7 Å²	30.7	34%	0.339	18%	0.18	S	C	.	.	B	Isolated β-bridge	trans	-100.6	150	174.8	0	0	0	0	0	112.5	F750 K789 L790 V791 G796	F750-A798 WeakPolarHBondContact CE2-O 3.19Å; K789-A798 HydrophobicContact CG-CB 4.45Å; L790-A798 CarbonylContact O-C 3.57Å; L790-A798 VanDerWaalsContact O-CA 3.29Å; L790-A798 WeakPolarHBondContact O-CA 3.13Å; V791-A798 HydrophobicContact CG2-CB 4.13Å; G796-A798 PolarHBondContact O-N 2.87Å
799	L	95.8	Very high	95	Very high	13 Å²	13	38.2 Å²	38.2	7%	0.068	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-80.4	162	153.9	-70.8	172.4	0	0	0	109.7	L743 F750 K789 L790 L802 L838	L743-L799 HydrophobicContact CD2-CD1 4.25Å; F750-L799 HydrophobicContact CD1-CD1 4.46Å; F750-L799 HydrophobicContact CD1-CD2 3.93Å; F750-L799 HydrophobicContact CD1-CG 4.12Å; F750-L799 HydrophobicContact CD2-CD2 3.8Å; F750-L799 HydrophobicContact CE1-CD1 4.21Å; F750-L799 HydrophobicContact CE1-CD2 3.93Å; F750-L799 HydrophobicContact CE1-CG 3.68Å; F750-L799 HydrophobicContact CE2-CD2 3.82Å; F750-L799 HydrophobicContact CE2-CG 4.12Å; F750-L799 HydrophobicContact CG-CD2 3.86Å; F750-L799 HydrophobicContact CZ-CD2 3.9Å; F750-L799 HydrophobicContact CZ-CG 3.7Å; K789-L799 WeakPolarHBondContact CE-O 3.28Å; K789-L799 WeakPolarHBondContact CG-O 3.42Å; L790-L799 HydrophobicContact CB-CD1 4.37Å; L790-L799 HydrophobicContact CD1-CD1 4.21Å; L790-L799 PolarHBondContact O-N 3.24Å; L799-L802 HydrophobicContact CB-CD1 4.2Å; L799-L802 HydrophobicContact CD1-CD1 4.04Å; L799-L838 HydrophobicContact CD1-CD1 4.21Å; L799-L838 HydrophobicContact CD1-CD2 3.76Å; L799-L838 HydrophobicContact CD2-CD1 4.33Å
800	P	95.3	Very high	94.7	Very high	59 Å²	59	40.7 Å²	40.7	38%	0.383	23%	0.229	S	C	.	.			trans	-57.9	176.4	169.6	-23.5	34.8	0	0	0	112.9	L802	P800-L802 WeakPolarHBondContact O-CG 3.48Å; P800-L802 PolarHBondContact O-N 3.15Å
801	R	96.1	Very high	94.5	Very high	20 Å²	20	42 Å²	42	8%	0.075	24%	0.237	C	C	.	.			trans	-58.6	126.3	169	-69.3	168.5	-59.9	137.8	18.3	110.8	L765 Q769 D770 E771 T787 K831 D832	L765-R801 HydrophobicContact CD1-CG 3.77Å; Q769-R801 WeakPolarHBondContact O-CD 3.19Å; Q769-R801 PolarHBondContact O-NH1 2.93Å; D770-R801 WeakPolarHBondContact O-CD 3.35Å; E771-R801 PolarHBondContact OE1-N 3Å; E771-R801 WeakPolarHBondContact OE2-CB 3.47Å; E771-R801 VanDerWaalsContact OE2-CG 3.24Å; E771-R801 WeakPolarHBondContact OE2-CG 3.35Å; E771-R801 IonicContact OE2-CZ 3.37Å; E771-R801 PolarHBondContact OE2-N 3.39Å; E771-R801 IonicContact OE2-NE 3.15Å; E771-R801 PolarHBondContact OE2-NE 2.91Å; E771-R801 IonicContact OE2-NH2 2.73Å; T787-R801 HydrophobicContact CG2-CB 4.15Å; T787-R801 HydrophobicContact CG2-CG 4.31Å; R801-K831 HydrophobicContact CB-CB 3.9Å; R801-K831 HydrophobicContact CB-CD 4.13Å; R801-K831 WeakPolarHBondContact O-CB 3.18Å; R801-K831 PolarHBondContact O-N 2.7Å; R801-D832 IonicContact CZ-OD2 3.95Å; R801-D832 IonicContact NH1-OD2 2.63Å; R801-D832 PolarHBondContact NH1-OD2 2.81Å; R801-D832 VanDerWaalsContact NH1-OD2 3.15Å; R801-D832 IonicContact NH2-OD2 3.82Å; R801-D832 PolarHBondContact NH2-OD2 2.86Å
802	L	97.4	Very high	94.5	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	144	179.3	-62.8	169.9	0	0	0	109.5	V788 L790 L799 P800 F828 H829 L830 L838	V788-L802 HydrophobicContact CG2-CB 4.34Å; V788-L802 WeakPolarHBondContact CG2-O 3.46Å; V788-L802 PolarHBondContact N-O 2.81Å; V788-L802 PolarHBondContact O-N 2.83Å; V788-L802 VanDerWaalsContact O-O 3.11Å; L790-L802 HydrophobicContact CD1-CD1 3.82Å; L790-L802 HydrophobicContact CG-CD1 4.16Å; L799-L802 HydrophobicContact CB-CD1 4.2Å; L799-L802 HydrophobicContact CD1-CD1 4.04Å; P800-L802 WeakPolarHBondContact O-CG 3.48Å; P800-L802 PolarHBondContact O-N 3.15Å; L802-F828 HydrophobicContact CB-CB 4.14Å; L802-F828 HydrophobicContact CB-CD1 4.08Å; L802-F828 HydrophobicContact CD1-CB 3.93Å; L802-F828 HydrophobicContact CD1-CD1 4.03Å; L802-F828 HydrophobicContact CD1-CG 4.13Å; L802-F828 HydrophobicContact CD2-CB 4.1Å; L802-F828 HydrophobicContact CG-CB 4.26Å; L802-H829 CarbonylContact C-O 3.33Å; L802-H829 VanDerWaalsContact CA-O 3.28Å; L802-H829 WeakPolarHBondContact CA-O 3.42Å; L802-L830 HydrophobicContact CD2-CD1 3.99Å; L802-L830 HydrophobicContact CD2-CG 3.84Å; L802-L838 HydrophobicContact CD1-CD2 4.35Å
803	I	97.4	Very high	94.3	Very high	23 Å²	23	42 Å²	42	12%	0.118	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.9	168.3	-56.6	177.5	0	0	0	108.1	G785 R805 H829 K831	G785-I803 WeakPolarHBondContact O-CG2 3.34Å; I803-R805 HydrophobicContact CG2-CG 4.38Å; I803-R805 PolarHBondContact O-N 3.35Å; I803-H829 HydrophobicContact CB-CB 4.33Å; I803-H829 PolarHBondContact N-O 2.87Å; I803-H829 PolarHBondContact O-N 3.47Å; I803-K831 HydrophobicContact CD1-CG 4.38Å; I803-K831 HydrophobicContact CG1-CB 4.39Å
804	V	97.7	Very high	94.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	118	-179.9	61.1	0	0	0	0	110.5	I782 H783 Y784 G785 H786 V788 V820 C826 F828	I782-V804 HydrophobicContact CG2-CG1 3.82Å; H783-V804 WeakPolarHBondContact O-CG1 3.39Å; Y784-V804 HydrophobicContact CD1-CG2 4.23Å; Y784-V804 HydrophobicContact CE1-CG2 4.29Å; G785-V804 PolarHBondContact N-O 2.86Å; H786-V804 PolarHBondContact O-N 3.33Å; V788-V804 HydrophobicContact CG1-CG1 4.41Å; V788-V804 HydrophobicContact CG2-CB 4.35Å; V804-V820 HydrophobicContact CG1-CG2 4.3Å; V804-V820 HydrophobicContact CG2-CG2 4.18Å; V804-C826 HydrophobicContact CG2-CB 4.14Å; V804-F828 HydrophobicContact CB-CD1 4.32Å; V804-F828 HydrophobicContact CB-CE1 4.11Å; V804-F828 HydrophobicContact CG2-CD1 4.5Å; V804-F828 HydrophobicContact CG2-CE1 3.99Å; V804-F828 HydrophobicContact CG2-CZ 4.46Å
805	R	97	Very high	94.4	Very high	51 Å²	51	42.9 Å²	42.9	19%	0.192	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	150.2	-178.2	-59.1	-66.3	-170.5	171.3	-2.2	111.6	I803 V812 L814 C826 A827	I803-R805 HydrophobicContact CG2-CG 4.38Å; I803-R805 PolarHBondContact O-N 3.35Å; R805-V812 HydrophobicContact CB-CG1 3.4Å; R805-V812 HydrophobicContact CG-CG1 4.03Å; R805-L814 PolarHBondContact NH1-O 2.91Å; R805-C826 CarbonylContact O-C 3.33Å; R805-C826 WeakPolarHBondContact O-CA 3.32Å; R805-C826 WeakPolarHBondContact O-CB 3.5Å; R805-A827 PolarHBondContact N-O 2.94Å; R805-A827 PolarHBondContact O-N 2.68Å
806	K	96.2	Very high	94.4	Very high	40 Å²	40	40.7 Å²	40.7	17%	0.174	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	139.1	-176.8	-168.5	169.6	-176.1	163.1	0	110.7	Y784 V812 L813 A816 D818	Y784-K806 HydrophobicContact CD1-CB 3.73Å; Y784-K806 HydrophobicContact CD2-CB 3.89Å; Y784-K806 HydrophobicContact CD2-CD 3.75Å; Y784-K806 HydrophobicContact CD2-CG 4.1Å; Y784-K806 HydrophobicContact CE1-CB 3.76Å; Y784-K806 HydrophobicContact CE1-CG 4.19Å; Y784-K806 HydrophobicContact CE2-CB 3.93Å; Y784-K806 HydrophobicContact CE2-CD 3.57Å; Y784-K806 HydrophobicContact CE2-CG 3.73Å; Y784-K806 HydrophobicContact CG-CB 3.79Å; Y784-K806 HydrophobicContact CG-CD 4.47Å; Y784-K806 HydrophobicContact CG-CG 4.48Å; K806-V812 WeakPolarHBondContact O-CA 3.42Å; K806-L813 HydrophobicContact CB-CB 4.4Å; K806-L813 HydrophobicContact CD-CD1 4.46Å; K806-L813 PolarHBondContact O-N 2.78Å; K806-A816 HydrophobicContact CB-CB 3.48Å; K806-A816 VanDerWaalsContact CB-CB 3.48Å; K806-A816 HydrophobicContact CD-CB 3.74Å; K806-A816 HydrophobicContact CG-CB 4.26Å; K806-D818 IonicContact NZ-OD1 2.71Å; K806-D818 PolarHBondContact NZ-OD1 3.36Å; K806-D818 IonicContact NZ-OD2 3.86Å; K806-D818 PolarHBondContact NZ-OD2 3.14Å
807	V	94.4	Very high	94.4	Very high	13 Å²	13	42.6 Å²	42.6	8%	0.079	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.1	-179.9	178.2	0	0	0	0	111	K809 T811 V812 K825 A827 I862 A867	V807-K809 WeakPolarHBondContact CG1-O 3.26Å; V807-T811 WeakPolarHBondContact CA-O 3.45Å; V807-V812 HydrophobicContact CG2-CG2 4.33Å; V807-K825 HydrophobicContact CB-CB 4.2Å; V807-K825 PolarHBondContact N-O 3.03Å; V807-K825 VanDerWaalsContact N-O 3.12Å; V807-A827 HydrophobicContact CG2-CB 3.66Å; V807-I862 HydrophobicContact CG1-CD1 4.07Å; V807-I862 HydrophobicContact CG2-CD1 3.73Å; V807-A867 HydrophobicContact CG1-CB 4.17Å
808	D	91.2	Very high	94.3	Very high	86 Å²	86	41 Å²	41	46%	0.46	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.4	158.8	-176	30.3	0	0	0	109.3	T810 T811	D808-T810 PolarHBondContact O-N 2.96Å; D808-T811 PolarHBondContact N-O 2.78Å; D808-T811 PolarHBondContact O-N 3.43Å; D808-T811 VanDerWaalsContact O-O 3.1Å; D808-T811 PolarHBondContact O-OG1 2.88Å
809	K	87.7	Confident	94.3	Very high	158 Å²	158	39.5 Å²	39.5	69%	0.687	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	-104.6	-173.7	-56.8	161.7	-165.4	165.5	0	111.9	V807	V807-K809 WeakPolarHBondContact CG1-O 3.26Å
810	T	90.8	Very high	94.3	Very high	62 Å²	62	38.9 Å²	38.9	38%	0.38	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	12.9	178.8	53.2	0	0	0	0	112.1	D808 I862 D864	D808-T810 PolarHBondContact O-N 2.96Å; T810-I862 VanDerWaalsContact O-CG1 3.31Å; T810-I862 WeakPolarHBondContact O-CG1 3.41Å; T810-I862 PolarHBondContact O-N 3.15Å; T810-D864 WeakPolarHBondContact CG2-OD1 3.29Å
811	T	93.9	Very high	94.3	Very high	28 Å²	28	36.1 Å²	36.1	17%	0.172	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130.5	178.1	51.5	0	0	0	0	111.6	V807 D808 E860 K861	V807-T811 WeakPolarHBondContact CA-O 3.45Å; D808-T811 PolarHBondContact N-O 2.78Å; D808-T811 PolarHBondContact O-N 3.43Å; D808-T811 VanDerWaalsContact O-O 3.1Å; D808-T811 PolarHBondContact O-OG1 2.88Å; T811-E860 CarbonylContact C-O 3.48Å; T811-E860 VanDerWaalsContact CA-O 3.26Å; T811-E860 WeakPolarHBondContact CA-O 3.11Å; T811-K861 HydrophobicContact CG2-CG 4.29Å
812	V	95.7	Very high	94.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	137.8	167.5	-178.2	0	0	0	0	109	R805 K806 V807 L814 A827 Y837 R859 E860 I862	R805-V812 HydrophobicContact CB-CG1 3.4Å; R805-V812 HydrophobicContact CG-CG1 4.03Å; K806-V812 WeakPolarHBondContact O-CA 3.42Å; V807-V812 HydrophobicContact CG2-CG2 4.33Å; V812-L814 HydrophobicContact CG1-CD2 4.04Å; V812-A827 HydrophobicContact CG2-CB 4.1Å; V812-Y837 HydrophobicContact CG1-CE1 4.42Å; V812-Y837 HydrophobicContact CG2-CE1 3.97Å; V812-R859 WeakPolarHBondContact O-CA 3.28Å; V812-E860 HydrophobicContact CB-CB 4.41Å; V812-E860 PolarHBondContact N-O 2.88Å; V812-E860 PolarHBondContact O-N 3.39Å; V812-I862 HydrophobicContact CG2-CB 4.28Å; V812-I862 HydrophobicContact CG2-CD1 3.65Å; V812-I862 HydrophobicContact CG2-CG1 3.86Å; V812-I862 HydrophobicContact CG2-CG2 3.49Å; V812-I862 VanDerWaalsContact CG2-CG2 3.49Å
813	L	93.5	Very high	94.1	Very high	30 Å²	30	37 Å²	37	16%	0.157	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	113.8	170.8	-57.3	179.3	0	0	0	108.4	K806 A816 R859	K806-L813 HydrophobicContact CB-CB 4.4Å; K806-L813 HydrophobicContact CD-CD1 4.46Å; K806-L813 PolarHBondContact O-N 2.78Å; L813-A816 HydrophobicContact CB-CB 4.09Å; L813-R859 HydrophobicContact CD2-CG 4.06Å
814	L	93.4	Very high	94	Very high	42 Å²	42	36.5 Å²	36.5	22%	0.22	19%	0.187	C	C	.	.	S	Bend	trans	-82.6	-19.5	179.3	-59.1	179.5	0	0	0	112.3	R805 V812 L858 E860	R805-L814 PolarHBondContact NH1-O 2.91Å; V812-L814 HydrophobicContact CG1-CD2 4.04Å; L814-L858 WeakPolarHBondContact CB-O 3.26Å; L814-L858 PolarHBondContact N-O 2.9Å; L814-E860 HydrophobicContact CD1-CG 4.09Å; L814-E860 HydrophobicContact CG-CG 4.49Å
815	D	93	Very high	93.9	Very high	90 Å²	90	40.4 Å²	40.4	48%	0.481	20%	0.203	S	C	.	.	S	Bend	trans	-88.8	2	178.5	63.3	-32.2	0	0	0	114.1	L858	D815-L858 HydrophobicContact CB-CB 4.32Å; D815-L858 HydrophobicContact CB-CD1 4.17Å
816	A	92.8	Very high	93.9	Very high	10 Å²	10	38 Å²	38	8%	0.083	19%	0.194	C	C	.	.			trans	-76	127.1	178.7	0	0	0	0	0	111.8	Y784 K806 L813	Y784-A816 CarbonylContact C-O 3.33Å; Y784-A816 WeakPolarHBondContact CB-O 3.38Å; Y784-A816 HydrophobicContact CD2-CB 4.35Å; Y784-A816 HydrophobicContact CG-CB 4.22Å; K806-A816 HydrophobicContact CB-CB 3.48Å; K806-A816 VanDerWaalsContact CB-CB 3.48Å; K806-A816 HydrophobicContact CD-CB 3.74Å; K806-A816 HydrophobicContact CG-CB 4.26Å; L813-A816 HydrophobicContact CB-CB 4.09Å
817	D	92.8	Very high	93.9	Very high	87 Å²	87	36 Å²	36	47%	0.465	19%	0.186	S	C	.	.			trans	-120.7	-10.8	-172.6	61.5	-18.7	0	0	0	113.2	K711 H783	K711-D817 WeakPolarHBondContact CE-OD1 3.34Å; K711-D817 IonicContact NZ-OD1 2.61Å; K711-D817 PolarHBondContact NZ-OD1 2.69Å; K711-D817 IonicContact NZ-OD2 2.82Å; K711-D817 PolarHBondContact NZ-OD2 2.92Å; H783-D817 PolarHBondContact CD2-O 3.27Å
818	D	93	Very high	94.1	Very high	7 Å²	7	35.4 Å²	35.4	4%	0.037	18%	0.182	C	C	.	.	S	Bend	trans	-79.3	156.4	-168.4	62.2	-73.6	0	0	0	113.6	K711 Y784 K806 V820 H824	K711-D818 HydrophobicContact CB-CB 3.92Å; K711-D818 HydrophobicContact CD-CB 4.06Å; K711-D818 HydrophobicContact CG-CB 3.86Å; Y784-D818 WeakPolarHBondContact CD2-O 3.47Å; Y784-D818 PolarHBondContact N-O 2.86Å; K806-D818 IonicContact NZ-OD1 2.71Å; K806-D818 PolarHBondContact NZ-OD1 3.36Å; K806-D818 IonicContact NZ-OD2 3.86Å; K806-D818 PolarHBondContact NZ-OD2 3.14Å; D818-V820 PolarHBondContact O-N 2.68Å; D818-H824 IonicContact OD2-NE2 3.81Å; D818-H824 PolarHBondContact OD2-NE2 3.34Å
819	P	95.1	Very high	94.4	Very high	10 Å²	10	32.7 Å²	32.7	7%	0.065	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-54.4	133.6	176.6	-22.5	28.5	0	0	0	112.5	Q712 S821 H824	Q712-P819 HydrophobicContact CB-CB 4.2Å; Q712-P819 HydrophobicContact CB-CG 4.45Å; Q712-P819 HydrophobicContact CG-CB 4.26Å; Q712-P819 VanDerWaalsContact O-CD 3.3Å; Q712-P819 WeakPolarHBondContact O-CD 3.46Å; P819-S821 PolarHBondContact O-N 2.93Å; P819-H824 PolarHBondContact O-NE2 2.68Å
820	V	95.7	Very high	94.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-67.8	129	172.9	-171.8	0	0	0	0	108.4	C720 I721 I782 Y784 V804 D818 I870	C720-V820 CarbonylContact C-O 3.59Å; C720-V820 WeakPolarHBondContact CA-O 3.28Å; I721-V820 HydrophobicContact CD1-CG1 4.09Å; I721-V820 PolarHBondContact N-O 2.81Å; I721-V820 VanDerWaalsContact N-O 3.1Å; I782-V820 HydrophobicContact CB-CG2 4.44Å; I782-V820 HydrophobicContact CG2-CB 4.47Å; I782-V820 HydrophobicContact CG2-CG2 3.91Å; I782-V820 WeakPolarHBondContact O-CG2 3.41Å; I782-V820 PolarHBondContact O-N 3.22Å; Y784-V820 HydrophobicContact CD1-CG2 3.88Å; Y784-V820 HydrophobicContact CD2-CG2 4.41Å; Y784-V820 HydrophobicContact CE1-CG1 4.35Å; Y784-V820 HydrophobicContact CE1-CG2 3.8Å; Y784-V820 HydrophobicContact CE2-CG2 4.33Å; Y784-V820 HydrophobicContact CG-CG2 4.2Å; V804-V820 HydrophobicContact CG1-CG2 4.3Å; V804-V820 HydrophobicContact CG2-CG2 4.18Å; D818-V820 PolarHBondContact O-N 2.68Å; V820-I870 HydrophobicContact CG1-CD1 4.24Å; V820-I870 HydrophobicContact CG1-CG2 3.8Å
821	S	94.8	Very high	94.9	Very high	1 Å²	1	24 Å²	24	1%	0.007	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-125.1	158.5	-169.8	-169.1	0	0	0	0	111.9	L719 P819 L823 H824	L719-S821 WeakPolarHBondContact O-CA 3.33Å; L719-S821 WeakPolarHBondContact O-CB 3.2Å; L719-S821 PolarHBondContact O-OG 2.79Å; P819-S821 PolarHBondContact O-N 2.93Å; S821-L823 PolarHBondContact O-N 3.18Å; S821-H824 PolarHBondContact N-CE1 2.7Å; S821-H824 PolarHBondContact N-ND1 3.45Å; S821-H824 VanDerWaalsContact O-CB 3.25Å; S821-H824 WeakPolarHBondContact O-CB 3.39Å; S821-H824 PolarHBondContact O-N 2.93Å; S821-H824 VanDerWaalsContact O-N 3.1Å
822	Q	95.1	Very high	94.9	Very high	8 Å²	8	28.5 Å²	28.5	4%	0.037	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	131.3	-176.1	-55.7	-60	-33.5	0	0	112.5	V543 L719 C720 H824 S872	V543-Q822 HydrophobicContact CG1-CB 4.36Å; V543-Q822 HydrophobicContact CG1-CG 3.91Å; V543-Q822 HydrophobicContact CG2-CB 3.88Å; V543-Q822 HydrophobicContact CG2-CG 4.25Å; L719-Q822 HydrophobicContact CB-CG 4.48Å; L719-Q822 HydrophobicContact CD2-CG 4.27Å; L719-Q822 WeakPolarHBondContact O-CG 3.48Å; L719-Q822 PolarHBondContact O-N 3Å; C720-Q822 PolarHBondContact O-NE2 3.11Å; Q822-H824 PolarHBondContact O-N 2.71Å; Q822-S872 PolarHBondContact NE2-OG 2.9Å
823	L	95.7	Very high	94.8	Very high	30 Å²	30	30.8 Å²	30.8	16%	0.157	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	22.4	-176.9	-65.1	174.4	0	0	0	115	I704 P707 F730 S821 T869 I870 I871	I704-L823 HydrophobicContact CD1-CD1 4.16Å; P707-L823 HydrophobicContact CB-CB 3.97Å; P707-L823 HydrophobicContact CG-CB 3.61Å; P707-L823 HydrophobicContact CG-CD1 4.14Å; F730-L823 HydrophobicContact CE1-CD2 3.93Å; F730-L823 HydrophobicContact CZ-CD2 3.8Å; S821-L823 PolarHBondContact O-N 3.18Å; L823-T869 HydrophobicContact CD2-CG2 4.09Å; L823-I870 VanDerWaalsContact CA-O 3.29Å; L823-I870 WeakPolarHBondContact CA-O 3.34Å; L823-I870 PolarHBondContact N-O 2.88Å; L823-I871 HydrophobicContact CD2-CB 4.24Å; L823-I871 HydrophobicContact CD2-CD1 3.85Å; L823-I871 HydrophobicContact CG-CD1 4.06Å
824	H	94.8	Very high	94.7	Very high	14 Å²	14	35.7 Å²	35.7	7%	0.065	19%	0.187	C	C	.	.			trans	-67.2	154.8	164.3	-81.2	-173.1	0	0	0	111.9	Y784 D818 P819 S821 Q822 T869 I870	Y784-H824 AromaticContact CE2-CE1 3.12Å; Y784-H824 WeakPolarHBondContact CE2-CE1 3.47Å; Y784-H824 AromaticContact CE2-ND1 3.89Å; Y784-H824 AromaticContact CZ-CE1 3.03Å; Y784-H824 AromaticContact CZ-ND1 3.83Å; Y784-H824 VanDerWaalsContact OH-CB 3.25Å; Y784-H824 WeakPolarHBondContact OH-CB 3.43Å; Y784-H824 PolarHBondContact OH-CE1 3.3Å; Y784-H824 PolarHBondContact OH-ND1 3.37Å; D818-H824 IonicContact OD2-NE2 3.81Å; D818-H824 PolarHBondContact OD2-NE2 3.34Å; P819-H824 PolarHBondContact O-NE2 2.68Å; S821-H824 PolarHBondContact N-CE1 2.7Å; S821-H824 PolarHBondContact N-ND1 3.45Å; S821-H824 VanDerWaalsContact O-CB 3.25Å; S821-H824 WeakPolarHBondContact O-CB 3.39Å; S821-H824 PolarHBondContact O-N 2.93Å; S821-H824 VanDerWaalsContact O-N 3.1Å; Q822-H824 PolarHBondContact O-N 2.71Å; H824-T869 WeakPolarHBondContact O-CA 3.33Å; H824-I870 HydrophobicContact CB-CG2 4.35Å; H824-I870 PolarHBondContact O-N 2.91Å; H824-I870 VanDerWaalsContact O-N 3.12Å
825	K	95	Very high	94.6	Very high	81 Å²	81	38.1 Å²	38.1	35%	0.352	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.2	165.5	-79.5	-173.5	157.5	-68.9	0	110.3	V807 A867 W868	V807-K825 HydrophobicContact CB-CB 4.2Å; V807-K825 PolarHBondContact N-O 3.03Å; V807-K825 VanDerWaalsContact N-O 3.12Å; K825-A867 PolarHBondContact NZ-O 3.37Å; K825-W868 WeakPolarHBondContact CA-O 3.48Å
826	C	96.7	Very high	94.8	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	163.8	179.7	60.1	0	0	0	0	110.9	Y784 V804 R805 A867 W868	Y784-C826 HydrophobicContact CE1-CB 4.15Å; V804-C826 HydrophobicContact CG2-CB 4.14Å; R805-C826 CarbonylContact O-C 3.33Å; R805-C826 WeakPolarHBondContact O-CA 3.32Å; R805-C826 WeakPolarHBondContact O-CB 3.5Å; C826-A867 CarbonylContact O-C 3.5Å; C826-W868 PolarHBondContact N-O 3.39Å; C826-W868 PolarHBondContact O-N 2.8Å; C826-W868 VanDerWaalsContact O-O 3.13Å
827	A	97.7	Very high	95	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	149.7	168.1	0	0	0	0	0	108.3	R805 V807 V812 Y837 I862	R805-A827 PolarHBondContact N-O 2.94Å; R805-A827 PolarHBondContact O-N 2.68Å; V807-A827 HydrophobicContact CG2-CB 3.66Å; V812-A827 HydrophobicContact CG2-CB 4.1Å; A827-Y837 HydrophobicContact CB-CD1 3.7Å; A827-Y837 HydrophobicContact CB-CE1 3.95Å; A827-I862 HydrophobicContact CB-CD1 3.91Å
828	F	97.9	Very high	95.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	105.1	-179.9	-64.7	-85.1	0	0	0	108.7	L729 V788 L790 L802 V804 Y837 L838 W868	L729-F828 HydrophobicContact CD1-CD2 4.26Å; L729-F828 HydrophobicContact CD1-CE2 3.5Å; L729-F828 VanDerWaalsContact CD1-CE2 3.5Å; L729-F828 HydrophobicContact CD1-CZ 3.82Å; L729-F828 HydrophobicContact CD2-CE2 3.74Å; L729-F828 HydrophobicContact CD2-CZ 3.84Å; L729-F828 HydrophobicContact CG-CE2 4.28Å; V788-F828 HydrophobicContact CG2-CE1 4.46Å; L790-F828 HydrophobicContact CD1-CD1 4.46Å; L790-F828 HydrophobicContact CD1-CE1 4.18Å; L790-F828 HydrophobicContact CD1-CZ 4.35Å; L802-F828 HydrophobicContact CB-CB 4.14Å; L802-F828 HydrophobicContact CB-CD1 4.08Å; L802-F828 HydrophobicContact CD1-CB 3.93Å; L802-F828 HydrophobicContact CD1-CD1 4.03Å; L802-F828 HydrophobicContact CD1-CG 4.13Å; L802-F828 HydrophobicContact CD2-CB 4.1Å; L802-F828 HydrophobicContact CG-CB 4.26Å; V804-F828 HydrophobicContact CB-CD1 4.32Å; V804-F828 HydrophobicContact CB-CE1 4.11Å; V804-F828 HydrophobicContact CG2-CD1 4.5Å; V804-F828 HydrophobicContact CG2-CE1 3.99Å; V804-F828 HydrophobicContact CG2-CZ 4.46Å; F828-Y837 CarbonylContact O-C 3.58Å; F828-Y837 VanDerWaalsContact O-CA 3.31Å; F828-Y837 WeakPolarHBondContact O-CA 3.43Å; F828-L838 HydrophobicContact CB-CB 3.99Å; F828-L838 HydrophobicContact CB-CD2 4.39Å; F828-L838 HydrophobicContact CD2-CD2 4.45Å; F828-L838 PolarHBondContact O-N 3.07Å; F828-W868 HydrophobicContact CD2-CG 4.45Å; F828-W868 HydrophobicContact CE2-CB 4.26Å; F828-W868 HydrophobicContact CE2-CG 4.48Å
829	H	97.3	Very high	95.3	Very high	28 Å²	28	31.6 Å²	31.6	13%	0.13	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	134.1	172.7	171.6	97.4	0	0	0	108.5	L802 I803 K831 M836 Y837	L802-H829 CarbonylContact C-O 3.33Å; L802-H829 VanDerWaalsContact CA-O 3.28Å; L802-H829 WeakPolarHBondContact CA-O 3.42Å; I803-H829 HydrophobicContact CB-CB 4.33Å; I803-H829 PolarHBondContact N-O 2.87Å; I803-H829 PolarHBondContact O-N 3.47Å; H829-K831 PolarHBondContact O-N 3.01Å; H829-M836 WeakPolarHBondContact CA-O 3.13Å; H829-Y837 HydrophobicContact CB-CD1 4.02Å; H829-Y837 HydrophobicContact CB-CE1 3.63Å; H829-Y837 AromaticContact ND1-CZ 3.99Å
830	L	96.2	Very high	95.2	Very high	10 Å²	10	31.6 Å²	31.6	5%	0.052	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	121.3	176	-78.2	75.3	0	0	0	109	L802 T833 M836 L838 Q847	L802-L830 HydrophobicContact CD2-CD1 3.99Å; L802-L830 HydrophobicContact CD2-CG 3.84Å; L830-T833 HydrophobicContact CB-CG2 3.69Å; L830-T833 PolarHBondContact O-N 3.49Å; L830-T833 PolarHBondContact O-OG1 3.15Å; L830-M836 PolarHBondContact N-O 2.83Å; L830-L838 HydrophobicContact CD1-CB 4.29Å; L830-Q847 HydrophobicContact CD2-CG 3.7Å
831	K	93.6	Very high	95.1	Very high	28 Å²	28	34.6 Å²	34.6	12%	0.122	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	144.4	-179.1	-169.2	167.2	179.2	175.3	0	110	D767 T787 R801 I803 H829 T833	D767-K831 PolarHBondContact O-NZ 3.44Å; T787-K831 HydrophobicContact CG2-CD 3.78Å; T787-K831 PolarHBondContact OG1-NZ 3.17Å; R801-K831 HydrophobicContact CB-CB 3.9Å; R801-K831 HydrophobicContact CB-CD 4.13Å; R801-K831 WeakPolarHBondContact O-CB 3.18Å; R801-K831 PolarHBondContact O-N 2.7Å; I803-K831 HydrophobicContact CD1-CG 4.38Å; I803-K831 HydrophobicContact CG1-CB 4.39Å; H829-K831 PolarHBondContact O-N 3.01Å; K831-T833 VanDerWaalsContact C-N 3.27Å; K831-T833 PolarHBondContact O-N 3.04Å
832	D	92.4	Very high	94.8	Very high	123 Å²	123	42.3 Å²	42.3	66%	0.658	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	27.9	-178.3	-45.7	-33.2	0	0	0	114.6	R801	R801-D832 IonicContact CZ-OD2 3.95Å; R801-D832 IonicContact NH1-OD2 2.63Å; R801-D832 PolarHBondContact NH1-OD2 2.81Å; R801-D832 VanDerWaalsContact NH1-OD2 3.15Å; R801-D832 IonicContact NH2-OD2 3.82Å; R801-D832 PolarHBondContact NH2-OD2 2.86Å
833	T	93.7	Very high	94.6	Very high	47 Å²	47	45.7 Å²	45.7	29%	0.288	23%	0.231	S	C	.	.	S	Bend	trans	-120.4	152.8	173	73.2	0	0	0	0	112.6	L830 K831 R835 M836	L830-T833 HydrophobicContact CB-CG2 3.69Å; L830-T833 PolarHBondContact O-N 3.49Å; L830-T833 PolarHBondContact O-OG1 3.15Å; K831-T833 VanDerWaalsContact C-N 3.27Å; K831-T833 PolarHBondContact O-N 3.04Å; T833-R835 VanDerWaalsContact C-N 3.34Å; T833-R835 PolarHBondContact O-N 2.82Å; T833-M836 WeakPolarHBondContact OG1-CB 3.25Å; T833-M836 PolarHBondContact OG1-N 3.35Å
834	D	91.4	Very high	94.6	Very high	133 Å²	133	51.6 Å²	51.6	71%	0.711	26%	0.255	S	S	*	.	S	Bend	trans	-74.3	88.3	172.2	-173.4	21	0	0	0	110.7	M836	D834-M836 PolarHBondContact O-N 3.41Å
835	R	92.1	Very high	94.6	Very high	94 Å²	94	52.5 Å²	52.5	36%	0.355	26%	0.26	S	S	.	.	S	Bend	trans	55	28.3	171.6	-54	178.6	-161.3	-100.5	2.7	115	T833 Y837 P849 S850 E860	T833-R835 VanDerWaalsContact C-N 3.34Å; T833-R835 PolarHBondContact O-N 2.82Å; R835-Y837 WeakPolarHBondContact O-CD2 3.43Å; R835-Y837 WeakPolarHBondContact O-CE2 3.36Å; R835-P849 WeakPolarHBondContact O-CA 3.42Å; R835-S850 WeakPolarHBondContact CB-OG 3.44Å; R835-S850 PolarHBondContact O-N 3Å; R835-E860 WeakPolarHBondContact CD-OE1 3.32Å; R835-E860 WeakPolarHBondContact CG-OE1 3.46Å; R835-E860 IonicContact CZ-OE1 3.65Å; R835-E860 IonicContact NE-OE1 3.88Å; R835-E860 IonicContact NH1-OE1 2.7Å; R835-E860 PolarHBondContact NH1-OE1 2.84Å
836	M	96.5	Very high	94.6	Very high	46 Å²	46	50.9 Å²	50.9	23%	0.227	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	134.5	176.4	-57.2	-65.6	-77.8	0	0	110.4	H829 L830 T833 D834 Q847 P849	H829-M836 WeakPolarHBondContact CA-O 3.13Å; L830-M836 PolarHBondContact N-O 2.83Å; T833-M836 WeakPolarHBondContact OG1-CB 3.25Å; T833-M836 PolarHBondContact OG1-N 3.35Å; D834-M836 PolarHBondContact O-N 3.41Å; M836-Q847 HydrophobicContact CB-CB 4.46Å; M836-Q847 HydrophobicContact CE-CB 3.7Å; M836-P849 HydrophobicContact SD-CB 3.8Å; M836-P849 HydrophobicContact SD-CG 4.32Å
837	Y	97.4	Very high	94.6	Very high	1 Å²	1	56 Å²	56	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	147.3	177.6	-71.6	-97.3	0	0	0	111.7	V812 A827 F828 H829 R835 C839 Q847 L848 E860 I862	V812-Y837 HydrophobicContact CG1-CE1 4.42Å; V812-Y837 HydrophobicContact CG2-CE1 3.97Å; A827-Y837 HydrophobicContact CB-CD1 3.7Å; A827-Y837 HydrophobicContact CB-CE1 3.95Å; F828-Y837 CarbonylContact O-C 3.58Å; F828-Y837 VanDerWaalsContact O-CA 3.31Å; F828-Y837 WeakPolarHBondContact O-CA 3.43Å; H829-Y837 HydrophobicContact CB-CD1 4.02Å; H829-Y837 HydrophobicContact CB-CE1 3.63Å; H829-Y837 AromaticContact ND1-CZ 3.99Å; R835-Y837 WeakPolarHBondContact O-CD2 3.43Å; R835-Y837 WeakPolarHBondContact O-CE2 3.36Å; Y837-C839 PolarHBondContact O-N 2.95Å; Y837-C839 PolarHBondContact O-SG 2.81Å; Y837-Q847 WeakPolarHBondContact O-CA 3.47Å; Y837-L848 PolarHBondContact N-O 2.84Å; Y837-L848 PolarHBondContact O-N 2.83Å; Y837-L848 VanDerWaalsContact O-N 3.14Å; Y837-E860 WeakPolarHBondContact CE2-OE2 3.5Å; Y837-E860 VanDerWaalsContact CZ-OE2 3.31Å; Y837-E860 PolarHBondContact OH-OE2 3.41Å; Y837-I862 HydrophobicContact CD2-CG2 4.07Å; Y837-I862 HydrophobicContact CE2-CG2 4.17Å; Y837-I862 HydrophobicContact CG-CG2 4.28Å
838	L	97	Very high	94.4	Very high	7 Å²	7	58.9 Å²	58.9	4%	0.037	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	111.3	171.3	-170	75.8	0	0	0	109.5	L799 L802 F828 L830 I845 W868	L799-L838 HydrophobicContact CD1-CD1 4.21Å; L799-L838 HydrophobicContact CD1-CD2 3.76Å; L799-L838 HydrophobicContact CD2-CD1 4.33Å; L802-L838 HydrophobicContact CD1-CD2 4.35Å; F828-L838 HydrophobicContact CB-CB 3.99Å; F828-L838 HydrophobicContact CB-CD2 4.39Å; F828-L838 HydrophobicContact CD2-CD2 4.45Å; F828-L838 PolarHBondContact O-N 3.07Å; L830-L838 HydrophobicContact CD1-CB 4.29Å; L838-I845 HydrophobicContact CD1-CG2 3.55Å; L838-I845 HydrophobicContact CG-CG2 4.25Å; L838-W868 PolarHBondContact O-NE1 3.11Å
839	C	95.5	Very high	94.2	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.014	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	155.9	-174.8	-62.7	0	0	0	0	111.2	Y837 I845 V846 L848 A866	Y837-C839 PolarHBondContact O-N 2.95Å; Y837-C839 PolarHBondContact O-SG 2.81Å; C839-I845 WeakPolarHBondContact O-CA 3.45Å; C839-V846 HydrophobicContact CB-CG2 4.05Å; C839-V846 PolarHBondContact N-O 2.92Å; C839-V846 PolarHBondContact O-N 2.85Å; C839-V846 VanDerWaalsContact O-O 3.05Å; C839-L848 HydrophobicContact CB-CB 4.35Å; C839-L848 HydrophobicContact CB-CD1 3.78Å; C839-L848 HydrophobicContact CB-CG 3.96Å; C839-A866 WeakPolarHBondContact SG-CB 3.24Å
840	L	93.1	Very high	94	Very high	11 Å²	11	62.3 Å²	62.3	6%	0.058	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	152.1	159.9	69	88.3	0	0	0	111.1	N731 L733 R741 A752 K844 A865 W868	N731-L840 HydrophobicContact CB-CD2 3.34Å; L733-L840 HydrophobicContact CD1-CD1 4.44Å; L733-L840 HydrophobicContact CD1-CD2 4.33Å; R741-L840 HydrophobicContact CB-CD2 4.29Å; A752-L840 HydrophobicContact CB-CB 4.08Å; L840-K844 CarbonylContact C-O 3.59Å; L840-K844 WeakPolarHBondContact CA-O 3.28Å; L840-A865 HydrophobicContact CD1-CB 4.19Å; L840-A865 HydrophobicContact CG-CB 4.04Å; L840-A865 PolarHBondContact N-O 2.97Å; L840-A865 VanDerWaalsContact N-O 3.15Å; L840-A865 WeakPolarHBondContact O-CB 3.43Å; L840-W868 HydrophobicContact CB-CH2 4.22Å; L840-W868 HydrophobicContact CB-CZ2 4.34Å; L840-W868 HydrophobicContact CD2-CH2 4.42Å
841	S	92.2	Very high	93.9	Very high	62 Å²	62	66 Å²	66	43%	0.434	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	107.7	162.2	-174.5	0	0	0	0	107.8	D843 K844	S841-D843 PolarHBondContact O-N 3.38Å; S841-D843 VanDerWaalsContact O-N 3.11Å; S841-K844 PolarHBondContact N-O 3.02Å; S841-K844 PolarHBondContact O-N 3.34Å
842	Q	88.4	Confident	93.7	Very high	164 Å²	164	67.6 Å²	67.6	77%	0.766	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	-112.3	-164.5	-57	172	-4.5	0	0	110
843	D	92.3	Very high	93.3	Very high	79 Å²	79	62.4 Å²	62.4	42%	0.422	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	7.3	179.3	-51.8	-43.3	0	0	0	112.6	R741 H751 A752 S841	R741-D843 IonicContact CZ-OD1 2.66Å; R741-D843 VanDerWaalsContact CZ-OD1 3.22Å; R741-D843 IonicContact NE-OD1 3.3Å; R741-D843 PolarHBondContact NE-OD1 2.79Å; R741-D843 IonicContact NH2-OD1 3.41Å; R741-D843 PolarHBondContact NH2-OD1 3.18Å; H751-D843 WeakPolarHBondContact CB-O 3.48Å; A752-D843 PolarHBondContact N-O 2.93Å; A752-D843 WeakPolarHBondContact O-CA 3.47Å; S841-D843 PolarHBondContact O-N 3.38Å; S841-D843 VanDerWaalsContact O-N 3.11Å
844	K	94.4	Very high	92.7	Very high	154 Å²	154	67.5 Å²	67.5	67%	0.67	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	154.6	176.4	-64	-171.3	177.1	-172	0	112.1	L840 S841	L840-K844 CarbonylContact C-O 3.59Å; L840-K844 WeakPolarHBondContact CA-O 3.28Å; S841-K844 PolarHBondContact N-O 3.02Å; S841-K844 PolarHBondContact O-N 3.34Å
845	I	96.3	Very high	92.3	Very high	32 Å²	32	70.2 Å²	70.2	16%	0.164	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	136	166	-59.4	-58.9	0	0	0	109.5	L743 F750 A752 L838 C839 W868	L743-I845 HydrophobicContact CD1-CD1 3.53Å; L743-I845 HydrophobicContact CD1-CG1 3.64Å; F750-I845 HydrophobicContact CB-CB 4.41Å; F750-I845 HydrophobicContact CB-CG1 4.23Å; A752-I845 HydrophobicContact CB-CD1 4.03Å; L838-I845 HydrophobicContact CD1-CG2 3.55Å; L838-I845 HydrophobicContact CG-CG2 4.25Å; C839-I845 WeakPolarHBondContact O-CA 3.45Å; I845-W868 HydrophobicContact CD1-CH2 3.66Å; I845-W868 HydrophobicContact CD1-CZ2 3.87Å
846	V	95.3	Very high	92	Very high	48 Å²	48	68.1 Å²	68.1	29%	0.291	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	167.2	-178.8	-62	0	0	0	0	110.5	C839 L848	C839-V846 HydrophobicContact CB-CG2 4.05Å; C839-V846 PolarHBondContact N-O 2.92Å; C839-V846 PolarHBondContact O-N 2.85Å; C839-V846 VanDerWaalsContact O-O 3.05Å; V846-L848 HydrophobicContact CG2-CD1 4.42Å; V846-L848 HydrophobicContact CG2-CD2 4.39Å; V846-L848 HydrophobicContact CG2-CG 4.09Å
847	Q	95.3	Very high	91.6	Very high	107 Å²	107	71.4 Å²	71.4	50%	0.5	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.1	170.2	-52.9	175.3	10.9	0	0	108.2	L830 M836 Y837	L830-Q847 HydrophobicContact CD2-CG 3.7Å; M836-Q847 HydrophobicContact CB-CB 4.46Å; M836-Q847 HydrophobicContact CE-CB 3.7Å; Y837-Q847 WeakPolarHBondContact O-CA 3.47Å
848	L	93.7	Very high	91.2	Very high	61 Å²	61	75.4 Å²	75.4	32%	0.319	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143	173.5	-60	173.4	0	0	0	110.4	Y837 C839 V846	Y837-L848 PolarHBondContact N-O 2.84Å; Y837-L848 PolarHBondContact O-N 2.83Å; Y837-L848 VanDerWaalsContact O-N 3.14Å; C839-L848 HydrophobicContact CB-CB 4.35Å; C839-L848 HydrophobicContact CB-CD1 3.78Å; C839-L848 HydrophobicContact CB-CG 3.96Å; V846-L848 HydrophobicContact CG2-CD1 4.42Å; V846-L848 HydrophobicContact CG2-CD2 4.39Å; V846-L848 HydrophobicContact CG2-CG 4.09Å
849	P	94.7	Very high	91	Very high	88 Å²	88	80.1 Å²	80.1	57%	0.571	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	149.7	175	30.2	-34.7	0	0	0	111.4	R835 M836	R835-P849 WeakPolarHBondContact O-CA 3.42Å; M836-P849 HydrophobicContact SD-CB 3.8Å; M836-P849 HydrophobicContact SD-CG 4.32Å
850	S	93.4	Very high	91	Very high	11 Å²	11	80.2 Å²	80.2	8%	0.077	42%	0.424	C	S	.	.			trans	-80.1	169.9	162.4	76.1	0	0	0	0	111.3	R835 E860 K861	R835-S850 WeakPolarHBondContact CB-OG 3.44Å; R835-S850 PolarHBondContact O-N 3Å; S850-E860 WeakPolarHBondContact CB-OE2 3.28Å; S850-E860 PolarHBondContact OG-OE2 2.66Å; S850-K861 WeakPolarHBondContact CA-O 3.3Å; S850-K861 WeakPolarHBondContact CB-O 3.42Å
851	T	92.6	Very high	91	Very high	89 Å²	89	84 Å²	84	55%	0.546	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.3	166.8	-52.3	0	0	0	0	108.5	E860 K861	T851-E860 CarbonylContact O-C 3.59Å; T851-K861 PolarHBondContact N-O 2.72Å; T851-K861 PolarHBondContact O-N 2.99Å
852	P	88.9	Confident	91.1	Very high	61 Å²	61	81.8 Å²	81.8	40%	0.396	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	156.7	177.7	26.1	-34.4	0	0	0	112.1
853	C	85.2	Confident	91.2	Very high	13 Å²	13	78.4 Å²	78.4	9%	0.088	41%	0.41	C	S	.	.			trans	-94.4	113	172.2	-70.2	0	0	0	0	111	E855 N856 R859	C853-E855 PolarHBondContact O-N 3.45Å; C853-N856 WeakPolarHBondContact CB-O 3.21Å; C853-N856 CarbonylContact O-C 3.54Å; C853-N856 PolarHBondContact O-N 3.36Å; C853-R859 HydrophobicContact CB-CB 4.04Å; C853-R859 VanDerWaalsContact CB-O 3.31Å; C853-R859 WeakPolarHBondContact CB-O 3.34Å; C853-R859 PolarHBondContact N-O 2.81Å; C853-R859 VanDerWaalsContact N-O 3.11Å
854	D	81.3	Confident	91.2	Very high	155 Å²	155	77.8 Å²	77.8	83%	0.829	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.4	175.8	-43.4	-74.5	0	0	0	112.6
855	E	82.7	Confident	91.1	Very high	189 Å²	189	70.8 Å²	70.8	88%	0.883	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-24.9	178	-64.3	172.3	-168.8	0	0	114.1	C853	C853-E855 PolarHBondContact O-N 3.45Å
856	N	86	Confident	91.1	Very high	51 Å²	51	69.3 Å²	69.3	27%	0.273	37%	0.37	S	S	.	.			trans	-161.1	112.5	-174.8	-174.6	-20.3	0	0	0	111.6	C853 L858 R859	C853-N856 WeakPolarHBondContact CB-O 3.21Å; C853-N856 CarbonylContact O-C 3.54Å; C853-N856 PolarHBondContact O-N 3.36Å; N856-L858 PolarHBondContact O-N 3.47Å; N856-L858 VanDerWaalsContact O-N 3.16Å; N856-L858 WeakPolarHBondContact OD1-CB 3.4Å; N856-L858 PolarHBondContact OD1-N 3.22Å; N856-R859 HydrophobicContact CB-CG 4.41Å; N856-R859 PolarHBondContact O-N 3.12Å; N856-R859 VanDerWaalsContact O-N 3.09Å
857	P	87.8	Confident	91.1	Very high	114 Å²	114	67.1 Å²	67.1	74%	0.74	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-14.2	-177	29.4	-36.4	0	0	0	114.4	R859	P857-R859 PolarHBondContact O-N 2.83Å
858	L	89.5	Confident	91.2	Very high	86 Å²	86	62 Å²	62	45%	0.45	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	7.7	174.5	-58.1	171	0	0	0	112.5	L814 D815 N856	L814-L858 WeakPolarHBondContact CB-O 3.26Å; L814-L858 PolarHBondContact N-O 2.9Å; D815-L858 HydrophobicContact CB-CB 4.32Å; D815-L858 HydrophobicContact CB-CD1 4.17Å; N856-L858 PolarHBondContact O-N 3.47Å; N856-L858 VanDerWaalsContact O-N 3.16Å; N856-L858 WeakPolarHBondContact OD1-CB 3.4Å; N856-L858 PolarHBondContact OD1-N 3.22Å
859	R	93	Very high	91.3	Very high	105 Å²	105	59.7 Å²	59.7	40%	0.396	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	144.7	-177.9	-62.6	-172.1	176.6	-176.2	-2.1	113	V812 L813 C853 N856 P857	V812-R859 WeakPolarHBondContact O-CA 3.28Å; L813-R859 HydrophobicContact CD2-CG 4.06Å; C853-R859 HydrophobicContact CB-CB 4.04Å; C853-R859 VanDerWaalsContact CB-O 3.31Å; C853-R859 WeakPolarHBondContact CB-O 3.34Å; C853-R859 PolarHBondContact N-O 2.81Å; C853-R859 VanDerWaalsContact N-O 3.11Å; N856-R859 HydrophobicContact CB-CG 4.41Å; N856-R859 PolarHBondContact O-N 3.12Å; N856-R859 VanDerWaalsContact O-N 3.09Å; P857-R859 PolarHBondContact O-N 2.83Å
860	E	93.9	Very high	91.5	Very high	5 Å²	5	55.6 Å²	55.6	2%	0.023	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139.6	174.5	-56.4	-174.8	162.1	0	0	110.4	T811 V812 L814 R835 Y837 S850 T851	T811-E860 CarbonylContact C-O 3.48Å; T811-E860 VanDerWaalsContact CA-O 3.26Å; T811-E860 WeakPolarHBondContact CA-O 3.11Å; V812-E860 HydrophobicContact CB-CB 4.41Å; V812-E860 PolarHBondContact N-O 2.88Å; V812-E860 PolarHBondContact O-N 3.39Å; L814-E860 HydrophobicContact CD1-CG 4.09Å; L814-E860 HydrophobicContact CG-CG 4.49Å; R835-E860 WeakPolarHBondContact CD-OE1 3.32Å; R835-E860 WeakPolarHBondContact CG-OE1 3.46Å; R835-E860 IonicContact CZ-OE1 3.65Å; R835-E860 IonicContact NE-OE1 3.88Å; R835-E860 IonicContact NH1-OE1 2.7Å; R835-E860 PolarHBondContact NH1-OE1 2.84Å; Y837-E860 WeakPolarHBondContact CE2-OE2 3.5Å; Y837-E860 VanDerWaalsContact CZ-OE2 3.31Å; Y837-E860 PolarHBondContact OH-OE2 3.41Å; S850-E860 WeakPolarHBondContact CB-OE2 3.28Å; S850-E860 PolarHBondContact OG-OE2 2.66Å; T851-E860 CarbonylContact O-C 3.59Å
861	K	93.7	Very high	91.7	Very high	90 Å²	90	55.1 Å²	55.1	39%	0.391	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.9	171.4	-66.7	161.2	-171.6	165.6	0	108.7	T811 S850 T851	T811-K861 HydrophobicContact CG2-CG 4.29Å; S850-K861 WeakPolarHBondContact CA-O 3.3Å; S850-K861 WeakPolarHBondContact CB-O 3.42Å; T851-K861 PolarHBondContact N-O 2.72Å; T851-K861 PolarHBondContact O-N 2.99Å
862	I	94.4	Very high	92	Very high	15 Å²	15	51.2 Å²	51.2	8%	0.077	27%	0.267	C	S	.	.			trans	-115.6	160.3	175.3	53.2	164.4	0	0	0	110.8	V807 T810 V812 A827 Y837 A866 A867	V807-I862 HydrophobicContact CG1-CD1 4.07Å; V807-I862 HydrophobicContact CG2-CD1 3.73Å; T810-I862 VanDerWaalsContact O-CG1 3.31Å; T810-I862 WeakPolarHBondContact O-CG1 3.41Å; T810-I862 PolarHBondContact O-N 3.15Å; V812-I862 HydrophobicContact CG2-CB 4.28Å; V812-I862 HydrophobicContact CG2-CD1 3.65Å; V812-I862 HydrophobicContact CG2-CG1 3.86Å; V812-I862 HydrophobicContact CG2-CG2 3.49Å; V812-I862 VanDerWaalsContact CG2-CG2 3.49Å; A827-I862 HydrophobicContact CB-CD1 3.91Å; Y837-I862 HydrophobicContact CD2-CG2 4.07Å; Y837-I862 HydrophobicContact CE2-CG2 4.17Å; Y837-I862 HydrophobicContact CG-CG2 4.28Å; I862-A866 HydrophobicContact CB-CB 4.09Å; I862-A866 HydrophobicContact CD1-CB 4.02Å; I862-A867 HydrophobicContact CD1-CB 4.4Å
863	N	91.8	Very high	92.4	Very high	94 Å²	94	48.4 Å²	48.4	50%	0.503	25%	0.249	S	C	.	.			trans	-68.2	146.1	169	-167.7	-38.6	0	0	0	110.2	A865 A866	N863-A865 HydrophobicContact CB-CB 4.28Å; N863-A865 PolarHBondContact O-N 3.38Å; N863-A865 WeakPolarHBondContact OD1-CB 3.36Å; N863-A865 PolarHBondContact OD1-N 3.47Å; N863-A866 WeakPolarHBondContact O-CB 3.39Å; N863-A866 PolarHBondContact O-N 2.7Å
864	D	91.7	Very high	93	Very high	66 Å²	66	49.6 Å²	49.6	35%	0.353	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-46.8	-34.5	167.3	-95.5	-5.9	0	0	0	111.7	N731 T810 A866 A867	N731-D864 PolarHBondContact ND2-O 3.2Å; T810-D864 WeakPolarHBondContact CG2-OD1 3.29Å; D864-A866 PolarHBondContact O-N 3.5Å; D864-A867 PolarHBondContact O-N 2.85Å; D864-A867 VanDerWaalsContact O-N 3.15Å
865	A	92.9	Very high	93.7	Very high	6 Å²	6	46.2 Å²	46.2	5%	0.05	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-61.9	-19.1	177.2	0	0	0	0	0	115.4	N731 L840 N863	N731-A865 PolarHBondContact ND2-O 3.47Å; L840-A865 HydrophobicContact CD1-CB 4.19Å; L840-A865 HydrophobicContact CG-CB 4.04Å; L840-A865 PolarHBondContact N-O 2.97Å; L840-A865 VanDerWaalsContact N-O 3.15Å; L840-A865 WeakPolarHBondContact O-CB 3.43Å; N863-A865 HydrophobicContact CB-CB 4.28Å; N863-A865 PolarHBondContact O-N 3.38Å; N863-A865 WeakPolarHBondContact OD1-CB 3.36Å; N863-A865 PolarHBondContact OD1-N 3.47Å
866	A	95.2	Very high	94.4	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.008	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-92.2	-12.3	176.6	0	0	0	0	0	113.5	C839 I862 N863 D864 W868	C839-A866 WeakPolarHBondContact SG-CB 3.24Å; I862-A866 HydrophobicContact CB-CB 4.09Å; I862-A866 HydrophobicContact CD1-CB 4.02Å; N863-A866 WeakPolarHBondContact O-CB 3.39Å; N863-A866 PolarHBondContact O-N 2.7Å; D864-A866 PolarHBondContact O-N 3.5Å; A866-W868 PolarHBondContact O-N 2.85Å; A866-W868 VanDerWaalsContact O-N 3.13Å
867	A	95.4	Very high	94.9	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.017	19%	0.187	C	C	.	.			trans	-89.4	73.5	-170.8	0	0	0	0	0	112.6	V807 K825 C826 I862 D864	V807-A867 HydrophobicContact CG1-CB 4.17Å; K825-A867 PolarHBondContact NZ-O 3.37Å; C826-A867 CarbonylContact O-C 3.5Å; I862-A867 HydrophobicContact CD1-CB 4.4Å; D864-A867 PolarHBondContact O-N 2.85Å; D864-A867 VanDerWaalsContact O-N 3.15Å
868	W	97.1	Very high	95.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	150.1	176.8	-59.3	93.6	0	0	0	112.3	L729 N731 L743 K825 C826 F828 L838 L840 I845 A866	L729-W868 HydrophobicContact CB-CE3 4.04Å; L729-W868 HydrophobicContact CD2-CB 4.49Å; N731-W868 HydrophobicContact CB-CE3 4.2Å; N731-W868 HydrophobicContact CB-CZ3 4.24Å; L743-W868 HydrophobicContact CB-CZ3 4.26Å; K825-W868 WeakPolarHBondContact CA-O 3.48Å; C826-W868 PolarHBondContact N-O 3.39Å; C826-W868 PolarHBondContact O-N 2.8Å; C826-W868 VanDerWaalsContact O-O 3.13Å; F828-W868 HydrophobicContact CD2-CG 4.45Å; F828-W868 HydrophobicContact CE2-CB 4.26Å; F828-W868 HydrophobicContact CE2-CG 4.48Å; L838-W868 PolarHBondContact O-NE1 3.11Å; L840-W868 HydrophobicContact CB-CH2 4.22Å; L840-W868 HydrophobicContact CB-CZ2 4.34Å; L840-W868 HydrophobicContact CD2-CH2 4.42Å; I845-W868 HydrophobicContact CD1-CH2 3.66Å; I845-W868 HydrophobicContact CD1-CZ2 3.87Å; A866-W868 PolarHBondContact O-N 2.85Å; A866-W868 VanDerWaalsContact O-N 3.13Å
869	T	97.1	Very high	95.6	Very high	13 Å²	13	31.7 Å²	31.7	8%	0.08	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	125	172.3	-40.2	0	0	0	0	107.5	F730 L823 H824	F730-T869 HydrophobicContact CE1-CG2 3.94Å; F730-T869 HydrophobicContact CE2-CG2 3.99Å; F730-T869 HydrophobicContact CZ-CG2 3.54Å; F730-T869 PolarHBondContact N-O 3.13Å; F730-T869 WeakPolarHBondContact O-CA 3.3Å; F730-T869 VanDerWaalsContact O-CB 3.3Å; F730-T869 WeakPolarHBondContact O-CB 3.43Å; F730-T869 PolarHBondContact O-N 2.85Å; F730-T869 PolarHBondContact O-OG1 2.82Å; F730-T869 VanDerWaalsContact O-OG1 3.1Å; L823-T869 HydrophobicContact CD2-CG2 4.09Å; H824-T869 WeakPolarHBondContact O-CA 3.33Å
870	I	98	Very high	95.7	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	138	-174.3	-170.6	169.7	0	0	0	111.6	I721 I727 L729 I762 V820 L823 H824	I721-I870 HydrophobicContact CD1-CB 4.47Å; I721-I870 HydrophobicContact CD1-CD1 3.55Å; I721-I870 HydrophobicContact CD1-CG1 3.59Å; I721-I870 HydrophobicContact CD1-CG2 4.13Å; I727-I870 HydrophobicContact CB-CG1 4.32Å; I727-I870 HydrophobicContact CD1-CD1 3.64Å; I727-I870 HydrophobicContact CD1-CG1 3.96Å; I727-I870 HydrophobicContact CG2-CD1 4.36Å; I727-I870 HydrophobicContact CG2-CG1 4.24Å; L729-I870 HydrophobicContact CD2-CB 3.77Å; L729-I870 HydrophobicContact CD2-CD1 4.17Å; L729-I870 HydrophobicContact CD2-CG1 3.76Å; I762-I870 HydrophobicContact CD1-CD1 4.43Å; V820-I870 HydrophobicContact CG1-CD1 4.24Å; V820-I870 HydrophobicContact CG1-CG2 3.8Å; L823-I870 VanDerWaalsContact CA-O 3.29Å; L823-I870 WeakPolarHBondContact CA-O 3.34Å; L823-I870 PolarHBondContact N-O 2.88Å; H824-I870 HydrophobicContact CB-CG2 4.35Å; H824-I870 PolarHBondContact O-N 2.91Å; H824-I870 VanDerWaalsContact O-N 3.12Å
871	I	98.2	Very high	95.8	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	136.8	177.7	-174.4	167.6	0	0	0	110.5	A541 V543 I727 A728 F730 L823	A541-I871 HydrophobicContact CB-CD1 3.56Å; A541-I871 HydrophobicContact CB-CG1 4.1Å; V543-I871 HydrophobicContact CG2-CD1 3.69Å; V543-I871 HydrophobicContact CG2-CG1 4.03Å; I727-I871 CarbonylContact C-O 3.49Å; I727-I871 VanDerWaalsContact CA-O 3.22Å; I727-I871 WeakPolarHBondContact CA-O 3.37Å; I727-I871 WeakPolarHBondContact CB-O 3.43Å; A728-I871 HydrophobicContact CB-CG2 4.37Å; A728-I871 PolarHBondContact N-O 3.2Å; A728-I871 PolarHBondContact O-N 3.04Å; F730-I871 HydrophobicContact CD1-CG2 4.36Å; F730-I871 HydrophobicContact CE1-CG2 4.05Å; L823-I871 HydrophobicContact CD2-CB 4.24Å; L823-I871 HydrophobicContact CD2-CD1 3.85Å; L823-I871 HydrophobicContact CG-CD1 4.06Å
872	S	98.1	Very high	95.7	Very high	6 Å²	6	22.8 Å²	22.8	4%	0.042	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	141.7	175.5	-62.6	0	0	0	0	111.8	K542 K726 Q822	K542-S872 PolarHBondContact N-O 2.84Å; K726-S872 CarbonylContact O-C 3.53Å; K726-S872 VanDerWaalsContact O-CA 3.28Å; K726-S872 WeakPolarHBondContact O-CA 3.42Å; Q822-S872 PolarHBondContact NE2-OG 2.9Å
873	T	98.2	Very high	95.5	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.012	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	159.2	-174	49.3	0	0	0	0	111.5	H540 K542 P557 K726 I727 A728 W757 S759	H540-T873 CarbonylContact O-C 3.52Å; H540-T873 VanDerWaalsContact O-CA 3.25Å; H540-T873 WeakPolarHBondContact O-CA 3.32Å; H540-T873 WeakPolarHBondContact O-CB 3.33Å; K542-T873 WeakPolarHBondContact CE-O 3.5Å; P557-T873 HydrophobicContact CG-CG2 4.35Å; K726-T873 PolarHBondContact O-N 3.17Å; K726-T873 PolarHBondContact O-OG1 3.49Å; I727-T873 PolarHBondContact N-OG1 2.84Å; A728-T873 HydrophobicContact CB-CG2 3.64Å; W757-T873 HydrophobicContact CE3-CG2 4.44Å; W757-T873 HydrophobicContact CH2-CG2 3.77Å; W757-T873 HydrophobicContact CZ3-CG2 3.51Å; S759-T873 PolarHBondContact OG-OG1 3.05Å
874	D	97.4	Very high	95.3	Very high	38 Å²	38	19 Å²	19	20%	0.203	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	162.4	-178.7	-135.8	-24	0	0	0	111.9	L539 H540 K542 R699	L539-D874 WeakPolarHBondContact CA-O 3.47Å; H540-D874 PolarHBondContact N-O 2.95Å; H540-D874 VanDerWaalsContact N-O 3.14Å; H540-D874 PolarHBondContact O-N 2.84Å; K542-D874 WeakPolarHBondContact CE-OD2 3.46Å; K542-D874 HydrophobicContact CG-CB 3.85Å; K542-D874 IonicContact NZ-OD1 2.68Å; K542-D874 PolarHBondContact NZ-OD1 3.15Å; K542-D874 IonicContact NZ-OD2 2.82Å; K542-D874 PolarHBondContact NZ-OD2 3.02Å; R699-D874 HydrophobicContact CB-CB 4.2Å; R699-D874 WeakPolarHBondContact CB-OD2 3.31Å
875	R	96.2	Very high	95	Very high	85 Å²	85	17.4 Å²	17.4	32%	0.321	8%	0.082	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	120.5	-178.2	177.3	167.6	173.2	153.9	-15	109	I537 L539 E877	I537-R875 HydrophobicContact CG2-CG 3.93Å; L539-R875 HydrophobicContact CD2-CB 3.66Å; L539-R875 HydrophobicContact CD2-CG 3.67Å; R875-E877 HydrophobicContact CG-CB 4.44Å; R875-E877 IonicContact CZ-OE2 3.7Å; R875-E877 IonicContact NE-OE2 2.81Å; R875-E877 PolarHBondContact NE-OE2 2.82Å; R875-E877 IonicContact NH2-OE1 3.96Å; R875-E877 IonicContact NH2-OE2 2.74Å; R875-E877 PolarHBondContact NH2-OE2 3.22Å
876	A	96.6	Very high	94.8	Very high	3 Å²	3	17.7 Å²	17.7	3%	0.025	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	135	155.5	0	0	0	0	0	107.8	I537 I538 Y697 Y878	I537-A876 WeakPolarHBondContact CA-O 3.5Å; I538-A876 HydrophobicContact CB-CB 4.35Å; I538-A876 PolarHBondContact N-O 2.95Å; I538-A876 PolarHBondContact O-N 3.28Å; Y697-A876 VanDerWaalsContact O-CB 3.27Å; Y697-A876 WeakPolarHBondContact O-CB 3.49Å; A876-Y878 HydrophobicContact CB-CE2 4.18Å
877	E	95.9	Very high	94.4	Very high	49 Å²	49	21.1 Å²	21.1	23%	0.229	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	138.2	179.1	178.6	171	162.4	0	0	108.7	I535 L536 I537 R875 R879	I535-E877 HydrophobicContact CG2-CG 4.15Å; L536-E877 WeakPolarHBondContact O-CA 3.47Å; I537-E877 HydrophobicContact CG1-CG 4.29Å; R875-E877 HydrophobicContact CG-CB 4.44Å; R875-E877 IonicContact CZ-OE2 3.7Å; R875-E877 IonicContact NE-OE2 2.81Å; R875-E877 PolarHBondContact NE-OE2 2.82Å; R875-E877 IonicContact NH2-OE1 3.96Å; R875-E877 IonicContact NH2-OE2 2.74Å; R875-E877 PolarHBondContact NH2-OE2 3.22Å; E877-R879 IonicContact OE1-CZ 3.21Å; E877-R879 VanDerWaalsContact OE1-CZ 3.28Å; E877-R879 IonicContact OE1-NE 2.66Å; E877-R879 PolarHBondContact OE1-NE 2.89Å; E877-R879 IonicContact OE1-NH2 3.7Å; E877-R879 PolarHBondContact OE1-NH2 2.86Å
878	Y	97	Very high	93.9	Very high	15 Å²	15	24.9 Å²	24.9	6%	0.059	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.8	179.5	-60.2	-77.7	0	0	0	108.3	I535 L536 I538 F696 Y697 A876 V913 I915	I535-Y878 WeakPolarHBondContact CA-O 3.48Å; L536-Y878 HydrophobicContact CD2-CD2 4.25Å; L536-Y878 PolarHBondContact N-O 2.93Å; L536-Y878 PolarHBondContact O-N 2.79Å; I538-Y878 HydrophobicContact CD1-CE2 4.36Å; F696-Y878 HydrophobicContact CB-CD2 4.18Å; F696-Y878 HydrophobicContact CB-CE2 3.78Å; F696-Y878 HydrophobicContact CD1-CD1 4.22Å; F696-Y878 AromaticContact CD1-CD2 3.64Å; F696-Y878 HydrophobicContact CD1-CD2 3.64Å; F696-Y878 HydrophobicContact CD1-CE1 4.48Å; F696-Y878 AromaticContact CD1-CE2 3.97Å; F696-Y878 HydrophobicContact CD1-CE2 3.97Å; F696-Y878 AromaticContact CD1-CG 3.76Å; F696-Y878 HydrophobicContact CD1-CG 3.76Å; F696-Y878 HydrophobicContact CE1-CD2 4.5Å; F696-Y878 HydrophobicContact CE1-CG 4.28Å; F696-Y878 HydrophobicContact CG-CD2 4.3Å; F696-Y878 HydrophobicContact CG-CE2 4.35Å; Y697-Y878 PolarHBondContact N-OH 2.63Å; Y697-Y878 VanDerWaalsContact N-OH 3.1Å; Y697-Y878 PolarHBondContact O-OH 3.42Å; A876-Y878 HydrophobicContact CB-CE2 4.18Å; Y878-V913 HydrophobicContact CD1-CB 3.72Å; Y878-V913 HydrophobicContact CD1-CG1 3.82Å; Y878-V913 HydrophobicContact CD1-CG2 4.36Å; Y878-V913 HydrophobicContact CE1-CB 4.32Å; Y878-I915 HydrophobicContact CD1-CD1 4.42Å; Y878-I915 HydrophobicContact CD1-CG1 4.49Å; Y878-I915 HydrophobicContact CE1-CD1 3.83Å; Y878-I915 HydrophobicContact CE1-CG1 4.26Å
879	R	96.2	Very high	93.5	Very high	68 Å²	68	28.6 Å²	28.6	26%	0.257	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.9	176.5	-57.8	-166.9	179	-168.3	3.7	109.2	I535 E877	I535-R879 HydrophobicContact CB-CG 4.49Å; I535-R879 HydrophobicContact CG1-CG 4.03Å; I535-R879 HydrophobicContact CG2-CG 4.15Å; E877-R879 IonicContact OE1-CZ 3.21Å; E877-R879 VanDerWaalsContact OE1-CZ 3.28Å; E877-R879 IonicContact OE1-NE 2.66Å; E877-R879 PolarHBondContact OE1-NE 2.89Å; E877-R879 IonicContact OE1-NH2 3.7Å; E877-R879 PolarHBondContact OE1-NH2 2.86Å
880	W	96	Very high	93.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	160.5	169.9	66.5	87.2	0	0	0	111.5	Q534 L536 W568 L693 F696 V910 V913 I993 I994 Y995	Q534-W880 HydrophobicContact CB-CD2 4.23Å; Q534-W880 HydrophobicContact CB-CZ2 3.87Å; Q534-W880 PolarHBondContact N-O 3.37Å; Q534-W880 PolarHBondContact O-N 2.78Å; Q534-W880 VanDerWaalsContact O-N 3.12Å; L536-W880 HydrophobicContact CB-CH2 3.93Å; L536-W880 HydrophobicContact CB-CZ3 3.88Å; L536-W880 HydrophobicContact CD2-CH2 4.3Å; L536-W880 HydrophobicContact CD2-CZ3 4.41Å; W568-W880 AromaticContact CH2-CH2 3.65Å; W568-W880 HydrophobicContact CH2-CH2 3.65Å; W568-W880 AromaticContact CH2-CZ2 3.48Å; W568-W880 HydrophobicContact CH2-CZ2 3.48Å; W568-W880 VanDerWaalsContact CH2-CZ2 3.48Å; W568-W880 AromaticContact CZ2-CH2 3.79Å; W568-W880 HydrophobicContact CZ2-CH2 3.79Å; W568-W880 AromaticContact CZ2-CZ2 3.85Å; W568-W880 HydrophobicContact CZ2-CZ2 3.85Å; W568-W880 HydrophobicContact CZ3-CZ2 4.27Å; L693-W880 HydrophobicContact CD2-CZ2 4.34Å; F696-W880 HydrophobicContact CE1-CE3 4.23Å; F696-W880 AromaticContact CE1-CH2 3.88Å; F696-W880 HydrophobicContact CE1-CH2 3.88Å; F696-W880 AromaticContact CE1-CZ3 3.49Å; F696-W880 HydrophobicContact CE1-CZ3 3.49Å; F696-W880 VanDerWaalsContact CE1-CZ3 3.49Å; F696-W880 HydrophobicContact CE2-CH2 4.49Å; F696-W880 AromaticContact CZ-CH2 3.56Å; F696-W880 HydrophobicContact CZ-CH2 3.56Å; F696-W880 HydrophobicContact CZ-CZ2 4.33Å; F696-W880 AromaticContact CZ-CZ3 3.68Å; F696-W880 HydrophobicContact CZ-CZ3 3.68Å; W880-V910 HydrophobicContact CD2-CB 4.3Å; W880-V910 HydrophobicContact CD2-CG1 4.49Å; W880-V910 HydrophobicContact CD2-CG2 3.74Å; W880-V910 HydrophobicContact CE3-CG2 4.03Å; W880-V910 HydrophobicContact CG-CB 4.17Å; W880-V910 HydrophobicContact CG-CG1 4.22Å; W880-V910 HydrophobicContact CG-CG2 4.15Å; W880-V910 HydrophobicContact CH2-CG2 4.44Å; W880-V910 HydrophobicContact CZ2-CG2 4.18Å; W880-V910 HydrophobicContact CZ3-CG2 4.37Å; W880-V913 HydrophobicContact CE3-CG2 4.36Å; W880-I993 HydrophobicContact CB-CG2 4.22Å; W880-I994 CarbonylContact C-O 3.52Å; W880-I994 WeakPolarHBondContact CA-O 3.41Å; W880-Y995 HydrophobicContact CB-CD1 3.67Å; W880-Y995 HydrophobicContact CB-CE1 3.83Å
881	F	94.8	Very high	92.6	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.035	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-136	134.3	170.9	178.4	-100.6	0	0	0	110.1	Y527 R532 L570 H885 L886 I994	Y527-F881 HydrophobicContact CD2-CB 3.99Å; Y527-F881 AromaticContact CD2-CD1 3.45Å; Y527-F881 HydrophobicContact CD2-CD1 3.45Å; Y527-F881 VanDerWaalsContact CD2-CD1 3.45Å; Y527-F881 HydrophobicContact CD2-CD2 4.17Å; Y527-F881 AromaticContact CD2-CE1 3.89Å; Y527-F881 HydrophobicContact CD2-CE1 3.89Å; Y527-F881 AromaticContact CD2-CG 3.59Å; Y527-F881 HydrophobicContact CD2-CG 3.59Å; Y527-F881 HydrophobicContact CD2-CZ 4.43Å; Y527-F881 HydrophobicContact CE2-CB 3.65Å; Y527-F881 HydrophobicContact CE2-CD1 4.03Å; Y527-F881 HydrophobicContact CE2-CD2 4.37Å; Y527-F881 AromaticContact CE2-CG 3.76Å; Y527-F881 HydrophobicContact CE2-CG 3.76Å; Y527-F881 HydrophobicContact CG-CD1 4.12Å; Y527-F881 HydrophobicContact CG-CE1 4.4Å; R532-F881 HydrophobicContact CB-CE2 4.42Å; R532-F881 WeakPolarHBondContact O-CD2 3.38Å; L570-F881 HydrophobicContact CD1-CE2 4.43Å; F881-H885 HydrophobicContact CE2-CB 4.39Å; F881-H885 HydrophobicContact CZ-CB 4.49Å; F881-L886 HydrophobicContact CE1-CD1 4.36Å; F881-L886 HydrophobicContact CE1-CD2 3.69Å; F881-L886 HydrophobicContact CE1-CG 3.72Å; F881-L886 HydrophobicContact CZ-CD2 3.63Å; F881-L886 HydrophobicContact CZ-CG 3.82Å; F881-I994 HydrophobicContact CB-CB 4.41Å; F881-I994 HydrophobicContact CD1-CD1 4Å; F881-I994 HydrophobicContact CD1-CG1 4.5Å; F881-I994 PolarHBondContact N-O 3.05Å; F881-I994 PolarHBondContact O-N 3.19Å
882	E	92.2	Very high	91.9	Very high	5 Å²	5	37 Å²	37	2%	0.023	19%	0.186	C	C	.	.			trans	-101.2	113.1	178.7	-164.4	177.9	149.3	0	0	109	K691 S884 H885 P905 C906	K691-E882 IonicContact NZ-OE1 2.66Å; K691-E882 PolarHBondContact NZ-OE1 3.17Å; K691-E882 IonicContact NZ-OE2 3.15Å; K691-E882 PolarHBondContact NZ-OE2 2.88Å; E882-S884 WeakPolarHBondContact CG-OG 3.22Å; E882-S884 PolarHBondContact O-N 3.13Å; E882-S884 PolarHBondContact OE1-OG 2.86Å; E882-H885 PolarHBondContact O-N 2.92Å; E882-P905 WeakPolarHBondContact OE1-CA 3.21Å; E882-C906 PolarHBondContact OE1-N 3.03Å
883	P	90.4	Very high	91	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.013	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-62.7	-14.2	-170.3	-24.6	33.1	0	0	0	115.9	L519 H885 L886 P903 G992 I994	L519-P883 HydrophobicContact CD1-CB 4.14Å; L519-P883 HydrophobicContact CD1-CG 3.79Å; P883-H885 PolarHBondContact O-N 3.05Å; P883-L886 HydrophobicContact CB-CD1 4.07Å; P883-L886 VanDerWaalsContact O-CB 3.32Å; P883-L886 WeakPolarHBondContact O-CB 3.46Å; P883-L886 WeakPolarHBondContact O-CG 3.3Å; P883-L886 PolarHBondContact O-N 2.81Å; P883-P903 HydrophobicContact CB-CG 3.84Å; P883-G992 WeakPolarHBondContact CD-O 3.28Å; P883-G992 WeakPolarHBondContact CG-O 3.3Å; P883-I994 HydrophobicContact CG-CG1 4.38Å
884	S	86.9	Confident	90.3	Very high	26 Å²	26	50.7 Å²	50.7	18%	0.182	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-61.7	-17	171.1	59.5	0	0	0	0	113.6	E882 P903	E882-S884 WeakPolarHBondContact CG-OG 3.22Å; E882-S884 PolarHBondContact O-N 3.13Å; E882-S884 PolarHBondContact OE1-OG 2.86Å; S884-P903 WeakPolarHBondContact CA-O 3.49Å; S884-P903 WeakPolarHBondContact CB-O 3.46Å
885	H	86.4	Confident	89.7	Confident	34 Å²	34	50.6 Å²	50.6	16%	0.157	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-89.3	1.2	173.7	-63.5	-62.2	0	0	0	114	L570 F881 E882 P883	L570-H885 HydrophobicContact CB-CB 4.33Å; L570-H885 HydrophobicContact CD1-CB 3.74Å; F881-H885 HydrophobicContact CE2-CB 4.39Å; F881-H885 HydrophobicContact CZ-CB 4.49Å; E882-H885 PolarHBondContact O-N 2.92Å; P883-H885 PolarHBondContact O-N 3.05Å
886	L	88.1	Confident	89.2	Confident	12 Å²	12	52.6 Å²	52.6	6%	0.063	27%	0.272	C	S	.	.	S	Bend	trans	-66.6	143.5	172.8	-72	171.1	0	0	0	111.2	M523 A526 F881 P883 I900 P902	M523-L886 HydrophobicContact CB-CD1 3.79Å; M523-L886 HydrophobicContact CG-CD1 4.12Å; A526-L886 HydrophobicContact CB-CD2 3.94Å; F881-L886 HydrophobicContact CE1-CD1 4.36Å; F881-L886 HydrophobicContact CE1-CD2 3.69Å; F881-L886 HydrophobicContact CE1-CG 3.72Å; F881-L886 HydrophobicContact CZ-CD2 3.63Å; F881-L886 HydrophobicContact CZ-CG 3.82Å; P883-L886 HydrophobicContact CB-CD1 4.07Å; P883-L886 VanDerWaalsContact O-CB 3.32Å; P883-L886 WeakPolarHBondContact O-CB 3.46Å; P883-L886 WeakPolarHBondContact O-CG 3.3Å; P883-L886 PolarHBondContact O-N 2.81Å; L886-I900 HydrophobicContact CB-CD1 3.93Å; L886-I900 HydrophobicContact CD1-CD1 4.01Å; L886-I900 HydrophobicContact CG-CD1 4.44Å; L886-P902 HydrophobicContact CB-CG 4.27Å; L886-P902 WeakPolarHBondContact O-CG 3.47Å
887	P	85.7	Confident	88.8	Confident	72 Å²	72	57.8 Å²	57.8	47%	0.468	30%	0.298	S	S	.	.			trans	-68.5	148.2	169.7	30.5	-34.9	0	0	0	110.5	T889 I900	P887-T889 WeakPolarHBondContact CG-O 3.34Å; P887-T889 PolarHBondContact O-N 2.98Å; P887-I900 WeakPolarHBondContact O-CD1 3.48Å; P887-I900 VanDerWaalsContact O-CG1 3.23Å; P887-I900 WeakPolarHBondContact O-CG1 3.47Å
888	S	86.2	Confident	88.4	Confident	81 Å²	81	58.5 Å²	58.5	57%	0.566	30%	0.3	S	S	*	.	S	Bend	trans	-64.8	-3.9	178	-44.1	0	0	0	0	114.7	P899 I900	S888-P899 WeakPolarHBondContact O-CA 3.44Å; S888-I900 CarbonylContact C-O 3.56Å; S888-I900 WeakPolarHBondContact CA-O 3.13Å; S888-I900 PolarHBondContact O-N 3.15Å
889	T	88.5	Confident	88	Confident	78 Å²	78	62.9 Å²	62.9	48%	0.479	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	139.5	172.1	56.9	0	0	0	0	109.9	P887 I897 K898	P887-T889 WeakPolarHBondContact CG-O 3.34Å; P887-T889 PolarHBondContact O-N 2.98Å; T889-I897 HydrophobicContact CG2-CG2 4.16Å; T889-K898 CarbonylContact C-O 3.56Å; T889-K898 VanDerWaalsContact CA-O 3.24Å; T889-K898 WeakPolarHBondContact CA-O 3.47Å
890	Y	88.5	Confident	87.6	Confident	15 Å²	15	60.3 Å²	60.3	6%	0.059	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	158.2	171.2	82.5	-79.3	0	0	0	111.3	D522 R525 A526 T892 I897 K898 I900	D522-Y890 HydrophobicContact CB-CE1 4.14Å; D522-Y890 WeakPolarHBondContact O-CE1 3.43Å; D522-Y890 PolarHBondContact OD1-OH 2.94Å; R525-Y890 HydrophobicContact CB-CE2 3.85Å; R525-Y890 WeakPolarHBondContact CB-OH 3.41Å; R525-Y890 WeakPolarHBondContact CD-OH 3.45Å; A526-Y890 HydrophobicContact CB-CD1 3.82Å; A526-Y890 HydrophobicContact CB-CD2 4.02Å; A526-Y890 HydrophobicContact CB-CE1 4.46Å; A526-Y890 HydrophobicContact CB-CG 3.56Å; Y890-T892 HydrophobicContact CE2-CG2 4.06Å; Y890-I897 WeakPolarHBondContact O-CA 3.2Å; Y890-K898 HydrophobicContact CD1-CB 4.03Å; Y890-K898 HydrophobicContact CE1-CB 3.61Å; Y890-K898 HydrophobicContact CE1-CD 4.01Å; Y890-K898 HydrophobicContact CE1-CG 4.47Å; Y890-K898 PolarHBondContact N-O 2.98Å; Y890-K898 PolarHBondContact O-N 3.1Å; Y890-K898 WeakPolarHBondContact OH-CD 3.5Å; Y890-I900 HydrophobicContact CD1-CD1 4.48Å; Y890-I900 HydrophobicContact CD1-CG2 4Å; Y890-I900 HydrophobicContact CE1-CG2 3.99Å
891	R	86.7	Confident	87.2	Confident	162 Å²	162	66.1 Å²	66.1	61%	0.611	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.5	174.8	-178.1	175.9	-77.3	-166.2	-1.4	109.6	Q896	R891-Q896 CarbonylContact C-O 3.45Å; R891-Q896 VanDerWaalsContact CA-O 3.32Å; R891-Q896 WeakPolarHBondContact CA-O 3.13Å
892	T	84.7	Confident	86.8	Confident	16 Å²	16	67.4 Å²	67.4	10%	0.098	37%	0.367	C	S	.	.			trans	-72.9	166.7	174	74.9	0	0	0	0	111.1	Y890 D894 G895 Q896 K898	Y890-T892 HydrophobicContact CE2-CG2 4.06Å; T892-D894 VanDerWaalsContact CB-OD2 3.28Å; T892-D894 WeakPolarHBondContact CB-OD2 3.46Å; T892-D894 PolarHBondContact O-N 2.81Å; T892-D894 VanDerWaalsContact O-N 3.16Å; T892-D894 PolarHBondContact OG1-N 3.49Å; T892-D894 PolarHBondContact OG1-OD2 3.37Å; T892-G895 PolarHBondContact O-N 3.33Å; T892-Q896 HydrophobicContact CG2-CB 4.43Å; T892-Q896 PolarHBondContact N-O 2.76Å; T892-Q896 PolarHBondContact OG1-N 2.83Å; T892-K898 HydrophobicContact CG2-CD 3.82Å; T892-K898 HydrophobicContact CG2-CG 4.07Å
893	K	79.6	Confident	86.6	Confident	164 Å²	164	68 Å²	68	71%	0.713	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.1	174.9	-64.7	-159.6	174.7	-156.4	0	112.5	D432 G895	D432-K893 IonicContact OD1-NZ 3.45Å; K893-G895 VanDerWaalsContact C-N 3.27Å; K893-G895 PolarHBondContact O-N 2.98Å
894	D	82.9	Confident	86.3	Confident	131 Å²	131	73.2 Å²	73.2	70%	0.701	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	2	175.4	-20.8	-86	0	0	0	113.4	T892 Q896	T892-D894 VanDerWaalsContact CB-OD2 3.28Å; T892-D894 WeakPolarHBondContact CB-OD2 3.46Å; T892-D894 PolarHBondContact O-N 2.81Å; T892-D894 VanDerWaalsContact O-N 3.16Å; T892-D894 PolarHBondContact OG1-N 3.49Å; T892-D894 PolarHBondContact OG1-OD2 3.37Å; D894-Q896 VanDerWaalsContact C-N 3.3Å; D894-Q896 PolarHBondContact O-N 2.97Å
895	G	84	Confident	86.1	Confident	37 Å²	37	74 Å²	74	38%	0.381	41%	0.409	S	S	.	.	S	Bend	trans	82.8	-6.1	178.6	0	0	0	0	0	115.6	T892 K893	T892-G895 PolarHBondContact O-N 3.33Å; K893-G895 VanDerWaalsContact C-N 3.27Å; K893-G895 PolarHBondContact O-N 2.98Å
896	Q	86.7	Confident	85.9	Confident	126 Å²	126	73.2 Å²	73.2	59%	0.589	41%	0.407	S	S	*	.			trans	-68.1	143.3	177.1	-61	-173.6	9.7	0	0	110.9	R891 T892 D894	R891-Q896 CarbonylContact C-O 3.45Å; R891-Q896 VanDerWaalsContact CA-O 3.32Å; R891-Q896 WeakPolarHBondContact CA-O 3.13Å; T892-Q896 HydrophobicContact CG2-CB 4.43Å; T892-Q896 PolarHBondContact N-O 2.76Å; T892-Q896 PolarHBondContact OG1-N 2.83Å; D894-Q896 VanDerWaalsContact C-N 3.3Å; D894-Q896 PolarHBondContact O-N 2.97Å
897	I	87	Confident	85.7	Confident	112 Å²	112	80.4 Å²	80.4	57%	0.574	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	121.5	172.9	-58	177.5	0	0	0	108.3	T889 Y890	T889-I897 HydrophobicContact CG2-CG2 4.16Å; Y890-I897 WeakPolarHBondContact O-CA 3.2Å
898	K	88.1	Confident	85.9	Confident	64 Å²	64	80 Å²	80	28%	0.278	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	134.8	174.8	-79.9	-177	169.1	-171.2	0	110.7	D522 T889 Y890 T892	D522-K898 IonicContact OD1-NZ 2.79Å; D522-K898 PolarHBondContact OD1-NZ 3.02Å; D522-K898 IonicContact OD2-NZ 3.93Å; T889-K898 CarbonylContact C-O 3.56Å; T889-K898 VanDerWaalsContact CA-O 3.24Å; T889-K898 WeakPolarHBondContact CA-O 3.47Å; Y890-K898 HydrophobicContact CD1-CB 4.03Å; Y890-K898 HydrophobicContact CE1-CB 3.61Å; Y890-K898 HydrophobicContact CE1-CD 4.01Å; Y890-K898 HydrophobicContact CE1-CG 4.47Å; Y890-K898 PolarHBondContact N-O 2.98Å; Y890-K898 PolarHBondContact O-N 3.1Å; Y890-K898 WeakPolarHBondContact OH-CD 3.5Å; T892-K898 HydrophobicContact CG2-CD 3.82Å; T892-K898 HydrophobicContact CG2-CG 4.07Å
899	P	88.5	Confident	86.3	Confident	107 Å²	107	78.2 Å²	78.2	70%	0.695	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	147.6	168.2	32.5	-34	0	0	0	110.7	S888	S888-P899 WeakPolarHBondContact O-CA 3.44Å
900	I	87.8	Confident	86.5	Confident	15 Å²	15	74.6 Å²	74.6	8%	0.077	41%	0.406	C	S	.	.			trans	-137.4	153.9	165.2	53	169.9	0	0	0	108.6	D522 A526 L886 P887 S888 Y890 P902	D522-I900 HydrophobicContact CB-CG2 4.06Å; A526-I900 HydrophobicContact CB-CD1 3.7Å; L886-I900 HydrophobicContact CB-CD1 3.93Å; L886-I900 HydrophobicContact CD1-CD1 4.01Å; L886-I900 HydrophobicContact CG-CD1 4.44Å; P887-I900 WeakPolarHBondContact O-CD1 3.48Å; P887-I900 VanDerWaalsContact O-CG1 3.23Å; P887-I900 WeakPolarHBondContact O-CG1 3.47Å; S888-I900 CarbonylContact C-O 3.56Å; S888-I900 WeakPolarHBondContact CA-O 3.13Å; S888-I900 PolarHBondContact O-N 3.15Å; Y890-I900 HydrophobicContact CD1-CD1 4.48Å; Y890-I900 HydrophobicContact CD1-CG2 4Å; Y890-I900 HydrophobicContact CE1-CG2 3.99Å; I900-P902 WeakPolarHBondContact O-CD 3.44Å
901	T	87.6	Confident	86.9	Confident	122 Å²	122	75 Å²	75	75%	0.748	41%	0.41	S	S	*	.			trans	-109.4	95.2	176.9	-53.9	0	0	0	0	108.2	M523	M523-T901 WeakPolarHBondContact CE-O 3.32Å
902	P	86.4	Confident	87.3	Confident	34 Å²	34	71.1 Å²	71.1	22%	0.221	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-55.8	140.8	-179.7	-24.3	34	0	0	0	111.3	L886 I900	L886-P902 HydrophobicContact CB-CG 4.27Å; L886-P902 WeakPolarHBondContact O-CG 3.47Å; I900-P902 WeakPolarHBondContact O-CD 3.44Å
903	P	87.4	Confident	87.8	Confident	17 Å²	17	70.6 Å²	70.6	11%	0.11	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-68.7	159.8	176.1	30.7	-35.4	0	0	0	111.3	I518 P883 S884	I518-P903 HydrophobicContact CG2-CB 3.68Å; I518-P903 HydrophobicContact CG2-CG 4.36Å; P883-P903 HydrophobicContact CB-CG 3.84Å; S884-P903 WeakPolarHBondContact CA-O 3.49Å; S884-P903 WeakPolarHBondContact CB-O 3.46Å
904	P	84.8	Confident	88.7	Confident	113 Å²	113	63.2 Å²	63.2	73%	0.734	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-59.7	150	171.1	27.2	-35.1	0	0	0	110.8
905	P	82.7	Confident	89.3	Confident	42 Å²	42	58.3 Å²	58.3	27%	0.273	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-55.2	139.1	178	-26.6	34.9	0	0	0	113.2	Y572 E882	Y572-P905 HydrophobicContact CE2-CB 3.8Å; Y572-P905 HydrophobicContact CE2-CG 4.4Å; Y572-P905 WeakPolarHBondContact OH-CB 3.42Å; E882-P905 WeakPolarHBondContact OE1-CA 3.21Å
906	C	83.3	Confident	89.8	Confident	17 Å²	17	57.5 Å²	57.5	12%	0.115	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-73.2	134	-178.4	-174.7	0	0	0	0	111.3	K691 E882 T908 D991 I993	K691-C906 WeakPolarHBondContact CE-O 3.38Å; K691-C906 PolarHBondContact NZ-O 3.37Å; E882-C906 PolarHBondContact OE1-N 3.03Å; C906-T908 PolarHBondContact SG-N 2.91Å; C906-T908 PolarHBondContact SG-OG1 3.23Å; C906-T908 VanDerWaalsContact SG-OG1 3.39Å; C906-D991 PolarHBondContact SG-OD2 2.85Å; C906-I993 HydrophobicContact CB-CD1 4.17Å
907	L	83	Confident	90.2	Very high	164 Å²	164	57.3 Å²	57.3	86%	0.859	33%	0.326	S	S	*	.			trans	-86.3	-13.4	177.5	-59	178.7	0	0	0	113.5
908	T	90.1	Very high	90.5	Very high	63 Å²	63	54.9 Å²	54.9	39%	0.387	31%	0.314	S	S	.	.	S	Bend	trans	-97	142.5	-178.9	76.3	0	0	0	0	111.3	C906 R989 D991	C906-T908 PolarHBondContact SG-N 2.91Å; C906-T908 PolarHBondContact SG-OG1 3.23Å; C906-T908 VanDerWaalsContact SG-OG1 3.39Å; T908-R989 PolarHBondContact OG1-NH2 3.34Å; T908-D991 PolarHBondContact OG1-OD2 3.07Å
909	P	93.4	Very high	90.8	Very high	44 Å²	44	53.6 Å²	53.6	29%	0.286	31%	0.31	S	S	.	.			trans	-54.3	151.8	-179.7	-28.1	35.6	0	0	0	113.3	D692 L693 T911 R989	D692-P909 HydrophobicContact CB-CG 4.29Å; L693-P909 WeakPolarHBondContact O-CB 3.4Å; P909-T911 PolarHBondContact O-N 3.13Å; P909-R989 PolarHBondContact O-NH1 2.94Å; P909-R989 PolarHBondContact O-NH2 3.42Å
910	V	94.6	Very high	91	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.012	30%	0.3	C	S	.	.	S	Bend	trans	-71.8	-18.5	177	-48.3	0	0	0	0	111.7	L693 F696 W880 V913 R989 I993 Y995	L693-V910 WeakPolarHBondContact O-CG2 3.39Å; L693-V910 PolarHBondContact O-N 3.3Å; F696-V910 HydrophobicContact CE1-CG2 4.15Å; F696-V910 HydrophobicContact CZ-CG2 3.77Å; W880-V910 HydrophobicContact CD2-CB 4.3Å; W880-V910 HydrophobicContact CD2-CG1 4.49Å; W880-V910 HydrophobicContact CD2-CG2 3.74Å; W880-V910 HydrophobicContact CE3-CG2 4.03Å; W880-V910 HydrophobicContact CG-CB 4.17Å; W880-V910 HydrophobicContact CG-CG1 4.22Å; W880-V910 HydrophobicContact CG-CG2 4.15Å; W880-V910 HydrophobicContact CH2-CG2 4.44Å; W880-V910 HydrophobicContact CZ2-CG2 4.18Å; W880-V910 HydrophobicContact CZ3-CG2 4.37Å; V910-V913 HydrophobicContact CG2-CG2 4.08Å; V910-V913 WeakPolarHBondContact O-CG2 3.45Å; V910-R989 PolarHBondContact O-NH1 3.01Å; V910-I993 HydrophobicContact CG1-CD1 4.11Å; V910-Y995 PolarHBondContact O-OH 2.73Å
911	T	94.9	Very high	91.2	Very high	24 Å²	24	57.7 Å²	57.7	15%	0.147	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-88.8	150.8	178.4	65.4	0	0	0	0	113.1	G694 Q695 F696 P909 V913	G694-T911 VanDerWaalsContact CA-OG1 3.3Å; G694-T911 WeakPolarHBondContact CA-OG1 3.39Å; Q695-T911 PolarHBondContact N-OG1 3.47Å; Q695-T911 VanDerWaalsContact N-OG1 3.07Å; F696-T911 HydrophobicContact CD1-CG2 3.73Å; F696-T911 HydrophobicContact CD2-CG2 4.2Å; F696-T911 HydrophobicContact CE1-CG2 3.45Å; F696-T911 VanDerWaalsContact CE1-CG2 3.45Å; F696-T911 HydrophobicContact CE2-CG2 3.94Å; F696-T911 HydrophobicContact CG-CG2 4.11Å; F696-T911 HydrophobicContact CZ-CG2 3.57Å; P909-T911 PolarHBondContact O-N 3.13Å; T911-V913 HydrophobicContact CG2-CG2 4.25Å
912	P	95.3	Very high	91.2	Very high	79 Å²	79	54.1 Å²	54.1	51%	0.513	30%	0.295	S	S	.	.	S	Bend	cis	-66.3	129.5	-3.1	-22.3	35.6	0	0	0	112.2	N936	P912-N936 HydrophobicContact CB-CB 3.76Å
913	V	97	Very high	90.9	Very high	5 Å²	5	55.6 Å²	55.6	3%	0.03	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-84.8	123.8	177.3	172.7	0	0	0	0	107.9	F696 Y878 W880 V910 T911 N936 Y995	F696-V913 HydrophobicContact CE1-CG2 3.96Å; Y878-V913 HydrophobicContact CD1-CB 3.72Å; Y878-V913 HydrophobicContact CD1-CG1 3.82Å; Y878-V913 HydrophobicContact CD1-CG2 4.36Å; Y878-V913 HydrophobicContact CE1-CB 4.32Å; W880-V913 HydrophobicContact CE3-CG2 4.36Å; V910-V913 HydrophobicContact CG2-CG2 4.08Å; V910-V913 WeakPolarHBondContact O-CG2 3.45Å; T911-V913 HydrophobicContact CG2-CG2 4.25Å; V913-N936 WeakPolarHBondContact O-CB 3.46Å; V913-N936 PolarHBondContact O-ND2 2.89Å; V913-Y995 HydrophobicContact CB-CE1 4.37Å; V913-Y995 HydrophobicContact CG1-CD1 3.87Å; V913-Y995 HydrophobicContact CG1-CE1 4.12Å; V913-Y995 HydrophobicContact CG2-CE1 4.01Å
914	P	97.3	Very high	90.3	Very high	10 Å²	10	56.8 Å²	56.8	7%	0.065	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-67.6	136.8	176.7	29.9	-34.8	0	0	0	110.7	E935 F937 L987 Y995	P914-E935 WeakPolarHBondContact CA-O 3.4Å; P914-F937 HydrophobicContact CB-CD1 3.72Å; P914-F937 HydrophobicContact CB-CE1 4Å; P914-L987 HydrophobicContact CB-CD1 3.69Å; P914-L987 HydrophobicContact CG-CB 4.2Å; P914-L987 HydrophobicContact CG-CD1 3.94Å; P914-Y995 VanDerWaalsContact CD-CD2 3.44Å; P914-Y995 VanDerWaalsContact CD-CE2 3.46Å; P914-Y995 HydrophobicContact CG-CD1 4.41Å; P914-Y995 HydrophobicContact CG-CD2 3.31Å; P914-Y995 HydrophobicContact CG-CE2 3.77Å; P914-Y995 HydrophobicContact CG-CG 3.66Å
915	I	95.4	Very high	89.8	Confident	27 Å²	27	53 Å²	53	14%	0.138	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.1	176.9	-52.9	176.7	0	0	0	107.7	Y878 G934 E935	Y878-I915 HydrophobicContact CD1-CD1 4.42Å; Y878-I915 HydrophobicContact CD1-CG1 4.49Å; Y878-I915 HydrophobicContact CE1-CD1 3.83Å; Y878-I915 HydrophobicContact CE1-CG1 4.26Å; I915-G934 CarbonylContact O-C 3.59Å; I915-G934 WeakPolarHBondContact O-CA 3.29Å; I915-E935 HydrophobicContact CB-CB 4.32Å; I915-E935 PolarHBondContact N-O 3.12Å; I915-E935 PolarHBondContact O-N 2.7Å
916	V	95.8	Very high	89.3	Confident	21 Å²	21	53 Å²	53	13%	0.127	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	136.2	169.7	-173.5	0	0	0	0	109.1	M919 I932 F937 L987 L999	V916-M919 HydrophobicContact CG1-CG 3.93Å; V916-M919 HydrophobicContact CG1-SD 4.28Å; V916-I932 HydrophobicContact CB-CG2 4.32Å; V916-I932 HydrophobicContact CG1-CG2 3.59Å; V916-I932 HydrophobicContact CG2-CG2 3.78Å; V916-F937 HydrophobicContact CG2-CE1 4.39Å; V916-F937 HydrophobicContact CG2-CZ 4.32Å; V916-L987 HydrophobicContact CG2-CD1 3.88Å; V916-L999 HydrophobicContact CB-CD1 4.28Å; V916-L999 HydrophobicContact CG1-CD1 3.6Å
917	R	93.2	Very high	89.3	Confident	122 Å²	122	53.5 Å²	53.5	46%	0.46	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-37.6	178.7	-73.2	-171.7	-82.8	180	-9.9	112.6	I933 G934 E935 E958	R917-I933 PolarHBondContact N-O 3.19Å; R917-G934 PolarHBondContact NE-O 2.83Å; R917-G934 PolarHBondContact NH2-O 2.88Å; R917-E935 VanDerWaalsContact CD-OE1 3.32Å; R917-E935 WeakPolarHBondContact CD-OE1 3.44Å; R917-E935 IonicContact CZ-OE1 2.9Å; R917-E935 IonicContact NE-OE1 2.72Å; R917-E935 PolarHBondContact NE-OE1 2.91Å; R917-E958 IonicContact CZ-OE1 3.25Å; R917-E958 IonicContact NH1-OE1 3.28Å; R917-E958 IonicContact NH2-OE1 2.84Å; R917-E958 PolarHBondContact NH2-OE1 3.46Å
918	D	93.5	Very high	89.5	Confident	60 Å²	60	46.4 Å²	46.4	32%	0.321	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	156.4	-175.8	-175.2	20.5	0	0	0	109.7	R920 I933	D918-R920 IonicContact OD2-CZ 2.67Å; D918-R920 IonicContact OD2-NE 3.68Å; D918-R920 PolarHBondContact OD2-NE 2.95Å; D918-R920 IonicContact OD2-NH2 2.63Å; D918-R920 PolarHBondContact OD2-NH2 2.85Å; D918-I933 HydrophobicContact CB-CB 4.2Å; D918-I933 HydrophobicContact CB-CD1 4.41Å; D918-I933 PolarHBondContact N-O 2.9Å; D918-I933 VanDerWaalsContact N-O 3.15Å; D918-I933 PolarHBondContact O-N 2.72Å
919	M	94.3	Very high	89.7	Confident	38 Å²	38	44 Å²	44	19%	0.187	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	130.3	-177.9	-81.4	175.2	39.7	0	0	110.7	V916 L930 E931 I932 I985 L999	V916-M919 HydrophobicContact CG1-CG 3.93Å; V916-M919 HydrophobicContact CG1-SD 4.28Å; M919-L930 HydrophobicContact CB-CD1 4.37Å; M919-L930 HydrophobicContact CE-CD1 3.98Å; M919-L930 HydrophobicContact CE-CD2 4Å; M919-E931 CarbonylContact C-O 3.54Å; M919-E931 WeakPolarHBondContact CA-O 3.45Å; M919-I932 HydrophobicContact CG-CG1 4.27Å; M919-I932 HydrophobicContact CG-CG2 4.26Å; M919-I985 HydrophobicContact CE-CB 4.39Å; M919-I985 HydrophobicContact CE-CG1 3.76Å; M919-I985 HydrophobicContact SD-CB 4.42Å; M919-I985 HydrophobicContact SD-CG1 4.42Å; M919-I985 HydrophobicContact SD-CG2 4.2Å; M919-L999 HydrophobicContact CE-CB 4.48Å; M919-L999 HydrophobicContact CG-CD1 3.96Å; M919-L999 HydrophobicContact SD-CB 3.68Å; M919-L999 HydrophobicContact SD-CD1 3.52Å; M919-L999 VanDerWaalsContact SD-CD1 3.52Å; M919-L999 HydrophobicContact SD-CG 4.26Å
920	R	93.5	Very high	89.8	Confident	127 Å²	127	41.9 Å²	41.9	48%	0.479	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	143.5	-172.9	-55.8	179.6	-175	177.4	1.4	111	D918 E931 I933	D918-R920 IonicContact OD2-CZ 2.67Å; D918-R920 IonicContact OD2-NE 3.68Å; D918-R920 PolarHBondContact OD2-NE 2.95Å; D918-R920 IonicContact OD2-NH2 2.63Å; D918-R920 PolarHBondContact OD2-NH2 2.85Å; R920-E931 HydrophobicContact CB-CB 4.29Å; R920-E931 PolarHBondContact N-O 3.14Å; R920-E931 PolarHBondContact O-N 3.1Å; R920-I933 HydrophobicContact CG-CD1 4.48Å
921	V	91.8	Very high	89.8	Confident	81 Å²	81	43.6 Å²	43.6	49%	0.491	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.6	179.1	-170.4	0	0	0	0	109	L930 F1001	V921-L930 HydrophobicContact CG2-CD1 4.23Å; V921-F1001 HydrophobicContact CG2-CD2 4.49Å; V921-F1001 HydrophobicContact CG2-CE2 3.76Å
922	N	87.5	Confident	89.9	Confident	46 Å²	46	42.5 Å²	42.5	25%	0.246	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.7	-179.5	-66.8	-29.6	0	0	0	109.5	M929 E931	N922-M929 PolarHBondContact N-O 3.17Å; N922-M929 PolarHBondContact O-N 2.74Å; N922-E931 PolarHBondContact ND2-OE2 3.31Å
923	G	80.1	Confident	90	Very high	65 Å²	65	40.3 Å²	40.3	67%	0.67	24%	0.235	S	C	*	.	S	Bend	trans	76.5	-158.1	-174.4	0	0	0	0	0	113.1
924	G	75.4	Confident	89.9	Confident	43 Å²	43	40.1 Å²	40.1	44%	0.443	23%	0.233	S	C	.	.			trans	-179.1	167.6	-178.2	0	0	0	0	0	112.7	V927	G924-V927 PolarHBondContact O-N 2.91Å
925	G	73.9	Confident	89.8	Confident	32 Å²	32	41.7 Å²	41.7	33%	0.33	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	61.8	-143.7	-168.7	0	0	0	0	0	110.9	V927 A928	G925-V927 PolarHBondContact O-N 2.95Å; G925-A928 WeakPolarHBondContact O-CB 3.34Å; G925-A928 PolarHBondContact O-N 3.37Å; G925-A928 VanDerWaalsContact O-N 3.16Å
926	D	73.2	Confident	89.8	Confident	42 Å²	42	42.9 Å²	42.9	23%	0.225	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-57.3	-21.3	-179	-42	-55.5	0	0	0	113.7	H1012 C1013 L1017 I1020	D926-H1012 IonicContact OD1-CE1 3.87Å; D926-H1012 IonicContact OD1-CG 3.71Å; D926-H1012 IonicContact OD1-ND1 2.94Å; D926-H1012 PolarHBondContact OD1-ND1 2.96Å; D926-H1012 VanDerWaalsContact OD2-CA 3.29Å; D926-H1012 WeakPolarHBondContact OD2-CA 3.14Å; D926-H1012 IonicContact OD2-ND1 3.36Å; D926-C1013 PolarHBondContact OD2-N 2.97Å; D926-L1017 HydrophobicContact CB-CD2 3.94Å; D926-L1017 HydrophobicContact CB-CG 4.47Å; D926-I1020 WeakPolarHBondContact O-CD1 3.39Å
927	V	81.3	Confident	89.9	Confident	29 Å²	29	42 Å²	42	18%	0.176	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-98.1	9.1	-173	-141.9	0	0	0	0	112.8	F121 I125 G924 G925 M929 A1016	F121-V927 HydrophobicContact CE1-CG1 3.88Å; F121-V927 HydrophobicContact CE2-CG1 4.3Å; F121-V927 HydrophobicContact CZ-CG1 3.42Å; F121-V927 VanDerWaalsContact CZ-CG1 3.42Å; I125-V927 HydrophobicContact CD1-CG1 4.25Å; G924-V927 PolarHBondContact O-N 2.91Å; G925-V927 PolarHBondContact O-N 2.95Å; V927-M929 PolarHBondContact O-N 2.67Å; V927-A1016 HydrophobicContact CG1-CB 4.35Å; V927-A1016 HydrophobicContact CG2-CB 3.63Å
928	A	89.2	Confident	90	Very high	15 Å²	15	37.3 Å²	37.3	12%	0.124	23%	0.227	C	C	.	.			trans	-62.5	116.2	-178.2	0	0	0	0	0	111.4	G925 V964	G925-A928 WeakPolarHBondContact O-CB 3.34Å; G925-A928 PolarHBondContact O-N 3.37Å; G925-A928 VanDerWaalsContact O-N 3.16Å; A928-V964 HydrophobicContact CB-CB 4.02Å; A928-V964 HydrophobicContact CB-CG2 4.03Å; A928-V964 PolarHBondContact O-N 3.41Å
929	M	93.1	Very high	90	Very high	11 Å²	11	38.6 Å²	38.6	5%	0.054	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	137.3	172.1	-68.7	-166.3	-59.8	0	0	110.4	F121 Y122 N922 V927 C962 F963	F121-M929 HydrophobicContact CD1-CE 3.93Å; F121-M929 HydrophobicContact CD1-SD 4.26Å; F121-M929 HydrophobicContact CE1-CE 3.71Å; F121-M929 HydrophobicContact CE1-CG 4.44Å; F121-M929 HydrophobicContact CE1-SD 3.74Å; Y122-M929 HydrophobicContact CE2-CE 4.5Å; N922-M929 PolarHBondContact N-O 3.17Å; N922-M929 PolarHBondContact O-N 2.74Å; V927-M929 PolarHBondContact O-N 2.67Å; M929-C962 CarbonylContact C-O 3.46Å; M929-C962 VanDerWaalsContact CA-O 3.3Å; M929-C962 WeakPolarHBondContact CA-O 3.28Å; M929-F963 HydrophobicContact CG-CD1 3.68Å; M929-F963 HydrophobicContact CG-CE1 3.67Å; M929-F963 HydrophobicContact SD-CD1 4.48Å; M929-F963 HydrophobicContact SD-CE1 3.99Å
930	L	95	Very high	89.9	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	116.9	170.7	178.7	72.2	0	0	0	109.1	M919 V921 I932 F945 L961 C962 V964 I985 F1001	M919-L930 HydrophobicContact CB-CD1 4.37Å; M919-L930 HydrophobicContact CE-CD1 3.98Å; M919-L930 HydrophobicContact CE-CD2 4Å; V921-L930 HydrophobicContact CG2-CD1 4.23Å; L930-I932 HydrophobicContact CD2-CD1 3.93Å; L930-I932 HydrophobicContact CD2-CG1 4.04Å; L930-I932 HydrophobicContact CG-CD1 4.4Å; L930-I932 HydrophobicContact CG-CG1 3.97Å; L930-F945 HydrophobicContact CB-CZ 4.08Å; L930-F945 HydrophobicContact CD2-CE1 3.99Å; L930-F945 HydrophobicContact CD2-CE2 4.16Å; L930-F945 HydrophobicContact CD2-CZ 3.44Å; L930-F945 VanDerWaalsContact CD2-CZ 3.44Å; L930-F945 HydrophobicContact CG-CZ 4.39Å; L930-L961 CarbonylContact O-C 3.55Å; L930-L961 WeakPolarHBondContact O-CA 3.4Å; L930-C962 PolarHBondContact N-O 3.17Å; L930-C962 PolarHBondContact O-N 3.48Å; L930-V964 HydrophobicContact CB-CG2 4.04Å; L930-I985 HydrophobicContact CD2-CD1 4.16Å; L930-F1001 HydrophobicContact CD1-CD2 4.11Å; L930-F1001 HydrophobicContact CD1-CE2 4.38Å
931	E	95.6	Very high	90	Very high	38 Å²	38	36.1 Å²	36.1	18%	0.178	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	123.4	170.9	-179.5	-177.2	165	0	0	109.1	M919 R920 N922 I933 L959 L961	M919-E931 CarbonylContact C-O 3.54Å; M919-E931 WeakPolarHBondContact CA-O 3.45Å; R920-E931 HydrophobicContact CB-CB 4.29Å; R920-E931 PolarHBondContact N-O 3.14Å; R920-E931 PolarHBondContact O-N 3.1Å; N922-E931 PolarHBondContact ND2-OE2 3.31Å; E931-I933 HydrophobicContact CG-CG1 4.23Å; E931-L959 HydrophobicContact CG-CD1 3.61Å; E931-L961 HydrophobicContact CB-CD2 3.82Å; E931-L961 HydrophobicContact CG-CD2 3.76Å
932	I	96.4	Very high	90.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.7	-179	-53.4	-171.8	0	0	0	107.9	V916 M919 L930 F937 V943 I960 I985	V916-I932 HydrophobicContact CB-CG2 4.32Å; V916-I932 HydrophobicContact CG1-CG2 3.59Å; V916-I932 HydrophobicContact CG2-CG2 3.78Å; M919-I932 HydrophobicContact CG-CG1 4.27Å; M919-I932 HydrophobicContact CG-CG2 4.26Å; L930-I932 HydrophobicContact CD2-CD1 3.93Å; L930-I932 HydrophobicContact CD2-CG1 4.04Å; L930-I932 HydrophobicContact CG-CD1 4.4Å; L930-I932 HydrophobicContact CG-CG1 3.97Å; I932-F937 HydrophobicContact CG2-CE2 4.29Å; I932-F937 HydrophobicContact CG2-CZ 3.86Å; I932-F937 WeakPolarHBondContact O-CE2 3.49Å; I932-V943 HydrophobicContact CD1-CB 4.4Å; I932-V943 HydrophobicContact CD1-CG1 3.8Å; I932-V943 HydrophobicContact CD1-CG2 3.62Å; I932-I960 PolarHBondContact N-O 2.85Å; I932-I960 PolarHBondContact O-N 2.87Å; I932-I985 HydrophobicContact CD1-CG2 4.34Å
933	I	96.8	Very high	90.6	Very high	34 Å²	34	31.4 Å²	31.4	17%	0.174	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.2	-176	-56.8	169.8	0	0	0	108.2	R917 D918 R920 E931 E958 L959	R917-I933 PolarHBondContact N-O 3.19Å; D918-I933 HydrophobicContact CB-CB 4.2Å; D918-I933 HydrophobicContact CB-CD1 4.41Å; D918-I933 PolarHBondContact N-O 2.9Å; D918-I933 VanDerWaalsContact N-O 3.15Å; D918-I933 PolarHBondContact O-N 2.72Å; R920-I933 HydrophobicContact CG-CD1 4.48Å; E931-I933 HydrophobicContact CG-CG1 4.23Å; I933-E958 WeakPolarHBondContact CA-O 3.43Å; I933-L959 HydrophobicContact CG1-CD1 3.97Å
934	G	95.8	Very high	91.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	-152.3	-168.4	0	0	0	0	0	115.5	I915 R917 F937 E958	I915-G934 CarbonylContact O-C 3.59Å; I915-G934 WeakPolarHBondContact O-CA 3.29Å; R917-G934 PolarHBondContact NE-O 2.83Å; R917-G934 PolarHBondContact NH2-O 2.88Å; G934-F937 VanDerWaalsContact CA-CZ 3.45Å; G934-E958 PolarHBondContact N-O 3.2Å; G934-E958 VanDerWaalsContact O-CA 3.27Å; G934-E958 WeakPolarHBondContact O-CA 3.42Å; G934-E958 WeakPolarHBondContact O-CB 3.45Å
935	E	95.1	Very high	92.5	Very high	44 Å²	44	26.3 Å²	26.3	21%	0.206	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	152.6	179.8	-65	163.9	-128.6	0	0	109.4	R699 P914 I915 R917 F937 E957	R699-E935 IonicContact CZ-OE1 3.46Å; R699-E935 IonicContact NH1-OE1 3.22Å; R699-E935 PolarHBondContact NH1-OE1 2.95Å; R699-E935 IonicContact NH1-OE2 2.7Å; R699-E935 PolarHBondContact NH1-OE2 2.64Å; R699-E935 IonicContact NH2-OE1 3.69Å; R699-E935 PolarHBondContact NH2-OE1 3.06Å; P914-E935 WeakPolarHBondContact CA-O 3.4Å; I915-E935 HydrophobicContact CB-CB 4.32Å; I915-E935 PolarHBondContact N-O 3.12Å; I915-E935 PolarHBondContact O-N 2.7Å; R917-E935 VanDerWaalsContact CD-OE1 3.32Å; R917-E935 WeakPolarHBondContact CD-OE1 3.44Å; R917-E935 IonicContact CZ-OE1 2.9Å; R917-E935 IonicContact NE-OE1 2.72Å; R917-E935 PolarHBondContact NE-OE1 2.91Å; E935-F937 VanDerWaalsContact C-N 3.28Å; E935-F937 PolarHBondContact O-N 2.94Å; E935-E957 CarbonylContact C-O 3.55Å
936	N	96.1	Very high	93.5	Very high	51 Å²	51	25 Å²	25	27%	0.273	13%	0.132	S	C	.	.	S	Bend	trans	59.1	28.3	176.5	-50.1	-43.6	0	0	0	115.3	P912 V913 E957	P912-N936 HydrophobicContact CB-CB 3.76Å; V913-N936 WeakPolarHBondContact O-CB 3.46Å; V913-N936 PolarHBondContact O-ND2 2.89Å; N936-E957 PolarHBondContact N-O 2.93Å; N936-E957 VanDerWaalsContact N-O 3.09Å
937	F	97	Very high	94.5	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.018	13%	0.127	C	C	.	.			trans	-69.2	157.2	172.4	-63.6	-18.6	0	0	0	111.8	P914 V916 I932 G934 E935 Y954 E957 I960 L987	P914-F937 HydrophobicContact CB-CD1 3.72Å; P914-F937 HydrophobicContact CB-CE1 4Å; V916-F937 HydrophobicContact CG2-CE1 4.39Å; V916-F937 HydrophobicContact CG2-CZ 4.32Å; I932-F937 HydrophobicContact CG2-CE2 4.29Å; I932-F937 HydrophobicContact CG2-CZ 3.86Å; I932-F937 WeakPolarHBondContact O-CE2 3.49Å; G934-F937 VanDerWaalsContact CA-CZ 3.45Å; E935-F937 VanDerWaalsContact C-N 3.28Å; E935-F937 PolarHBondContact O-N 2.94Å; F937-Y954 HydrophobicContact CB-CD2 4.47Å; F937-Y954 HydrophobicContact CB-CE2 4.27Å; F937-E957 WeakPolarHBondContact CB-O 3.25Å; F937-E957 PolarHBondContact N-O 2.8Å; F937-I960 HydrophobicContact CB-CD1 3.71Å; F937-I960 HydrophobicContact CB-CG1 3.93Å; F937-I960 HydrophobicContact CD1-CD1 4.22Å; F937-I960 HydrophobicContact CD2-CB 4.17Å; F937-I960 HydrophobicContact CD2-CD1 4.05Å; F937-I960 HydrophobicContact CD2-CG1 3.78Å; F937-I960 HydrophobicContact CE2-CB 4.46Å; F937-I960 HydrophobicContact CG-CD1 3.74Å; F937-I960 HydrophobicContact CG-CG1 3.96Å; F937-L987 HydrophobicContact CD1-CD1 4.09Å; F937-L987 HydrophobicContact CE1-CD1 3.62Å; F937-L987 HydrophobicContact CZ-CD1 4.45Å
938	S	94.7	Very high	95.2	Very high	23 Å²	23	22.7 Å²	22.7	16%	0.161	12%	0.119	C	C	.	.			trans	-154.3	160.8	-179.8	81.2	0	0	0	0	111.1	R940 H941 Y954	S938-R940 PolarHBondContact O-N 3.05Å; S938-R940 PolarHBondContact OG-N 3.15Å; S938-H941 PolarHBondContact N-ND1 3.24Å; S938-H941 PolarHBondContact O-N 3.13Å; S938-H941 VanDerWaalsContact O-N 3.16Å; S938-H941 PolarHBondContact OG-CE1 2.9Å; S938-H941 PolarHBondContact OG-ND1 2.99Å; S938-Y954 VanDerWaalsContact CA-CE2 3.46Å
939	P	94.6	Very high	95.5	Very high	86 Å²	86	22.3 Å²	22.3	56%	0.558	12%	0.115	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-11.1	172.8	-23.4	33.3	0	0	0	115.1	Y954	P939-Y954 HydrophobicContact CG-CD1 3.7Å; P939-Y954 HydrophobicContact CG-CD2 4.47Å; P939-Y954 HydrophobicContact CG-CE1 3.93Å; P939-Y954 HydrophobicContact CG-CG 3.97Å
940	R	92.7	Very high	95.5	Very high	102 Å²	102	21.9 Å²	21.9	39%	0.385	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	2.2	178.3	-56.6	-171	-60	144.1	0.9	113.6	S938 R989 Q990	S938-R940 PolarHBondContact O-N 3.05Å; S938-R940 PolarHBondContact OG-N 3.15Å; R940-R989 HydrophobicContact CB-CG 4.32Å; R940-R989 CarbonylContact O-C 3.42Å; R940-R989 WeakPolarHBondContact O-CA 3.4Å; R940-Q990 HydrophobicContact CB-CB 4.4Å; R940-Q990 PolarHBondContact O-N 3.41Å
941	H	95.1	Very high	95.4	Very high	11 Å²	11	23.2 Å²	23.2	5%	0.051	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.5	-179.5	-60.9	145.6	0	0	0	111.2	S938 T952 I960 V988 Y995	S938-H941 PolarHBondContact N-ND1 3.24Å; S938-H941 PolarHBondContact O-N 3.13Å; S938-H941 VanDerWaalsContact O-N 3.16Å; S938-H941 PolarHBondContact OG-CE1 2.9Å; S938-H941 PolarHBondContact OG-ND1 2.99Å; H941-T952 WeakPolarHBondContact O-CG2 3.18Å; H941-I960 HydrophobicContact CB-CD1 4.18Å; H941-V988 CarbonylContact C-O 3.18Å; H941-V988 WeakPolarHBondContact CA-O 3.41Å; H941-Y995 AromaticContact NE2-CE2 3.73Å
942	Q	95.9	Very high	95.3	Very high	28 Å²	28	23 Å²	23	13%	0.131	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	136.9	169.2	-177	170.1	35.7	0	0	109.4	S515 A950 V988	S515-Q942 PolarHBondContact OG-OE1 3.21Å; S515-Q942 VanDerWaalsContact OG-OE1 3.06Å; Q942-A950 WeakPolarHBondContact CG-O 3.44Å; Q942-A950 PolarHBondContact NE2-O 3.41Å; Q942-A950 VanDerWaalsContact NE2-O 3.09Å; Q942-V988 PolarHBondContact N-O 2.86Å; Q942-V988 PolarHBondContact O-N 2.85Å
943	V	96.8	Very high	95.2	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	134.4	170	-175.6	0	0	0	0	109.2	I932 F945 A950 T952 I960 C962 I985 L987	I932-V943 HydrophobicContact CD1-CB 4.4Å; I932-V943 HydrophobicContact CD1-CG1 3.8Å; I932-V943 HydrophobicContact CD1-CG2 3.62Å; V943-F945 HydrophobicContact CG1-CD2 4.1Å; V943-F945 HydrophobicContact CG1-CE2 3.84Å; V943-A950 HydrophobicContact CB-CB 4.47Å; V943-A950 WeakPolarHBondContact O-CB 3.44Å; V943-A950 PolarHBondContact O-N 3.1Å; V943-T952 HydrophobicContact CG2-CG2 3.88Å; V943-T952 PolarHBondContact N-OG1 2.91Å; V943-I960 HydrophobicContact CG2-CG2 3.82Å; V943-C962 HydrophobicContact CB-CB 4.06Å; V943-C962 HydrophobicContact CG2-CB 3.99Å; V943-I985 HydrophobicContact CG1-CG2 4.25Å; V943-L987 HydrophobicContact CG2-CD2 3.81Å
944	W	97.4	Very high	95.1	Very high	1 Å²	1	25.9 Å²	25.9	0%	0.004	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.3	172.2	-75.7	59.7	0	0	0	109.9	L519 R521 M524 D947 V948 P949 S986 V988	L519-W944 HydrophobicContact CB-CZ2 4.38Å; L519-W944 HydrophobicContact CD2-CH2 4.2Å; L519-W944 HydrophobicContact CD2-CZ2 4.08Å; L519-W944 HydrophobicContact CG-CH2 4.37Å; L519-W944 HydrophobicContact CG-CZ2 4.43Å; L519-W944 WeakPolarHBondContact O-CH2 3.24Å; R521-W944 HydrophobicContact CG-CZ3 4.28Å; M524-W944 HydrophobicContact CB-CE3 4.03Å; M524-W944 HydrophobicContact CB-CH2 4.39Å; M524-W944 HydrophobicContact CB-CZ3 3.64Å; M524-W944 HydrophobicContact CE-CB 4.26Å; M524-W944 HydrophobicContact CG-CE3 3.69Å; M524-W944 HydrophobicContact CG-CZ3 3.86Å; W944-D947 WeakPolarHBondContact CZ3-O 3.37Å; W944-V948 CarbonylContact C-O 3.57Å; W944-V948 VanDerWaalsContact CA-O 3.32Å; W944-V948 WeakPolarHBondContact CA-O 3.44Å; W944-P949 HydrophobicContact CD2-CB 3.95Å; W944-P949 HydrophobicContact CE3-CB 4.32Å; W944-P949 HydrophobicContact CG-CB 4.49Å; W944-P949 HydrophobicContact CH2-CB 4.27Å; W944-P949 HydrophobicContact CH2-CG 4.27Å; W944-P949 HydrophobicContact CZ2-CB 3.85Å; W944-P949 HydrophobicContact CZ2-CG 4.31Å; W944-P949 HydrophobicContact CZ3-CB 4.47Å; W944-P949 HydrophobicContact CZ3-CG 4.42Å; W944-S986 PolarHBondContact N-O 2.85Å; W944-S986 PolarHBondContact O-N 3.39Å; W944-V988 HydrophobicContact CB-CG2 4.29Å; W944-V988 HydrophobicContact CD2-CG2 4.12Å; W944-V988 HydrophobicContact CG-CB 4.37Å; W944-V988 HydrophobicContact CG-CG2 3.69Å
945	F	96.9	Very high	95	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	95.9	171.6	-70.7	-117.4	0	0	0	106.7	L930 V943 D947 V948 A950 V964 P965 F970 V983 I985 F1001	L930-F945 HydrophobicContact CB-CZ 4.08Å; L930-F945 HydrophobicContact CD2-CE1 3.99Å; L930-F945 HydrophobicContact CD2-CE2 4.16Å; L930-F945 HydrophobicContact CD2-CZ 3.44Å; L930-F945 VanDerWaalsContact CD2-CZ 3.44Å; L930-F945 HydrophobicContact CG-CZ 4.39Å; V943-F945 HydrophobicContact CG1-CD2 4.1Å; V943-F945 HydrophobicContact CG1-CE2 3.84Å; F945-D947 PolarHBondContact O-N 2.96Å; F945-V948 PolarHBondContact N-O 2.66Å; F945-V948 WeakPolarHBondContact O-CB 3.47Å; F945-V948 PolarHBondContact O-N 3.07Å; F945-A950 HydrophobicContact CD2-CB 3.76Å; F945-A950 HydrophobicContact CE2-CB 3.7Å; F945-V964 HydrophobicContact CE1-CB 4.48Å; F945-V964 HydrophobicContact CE1-CG1 4.19Å; F945-V964 HydrophobicContact CE1-CG2 4.31Å; F945-V964 HydrophobicContact CZ-CB 4.46Å; F945-V964 HydrophobicContact CZ-CG2 4.19Å; F945-P965 HydrophobicContact CB-CG 4.17Å; F945-P965 HydrophobicContact CD2-CG 3.84Å; F945-P965 HydrophobicContact CE2-CG 4.31Å; F945-P965 HydrophobicContact CG-CG 3.96Å; F945-F970 HydrophobicContact CB-CE1 4.47Å; F945-F970 HydrophobicContact CB-CZ 3.88Å; F945-F970 WeakPolarHBondContact O-CE1 3.31Å; F945-V983 HydrophobicContact CB-CG1 3.91Å; F945-I985 HydrophobicContact CB-CD1 4.33Å; F945-I985 HydrophobicContact CD1-CD1 3.51Å; F945-I985 HydrophobicContact CD2-CD1 4.03Å; F945-I985 HydrophobicContact CE1-CD1 3.77Å; F945-I985 HydrophobicContact CE2-CD1 4.25Å; F945-I985 HydrophobicContact CG-CD1 3.66Å; F945-I985 HydrophobicContact CZ-CD1 4.13Å; F945-F1001 HydrophobicContact CD1-CB 4.23Å; F945-F1001 HydrophobicContact CD1-CD1 4.19Å; F945-F1001 HydrophobicContact CD1-CG 4.18Å; F945-F1001 HydrophobicContact CE1-CB 4.15Å; F945-F1001 HydrophobicContact CE1-CD1 4Å; F945-F1001 HydrophobicContact CE1-CD2 4.05Å; F945-F1001 HydrophobicContact CE1-CE1 4.45Å; F945-F1001 HydrophobicContact CE1-CE2 4.46Å; F945-F1001 AromaticContact CE1-CG 3.79Å; F945-F1001 HydrophobicContact CE1-CG 3.79Å
946	G	95.6	Very high	95.1	Very high	4 Å²	4	29.7 Å²	29.7	4%	0.041	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	-121.1	-173.3	0	0	0	0	0	110.7	M524 L528 V983 P984	M524-G946 WeakPolarHBondContact CE-O 3.39Å; M524-G946 VanDerWaalsContact CG-O 3.3Å; M524-G946 WeakPolarHBondContact CG-O 3.42Å; L528-G946 VanDerWaalsContact CD1-C 3.42Å; G946-V983 VanDerWaalsContact N-CG1 3.27Å; G946-P984 PolarHBondContact N-O 2.88Å
947	D	94.3	Very high	95.1	Very high	24 Å²	24	33.4 Å²	33.4	13%	0.128	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	6.1	176.3	85.2	-44.9	0	0	0	113.9	R521 M524 R525 L528 W944 F945	R521-D947 WeakPolarHBondContact CD-O 3.41Å; R521-D947 WeakPolarHBondContact CG-O 3.18Å; R521-D947 IonicContact CZ-OD1 3.66Å; R521-D947 IonicContact CZ-OD2 3.22Å; R521-D947 PolarHBondContact NE-O 2.97Å; R521-D947 IonicContact NE-OD2 3.43Å; R521-D947 PolarHBondContact NE-OD2 3.12Å; R521-D947 VanDerWaalsContact NE-OD2 3.11Å; R521-D947 IonicContact NH2-OD1 3.09Å; R521-D947 PolarHBondContact NH2-OD1 2.83Å; R521-D947 IonicContact NH2-OD2 2.68Å; R521-D947 PolarHBondContact NH2-OD2 3.1Å; M524-D947 HydrophobicContact CG-CB 4.49Å; R525-D947 HydrophobicContact CG-CB 3.76Å; R525-D947 IonicContact CZ-OD2 3.92Å; R525-D947 IonicContact NE-OD2 2.83Å; R525-D947 PolarHBondContact NE-OD2 2.86Å; R525-D947 IonicContact NH2-OD2 2.85Å; R525-D947 PolarHBondContact NH2-OD2 2.84Å; L528-D947 HydrophobicContact CD1-CB 4.45Å; W944-D947 WeakPolarHBondContact CZ3-O 3.37Å; F945-D947 PolarHBondContact O-N 2.96Å
948	V	95.3	Very high	95.1	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.1	179.6	179.8	0	0	0	0	110.6	R521 W944 F945 P965 E969 F970	R521-V948 VanDerWaalsContact NH2-CG2 3.28Å; W944-V948 CarbonylContact C-O 3.57Å; W944-V948 VanDerWaalsContact CA-O 3.32Å; W944-V948 WeakPolarHBondContact CA-O 3.44Å; F945-V948 PolarHBondContact N-O 2.66Å; F945-V948 WeakPolarHBondContact O-CB 3.47Å; F945-V948 PolarHBondContact O-N 3.07Å; V948-P965 HydrophobicContact CB-CG 4.43Å; V948-P965 HydrophobicContact CG1-CB 3.68Å; V948-P965 HydrophobicContact CG1-CG 3.66Å; V948-E969 HydrophobicContact CG1-CB 4.29Å; V948-E969 WeakPolarHBondContact CG1-OE2 3.4Å; V948-E969 HydrophobicContact CG2-CB 3.97Å; V948-F970 HydrophobicContact CB-CE1 4.12Å; V948-F970 HydrophobicContact CB-CZ 3.99Å; V948-F970 HydrophobicContact CG2-CD1 3.95Å; V948-F970 HydrophobicContact CG2-CE1 3.48Å; V948-F970 VanDerWaalsContact CG2-CE1 3.48Å; V948-F970 HydrophobicContact CG2-CE2 4.21Å; V948-F970 HydrophobicContact CG2-CG 4.49Å; V948-F970 HydrophobicContact CG2-CZ 3.63Å
949	P	95.4	Very high	95.1	Very high	6 Å²	6	39.5 Å²	39.5	4%	0.039	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	128.9	167.2	26	-29.8	0	0	0	110.7	C513 W944	C513-P949 PolarHBondContact SG-O 3.33Å; C513-P949 VanDerWaalsContact SG-O 3.35Å; W944-P949 HydrophobicContact CD2-CB 3.95Å; W944-P949 HydrophobicContact CE3-CB 4.32Å; W944-P949 HydrophobicContact CG-CB 4.49Å; W944-P949 HydrophobicContact CH2-CB 4.27Å; W944-P949 HydrophobicContact CH2-CG 4.27Å; W944-P949 HydrophobicContact CZ2-CB 3.85Å; W944-P949 HydrophobicContact CZ2-CG 4.31Å; W944-P949 HydrophobicContact CZ3-CB 4.47Å; W944-P949 HydrophobicContact CZ3-CG 4.42Å
950	A	94	Very high	95.2	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.025	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-95.7	150.5	175.2	0	0	0	0	0	112.1	Q942 V943 F945 T952 C962 P965	Q942-A950 WeakPolarHBondContact CG-O 3.44Å; Q942-A950 PolarHBondContact NE2-O 3.41Å; Q942-A950 VanDerWaalsContact NE2-O 3.09Å; V943-A950 HydrophobicContact CB-CB 4.47Å; V943-A950 WeakPolarHBondContact O-CB 3.44Å; V943-A950 PolarHBondContact O-N 3.1Å; F945-A950 HydrophobicContact CD2-CB 3.76Å; F945-A950 HydrophobicContact CE2-CB 3.7Å; A950-T952 PolarHBondContact O-N 3.05Å; A950-T952 PolarHBondContact O-OG1 3.22Å; A950-C962 HydrophobicContact CB-CB 4.19Å; A950-P965 HydrophobicContact CB-CG 4.14Å
951	Q	91.1	Very high	95.4	Very high	29 Å²	29	30.9 Å²	30.9	14%	0.136	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-66.5	121.4	167.5	-176.8	171	35.8	0	0	109.1	F953 C962 F963 A1023	Q951-F953 HydrophobicContact CG-CE1 4.36Å; Q951-F953 HydrophobicContact CG-CE2 3.99Å; Q951-F953 HydrophobicContact CG-CZ 3.72Å; Q951-C962 WeakPolarHBondContact O-CA 3.31Å; Q951-C962 WeakPolarHBondContact O-CB 3.48Å; Q951-F963 HydrophobicContact CB-CD2 4.22Å; Q951-F963 PolarHBondContact O-N 2.71Å; Q951-F963 VanDerWaalsContact O-N 3.11Å; Q951-A1023 VanDerWaalsContact NE2-C 3.28Å; Q951-A1023 PolarHBondContact NE2-O 2.61Å
952	T	94.5	Very high	95.3	Very high	33 Å²	33	30.3 Å²	30.3	20%	0.202	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	134.9	-167.1	-58.1	0	0	0	0	111.1	H941 V943 A950 I960	H941-T952 WeakPolarHBondContact O-CG2 3.18Å; V943-T952 HydrophobicContact CG2-CG2 3.88Å; V943-T952 PolarHBondContact N-OG1 2.91Å; A950-T952 PolarHBondContact O-N 3.05Å; A950-T952 PolarHBondContact O-OG1 3.22Å; T952-I960 HydrophobicContact CG2-CG2 3.5Å
953	F	93.3	Very high	95.2	Very high	44 Å²	44	30 Å²	30	19%	0.193	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	109.1	-179.8	-53.1	-84.1	0	0	0	110.1	Q951 L961 F963	Q951-F953 HydrophobicContact CG-CE1 4.36Å; Q951-F953 HydrophobicContact CG-CE2 3.99Å; Q951-F953 HydrophobicContact CG-CZ 3.72Å; F953-L961 HydrophobicContact CB-CB 4.39Å; F953-L961 PolarHBondContact N-O 3.38Å; F953-L961 PolarHBondContact O-N 2.85Å; F953-F963 AromaticContact CE2-CD2 3.87Å; F953-F963 HydrophobicContact CE2-CD2 3.87Å; F953-F963 AromaticContact CE2-CE2 3.64Å; F953-F963 HydrophobicContact CE2-CE2 3.64Å; F953-F963 HydrophobicContact CE2-CZ 4.25Å; F953-F963 HydrophobicContact CZ-CD2 4.29Å; F953-F963 AromaticContact CZ-CE2 3.77Å; F953-F963 HydrophobicContact CZ-CE2 3.77Å
954	Y	95.6	Very high	95.1	Very high	51 Å²	51	31.1 Å²	31.1	20%	0.2	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131.1	173	171.6	-94.6	0	0	0	111.1	F937 S938 P939 C956 E957 I960	F937-Y954 HydrophobicContact CB-CD2 4.47Å; F937-Y954 HydrophobicContact CB-CE2 4.27Å; S938-Y954 VanDerWaalsContact CA-CE2 3.46Å; P939-Y954 HydrophobicContact CG-CD1 3.7Å; P939-Y954 HydrophobicContact CG-CD2 4.47Å; P939-Y954 HydrophobicContact CG-CE1 3.93Å; P939-Y954 HydrophobicContact CG-CG 3.97Å; Y954-C956 WeakPolarHBondContact CE2-O 3.21Å; Y954-C956 VanDerWaalsContact CZ-C 3.44Å; Y954-E957 PolarHBondContact OH-N 2.89Å; Y954-I960 HydrophobicContact CD2-CG1 4.29Å
955	R	94.8	Very high	94.8	Very high	68 Å²	68	31.4 Å²	31.4	26%	0.257	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-53.5	173.2	-65.1	-73.3	167.5	-158	-12.7	111.2	S114 L959 L961	S114-R955 PolarHBondContact O-NH1 2.91Å; S114-R955 PolarHBondContact O-NH2 3.35Å; S114-R955 VanDerWaalsContact O-NH2 3.12Å; R955-L959 HydrophobicContact CB-CB 4.12Å; R955-L959 HydrophobicContact CB-CD2 3.98Å; R955-L959 HydrophobicContact CB-CG 4.1Å; R955-L959 WeakPolarHBondContact CB-O 3.17Å; R955-L959 HydrophobicContact CG-CD2 4.2Å; R955-L959 HydrophobicContact CG-CG 4.4Å; R955-L959 PolarHBondContact N-O 3.34Å; R955-L961 HydrophobicContact CG-CD1 4.19Å; R955-L961 HydrophobicContact CG-CG 4.1Å
956	C	96.1	Very high	94.4	Very high	55 Å²	55	35.2 Å²	35.2	37%	0.372	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	178.6	175.4	68	0	0	0	0	111.2	Y954 E958 L959	Y954-C956 WeakPolarHBondContact CE2-O 3.21Å; Y954-C956 VanDerWaalsContact CZ-C 3.44Å; C956-E958 PolarHBondContact O-N 3.28Å; C956-L959 PolarHBondContact N-O 2.68Å; C956-L959 VanDerWaalsContact N-O 3.11Å; C956-L959 PolarHBondContact O-N 2.63Å; C956-L959 VanDerWaalsContact SG-CB 3.59Å; C956-L959 PolarHBondContact SG-N 3.35Å
957	E	95.6	Very high	94.1	Very high	129 Å²	129	35.1 Å²	35.1	60%	0.603	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-13.6	179.9	-58.9	-173.7	165.5	0	0	114	E935 N936 F937 Y954	E935-E957 CarbonylContact C-O 3.55Å; N936-E957 PolarHBondContact N-O 2.93Å; N936-E957 VanDerWaalsContact N-O 3.09Å; F937-E957 WeakPolarHBondContact CB-O 3.25Å; F937-E957 PolarHBondContact N-O 2.8Å; Y954-E957 PolarHBondContact OH-N 2.89Å
958	E	96.6	Very high	93.7	Very high	110 Å²	110	36.3 Å²	36.3	51%	0.514	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-7	175	-60.3	-169.3	118	0	0	114.2	R917 I933 G934 C956	R917-E958 IonicContact CZ-OE1 3.25Å; R917-E958 IonicContact NH1-OE1 3.28Å; R917-E958 IonicContact NH2-OE1 2.84Å; R917-E958 PolarHBondContact NH2-OE1 3.46Å; I933-E958 WeakPolarHBondContact CA-O 3.43Å; G934-E958 PolarHBondContact N-O 3.2Å; G934-E958 VanDerWaalsContact O-CA 3.27Å; G934-E958 WeakPolarHBondContact O-CA 3.42Å; G934-E958 WeakPolarHBondContact O-CB 3.45Å; C956-E958 PolarHBondContact O-N 3.28Å
959	L	96.5	Very high	93.4	Very high	45 Å²	45	39.8 Å²	39.8	24%	0.236	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	124	-172.8	-169.4	65.9	0	0	0	114.2	E931 I933 R955 C956	E931-L959 HydrophobicContact CG-CD1 3.61Å; I933-L959 HydrophobicContact CG1-CD1 3.97Å; R955-L959 HydrophobicContact CB-CB 4.12Å; R955-L959 HydrophobicContact CB-CD2 3.98Å; R955-L959 HydrophobicContact CB-CG 4.1Å; R955-L959 WeakPolarHBondContact CB-O 3.17Å; R955-L959 HydrophobicContact CG-CD2 4.2Å; R955-L959 HydrophobicContact CG-CG 4.4Å; R955-L959 PolarHBondContact N-O 3.34Å; C956-L959 PolarHBondContact N-O 2.68Å; C956-L959 VanDerWaalsContact N-O 3.11Å; C956-L959 PolarHBondContact O-N 2.63Å; C956-L959 VanDerWaalsContact SG-CB 3.59Å; C956-L959 PolarHBondContact SG-N 3.35Å
960	I	96.5	Very high	93.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	142.1	168.3	-77.1	176.5	0	0	0	108.9	I932 F937 H941 V943 T952 Y954	I932-I960 PolarHBondContact N-O 2.85Å; I932-I960 PolarHBondContact O-N 2.87Å; F937-I960 HydrophobicContact CB-CD1 3.71Å; F937-I960 HydrophobicContact CB-CG1 3.93Å; F937-I960 HydrophobicContact CD1-CD1 4.22Å; F937-I960 HydrophobicContact CD2-CB 4.17Å; F937-I960 HydrophobicContact CD2-CD1 4.05Å; F937-I960 HydrophobicContact CD2-CG1 3.78Å; F937-I960 HydrophobicContact CE2-CB 4.46Å; F937-I960 HydrophobicContact CG-CD1 3.74Å; F937-I960 HydrophobicContact CG-CG1 3.96Å; H941-I960 HydrophobicContact CB-CD1 4.18Å; V943-I960 HydrophobicContact CG2-CG2 3.82Å; T952-I960 HydrophobicContact CG2-CG2 3.5Å; Y954-I960 HydrophobicContact CD2-CG1 4.29Å
961	L	95.1	Very high	92.7	Very high	7 Å²	7	44.9 Å²	44.9	4%	0.037	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154.3	167.4	-50.6	178.4	0	0	0	109.6	Y118 L930 E931 F953 R955	Y118-L961 HydrophobicContact CD2-CD1 4.43Å; Y118-L961 HydrophobicContact CE2-CD1 3.84Å; L930-L961 CarbonylContact O-C 3.55Å; L930-L961 WeakPolarHBondContact O-CA 3.4Å; E931-L961 HydrophobicContact CB-CD2 3.82Å; E931-L961 HydrophobicContact CG-CD2 3.76Å; F953-L961 HydrophobicContact CB-CB 4.39Å; F953-L961 PolarHBondContact N-O 3.38Å; F953-L961 PolarHBondContact O-N 2.85Å; R955-L961 HydrophobicContact CG-CD1 4.19Å; R955-L961 HydrophobicContact CG-CG 4.1Å
962	C	94.6	Very high	92.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	157.8	166.7	56.7	0	0	0	0	111.1	M929 L930 V943 A950 Q951	M929-C962 CarbonylContact C-O 3.46Å; M929-C962 VanDerWaalsContact CA-O 3.3Å; M929-C962 WeakPolarHBondContact CA-O 3.28Å; L930-C962 PolarHBondContact N-O 3.17Å; L930-C962 PolarHBondContact O-N 3.48Å; V943-C962 HydrophobicContact CB-CB 4.06Å; V943-C962 HydrophobicContact CG2-CB 3.99Å; A950-C962 HydrophobicContact CB-CB 4.19Å; Q951-C962 WeakPolarHBondContact O-CA 3.31Å; Q951-C962 WeakPolarHBondContact O-CB 3.48Å
963	F	93.3	Very high	91.9	Very high	20 Å²	20	60 Å²	60	9%	0.088	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	139.9	167	-72.7	-57.3	0	0	0	109.8	F121 M929 Q951 F953 P965 I1020	F121-F963 HydrophobicContact CE1-CE1 4.31Å; F121-F963 HydrophobicContact CE2-CZ 4.32Å; F121-F963 AromaticContact CZ-CE1 3.75Å; F121-F963 HydrophobicContact CZ-CE1 3.75Å; F121-F963 AromaticContact CZ-CZ 3.96Å; F121-F963 HydrophobicContact CZ-CZ 3.96Å; M929-F963 HydrophobicContact CG-CD1 3.68Å; M929-F963 HydrophobicContact CG-CE1 3.67Å; M929-F963 HydrophobicContact SD-CD1 4.48Å; M929-F963 HydrophobicContact SD-CE1 3.99Å; Q951-F963 HydrophobicContact CB-CD2 4.22Å; Q951-F963 PolarHBondContact O-N 2.71Å; Q951-F963 VanDerWaalsContact O-N 3.11Å; F953-F963 AromaticContact CE2-CD2 3.87Å; F953-F963 HydrophobicContact CE2-CD2 3.87Å; F953-F963 AromaticContact CE2-CE2 3.64Å; F953-F963 HydrophobicContact CE2-CE2 3.64Å; F953-F963 HydrophobicContact CE2-CZ 4.25Å; F953-F963 HydrophobicContact CZ-CD2 4.29Å; F953-F963 AromaticContact CZ-CE2 3.77Å; F953-F963 HydrophobicContact CZ-CE2 3.77Å; F963-P965 WeakPolarHBondContact O-CD 3.42Å; F963-I1020 HydrophobicContact CD1-CG1 4.46Å; F963-I1020 HydrophobicContact CD2-CG1 4.45Å; F963-I1020 HydrophobicContact CD2-CG2 4.34Å; F963-I1020 HydrophobicContact CE1-CD1 4.45Å; F963-I1020 HydrophobicContact CE1-CG1 4.03Å; F963-I1020 HydrophobicContact CE2-CG1 4Å; F963-I1020 HydrophobicContact CE2-CG2 4.38Å; F963-I1020 HydrophobicContact CZ-CG1 3.8Å
964	V	94	Very high	91.5	Very high	24 Å²	24	60 Å²	60	15%	0.145	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-72.1	121.7	168.7	176.3	0	0	0	0	107.7	A928 L930 F945 F1001 Y1003	A928-V964 HydrophobicContact CB-CB 4.02Å; A928-V964 HydrophobicContact CB-CG2 4.03Å; A928-V964 PolarHBondContact O-N 3.41Å; L930-V964 HydrophobicContact CB-CG2 4.04Å; F945-V964 HydrophobicContact CE1-CB 4.48Å; F945-V964 HydrophobicContact CE1-CG1 4.19Å; F945-V964 HydrophobicContact CE1-CG2 4.31Å; F945-V964 HydrophobicContact CZ-CB 4.46Å; F945-V964 HydrophobicContact CZ-CG2 4.19Å; V964-F1001 HydrophobicContact CB-CZ 4.41Å; V964-F1001 HydrophobicContact CG1-CE1 3.71Å; V964-F1001 HydrophobicContact CG1-CE2 4.38Å; V964-F1001 HydrophobicContact CG1-CZ 3.57Å; V964-F1001 HydrophobicContact CG2-CE2 3.95Å; V964-F1001 HydrophobicContact CG2-CZ 3.88Å; V964-Y1003 HydrophobicContact CG1-CE1 3.83Å; V964-Y1003 WeakPolarHBondContact CG1-OH 3.46Å
965	P	92	Very high	90.6	Very high	8 Å²	8	62.5 Å²	62.5	5%	0.052	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-62.4	149.7	177.7	-23	34.3	0	0	0	112	F945 V948 A950 F963 F970 Y1003	F945-P965 HydrophobicContact CB-CG 4.17Å; F945-P965 HydrophobicContact CD2-CG 3.84Å; F945-P965 HydrophobicContact CE2-CG 4.31Å; F945-P965 HydrophobicContact CG-CG 3.96Å; V948-P965 HydrophobicContact CB-CG 4.43Å; V948-P965 HydrophobicContact CG1-CB 3.68Å; V948-P965 HydrophobicContact CG1-CG 3.66Å; A950-P965 HydrophobicContact CB-CG 4.14Å; F963-P965 WeakPolarHBondContact O-CD 3.42Å; P965-F970 HydrophobicContact CB-CE2 4.17Å; P965-F970 HydrophobicContact CB-CZ 4.48Å; P965-Y1003 WeakPolarHBondContact O-CE1 3.37Å; P965-Y1003 PolarHBondContact O-OH 2.87Å
966	D	88.5	Confident	89.9	Confident	79 Å²	79	62.5 Å²	62.5	42%	0.422	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-68.7	152.6	177	178.1	51.3	0	0	0	111.7	S968 E969	D966-S968 PolarHBondContact O-N 3.02Å; D966-S968 WeakPolarHBondContact OD2-CB 3.21Å; D966-S968 PolarHBondContact OD2-N 3.46Å; D966-S968 PolarHBondContact OD2-OG 2.88Å; D966-E969 WeakPolarHBondContact O-CB 3.06Å; D966-E969 PolarHBondContact O-N 2.84Å; D966-E969 VanDerWaalsContact O-N 3.08Å
967	I	88.5	Confident	89.3	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.015	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-61.9	-26.4	-178.4	-165.7	58.9	0	0	0	112.6	E969 F970 H971 W974 I977 L981 Y1003	I967-E969 PolarHBondContact O-N 2.86Å; I967-F970 PolarHBondContact O-N 3.02Å; I967-H971 PolarHBondContact O-N 3.46Å; I967-W974 HydrophobicContact CD1-CE3 4.12Å; I967-W974 HydrophobicContact CD1-CZ3 4.25Å; I967-W974 HydrophobicContact CG1-CE3 3.64Å; I967-W974 HydrophobicContact CG1-CZ3 4.25Å; I967-W974 HydrophobicContact CG2-CB 4.5Å; I967-I977 HydrophobicContact CB-CG1 4.14Å; I967-I977 HydrophobicContact CD1-CG1 4.39Å; I967-I977 HydrophobicContact CG1-CG1 4.03Å; I967-I977 HydrophobicContact CG2-CG1 4.41Å; I967-L981 HydrophobicContact CD1-CD2 3.65Å; I967-Y1003 HydrophobicContact CD1-CD1 4.15Å; I967-Y1003 HydrophobicContact CD1-CG 4.14Å
968	S	86.8	Confident	88.8	Confident	49 Å²	49	59.1 Å²	59.1	34%	0.343	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-65.8	-20	176	67.8	0	0	0	0	114.2	D966 F970 H971 R972	D966-S968 PolarHBondContact O-N 3.02Å; D966-S968 WeakPolarHBondContact OD2-CB 3.21Å; D966-S968 PolarHBondContact OD2-N 3.46Å; D966-S968 PolarHBondContact OD2-OG 2.88Å; S968-F970 PolarHBondContact O-N 2.79Å; S968-H971 WeakPolarHBondContact CA-O 3.38Å; S968-H971 CarbonylContact O-C 3.47Å; S968-R972 PolarHBondContact O-N 2.78Å
969	E	88.7	Confident	88.4	Confident	73 Å²	73	59 Å²	59	34%	0.341	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-72.4	-17.6	175.2	-65.4	-155.4	-120.8	0	0	113.7	R521 V948 D966 I967	R521-E969 PolarHBondContact NH2-O 3.32Å; R521-E969 VanDerWaalsContact NH2-O 3.11Å; V948-E969 HydrophobicContact CG1-CB 4.29Å; V948-E969 WeakPolarHBondContact CG1-OE2 3.4Å; V948-E969 HydrophobicContact CG2-CB 3.97Å; D966-E969 WeakPolarHBondContact O-CB 3.06Å; D966-E969 PolarHBondContact O-N 2.84Å; D966-E969 VanDerWaalsContact O-N 3.08Å; I967-E969 PolarHBondContact O-N 2.86Å
970	F	89.4	Confident	88.1	Confident	45 Å²	45	60.5 Å²	60.5	20%	0.197	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-46.7	173.8	-54.3	-85.9	0	0	0	111.3	F945 V948 P965 I967 S968 L981 V983 Y1003	F945-F970 HydrophobicContact CB-CE1 4.47Å; F945-F970 HydrophobicContact CB-CZ 3.88Å; F945-F970 WeakPolarHBondContact O-CE1 3.31Å; V948-F970 HydrophobicContact CB-CE1 4.12Å; V948-F970 HydrophobicContact CB-CZ 3.99Å; V948-F970 HydrophobicContact CG2-CD1 3.95Å; V948-F970 HydrophobicContact CG2-CE1 3.48Å; V948-F970 VanDerWaalsContact CG2-CE1 3.48Å; V948-F970 HydrophobicContact CG2-CE2 4.21Å; V948-F970 HydrophobicContact CG2-CG 4.49Å; V948-F970 HydrophobicContact CG2-CZ 3.63Å; P965-F970 HydrophobicContact CB-CE2 4.17Å; P965-F970 HydrophobicContact CB-CZ 4.48Å; I967-F970 PolarHBondContact O-N 3.02Å; S968-F970 PolarHBondContact O-N 2.79Å; F970-L981 HydrophobicContact CB-CD2 3.86Å; F970-L981 HydrophobicContact CD1-CD2 4.43Å; F970-L981 HydrophobicContact CD2-CD2 4.36Å; F970-L981 HydrophobicContact CG-CD2 3.96Å; F970-V983 HydrophobicContact CD1-CG2 4.45Å; F970-V983 HydrophobicContact CE1-CG1 3.76Å; F970-V983 HydrophobicContact CE1-CG2 4.11Å; F970-V983 HydrophobicContact CZ-CG1 4.13Å; F970-V983 HydrophobicContact CZ-CG2 4.37Å; F970-Y1003 AromaticContact CE2-CE2 3.97Å; F970-Y1003 HydrophobicContact CE2-CE2 3.97Å; F970-Y1003 AromaticContact CE2-CZ 3.79Å; F970-Y1003 WeakPolarHBondContact CE2-OH 3.31Å; F970-Y1003 HydrophobicContact CZ-CE2 4.31Å
971	H	85.8	Confident	87.9	Confident	70 Å²	70	62.1 Å²	62.1	32%	0.324	30%	0.303	S	S	.	.			trans	-127	92.3	-178.1	-70.5	-60	0	0	0	110.4	I967 S968 D973 W974	I967-H971 PolarHBondContact O-N 3.46Å; S968-H971 WeakPolarHBondContact CA-O 3.38Å; S968-H971 CarbonylContact O-C 3.47Å; H971-D973 PolarHBondContact O-N 3.09Å; H971-W974 HydrophobicContact CB-CB 3.97Å; H971-W974 HydrophobicContact CB-CD2 3.81Å; H971-W974 HydrophobicContact CB-CE3 4.29Å; H971-W974 HydrophobicContact CB-CG 3.68Å; H971-W974 AromaticContact CD2-CE3 3.99Å; H971-W974 AromaticContact CD2-CH2 3.89Å; H971-W974 AromaticContact CD2-CZ3 3.89Å; H971-W974 WeakPolarHBondContact O-CB 3.34Å; H971-W974 PolarHBondContact O-N 2.95Å
972	R	83.1	Confident	87.8	Confident	231 Å²	231	66.2 Å²	66.2	87%	0.872	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.5	-178.1	-66.1	-179.7	177	-178.6	-3.7	114.7	S968 W974	S968-R972 PolarHBondContact O-N 2.78Å; R972-W974 VanDerWaalsContact C-N 3.33Å
973	D	85.1	Confident	87.8	Confident	149 Å²	149	66.4 Å²	66.4	80%	0.797	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.5	179.5	-46.7	-56	0	0	0	113.1	H971	H971-D973 PolarHBondContact O-N 3.09Å
974	W	83.9	Confident	87.9	Confident	43 Å²	43	66.2 Å²	66.2	16%	0.163	32%	0.323	C	S	.	.			trans	-104	117.9	-178.6	-71.7	16.3	0	0	0	111.1	I967 H971 R972 I977 Q978 K979	I967-W974 HydrophobicContact CD1-CE3 4.12Å; I967-W974 HydrophobicContact CD1-CZ3 4.25Å; I967-W974 HydrophobicContact CG1-CE3 3.64Å; I967-W974 HydrophobicContact CG1-CZ3 4.25Å; I967-W974 HydrophobicContact CG2-CB 4.5Å; H971-W974 HydrophobicContact CB-CB 3.97Å; H971-W974 HydrophobicContact CB-CD2 3.81Å; H971-W974 HydrophobicContact CB-CE3 4.29Å; H971-W974 HydrophobicContact CB-CG 3.68Å; H971-W974 AromaticContact CD2-CE3 3.99Å; H971-W974 AromaticContact CD2-CH2 3.89Å; H971-W974 AromaticContact CD2-CZ3 3.89Å; H971-W974 WeakPolarHBondContact O-CB 3.34Å; H971-W974 PolarHBondContact O-N 2.95Å; R972-W974 VanDerWaalsContact C-N 3.33Å; W974-I977 HydrophobicContact CZ3-CG2 4.42Å; W974-Q978 HydrophobicContact CD2-CB 4.13Å; W974-Q978 HydrophobicContact CD2-CG 4.14Å; W974-Q978 HydrophobicContact CE3-CB 4.3Å; W974-Q978 HydrophobicContact CG-CG 4.25Å; W974-Q978 HydrophobicContact CH2-CB 4.43Å; W974-Q978 HydrophobicContact CZ2-CB 4.2Å; W974-Q978 HydrophobicContact CZ3-CB 4.46Å; W974-K979 HydrophobicContact CH2-CB 3.86Å; W974-K979 HydrophobicContact CZ2-CB 4.42Å; W974-K979 WeakPolarHBondContact CZ3-O 3.36Å
975	T	78.4	Confident	88.1	Confident	105 Å²	105	65.2 Å²	65.2	64%	0.644	32%	0.317	S	S	*	.	S	Bend	trans	-92.5	-0.8	171.3	52.4	0	0	0	0	113.5
976	Y	79.4	Confident	88.3	Confident	68 Å²	68	64.8 Å²	64.8	27%	0.267	32%	0.315	S	S	.	.	S	Bend	trans	-163.4	162.9	173.4	61.5	-82.5	0	0	0	108.7	Q978 E1006 P1009	Y976-Q978 HydrophobicContact CD2-CG 4.28Å; Y976-Q978 HydrophobicContact CE2-CG 3.93Å; Y976-Q978 PolarHBondContact O-N 2.87Å; Y976-E1006 HydrophobicContact CD2-CB 4.17Å; Y976-P1009 HydrophobicContact CD1-CB 4.09Å; Y976-P1009 HydrophobicContact CD1-CG 4.44Å
977	I	84.3	Confident	88.7	Confident	13 Å²	13	61.2 Å²	61.2	7%	0.067	30%	0.295	C	S	.	.			trans	-70.4	105.2	-178.3	-50.7	161	0	0	0	109.4	I967 W974 K979 Y1003 H1004 P1005 E1006	I967-I977 HydrophobicContact CB-CG1 4.14Å; I967-I977 HydrophobicContact CD1-CG1 4.39Å; I967-I977 HydrophobicContact CG1-CG1 4.03Å; I967-I977 HydrophobicContact CG2-CG1 4.41Å; W974-I977 HydrophobicContact CZ3-CG2 4.42Å; I977-K979 WeakPolarHBondContact CG2-O 3.48Å; I977-Y1003 HydrophobicContact CD1-CD1 3.93Å; I977-Y1003 HydrophobicContact CD1-CG 4.43Å; I977-Y1003 HydrophobicContact CG1-CD1 4.34Å; I977-H1004 WeakPolarHBondContact CB-O 3.18Å; I977-H1004 WeakPolarHBondContact CD1-O 3.5Å; I977-H1004 WeakPolarHBondContact CG2-O 3.25Å; I977-P1005 CarbonylContact O-C 3.54Å; I977-P1005 VanDerWaalsContact O-CA 3.3Å; I977-P1005 WeakPolarHBondContact O-CA 3.41Å; I977-E1006 HydrophobicContact CB-CG 4.2Å; I977-E1006 HydrophobicContact CD1-CG 4.3Å; I977-E1006 VanDerWaalsContact CD1-OE1 3.26Å; I977-E1006 WeakPolarHBondContact CD1-OE1 3.46Å; I977-E1006 HydrophobicContact CG1-CG 4.45Å; I977-E1006 WeakPolarHBondContact CG1-OE1 3.36Å; I977-E1006 PolarHBondContact O-N 2.91Å
978	Q	84.1	Confident	89.1	Confident	99 Å²	99	61.2 Å²	61.2	46%	0.463	30%	0.295	S	S	.	.			trans	-84.5	-29.8	-178.1	-63	-175.7	3.7	0	0	113.2	W974 Y976	W974-Q978 HydrophobicContact CD2-CB 4.13Å; W974-Q978 HydrophobicContact CD2-CG 4.14Å; W974-Q978 HydrophobicContact CE3-CB 4.3Å; W974-Q978 HydrophobicContact CG-CG 4.25Å; W974-Q978 HydrophobicContact CH2-CB 4.43Å; W974-Q978 HydrophobicContact CZ2-CB 4.2Å; W974-Q978 HydrophobicContact CZ3-CB 4.46Å; Y976-Q978 HydrophobicContact CD2-CG 4.28Å; Y976-Q978 HydrophobicContact CE2-CG 3.93Å; Y976-Q978 PolarHBondContact O-N 2.87Å
979	K	87.4	Confident	89.5	Confident	109 Å²	109	58.9 Å²	58.9	47%	0.474	28%	0.279	S	S	.	.	S	Bend	trans	-145.5	149.9	-179.1	171.5	-176.2	169.8	-171	0	108.7	N435 W974 I977 L981	N435-K979 PolarHBondContact OD1-NZ 3.28Å; W974-K979 HydrophobicContact CH2-CB 3.86Å; W974-K979 HydrophobicContact CZ2-CB 4.42Å; W974-K979 WeakPolarHBondContact CZ3-O 3.36Å; I977-K979 WeakPolarHBondContact CG2-O 3.48Å; K979-L981 PolarHBondContact O-N 3.35Å
980	T	91.3	Very high	89.6	Confident	75 Å²	75	60 Å²	60	46%	0.46	28%	0.284	S	S	.	.			trans	-53.6	122	176	-44.5	0	0	0	0	110.8	T1002 Y1003 P1005	T980-T1002 HydrophobicContact CG2-CG2 3.45Å; T980-T1002 VanDerWaalsContact CG2-CG2 3.45Å; T980-Y1003 VanDerWaalsContact CA-O 3.31Å; T980-Y1003 WeakPolarHBondContact CA-O 3.28Å; T980-P1005 WeakPolarHBondContact OG1-CD 3.34Å
981	L	91.6	Very high	89.7	Confident	35 Å²	35	59.4 Å²	59.4	18%	0.183	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	119.7	175.7	176.3	69.6	0	0	0	108.6	I967 F970 K979 V983 T1002 Y1003	I967-L981 HydrophobicContact CD1-CD2 3.65Å; F970-L981 HydrophobicContact CB-CD2 3.86Å; F970-L981 HydrophobicContact CD1-CD2 4.43Å; F970-L981 HydrophobicContact CD2-CD2 4.36Å; F970-L981 HydrophobicContact CG-CD2 3.96Å; K979-L981 PolarHBondContact O-N 3.35Å; L981-V983 HydrophobicContact CD2-CG2 3.93Å; L981-V983 HydrophobicContact CG-CG2 3.78Å; L981-T1002 WeakPolarHBondContact O-CA 3.38Å; L981-Y1003 HydrophobicContact CD2-CD2 4.44Å; L981-Y1003 PolarHBondContact N-O 3.32Å; L981-Y1003 VanDerWaalsContact N-O 3.13Å; L981-Y1003 PolarHBondContact O-N 3.49Å
982	E	93.7	Very high	90	Very high	92 Å²	92	56.1 Å²	56.1	43%	0.43	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.7	174.5	-173.9	170.8	-173.2	0	0	109.4	T1000	E982-T1000 HydrophobicContact CG-CG2 4.01Å; E982-T1000 WeakPolarHBondContact OE1-CB 3.3Å; E982-T1000 WeakPolarHBondContact OE1-CG2 3.28Å; E982-T1000 PolarHBondContact OE1-OG1 3.4Å
983	V	94.5	Very high	90.6	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.03	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	130.6	-169.9	-176.2	0	0	0	0	109.5	F945 G946 F970 L981 T1000 F1001 Y1003	F945-V983 HydrophobicContact CB-CG1 3.91Å; G946-V983 VanDerWaalsContact N-CG1 3.27Å; F970-V983 HydrophobicContact CD1-CG2 4.45Å; F970-V983 HydrophobicContact CE1-CG1 3.76Å; F970-V983 HydrophobicContact CE1-CG2 4.11Å; F970-V983 HydrophobicContact CZ-CG1 4.13Å; F970-V983 HydrophobicContact CZ-CG2 4.37Å; L981-V983 HydrophobicContact CD2-CG2 3.93Å; L981-V983 HydrophobicContact CG-CG2 3.78Å; V983-T1000 CarbonylContact O-C 3.58Å; V983-T1000 WeakPolarHBondContact O-CA 3.35Å; V983-F1001 PolarHBondContact N-O 2.84Å; V983-F1001 PolarHBondContact O-N 3.02Å; V983-Y1003 HydrophobicContact CG2-CD2 3.96Å; V983-Y1003 HydrophobicContact CG2-CE2 3.85Å
984	P	96.3	Very high	91.1	Very high	15 Å²	15	38 Å²	38	10%	0.097	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	134.8	-175.3	30.3	-30.8	0	0	0	111.1	Y431 L528 G946	Y431-P984 HydrophobicContact CE1-CG 4.32Å; Y431-P984 WeakPolarHBondContact OH-CB 3.11Å; Y431-P984 WeakPolarHBondContact OH-CD 3.41Å; Y431-P984 VanDerWaalsContact OH-N 3.12Å; L528-P984 HydrophobicContact CD2-CG 3.89Å; G946-P984 PolarHBondContact N-O 2.88Å
985	I	97	Very high	91.8	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.015	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	134.1	-178.8	-63.1	-68.2	0	0	0	110.2	M919 L930 I932 V943 F945 S997 L999 F1001	M919-I985 HydrophobicContact CE-CB 4.39Å; M919-I985 HydrophobicContact CE-CG1 3.76Å; M919-I985 HydrophobicContact SD-CB 4.42Å; M919-I985 HydrophobicContact SD-CG1 4.42Å; M919-I985 HydrophobicContact SD-CG2 4.2Å; L930-I985 HydrophobicContact CD2-CD1 4.16Å; I932-I985 HydrophobicContact CD1-CG2 4.34Å; V943-I985 HydrophobicContact CG1-CG2 4.25Å; F945-I985 HydrophobicContact CB-CD1 4.33Å; F945-I985 HydrophobicContact CD1-CD1 3.51Å; F945-I985 HydrophobicContact CD2-CD1 4.03Å; F945-I985 HydrophobicContact CE1-CD1 3.77Å; F945-I985 HydrophobicContact CE2-CD1 4.25Å; F945-I985 HydrophobicContact CG-CD1 3.66Å; F945-I985 HydrophobicContact CZ-CD1 4.13Å; I985-S997 WeakPolarHBondContact O-CB 3.45Å; I985-S997 PolarHBondContact O-N 2.33Å; I985-S997 PolarHBondContact O-OG 2.95Å; I985-L999 PolarHBondContact N-O 3.12Å; I985-F1001 HydrophobicContact CD1-CB 3.89Å; I985-F1001 HydrophobicContact CG1-CB 4.02Å
986	S	97.2	Very high	92.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	147.9	176.9	-60.6	0	0	0	0	111	W944 Y995	W944-S986 PolarHBondContact N-O 2.85Å; W944-S986 PolarHBondContact O-N 3.39Å; S986-Y995 WeakPolarHBondContact CA-O 3.06Å
987	L	97	Very high	93.2	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	118.8	170.3	-66.6	172.6	0	0	0	107.8	P914 V916 F937 V943 Y995	P914-L987 HydrophobicContact CB-CD1 3.69Å; P914-L987 HydrophobicContact CG-CB 4.2Å; P914-L987 HydrophobicContact CG-CD1 3.94Å; V916-L987 HydrophobicContact CG2-CD1 3.88Å; F937-L987 HydrophobicContact CD1-CD1 4.09Å; F937-L987 HydrophobicContact CE1-CD1 3.62Å; F937-L987 HydrophobicContact CZ-CD1 4.45Å; V943-L987 HydrophobicContact CG2-CD2 3.81Å; L987-Y995 HydrophobicContact CB-CD2 4.46Å; L987-Y995 PolarHBondContact N-O 2.99Å; L987-Y995 WeakPolarHBondContact O-CB 3.44Å; L987-Y995 WeakPolarHBondContact O-CD2 3.18Å; L987-Y995 PolarHBondContact O-N 2.92Å
988	V	96.9	Very high	93.5	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.7	180	176.9	0	0	0	0	108.7	L519 H941 Q942 W944 I993 I994	L519-V988 HydrophobicContact CB-CG1 4.07Å; L519-V988 HydrophobicContact CD2-CB 4.39Å; L519-V988 HydrophobicContact CD2-CG1 3.69Å; L519-V988 HydrophobicContact CD2-CG2 3.75Å; H941-V988 CarbonylContact C-O 3.18Å; H941-V988 WeakPolarHBondContact CA-O 3.41Å; Q942-V988 PolarHBondContact N-O 2.86Å; Q942-V988 PolarHBondContact O-N 2.85Å; W944-V988 HydrophobicContact CB-CG2 4.29Å; W944-V988 HydrophobicContact CD2-CG2 4.12Å; W944-V988 HydrophobicContact CG-CB 4.37Å; W944-V988 HydrophobicContact CG-CG2 3.69Å; V988-I993 WeakPolarHBondContact CA-O 3.5Å; V988-I994 HydrophobicContact CG2-CG1 4.43Å; V988-I994 HydrophobicContact CG2-CG2 4.25Å
989	R	95	Very high	94	Very high	1 Å²	1	30.8 Å²	30.8	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	153.4	175.6	-157.4	166.3	78	175.4	8.6	110.6	T908 P909 V910 R940 D991 G992 I993 Y995	T908-R989 PolarHBondContact OG1-NH2 3.34Å; P909-R989 PolarHBondContact O-NH1 2.94Å; P909-R989 PolarHBondContact O-NH2 3.42Å; V910-R989 PolarHBondContact O-NH1 3.01Å; R940-R989 HydrophobicContact CB-CG 4.32Å; R940-R989 CarbonylContact O-C 3.42Å; R940-R989 WeakPolarHBondContact O-CA 3.4Å; R989-D991 VanDerWaalsContact CB-OD1 3.23Å; R989-D991 WeakPolarHBondContact CB-OD1 3.49Å; R989-D991 WeakPolarHBondContact CG-OD1 3.29Å; R989-D991 IonicContact CZ-OD1 3.11Å; R989-D991 IonicContact CZ-OD2 2.82Å; R989-D991 IonicContact NE-OD1 3.54Å; R989-D991 PolarHBondContact NE-OD1 3Å; R989-D991 IonicContact NE-OD2 2.93Å; R989-D991 PolarHBondContact NE-OD2 3.36Å; R989-D991 IonicContact NH2-OD1 2.7Å; R989-D991 IonicContact NH2-OD2 2.73Å; R989-D991 PolarHBondContact NH2-OD2 3.37Å; R989-D991 PolarHBondContact O-N 3Å; R989-D991 VanDerWaalsContact O-N 3.11Å; R989-G992 WeakPolarHBondContact O-CA 3.26Å; R989-G992 PolarHBondContact O-N 3.15Å; R989-I993 HydrophobicContact CB-CB 4.31Å; R989-I993 PolarHBondContact N-O 2.85Å; R989-Y995 HydrophobicContact CB-CE2 3.98Å; R989-Y995 WeakPolarHBondContact CD-OH 3.16Å; R989-Y995 PolarHBondContact NH1-OH 2.56Å
990	Q	91.3	Very high	94.4	Very high	97 Å²	97	28 Å²	28	45%	0.453	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-31.1	-175.9	-159	-179.4	7.7	0	0	114.6	L516 G517 I518 R940 G992	L516-Q990 WeakPolarHBondContact O-CG 3.36Å; L516-Q990 PolarHBondContact O-NE2 2.93Å; L516-Q990 VanDerWaalsContact O-NE2 3.14Å; G517-Q990 WeakPolarHBondContact CA-O 3.33Å; I518-Q990 PolarHBondContact N-O 3.45Å; R940-Q990 HydrophobicContact CB-CB 4.4Å; R940-Q990 PolarHBondContact O-N 3.41Å; Q990-G992 PolarHBondContact O-N 3.37Å
991	D	90.8	Very high	94.6	Very high	32 Å²	32	25.6 Å²	25.6	17%	0.171	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	9.9	173.7	57.4	-16.6	0	0	0	113.9	C906 T908 R989	C906-D991 PolarHBondContact SG-OD2 2.85Å; T908-D991 PolarHBondContact OG1-OD2 3.07Å; R989-D991 VanDerWaalsContact CB-OD1 3.23Å; R989-D991 WeakPolarHBondContact CB-OD1 3.49Å; R989-D991 WeakPolarHBondContact CG-OD1 3.29Å; R989-D991 IonicContact CZ-OD1 3.11Å; R989-D991 IonicContact CZ-OD2 2.82Å; R989-D991 IonicContact NE-OD1 3.54Å; R989-D991 PolarHBondContact NE-OD1 3Å; R989-D991 IonicContact NE-OD2 2.93Å; R989-D991 PolarHBondContact NE-OD2 3.36Å; R989-D991 IonicContact NH2-OD1 2.7Å; R989-D991 IonicContact NH2-OD2 2.73Å; R989-D991 PolarHBondContact NH2-OD2 3.37Å; R989-D991 PolarHBondContact O-N 3Å; R989-D991 VanDerWaalsContact O-N 3.11Å
992	G	92.4	Very high	94.7	Very high	1 Å²	1	26 Å²	26	1%	0.01	16%	0.156	C	C	.	.	S	Bend	trans	91.8	-11.5	174.9	0	0	0	0	0	115.4	P883 R989 Q990 I994	P883-G992 WeakPolarHBondContact CD-O 3.28Å; P883-G992 WeakPolarHBondContact CG-O 3.3Å; R989-G992 WeakPolarHBondContact O-CA 3.26Å; R989-G992 PolarHBondContact O-N 3.15Å; Q990-G992 PolarHBondContact O-N 3.37Å; G992-I994 WeakPolarHBondContact O-CG1 3.12Å; G992-I994 PolarHBondContact O-N 3.09Å
993	I	94.9	Very high	94.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.138	C	C	.	.			trans	-61.6	125.7	-176.1	-55.3	-166.9	0	0	0	110.4	W880 C906 V910 V988 R989 Y995	W880-I993 HydrophobicContact CB-CG2 4.22Å; C906-I993 HydrophobicContact CB-CD1 4.17Å; V910-I993 HydrophobicContact CG1-CD1 4.11Å; V988-I993 WeakPolarHBondContact CA-O 3.5Å; R989-I993 HydrophobicContact CB-CB 4.31Å; R989-I993 PolarHBondContact N-O 2.85Å; I993-Y995 HydrophobicContact CG2-CD1 4.43Å; I993-Y995 HydrophobicContact CG2-CE1 3.83Å; I993-Y995 HydrophobicContact CG2-CE2 4.48Å
994	I	96.5	Very high	94.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.3	-176.3	-46.3	178.9	0	0	0	108.8	L519 M524 Y527 W880 F881 P883 V988 G992	L519-I994 HydrophobicContact CD1-CD1 3.98Å; L519-I994 HydrophobicContact CD1-CG1 4.39Å; L519-I994 HydrophobicContact CD2-CD1 3.86Å; L519-I994 HydrophobicContact CD2-CG1 3.94Å; M524-I994 HydrophobicContact CE-CG2 4.36Å; M524-I994 HydrophobicContact SD-CD1 3.83Å; M524-I994 HydrophobicContact SD-CG2 4.35Å; Y527-I994 HydrophobicContact CD1-CD1 3.65Å; Y527-I994 HydrophobicContact CD1-CG2 4.23Å; Y527-I994 HydrophobicContact CD2-CD1 4.23Å; Y527-I994 HydrophobicContact CE1-CD1 4.21Å; Y527-I994 HydrophobicContact CE1-CG2 3.74Å; Y527-I994 HydrophobicContact CG-CD1 3.67Å; W880-I994 CarbonylContact C-O 3.52Å; W880-I994 WeakPolarHBondContact CA-O 3.41Å; F881-I994 HydrophobicContact CB-CB 4.41Å; F881-I994 HydrophobicContact CD1-CD1 4Å; F881-I994 HydrophobicContact CD1-CG1 4.5Å; F881-I994 PolarHBondContact N-O 3.05Å; F881-I994 PolarHBondContact O-N 3.19Å; P883-I994 HydrophobicContact CG-CG1 4.38Å; V988-I994 HydrophobicContact CG2-CG1 4.43Å; V988-I994 HydrophobicContact CG2-CG2 4.25Å; G992-I994 WeakPolarHBondContact O-CG1 3.12Å; G992-I994 PolarHBondContact O-N 3.09Å
995	Y	97.2	Very high	93.8	Very high	3 Å²	3	30.8 Å²	30.8	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	109.3	171.8	-50.7	-72.8	0	0	0	109.1	W880 V910 V913 P914 H941 S986 L987 R989 I993 S997	W880-Y995 HydrophobicContact CB-CD1 3.67Å; W880-Y995 HydrophobicContact CB-CE1 3.83Å; V910-Y995 PolarHBondContact O-OH 2.73Å; V913-Y995 HydrophobicContact CB-CE1 4.37Å; V913-Y995 HydrophobicContact CG1-CD1 3.87Å; V913-Y995 HydrophobicContact CG1-CE1 4.12Å; V913-Y995 HydrophobicContact CG2-CE1 4.01Å; P914-Y995 VanDerWaalsContact CD-CD2 3.44Å; P914-Y995 VanDerWaalsContact CD-CE2 3.46Å; P914-Y995 HydrophobicContact CG-CD1 4.41Å; P914-Y995 HydrophobicContact CG-CD2 3.31Å; P914-Y995 HydrophobicContact CG-CE2 3.77Å; P914-Y995 HydrophobicContact CG-CG 3.66Å; H941-Y995 AromaticContact NE2-CE2 3.73Å; S986-Y995 WeakPolarHBondContact CA-O 3.06Å; L987-Y995 HydrophobicContact CB-CD2 4.46Å; L987-Y995 PolarHBondContact N-O 2.99Å; L987-Y995 WeakPolarHBondContact O-CB 3.44Å; L987-Y995 WeakPolarHBondContact O-CD2 3.18Å; L987-Y995 PolarHBondContact O-N 2.92Å; R989-Y995 HydrophobicContact CB-CE2 3.98Å; R989-Y995 WeakPolarHBondContact CD-OH 3.16Å; R989-Y995 PolarHBondContact NH1-OH 2.56Å; I993-Y995 HydrophobicContact CG2-CD1 4.43Å; I993-Y995 HydrophobicContact CG2-CE1 3.83Å; I993-Y995 HydrophobicContact CG2-CE2 4.48Å; Y995-S997 PolarHBondContact O-N 3.22Å
996	A	94.9	Very high	93.1	Very high	16 Å²	16	32.6 Å²	32.6	13%	0.132	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	123.4	174	0	0	0	0	0	110.1	G998	A996-G998 VanDerWaalsContact C-N 3.3Å; A996-G998 PolarHBondContact O-N 2.88Å
997	S	93.8	Very high	92	Very high	26 Å²	26	39.4 Å²	39.4	18%	0.182	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-22.9	178.3	67.5	0	0	0	0	113.4	I985 Y995 L999	I985-S997 WeakPolarHBondContact O-CB 3.45Å; I985-S997 PolarHBondContact O-N 2.33Å; I985-S997 PolarHBondContact O-OG 2.95Å; Y995-S997 PolarHBondContact O-N 3.22Å; S997-L999 PolarHBondContact O-N 2.98Å; S997-L999 PolarHBondContact OG-N 2.65Å; S997-L999 PolarHBondContact OG-O 2.63Å
998	G	90.5	Very high	90.9	Very high	65 Å²	65	40.3 Å²	40.3	67%	0.67	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	73.7	7.1	-167.4	0	0	0	0	0	114	A996	A996-G998 VanDerWaalsContact C-N 3.3Å; A996-G998 PolarHBondContact O-N 2.88Å
999	L	94	Very high	89.8	Confident	66 Å²	66	44.5 Å²	44.5	35%	0.346	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	155.3	-179.2	-60	177.1	0	0	0	111.3	V916 M919 I985 S997	V916-L999 HydrophobicContact CB-CD1 4.28Å; V916-L999 HydrophobicContact CG1-CD1 3.6Å; M919-L999 HydrophobicContact CE-CB 4.48Å; M919-L999 HydrophobicContact CG-CD1 3.96Å; M919-L999 HydrophobicContact SD-CB 3.68Å; M919-L999 HydrophobicContact SD-CD1 3.52Å; M919-L999 VanDerWaalsContact SD-CD1 3.52Å; M919-L999 HydrophobicContact SD-CG 4.26Å; I985-L999 PolarHBondContact N-O 3.12Å; S997-L999 PolarHBondContact O-N 2.98Å; S997-L999 PolarHBondContact OG-N 2.65Å; S997-L999 PolarHBondContact OG-O 2.63Å
1000	T	95.5	Very high	88.6	Confident	50 Å²	50	50.8 Å²	50.8	31%	0.307	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	157.1	178.7	56.7	0	0	0	0	110.9	Y431 E982 V983	Y431-T1000 HydrophobicContact CE2-CG2 3.7Å; Y431-T1000 WeakPolarHBondContact OH-CG2 3.26Å; E982-T1000 HydrophobicContact CG-CG2 4.01Å; E982-T1000 WeakPolarHBondContact OE1-CB 3.3Å; E982-T1000 WeakPolarHBondContact OE1-CG2 3.28Å; E982-T1000 PolarHBondContact OE1-OG1 3.4Å; V983-T1000 CarbonylContact O-C 3.58Å; V983-T1000 WeakPolarHBondContact O-CA 3.35Å
1001	F	94.9	Very high	87.5	Confident	25 Å²	25	55.4 Å²	55.4	11%	0.11	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	136.5	170.5	179.5	-86	0	0	0	108.9	V921 L930 F945 V964 V983 I985 Y1003	V921-F1001 HydrophobicContact CG2-CD2 4.49Å; V921-F1001 HydrophobicContact CG2-CE2 3.76Å; L930-F1001 HydrophobicContact CD1-CD2 4.11Å; L930-F1001 HydrophobicContact CD1-CE2 4.38Å; F945-F1001 HydrophobicContact CD1-CB 4.23Å; F945-F1001 HydrophobicContact CD1-CD1 4.19Å; F945-F1001 HydrophobicContact CD1-CG 4.18Å; F945-F1001 HydrophobicContact CE1-CB 4.15Å; F945-F1001 HydrophobicContact CE1-CD1 4Å; F945-F1001 HydrophobicContact CE1-CD2 4.05Å; F945-F1001 HydrophobicContact CE1-CE1 4.45Å; F945-F1001 HydrophobicContact CE1-CE2 4.46Å; F945-F1001 AromaticContact CE1-CG 3.79Å; F945-F1001 HydrophobicContact CE1-CG 3.79Å; V964-F1001 HydrophobicContact CB-CZ 4.41Å; V964-F1001 HydrophobicContact CG1-CE1 3.71Å; V964-F1001 HydrophobicContact CG1-CE2 4.38Å; V964-F1001 HydrophobicContact CG1-CZ 3.57Å; V964-F1001 HydrophobicContact CG2-CE2 3.95Å; V964-F1001 HydrophobicContact CG2-CZ 3.88Å; V983-F1001 PolarHBondContact N-O 2.84Å; V983-F1001 PolarHBondContact O-N 3.02Å; I985-F1001 HydrophobicContact CD1-CB 3.89Å; I985-F1001 HydrophobicContact CG1-CB 4.02Å; F1001-Y1003 AromaticContact CD1-CD2 3.72Å; F1001-Y1003 HydrophobicContact CD1-CD2 3.72Å; F1001-Y1003 AromaticContact CD1-CE2 3.49Å; F1001-Y1003 HydrophobicContact CD1-CE2 3.49Å; F1001-Y1003 VanDerWaalsContact CD1-CE2 3.49Å; F1001-Y1003 HydrophobicContact CD1-CG 4.38Å; F1001-Y1003 AromaticContact CD1-CZ 4Å; F1001-Y1003 HydrophobicContact CE1-CD1 4.07Å; F1001-Y1003 AromaticContact CE1-CD2 3.76Å; F1001-Y1003 HydrophobicContact CE1-CD2 3.76Å; F1001-Y1003 AromaticContact CE1-CE1 3.94Å; F1001-Y1003 HydrophobicContact CE1-CE1 3.94Å; F1001-Y1003 AromaticContact CE1-CE2 3.6Å; F1001-Y1003 HydrophobicContact CE1-CE2 3.6Å; F1001-Y1003 AromaticContact CE1-CG 3.98Å; F1001-Y1003 HydrophobicContact CE1-CG 3.98Å; F1001-Y1003 AromaticContact CE1-CZ 3.7Å
1002	T	94.1	Very high	86.5	Confident	44 Å²	44	58.5 Å²	58.5	27%	0.27	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.7	-173.5	-60.9	0	0	0	0	111.2	T980 L981	T980-T1002 HydrophobicContact CG2-CG2 3.45Å; T980-T1002 VanDerWaalsContact CG2-CG2 3.45Å; L981-T1002 WeakPolarHBondContact O-CA 3.38Å
1003	Y	91.4	Very high	85.5	Confident	13 Å²	13	61.3 Å²	61.3	5%	0.051	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.4	168.5	-68.9	-95.6	0	0	0	108.7	V964 P965 I967 F970 I977 T980 L981 V983 F1001	V964-Y1003 HydrophobicContact CG1-CE1 3.83Å; V964-Y1003 WeakPolarHBondContact CG1-OH 3.46Å; P965-Y1003 WeakPolarHBondContact O-CE1 3.37Å; P965-Y1003 PolarHBondContact O-OH 2.87Å; I967-Y1003 HydrophobicContact CD1-CD1 4.15Å; I967-Y1003 HydrophobicContact CD1-CG 4.14Å; F970-Y1003 AromaticContact CE2-CE2 3.97Å; F970-Y1003 HydrophobicContact CE2-CE2 3.97Å; F970-Y1003 AromaticContact CE2-CZ 3.79Å; F970-Y1003 WeakPolarHBondContact CE2-OH 3.31Å; F970-Y1003 HydrophobicContact CZ-CE2 4.31Å; I977-Y1003 HydrophobicContact CD1-CD1 3.93Å; I977-Y1003 HydrophobicContact CD1-CG 4.43Å; I977-Y1003 HydrophobicContact CG1-CD1 4.34Å; T980-Y1003 VanDerWaalsContact CA-O 3.31Å; T980-Y1003 WeakPolarHBondContact CA-O 3.28Å; L981-Y1003 HydrophobicContact CD2-CD2 4.44Å; L981-Y1003 PolarHBondContact N-O 3.32Å; L981-Y1003 VanDerWaalsContact N-O 3.13Å; L981-Y1003 PolarHBondContact O-N 3.49Å; V983-Y1003 HydrophobicContact CG2-CD2 3.96Å; V983-Y1003 HydrophobicContact CG2-CE2 3.85Å; F1001-Y1003 AromaticContact CD1-CD2 3.72Å; F1001-Y1003 HydrophobicContact CD1-CD2 3.72Å; F1001-Y1003 AromaticContact CD1-CE2 3.49Å; F1001-Y1003 HydrophobicContact CD1-CE2 3.49Å; F1001-Y1003 VanDerWaalsContact CD1-CE2 3.49Å; F1001-Y1003 HydrophobicContact CD1-CG 4.38Å; F1001-Y1003 AromaticContact CD1-CZ 4Å; F1001-Y1003 HydrophobicContact CE1-CD1 4.07Å; F1001-Y1003 AromaticContact CE1-CD2 3.76Å; F1001-Y1003 HydrophobicContact CE1-CD2 3.76Å; F1001-Y1003 AromaticContact CE1-CE1 3.94Å; F1001-Y1003 HydrophobicContact CE1-CE1 3.94Å; F1001-Y1003 AromaticContact CE1-CE2 3.6Å; F1001-Y1003 HydrophobicContact CE1-CE2 3.6Å; F1001-Y1003 AromaticContact CE1-CG 3.98Å; F1001-Y1003 HydrophobicContact CE1-CG 3.98Å; F1001-Y1003 AromaticContact CE1-CZ 3.7Å
1004	H	89.1	Confident	84.7	Confident	127 Å²	127	66.1 Å²	66.1	59%	0.588	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-94.4	142.4	-179.3	-67.5	-63.6	0	0	0	112.3	I977	I977-H1004 WeakPolarHBondContact CB-O 3.18Å; I977-H1004 WeakPolarHBondContact CD1-O 3.5Å; I977-H1004 WeakPolarHBondContact CG2-O 3.25Å
1005	P	86.4	Confident	83.7	Confident	72 Å²	72	69.9 Å²	69.9	47%	0.468	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-56.8	145.7	-178.8	-26.3	34.3	0	0	0	114.9	I977 T980	I977-P1005 CarbonylContact O-C 3.54Å; I977-P1005 VanDerWaalsContact O-CA 3.3Å; I977-P1005 WeakPolarHBondContact O-CA 3.41Å; T980-P1005 WeakPolarHBondContact OG1-CD 3.34Å
1006	E	82.3	Confident	82.5	Confident	40 Å²	40	70.1 Å²	70.1	19%	0.187	40%	0.402	C	S	.	.			trans	-111.3	147.3	179	-63.3	176.5	-155.8	0	0	111.4	Y976 I977 G1008 R1010	Y976-E1006 HydrophobicContact CD2-CB 4.17Å; I977-E1006 HydrophobicContact CB-CG 4.2Å; I977-E1006 HydrophobicContact CD1-CG 4.3Å; I977-E1006 VanDerWaalsContact CD1-OE1 3.26Å; I977-E1006 WeakPolarHBondContact CD1-OE1 3.46Å; I977-E1006 HydrophobicContact CG1-CG 4.45Å; I977-E1006 WeakPolarHBondContact CG1-OE1 3.36Å; I977-E1006 PolarHBondContact O-N 2.91Å; E1006-G1008 PolarHBondContact O-N 2.79Å; E1006-G1008 VanDerWaalsContact O-N 3.1Å; E1006-R1010 VanDerWaalsContact CD-CZ 3.47Å; E1006-R1010 IonicContact OE1-CZ 3.25Å; E1006-R1010 IonicContact OE1-NE 3.64Å; E1006-R1010 PolarHBondContact OE1-NE 2.87Å; E1006-R1010 IonicContact OE1-NH2 2.7Å; E1006-R1010 PolarHBondContact OE1-NH2 2.75Å; E1006-R1010 WeakPolarHBondContact OE2-CG 3.38Å; E1006-R1010 IonicContact OE2-CZ 2.68Å; E1006-R1010 IonicContact OE2-NE 3.84Å; E1006-R1010 PolarHBondContact OE2-NE 3.41Å; E1006-R1010 IonicContact OE2-NH2 4Å
1007	S	73.6	Confident	81.7	Confident	143 Å²	143	71.7 Å²	71.7	100%	1	41%	0.408	S	S	*	.	S	Bend	trans	-68.5	-4.8	178.7	-52.2	0	0	0	0	114.5
1008	G	72.8	Confident	81.1	Confident	22 Å²	22	75.8 Å²	75.8	23%	0.227	42%	0.424	C	S	.	.	S	Bend	trans	155.6	176.6	-176.5	0	0	0	0	0	111.3	E1006	E1006-G1008 PolarHBondContact O-N 2.79Å; E1006-G1008 VanDerWaalsContact O-N 3.1Å
1009	P	74	Confident	80.6	Confident	91 Å²	91	75.7 Å²	75.7	59%	0.591	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-64.8	133.7	-179.7	27.3	-34.6	0	0	0	112.3	Y976	Y976-P1009 HydrophobicContact CD1-CB 4.09Å; Y976-P1009 HydrophobicContact CD1-CG 4.44Å
1010	R	69.6	Low	79.8	Confident	134 Å²	134	74.2 Å²	74.2	51%	0.506	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-77.3	157.4	174	-55.4	-176.9	-150.2	-137.9	13.6	110.9	E1006	E1006-R1010 VanDerWaalsContact CD-CZ 3.47Å; E1006-R1010 IonicContact OE1-CZ 3.25Å; E1006-R1010 IonicContact OE1-NE 3.64Å; E1006-R1010 PolarHBondContact OE1-NE 2.87Å; E1006-R1010 IonicContact OE1-NH2 2.7Å; E1006-R1010 PolarHBondContact OE1-NH2 2.75Å; E1006-R1010 WeakPolarHBondContact OE2-CG 3.38Å; E1006-R1010 IonicContact OE2-CZ 2.68Å; E1006-R1010 IonicContact OE2-NE 3.84Å; E1006-R1010 PolarHBondContact OE2-NE 3.41Å; E1006-R1010 IonicContact OE2-NH2 4Å
1011	Q	68.3	Low	79.2	Confident	194 Å²	194	77.8 Å²	77.8	91%	0.907	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-81.2	118.4	162.9	-69.4	-178.7	-17.4	0	0	108.7
1012	H	71.4	Confident	78.5	Confident	97 Å²	97	79.4 Å²	79.4	45%	0.449	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-68.7	137.5	178.9	-61.8	-74	0	0	0	112.4	D926 Q1014 L1017	D926-H1012 IonicContact OD1-CE1 3.87Å; D926-H1012 IonicContact OD1-CG 3.71Å; D926-H1012 IonicContact OD1-ND1 2.94Å; D926-H1012 PolarHBondContact OD1-ND1 2.96Å; D926-H1012 VanDerWaalsContact OD2-CA 3.29Å; D926-H1012 WeakPolarHBondContact OD2-CA 3.14Å; D926-H1012 IonicContact OD2-ND1 3.36Å; H1012-Q1014 PolarHBondContact O-N 2.83Å; H1012-L1017 HydrophobicContact CB-CD1 3.8Å
1013	C	71.1	Confident	77.7	Confident	59 Å²	59	78.1 Å²	78.1	40%	0.399	42%	0.419	S	S	.	.			trans	-79.1	93.2	174	-174.8	0	0	0	0	110	D926 A1016 L1017	D926-C1013 PolarHBondContact OD2-N 2.97Å; C1013-A1016 HydrophobicContact CB-CB 4.02Å; C1013-A1016 WeakPolarHBondContact O-CB 3.37Å; C1013-A1016 PolarHBondContact O-N 2.84Å; C1013-L1017 PolarHBondContact O-N 2.63Å; C1013-L1017 VanDerWaalsContact O-N 3.07Å
1014	Q	77	Confident	76.9	Confident	102 Å²	102	79.6 Å²	79.6	48%	0.477	43%	0.431	S	S	.	.	H	α-helix	trans	-52.7	-42.4	-177.8	-63.4	-60.3	-34.6	0	0	114.2	H1012 A1016 L1017 E1018	H1012-Q1014 PolarHBondContact O-N 2.83Å; Q1014-A1016 VanDerWaalsContact C-N 3.29Å; Q1014-A1016 PolarHBondContact O-N 2.87Å; Q1014-L1017 PolarHBondContact O-N 2.71Å; Q1014-E1018 WeakPolarHBondContact O-CG 3.42Å; Q1014-E1018 PolarHBondContact O-N 3.06Å
1015	P	75.7	Confident	76.6	Confident	79 Å²	79	79 Å²	79	51%	0.513	43%	0.431	S	S	.	.	H	α-helix	trans	-59.6	-35.3	174.4	-25.7	35.8	0	0	0	113.8	E1018 I1019	P1015-E1018 PolarHBondContact O-N 3.15Å; P1015-I1019 WeakPolarHBondContact O-CD1 3.49Å; P1015-I1019 VanDerWaalsContact O-CG1 3.27Å; P1015-I1019 WeakPolarHBondContact O-CG1 3.42Å; P1015-I1019 PolarHBondContact O-N 3.35Å; P1015-I1019 VanDerWaalsContact O-N 3.08Å
1016	A	72.9	Confident	76.2	Confident	7 Å²	7	78.3 Å²	78.3	6%	0.058	43%	0.432	C	S	.	.	H	α-helix	trans	-71.3	-43	176.4	0	0	0	0	0	111.7	V927 C1013 Q1014 E1018 I1019 I1020	V927-A1016 HydrophobicContact CG1-CB 4.35Å; V927-A1016 HydrophobicContact CG2-CB 3.63Å; C1013-A1016 HydrophobicContact CB-CB 4.02Å; C1013-A1016 WeakPolarHBondContact O-CB 3.37Å; C1013-A1016 PolarHBondContact O-N 2.84Å; Q1014-A1016 VanDerWaalsContact C-N 3.29Å; Q1014-A1016 PolarHBondContact O-N 2.87Å; A1016-E1018 VanDerWaalsContact C-N 3.26Å; A1016-E1018 PolarHBondContact O-N 3.39Å; A1016-I1019 PolarHBondContact O-N 3.48Å; A1016-I1019 VanDerWaalsContact O-N 3.17Å; A1016-I1020 WeakPolarHBondContact O-CD1 3.24Å; A1016-I1020 VanDerWaalsContact O-CG1 3.3Å; A1016-I1020 WeakPolarHBondContact O-CG1 3.45Å; A1016-I1020 PolarHBondContact O-N 2.98Å
1017	L	77.8	Confident	75.6	Confident	49 Å²	49	78.1 Å²	78.1	26%	0.257	44%	0.437	S	S	.	.	H	α-helix	trans	-60.4	-35.5	173.8	-67	-178.6	0	0	0	112.1	D926 H1012 C1013 Q1014 R1021	D926-L1017 HydrophobicContact CB-CD2 3.94Å; D926-L1017 HydrophobicContact CB-CG 4.47Å; H1012-L1017 HydrophobicContact CB-CD1 3.8Å; C1013-L1017 PolarHBondContact O-N 2.63Å; C1013-L1017 VanDerWaalsContact O-N 3.07Å; Q1014-L1017 PolarHBondContact O-N 2.71Å; L1017-R1021 WeakPolarHBondContact O-CB 3.45Å; L1017-R1021 PolarHBondContact O-N 3.11Å
1018	E	80.4	Confident	75.5	Confident	112 Å²	112	75.2 Å²	75.2	52%	0.523	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-44.2	172.6	-78.5	175.2	-175.9	0	0	112.6	Q1014 P1015 A1016 R1021 A1022	Q1014-E1018 WeakPolarHBondContact O-CG 3.42Å; Q1014-E1018 PolarHBondContact O-N 3.06Å; P1015-E1018 PolarHBondContact O-N 3.15Å; A1016-E1018 VanDerWaalsContact C-N 3.26Å; A1016-E1018 PolarHBondContact O-N 3.39Å; E1018-R1021 PolarHBondContact O-N 3.26Å; E1018-A1022 WeakPolarHBondContact O-CB 3.37Å; E1018-A1022 PolarHBondContact O-N 3.13Å
1019	I	80.1	Confident	75.6	Confident	64 Å²	64	77.1 Å²	77.1	33%	0.328	43%	0.427	S	S	.	.	H	α-helix	trans	-64.6	-43.1	176.9	-64.4	160.3	0	0	0	111.2	F121 P1015 A1016 R1021 A1022 A1023	F121-I1019 HydrophobicContact CD2-CG2 3.78Å; F121-I1019 HydrophobicContact CE2-CB 4.44Å; F121-I1019 HydrophobicContact CE2-CG2 3.67Å; P1015-I1019 WeakPolarHBondContact O-CD1 3.49Å; P1015-I1019 VanDerWaalsContact O-CG1 3.27Å; P1015-I1019 WeakPolarHBondContact O-CG1 3.42Å; P1015-I1019 PolarHBondContact O-N 3.35Å; P1015-I1019 VanDerWaalsContact O-N 3.08Å; A1016-I1019 PolarHBondContact O-N 3.48Å; A1016-I1019 VanDerWaalsContact O-N 3.17Å; I1019-R1021 VanDerWaalsContact C-N 3.35Å; I1019-R1021 PolarHBondContact O-N 3.39Å; I1019-A1022 PolarHBondContact O-N 2.92Å; I1019-A1023 WeakPolarHBondContact O-CB 3.42Å; I1019-A1023 PolarHBondContact O-N 2.82Å
1020	I	77.3	Confident	75.3	Confident	34 Å²	34	74.1 Å²	74.1	17%	0.174	41%	0.41	C	S	.	.	H	α-helix	trans	-63.8	-41.4	177.4	-66.3	161.1	0	0	0	110.6	D926 F963 A1016 A1023 S1024	D926-I1020 WeakPolarHBondContact O-CD1 3.39Å; F963-I1020 HydrophobicContact CD1-CG1 4.46Å; F963-I1020 HydrophobicContact CD2-CG1 4.45Å; F963-I1020 HydrophobicContact CD2-CG2 4.34Å; F963-I1020 HydrophobicContact CE1-CD1 4.45Å; F963-I1020 HydrophobicContact CE1-CG1 4.03Å; F963-I1020 HydrophobicContact CE2-CG1 4Å; F963-I1020 HydrophobicContact CE2-CG2 4.38Å; F963-I1020 HydrophobicContact CZ-CG1 3.8Å; A1016-I1020 WeakPolarHBondContact O-CD1 3.24Å; A1016-I1020 VanDerWaalsContact O-CG1 3.3Å; A1016-I1020 WeakPolarHBondContact O-CG1 3.45Å; A1016-I1020 PolarHBondContact O-N 2.98Å; I1020-A1023 PolarHBondContact O-N 3.49Å; I1020-S1024 WeakPolarHBondContact O-CB 3.37Å; I1020-S1024 PolarHBondContact O-N 2.7Å; I1020-S1024 PolarHBondContact O-OG 3.18Å
1021	R	82.5	Confident	75.1	Confident	125 Å²	125	69 Å²	69	47%	0.472	40%	0.396	S	S	.	.	H	α-helix	trans	-63	-44.6	174.3	-170.8	-173.5	-55.9	123.2	5.3	111.7	L1017 E1018 I1019 S1024 I1025	L1017-R1021 WeakPolarHBondContact O-CB 3.45Å; L1017-R1021 PolarHBondContact O-N 3.11Å; E1018-R1021 PolarHBondContact O-N 3.26Å; I1019-R1021 VanDerWaalsContact C-N 3.35Å; I1019-R1021 PolarHBondContact O-N 3.39Å; R1021-S1024 PolarHBondContact O-N 3.09Å; R1021-I1025 HydrophobicContact CG-CD1 4.11Å; R1021-I1025 VanDerWaalsContact O-CG1 3.3Å; R1021-I1025 WeakPolarHBondContact O-CG1 3.45Å; R1021-I1025 PolarHBondContact O-N 2.93Å
1022	A	81.6	Confident	75.2	Confident	59 Å²	59	62.4 Å²	62.4	49%	0.488	38%	0.375	S	S	.	.	H	α-helix	trans	-64.4	-44.1	177.2	0	0	0	0	0	112	E1018 I1019 S1024 I1025 A1026	E1018-A1022 WeakPolarHBondContact O-CB 3.37Å; E1018-A1022 PolarHBondContact O-N 3.13Å; I1019-A1022 PolarHBondContact O-N 2.92Å; A1022-S1024 VanDerWaalsContact C-N 3.32Å; A1022-S1024 PolarHBondContact O-N 3.35Å; A1022-I1025 PolarHBondContact O-N 3.16Å; A1022-A1026 WeakPolarHBondContact O-CB 3.27Å; A1022-A1026 PolarHBondContact O-N 3.01Å
1023	A	76.5	Confident	75	Confident	17 Å²	17	60.8 Å²	60.8	14%	0.14	38%	0.378	C	S	.	.	H	α-helix	trans	-61.8	-39.2	174.4	0	0	0	0	0	112	Q951 I1019 I1020 A1027	Q951-A1023 VanDerWaalsContact NE2-C 3.28Å; Q951-A1023 PolarHBondContact NE2-O 2.61Å; I1019-A1023 WeakPolarHBondContact O-CB 3.42Å; I1019-A1023 PolarHBondContact O-N 2.82Å; I1020-A1023 PolarHBondContact O-N 3.49Å; A1023-A1027 WeakPolarHBondContact O-CB 3.43Å; A1023-A1027 PolarHBondContact O-N 2.9Å
1024	S	75.2	Confident	74.5	Confident	44 Å²	44	60.4 Å²	60.4	31%	0.308	38%	0.379	S	S	.	.	H	α-helix	trans	-64.1	-47.6	175.6	-62.7	0	0	0	0	111.7	I1020 R1021 A1022 A1026 A1027 V1028	I1020-S1024 WeakPolarHBondContact O-CB 3.37Å; I1020-S1024 PolarHBondContact O-N 2.7Å; I1020-S1024 PolarHBondContact O-OG 3.18Å; R1021-S1024 PolarHBondContact O-N 3.09Å; A1022-S1024 VanDerWaalsContact C-N 3.32Å; A1022-S1024 PolarHBondContact O-N 3.35Å; S1024-A1026 PolarHBondContact O-N 3.07Å; S1024-A1027 PolarHBondContact O-N 3.41Å; S1024-V1028 WeakPolarHBondContact O-CG2 3.49Å; S1024-V1028 PolarHBondContact O-N 3.12Å
1025	I	81.3	Confident	73.7	Confident	114 Å²	114	58.3 Å²	58.3	59%	0.585	38%	0.379	S	S	*	.	H	α-helix	trans	-61.6	-43.4	176.9	-68.5	164.4	0	0	0	110.9	R1021 A1022 A1027 V1028 A1029	R1021-I1025 HydrophobicContact CG-CD1 4.11Å; R1021-I1025 VanDerWaalsContact O-CG1 3.3Å; R1021-I1025 WeakPolarHBondContact O-CG1 3.45Å; R1021-I1025 PolarHBondContact O-N 2.93Å; A1022-I1025 PolarHBondContact O-N 3.16Å; I1025-A1027 VanDerWaalsContact C-N 3.35Å; I1025-A1027 PolarHBondContact O-N 3.39Å; I1025-V1028 PolarHBondContact O-N 3.08Å; I1025-A1029 WeakPolarHBondContact O-CB 3.36Å; I1025-A1029 PolarHBondContact O-N 2.94Å
1026	A	78.3	Confident	72.9	Confident	59 Å²	59	58 Å²	58	49%	0.488	38%	0.379	S	S	.	.	H	α-helix	trans	-62.5	-39.6	177.5	0	0	0	0	0	112.5	A1022 S1024 A1029 A1030	A1022-A1026 WeakPolarHBondContact O-CB 3.27Å; A1022-A1026 PolarHBondContact O-N 3.01Å; S1024-A1026 PolarHBondContact O-N 3.07Å; A1026-A1029 PolarHBondContact O-N 3.14Å; A1026-A1030 WeakPolarHBondContact O-CB 3.31Å; A1026-A1030 PolarHBondContact O-N 3.36Å
1027	A	69.6	Low	71.8	Confident	36 Å²	36	60.4 Å²	60.4	30%	0.298	40%	0.399	S	S	.	.	H	α-helix	trans	-65.1	-43.3	175.8	0	0	0	0	0	112.3	A1023 S1024 I1025 A1030 A1031	A1023-A1027 WeakPolarHBondContact O-CB 3.43Å; A1023-A1027 PolarHBondContact O-N 2.9Å; S1024-A1027 PolarHBondContact O-N 3.41Å; I1025-A1027 VanDerWaalsContact C-N 3.35Å; I1025-A1027 PolarHBondContact O-N 3.39Å; A1027-A1030 PolarHBondContact O-N 3.02Å; A1027-A1031 WeakPolarHBondContact O-CB 3.41Å; A1027-A1031 PolarHBondContact O-N 3.04Å
1028	V	72.9	Confident	70.5	Confident	82 Å²	82	62.7 Å²	62.7	50%	0.497	42%	0.415	S	S	.	.	H	α-helix	trans	-64.5	-42.7	175.8	173.1	0	0	0	0	111.4	S1024 I1025 A1030 A1031 A1032	S1024-V1028 WeakPolarHBondContact O-CG2 3.49Å; S1024-V1028 PolarHBondContact O-N 3.12Å; I1025-V1028 PolarHBondContact O-N 3.08Å; V1028-A1030 PolarHBondContact O-N 3.12Å; V1028-A1031 WeakPolarHBondContact O-CB 3.19Å; V1028-A1031 PolarHBondContact O-N 3.25Å; V1028-A1032 PolarHBondContact O-N 2.93Å
1029	A	73.7	Confident	68.8	Low	61 Å²	61	62.1 Å²	62.1	50%	0.504	42%	0.419	S	S	.	.	H	α-helix	trans	-61.9	-41.7	176.5	0	0	0	0	0	112.2	I1025 A1026 A1032 A1033	I1025-A1029 WeakPolarHBondContact O-CB 3.36Å; I1025-A1029 PolarHBondContact O-N 2.94Å; A1026-A1029 PolarHBondContact O-N 3.14Å; A1029-A1032 PolarHBondContact O-N 3.43Å; A1029-A1033 WeakPolarHBondContact O-CB 3.44Å; A1029-A1033 PolarHBondContact O-N 3.03Å
1030	A	69.1	Low	66.9	Low	28 Å²	28	62.9 Å²	62.9	23%	0.231	43%	0.43	C	S	.	.	H	α-helix	trans	-68.2	-35.1	176.2	0	0	0	0	0	112.7	F110 A1026 A1027 V1028 A1033 A1034	F110-A1030 HydrophobicContact CE1-CB 3.61Å; F110-A1030 HydrophobicContact CZ-CB 3.51Å; A1026-A1030 WeakPolarHBondContact O-CB 3.31Å; A1026-A1030 PolarHBondContact O-N 3.36Å; A1027-A1030 PolarHBondContact O-N 3.02Å; V1028-A1030 PolarHBondContact O-N 3.12Å; A1030-A1033 PolarHBondContact O-N 3.41Å; A1030-A1034 PolarHBondContact O-N 3.03Å
1031	A	65	Low	65.2	Low	28 Å²	28	65.4 Å²	65.4	23%	0.231	45%	0.451	C	S	.	.	H	α-helix	trans	-61.8	-48.6	172.6	0	0	0	0	0	111.9	L516 A1027 V1028 A1033 A1034 A1035	L516-A1031 HydrophobicContact CD2-CB 3.59Å; L516-A1031 HydrophobicContact CG-CB 4.44Å; A1027-A1031 WeakPolarHBondContact O-CB 3.41Å; A1027-A1031 PolarHBondContact O-N 3.04Å; V1028-A1031 WeakPolarHBondContact O-CB 3.19Å; V1028-A1031 PolarHBondContact O-N 3.25Å; A1031-A1033 VanDerWaalsContact C-N 3.34Å; A1031-A1033 PolarHBondContact O-N 3Å; A1031-A1034 PolarHBondContact O-N 3.18Å; A1031-A1035 PolarHBondContact O-N 3Å
1032	A	69.1	Low	63	Low	55 Å²	55	66 Å²	66	46%	0.455	46%	0.463	S	S	.	.	H	α-helix	trans	-62.6	-39	177.8	0	0	0	0	0	112.4	V1028 A1029 A1035 S1036	V1028-A1032 PolarHBondContact O-N 2.93Å; A1029-A1032 PolarHBondContact O-N 3.43Å; A1032-A1035 PolarHBondContact O-N 3.18Å; A1032-S1036 WeakPolarHBondContact O-CB 3.47Å; A1032-S1036 PolarHBondContact O-N 3.11Å; A1032-S1036 PolarHBondContact O-OG 3.5Å
1033	A	67.1	Low	60.8	Low	63 Å²	63	67.3 Å²	67.3	52%	0.521	47%	0.469	S	S	.	.	H	α-helix	trans	-63.1	-43.4	174.5	0	0	0	0	0	112.2	A1029 A1030 A1031 S1036 A1037	A1029-A1033 WeakPolarHBondContact O-CB 3.44Å; A1029-A1033 PolarHBondContact O-N 3.03Å; A1030-A1033 PolarHBondContact O-N 3.41Å; A1031-A1033 VanDerWaalsContact C-N 3.34Å; A1031-A1033 PolarHBondContact O-N 3Å; A1033-S1036 PolarHBondContact O-N 3.48Å; A1033-A1037 PolarHBondContact O-N 3.44Å; A1033-A1037 VanDerWaalsContact O-N 3.12Å
1034	A	61.5	Low	58.6	Low	51 Å²	51	74.7 Å²	74.7	42%	0.421	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-44.9	176.8	0	0	0	0	0	112.2	A1030 A1031 S1036 A1037 V1038	A1030-A1034 PolarHBondContact O-N 3.03Å; A1031-A1034 PolarHBondContact O-N 3.18Å; A1034-S1036 VanDerWaalsContact C-N 3.31Å; A1034-S1036 PolarHBondContact O-N 2.95Å; A1034-A1037 PolarHBondContact O-N 3.21Å; A1034-V1038 PolarHBondContact O-N 3.03Å
1035	A	59.3	Low	56.5	Low	57 Å²	57	77.3 Å²	77.3	47%	0.471	52%	0.523	S	S	.	.	H	α-helix	trans	-62.3	-37.2	175.6	0	0	0	0	0	112.8	A1031 A1032 V1038 T1039	A1031-A1035 PolarHBondContact O-N 3Å; A1032-A1035 PolarHBondContact O-N 3.18Å; A1035-V1038 PolarHBondContact O-N 3.16Å; A1035-T1039 PolarHBondContact O-N 3.28Å; A1035-T1039 VanDerWaalsContact O-N 3.08Å; A1035-T1039 PolarHBondContact O-OG1 3.26Å
1036	S	60.1	Low	54.1	Low	73 Å²	73	78.2 Å²	78.2	51%	0.51	54%	0.535	S	S	.	.	H	α-helix	trans	-66.1	-37.8	177.9	-59.2	0	0	0	0	112.6	A1032 A1033 A1034 T1039 S1040	A1032-S1036 WeakPolarHBondContact O-CB 3.47Å; A1032-S1036 PolarHBondContact O-N 3.11Å; A1032-S1036 PolarHBondContact O-OG 3.5Å; A1033-S1036 PolarHBondContact O-N 3.48Å; A1034-S1036 VanDerWaalsContact C-N 3.31Å; A1034-S1036 PolarHBondContact O-N 2.95Å; S1036-T1039 PolarHBondContact O-N 3.28Å; S1036-S1040 WeakPolarHBondContact O-CB 3.23Å; S1036-S1040 PolarHBondContact O-N 2.99Å; S1036-S1040 PolarHBondContact O-OG 3.28Å
1037	A	49.6	Very low	52	Low	58 Å²	58	81.1 Å²	81.1	48%	0.479	55%	0.551	S	S	.	*	H	α-helix	trans	-67.7	-35.3	175.9	0	0	0	0	0	113.3	A1033 A1034 S1040 S1041	A1033-A1037 PolarHBondContact O-N 3.44Å; A1033-A1037 VanDerWaalsContact O-N 3.12Å; A1034-A1037 PolarHBondContact O-N 3.21Å; A1037-S1040 PolarHBondContact O-OG 2.91Å; A1037-S1041 PolarHBondContact O-OG 3.07Å
1038	V	49.9	Very low	50.3	Low	96 Å²	96	88.5 Å²	88.5	58%	0.582	58%	0.579	S	S	*	*	H	α-helix	trans	-71.1	-36.6	174.8	176.4	0	0	0	0	111.4	A1034 A1035 S1041	A1034-V1038 PolarHBondContact O-N 3.03Å; A1035-V1038 PolarHBondContact O-N 3.16Å; V1038-S1041 PolarHBondContact O-OG 3.32Å; V1038-S1041 VanDerWaalsContact O-OG 3.11Å
1039	T	45.6	Very low	48.3	Very low	101 Å²	101	94 Å²	94	62%	0.62	60%	0.6	S	S	*	*	H	α-helix	trans	-69.2	-45.6	178.4	-53.9	0	0	0	0	111.9	A1035 S1036 S1041 N1042	A1035-T1039 PolarHBondContact O-N 3.28Å; A1035-T1039 VanDerWaalsContact O-N 3.08Å; A1035-T1039 PolarHBondContact O-OG1 3.26Å; S1036-T1039 PolarHBondContact O-N 3.28Å; T1039-S1041 PolarHBondContact O-N 3.42Å; T1039-N1042 PolarHBondContact O-N 3.45Å
1040	S	39.8	Very low	46	Very low	79 Å²	79	98.4 Å²	98.4	55%	0.552	61%	0.614	S	S	*	*	H	α-helix	trans	-71.6	-8	-176.7	48.3	0	0	0	0	115.1	S1036 A1037	S1036-S1040 WeakPolarHBondContact O-CB 3.23Å; S1036-S1040 PolarHBondContact O-N 2.99Å; S1036-S1040 PolarHBondContact O-OG 3.28Å; A1037-S1040 PolarHBondContact O-OG 2.91Å
1041	S	42.6	Very low	44.2	Very low	88 Å²	88	105.3 Å²	105.3	62%	0.615	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-7.1	173.2	37.9	0	0	0	0	114	A1037 V1038 T1039	A1037-S1041 PolarHBondContact O-OG 3.07Å; V1038-S1041 PolarHBondContact O-OG 3.32Å; V1038-S1041 VanDerWaalsContact O-OG 3.11Å; T1039-S1041 PolarHBondContact O-N 3.42Å
1042	N	36.4	Very low	42.5	Very low	137 Å²	137	111.2 Å²	111.2	73%	0.733	67%	0.673	S	S	*	*	S	Bend	trans	-102.7	3.4	177.6	-76.9	-27.9	0	0	0	114.2	T1039	T1039-N1042 PolarHBondContact O-N 3.45Å
1043	S	33.3	Very low	40.7	Very low	86 Å²	86	117.1 Å²	117.1	60%	0.601	69%	0.691	S	S	*	*			trans	-107.3	42.3	-174.1	66.8	0	0	0	0	114.7
1044	L	30.5	Very low	38.9	Very low	172 Å²	172	120.5 Å²	120.5	90%	0.901	71%	0.708	S	S	*	*			trans	-123.6	83.8	161.6	-92	88.2	0	0	0	109.6
1045	S	31.4	Very low	37.5	Very low	99 Å²	99	123.7 Å²	123.7	69%	0.692	73%	0.727	S	S	*	*			trans	-99.9	116.5	-179.8	58.4	0	0	0	0	112.1
1046	T	31	Very low	35.9	Very low	134 Å²	134	126.8 Å²	126.8	82%	0.822	74%	0.744	S	S	*	*			trans	32.8	103.2	141.7	55	0	0	0	0	118.7
1047	S	34.5	Very low	34.5	Very low	120 Å²	120	128.3 Å²	128.3	84%	0.839	76%	0.755	S	S	*	*			trans	-120.9	118.4	141.7	57.5	0	0	0	0	107.7
1048	E	33.4	Very low	33.7	Very low	190 Å²	190	130.7 Å²	130.7	89%	0.888	77%	0.767	S	S	*	*			trans	-74.2	139.2	176.8	-59.3	176.6	113	0	0	110.8
1049	E	30.3	Very low	32.7	Very low	197 Å²	197	137.1 Å²	137.1	92%	0.921	78%	0.781	S	S	*	*			trans	-152.7	152	132.7	-133.4	-178.9	146.9	0	0	111.5
1050	L	27.4	Very low	31.9	Very low	155 Å²	155	137.9 Å²	137.9	81%	0.812	79%	0.791	S	S	*	*			trans	-81.2	143	-177.1	-67.9	147.9	0	0	0	111
1051	L	29.6	Very low	31.5	Very low	172 Å²	172	137.2 Å²	137.2	90%	0.901	80%	0.797	S	S	*	*			trans	-154.6	120	150.3	-111.4	170.2	0	0	0	111.2
1052	L	30.6	Very low	30.9	Very low	152 Å²	152	140.9 Å²	140.9	80%	0.796	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-83.4	168.2	171.8	-93.5	85	0	0	0	111.8
1053	E	29.7	Very low	30.5	Very low	180 Å²	180	140.5 Å²	140.5	84%	0.841	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-56.8	150.7	176	-69.2	-163.5	141.3	0	0	114.1	S1055	E1053-S1055 PolarHBondContact O-N 3.43Å
1054	P	29.7	Very low	30.5	Very low	134 Å²	134	142.6 Å²	142.6	87%	0.87	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-74.9	121.2	-177.2	30.1	-35	0	0	0	112.5
1055	S	32.2	Very low	30.5	Very low	117 Å²	117	139.7 Å²	139.7	82%	0.818	81%	0.813	S	S	*	*			trans	-135.2	130.9	157.9	55.8	0	0	0	0	112.2	E1053	E1053-S1055 PolarHBondContact O-N 3.43Å
1056	C	26.1	Very low	30.3	Very low	122 Å²	122	140.7 Å²	140.7	82%	0.824	82%	0.82	S	S	*	*			trans	-41.6	129.9	-172	-51.4	0	0	0	0	116.9
1057	S	31.3	Very low	30.4	Very low	106 Å²	106	139.9 Å²	139.9	74%	0.741	82%	0.82	S	S	*	*				167	150	99.4	-72.5	0	0	0	0	116.1
1058	S	32.5	Very low	30	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	82%	0.817	S	S	*	*			trans	56.9	94.3	147.7	57.2	0	0	0	0	122.4
1059	R	28.4	Very low	30	Very low	231 Å²	231	138.7 Å²	138.7	87%	0.872	81%	0.813	S	S	*	*				84.2	117	105.1	-165.7	-178.6	-174.9	172.9	2.1	120.5
1060	S	29.7	Very low	29.8	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	80%	0.803	S	S	*	*			trans	65.3	136.1	156.1	56.5	0	0	0	0	119.4
1061	G	30.1	Very low	30	Very low	66 Å²	66	135.2 Å²	135.2	68%	0.68	81%	0.806	S	S	*	*			cis	163.8	-173	-4.5	0	0	0	0	0	113.6
1062	I	31.6	Very low	30	Very low	165 Å²	165	132.7 Å²	132.7	85%	0.846	79%	0.793	S	S	*	*			trans	74.6	120.8	178.9	-49.1	171.9	0	0	0	113
1063	V	27.4	Very low	29.9	Very low	128 Å²	128	132.5 Å²	132.5	78%	0.776	79%	0.793	S	S	*	*			cis	121.1	148.7	5.6	173.4	0	0	0	0	111.5
1064	V	32.2	Very low	29.9	Very low	131 Å²	131	129.8 Å²	129.8	79%	0.794	79%	0.788	S	S	*	*			trans	84.6	134.2	-178.9	-171.9	0	0	0	0	114.9
1065	S	30.5	Very low	29.9	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	78%	0.784	S	S	*	*			cis	-164.8	161	-25.7	-94.9	0	0	0	0	110.2
1066	S	28.2	Very low	29.9	Very low	120 Å²	120	129.7 Å²	129.7	84%	0.839	78%	0.782	S	S	*	*			trans	-81.3	159.6	-179.2	-36	0	0	0	0	115.1
1067	S	32.4	Very low	30	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	78%	0.784	S	S	*	*			trans	-151.9	131.2	150.6	60.8	0	0	0	0	112
1068	T	26.6	Very low	30	Very low	129 Å²	129	137.3 Å²	137.3	79%	0.791	79%	0.794	S	S	*	*			trans	-105.2	146.2	176.8	-50.5	0	0	0	0	109.9
1069	I	33	Very low	29.6	Very low	156 Å²	156	137.7 Å²	137.7	80%	0.8	80%	0.797	S	S	*	*			trans	-132.3	111.4	165.1	-60.7	-178	0	0	0	109.4
1070	E	26.4	Very low	29.7	Very low	150 Å²	150	132.5 Å²	132.5	70%	0.701	80%	0.796	S	S	*	*			trans	-84.8	155.5	154.4	-61.5	-178.4	145.6	0	0	109.2
1071	C	31.4	Very low	29.6	Very low	129 Å²	129	134.6 Å²	134.6	87%	0.872	79%	0.793	S	S	*	*			trans	-143.5	134.1	150.3	-93.7	0	0	0	0	109.2
1072	N	29.7	Very low	29.5	Very low	119 Å²	119	140.2 Å²	140.2	64%	0.636	80%	0.799	S	S	*	*			trans	-107.7	173.3	-170.5	-74.1	-71.8	0	0	0	112
1073	N	28.7	Very low	29.3	Very low	149 Å²	149	137.4 Å²	137.4	80%	0.797	79%	0.786	S	S	*	*				112.4	133.3	122.8	-95.1	-20.1	0	0	0	122.2
1074	V	30.6	Very low	29.4	Very low	123 Å²	123	137.9 Å²	137.9	75%	0.745	78%	0.783	S	S	*	*			trans	90.9	122.7	138.3	168.1	0	0	0	0	120
1075	V	29.7	Very low	29.3	Very low	129 Å²	129	137.5 Å²	137.5	78%	0.782	79%	0.786	S	S	*	*			trans	-99.1	143.8	166.6	172.9	0	0	0	0	109.1
1076	P	32.5	Very low	29.4	Very low	119 Å²	119	139.3 Å²	139.3	77%	0.773	78%	0.782	S	S	*	*			trans	-115.5	122.8	155.6	33.2	-22.1	0	0	0	112
1077	Q	26.2	Very low	29.6	Very low	185 Å²	185	142.2 Å²	142.2	86%	0.864	78%	0.782	S	S	*	*			trans	-82.2	140.2	154.8	-70.3	179	-40.6	0	0	108.8
1078	Q	31.2	Very low	29.6	Very low	203 Å²	203	141.7 Å²	141.7	95%	0.949	77%	0.771	S	S	*	*			trans	-157.2	150.6	143.4	-119.3	169.6	28.2	0	0	112.2
1079	S	24.6	Very low	30	Very low	116 Å²	116	144 Å²	144	81%	0.811	77%	0.769	S	S	*	*			trans	-123.1	140	-172.8	54.1	0	0	0	0	110.8
1080	S	31.3	Very low	29.9	Very low	122 Å²	122	143 Å²	143	85%	0.853	77%	0.766	S	S	*	*			trans	-151.8	144.8	157	50.1	0	0	0	0	110.7
1081	E	27	Very low	30	Very low	161 Å²	161	141.3 Å²	141.3	75%	0.752	77%	0.771	S	S	*	*			trans	-87.5	166	179.9	-56.6	153.9	104.5	0	0	110.5
1082	F	28.9	Very low	29.9	Very low	183 Å²	183	143.5 Å²	143.5	80%	0.803	77%	0.77	S	S	*	*				-173.4	109.5	108	-116.8	-98.9	0	0	0	114.4
1083	N	27.7	Very low	29.9	Very low	107 Å²	107	144.1 Å²	144.1	57%	0.572	78%	0.782	S	S	*	*			trans	33.6	115.2	139.8	-74.1	-64.3	0	0	0	123.4
1084	L	27.7	Very low	29.8	Very low	137 Å²	137	145.7 Å²	145.7	72%	0.717	79%	0.789	S	S	*	*				72.5	121	104	-149.2	83.8	0	0	0	121.1
1085	S	31.7	Very low	29.7	Very low	123 Å²	123	146.4 Å²	146.4	86%	0.86	79%	0.789	S	S	*	*				-164.5	155	117.9	32.6	0	0	0	0	111.4
1086	Q	31.1	Very low	29.7	Very low	148 Å²	148	146.4 Å²	146.4	69%	0.692	79%	0.785	S	S	*	*			trans	-114	155.3	-168.7	-56.6	164.3	-43.5	0	0	111.4
1087	H	34	Very low	29.7	Very low	181 Å²	181	148.9 Å²	148.9	84%	0.838	79%	0.791	S	S	*	*			trans	-157.1	96.5	131.5	-132.2	-82.5	0	0	0	116.6
1088	N	32.4	Very low	29.9	Very low	107 Å²	107	148.3 Å²	148.3	57%	0.572	79%	0.788	S	S	*	*			trans	-5.3	131.5	144.8	-55.4	-31.2	0	0	0	118.6
1089	K	34	Very low	29.8	Very low	177 Å²	177	146.5 Å²	146.5	77%	0.77	79%	0.785	S	S	*	*				-177.2	134.8	85.9	-96.3	-168.7	167.5	177.5	0	116.7
1090	D	30.6	Very low	30.1	Very low	136 Å²	136	146.1 Å²	146.1	73%	0.727	78%	0.783	S	S	*	*			trans	36.2	111	136.4	-38.7	-24.9	0	0	0	120.9
1091	S	30.1	Very low	29.9	Very low	114 Å²	114	148.2 Å²	148.2	80%	0.797	78%	0.777	S	S	*	*				-176	155.3	98.6	-163.3	0	0	0	0	113.6
1092	M	27.3	Very low	29.9	Very low	175 Å²	175	149.6 Å²	149.6	86%	0.862	79%	0.788	S	S	*	*			trans	-59.6	131	-171.2	-65.9	163.1	-87.1	0	0	116.5
1093	C	29.8	Very low	29.8	Very low	131 Å²	131	143.9 Å²	143.9	89%	0.885	78%	0.775	S	S	*	*				-158.9	141	122.7	-102.1	0	0	0	0	108.4
1094	L	27.7	Very low	29.8	Very low	182 Å²	182	143.4 Å²	143.4	95%	0.953	78%	0.78	S	S	*	*			trans	-107.8	114.4	-177.8	-89.2	166.5	0	0	0	110.2
1095	D	27.8	Very low	29.9	Very low	138 Å²	138	143 Å²	143	74%	0.738	78%	0.783	S	S	*	*			trans	-138	144.9	175.8	-122.5	-37.2	0	0	0	110.2
1096	N	30.9	Very low	29.7	Very low	129 Å²	129	142.4 Å²	142.4	69%	0.69	78%	0.779	S	S	*	*			trans	37.2	115.1	162.1	-59.8	-60.3	0	0	0	120.6
1097	N	31.9	Very low	29.5	Very low	171 Å²	171	140.4 Å²	140.4	91%	0.914	78%	0.781	S	S	*	*			trans	-146	92.1	146.4	-112.4	-42.3	0	0	0	111.2
1098	H	31.1	Very low	29.2	Very low	173 Å²	173	136.5 Å²	136.5	80%	0.801	77%	0.774	S	S	*	*			trans	-75.7	121	163.1	-89.2	-51.8	0	0	0	109.2
1099	N	28.4	Very low	29.1	Very low	165 Å²	165	142.8 Å²	142.8	88%	0.882	79%	0.791	S	S	*	*			trans	175.7	90.1	137.9	-93	-28.6	0	0	0	112.5
1100	S	30	Very low	28.9	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	79%	0.794	S	S	*	*			trans	-177.6	120.8	144	44.3	0	0	0	0	110.6
1101	F	28.4	Very low	28.8	Very low	167 Å²	167	143.7 Å²	143.7	73%	0.732	80%	0.796	S	S	*	*				174.9	86	125.8	-115.2	-100.6	0	0	0	111.3	A1103	F1101-A1103 HydrophobicContact CD1-CB 4.04Å; F1101-A1103 HydrophobicContact CE1-CB 3.98Å
1102	L	25.9	Very low	28.8	Very low	190 Å²	190	146.9 Å²	146.9	100%	0.995	80%	0.802	S	S	*	*			trans	-94.2	74.6	155.3	-84.4	173.6	0	0	0	108.5
1103	A	27.7	Very low	29	Very low	63 Å²	63	143 Å²	143	52%	0.521	79%	0.792	S	S	.	*			trans	-162.4	147	169.8	0	0	0	0	0	112.1	F1101	F1101-A1103 HydrophobicContact CD1-CB 4.04Å; F1101-A1103 HydrophobicContact CE1-CB 3.98Å
1104	S	26.8	Very low	29	Very low	97 Å²	97	147.4 Å²	147.4	68%	0.678	79%	0.79	S	S	*	*			trans	48.5	105.4	160.8	62.3	0	0	0	0	119.6
1105	V	30.5	Very low	29.1	Very low	128 Å²	128	147 Å²	147	78%	0.776	79%	0.788	S	S	*	*			trans	-131.2	71.8	130.7	-169	0	0	0	0	109.5	S1108	V1105-S1108 WeakPolarHBondContact CG1-OG 3.47Å
1106	S	26.9	Very low	29.3	Very low	111 Å²	111	148.2 Å²	148.2	78%	0.776	79%	0.794	S	S	*	*			trans	-94.7	150.6	146	-174.4	0	0	0	0	107.1
1107	S	27.5	Very low	29.1	Very low	106 Å²	106	149.1 Å²	149.1	74%	0.741	80%	0.799	S	S	*	*			trans	64.2	109.9	-166.3	-65.1	0	0	0	0	115.3
1108	S	28.8	Very low	28.8	Very low	98 Å²	98	146.8 Å²	146.8	69%	0.685	80%	0.795	S	S	*	*			trans	-137.7	22.4	158.1	-74.8	0	0	0	0	112.8	V1105 Q1110	V1105-S1108 WeakPolarHBondContact CG1-OG 3.47Å; S1108-Q1110 PolarHBondContact O-N 3.04Å
1109	Y	29.9	Very low	28.8	Very low	239 Å²	239	146.7 Å²	146.7	94%	0.937	80%	0.8	S	S	*	*	S	Bend	trans	-85.9	31.3	170.3	-107.7	-77.3	0	0	0	112.6
1110	Q	29.2	Very low	28.7	Very low	175 Å²	175	146.2 Å²	146.2	82%	0.818	80%	0.798	S	S	*	*	S	Bend	trans	-156.7	42.3	-172.9	-142.1	170.5	93	0	0	115.9	S1108	S1108-Q1110 PolarHBondContact O-N 3.04Å
1111	M	28.3	Very low	28.7	Very low	158 Å²	158	147.3 Å²	147.3	78%	0.778	80%	0.8	S	S	*	*			trans	-137.3	2.5	172.5	-139.1	177.8	-70.7	0	0	117.3	S1113	M1111-S1113 VanDerWaalsContact C-N 3.28Å; M1111-S1113 PolarHBondContact O-N 2.83Å
1112	I	31	Very low	28.9	Very low	181 Å²	181	145.6 Å²	145.6	93%	0.928	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	53.5	174.8	-45.4	-177.9	0	0	0	110.5
1113	S	30.7	Very low	29.2	Very low	93 Å²	93	141.2 Å²	141.2	65%	0.65	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.8	12	-177.8	58.5	0	0	0	0	114.7	M1111	M1111-S1113 VanDerWaalsContact C-N 3.28Å; M1111-S1113 PolarHBondContact O-N 2.83Å
1114	R	28.8	Very low	29.2	Very low	224 Å²	224	141.3 Å²	141.3	85%	0.845	80%	0.796	S	S	*	*	S	Bend	trans	-126.9	14.7	-175	-72.7	-170.3	173	-176.4	-1	115.9
1115	L	31	Very low	29.4	Very low	174 Å²	174	146 Å²	146	91%	0.911	80%	0.801	S	S	*	*	S	Bend	trans	-109.4	-4.5	175.8	-83.9	165.3	0	0	0	115
1116	N	31	Very low	29.5	Very low	162 Å²	162	148.6 Å²	148.6	87%	0.866	80%	0.798	S	S	*	*	S	Bend	trans	-111.5	26.9	-177	-80.8	-2.6	0	0	0	113.9
1117	N	26.6	Very low	29.6	Very low	148 Å²	148	150.4 Å²	150.4	79%	0.791	79%	0.794	S	S	*	*			trans	-152.6	51.1	-174.3	-140.9	-3.8	0	0	0	116.8
1118	C	27.3	Very low	29.6	Very low	122 Å²	122	152.4 Å²	152.4	82%	0.824	80%	0.796	S	S	*	*	S	Bend	trans	-144.9	89.9	164.1	-84.8	0	0	0	0	111.1
1119	N	30	Very low	29.6	Very low	171 Å²	171	156.7 Å²	156.7	91%	0.914	81%	0.805	S	S	*	*			trans	166	89.3	147.1	-88.7	-18	0	0	0	109.3
1120	N	26	Very low	29.4	Very low	156 Å²	156	151 Å²	151	83%	0.834	80%	0.795	S	S	*	*			trans	-150.8	83.4	175.6	-159.1	1	0	0	0	111.8
1121	T	31.4	Very low	29.4	Very low	131 Å²	131	151.8 Å²	151.8	80%	0.804	80%	0.797	S	S	*	*			trans	-148.6	104.6	173	47	0	0	0	0	111.4
1122	T	31.7	Very low	29.2	Very low	130 Å²	130	150.7 Å²	150.7	80%	0.798	79%	0.794	S	S	*	*			trans	145.9	119.4	131.2	-60.5	0	0	0	0	112.1
1123	S	31.3	Very low	29.1	Very low	98 Å²	98	149.8 Å²	149.8	69%	0.685	79%	0.786	S	S	*	*			trans	13.5	134.8	153.8	-167.5	0	0	0	0	120.3
1124	G	28.1	Very low	28.8	Very low	66 Å²	66	152.4 Å²	152.4	68%	0.68	79%	0.788	S	S	*	*			cis	136.3	176.6	2.7	0	0	0	0	0	113.3
1125	Y	31.1	Very low	28.9	Very low	196 Å²	196	148.8 Å²	148.8	77%	0.769	78%	0.78	S	S	*	*			trans	89.4	111.5	171.7	-70.4	-100.6	0	0	0	120.4
1126	Y	32.2	Very low	28.6	Very low	182 Å²	182	145.6 Å²	145.6	71%	0.714	76%	0.764	S	S	*	*			trans	55.8	145.3	135.5	-74.6	-106.3	0	0	0	121.3
1127	E	28.9	Very low	28.5	Very low	149 Å²	149	147.9 Å²	147.9	70%	0.696	76%	0.762	S	S	*	*			cis	-167.1	-174.7	-26.5	-139.3	166.2	-139.8	0	0	108.4
1128	D	27.4	Very low	28.6	Very low	148 Å²	148	146.3 Å²	146.3	79%	0.791	76%	0.763	S	S	*	*			trans	-61.1	153.8	176	-63	-74.9	0	0	0	113
1129	E	30.6	Very low	28.7	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.874	76%	0.764	S	S	*	*				-168.8	165.3	80.4	-92.6	-163.8	158.4	0	0	114.1
1130	T	25.8	Very low	29.1	Very low	119 Å²	119	145.4 Å²	145.4	73%	0.73	75%	0.748	S	S	*	*			trans	-78.4	144.1	170.6	53.7	0	0	0	0	113.3
1131	F	28.3	Very low	29.5	Very low	193 Å²	193	146 Å²	146	85%	0.846	75%	0.746	S	S	*	*			trans	-165.7	164.9	134.8	-127.6	-95.4	0	0	0	113.7
1132	N	24.8	Very low	29.6	Very low	135 Å²	135	147.5 Å²	147.5	72%	0.722	74%	0.743	S	S	*	*			trans	-85.4	149.6	177.5	-66.4	-78.5	0	0	0	112.9
1133	Q	27.3	Very low	29.6	Very low	161 Å²	161	149.4 Å²	149.4	75%	0.752	74%	0.743	S	S	*	*				169.6	127.4	112.2	-91	169.1	35.1	0	0	115.7
1134	Q	25.6	Very low	29.7	Very low	149 Å²	149	151 Å²	151	70%	0.696	74%	0.74	S	S	*	*			trans	44.2	149.9	133	-60.2	-178.4	-39.8	0	0	124.5
1135	H	29.6	Very low	30.1	Very low	148 Å²	148	154.5 Å²	154.5	69%	0.685	74%	0.738	S	S	*	*			trans	74	148.4	156.2	-64.4	-47.4	0	0	0	118.1
1136	N	26.3	Very low	30	Very low	106 Å²	106	151.5 Å²	151.5	57%	0.567	73%	0.731	S	S	*	*			cis	-167.8	142.9	-9.5	-113.1	-5.1	0	0	0	112.6
1137	Y	28.2	Very low	30.1	Very low	210 Å²	210	149.8 Å²	149.8	82%	0.824	73%	0.734	S	S	*	*			trans	54.5	167.9	158.4	-57.7	-67.4	0	0	0	117.9
1138	S	28.6	Very low	30.2	Very low	116 Å²	116	149.5 Å²	149.5	81%	0.811	73%	0.732	S	S	*	*			cis	-147.4	163.6	13.2	-51.1	0	0	0	0	113
1139	H	29.6	Very low	30.3	Very low	182 Å²	182	149.7 Å²	149.7	84%	0.843	73%	0.728	S	S	*	*			trans	-113	-165.1	168.4	-140	22.7	0	0	0	108.3
1140	P	38.8	Very low	30.3	Very low	91 Å²	91	146.4 Å²	146.4	59%	0.591	73%	0.726	S	S	*	*			cis	-131.1	-166.6	-30	35.4	-15	0	0	0	112.1
1141	H	34.4	Very low	30.5	Very low	168 Å²	168	148.1 Å²	148.1	78%	0.778	73%	0.725	S	S	*	*				176.3	164.6	116	-123.1	-87.9	0	0	0	116.9
1142	H	33.2	Very low	30.5	Very low	163 Å²	163	145.8 Å²	145.8	76%	0.755	72%	0.717	S	S	*	*			trans	-80.6	162.5	-178	-67.2	-76.2	0	0	0	117.3
1143	Q	32.5	Very low	30.6	Very low	171 Å²	171	146.4 Å²	146.4	80%	0.799	72%	0.716	S	S	*	*				175.3	159.9	118	-93.1	-162.5	-57.5	0	0	111
1144	E	31.8	Very low	30.8	Very low	130 Å²	130	146.2 Å²	146.2	61%	0.607	71%	0.714	S	S	*	*			cis	-164	155.5	-39.2	-136.9	176.6	158.1	0	0	112.2
1145	H	36.2	Very low	31	Very low	141 Å²	141	145.4 Å²	145.4	65%	0.653	71%	0.711	S	S	*	*			trans	61.5	118.3	145.7	-85.7	-10.9	0	0	0	126.6
1146	Q	30.4	Very low	30.9	Very low	132 Å²	132	147.9 Å²	147.9	62%	0.617	72%	0.715	S	S	*	*				90.2	138.6	115.7	-82.7	-172	61.3	0	0	125.4
1147	L	33.8	Very low	31.1	Very low	147 Å²	147	147.1 Å²	147.1	77%	0.77	72%	0.724	S	S	*	*			trans	106.3	144.9	145.7	-70.4	134.3	0	0	0	120.2
1148	Q	30.6	Very low	31	Very low	143 Å²	143	143.6 Å²	143.6	67%	0.668	72%	0.723	S	S	*	*				-154.3	154.7	-56.4	-168.9	152.4	-7.9	0	0	111.2
1149	Q	29.2	Very low	31.1	Very low	151 Å²	151	145.6 Å²	145.6	71%	0.706	73%	0.725	S	S	*	*			trans	-30.5	142.6	172.7	-57.1	147.7	-33.7	0	0	119
1150	S	30.8	Very low	31	Very low	118 Å²	118	142.4 Å²	142.4	83%	0.825	72%	0.719	S	S	*	*			trans	173	164	133	41.5	0	0	0	0	111.2
1151	H	30.2	Very low	30.5	Very low	155 Å²	155	145.9 Å²	145.9	72%	0.718	73%	0.727	S	S	*	*				-164	153.1	-53.5	-133	44.9	0	0	0	109.1
1152	Q	29.1	Very low	30.2	Very low	145 Å²	145	145.5 Å²	145.5	68%	0.678	73%	0.725	S	S	*	*			trans	60.6	110.4	152.7	-71	171.4	-8.9	0	0	123.5
1153	Q	27.1	Very low	30.2	Very low	148 Å²	148	145.1 Å²	145.1	69%	0.692	72%	0.724	S	S	*	*				65	158.9	113	-68.1	172.8	-30.3	0	0	123.7
1154	H	31.7	Very low	30.1	Very low	156 Å²	156	144 Å²	144	72%	0.722	72%	0.718	S	S	*	*			trans	74.9	149.8	163.5	-64	-51.1	0	0	0	118.8
1155	H	28.6	Very low	30.1	Very low	133 Å²	133	144 Å²	144	62%	0.616	72%	0.722	S	S	*	*			cis	-169.6	147.4	-32.7	-131.7	-16.8	0	0	0	110.7
1156	Y	26.9	Very low	29.9	Very low	200 Å²	200	144.1 Å²	144.1	78%	0.784	73%	0.726	S	S	*	*			trans	63.7	164.8	155.8	-76	-64.7	0	0	0	121.7
1157	A	30.7	Very low	29.8	Very low	90 Å²	90	148 Å²	148	74%	0.744	74%	0.735	S	S	*	*			trans	62.4	123	175.3	0	0	0	0	0	115.5
1158	V	27.1	Very low	29.6	Very low	135 Å²	135	147.1 Å²	147.1	82%	0.818	73%	0.731	S	S	*	*			cis	58.4	98.5	25.7	-169.1	0	0	0	0	113.7
1159	D	30.1	Very low	29.5	Very low	159 Å²	159	146.6 Å²	146.6	85%	0.85	73%	0.733	S	S	*	*			trans	-152.3	166.8	138.7	-131.5	-33.7	0	0	0	111.9
1160	T	27.9	Very low	29.6	Very low	114 Å²	114	145.9 Å²	145.9	70%	0.699	73%	0.734	S	S	*	*			trans	-143.3	120.6	-171.3	-56.3	0	0	0	0	112.5
1161	Q	29	Very low	29.6	Very low	165 Å²	165	146.7 Å²	146.7	77%	0.771	73%	0.729	S	S	*	*			trans	-167.8	126.2	158.9	-103.2	145.2	29.5	0	0	108.1
1162	E	27.6	Very low	29.5	Very low	159 Å²	159	146.7 Å²	146.7	74%	0.743	74%	0.735	S	S	*	*				82.3	165.9	72.8	-74.4	-156.9	121.8	0	0	114
1163	H	32.9	Very low	29.6	Very low	156 Å²	156	145.3 Å²	145.3	72%	0.722	74%	0.741	S	S	*	*			trans	73.8	133.6	179.9	-67.7	-87.7	0	0	0	118.1
1164	H	31	Very low	29.6	Very low	148 Å²	148	145.4 Å²	145.4	69%	0.685	75%	0.746	S	S	*	*			cis	-169.2	179.6	-21.4	-141.7	-112.3	0	0	0	110.5
1165	L	30.9	Very low	29.5	Very low	130 Å²	130	142.8 Å²	142.8	68%	0.681	75%	0.745	S	S	*	*			trans	76.6	116.3	152.6	-70.6	164.2	0	0	0	121.6
1166	L	32.1	Very low	29.7	Very low	142 Å²	142	143.5 Å²	143.5	74%	0.743	75%	0.753	S	S	*	*			trans	74.9	154.5	137.8	-57	167	0	0	0	119.8
1167	R	29.3	Very low	29.8	Very low	214 Å²	214	139.9 Å²	139.9	81%	0.808	75%	0.752	S	S	*	*			cis	-166.5	142.7	-32.9	-173	170.5	-177	177.4	1.1	108.9
1168	N	29.5	Very low	29.9	Very low	128 Å²	128	142.7 Å²	142.7	68%	0.684	76%	0.76	S	S	*	*			trans	-3.8	135.2	170.1	-59.5	16	0	0	0	120.6
1169	N	28.4	Very low	30.1	Very low	132 Å²	132	142 Å²	142	71%	0.706	76%	0.756	S	S	*	*			trans	53.3	109.9	135.5	-54.1	6.7	0	0	0	119.1
1170	N	30.3	Very low	30.3	Very low	137 Å²	137	142.3 Å²	142.3	73%	0.733	76%	0.758	S	S	*	*				175.3	157	96.1	-92.6	-28.1	0	0	0	113.9
1171	N	31.9	Very low	30.4	Very low	135 Å²	135	146.4 Å²	146.4	72%	0.722	76%	0.761	S	S	*	*			trans	53.6	122	149.3	-60.1	-11.8	0	0	0	121.4
1172	N	27.1	Very low	30.5	Very low	154 Å²	154	146.9 Å²	146.9	82%	0.824	77%	0.767	S	S	*	*				16.6	117.6	129.8	-54.7	-8.3	0	0	0	118.3
1173	S	31.5	Very low	30.5	Very low	116 Å²	116	147.2 Å²	147.2	81%	0.811	77%	0.767	S	S	*	*				-175.8	148	100.4	59.3	0	0	0	0	113.8
1174	N	27.4	Very low	30.3	Very low	151 Å²	151	150.6 Å²	150.6	81%	0.807	78%	0.775	S	S	*	*			trans	-33.7	149.3	165.4	-46.4	-24.6	0	0	0	114.1
1175	S	28.5	Very low	30.2	Very low	100 Å²	100	149.8 Å²	149.8	70%	0.699	77%	0.774	S	S	*	*				170.1	170.5	79.3	50.2	0	0	0	0	112.3
1176	L	32.6	Very low	30.4	Very low	149 Å²	149	149.3 Å²	149.3	78%	0.78	78%	0.779	S	S	*	*			trans	61.2	119.5	178	-76.9	64.8	0	0	0	115
1177	T	29	Very low	30.4	Very low	124 Å²	124	148.1 Å²	148.1	76%	0.761	78%	0.777	S	S	*	*			cis	72.5	94.6	32.1	83.3	0	0	0	0	116.3
1178	T	34.7	Very low	30.3	Very low	148 Å²	148	145.4 Å²	145.4	91%	0.908	78%	0.779	S	S	*	*			trans	-134.6	133.2	137.7	-47.8	0	0	0	0	107.9
1179	T	30.8	Very low	30.5	Very low	122 Å²	122	145.3 Å²	145.3	75%	0.748	78%	0.783	S	S	*	*			trans	-91.3	153.9	174.7	49	0	0	0	0	110.8
1180	D	34	Very low	30.7	Very low	164 Å²	164	148.3 Å²	148.3	88%	0.877	81%	0.814	S	S	*	*				-146.4	159.5	128.7	-131.2	-33.3	0	0	0	113
1181	R	29.1	Very low	30.7	Very low	201 Å²	201	148.9 Å²	148.9	76%	0.758	82%	0.818	S	S	*	*			trans	-113.1	129	-170.7	-71.2	171.9	166.6	177.7	-4	112
1182	L	31	Very low	30.6	Very low	174 Å²	174	149.6 Å²	149.6	91%	0.911	82%	0.823	S	S	*	*			trans	-131.3	117.4	149.1	-80.5	175.2	0	0	0	109.6
1183	F	27.7	Very low	30.8	Very low	167 Å²	167	149.3 Å²	149.3	73%	0.732	82%	0.823	S	S	*	*			trans	-78.4	134.5	167.9	-77.1	-103.2	0	0	0	108.5
1184	Y	29.2	Very low	30.8	Very low	227 Å²	227	151.3 Å²	151.3	89%	0.89	82%	0.824	S	S	*	*			trans	-117.9	115.9	164	-127.5	-90.1	0	0	0	108.8
1185	I	30.1	Very low	31	Very low	130 Å²	130	151.3 Å²	151.3	67%	0.667	83%	0.825	S	S	*	*			trans	-96.7	117.2	175.7	-61.3	171.8	0	0	0	106.7	V1187	I1185-V1187 HydrophobicContact CG2-CG2 4.24Å; I1185-V1187 PolarHBondContact O-N 3.32Å; I1185-V1187 VanDerWaalsContact O-N 3.1Å
1186	P	33.5	Very low	31.1	Very low	120 Å²	120	154.7 Å²	154.7	78%	0.779	83%	0.833	S	S	*	*			trans	-71.6	102.9	167.1	29.1	-30.6	0	0	0	108.4
1187	V	33	Very low	31	Very low	117 Å²	117	155.1 Å²	155.1	71%	0.709	84%	0.837	S	S	*	*			trans	-77.6	135.6	173.4	177.1	0	0	0	0	108.8	I1185	I1185-V1187 HydrophobicContact CG2-CG2 4.24Å; I1185-V1187 PolarHBondContact O-N 3.32Å; I1185-V1187 VanDerWaalsContact O-N 3.1Å
1188	N	27.4	Very low	31.2	Very low	158 Å²	158	157.5 Å²	157.5	85%	0.845	84%	0.843	S	S	*	*			trans	-58	136.9	172.8	-82.3	-4.9	0	0	0	111.3
1189	T	32.3	Very low	30.9	Very low	125 Å²	125	158.3 Å²	158.3	77%	0.767	84%	0.837	S	S	*	*			trans	-131.8	118.5	164.3	52.3	0	0	0	0	109.7
1190	S	32.8	Very low	30.9	Very low	195 Å²	195	161.6 Å²	161.6	100%	1.364	85%	0.845	S	S	*	*			trans	50.9	0	176.6	67.9	0	0	0	0	116.5

Retrieved 1,190 of 1,190 residues in 727.6 ms (Link to these results)

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