A0A3Q0KJD3_SCHMA Loading...

Putative fyve-containing

AlphaFold DB , UniProt , Accession A0A3Q0KJD3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,051 aa.

						>A0A3Q0KJD3_SCHMA|A0A3Q0KJD3
MSSGDSSSQHKESLMHEINALFAPPTNESYGKKGSLGIPSFRRARKNNESTTNSSETNSSSLEHYQLPNTSAKNDPFWRKPRANCHEYCDSCGCIEGERLVCDRCPASFHLECLDPPLDPDEAPVGVWFCHRCSMVLKDEEDKTSTSSSQTTIATDTGSSRSGKSGHKRQDQASSSSSVGTATAATVGPSNSTSTSSISNNNNNNSHSHQQTPLQQFIQSQTSRRHYTFRSTSNENYCLDMNKLSSSRSSTWGDSAYVADIEESELRALWKVIEYAKYQNPKEYDLPKDLLPGVKLPGSYKTPTERKNKSIIELENGLIPQPVRRCYVCVRTCFYAPLLPCDYCSACFHLECLNPPLSHYPPRSDRWMCPNHTEHTTERYLARSIRLTERMQIWTKLYSLSNENNYCEQQSIDEVDEITKILEHIPPYELTYTPDEESSILSDLMRTIQRSRNEQQQQQHQMSSSDLSNTAMSSIFDSILYSTNNTTTIKDKQHILSNRHLWRLNRELAAKSRNNHNYYNKQIRIVVPKAVKYLYNNPVKRIPRVNESSNICQLTNLLDESSTDDKSIFVRGLLQFYLQNTLKLLSPSSNRIQTDNSTTATDTSSIIVTTHSTTLSTSSFEATPATITATTTAIDDLLNNDNNDNTSSSFVIDNKTTDALKLTTDSIGMDINNSLSTLSYNTEELSKDLSFIQDNNEDSCHSLEQWNTTVMNKLNDITDDNSIPSKLARLDPQLLYTLAAQRLYELLDVNNQNSILPNQDNIEQNSCKRKKDSSKALNIPESCIRARAVLTPCDGTNGYETRMHYRQLTVGTSPDCHLCLANYNLSSTYNNNDKCSFVSPHHATIFYDDWTQHYELINYSEYGTCVDGIIYGNDIEKKLIYIPESSDLVQRVRNLIKTAPKELSPNYQTSSVISELCASPPKRLMKMLSKRHEDLSHMTSMCDCTSLHFGRNDKSQNLFNDNTDISDKTDSSDLINGWEGPAILRHGSVIQFGCYKFVFGLINHSLPSYSSSTTTTATMTSNCSTSSSHETQIVLLTNSLSVTNNNNLLVH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	37.6	Very low	237 Å²	237	141.1 Å²	141.1	100%	1.167	83%	0.826	S	S	*	*				0	106.2	0	-53.3	179.7	80.7	0	0	106.3
2	S	34	Very low	38.3	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	81%	0.813	S	S	*	*			cis	-140.7	129.9	-4.6	-66.9	0	0	0	0	107.1
3	S	34.1	Very low	39.6	Very low	124 Å²	124	136.1 Å²	136.1	87%	0.867	79%	0.791	S	S	*	*				64.1	123.1	99.1	-40.7	0	0	0	0	113
4	G	37.8	Very low	40.9	Very low	73 Å²	73	132.8 Å²	132.8	75%	0.753	77%	0.768	S	S	*	*			cis	-165.2	-176.4	2.9	0	0	0	0	0	111.5
5	D	35.6	Very low	41.6	Very low	169 Å²	169	132.1 Å²	132.1	90%	0.904	76%	0.757	S	S	*	*			trans	-67.6	138.2	-155.4	-60.3	-67.6	0	0	0	117.6	S7	D5-S7 PolarHBondContact O-N 2.97Å
6	S	33	Very low	42.9	Very low	123 Å²	123	133 Å²	133	86%	0.86	75%	0.752	S	S	*	*			trans	-87.8	97.3	174.7	52.1	0	0	0	0	112
7	S	32.9	Very low	43.9	Very low	118 Å²	118	132.5 Å²	132.5	83%	0.825	74%	0.742	S	S	*	*			trans	-158.2	69.3	169.8	180	0	0	0	0	113.3	D5	D5-S7 PolarHBondContact O-N 2.97Å
8	S	39.6	Very low	44.6	Very low	100 Å²	100	129.5 Å²	129.5	70%	0.699	72%	0.723	S	S	*	*			trans	-128.9	-19.7	178.6	54.5	0	0	0	0	116.2	H10	S8-H10 VanDerWaalsContact C-N 3.29Å; S8-H10 PolarHBondContact O-N 3.44Å
9	Q	41.6	Very low	45.5	Very low	173 Å²	173	128.3 Å²	128.3	81%	0.808	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-16.6	-172.9	-73.2	-176	-39.4	0	0	115.5	K11	Q9-K11 VanDerWaalsContact C-N 3.26Å; Q9-K11 PolarHBondContact O-N 2.91Å
10	H	46	Very low	46.4	Very low	157 Å²	157	125.5 Å²	125.5	73%	0.727	71%	0.709	S	S	*	*	H	α-helix	trans	-74.5	-12.6	-174.6	-144.9	-55.5	0	0	0	114.3	S8	S8-H10 VanDerWaalsContact C-N 3.29Å; S8-H10 PolarHBondContact O-N 3.44Å
11	K	46.3	Very low	46.8	Very low	176 Å²	176	126 Å²	126	77%	0.765	71%	0.709	S	S	*	*	H	α-helix	trans	-90	-30.3	-172.3	-138.5	177.3	-174.9	-177.4	0	114.2	Q9	Q9-K11 VanDerWaalsContact C-N 3.26Å; Q9-K11 PolarHBondContact O-N 2.91Å
12	E	46	Very low	47.5	Very low	142 Å²	142	122.9 Å²	122.9	66%	0.664	69%	0.689	S	S	*	*	H	α-helix	trans	-80.8	-29	176.9	-71	174.3	134.8	0	0	112.5	L14 M15 H16	E12-L14 VanDerWaalsContact C-N 3.35Å; E12-M15 PolarHBondContact O-N 3.26Å; E12-H16 PolarHBondContact O-N 3.43Å; E12-H16 PolarHBondContact O-ND1 2.71Å
13	S	54.5	Low	47.8	Very low	75 Å²	75	120.9 Å²	120.9	52%	0.524	68%	0.679	S	S	.	*	H	α-helix	trans	-62	-42.1	172.7	-165.3	0	0	0	0	111.8	M15 H16 E17	S13-M15 VanDerWaalsContact C-N 3.3Å; S13-M15 PolarHBondContact O-N 3.21Å; S13-H16 PolarHBondContact O-N 3.25Å; S13-E17 PolarHBondContact O-N 3.25Å
14	L	57.8	Low	47.8	Very low	90 Å²	90	120.3 Å²	120.3	47%	0.471	67%	0.673	S	S	.	*	H	α-helix	trans	-66.2	-31.8	-178.8	-132.1	166.8	0	0	0	112.1	E12 E17 I18	E12-L14 VanDerWaalsContact C-N 3.35Å; L14-E17 PolarHBondContact O-N 3.34Å; L14-I18 HydrophobicContact CD2-CD1 3.84Å; L14-I18 HydrophobicContact CD2-CG1 4.2Å; L14-I18 VanDerWaalsContact O-CG1 3.28Å; L14-I18 WeakPolarHBondContact O-CG1 3.39Å; L14-I18 PolarHBondContact O-N 3.37Å
15	M	52	Low	47.9	Very low	123 Å²	123	122.6 Å²	122.6	61%	0.606	67%	0.674	S	S	*	*	H	α-helix	trans	-77.9	-29.6	177.3	-159.6	146.2	69.8	0	0	112.7	E12 S13 N19	E12-M15 PolarHBondContact O-N 3.26Å; S13-M15 VanDerWaalsContact C-N 3.3Å; S13-M15 PolarHBondContact O-N 3.21Å; M15-N19 WeakPolarHBondContact O-CB 3.44Å; M15-N19 PolarHBondContact O-N 2.68Å; M15-N19 PolarHBondContact O-ND2 3.45Å
16	H	62.4	Low	48	Very low	146 Å²	146	119.4 Å²	119.4	68%	0.676	66%	0.661	S	S	*	*	H	α-helix	trans	-67.7	-38.8	167	-86.9	79.1	0	0	0	112.2	E12 S13 N19 A20	E12-H16 PolarHBondContact O-N 3.43Å; E12-H16 PolarHBondContact O-ND1 2.71Å; S13-H16 PolarHBondContact O-N 3.25Å; H16-N19 PolarHBondContact O-N 2.92Å; H16-A20 WeakPolarHBondContact O-CB 3.3Å; H16-A20 PolarHBondContact O-N 3.31Å
17	E	60	Low	48.3	Very low	125 Å²	125	122 Å²	122	58%	0.584	67%	0.665	S	S	*	*	H	α-helix	trans	-67.4	-40.7	178	-164.1	165.5	-144.6	0	0	111.9	S13 L14 A20 L21	S13-E17 PolarHBondContact O-N 3.25Å; L14-E17 PolarHBondContact O-N 3.34Å; E17-A20 PolarHBondContact O-N 3.14Å; E17-L21 WeakPolarHBondContact O-CG 3.22Å; E17-L21 PolarHBondContact O-N 3.38Å
18	I	56.3	Low	48.8	Very low	78 Å²	78	125.2 Å²	125.2	40%	0.4	67%	0.667	S	S	.	*	H	α-helix	trans	-63.5	-44.9	171.2	-70	165.5	0	0	0	111.2	L14 A20 L21 F22	L14-I18 HydrophobicContact CD2-CD1 3.84Å; L14-I18 HydrophobicContact CD2-CG1 4.2Å; L14-I18 VanDerWaalsContact O-CG1 3.28Å; L14-I18 WeakPolarHBondContact O-CG1 3.39Å; L14-I18 PolarHBondContact O-N 3.37Å; I18-A20 VanDerWaalsContact C-N 3.27Å; I18-A20 PolarHBondContact O-N 2.77Å; I18-L21 PolarHBondContact O-N 3.24Å; I18-L21 VanDerWaalsContact O-N 3.12Å; I18-F22 HydrophobicContact CG2-CD2 4.25Å; I18-F22 HydrophobicContact CG2-CE2 4.16Å; I18-F22 WeakPolarHBondContact O-CD2 3.46Å
19	N	62	Low	48.8	Very low	106 Å²	106	124.4 Å²	124.4	57%	0.567	66%	0.662	S	S	*	*	H	α-helix	trans	-65.2	-29.7	178.1	-73.5	-14.4	0	0	0	112.8	M15 H16 A23	M15-N19 WeakPolarHBondContact O-CB 3.44Å; M15-N19 PolarHBondContact O-N 2.68Å; M15-N19 PolarHBondContact O-ND2 3.45Å; H16-N19 PolarHBondContact O-N 2.92Å; N19-A23 PolarHBondContact O-N 2.9Å
20	A	63.3	Low	48.6	Very low	73 Å²	73	127.6 Å²	127.6	60%	0.603	67%	0.668	S	S	*	*	H	α-helix	trans	-70.7	-28.7	173.6	0	0	0	0	0	113.1	H16 E17 I18 F22	H16-A20 WeakPolarHBondContact O-CB 3.3Å; H16-A20 PolarHBondContact O-N 3.31Å; E17-A20 PolarHBondContact O-N 3.14Å; I18-A20 VanDerWaalsContact C-N 3.27Å; I18-A20 PolarHBondContact O-N 2.77Å; A20-F22 VanDerWaalsContact C-N 3.31Å; A20-F22 PolarHBondContact O-N 2.94Å
21	L	53.6	Low	48.1	Very low	135 Å²	135	123.4 Å²	123.4	71%	0.707	67%	0.667	S	S	*	*	H	α-helix	trans	-74.2	-17.3	176.9	-73.4	166.9	0	0	0	114	E17 I18	E17-L21 WeakPolarHBondContact O-CG 3.22Å; E17-L21 PolarHBondContact O-N 3.38Å; I18-L21 PolarHBondContact O-N 3.24Å; I18-L21 VanDerWaalsContact O-N 3.12Å
22	F	48	Very low	47.6	Very low	172 Å²	172	124.6 Å²	124.6	75%	0.754	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	4.5	178.8	-66.4	-72.8	0	0	0	114.1	I18 A20	I18-F22 HydrophobicContact CG2-CD2 4.25Å; I18-F22 HydrophobicContact CG2-CE2 4.16Å; I18-F22 WeakPolarHBondContact O-CD2 3.46Å; A20-F22 VanDerWaalsContact C-N 3.31Å; A20-F22 PolarHBondContact O-N 2.94Å
23	A	41.1	Very low	47.1	Very low	61 Å²	61	128.1 Å²	128.1	50%	0.504	69%	0.685	S	S	.	*	S	Bend	trans	-74	134.7	175.9	0	0	0	0	0	111.1	N19	N19-A23 PolarHBondContact O-N 2.9Å
24	P	33.3	Very low	46.1	Very low	111 Å²	111	128.2 Å²	128.2	72%	0.721	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-64.9	141.3	174.6	27.2	-33.7	0	0	0	110.7	T26	P24-T26 PolarHBondContact O-N 2.9Å
25	P	39.8	Very low	44.9	Very low	121 Å²	121	129.1 Å²	129.1	79%	0.786	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-68	122.6	-174.5	26.7	-34	0	0	0	111.5
26	T	39.3	Very low	44	Very low	102 Å²	102	131.4 Å²	131.4	63%	0.626	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-90.3	151	170.5	55.7	0	0	0	0	110.9	P24 E28 S29	P24-T26 PolarHBondContact O-N 2.9Å; T26-E28 PolarHBondContact O-N 3.02Å; T26-S29 PolarHBondContact O-OG 2.76Å; T26-S29 VanDerWaalsContact O-OG 3.05Å
27	N	37.8	Very low	42.4	Very low	178 Å²	178	128 Å²	128	95%	0.952	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	17.5	-170.4	-86.3	-11.2	0	0	0	116.6
28	E	44.5	Very low	41.1	Very low	186 Å²	186	130 Å²	130	87%	0.869	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	6.5	-176.5	-60.5	-169	148.9	0	0	113.8	T26	T26-E28 PolarHBondContact O-N 3.02Å
29	S	39.1	Very low	39.8	Very low	83 Å²	83	131.4 Å²	131.4	58%	0.58	76%	0.758	S	S	*	*			trans	-95.9	2.3	-165.7	49.3	0	0	0	0	117.2	T26 G31	T26-S29 PolarHBondContact O-OG 2.76Å; T26-S29 VanDerWaalsContact O-OG 3.05Å; S29-G31 VanDerWaalsContact C-N 3.31Å; S29-G31 PolarHBondContact O-N 3.18Å
30	Y	37.2	Very low	38.5	Very low	240 Å²	240	131.8 Å²	131.8	94%	0.941	77%	0.769	S	S	*	*			trans	-84.4	70.2	170.9	-84.7	-78.7	0	0	0	112.7
31	G	34.8	Very low	37.1	Very low	68 Å²	68	136 Å²	136	70%	0.701	77%	0.774	S	S	*	*			trans	-91.8	114.2	176.9	0	0	0	0	0	114.1	S29	S29-G31 VanDerWaalsContact C-N 3.31Å; S29-G31 PolarHBondContact O-N 3.18Å
32	K	35.8	Very low	36.3	Very low	202 Å²	202	139.7 Å²	139.7	88%	0.878	78%	0.778	S	S	*	*			trans	1	126.4	151.7	-70.4	168.1	171.9	168.5	0	117.7
33	K	36.9	Very low	35.6	Very low	215 Å²	215	140.7 Å²	140.7	94%	0.935	78%	0.777	S	S	*	*				-171.3	128.6	124.2	-105.3	159.5	-174.8	178.4	0	114.4
34	G	32.4	Very low	35.1	Very low	78 Å²	78	142.5 Å²	142.5	80%	0.804	79%	0.792	S	S	*	*			trans	87.6	147.7	161.7	0	0	0	0	0	117.1
35	S	34.3	Very low	35.4	Very low	109 Å²	109	149.2 Å²	149.2	76%	0.762	80%	0.803	S	S	*	*			cis	-168.9	142.8	-29	-157.8	0	0	0	0	110.4
36	L	31.8	Very low	35.2	Very low	170 Å²	170	151.7 Å²	151.7	89%	0.89	80%	0.801	S	S	*	*			trans	76.9	123.8	166	-52.1	176.5	0	0	0	120.6
37	G	29.8	Very low	35.1	Very low	76 Å²	76	154 Å²	154	78%	0.784	81%	0.81	S	S	*	*			trans	77.9	135.3	163.1	0	0	0	0	0	115.8
38	I	32	Very low	34.8	Very low	167 Å²	167	152 Å²	152	86%	0.856	80%	0.799	S	S	*	*			cis	-146.9	142.2	4.5	-65.6	163.6	0	0	0	107.5
39	P	28.5	Very low	34.4	Very low	107 Å²	107	151.8 Å²	151.8	70%	0.695	80%	0.798	S	S	*	*			trans	-106.8	139.3	176.7	36.5	-29.3	0	0	0	114.5
40	S	36	Very low	34.2	Very low	113 Å²	113	152.4 Å²	152.4	79%	0.79	80%	0.802	S	S	*	*			trans	-143.3	103.2	167.1	-146.9	0	0	0	0	109.4
41	F	33.8	Very low	33.9	Very low	163 Å²	163	146.9 Å²	146.9	72%	0.715	79%	0.794	S	S	*	*				54.9	112.9	84.8	-71.4	-65.1	0	0	0	112
42	R	35.4	Very low	33.9	Very low	211 Å²	211	150.4 Å²	150.4	80%	0.796	80%	0.802	S	S	*	*				-174.1	168.9	58.3	-72.8	-175.6	-168	-174.3	3.8	108.8
43	R	34.2	Very low	33.6	Very low	194 Å²	194	148.1 Å²	148.1	73%	0.732	80%	0.799	S	S	*	*			cis	-175.1	123.4	-23.7	176.2	-176.6	-66.2	-176.7	-2.4	106.6
44	A	31.2	Very low	33.5	Very low	98 Å²	98	143 Å²	143	81%	0.81	79%	0.79	S	S	*	*			trans	-75.5	157.1	175.3	0	0	0	0	0	112.5
45	R	38.4	Very low	33.5	Very low	253 Å²	253	143.9 Å²	143.9	96%	0.955	78%	0.784	S	S	*	*			trans	-141.7	153.1	161.1	-123.1	178.2	-178.5	178.7	-1.6	111.8
46	K	36.4	Very low	33.5	Very low	173 Å²	173	146.6 Å²	146.6	75%	0.752	79%	0.785	S	S	*	*			trans	-125.2	154.9	-160.7	167.9	-175.3	176	-177.8	0	109.3
47	N	37.1	Very low	33.6	Very low	151 Å²	151	143.6 Å²	143.6	81%	0.807	77%	0.774	S	S	*	*			trans	155.5	120.1	151.3	-77.6	-3.4	0	0	0	106.3
48	N	32	Very low	33.6	Very low	134 Å²	134	146.7 Å²	146.7	72%	0.717	77%	0.772	S	S	*	*			cis	78.3	87.9	30.6	-151.3	78.9	0	0	0	114.2
49	E	34.6	Very low	33.5	Very low	182 Å²	182	143.8 Å²	143.8	85%	0.85	77%	0.767	S	S	*	*			trans	-168.9	131.3	138.2	-106.5	170.8	159.2	0	0	114.2
50	S	35.3	Very low	33.6	Very low	96 Å²	96	144 Å²	144	67%	0.671	77%	0.771	S	S	*	*			trans	48.5	107.9	140	-42.2	0	0	0	0	123.8
51	T	32.2	Very low	33.5	Very low	125 Å²	125	143.3 Å²	143.3	77%	0.767	77%	0.766	S	S	*	*				26	122.8	127.5	53.1	0	0	0	0	121.1
52	T	33.6	Very low	33.3	Very low	141 Å²	141	143.2 Å²	143.2	87%	0.865	77%	0.772	S	S	*	*				-170	160	95.2	32.7	0	0	0	0	112.9
53	N	30.4	Very low	33	Very low	155 Å²	155	141.1 Å²	141.1	83%	0.829	77%	0.771	S	S	*	*			trans	-61.8	177.2	-169.3	-58.3	-25.1	0	0	0	118.3
54	S	34	Very low	33	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	77%	0.771	S	S	*	*			trans	103.1	89.5	149.2	-47.5	0	0	0	0	118
55	S	33.7	Very low	33.1	Very low	97 Å²	97	146.1 Å²	146.1	68%	0.678	78%	0.777	S	S	*	*				51.5	133	120	57.8	0	0	0	0	122.6
56	E	32.6	Very low	32.8	Very low	166 Å²	166	141 Å²	141	78%	0.776	76%	0.764	S	S	*	*			trans	94.6	101.2	139.5	-75.5	162.5	-143.5	0	0	121.6
57	T	34.2	Very low	32.5	Very low	108 Å²	108	140.1 Å²	140.1	66%	0.663	77%	0.767	S	S	*	*				76.9	121.3	127.9	57.9	0	0	0	0	122.5
58	N	31.1	Very low	32.2	Very low	140 Å²	140	139.2 Å²	139.2	75%	0.749	77%	0.769	S	S	*	*				75.8	100.1	128	-62	-4.7	0	0	0	121
59	S	29.1	Very low	32	Very low	107 Å²	107	139.6 Å²	139.6	75%	0.748	77%	0.771	S	S	*	*				55.8	120.6	125.6	63.3	0	0	0	0	120.9
60	S	30.2	Very low	32	Very low	111 Å²	111	137 Å²	137	78%	0.776	77%	0.768	S	S	*	*				175.1	154.8	110.6	45.4	0	0	0	0	114.1
61	S	33.9	Very low	32	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	77%	0.773	S	S	*	*			trans	39.4	118.2	147.5	54.4	0	0	0	0	122.8
62	L	29.7	Very low	31.9	Very low	161 Å²	161	136.4 Å²	136.4	84%	0.843	78%	0.775	S	S	*	*				53.5	142.3	109.8	-102.6	143.7	0	0	0	122.1
63	E	30	Very low	31.9	Very low	166 Å²	166	138.8 Å²	138.8	78%	0.776	77%	0.773	S	S	*	*			trans	95.9	104.8	156.2	-66.1	-168.8	-179.8	0	0	122.1
64	H	33.3	Very low	32	Very low	156 Å²	156	138.7 Å²	138.7	72%	0.722	77%	0.773	S	S	*	*				74	101.5	111.5	-149.3	94.3	0	0	0	120.4	Q66	H64-Q66 WeakPolarHBondContact NE2-CG 3.48Å; H64-Q66 PolarHBondContact NE2-NE2 3.03Å
65	Y	32.8	Very low	32.2	Very low	242 Å²	242	140.6 Å²	140.6	95%	0.949	78%	0.775	S	S	*	*			trans	-138.3	147.1	145.8	-86	-74.7	0	0	0	111.7
66	Q	33.2	Very low	32.4	Very low	146 Å²	146	141.7 Å²	141.7	68%	0.682	78%	0.779	S	S	*	*			trans	-101.7	162.3	-158	-70.3	167.9	-31.8	0	0	115.3	H64	H64-Q66 WeakPolarHBondContact NE2-CG 3.48Å; H64-Q66 PolarHBondContact NE2-NE2 3.03Å
67	L	29	Very low	33	Very low	153 Å²	153	140.9 Å²	140.9	80%	0.801	77%	0.773	S	S	*	*			trans	-38.2	165.7	175.5	-56.7	165.7	0	0	0	117.2
68	P	32.3	Very low	33.9	Very low	132 Å²	132	139.3 Å²	139.3	86%	0.857	76%	0.755	S	S	*	*				-128	159.9	103.9	7.6	13.3	0	0	0	114.8
69	N	26.3	Very low	34.9	Very low	143 Å²	143	140.2 Å²	140.2	77%	0.765	75%	0.749	S	S	*	*			trans	-117.6	116.2	-166.6	179.8	21.1	0	0	0	111.8
70	T	35.2	Very low	36.2	Very low	126 Å²	126	144.6 Å²	144.6	77%	0.773	75%	0.754	S	S	*	*			trans	-145.5	117.8	170.7	54.3	0	0	0	0	114.5
71	S	34.5	Very low	37.4	Very low	113 Å²	113	143.6 Å²	143.6	79%	0.79	75%	0.745	S	S	*	*			trans	56.6	115.2	149.9	59.7	0	0	0	0	121
72	A	30.4	Very low	39	Very low	96 Å²	96	145.7 Å²	145.7	79%	0.793	74%	0.738	S	S	*	*			trans	-55.7	142.8	172.5	0	0	0	0	0	116.6
73	K	33.8	Very low	40.6	Very low	191 Å²	191	143.7 Å²	143.7	83%	0.83	74%	0.744	S	S	*	*			trans	-172	119.7	141.9	-100.9	151.1	-174.6	177.3	0	111.4
74	N	33.2	Very low	42.8	Very low	154 Å²	154	142 Å²	142	82%	0.824	74%	0.741	S	S	*	*			trans	49.5	84.7	153.8	-53.2	-8.4	0	0	0	119.2
75	D	38	Very low	45	Very low	146 Å²	146	135.8 Å²	135.8	78%	0.781	71%	0.714	S	S	*	*			trans	-95.5	117.7	157.2	-94.9	-38.8	0	0	0	110.6	F77	D75-F77 PolarHBondContact O-N 3.22Å
76	P	38.5	Very low	47.4	Very low	120 Å²	120	126.7 Å²	126.7	78%	0.779	68%	0.68	S	S	*	*			trans	-81.9	59.3	170.6	35.7	-34.4	0	0	0	110.5
77	F	44.3	Very low	49.7	Very low	148 Å²	148	127 Å²	127	65%	0.649	68%	0.681	S	S	*	*			trans	-98.8	127.8	170.3	-114.7	-86.2	0	0	0	109.4	D75 R79	D75-F77 PolarHBondContact O-N 3.22Å; F77-R79 PolarHBondContact O-N 3.24Å
78	W	52.8	Low	52.4	Low	75 Å²	75	124.1 Å²	124.1	28%	0.284	66%	0.661	S	S	.	*			trans	-49.1	126.7	179.5	-58.3	104.7	0	0	0	110.4	K80 L100 A123 V125	W78-K80 PolarHBondContact O-N 2.95Å; W78-L100 HydrophobicContact CE3-CD1 4.22Å; W78-A123 HydrophobicContact CE3-CB 4.45Å; W78-A123 VanDerWaalsContact CH2-C 3.49Å; W78-A123 HydrophobicContact CH2-CB 3.26Å; W78-A123 VanDerWaalsContact CH2-O 3.28Å; W78-A123 WeakPolarHBondContact CH2-O 3.22Å; W78-A123 HydrophobicContact CZ2-CB 3.4Å; W78-A123 HydrophobicContact CZ3-CB 3.8Å; W78-V125 HydrophobicContact CH2-CG2 4.25Å
79	R	53.1	Low	55	Low	160 Å²	160	117.9 Å²	117.9	60%	0.604	62%	0.62	S	S	*	*			trans	-43.8	135.3	-158.2	-64.2	176.9	-178.3	-109.9	4.6	112.7	F77 G126	F77-R79 PolarHBondContact O-N 3.24Å; R79-G126 PolarHBondContact NE-O 2.68Å; R79-G126 VanDerWaalsContact NE-O 3.1Å; R79-G126 PolarHBondContact NH2-O 2.92Å
80	K	55.8	Low	57.8	Low	199 Å²	199	113.4 Å²	113.4	87%	0.865	60%	0.596	S	S	*	*			trans	-44.4	125.2	169.6	-75.7	-175.2	177.8	179.2	0	109.6	W78 R82	W78-K80 PolarHBondContact O-N 2.95Å; K80-R82 PolarHBondContact O-N 2.95Å
81	P	56.2	Low	60	Low	90 Å²	90	109.9 Å²	109.9	58%	0.584	58%	0.576	S	S	*	*			trans	-58.8	139	-171.8	-22.8	30.9	0	0	0	111.7	C85 V101	P81-C85 WeakPolarHBondContact CB-SG 3.5Å; P81-V101 HydrophobicContact CB-CG2 4.22Å
82	R	66.7	Low	62.3	Low	143 Å²	143	106.7 Å²	106.7	54%	0.54	55%	0.554	S	S	.	*			trans	-65.4	140.4	172.9	-71.2	172.9	60.4	-175	-3.5	108.8	K80 N84 C85 D103	K80-R82 PolarHBondContact O-N 2.95Å; R82-N84 PolarHBondContact O-N 2.9Å; R82-C85 PolarHBondContact O-N 3.39Å; R82-C85 PolarHBondContact O-SG 3.01Å; R82-D103 PolarHBondContact NH1-O 3.32Å
83	A	64	Low	64.7	Low	118 Å²	118	104.1 Å²	104.1	98%	0.975	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-9.2	-178.5	0	0	0	0	0	115.8
84	N	75.4	Confident	66.9	Low	132 Å²	132	97.3 Å²	97.3	71%	0.706	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	35.1	177.2	-156.7	104.3	0	0	0	111.6	R82 P106	R82-N84 PolarHBondContact O-N 2.9Å; N84-P106 WeakPolarHBondContact O-CA 3.3Å; N84-P106 WeakPolarHBondContact O-CB 3.4Å
85	C	79.1	Confident	69.1	Low	24 Å²	24	95.3 Å²	95.3	16%	0.162	50%	0.501	C	S	.	.	S	Bend	trans	-105.2	159.6	167.1	70.8	0	0	0	0	111.6	P81 R82 V101 P106	P81-C85 WeakPolarHBondContact CB-SG 3.5Å; R82-C85 PolarHBondContact O-N 3.39Å; R82-C85 PolarHBondContact O-SG 3.01Å; C85-V101 HydrophobicContact CB-CG1 3.6Å; C85-V101 HydrophobicContact CB-CG2 4.4Å; C85-P106 CarbonylContact C-O 3.1Å; C85-P106 WeakPolarHBondContact CA-O 3.36Å
86	H	83.1	Confident	70.9	Confident	51 Å²	51	96.3 Å²	96.3	24%	0.236	50%	0.501	C	S	.	.			trans	-69.8	132.6	175	-60.9	158.8	0	0	0	111.2	Y88 D90 R99 P106 S108	H86-Y88 HydrophobicContact CB-CD1 4.26Å; H86-Y88 HydrophobicContact CB-CD2 4.36Å; H86-Y88 HydrophobicContact CB-CE1 3.99Å; H86-Y88 HydrophobicContact CB-CE2 4.09Å; H86-Y88 HydrophobicContact CB-CG 4.44Å; H86-Y88 AromaticContact CG-CZ 3.82Å; H86-Y88 AromaticContact ND1-CE2 3.99Å; H86-Y88 AromaticContact ND1-CZ 3.93Å; H86-Y88 PolarHBondContact O-N 3.03Å; H86-D90 IonicContact CE1-OD1 2.69Å; H86-D90 PolarHBondContact CE1-OD1 3.03Å; H86-D90 VanDerWaalsContact CE1-OD1 3.32Å; H86-D90 IonicContact CE1-OD2 2.86Å; H86-D90 IonicContact CG-OD2 3.48Å; H86-D90 VanDerWaalsContact ND1-CG 3.29Å; H86-D90 IonicContact ND1-OD1 2.91Å; H86-D90 PolarHBondContact ND1-OD1 3.29Å; H86-D90 IonicContact ND1-OD2 3.63Å; H86-D90 PolarHBondContact ND1-OD2 2.84Å; H86-R99 PolarHBondContact O-NH1 3.31Å; H86-R99 VanDerWaalsContact O-NH1 3.12Å; H86-P106 PolarHBondContact N-O 3.2Å; H86-S108 PolarHBondContact O-OG 3.16Å
87	E	82.4	Confident	72.7	Confident	152 Å²	152	93.2 Å²	93.2	71%	0.71	49%	0.491	S	S	*	.	S	Bend	trans	-72.2	-3.1	175.8	-63.5	-169.8	160.1	0	0	113.6	R99	E87-R99 PolarHBondContact O-NH1 2.95Å; E87-R99 VanDerWaalsContact O-NH1 3.11Å; E87-R99 PolarHBondContact O-NH2 3.46Å
88	Y	84.9	Confident	74.2	Confident	94 Å²	94	91.6 Å²	91.6	37%	0.369	49%	0.485	S	S	.	.	S	Bend	trans	-120.4	156.6	173.6	55.5	-90.4	0	0	0	110.5	H86 C94 S108	H86-Y88 HydrophobicContact CB-CD1 4.26Å; H86-Y88 HydrophobicContact CB-CD2 4.36Å; H86-Y88 HydrophobicContact CB-CE1 3.99Å; H86-Y88 HydrophobicContact CB-CE2 4.09Å; H86-Y88 HydrophobicContact CB-CG 4.44Å; H86-Y88 AromaticContact CG-CZ 3.82Å; H86-Y88 AromaticContact ND1-CE2 3.99Å; H86-Y88 AromaticContact ND1-CZ 3.93Å; H86-Y88 PolarHBondContact O-N 3.03Å; Y88-C94 WeakPolarHBondContact CA-O 3.35Å; Y88-S108 PolarHBondContact O-OG 3.27Å
89	C	87.5	Confident	75.6	Confident	0 Å²	0	90.8 Å²	90.8	0%	0	48%	0.482	C	S	.	.	B	Isolated β-bridge	trans	-72.2	124.3	169.3	163.6	0	0	0	0	110.8	S91 C92 G93 C94 R99 S108 H110	C89-S91 VanDerWaalsContact C-N 3.27Å; C89-S91 PolarHBondContact O-N 2.98Å; C89-S91 PolarHBondContact SG-N 3.07Å; C89-S91 VanDerWaalsContact SG-N 3.44Å; C89-C92 VanDerWaalsContact CB-SG 3.58Å; C89-G93 VanDerWaalsContact O-CA 3.26Å; C89-G93 WeakPolarHBondContact O-CA 3.28Å; C89-G93 PolarHBondContact O-N 3.24Å; C89-C94 PolarHBondContact N-O 3.3Å; C89-R99 HydrophobicContact CB-CG 4.36Å; C89-S108 CarbonylContact C-O 3.48Å; C89-S108 VanDerWaalsContact CA-O 3.27Å; C89-S108 WeakPolarHBondContact CA-O 3.46Å; C89-H110 WeakPolarHBondContact CB-CE1 3.12Å; C89-H110 WeakPolarHBondContact CB-ND1 3.17Å; C89-H110 PolarHBondContact SG-ND1 3.28Å
90	D	84.2	Confident	77	Confident	50 Å²	50	83.8 Å²	83.8	27%	0.267	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.2	-178.6	-77.1	-107.5	0	0	0	114	H86 A107 S108 F109	H86-D90 IonicContact CE1-OD1 2.69Å; H86-D90 PolarHBondContact CE1-OD1 3.03Å; H86-D90 VanDerWaalsContact CE1-OD1 3.32Å; H86-D90 IonicContact CE1-OD2 2.86Å; H86-D90 IonicContact CG-OD2 3.48Å; H86-D90 VanDerWaalsContact ND1-CG 3.29Å; H86-D90 IonicContact ND1-OD1 2.91Å; H86-D90 PolarHBondContact ND1-OD1 3.29Å; H86-D90 IonicContact ND1-OD2 3.63Å; H86-D90 PolarHBondContact ND1-OD2 2.84Å; D90-A107 HydrophobicContact CB-CB 4.32Å; D90-A107 WeakPolarHBondContact OD2-CA 3.47Å; D90-A107 WeakPolarHBondContact OD2-CB 3.41Å; D90-S108 PolarHBondContact N-O 3.07Å; D90-S108 PolarHBondContact OD2-N 3.38Å; D90-F109 HydrophobicContact CB-CD1 4.39Å; D90-F109 HydrophobicContact CB-CE1 3.78Å; D90-F109 HydrophobicContact CB-CZ 3.96Å
91	S	81.5	Confident	78.5	Confident	51 Å²	51	75.4 Å²	75.4	36%	0.357	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-67.5	173.3	-70.9	0	0	0	0	112.1	C89 F109 C113 K775	C89-S91 VanDerWaalsContact C-N 3.27Å; C89-S91 PolarHBondContact O-N 2.98Å; C89-S91 PolarHBondContact SG-N 3.07Å; C89-S91 VanDerWaalsContact SG-N 3.44Å; S91-F109 WeakPolarHBondContact OG-CD1 3.42Å; S91-C113 VanDerWaalsContact CB-O 3.25Å; S91-C113 WeakPolarHBondContact CB-O 3.41Å; S91-C113 PolarHBondContact OG-O 3.1Å; S91-K775 PolarHBondContact O-NZ 3.34Å
92	C	83.2	Confident	80	Confident	46 Å²	46	71.2 Å²	71.2	31%	0.311	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-12.1	-170.8	71.9	0	0	0	0	115.7	C89 C94 H110	C89-C92 VanDerWaalsContact CB-SG 3.58Å; C92-C94 PolarHBondContact O-N 3.1Å; C92-C94 VanDerWaalsContact SG-CB 3.6Å; C92-C94 PolarHBondContact SG-N 2.9Å; C92-C94 VanDerWaalsContact SG-N 3.37Å; C92-H110 PolarHBondContact SG-CE1 2.95Å; C92-H110 PolarHBondContact SG-ND1 3.3Å
93	G	80.5	Confident	80.8	Confident	43 Å²	43	66.4 Å²	66.4	44%	0.443	38%	0.38	S	S	.	.			trans	74.2	-0	-176	0	0	0	0	0	115.7	C89	C89-G93 VanDerWaalsContact O-CA 3.26Å; C89-G93 WeakPolarHBondContact O-CA 3.28Å; C89-G93 PolarHBondContact O-N 3.24Å
94	C	79.8	Confident	81.7	Confident	48 Å²	48	67.2 Å²	67.2	32%	0.324	36%	0.358	S	S	.	.			trans	-81.5	143	-178.6	-57.5	0	0	0	0	111.6	Y88 C89 C92	Y88-C94 WeakPolarHBondContact CA-O 3.35Å; C89-C94 PolarHBondContact N-O 3.3Å; C92-C94 PolarHBondContact O-N 3.1Å; C92-C94 VanDerWaalsContact SG-CB 3.6Å; C92-C94 PolarHBondContact SG-N 2.9Å; C92-C94 VanDerWaalsContact SG-N 3.37Å
95	I	80.4	Confident	82.2	Confident	112 Å²	112	62 Å²	62	57%	0.574	33%	0.331	S	S	*	.			trans	-88.6	-37.8	178.9	-64.8	168.1	0	0	0	111.1	R99	I95-R99 PolarHBondContact O-NE 2.26Å; I95-R99 PolarHBondContact O-NH2 3.49Å
96	E	75.7	Confident	82.6	Confident	167 Å²	167	63 Å²	63	78%	0.78	34%	0.338	S	S	*	.	S	Bend	trans	-69.1	153	178.2	-66	168.1	-166.8	0	0	112.1	H110	E96-H110 PolarHBondContact O-CE1 3.14Å; E96-H110 PolarHBondContact O-NE2 3.49Å
97	G	76.2	Confident	82.7	Confident	55 Å²	55	61 Å²	61	57%	0.567	33%	0.329	S	S	*	.	S	Bend	trans	93.8	157.5	179.6	0	0	0	0	0	114.4
98	E	75.2	Confident	83	Confident	113 Å²	113	53.7 Å²	53.7	53%	0.528	30%	0.296	S	S	.	.			trans	-71.3	132.6	179.2	-63.6	-168.3	177	0	0	111.5	H110	E98-H110 PolarHBondContact O-CD2 3.31Å; E98-H110 VanDerWaalsContact O-CD2 3.22Å
99	R	82.1	Confident	83	Confident	58 Å²	58	50.3 Å²	50.3	22%	0.219	28%	0.283	C	S	.	.			trans	-129.5	125.4	-170.9	-71.7	175.2	-73.9	127.8	-14.9	111.7	H86 E87 C89 I95 S108 F109	H86-R99 PolarHBondContact O-NH1 3.31Å; H86-R99 VanDerWaalsContact O-NH1 3.12Å; E87-R99 PolarHBondContact O-NH1 2.95Å; E87-R99 VanDerWaalsContact O-NH1 3.11Å; E87-R99 PolarHBondContact O-NH2 3.46Å; C89-R99 HydrophobicContact CB-CG 4.36Å; I95-R99 PolarHBondContact O-NE 2.26Å; I95-R99 PolarHBondContact O-NH2 3.49Å; R99-S108 PolarHBondContact NH1-OG 3.26Å; R99-S108 VanDerWaalsContact NH1-OG 3.1Å; R99-F109 CarbonylContact C-O 3.46Å; R99-F109 WeakPolarHBondContact CA-O 3.38Å
100	L	84	Confident	83	Confident	14 Å²	14	51.3 Å²	51.3	7%	0.073	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	121.1	170.8	-169.4	66.7	0	0	0	109.4	W78 S108 F109 L111 L114 P124 W128	W78-L100 HydrophobicContact CE3-CD1 4.22Å; L100-S108 WeakPolarHBondContact O-CA 3.4Å; L100-F109 PolarHBondContact N-O 3.43Å; L100-F109 PolarHBondContact O-N 2.93Å; L100-L111 HydrophobicContact CB-CD2 4.02Å; L100-L111 HydrophobicContact CD2-CD2 3.98Å; L100-L111 HydrophobicContact CG-CD2 4.47Å; L100-L114 HydrophobicContact CD2-CD1 4.15Å; L100-P124 HydrophobicContact CD1-CG 4.28Å; L100-P124 HydrophobicContact CD2-CG 3.76Å; L100-W128 HydrophobicContact CB-CZ3 4.45Å; L100-W128 HydrophobicContact CD2-CD2 3.46Å; L100-W128 VanDerWaalsContact CD2-CD2 3.46Å; L100-W128 HydrophobicContact CD2-CE3 3.7Å; L100-W128 HydrophobicContact CD2-CG 3.96Å; L100-W128 HydrophobicContact CD2-CH2 3.95Å; L100-W128 HydrophobicContact CD2-CZ2 3.76Å; L100-W128 HydrophobicContact CD2-CZ3 3.94Å; L100-W128 HydrophobicContact CG-CD2 3.87Å; L100-W128 HydrophobicContact CG-CE3 3.63Å; L100-W128 HydrophobicContact CG-CG 4.41Å; L100-W128 HydrophobicContact CG-CH2 4.35Å; L100-W128 HydrophobicContact CG-CZ3 3.88Å
101	V	86.5	Confident	82.9	Confident	23 Å²	23	50 Å²	50	14%	0.139	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	136.8	-178	-179.4	0	0	0	0	109.9	P81 C85	P81-V101 HydrophobicContact CB-CG2 4.22Å; C85-V101 HydrophobicContact CB-CG1 3.6Å; C85-V101 HydrophobicContact CB-CG2 4.4Å
102	C	86.8	Confident	82.9	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.014	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-74.8	131	174.1	-177.3	0	0	0	0	111.9	R104 A107 W128 C130	C102-R104 VanDerWaalsContact C-N 3.25Å; C102-R104 PolarHBondContact O-N 3.06Å; C102-R104 PolarHBondContact SG-N 2.98Å; C102-R104 VanDerWaalsContact SG-N 3.41Å; C102-A107 WeakPolarHBondContact CB-O 3.37Å; C102-A107 PolarHBondContact N-O 3.39Å; C102-W128 HydrophobicContact CB-CE3 4.43Å; C102-W128 HydrophobicContact CB-CZ3 4.19Å; C102-C130 HydrophobicContact CB-CB 3.9Å; C102-C130 PolarHBondContact SG-N 3.12Å
103	D	85	Confident	82.9	Confident	41 Å²	41	54.8 Å²	54.8	22%	0.219	30%	0.296	C	S	.	.	S	Bend	trans	-74.2	-12.2	177.2	-75.4	-54.9	0	0	0	114	R82 V127 W128 F129	R82-D103 PolarHBondContact NH1-O 3.32Å; D103-V127 HydrophobicContact CB-CG1 3.75Å; D103-V127 VanDerWaalsContact OD2-CA 3.3Å; D103-V127 WeakPolarHBondContact OD2-CA 3.35Å; D103-V127 WeakPolarHBondContact OD2-CG1 3.22Å; D103-W128 PolarHBondContact N-O 3.46Å; D103-W128 PolarHBondContact OD2-N 2.75Å; D103-F129 HydrophobicContact CB-CD1 4.26Å; D103-F129 HydrophobicContact CB-CE1 3.99Å
104	R	81.6	Confident	82.8	Confident	135 Å²	135	53.6 Å²	53.6	51%	0.509	28%	0.279	S	S	.	.	S	Bend	trans	-108.1	-16.5	-179.5	-99.1	-179.5	177.1	-121.5	-3.4	116.1	C102 F129 C133 L137	C102-R104 VanDerWaalsContact C-N 3.25Å; C102-R104 PolarHBondContact O-N 3.06Å; C102-R104 PolarHBondContact SG-N 2.98Å; C102-R104 VanDerWaalsContact SG-N 3.41Å; R104-F129 HydrophobicContact CB-CD1 3.82Å; R104-F129 HydrophobicContact CB-CE1 4.18Å; R104-F129 HydrophobicContact CG-CD1 3.75Å; R104-F129 HydrophobicContact CG-CE1 3.65Å; R104-C133 HydrophobicContact CB-CB 3.85Å; R104-L137 VanDerWaalsContact NH2-CD2 3.33Å
105	C	85.6	Confident	82.5	Confident	22 Å²	22	53.5 Å²	53.5	15%	0.149	28%	0.276	C	S	.	.	S	Bend	trans	-148.9	162.7	-179.6	77.8	0	0	0	0	110.5	A107	C105-A107 PolarHBondContact O-N 2.91Å
106	P	87.6	Confident	82.2	Confident	46 Å²	46	51.7 Å²	51.7	30%	0.299	27%	0.271	S	S	.	.	S	Bend	trans	-67.2	-3.1	-173.4	29.3	-38.4	0	0	0	114.4	N84 C85 H86	N84-P106 WeakPolarHBondContact O-CA 3.3Å; N84-P106 WeakPolarHBondContact O-CB 3.4Å; C85-P106 CarbonylContact C-O 3.1Å; C85-P106 WeakPolarHBondContact CA-O 3.36Å; H86-P106 PolarHBondContact N-O 3.2Å
107	A	86.9	Confident	82.2	Confident	8 Å²	8	46.2 Å²	46.2	7%	0.066	25%	0.25	C	C	.	.			trans	-71.6	138.4	-171.2	0	0	0	0	0	113.2	D90 C102 C105 F109	D90-A107 HydrophobicContact CB-CB 4.32Å; D90-A107 WeakPolarHBondContact OD2-CA 3.47Å; D90-A107 WeakPolarHBondContact OD2-CB 3.41Å; C102-A107 WeakPolarHBondContact CB-O 3.37Å; C102-A107 PolarHBondContact N-O 3.39Å; C105-A107 PolarHBondContact O-N 2.91Å; A107-F109 HydrophobicContact CB-CE2 3.5Å; A107-F109 VanDerWaalsContact CB-CE2 3.5Å; A107-F109 HydrophobicContact CB-CZ 3.74Å
108	S	87.1	Confident	82.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149.7	172.9	87.8	0	0	0	0	110.9	H86 Y88 C89 D90 R99 L100	H86-S108 PolarHBondContact O-OG 3.16Å; Y88-S108 PolarHBondContact O-OG 3.27Å; C89-S108 CarbonylContact C-O 3.48Å; C89-S108 VanDerWaalsContact CA-O 3.27Å; C89-S108 WeakPolarHBondContact CA-O 3.46Å; D90-S108 PolarHBondContact N-O 3.07Å; D90-S108 PolarHBondContact OD2-N 3.38Å; R99-S108 PolarHBondContact NH1-OG 3.26Å; R99-S108 VanDerWaalsContact NH1-OG 3.1Å; L100-S108 WeakPolarHBondContact O-CA 3.4Å
109	F	86.5	Confident	82.4	Confident	23 Å²	23	45.7 Å²	45.7	10%	0.101	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	135.8	-174.8	-58.8	-90	0	0	0	110.7	D90 S91 R99 L100 A107 L114 W128 C130	D90-F109 HydrophobicContact CB-CD1 4.39Å; D90-F109 HydrophobicContact CB-CE1 3.78Å; D90-F109 HydrophobicContact CB-CZ 3.96Å; S91-F109 WeakPolarHBondContact OG-CD1 3.42Å; R99-F109 CarbonylContact C-O 3.46Å; R99-F109 WeakPolarHBondContact CA-O 3.38Å; L100-F109 PolarHBondContact N-O 3.43Å; L100-F109 PolarHBondContact O-N 2.93Å; A107-F109 HydrophobicContact CB-CE2 3.5Å; A107-F109 VanDerWaalsContact CB-CE2 3.5Å; A107-F109 HydrophobicContact CB-CZ 3.74Å; F109-L114 HydrophobicContact CB-CD2 3.52Å; F109-L114 HydrophobicContact CB-CG 4.09Å; F109-L114 HydrophobicContact CD1-CD2 4.07Å; F109-L114 HydrophobicContact CD2-CD2 4.22Å; F109-L114 HydrophobicContact CG-CD2 3.68Å; F109-W128 AromaticContact CD2-CH2 3.76Å; F109-W128 HydrophobicContact CD2-CH2 3.76Å; F109-W128 HydrophobicContact CD2-CZ3 4.04Å; F109-W128 HydrophobicContact CE2-CH2 4.35Å; F109-W128 HydrophobicContact CG-CH2 4.45Å; F109-C130 HydrophobicContact CD2-CB 4.05Å; F109-C130 HydrophobicContact CE2-CB 3.38Å; F109-C130 HydrophobicContact CZ-CB 4.08Å
110	H	85.6	Confident	82.1	Confident	21 Å²	21	46.8 Å²	46.8	10%	0.097	25%	0.252	C	S	.	.			trans	-63.8	149.9	161.2	-53.8	97.2	0	0	0	109.6	C89 C92 E96 E98 E112 C113 L114	C89-H110 WeakPolarHBondContact CB-CE1 3.12Å; C89-H110 WeakPolarHBondContact CB-ND1 3.17Å; C89-H110 PolarHBondContact SG-ND1 3.28Å; C92-H110 PolarHBondContact SG-CE1 2.95Å; C92-H110 PolarHBondContact SG-ND1 3.3Å; E96-H110 PolarHBondContact O-CE1 3.14Å; E96-H110 PolarHBondContact O-NE2 3.49Å; E98-H110 PolarHBondContact O-CD2 3.31Å; E98-H110 VanDerWaalsContact O-CD2 3.22Å; H110-E112 VanDerWaalsContact C-N 3.26Å; H110-E112 PolarHBondContact O-N 3.43Å; H110-C113 HydrophobicContact CB-CB 3.85Å; H110-C113 WeakPolarHBondContact O-CA 3.38Å; H110-C113 WeakPolarHBondContact O-CB 3.39Å; H110-C113 PolarHBondContact O-N 2.87Å; H110-L114 PolarHBondContact O-N 2.74Å
111	L	84.1	Confident	81.5	Confident	23 Å²	23	54 Å²	54	12%	0.12	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-58.1	-41.5	176.9	-59.9	176.4	0	0	0	111.6	L100 C113 L114 P117 L118 P120 A123	L100-L111 HydrophobicContact CB-CD2 4.02Å; L100-L111 HydrophobicContact CD2-CD2 3.98Å; L100-L111 HydrophobicContact CG-CD2 4.47Å; L111-C113 PolarHBondContact O-N 3.07Å; L111-L114 PolarHBondContact O-N 3.1Å; L111-P117 WeakPolarHBondContact O-CA 3.29Å; L111-L118 WeakPolarHBondContact CB-O 3.36Å; L111-L118 PolarHBondContact O-N 2.69Å; L111-P120 HydrophobicContact CD1-CB 4.14Å; L111-A123 HydrophobicContact CD1-CB 3.96Å; L111-A123 HydrophobicContact CD2-CB 3.9Å
112	E	80.6	Confident	80.9	Confident	162 Å²	162	60 Å²	60	76%	0.757	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-63.5	-22.9	172.3	-61.4	174.8	-172.7	0	0	114.2	H110	H110-E112 VanDerWaalsContact C-N 3.26Å; H110-E112 PolarHBondContact O-N 3.43Å
113	C	82.5	Confident	80	Confident	34 Å²	34	60.1 Å²	60.1	23%	0.23	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-97.4	9.9	-174	-74.5	0	0	0	0	113.5	S91 H110 L111	S91-C113 VanDerWaalsContact CB-O 3.25Å; S91-C113 WeakPolarHBondContact CB-O 3.41Å; S91-C113 PolarHBondContact OG-O 3.1Å; H110-C113 HydrophobicContact CB-CB 3.85Å; H110-C113 WeakPolarHBondContact O-CA 3.38Å; H110-C113 WeakPolarHBondContact O-CB 3.39Å; H110-C113 PolarHBondContact O-N 2.87Å; L111-C113 PolarHBondContact O-N 3.07Å
114	L	79.2	Confident	79.2	Confident	19 Å²	19	60 Å²	60	10%	0.099	32%	0.32	C	S	.	.	S	Bend	trans	-84.2	162.4	171.1	-64.4	168.4	0	0	0	109.8	L100 F109 H110 L111 P116 P117 L118 W128	L100-L114 HydrophobicContact CD2-CD1 4.15Å; F109-L114 HydrophobicContact CB-CD2 3.52Å; F109-L114 HydrophobicContact CB-CG 4.09Å; F109-L114 HydrophobicContact CD1-CD2 4.07Å; F109-L114 HydrophobicContact CD2-CD2 4.22Å; F109-L114 HydrophobicContact CG-CD2 3.68Å; H110-L114 PolarHBondContact O-N 2.74Å; L111-L114 PolarHBondContact O-N 3.1Å; L114-P116 CarbonylContact C-O 3.57Å; L114-P116 WeakPolarHBondContact CB-O 3.46Å; L114-P116 CarbonylContact O-C 3.55Å; L114-P117 WeakPolarHBondContact O-CD 3.46Å; L114-P117 VanDerWaalsContact O-N 3.09Å; L114-L118 HydrophobicContact CD1-CB 4.38Å; L114-L118 HydrophobicContact CD1-CD1 3.47Å; L114-L118 VanDerWaalsContact CD1-CD1 3.47Å; L114-W128 HydrophobicContact CD1-CH2 4.43Å; L114-W128 HydrophobicContact CD1-CZ2 4.05Å; L114-W128 HydrophobicContact CD2-CH2 3.73Å; L114-W128 HydrophobicContact CD2-CZ2 3.8Å
115	D	73.9	Confident	78.5	Confident	46 Å²	46	60.2 Å²	60.2	25%	0.246	34%	0.336	C	S	.	.	S	Bend	trans	-124.4	98	176.5	177.3	7.1	0	0	0	108.1	R331 T332	D115-R331 WeakPolarHBondContact OD2-CA 3.28Å; D115-R331 WeakPolarHBondContact OD2-CB 3.45Å; D115-T332 WeakPolarHBondContact OD1-CB 3.27Å; D115-T332 VanDerWaalsContact OD1-CG2 3.3Å; D115-T332 WeakPolarHBondContact OD1-CG2 3.47Å; D115-T332 PolarHBondContact OD1-OG1 3.37Å; D115-T332 PolarHBondContact OD2-N 3.04Å; D115-T332 VanDerWaalsContact OD2-N 3.15Å
116	P	72.8	Confident	78	Confident	74 Å²	74	60.9 Å²	60.9	48%	0.481	35%	0.346	S	S	.	.	S	Bend	cis	-68.8	162.1	-3.9	28	-34.5	0	0	0	114.3	L114 I319	L114-P116 CarbonylContact C-O 3.57Å; L114-P116 WeakPolarHBondContact CB-O 3.46Å; L114-P116 CarbonylContact O-C 3.55Å; P116-I319 HydrophobicContact CB-CD1 3.74Å; P116-I319 HydrophobicContact CG-CD1 4.33Å
117	P	76.9	Confident	77.5	Confident	51 Å²	51	63.1 Å²	63.1	33%	0.331	36%	0.359	S	S	.	.			trans	-55.6	150	164.2	-24.7	35.3	0	0	0	111.9	L111 L114 F334	L111-P117 WeakPolarHBondContact O-CA 3.29Å; L114-P117 WeakPolarHBondContact O-CD 3.46Å; L114-P117 VanDerWaalsContact O-N 3.09Å; P117-F334 HydrophobicContact CG-CD2 4.41Å; P117-F334 HydrophobicContact CG-CE1 3.96Å; P117-F334 HydrophobicContact CG-CE2 3.54Å; P117-F334 HydrophobicContact CG-CZ 3.28Å
118	L	79	Confident	77.4	Confident	46 Å²	46	64.5 Å²	64.5	24%	0.241	36%	0.363	C	S	.	.			trans	-114.2	140.1	174	-89.3	138.9	0	0	0	110.4	L111 L114	L111-L118 WeakPolarHBondContact CB-O 3.36Å; L111-L118 PolarHBondContact O-N 2.69Å; L114-L118 HydrophobicContact CD1-CB 4.38Å; L114-L118 HydrophobicContact CD1-CD1 3.47Å; L114-L118 VanDerWaalsContact CD1-CD1 3.47Å
119	D	75.9	Confident	77.2	Confident	112 Å²	112	67.5 Å²	67.5	60%	0.599	38%	0.376	S	S	*	.			trans	-74.6	149	170.9	-77.3	-39.7	0	0	0	111	D121 E122 A123	D119-D121 PolarHBondContact O-N 2.87Å; D119-E122 HydrophobicContact CB-CB 4.48Å; D119-E122 PolarHBondContact O-N 3.03Å; D119-E122 VanDerWaalsContact O-N 3.16Å; D119-A123 PolarHBondContact O-N 3.41Å; D119-A123 VanDerWaalsContact O-N 3.07Å
120	P	75.4	Confident	77.1	Confident	81 Å²	81	66.5 Å²	66.5	53%	0.526	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.9	178.5	25.3	-33.9	0	0	0	113.8	L111	L111-P120 HydrophobicContact CD1-CB 4.14Å
121	D	72.3	Confident	76.8	Confident	166 Å²	166	69.2 Å²	69.2	89%	0.888	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-26	176.5	-65.7	-31.2	0	0	0	112.8	D119	D119-D121 PolarHBondContact O-N 2.87Å
122	E	73	Confident	76.7	Confident	147 Å²	147	76.9 Å²	76.9	69%	0.687	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	2.2	177.9	-156	174.7	-139.9	0	0	112.3	D119	D119-E122 HydrophobicContact CB-CB 4.48Å; D119-E122 PolarHBondContact O-N 3.03Å; D119-E122 VanDerWaalsContact O-N 3.16Å
123	A	68.4	Low	76.8	Confident	5 Å²	5	69.9 Å²	69.9	4%	0.041	38%	0.38	C	S	.	.	S	Bend	trans	-64.3	142.8	-177.1	0	0	0	0	0	111.7	W78 L111 D119 V125	W78-A123 HydrophobicContact CE3-CB 4.45Å; W78-A123 VanDerWaalsContact CH2-C 3.49Å; W78-A123 HydrophobicContact CH2-CB 3.26Å; W78-A123 VanDerWaalsContact CH2-O 3.28Å; W78-A123 WeakPolarHBondContact CH2-O 3.22Å; W78-A123 HydrophobicContact CZ2-CB 3.4Å; W78-A123 HydrophobicContact CZ3-CB 3.8Å; L111-A123 HydrophobicContact CD1-CB 3.96Å; L111-A123 HydrophobicContact CD2-CB 3.9Å; D119-A123 PolarHBondContact O-N 3.41Å; D119-A123 VanDerWaalsContact O-N 3.07Å; A123-V125 PolarHBondContact O-N 3.47Å
124	P	68.9	Low	76.8	Confident	39 Å²	39	70.2 Å²	70.2	25%	0.253	38%	0.383	S	S	.	.			trans	-76.4	101.9	-159.9	25.6	-32.9	0	0	0	113.1	L100 G126 W128	L100-P124 HydrophobicContact CD1-CG 4.28Å; L100-P124 HydrophobicContact CD2-CG 3.76Å; P124-G126 PolarHBondContact O-N 3.32Å; P124-W128 HydrophobicContact CB-CB 4.31Å; P124-W128 HydrophobicContact CB-CG 4.3Å; P124-W128 HydrophobicContact CG-CB 3.89Å; P124-W128 HydrophobicContact CG-CD2 4.45Å; P124-W128 HydrophobicContact CG-CG 3.6Å
125	V	65.7	Low	76.5	Confident	140 Å²	140	72.2 Å²	72.2	85%	0.848	39%	0.392	S	S	*	.			trans	-72.7	95.9	173.8	-172.8	0	0	0	0	110.1	W78 A123	W78-V125 HydrophobicContact CH2-CG2 4.25Å; A123-V125 PolarHBondContact O-N 3.47Å
126	G	75.3	Confident	76.8	Confident	35 Å²	35	73.6 Å²	73.6	36%	0.361	40%	0.402	S	S	.	.	S	Bend	trans	159	-136.9	178.2	0	0	0	0	0	113.5	R79 P124	R79-G126 PolarHBondContact NE-O 2.68Å; R79-G126 VanDerWaalsContact NE-O 3.1Å; R79-G126 PolarHBondContact NH2-O 2.92Å; P124-G126 PolarHBondContact O-N 3.32Å
127	V	78.5	Confident	76.8	Confident	93 Å²	93	71 Å²	71	56%	0.564	38%	0.384	S	S	*	.			trans	-93.6	128.7	166.8	-179.5	0	0	0	0	106.8	D103 F129	D103-V127 HydrophobicContact CB-CG1 3.75Å; D103-V127 VanDerWaalsContact OD2-CA 3.3Å; D103-V127 WeakPolarHBondContact OD2-CA 3.35Å; D103-V127 WeakPolarHBondContact OD2-CG1 3.22Å; V127-F129 HydrophobicContact CG1-CD1 4.46Å; V127-F129 HydrophobicContact CG1-CE1 3.61Å; V127-F129 HydrophobicContact CG1-CE2 3.95Å; V127-F129 HydrophobicContact CG1-CZ 3.34Å
128	W	83.1	Confident	76.5	Confident	38 Å²	38	74.6 Å²	74.6	14%	0.144	40%	0.395	C	S	.	.			trans	-122.6	138.9	179.3	-179.6	77.4	0	0	0	112.6	L100 C102 D103 F109 L114 P124 C130	L100-W128 HydrophobicContact CB-CZ3 4.45Å; L100-W128 HydrophobicContact CD2-CD2 3.46Å; L100-W128 VanDerWaalsContact CD2-CD2 3.46Å; L100-W128 HydrophobicContact CD2-CE3 3.7Å; L100-W128 HydrophobicContact CD2-CG 3.96Å; L100-W128 HydrophobicContact CD2-CH2 3.95Å; L100-W128 HydrophobicContact CD2-CZ2 3.76Å; L100-W128 HydrophobicContact CD2-CZ3 3.94Å; L100-W128 HydrophobicContact CG-CD2 3.87Å; L100-W128 HydrophobicContact CG-CE3 3.63Å; L100-W128 HydrophobicContact CG-CG 4.41Å; L100-W128 HydrophobicContact CG-CH2 4.35Å; L100-W128 HydrophobicContact CG-CZ3 3.88Å; C102-W128 HydrophobicContact CB-CE3 4.43Å; C102-W128 HydrophobicContact CB-CZ3 4.19Å; D103-W128 PolarHBondContact N-O 3.46Å; D103-W128 PolarHBondContact OD2-N 2.75Å; F109-W128 AromaticContact CD2-CH2 3.76Å; F109-W128 HydrophobicContact CD2-CH2 3.76Å; F109-W128 HydrophobicContact CD2-CZ3 4.04Å; F109-W128 HydrophobicContact CE2-CH2 4.35Å; F109-W128 HydrophobicContact CG-CH2 4.45Å; L114-W128 HydrophobicContact CD1-CH2 4.43Å; L114-W128 HydrophobicContact CD1-CZ2 4.05Å; L114-W128 HydrophobicContact CD2-CH2 3.73Å; L114-W128 HydrophobicContact CD2-CZ2 3.8Å; P124-W128 HydrophobicContact CB-CB 4.31Å; P124-W128 HydrophobicContact CB-CG 4.3Å; P124-W128 HydrophobicContact CG-CB 3.89Å; P124-W128 HydrophobicContact CG-CD2 4.45Å; P124-W128 HydrophobicContact CG-CG 3.6Å; W128-C130 VanDerWaalsContact CH2-CA 3.41Å; W128-C130 HydrophobicContact CH2-CB 3.54Å; W128-C130 HydrophobicContact CZ2-CB 4.23Å; W128-C130 HydrophobicContact CZ3-CB 3.76Å
129	F	83.6	Confident	76	Confident	63 Å²	63	74.3 Å²	74.3	28%	0.276	39%	0.393	S	S	.	.			trans	-118.9	122.3	178.1	-52.7	-61.7	0	0	0	109.2	D103 R104 V127 C133 L137	D103-F129 HydrophobicContact CB-CD1 4.26Å; D103-F129 HydrophobicContact CB-CE1 3.99Å; R104-F129 HydrophobicContact CB-CD1 3.82Å; R104-F129 HydrophobicContact CB-CE1 4.18Å; R104-F129 HydrophobicContact CG-CD1 3.75Å; R104-F129 HydrophobicContact CG-CE1 3.65Å; V127-F129 HydrophobicContact CG1-CD1 4.46Å; V127-F129 HydrophobicContact CG1-CE1 3.61Å; V127-F129 HydrophobicContact CG1-CE2 3.95Å; V127-F129 HydrophobicContact CG1-CZ 3.34Å; F129-C133 HydrophobicContact CB-CB 3.97Å; F129-L137 HydrophobicContact CB-CD1 4.11Å; F129-L137 HydrophobicContact CD1-CD1 3.93Å; F129-L137 HydrophobicContact CD2-CD1 3.1Å; F129-L137 HydrophobicContact CE1-CD1 4.08Å; F129-L137 HydrophobicContact CE2-CD1 3.28Å; F129-L137 HydrophobicContact CG-CD1 3.43Å; F129-L137 VanDerWaalsContact CG-CD1 3.43Å; F129-L137 HydrophobicContact CZ-CD1 3.75Å
130	C	85	Confident	75.5	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.007	39%	0.385	C	S	.	.			trans	-57.4	159.6	174.1	73.5	0	0	0	0	111.3	C102 F109 W128 R132 C133 S134	C102-C130 HydrophobicContact CB-CB 3.9Å; C102-C130 PolarHBondContact SG-N 3.12Å; F109-C130 HydrophobicContact CD2-CB 4.05Å; F109-C130 HydrophobicContact CE2-CB 3.38Å; F109-C130 HydrophobicContact CZ-CB 4.08Å; W128-C130 VanDerWaalsContact CH2-CA 3.41Å; W128-C130 HydrophobicContact CH2-CB 3.54Å; W128-C130 HydrophobicContact CZ2-CB 4.23Å; W128-C130 HydrophobicContact CZ3-CB 3.76Å; C130-R132 PolarHBondContact O-N 2.79Å; C130-C133 CarbonylContact O-C 3.57Å; C130-C133 WeakPolarHBondContact O-CA 3.08Å; C130-C133 PolarHBondContact O-N 2.96Å; C130-S134 PolarHBondContact O-N 3.23Å
131	H	78.8	Confident	74.9	Confident	79 Å²	79	74.3 Å²	74.3	37%	0.366	38%	0.383	S	S	.	.	H	α-helix	trans	-49	-40.1	-172	-165.9	48.8	0	0	0	114	C133 S134 M135 R325	H131-C133 PolarHBondContact O-N 3.28Å; H131-S134 PolarHBondContact O-N 3.47Å; H131-M135 WeakPolarHBondContact NE2-CE 3.48Å; H131-M135 PolarHBondContact O-N 3.1Å; H131-M135 VanDerWaalsContact O-N 3.07Å; H131-R325 PolarHBondContact CE1-NH2 2.96Å
132	R	81.3	Confident	74.2	Confident	184 Å²	184	68.9 Å²	68.9	69%	0.694	35%	0.354	S	S	*	.	H	α-helix	trans	-63.8	-38.4	175.6	-60.2	-175.1	-176.6	-144.1	5.8	113.6	C130 V136	C130-R132 PolarHBondContact O-N 2.79Å; R132-V136 WeakPolarHBondContact O-CG2 3.2Å; R132-V136 PolarHBondContact O-N 3.24Å
133	C	84	Confident	73.4	Confident	14 Å²	14	67.1 Å²	67.1	10%	0.095	34%	0.344	C	S	.	.	H	α-helix	trans	-81.6	-30	178.1	-71.8	0	0	0	0	112.6	R104 F129 C130 H131 L137	R104-C133 HydrophobicContact CB-CB 3.85Å; F129-C133 HydrophobicContact CB-CB 3.97Å; C130-C133 CarbonylContact O-C 3.57Å; C130-C133 WeakPolarHBondContact O-CA 3.08Å; C130-C133 PolarHBondContact O-N 2.96Å; H131-C133 PolarHBondContact O-N 3.28Å; C133-L137 WeakPolarHBondContact O-CB 3.45Å; C133-L137 PolarHBondContact O-N 3.26Å
134	S	82.2	Confident	72.6	Confident	42 Å²	42	70.4 Å²	70.4	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-67	-40.9	173.6	179.8	0	0	0	0	111.9	C130 H131 L137 K138	C130-S134 PolarHBondContact O-N 3.23Å; H131-S134 PolarHBondContact O-N 3.47Å; S134-L137 PolarHBondContact O-N 2.99Å; S134-K138 PolarHBondContact O-N 3.48Å; S134-K138 VanDerWaalsContact O-N 3.1Å
135	M	73.1	Confident	71.6	Confident	60 Å²	60	72.8 Å²	72.8	30%	0.296	38%	0.381	S	S	.	.	H	α-helix	trans	-58.5	-53.7	171	-70.4	-162.4	-164.1	0	0	111.5	H131 L137 K138 D139 V330	H131-M135 WeakPolarHBondContact NE2-CE 3.48Å; H131-M135 PolarHBondContact O-N 3.1Å; H131-M135 VanDerWaalsContact O-N 3.07Å; M135-L137 PolarHBondContact O-N 3.4Å; M135-L137 VanDerWaalsContact O-N 3.14Å; M135-K138 PolarHBondContact O-N 2.81Å; M135-K138 VanDerWaalsContact O-N 3.1Å; M135-D139 PolarHBondContact O-N 3.28Å; M135-V330 HydrophobicContact CE-CG1 3.92Å
136	V	78.9	Confident	70.6	Confident	76 Å²	76	72.1 Å²	72.1	46%	0.461	38%	0.377	S	S	.	.	H	α-helix	trans	-61.3	-26	-179.9	174.5	0	0	0	0	112.4	R132 E140	R132-V136 WeakPolarHBondContact O-CG2 3.2Å; R132-V136 PolarHBondContact O-N 3.24Å; V136-E140 WeakPolarHBondContact O-CG 3.36Å; V136-E140 PolarHBondContact O-N 3.4Å
137	L	74.1	Confident	69.1	Low	18 Å²	18	74.6 Å²	74.6	9%	0.094	39%	0.389	C	S	.	.	H	α-helix	trans	-72.5	-47	173.4	-95.3	165.9	0	0	0	112.6	R104 F129 C133 S134 M135 D139 E140 E141	R104-L137 VanDerWaalsContact NH2-CD2 3.33Å; F129-L137 HydrophobicContact CB-CD1 4.11Å; F129-L137 HydrophobicContact CD1-CD1 3.93Å; F129-L137 HydrophobicContact CD2-CD1 3.1Å; F129-L137 HydrophobicContact CE1-CD1 4.08Å; F129-L137 HydrophobicContact CE2-CD1 3.28Å; F129-L137 HydrophobicContact CG-CD1 3.43Å; F129-L137 VanDerWaalsContact CG-CD1 3.43Å; F129-L137 HydrophobicContact CZ-CD1 3.75Å; C133-L137 WeakPolarHBondContact O-CB 3.45Å; C133-L137 PolarHBondContact O-N 3.26Å; S134-L137 PolarHBondContact O-N 2.99Å; M135-L137 PolarHBondContact O-N 3.4Å; M135-L137 VanDerWaalsContact O-N 3.14Å; L137-D139 VanDerWaalsContact C-N 3.29Å; L137-D139 PolarHBondContact O-N 2.9Å; L137-E140 PolarHBondContact O-N 2.79Å; L137-E141 PolarHBondContact O-N 3.08Å
138	K	71	Confident	67.2	Low	128 Å²	128	75.1 Å²	75.1	56%	0.557	40%	0.397	S	S	*	.	H	α-helix	trans	-58.5	-45.3	174.3	-67.4	-174.5	176.2	-163.2	0	110.6	S134 M135 E140 E141 D142	S134-K138 PolarHBondContact O-N 3.48Å; S134-K138 VanDerWaalsContact O-N 3.1Å; M135-K138 PolarHBondContact O-N 2.81Å; M135-K138 VanDerWaalsContact O-N 3.1Å; K138-E140 PolarHBondContact O-N 3.12Å; K138-E141 PolarHBondContact O-N 3.05Å; K138-D142 WeakPolarHBondContact O-CB 3.4Å; K138-D142 PolarHBondContact O-N 3.47Å
139	D	66.8	Low	65.1	Low	40 Å²	40	78.1 Å²	78.1	21%	0.214	42%	0.424	C	S	.	.	H	α-helix	trans	-57	-22.6	174.5	-58.6	-24	0	0	0	113.3	M135 L137 K143 N453	M135-D139 PolarHBondContact O-N 3.28Å; L137-D139 VanDerWaalsContact C-N 3.29Å; L137-D139 PolarHBondContact O-N 2.9Å; D139-K143 VanDerWaalsContact O-CD 3.29Å; D139-K143 WeakPolarHBondContact O-CD 3.49Å; D139-K143 WeakPolarHBondContact O-CE 3.42Å; D139-K143 VanDerWaalsContact O-CG 3.22Å; D139-K143 WeakPolarHBondContact O-CG 3.44Å; D139-K143 PolarHBondContact O-NZ 3.01Å; D139-N453 PolarHBondContact OD1-ND2 3.34Å
140	E	65.8	Low	63	Low	90 Å²	90	84 Å²	84	42%	0.421	45%	0.452	S	S	.	.	H	α-helix	trans	-101.6	-32.5	179.5	-65.8	-73.4	112	0	0	113.1	V136 L137 K138 K143 T144	V136-E140 WeakPolarHBondContact O-CG 3.36Å; V136-E140 PolarHBondContact O-N 3.4Å; L137-E140 PolarHBondContact O-N 2.79Å; K138-E140 PolarHBondContact O-N 3.12Å; E140-K143 PolarHBondContact O-N 3.3Å; E140-K143 IonicContact OE1-NZ 2.74Å; E140-K143 PolarHBondContact OE1-NZ 3.48Å; E140-T144 WeakPolarHBondContact O-CB 3.13Å; E140-T144 WeakPolarHBondContact O-CG2 3.2Å; E140-T144 PolarHBondContact O-N 3.34Å; E140-T144 PolarHBondContact O-OG1 2.98Å
141	E	62.9	Low	60.5	Low	102 Å²	102	89.6 Å²	89.6	48%	0.477	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-41.2	171.8	-75.2	170.4	-178.1	0	0	110.5	L137 K138 K143 T144 S145	L137-E141 PolarHBondContact O-N 3.08Å; K138-E141 PolarHBondContact O-N 3.05Å; E141-K143 VanDerWaalsContact C-N 3.28Å; E141-K143 PolarHBondContact O-N 3.5Å; E141-T144 PolarHBondContact O-N 3.26Å; E141-T144 PolarHBondContact O-OG1 3.1Å; E141-S145 VanDerWaalsContact O-CB 3.22Å; E141-S145 WeakPolarHBondContact O-CB 3.33Å; E141-S145 PolarHBondContact O-N 3Å; E141-S145 PolarHBondContact O-OG 2.77Å
142	D	58.9	Low	58.5	Low	52 Å²	52	92.9 Å²	92.9	28%	0.278	51%	0.512	S	S	.	.	H	α-helix	trans	-66.8	-28.4	176.5	-61.9	-20.9	0	0	0	112.2	K138 T146	K138-D142 WeakPolarHBondContact O-CB 3.4Å; K138-D142 PolarHBondContact O-N 3.47Å; D142-T146 PolarHBondContact O-OG1 3.22Å
143	K	55.6	Low	56.6	Low	110 Å²	110	91.8 Å²	91.8	48%	0.478	52%	0.518	S	S	.	.	H	α-helix	trans	-81.4	-36.4	176.1	-68.2	177.9	-161.4	114.7	0	113.3	D139 E140 E141 S147	D139-K143 VanDerWaalsContact O-CD 3.29Å; D139-K143 WeakPolarHBondContact O-CD 3.49Å; D139-K143 WeakPolarHBondContact O-CE 3.42Å; D139-K143 VanDerWaalsContact O-CG 3.22Å; D139-K143 WeakPolarHBondContact O-CG 3.44Å; D139-K143 PolarHBondContact O-NZ 3.01Å; E140-K143 PolarHBondContact O-N 3.3Å; E140-K143 IonicContact OE1-NZ 2.74Å; E140-K143 PolarHBondContact OE1-NZ 3.48Å; E141-K143 VanDerWaalsContact C-N 3.28Å; E141-K143 PolarHBondContact O-N 3.5Å; K143-S147 PolarHBondContact O-OG 2.93Å
144	T	52.2	Low	54.3	Low	75 Å²	75	95 Å²	95	46%	0.46	55%	0.546	S	S	.	.	H	α-helix	trans	-83.2	-33.9	-177.5	47.9	0	0	0	0	112.5	E140 E141 T146 S147 S148	E140-T144 WeakPolarHBondContact O-CB 3.13Å; E140-T144 WeakPolarHBondContact O-CG2 3.2Å; E140-T144 PolarHBondContact O-N 3.34Å; E140-T144 PolarHBondContact O-OG1 2.98Å; E141-T144 PolarHBondContact O-N 3.26Å; E141-T144 PolarHBondContact O-OG1 3.1Å; T144-T146 PolarHBondContact O-N 3.5Å; T144-S147 PolarHBondContact O-N 3.46Å; T144-S147 VanDerWaalsContact O-N 3.14Å; T144-S147 PolarHBondContact O-OG 2.93Å; T144-S148 PolarHBondContact O-N 3.22Å
145	S	47.8	Very low	52.2	Low	88 Å²	88	99 Å²	99	62%	0.615	57%	0.569	S	S	*	*	H	α-helix	trans	-65	-27.4	175.6	-55.9	0	0	0	0	112.9	E141 S147	E141-S145 VanDerWaalsContact O-CB 3.22Å; E141-S145 WeakPolarHBondContact O-CB 3.33Å; E141-S145 PolarHBondContact O-N 3Å; E141-S145 PolarHBondContact O-OG 2.77Å; S145-S147 VanDerWaalsContact C-N 3.32Å
146	T	43.5	Very low	50.5	Low	126 Å²	126	102.6 Å²	102.6	77%	0.773	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-3.8	177.9	-47.9	0	0	0	0	113.1	D142 T144	D142-T146 PolarHBondContact O-OG1 3.22Å; T144-T146 PolarHBondContact O-N 3.5Å
147	S	44.7	Very low	48.6	Very low	87 Å²	87	106 Å²	106	61%	0.608	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.5	5.2	-171.1	51	0	0	0	0	116.1	K143 T144 S145	K143-S147 PolarHBondContact O-OG 2.93Å; T144-S147 PolarHBondContact O-N 3.46Å; T144-S147 VanDerWaalsContact O-N 3.14Å; T144-S147 PolarHBondContact O-OG 2.93Å; S145-S147 VanDerWaalsContact C-N 3.32Å
148	S	39	Very low	46.7	Very low	104 Å²	104	108.5 Å²	108.5	73%	0.727	64%	0.641	S	S	*	*	S	Bend	trans	-124.1	22.4	-178	-65.7	0	0	0	0	115.5	T144	T144-S148 PolarHBondContact O-N 3.22Å
149	S	37.1	Very low	45	Very low	101 Å²	101	107.6 Å²	107.6	71%	0.706	65%	0.651	S	S	*	*	S	Bend	trans	-113.5	127	168	-69.5	0	0	0	0	109.7
150	Q	39.7	Very low	43.7	Very low	187 Å²	187	110.1 Å²	110.1	87%	0.874	67%	0.672	S	S	*	*	S	Bend	trans	70.5	113.4	-165.7	-44.8	174.8	25.4	0	0	111.2
151	T	33.3	Very low	42.4	Very low	118 Å²	118	117 Å²	117	72%	0.724	69%	0.694	S	S	*	*			cis	-159.6	143.7	28.8	46.5	0	0	0	0	112.2
152	T	36.4	Very low	41.2	Very low	148 Å²	148	117.1 Å²	117.1	91%	0.908	71%	0.706	S	S	*	*			trans	-162.8	126.3	136.8	6.3	0	0	0	0	108.7
153	I	40.5	Very low	40.1	Very low	161 Å²	161	118.6 Å²	118.6	83%	0.826	73%	0.733	S	S	*	*			trans	-111.1	141.8	-174.4	-70.2	170.9	0	0	0	108.9
154	A	36.4	Very low	39.3	Very low	83 Å²	83	122.7 Å²	122.7	69%	0.686	75%	0.751	S	S	*	*			trans	65.2	140.4	171.8	0	0	0	0	0	115.1
155	T	38.4	Very low	38.7	Very low	124 Å²	124	124.6 Å²	124.6	76%	0.761	77%	0.767	S	S	*	*			cis	-143.2	135.9	44.9	35.2	0	0	0	0	114.9
156	D	37.9	Very low	38.2	Very low	136 Å²	136	123.7 Å²	123.7	73%	0.727	77%	0.772	S	S	*	*			trans	42.4	136.9	136	-59.2	-23.9	0	0	0	125
157	T	37.5	Very low	38.1	Very low	147 Å²	147	126.8 Å²	126.8	90%	0.902	78%	0.777	S	S	*	*			trans	86.6	137.4	155.2	75.5	0	0	0	0	118.6
158	G	35.9	Very low	37.6	Very low	71 Å²	71	131.1 Å²	131.1	73%	0.732	79%	0.785	S	S	*	*			trans	130.3	42.9	145.8	0	0	0	0	0	121.4
159	S	35.2	Very low	37.5	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	79%	0.786	S	S	*	*			trans	69.3	108.5	137.7	-151.1	0	0	0	0	121.2
160	S	37.8	Very low	37.6	Very low	93 Å²	93	137.5 Å²	137.5	65%	0.65	78%	0.784	S	S	*	*				77.4	128.5	118.6	-57.3	0	0	0	0	123.6
161	R	39.2	Very low	37.4	Very low	234 Å²	234	133.6 Å²	133.6	88%	0.883	77%	0.769	S	S	*	*			trans	80.5	148.2	144.8	-69	163.6	175.7	-172.1	-2.8	119.5
162	S	37.5	Very low	37.7	Very low	105 Å²	105	136.3 Å²	136.3	73%	0.734	77%	0.773	S	S	*	*			cis	179.9	128.9	-34	47.5	0	0	0	0	111.3
163	G	36.9	Very low	37.7	Very low	82 Å²	82	133.1 Å²	133.1	85%	0.845	76%	0.762	S	S	*	*			trans	74.8	172.1	157.1	0	0	0	0	0	117.9
164	K	38.4	Very low	37.6	Very low	196 Å²	196	130.4 Å²	130.4	85%	0.852	76%	0.757	S	S	*	*			cis	-168.8	149.3	-8.9	-166.4	169.6	-178.9	173.2	0	110.3
165	S	39.1	Very low	37.7	Very low	116 Å²	116	131.8 Å²	131.8	81%	0.811	76%	0.762	S	S	*	*			trans	60	155.1	158.4	49.3	0	0	0	0	120
166	G	37.6	Very low	37.7	Very low	69 Å²	69	130.8 Å²	130.8	71%	0.711	76%	0.76	S	S	*	*			cis	156.6	154.1	-11.4	0	0	0	0	0	115.4
167	H	40.6	Very low	37.8	Very low	191 Å²	191	129.4 Å²	129.4	88%	0.884	76%	0.761	S	S	*	*			trans	78.5	140.8	149.9	-82.9	-36.3	0	0	0	125.6
168	K	35.8	Very low	37.9	Very low	178 Å²	178	127.1 Å²	127.1	77%	0.774	75%	0.751	S	S	*	*			trans	79.9	150.8	146.4	-80.9	-170	163.9	-176.5	0	119.8
169	R	35.1	Very low	38	Very low	200 Å²	200	130.7 Å²	130.7	76%	0.755	76%	0.758	S	S	*	*			cis	176.8	156.9	-31.4	-123.3	-170.8	-172.9	-162.2	2.5	110
170	Q	39.7	Very low	38.1	Very low	139 Å²	139	128.3 Å²	128.3	65%	0.65	75%	0.751	S	S	*	*			trans	70.9	153.2	151.4	-68.1	-177.2	-90.2	0	0	119
171	D	36.3	Very low	38.1	Very low	105 Å²	105	131 Å²	131	56%	0.561	76%	0.764	S	S	*	*			cis	-172.2	163	-15.6	-106.9	-4.8	0	0	0	112.1
172	Q	39.1	Very low	37.8	Very low	174 Å²	174	123.5 Å²	123.5	81%	0.813	75%	0.752	S	S	*	*			trans	65.8	155.1	149.5	-71.9	166.3	68.4	0	0	119.5
173	A	37.6	Very low	37.6	Very low	82 Å²	82	125.2 Å²	125.2	68%	0.678	76%	0.758	S	S	*	*			cis	-164.4	163.2	-18.3	0	0	0	0	0	107.1
174	S	37.1	Very low	37.4	Very low	104 Å²	104	126 Å²	126	73%	0.727	76%	0.756	S	S	*	*				173.8	148.7	68.9	-53.5	0	0	0	0	112.6
175	S	39.4	Very low	37.2	Very low	112 Å²	112	121 Å²	121	78%	0.783	75%	0.752	S	S	*	*			trans	49.8	143.8	142.2	53.7	0	0	0	0	122.9
176	S	38.5	Very low	36.9	Very low	103 Å²	103	121.6 Å²	121.6	72%	0.72	75%	0.751	S	S	*	*			cis	-170.7	151	8.1	43.2	0	0	0	0	115.3
177	S	39.1	Very low	36.8	Very low	106 Å²	106	125.3 Å²	125.3	74%	0.741	76%	0.759	S	S	*	*			trans	60.2	144.9	141.3	60.2	0	0	0	0	122.9
178	S	39.1	Very low	36.4	Very low	100 Å²	100	119.3 Å²	119.3	70%	0.699	75%	0.749	S	S	*	*			cis	-179.9	157.9	-9.9	51.6	0	0	0	0	113.8
179	V	39.7	Very low	36.7	Very low	145 Å²	145	116.3 Å²	116.3	88%	0.879	75%	0.748	S	S	*	*			trans	71.7	135.9	163.1	-159.7	0	0	0	0	117.8
180	G	37.1	Very low	36.4	Very low	61 Å²	61	111.4 Å²	111.4	63%	0.629	74%	0.744	S	S	*	*			cis	161.8	140.7	-12.4	0	0	0	0	0	114.8
181	T	36.3	Very low	35.9	Very low	150 Å²	150	112 Å²	112	92%	0.92	75%	0.752	S	S	*	*			trans	65	148.5	150	-34	0	0	0	0	120.5
182	A	33.1	Very low	35.7	Very low	75 Å²	75	112.4 Å²	112.4	62%	0.62	76%	0.763	S	S	*	*			cis	-164.9	168.7	-43.9	0	0	0	0	0	111.2
183	T	34.3	Very low	35.4	Very low	141 Å²	141	110.4 Å²	110.4	87%	0.865	76%	0.763	S	S	*	*			trans	86.2	120.1	157.8	65.3	0	0	0	0	124.1
184	A	32.8	Very low	35.1	Very low	98 Å²	98	111.4 Å²	111.4	81%	0.81	77%	0.765	S	S	*	*			trans	79.1	108.9	134.6	0	0	0	0	0	125.1
185	A	34.7	Very low	34.9	Very low	91 Å²	91	112.2 Å²	112.2	75%	0.752	77%	0.766	S	S	*	*				87.5	121.9	125	0	0	0	0	0	124.2
186	T	32.7	Very low	34.6	Very low	129 Å²	129	112 Å²	112	79%	0.791	77%	0.765	S	S	*	*			trans	88.3	113	140.3	-48.1	0	0	0	0	121.8
187	V	34.5	Very low	34.4	Very low	147 Å²	147	111.5 Å²	111.5	89%	0.891	76%	0.761	S	S	*	*			trans	46.4	129.8	147.9	-177.6	0	0	0	0	120.7
188	G	33	Very low	34.1	Very low	66 Å²	66	114 Å²	114	68%	0.68	76%	0.764	S	S	*	*			trans	128.1	158.6	150.9	0	0	0	0	0	115.4
189	P	40.5	Very low	34	Very low	115 Å²	115	113.5 Å²	113.5	75%	0.747	76%	0.761	S	S	*	*			trans	-128.9	162.3	-146.2	38.9	-22.8	0	0	0	116.9
190	S	30.3	Very low	33.9	Very low	96 Å²	96	113.6 Å²	113.6	67%	0.671	76%	0.756	S	S	*	*			trans	61.5	143.4	148.8	63.1	0	0	0	0	121.6
191	N	29.1	Very low	33.9	Very low	151 Å²	151	116.5 Å²	116.5	81%	0.807	76%	0.757	S	S	*	*			trans	70.8	123.6	160.2	-59.2	-13.3	0	0	0	118.7
192	S	31.5	Very low	33.9	Very low	115 Å²	115	115 Å²	115	80%	0.804	74%	0.744	S	S	*	*				161.6	153.6	102.8	54.8	0	0	0	0	113
193	T	32	Very low	34	Very low	132 Å²	132	117.5 Å²	117.5	81%	0.81	75%	0.746	S	S	*	*			trans	149.8	99.1	152.3	-63.9	0	0	0	0	104.8
194	S	32.5	Very low	34	Very low	102 Å²	102	116.7 Å²	116.7	71%	0.713	74%	0.737	S	S	*	*	S	Bend	cis	-155	156.4	46.2	-35.4	0	0	0	0	108.8
195	T	32.2	Very low	33.8	Very low	122 Å²	122	119 Å²	119	75%	0.748	74%	0.735	S	S	*	*			cis	-150.9	150.1	13.1	40.8	0	0	0	0	110.4
196	S	33.1	Very low	33.7	Very low	108 Å²	108	119.6 Å²	119.6	76%	0.755	74%	0.735	S	S	*	*			trans	50	139.7	152.7	53	0	0	0	0	121.7
197	S	33.7	Very low	33.6	Very low	92 Å²	92	122.2 Å²	122.2	64%	0.643	74%	0.737	S	S	*	*			cis	-179.6	150.9	-4.8	48.2	0	0	0	0	110.9
198	I	34.4	Very low	33.6	Very low	159 Å²	159	120.5 Å²	120.5	82%	0.815	73%	0.732	S	S	*	*			trans	73	143.3	161.8	-55.2	148.6	0	0	0	116.3
199	S	36.6	Very low	33.6	Very low	89 Å²	89	126.2 Å²	126.2	62%	0.622	74%	0.741	S	S	*	*			cis	-175.6	144	-36.6	-85.7	0	0	0	0	108
200	N	36.2	Very low	33.4	Very low	146 Å²	146	129 Å²	129	78%	0.781	74%	0.744	S	S	*	*			trans	61.5	157.2	154.1	-68.4	-11.2	0	0	0	120.1
201	N	37.6	Very low	33.7	Very low	123 Å²	123	133.4 Å²	133.4	66%	0.658	75%	0.754	S	S	*	*			cis	-164.7	141.3	-42.6	-131.6	-8.8	0	0	0	108.5
202	N	36.3	Very low	33.7	Very low	119 Å²	119	132.7 Å²	132.7	64%	0.636	76%	0.755	S	S	*	*			trans	53.1	113.7	144.8	-67.9	-8.7	0	0	0	122.4
203	N	35.4	Very low	33.7	Very low	126 Å²	126	133.2 Å²	133.2	67%	0.674	76%	0.755	S	S	*	*				105.1	126	108.2	-76.2	1	0	0	0	122.8
204	N	33.8	Very low	33.3	Very low	125 Å²	125	134.6 Å²	134.6	67%	0.668	76%	0.757	S	S	*	*			trans	91.6	107.9	134.4	-65.8	-5.9	0	0	0	120.9
205	N	29.8	Very low	33.3	Very low	145 Å²	145	138.3 Å²	138.3	78%	0.775	76%	0.763	S	S	*	*				43.2	119.4	126.4	-65.7	-5	0	0	0	119.1
206	S	32.9	Very low	33.2	Very low	105 Å²	105	141.7 Å²	141.7	73%	0.734	77%	0.77	S	S	*	*				176.7	145.4	90.4	-73.5	0	0	0	0	114
207	H	30.7	Very low	33.1	Very low	183 Å²	183	145.4 Å²	145.4	85%	0.847	77%	0.773	S	S	*	*			trans	15.9	121.1	149.3	-64.5	-81	0	0	0	122.2
208	S	33.7	Very low	32.8	Very low	111 Å²	111	148.4 Å²	148.4	78%	0.776	78%	0.78	S	S	*	*				174.9	120	124.2	51.8	0	0	0	0	109.4
209	H	33.7	Very low	32.6	Very low	187 Å²	187	149 Å²	149	87%	0.866	78%	0.78	S	S	*	*				67.7	137.4	88.9	-104.4	-44.1	0	0	0	116.4
210	Q	35.3	Very low	32.3	Very low	173 Å²	173	149.1 Å²	149.1	81%	0.808	78%	0.781	S	S	*	*			trans	94.1	104	178	-58.8	174.7	12.6	0	0	113.5
211	Q	36.6	Very low	32.3	Very low	189 Å²	189	151 Å²	151	88%	0.883	79%	0.785	S	S	*	*				80.3	126.4	78.3	-81.8	-176.6	-12.1	0	0	113.1
212	T	30.2	Very low	31.9	Very low	135 Å²	135	151.7 Å²	151.7	83%	0.828	79%	0.794	S	S	*	*			trans	-70.4	157.5	-175.6	46.3	0	0	0	0	112.6
213	P	30.1	Very low	31.6	Very low	126 Å²	126	150.9 Å²	150.9	82%	0.818	80%	0.797	S	S	*	*				-137.8	155.5	112.4	25.6	-8	0	0	0	114.9
214	L	25.5	Very low	31.3	Very low	162 Å²	162	154.3 Å²	154.3	85%	0.848	80%	0.801	S	S	*	*			trans	-62.1	150.9	168.6	-87.1	145.2	0	0	0	112.4
215	Q	30.7	Very low	31.1	Very low	180 Å²	180	160.5 Å²	160.5	84%	0.841	82%	0.815	S	S	*	*			trans	67.8	63.4	143.1	-159.3	168.4	25.1	0	0	118.2
216	Q	31.8	Very low	31	Very low	192 Å²	192	159.1 Å²	159.1	90%	0.897	80%	0.804	S	S	*	*			trans	-158.2	59.6	161.9	-123.5	171.1	53.7	0	0	115.1
217	F	30.1	Very low	30.8	Very low	187 Å²	187	165.7 Å²	165.7	82%	0.82	81%	0.814	S	S	*	*			trans	-151.7	51.6	160.5	-134.7	-87.8	0	0	0	113.9
218	I	27.9	Very low	30.7	Very low	154 Å²	154	161.9 Å²	161.9	79%	0.79	80%	0.804	S	S	*	*			trans	-99.4	138	157.2	-74.3	173.6	0	0	0	106.6
219	Q	29.8	Very low	30.4	Very low	171 Å²	171	165.5 Å²	165.5	80%	0.799	81%	0.806	S	S	*	*	S	Bend	trans	80.5	147.3	-179.1	-63.9	160.3	15.2	0	0	118
220	S	31.1	Very low	30.2	Very low	92 Å²	92	166.4 Å²	166.4	64%	0.643	80%	0.802	S	S	*	*			trans	72.7	95.2	178.1	75.4	0	0	0	0	117.9
221	Q	36.6	Very low	29.7	Very low	187 Å²	187	163.5 Å²	163.5	87%	0.874	80%	0.8	S	S	*	*				-168.5	56.2	124.2	-91.2	-72.5	-16.3	0	0	107.9
222	T	27.5	Very low	29.5	Very low	137 Å²	137	161 Å²	161	84%	0.84	80%	0.798	S	S	*	*			trans	-77.5	112.2	164.8	35.7	0	0	0	0	109.1
223	S	31.6	Very low	29.4	Very low	102 Å²	102	159.2 Å²	159.2	71%	0.713	79%	0.791	S	S	*	*			trans	-162.4	114.4	152.8	-153.9	0	0	0	0	114.8
224	R	27.7	Very low	29.4	Very low	198 Å²	198	161.3 Å²	161.3	75%	0.747	80%	0.796	S	S	*	*			trans	27.2	117.3	138.3	-64.6	177.7	172.8	-169.3	-2.4	118.6
225	R	30.2	Very low	29.5	Very low	255 Å²	255	161.2 Å²	161.2	96%	0.962	79%	0.791	S	S	*	*				-121.1	110.8	128.5	-79.1	-169.4	173.4	175.5	-0.6	110.1
226	H	28.2	Very low	29.5	Very low	116 Å²	116	159.1 Å²	159.1	54%	0.537	79%	0.785	S	S	.	*			trans	-64.1	145.5	170.8	-76.6	-128	0	0	0	110.2	T228	H226-T228 HydrophobicContact CB-CG2 4.45Å
227	Y	28.4	Very low	29.4	Very low	242 Å²	242	160.2 Å²	160.2	95%	0.949	78%	0.783	S	S	*	*			trans	-127.9	111.5	142.4	-116.8	-85.7	0	0	0	108.1
228	T	27.6	Very low	29.3	Very low	104 Å²	104	157.5 Å²	157.5	64%	0.638	79%	0.786	S	S	*	*			trans	-120.4	114.3	-178.9	48.1	0	0	0	0	109.6	H226	H226-T228 HydrophobicContact CB-CG2 4.45Å
229	F	28.3	Very low	29.6	Very low	187 Å²	187	157.4 Å²	157.4	82%	0.82	79%	0.786	S	S	*	*			trans	-169.9	144.1	155.4	-138.9	-98.9	0	0	0	110
230	R	28.3	Very low	29.6	Very low	205 Å²	205	155 Å²	155	77%	0.774	78%	0.778	S	S	*	*			cis	-163	140.1	-35.9	-166.9	175.6	-167.6	-154.9	6.6	105.9
231	S	25.3	Very low	29.8	Very low	112 Å²	112	158.4 Å²	158.4	78%	0.783	79%	0.786	S	S	*	*			trans	-70.7	145.4	-175.2	-35.7	0	0	0	0	113.6
232	T	32.3	Very low	29.5	Very low	136 Å²	136	157 Å²	157	83%	0.834	79%	0.785	S	S	*	*			trans	-141.6	103.1	146.5	50.6	0	0	0	0	110.2
233	S	29.1	Very low	29.8	Very low	98 Å²	98	159.5 Å²	159.5	69%	0.685	78%	0.784	S	S	*	*			trans	1.4	129.2	149.8	53.2	0	0	0	0	119.3
234	N	29.7	Very low	30	Very low	170 Å²	170	162 Å²	162	91%	0.909	79%	0.789	S	S	*	*				-150.5	140.1	108.2	-116.6	5.7	0	0	0	110.8
235	E	27.1	Very low	30.1	Very low	160 Å²	160	157.2 Å²	157.2	75%	0.748	79%	0.786	S	S	*	*			trans	-102.6	175.8	-170.7	-59.2	175.1	146.1	0	0	112.1
236	N	30.9	Very low	30.1	Very low	136 Å²	136	150 Å²	150	73%	0.727	77%	0.774	S	S	*	*			trans	76.4	88.2	154.5	-52.5	-41.2	0	0	0	118.7
237	Y	30.4	Very low	30.4	Very low	215 Å²	215	149.5 Å²	149.5	84%	0.843	78%	0.783	S	S	*	*				-163.4	98.4	112.8	-129.5	-95.7	0	0	0	112.2
238	C	26.9	Very low	30.6	Very low	130 Å²	130	148.7 Å²	148.7	88%	0.878	78%	0.779	S	S	*	*			trans	-140.8	99	166	-97.3	0	0	0	0	109.3
239	L	34.8	Very low	30.9	Very low	152 Å²	152	148.4 Å²	148.4	80%	0.796	78%	0.781	S	S	*	*			trans	-153.9	148.3	167.7	-66.5	176	0	0	0	105.5
240	D	30.4	Very low	31	Very low	120 Å²	120	144.2 Å²	144.2	64%	0.642	78%	0.775	S	S	*	*			cis	-173.2	139.5	-21.5	177	12.7	0	0	0	103.1
241	M	34.9	Very low	31.3	Very low	164 Å²	164	140.3 Å²	140.3	81%	0.808	77%	0.774	S	S	*	*			trans	-179.8	75	161.1	-95.4	-37.3	92	0	0	110.6
242	N	30.5	Very low	31.8	Very low	158 Å²	158	147.1 Å²	147.1	85%	0.845	78%	0.783	S	S	*	*			trans	-113	85.9	161.1	-123.4	-10.9	0	0	0	108.8
243	K	33.7	Very low	31.7	Very low	189 Å²	189	144.3 Å²	144.3	82%	0.822	78%	0.781	S	S	*	*			trans	-172.8	98.8	167.2	-111	164.8	-170.8	178.6	0	112.7
244	L	34.7	Very low	32	Very low	155 Å²	155	147.8 Å²	147.8	81%	0.812	79%	0.792	S	S	*	*				-175.1	108.9	120.7	-117.9	66.5	0	0	0	110.6
245	S	30.9	Very low	32.2	Very low	98 Å²	98	145.4 Å²	145.4	69%	0.685	79%	0.788	S	S	*	*			trans	37.3	107.5	130.3	61.8	0	0	0	0	118.7
246	S	30.1	Very low	32.6	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	79%	0.792	S	S	*	*				88.2	109	77.1	168.5	0	0	0	0	114.5
247	S	34.4	Very low	33.1	Very low	105 Å²	105	146.3 Å²	146.3	73%	0.734	80%	0.797	S	S	*	*				-163.7	110.2	120.2	-81.7	0	0	0	0	112.8
248	R	32.8	Very low	33.7	Very low	225 Å²	225	140.9 Å²	140.9	85%	0.849	79%	0.786	S	S	*	*				37.4	142.8	124.4	-55.8	174.3	80.7	166.7	7	118.4
249	S	32.8	Very low	34.4	Very low	98 Å²	98	139 Å²	139	69%	0.685	78%	0.781	S	S	*	*			cis	174.7	157.5	1.2	45.3	0	0	0	0	107.2
250	S	32	Very low	34.9	Very low	99 Å²	99	139.1 Å²	139.1	69%	0.692	78%	0.782	S	S	*	*			cis	-170.8	-163	4.2	35.4	0	0	0	0	109.5
251	T	33.6	Very low	35.8	Very low	123 Å²	123	135.5 Å²	135.5	76%	0.755	76%	0.762	S	S	*	*	S	Bend	trans	80.6	121	-176.5	76.5	0	0	0	0	112.8
252	W	36.9	Very low	36.6	Very low	255 Å²	255	134.8 Å²	134.8	97%	0.966	76%	0.757	S	S	*	*	S	Bend	cis	-113.7	159.9	9.7	-72.5	50.6	0	0	0	111.6
253	G	29.4	Very low	37.9	Very low	77 Å²	77	136.6 Å²	136.6	79%	0.794	76%	0.76	S	S	*	*			trans	-86.5	130.5	-165.1	0	0	0	0	0	115.1
254	D	35.8	Very low	39	Very low	172 Å²	172	129.4 Å²	129.4	92%	0.92	73%	0.733	S	S	*	*			trans	-158.8	54	167.3	-114	-17.3	0	0	0	111.7
255	S	33.5	Very low	40.3	Very low	119 Å²	119	131.4 Å²	131.4	83%	0.832	74%	0.739	S	S	*	*			trans	-156.7	80.6	176.8	178.5	0	0	0	0	113.6
256	A	35.1	Very low	41.4	Very low	99 Å²	99	131.5 Å²	131.5	82%	0.818	73%	0.731	S	S	*	*	S	Bend	trans	-146.4	12.1	170.6	0	0	0	0	0	115
257	Y	40.8	Very low	43.3	Very low	217 Å²	217	133 Å²	133	85%	0.851	72%	0.721	S	S	*	*	S	Bend	trans	-143.1	14.4	-171.4	-124	-86.6	0	0	0	116.4
258	V	44.8	Very low	44.9	Very low	100 Å²	100	131.4 Å²	131.4	61%	0.606	71%	0.714	S	S	*	*			trans	-113.6	9.3	-171.3	-167.9	0	0	0	0	112.6	I261	V258-I261 HydrophobicContact CG1-CD1 4.23Å
259	A	40.1	Very low	46.7	Very low	92 Å²	92	125.5 Å²	125.5	76%	0.76	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-20.8	-168.5	0	0	0	0	0	116.3
260	D	45	Very low	48.5	Very low	153 Å²	153	126.2 Å²	126.2	82%	0.818	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.7	23.4	-171	-65.2	-45.4	0	0	0	114.2
261	I	50.6	Low	50.5	Low	45 Å²	45	128.3 Å²	128.3	23%	0.231	68%	0.683	C	S	.	*			trans	-87.5	-17.8	-170.3	-60.3	-173.2	0	0	0	113.4	V258 E263 S264 W270	V258-I261 HydrophobicContact CG1-CD1 4.23Å; I261-E263 VanDerWaalsContact C-N 3.28Å; I261-E263 PolarHBondContact O-N 2.73Å; I261-S264 WeakPolarHBondContact O-CB 3.17Å; I261-S264 PolarHBondContact O-N 2.9Å; I261-S264 PolarHBondContact O-OG 3.06Å; I261-W270 HydrophobicContact CD1-CZ2 4.01Å; I261-W270 HydrophobicContact CG2-CG 4.28Å
262	E	52.2	Low	52.2	Low	148 Å²	148	127 Å²	127	69%	0.692	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-23.5	-172.3	-61.4	-157.4	148.7	0	0	115.2	R267	E262-R267 WeakPolarHBondContact O-CD 3.43Å; E262-R267 PolarHBondContact O-NH1 3.41Å
263	E	56.6	Low	53.9	Low	197 Å²	197	118.2 Å²	118.2	92%	0.921	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-2.3	175.3	-62.2	-166.1	150.5	0	0	113.7	I261	I261-E263 VanDerWaalsContact C-N 3.28Å; I261-E263 PolarHBondContact O-N 2.73Å
264	S	57.8	Low	55.9	Low	37 Å²	37	119.8 Å²	119.8	26%	0.259	63%	0.632	S	S	.	*	S	Bend	trans	-75.6	146.2	-176.2	72.6	0	0	0	0	113.3	I261 L266 R267	I261-S264 WeakPolarHBondContact O-CB 3.17Å; I261-S264 PolarHBondContact O-N 2.9Å; I261-S264 PolarHBondContact O-OG 3.06Å; S264-L266 PolarHBondContact O-N 3.41Å; S264-R267 VanDerWaalsContact O-CB 3.32Å; S264-R267 WeakPolarHBondContact O-CB 3.4Å; S264-R267 PolarHBondContact O-N 3.11Å
265	E	60.4	Low	57.4	Low	197 Å²	197	118.7 Å²	118.7	92%	0.921	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-21.5	171.5	-62.2	-172.1	157.6	0	0	112.4	R267	E265-R267 PolarHBondContact O-N 2.84Å
266	L	54.4	Low	58.8	Low	101 Å²	101	115.9 Å²	115.9	53%	0.529	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-4.7	176.3	-57.9	177.3	0	0	0	113.8	S264 A268 L269 W270	S264-L266 PolarHBondContact O-N 3.41Å; L266-A268 PolarHBondContact O-N 2.97Å; L266-L269 HydrophobicContact CB-CB 4.5Å; L266-L269 CarbonylContact O-C 3.59Å; L266-L269 WeakPolarHBondContact O-CA 3.41Å; L266-L269 WeakPolarHBondContact O-CB 3.49Å; L266-L269 PolarHBondContact O-N 3.12Å; L266-W270 PolarHBondContact O-N 2.97Å
267	R	69.3	Low	60.3	Low	135 Å²	135	119.4 Å²	119.4	51%	0.509	60%	0.597	S	S	.	*	H	α-helix	trans	-57.8	-30.3	175.8	-168.6	175.1	-170.8	173	0.5	113	E262 S264 E265 K271	E262-R267 WeakPolarHBondContact O-CD 3.43Å; E262-R267 PolarHBondContact O-NH1 3.41Å; S264-R267 VanDerWaalsContact O-CB 3.32Å; S264-R267 WeakPolarHBondContact O-CB 3.4Å; S264-R267 PolarHBondContact O-N 3.11Å; E265-R267 PolarHBondContact O-N 2.84Å; R267-K271 PolarHBondContact O-N 2.9Å
268	A	69.3	Low	61.6	Low	70 Å²	70	118 Å²	118	58%	0.579	59%	0.591	S	S	*	*	H	α-helix	trans	-67.7	-41.4	171	0	0	0	0	0	112	L266 K271 V272	L266-A268 PolarHBondContact O-N 2.97Å; A268-K271 PolarHBondContact O-N 2.77Å; A268-V272 WeakPolarHBondContact O-CG2 3.31Å; A268-V272 PolarHBondContact O-N 2.95Å; A268-V272 VanDerWaalsContact O-N 3.16Å
269	L	69.5	Low	62.1	Low	101 Å²	101	116.7 Å²	116.7	53%	0.529	58%	0.579	S	S	.	*	H	α-helix	trans	-62.8	-43.1	175.6	-158.3	89.5	0	0	0	111	L266 K271 V272 I273	L266-L269 HydrophobicContact CB-CB 4.5Å; L266-L269 CarbonylContact O-C 3.59Å; L266-L269 WeakPolarHBondContact O-CA 3.41Å; L266-L269 WeakPolarHBondContact O-CB 3.49Å; L266-L269 PolarHBondContact O-N 3.12Å; L269-K271 PolarHBondContact O-N 3.12Å; L269-V272 CarbonylContact O-C 3.59Å; L269-V272 WeakPolarHBondContact O-CA 3.48Å; L269-V272 WeakPolarHBondContact O-CB 3.25Å; L269-V272 PolarHBondContact O-N 3.27Å; L269-I273 HydrophobicContact CD2-CD1 4.15Å; L269-I273 HydrophobicContact CG-CD1 4.32Å; L269-I273 WeakPolarHBondContact O-CG1 3.21Å; L269-I273 PolarHBondContact O-N 3.25Å
270	W	71.7	Confident	62.5	Low	114 Å²	114	119.3 Å²	119.3	43%	0.432	58%	0.58	S	S	.	*	H	α-helix	trans	-62.7	-41.5	177	-84.6	97.5	0	0	0	113.1	I261 L266 V272 I273 E274	I261-W270 HydrophobicContact CD1-CZ2 4.01Å; I261-W270 HydrophobicContact CG2-CG 4.28Å; L266-W270 PolarHBondContact O-N 2.97Å; W270-V272 PolarHBondContact O-N 3.39Å; W270-I273 PolarHBondContact O-N 3.44Å; W270-E274 WeakPolarHBondContact O-CB 3.29Å; W270-E274 PolarHBondContact O-N 3.31Å
271	K	73	Confident	62.8	Low	143 Å²	143	115.4 Å²	115.4	62%	0.622	56%	0.563	S	S	*	*	H	α-helix	trans	-61.6	-32.4	171.3	-76.1	-172.4	175.1	-173.9	0	113	R267 A268 L269 Y275	R267-K271 PolarHBondContact O-N 2.9Å; A268-K271 PolarHBondContact O-N 2.77Å; L269-K271 PolarHBondContact O-N 3.12Å; K271-Y275 VanDerWaalsContact O-CB 3.24Å; K271-Y275 WeakPolarHBondContact O-CB 3.46Å; K271-Y275 PolarHBondContact O-N 3.06Å
272	V	71.1	Confident	63	Low	95 Å²	95	121.3 Å²	121.3	58%	0.576	59%	0.587	S	S	*	*	H	α-helix	trans	-72.8	-40.1	174.4	172.8	0	0	0	0	111.4	A268 L269 W270 Y275 A276	A268-V272 WeakPolarHBondContact O-CG2 3.31Å; A268-V272 PolarHBondContact O-N 2.95Å; A268-V272 VanDerWaalsContact O-N 3.16Å; L269-V272 CarbonylContact O-C 3.59Å; L269-V272 WeakPolarHBondContact O-CA 3.48Å; L269-V272 WeakPolarHBondContact O-CB 3.25Å; L269-V272 PolarHBondContact O-N 3.27Å; W270-V272 PolarHBondContact O-N 3.39Å; V272-Y275 PolarHBondContact O-N 3.4Å; V272-A276 VanDerWaalsContact O-CB 3.24Å; V272-A276 WeakPolarHBondContact O-CB 3.49Å; V272-A276 PolarHBondContact O-N 3.19Å
273	I	71.7	Confident	63.1	Low	70 Å²	70	123 Å²	123	36%	0.359	60%	0.595	S	S	.	*	H	α-helix	trans	-64.3	-43.2	175	-68	163.9	0	0	0	110.9	L269 W270 A276 K277	L269-I273 HydrophobicContact CD2-CD1 4.15Å; L269-I273 HydrophobicContact CG-CD1 4.32Å; L269-I273 WeakPolarHBondContact O-CG1 3.21Å; L269-I273 PolarHBondContact O-N 3.25Å; W270-I273 PolarHBondContact O-N 3.44Å; I273-A276 PolarHBondContact O-N 3.45Å; I273-K277 PolarHBondContact O-N 3.4Å
274	E	71.1	Confident	62.7	Low	110 Å²	110	123 Å²	123	51%	0.514	59%	0.588	S	S	.	*	H	α-helix	trans	-64.2	-44	175.9	-173.2	167.4	-149.1	0	0	111.2	W270 A276 K277 Y278	W270-E274 WeakPolarHBondContact O-CB 3.29Å; W270-E274 PolarHBondContact O-N 3.31Å; E274-A276 VanDerWaalsContact C-N 3.32Å; E274-A276 PolarHBondContact O-N 3.12Å; E274-K277 WeakPolarHBondContact O-CB 3.3Å; E274-K277 PolarHBondContact O-N 3.36Å; E274-Y278 HydrophobicContact CG-CE2 4Å; E274-Y278 WeakPolarHBondContact O-CD2 3.23Å
275	Y	68.3	Low	62.3	Low	150 Å²	150	128.1 Å²	128.1	59%	0.588	61%	0.612	S	S	*	*	H	α-helix	trans	-63.2	-36	172.3	-174.2	-109.6	0	0	0	113	K271 V272 Y278 Q279	K271-Y275 VanDerWaalsContact O-CB 3.24Å; K271-Y275 WeakPolarHBondContact O-CB 3.46Å; K271-Y275 PolarHBondContact O-N 3.06Å; V272-Y275 PolarHBondContact O-N 3.4Å; Y275-Y278 PolarHBondContact O-N 2.78Å; Y275-Q279 HydrophobicContact CD1-CG 4.25Å; Y275-Q279 HydrophobicContact CE1-CG 3.9Å; Y275-Q279 VanDerWaalsContact CZ-NE2 3.28Å; Y275-Q279 PolarHBondContact O-N 3.08Å; Y275-Q279 VanDerWaalsContact O-N 3.12Å; Y275-Q279 PolarHBondContact OH-NE2 3.44Å
276	A	62.9	Low	61.7	Low	59 Å²	59	123 Å²	123	49%	0.488	59%	0.591	S	S	.	*	H	α-helix	trans	-68.8	-32.5	176.5	0	0	0	0	0	112.6	V272 I273 E274 Y278 Q279	V272-A276 VanDerWaalsContact O-CB 3.24Å; V272-A276 WeakPolarHBondContact O-CB 3.49Å; V272-A276 PolarHBondContact O-N 3.19Å; I273-A276 PolarHBondContact O-N 3.45Å; E274-A276 VanDerWaalsContact C-N 3.32Å; E274-A276 PolarHBondContact O-N 3.12Å; A276-Y278 PolarHBondContact O-N 2.63Å; A276-Q279 PolarHBondContact O-N 2.95Å
277	K	66.5	Low	61.6	Low	173 Å²	173	121.5 Å²	121.5	75%	0.752	59%	0.587	S	S	*	*	H	α-helix	trans	-59.6	-30.9	170.7	-83.3	-172.7	172.5	-174.7	0	113.1	I273 E274	I273-K277 PolarHBondContact O-N 3.4Å; E274-K277 WeakPolarHBondContact O-CB 3.3Å; E274-K277 PolarHBondContact O-N 3.36Å
278	Y	67.1	Low	60.9	Low	187 Å²	187	123.5 Å²	123.5	73%	0.733	60%	0.6	S	S	*	*	H	α-helix	trans	-98.2	-5.5	-179.8	-58.5	-66.4	0	0	0	114.1	E274 Y275 A276	E274-Y278 HydrophobicContact CG-CE2 4Å; E274-Y278 WeakPolarHBondContact O-CD2 3.23Å; Y275-Y278 PolarHBondContact O-N 2.78Å; A276-Y278 PolarHBondContact O-N 2.63Å
279	Q	56.4	Low	60.2	Low	73 Å²	73	127.6 Å²	127.6	34%	0.341	61%	0.612	S	S	.	*	S	Bend	trans	-87	120.4	169.2	-78	-127.8	3.2	0	0	110.1	Y275 A276 P281	Y275-Q279 HydrophobicContact CD1-CG 4.25Å; Y275-Q279 HydrophobicContact CE1-CG 3.9Å; Y275-Q279 VanDerWaalsContact CZ-NE2 3.28Å; Y275-Q279 PolarHBondContact O-N 3.08Å; Y275-Q279 VanDerWaalsContact O-N 3.12Å; Y275-Q279 PolarHBondContact OH-NE2 3.44Å; A276-Q279 PolarHBondContact O-N 2.95Å; Q279-P281 VanDerWaalsContact O-CD 3.32Å; Q279-P281 WeakPolarHBondContact O-CD 3.34Å; Q279-P281 VanDerWaalsContact O-N 3.15Å
280	N	48.4	Very low	59.4	Low	147 Å²	147	128.2 Å²	128.2	79%	0.786	62%	0.615	S	S	*	*			trans	-59.3	118.2	165.3	-155.5	13.1	0	0	0	107.9	K282	N280-K282 PolarHBondContact O-N 3.12Å
281	P	50.9	Low	58.6	Low	71 Å²	71	127.6 Å²	127.6	46%	0.461	62%	0.62	S	S	.	*			trans	-64.7	108	-163.8	18.9	-31.2	0	0	0	112.7	Q279 E283 Y284	Q279-P281 VanDerWaalsContact O-CD 3.32Å; Q279-P281 WeakPolarHBondContact O-CD 3.34Å; Q279-P281 VanDerWaalsContact O-N 3.15Å; P281-E283 PolarHBondContact O-N 3.3Å; P281-Y284 HydrophobicContact CB-CD2 3.73Å; P281-Y284 HydrophobicContact CB-CE2 3.59Å; P281-Y284 HydrophobicContact CG-CD2 3.64Å; P281-Y284 HydrophobicContact CG-CE2 3.38Å
282	K	54.1	Low	57.5	Low	169 Å²	169	123.3 Å²	123.3	74%	0.735	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-77.7	-1.5	178.9	-60.9	-175.8	-178.8	177.1	0	113.9	N280 Y284	N280-K282 PolarHBondContact O-N 3.12Å; K282-Y284 VanDerWaalsContact C-N 3.28Å
283	E	54.8	Low	56.5	Low	185 Å²	185	122.8 Å²	122.8	86%	0.864	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-85.3	-0.9	-178.7	-158.1	160	-150.7	0	0	112.6	P281 D285	P281-E283 PolarHBondContact O-N 3.3Å; E283-D285 VanDerWaalsContact C-N 3.35Å
284	Y	48.1	Very low	55.7	Low	195 Å²	195	123.6 Å²	123.6	77%	0.765	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-89.8	12.5	174.1	-64.6	-56.5	0	0	0	114.8	P281 K282 L286	P281-Y284 HydrophobicContact CB-CD2 3.73Å; P281-Y284 HydrophobicContact CB-CE2 3.59Å; P281-Y284 HydrophobicContact CG-CD2 3.64Å; P281-Y284 HydrophobicContact CG-CE2 3.38Å; K282-Y284 VanDerWaalsContact C-N 3.28Å; Y284-L286 PolarHBondContact O-N 3.48Å
285	D	49.2	Very low	54.8	Low	145 Å²	145	124.9 Å²	124.9	78%	0.775	63%	0.632	S	S	*	*	S	Bend	trans	-66.7	101	157.3	-92.2	-18.3	0	0	0	108	E283 P287	E283-D285 VanDerWaalsContact C-N 3.35Å; D285-P287 WeakPolarHBondContact O-CD 3.41Å
286	L	48.4	Very low	54.1	Low	89 Å²	89	118.9 Å²	118.9	47%	0.466	61%	0.61	S	S	.	*			trans	-51.3	123.9	178.2	-171.2	71.4	0	0	0	109	Y284 K288 L290 L291	Y284-L286 PolarHBondContact O-N 3.48Å; L286-K288 PolarHBondContact O-N 3.07Å; L286-L290 HydrophobicContact CD1-CB 3.94Å; L286-L290 HydrophobicContact CD1-CD1 4.34Å; L286-L290 HydrophobicContact CD2-CB 4.34Å; L286-L290 WeakPolarHBondContact CD2-O 3.43Å; L286-L290 HydrophobicContact CG-CB 3.89Å; L286-L291 HydrophobicContact CD2-CD2 4.29Å
287	P	51.3	Low	53.5	Low	70 Å²	70	118 Å²	118	46%	0.455	60%	0.599	S	S	.	*			trans	-46.9	137.4	177.7	-31.9	35.8	0	0	0	110.9	D285 D289 L290 L291	D285-P287 WeakPolarHBondContact O-CD 3.41Å; P287-D289 PolarHBondContact O-N 3.22Å; P287-L290 HydrophobicContact CB-CB 4.39Å; P287-L290 HydrophobicContact CB-CD1 4.29Å; P287-L290 HydrophobicContact CB-CG 4.35Å; P287-L290 HydrophobicContact CG-CD1 4.04Å; P287-L290 CarbonylContact O-C 3.46Å; P287-L290 WeakPolarHBondContact O-CA 3.35Å; P287-L290 PolarHBondContact O-N 3.43Å; P287-L291 PolarHBondContact O-N 3.06Å
288	K	56.2	Low	52.8	Low	178 Å²	178	110.8 Å²	110.8	77%	0.774	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-22.3	-174.4	-67.8	179.1	-178	174	0	112.8	L286 L291	L286-K288 PolarHBondContact O-N 3.07Å; K288-L291 HydrophobicContact CB-CD1 4.39Å; K288-L291 HydrophobicContact CG-CD1 4.41Å; K288-L291 WeakPolarHBondContact O-CB 3.43Å
289	D	54.6	Low	52.2	Low	155 Å²	155	104.2 Å²	104.2	83%	0.829	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-14.8	177.4	-42.3	-54.2	0	0	0	113.1	P287	P287-D289 PolarHBondContact O-N 3.22Å
290	L	52.5	Low	52.1	Low	114 Å²	114	109.1 Å²	109.1	60%	0.597	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-6.6	170.5	-70.1	177.3	0	0	0	112.9	L286 P287 P292	L286-L290 HydrophobicContact CD1-CB 3.94Å; L286-L290 HydrophobicContact CD1-CD1 4.34Å; L286-L290 HydrophobicContact CD2-CB 4.34Å; L286-L290 WeakPolarHBondContact CD2-O 3.43Å; L286-L290 HydrophobicContact CG-CB 3.89Å; P287-L290 HydrophobicContact CB-CB 4.39Å; P287-L290 HydrophobicContact CB-CD1 4.29Å; P287-L290 HydrophobicContact CB-CG 4.35Å; P287-L290 HydrophobicContact CG-CD1 4.04Å; P287-L290 CarbonylContact O-C 3.46Å; P287-L290 WeakPolarHBondContact O-CA 3.35Å; P287-L290 PolarHBondContact O-N 3.43Å; L290-P292 WeakPolarHBondContact O-CD 3.45Å
291	L	54.6	Low	52.2	Low	102 Å²	102	106.7 Å²	106.7	53%	0.534	56%	0.555	S	S	.	*	S	Bend	trans	-60.7	124.1	164.2	-72.8	170	0	0	0	108.3	L286 P287 K288 G293	L286-L291 HydrophobicContact CD2-CD2 4.29Å; P287-L291 PolarHBondContact O-N 3.06Å; K288-L291 HydrophobicContact CB-CD1 4.39Å; K288-L291 HydrophobicContact CG-CD1 4.41Å; K288-L291 WeakPolarHBondContact O-CB 3.43Å; L291-G293 PolarHBondContact O-N 3.34Å; L291-G293 VanDerWaalsContact O-N 3.08Å
292	P	49.6	Very low	52.4	Low	53 Å²	53	105.1 Å²	105.1	34%	0.344	54%	0.544	S	S	.	.			trans	-65.4	118.3	-175.5	-19.1	29.3	0	0	0	112.2	L290 V294 L387 M391	L290-P292 WeakPolarHBondContact O-CD 3.45Å; P292-V294 PolarHBondContact O-N 2.91Å; P292-V294 VanDerWaalsContact O-N 3.09Å; P292-L387 HydrophobicContact CG-CD2 3.95Å; P292-M391 HydrophobicContact CB-CE 3.44Å; P292-M391 VanDerWaalsContact CB-CE 3.44Å; P292-M391 HydrophobicContact CB-SD 3.41Å; P292-M391 WeakPolarHBondContact CB-SD 3.39Å; P292-M391 HydrophobicContact CG-CE 4.31Å; P292-M391 HydrophobicContact CG-SD 3.59Å; P292-M391 VanDerWaalsContact CG-SD 3.59Å
293	G	50.7	Low	52.2	Low	84 Å²	84	101.1 Å²	101.1	87%	0.866	54%	0.535	S	S	*	.	S	Bend	trans	-63	-14.3	177	0	0	0	0	0	114.2	L291	L291-G293 PolarHBondContact O-N 3.34Å; L291-G293 VanDerWaalsContact O-N 3.08Å
294	V	53.6	Low	52.1	Low	86 Å²	86	98.6 Å²	98.6	52%	0.521	53%	0.533	S	S	.	.	S	Bend	trans	-92.5	112.4	173.8	-175.7	0	0	0	0	109.5	P292 L296 M391	P292-V294 PolarHBondContact O-N 2.91Å; P292-V294 VanDerWaalsContact O-N 3.09Å; V294-L296 PolarHBondContact O-N 3.34Å; V294-L296 VanDerWaalsContact O-N 3.13Å; V294-M391 HydrophobicContact CB-CE 3.97Å; V294-M391 HydrophobicContact CG2-CE 4.48Å
295	K	53.2	Low	52.4	Low	137 Å²	137	94.1 Å²	94.1	60%	0.596	52%	0.518	S	S	*	.			trans	-65.2	109.5	172.9	-62.2	175.2	-176.1	172.6	0	109.5
296	L	53.2	Low	52.5	Low	25 Å²	25	94.5 Å²	94.5	13%	0.131	51%	0.509	C	S	.	.			trans	-57.9	135.6	168.1	-68	168.4	0	0	0	109.5	V294 G298 S299 L387 M391 W394	V294-L296 PolarHBondContact O-N 3.34Å; V294-L296 VanDerWaalsContact O-N 3.13Å; L296-G298 PolarHBondContact O-N 2.97Å; L296-S299 WeakPolarHBondContact O-CA 3.34Å; L296-S299 WeakPolarHBondContact O-CB 3.36Å; L296-S299 PolarHBondContact O-N 2.92Å; L296-L387 HydrophobicContact CD1-CD1 4.05Å; L296-M391 HydrophobicContact CD2-CG 4.09Å; L296-W394 HydrophobicContact CD2-CB 3.66Å; L296-W394 HydrophobicContact CD2-CG 3.73Å
297	P	50.1	Low	52.9	Low	40 Å²	40	99.5 Å²	99.5	26%	0.26	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	139.9	167.6	-27.1	37.9	0	0	0	110.7	S299 W394 Y398	P297-S299 PolarHBondContact O-N 3.08Å; P297-S299 VanDerWaalsContact O-N 3.16Å; P297-W394 HydrophobicContact CB-CE3 4.16Å; P297-W394 HydrophobicContact CB-CH2 3.95Å; P297-W394 HydrophobicContact CB-CZ2 4.48Å; P297-W394 HydrophobicContact CB-CZ3 3.77Å; P297-W394 HydrophobicContact CG-CD2 4.27Å; P297-W394 HydrophobicContact CG-CE3 3.6Å; P297-W394 HydrophobicContact CG-CH2 4.29Å; P297-W394 HydrophobicContact CG-CZ3 3.62Å; P297-Y398 HydrophobicContact CG-CD2 4.17Å; P297-Y398 HydrophobicContact CG-CE2 4.15Å
298	G	51.9	Low	53.3	Low	22 Å²	22	100.2 Å²	100.2	23%	0.227	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	-27.8	-168.1	0	0	0	0	0	114.7	L296 Y343	L296-G298 PolarHBondContact O-N 2.97Å; G298-Y343 VanDerWaalsContact O-CE1 3.27Å; G298-Y343 WeakPolarHBondContact O-CE1 3.33Å; G298-Y343 PolarHBondContact O-OH 2.87Å
299	S	54.7	Low	53.8	Low	49 Å²	49	96 Å²	96	34%	0.343	51%	0.509	S	S	.	.	S	Bend	trans	-75.5	157.2	176	-167.4	0	0	0	0	112.7	L296 P297 K301	L296-S299 WeakPolarHBondContact O-CA 3.34Å; L296-S299 WeakPolarHBondContact O-CB 3.36Å; L296-S299 PolarHBondContact O-N 2.92Å; P297-S299 PolarHBondContact O-N 3.08Å; P297-S299 VanDerWaalsContact O-N 3.16Å; S299-K301 PolarHBondContact O-N 2.99Å
300	Y	53.2	Low	54.8	Low	175 Å²	175	93.3 Å²	93.3	69%	0.686	50%	0.502	S	S	*	.			trans	-41.9	103	-162.3	-44.9	-86.9	0	0	0	115.8
301	K	51.7	Low	56.3	Low	96 Å²	96	89.1 Å²	89.1	42%	0.417	48%	0.48	S	S	.	.			trans	-51.2	142.4	153.2	-44.5	-179.8	-179.8	179	0	109.3	S299 E305 R366	S299-K301 PolarHBondContact O-N 2.99Å; K301-E305 HydrophobicContact CB-CB 3.68Å; K301-E305 HydrophobicContact CB-CG 4.41Å; K301-E305 HydrophobicContact CD-CB 4.41Å; K301-R366 VanDerWaalsContact CB-NH1 3.28Å; K301-R366 PolarHBondContact O-NH1 3.3Å; K301-R366 PolarHBondContact O-NH2 3.03Å
302	T	54.8	Low	57.5	Low	39 Å²	39	85.9 Å²	85.9	24%	0.239	46%	0.463	C	S	.	.			trans	-54	161.8	-170.6	61.3	0	0	0	0	113.9	T304 E305	T302-T304 PolarHBondContact O-N 3.5Å; T302-T304 VanDerWaalsContact O-N 3.11Å; T302-T304 PolarHBondContact OG1-OG1 2.91Å; T302-E305 VanDerWaalsContact CB-OE2 3.28Å; T302-E305 WeakPolarHBondContact CB-OE2 3.45Å; T302-E305 WeakPolarHBondContact CG2-OE2 3.25Å; T302-E305 PolarHBondContact N-OE2 2.74Å; T302-E305 PolarHBondContact O-N 3.36Å; T302-E305 VanDerWaalsContact OG1-CD 3.3Å; T302-E305 VanDerWaalsContact OG1-CG 3.32Å; T302-E305 WeakPolarHBondContact OG1-CG 3.46Å; T302-E305 PolarHBondContact OG1-OE2 3.1Å
303	P	50.7	Low	59.1	Low	84 Å²	84	88.2 Å²	88.2	55%	0.545	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-46.7	-37.6	171.3	-31.5	36.7	0	0	0	114.9	E305 R306	P303-E305 VanDerWaalsContact C-N 3.34Å; P303-R306 VanDerWaalsContact O-CB 3.31Å; P303-R306 WeakPolarHBondContact O-CB 3.41Å; P303-R306 WeakPolarHBondContact O-CD 3.35Å; P303-R306 VanDerWaalsContact O-CG 3.32Å; P303-R306 WeakPolarHBondContact O-CG 3.26Å; P303-R306 PolarHBondContact O-N 3.37Å
304	T	52.4	Low	60.5	Low	133 Å²	133	87.4 Å²	87.4	82%	0.816	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-74.9	-17.7	179	35.5	0	0	0	0	114.4	T302	T302-T304 PolarHBondContact O-N 3.5Å; T302-T304 VanDerWaalsContact O-N 3.11Å; T302-T304 PolarHBondContact OG1-OG1 2.91Å
305	E	54.6	Low	61.4	Low	100 Å²	100	89.7 Å²	89.7	47%	0.467	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-94.1	6.3	175.3	-66.6	164.7	113.3	0	0	112.3	K301 T302 P303 K307	K301-E305 HydrophobicContact CB-CB 3.68Å; K301-E305 HydrophobicContact CB-CG 4.41Å; K301-E305 HydrophobicContact CD-CB 4.41Å; T302-E305 VanDerWaalsContact CB-OE2 3.28Å; T302-E305 WeakPolarHBondContact CB-OE2 3.45Å; T302-E305 WeakPolarHBondContact CG2-OE2 3.25Å; T302-E305 PolarHBondContact N-OE2 2.74Å; T302-E305 PolarHBondContact O-N 3.36Å; T302-E305 VanDerWaalsContact OG1-CD 3.3Å; T302-E305 VanDerWaalsContact OG1-CG 3.32Å; T302-E305 WeakPolarHBondContact OG1-CG 3.46Å; T302-E305 PolarHBondContact OG1-OE2 3.1Å; P303-E305 VanDerWaalsContact C-N 3.34Å; E305-K307 PolarHBondContact O-N 2.71Å; E305-K307 VanDerWaalsContact O-N 3.12Å
306	R	51.5	Low	62.4	Low	153 Å²	153	90.7 Å²	90.7	58%	0.577	46%	0.461	S	S	*	.			trans	-78.1	87.4	178.7	-66.2	174.8	-179	150.1	0.4	112.3	P303 R366	P303-R306 VanDerWaalsContact O-CB 3.31Å; P303-R306 WeakPolarHBondContact O-CB 3.41Å; P303-R306 WeakPolarHBondContact O-CD 3.35Å; P303-R306 VanDerWaalsContact O-CG 3.32Å; P303-R306 WeakPolarHBondContact O-CG 3.26Å; P303-R306 PolarHBondContact O-N 3.37Å; R306-R366 VanDerWaalsContact CG-NH2 3.33Å
307	K	55.6	Low	63.2	Low	194 Å²	194	92 Å²	92	84%	0.843	48%	0.481	S	S	*	.			trans	-102.6	92.5	147.7	-76.7	-172	177.2	-178.5	0	108.6	E305 K309	E305-K307 PolarHBondContact O-N 2.71Å; E305-K307 VanDerWaalsContact O-N 3.12Å; K307-K309 PolarHBondContact O-N 3.44Å
308	N	59.2	Low	64.4	Low	85 Å²	85	96.2 Å²	96.2	46%	0.455	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-62.5	126.1	173.1	-65.9	15.5	0	0	0	108.1	S310 R363	N308-S310 PolarHBondContact O-N 3.44Å; N308-R363 PolarHBondContact ND2-O 3.46Å
309	K	67.9	Low	65.7	Low	90 Å²	90	96.3 Å²	96.3	39%	0.391	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-76.6	118.4	174.8	-63.2	176.5	-167.2	166.6	0	107.8	K307 P340 C341 D342 C344	K307-K309 PolarHBondContact O-N 3.44Å; K309-P340 HydrophobicContact CB-CB 3.9Å; K309-P340 HydrophobicContact CB-CG 3.49Å; K309-P340 VanDerWaalsContact CB-CG 3.49Å; K309-P340 HydrophobicContact CD-CB 4.13Å; K309-C341 WeakPolarHBondContact CD-O 3.24Å; K309-C341 WeakPolarHBondContact CE-O 3.27Å; K309-C341 PolarHBondContact NZ-O 3.44Å; K309-D342 WeakPolarHBondContact CE-O 3.29Å; K309-D342 PolarHBondContact N-OD1 3.29Å; K309-D342 PolarHBondContact NZ-O 2.75Å; K309-C344 PolarHBondContact NZ-O 2.81Å
310	S	74.6	Confident	66.8	Low	98 Å²	98	95.9 Å²	95.9	69%	0.685	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-64.1	145.5	177.8	51.8	0	0	0	0	111.1	N308 I312 P340	N308-S310 PolarHBondContact O-N 3.44Å; S310-I312 PolarHBondContact O-N 2.86Å; S310-P340 WeakPolarHBondContact O-CG 3.49Å
311	I	83.9	Confident	67.8	Low	27 Å²	27	96.2 Å²	96.2	14%	0.138	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-53.4	134.3	167.5	-58	161.6	0	0	0	107.8	E313 P337 Y360	I311-E313 HydrophobicContact CG2-CG 4.23Å; I311-E313 PolarHBondContact O-N 3.23Å; I311-P337 HydrophobicContact CG2-CB 3.88Å; I311-Y360 HydrophobicContact CD1-CD1 3.61Å; I311-Y360 HydrophobicContact CD1-CD2 4Å; I311-Y360 HydrophobicContact CD1-CE1 4.27Å; I311-Y360 HydrophobicContact CD1-CG 3.5Å; I311-Y360 VanDerWaalsContact CD1-CG 3.5Å; I311-Y360 HydrophobicContact CG1-CD1 3.82Å; I311-Y360 HydrophobicContact CG1-CE1 4.26Å; I311-Y360 HydrophobicContact CG1-CG 4.24Å; I311-Y360 HydrophobicContact CG2-CD1 4.07Å; I311-Y360 HydrophobicContact CG2-CE1 3.63Å
312	I	81.2	Confident	69.1	Low	33 Å²	33	96.5 Å²	96.5	17%	0.169	51%	0.511	C	S	.	.	B	Isolated β-bridge	trans	-96.8	97.7	-175.3	-50.5	173.7	0	0	0	108	S310 P320 R324 C333 P337 L338	S310-I312 PolarHBondContact O-N 2.86Å; I312-P320 HydrophobicContact CG2-CG 4.17Å; I312-R324 HydrophobicContact CD1-CB 3.97Å; I312-R324 HydrophobicContact CD1-CG 3.75Å; I312-C333 HydrophobicContact CG2-CB 4.31Å; I312-C333 VanDerWaalsContact O-CB 3.25Å; I312-C333 WeakPolarHBondContact O-CB 3.27Å; I312-P337 WeakPolarHBondContact O-CA 3.25Å; I312-L338 HydrophobicContact CB-CB 4.18Å; I312-L338 PolarHBondContact N-O 3.21Å; I312-L338 PolarHBondContact O-N 3.1Å
313	E	82.9	Confident	70.3	Confident	102 Å²	102	98.1 Å²	98.1	48%	0.477	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-95.5	173.9	175.1	-73.1	163.9	-144.8	0	0	110.4	I311 P320 P337	I311-E313 HydrophobicContact CG2-CG 4.23Å; I311-E313 PolarHBondContact O-N 3.23Å; E313-P320 WeakPolarHBondContact O-CD 3.32Å; E313-P320 VanDerWaalsContact O-CG 3.29Å; E313-P320 WeakPolarHBondContact O-CG 3.37Å; E313-P337 HydrophobicContact CB-CB 4.48Å; E313-P337 HydrophobicContact CG-CB 3.52Å; E313-P337 HydrophobicContact CG-CG 3.84Å
314	L	80.6	Confident	71.9	Confident	67 Å²	67	99 Å²	99	35%	0.351	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-75.2	127	168.7	-61.1	85.6	0	0	0	108.8	L318 C333 F334	L314-L318 WeakPolarHBondContact CA-O 3.26Å; L314-C333 VanDerWaalsContact CD1-O 3.23Å; L314-C333 WeakPolarHBondContact CD1-O 3.41Å; L314-F334 HydrophobicContact CD2-CD2 3.73Å; L314-F334 HydrophobicContact CD2-CE2 4.36Å
315	E	72.4	Confident	73.6	Confident	135 Å²	135	97.5 Å²	97.5	63%	0.631	49%	0.493	S	S	*	.	B	Isolated β-bridge	trans	-95.7	119.5	173.1	-169.3	174.3	177.5	0	0	108.5	G317 L318 P320	E315-G317 PolarHBondContact O-N 2.77Å; E315-G317 VanDerWaalsContact O-N 3.12Å; E315-L318 PolarHBondContact N-O 2.81Å; E315-L318 PolarHBondContact O-N 3.11Å; E315-P320 HydrophobicContact CB-CG 4.47Å
316	N	74	Confident	75.2	Confident	157 Å²	157	92.9 Å²	92.9	84%	0.84	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	30.3	-176.9	-58.8	-10.2	0	0	0	114.6	L318	N316-L318 PolarHBondContact O-N 3.12Å
317	G	69.6	Low	76.9	Confident	52 Å²	52	87.5 Å²	87.5	54%	0.536	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-2	-176.3	0	0	0	0	0	114.7	E315	E315-G317 PolarHBondContact O-N 2.77Å; E315-G317 VanDerWaalsContact O-N 3.12Å
318	L	74.6	Confident	78.4	Confident	129 Å²	129	81 Å²	81	68%	0.675	43%	0.428	S	S	*	.	B	Isolated β-bridge	trans	-98.1	152	176.3	-60.1	175.6	0	0	0	110.7	L314 E315 N316 P320	L314-L318 WeakPolarHBondContact CA-O 3.26Å; E315-L318 PolarHBondContact N-O 2.81Å; E315-L318 PolarHBondContact O-N 3.11Å; N316-L318 PolarHBondContact O-N 3.12Å; L318-P320 WeakPolarHBondContact O-CD 3.43Å
319	I	78.7	Confident	79.6	Confident	25 Å²	25	79 Å²	79	13%	0.128	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-79.5	123.2	175	-61.1	170	0	0	0	108.3	P116 Q321 V323 T332 F334	P116-I319 HydrophobicContact CB-CD1 3.74Å; P116-I319 HydrophobicContact CG-CD1 4.33Å; I319-Q321 PolarHBondContact O-N 2.89Å; I319-V323 HydrophobicContact CG2-CB 4.43Å; I319-V323 HydrophobicContact CG2-CG1 4.02Å; I319-V323 HydrophobicContact CG2-CG2 4.04Å; I319-T332 HydrophobicContact CD1-CG2 4.02Å; I319-T332 VanDerWaalsContact CD1-OG1 3.31Å; I319-T332 WeakPolarHBondContact CD1-OG1 3.23Å; I319-F334 HydrophobicContact CD1-CB 4.13Å; I319-F334 HydrophobicContact CG1-CB 4.28Å
320	P	78.7	Confident	80.4	Confident	39 Å²	39	77.1 Å²	77.1	25%	0.253	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-58.4	137.3	178.7	-25.9	35.7	0	0	0	112.6	I312 E313 E315 L318 P322 C333	I312-P320 HydrophobicContact CG2-CG 4.17Å; E313-P320 WeakPolarHBondContact O-CD 3.32Å; E313-P320 VanDerWaalsContact O-CG 3.29Å; E313-P320 WeakPolarHBondContact O-CG 3.37Å; E315-P320 HydrophobicContact CB-CG 4.47Å; L318-P320 WeakPolarHBondContact O-CD 3.43Å; P320-P322 CarbonylContact O-C 3.57Å; P320-C333 VanDerWaalsContact CD-SG 3.55Å
321	Q	75.2	Confident	80.6	Confident	182 Å²	182	76.4 Å²	76.4	85%	0.85	40%	0.398	S	S	*	.	S	Bend	trans	-94	140.8	173.7	-62.7	-168.5	10.6	0	0	110.8	I319	I319-Q321 PolarHBondContact O-N 2.89Å
322	P	77.6	Confident	80.7	Confident	103 Å²	103	75.2 Å²	75.2	67%	0.669	39%	0.392	S	S	*	.	S	Bend	cis	-72.4	137.7	-2.3	30.5	-35.4	0	0	0	112.3	P320 R324	P320-P322 CarbonylContact O-C 3.57Å; P322-R324 PolarHBondContact O-N 3.19Å
323	V	80.7	Confident	81	Confident	72 Å²	72	73.7 Å²	73.7	44%	0.436	38%	0.384	S	S	.	.			trans	-59	111	-174	176.5	0	0	0	0	111.4	I319 T332	I319-V323 HydrophobicContact CG2-CB 4.43Å; I319-V323 HydrophobicContact CG2-CG1 4.02Å; I319-V323 HydrophobicContact CG2-CG2 4.04Å; V323-T332 HydrophobicContact CG1-CG2 3.69Å
324	R	84.2	Confident	80.9	Confident	104 Å²	104	72.9 Å²	72.9	39%	0.392	38%	0.38	S	S	.	.			trans	-87.5	152.1	171.1	-63.9	-67.6	-179.3	158.2	-7	110.7	I312 P322 L338 S345	I312-R324 HydrophobicContact CD1-CB 3.97Å; I312-R324 HydrophobicContact CD1-CG 3.75Å; P322-R324 PolarHBondContact O-N 3.19Å; R324-L338 HydrophobicContact CB-CD1 4.05Å; R324-S345 PolarHBondContact NH1-O 2.91Å
325	R	87.2	Confident	81	Confident	101 Å²	101	74 Å²	74	38%	0.381	38%	0.38	S	S	.	.			trans	-134.3	151.4	-179.5	-72.5	176.8	179.5	146.3	13.3	110.6	H131 V330 R331 T332	H131-R325 PolarHBondContact CE1-NH2 2.96Å; R325-V330 VanDerWaalsContact CD-O 3.23Å; R325-V330 WeakPolarHBondContact CD-O 3.42Å; R325-V330 WeakPolarHBondContact CG-O 3.33Å; R325-R331 WeakPolarHBondContact CA-O 3.49Å; R325-T332 HydrophobicContact CG-CG2 4.17Å
326	C	89.5	Confident	81.6	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.02	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-65.9	132.9	175.1	177.4	0	0	0	0	112	V328 C329 V330 R331 L338 C347 H349 C352	C326-V328 PolarHBondContact O-N 3.32Å; C326-V328 PolarHBondContact SG-N 3.48Å; C326-C329 VanDerWaalsContact CB-SG 3.54Å; C326-V330 VanDerWaalsContact O-CA 3.24Å; C326-V330 WeakPolarHBondContact O-CA 3.36Å; C326-V330 PolarHBondContact O-N 2.79Å; C326-R331 PolarHBondContact N-O 2.89Å; C326-L338 HydrophobicContact CB-CD2 3.66Å; C326-C347 CarbonylContact C-O 3.13Å; C326-C347 VanDerWaalsContact CA-O 3.29Å; C326-C347 WeakPolarHBondContact CA-O 3.2Å; C326-H349 VanDerWaalsContact CB-CE1 3.46Å; C326-H349 WeakPolarHBondContact CB-CE1 3.32Å; C326-H349 VanDerWaalsContact CB-ND1 3.27Å; C326-H349 WeakPolarHBondContact CB-ND1 3.45Å; C326-H349 PolarHBondContact SG-N 3.47Å; C326-H349 VanDerWaalsContact SG-N 3.45Å; C326-C352 WeakPolarHBondContact SG-CB 3.37Å
327	Y	87.2	Confident	82.3	Confident	39 Å²	39	63.5 Å²	63.5	15%	0.153	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-11.8	176.8	-172.2	-88.6	0	0	0	113.2	A346 C347 F348 N371 T447 R450	Y327-A346 HydrophobicContact CD2-CB 4.13Å; Y327-A346 HydrophobicContact CG-CB 4.37Å; Y327-C347 PolarHBondContact N-O 3.39Å; Y327-F348 AromaticContact CD1-CE1 3.81Å; Y327-F348 HydrophobicContact CD1-CE1 3.81Å; Y327-F348 AromaticContact CD1-CZ 3.73Å; Y327-F348 HydrophobicContact CD1-CZ 3.73Å; Y327-F348 HydrophobicContact CG-CE1 4.11Å; Y327-F348 HydrophobicContact CG-CE2 4.46Å; Y327-F348 AromaticContact CG-CZ 3.81Å; Y327-F348 HydrophobicContact CG-CZ 3.81Å; Y327-N371 VanDerWaalsContact CD1-ND2 3.29Å; Y327-N371 WeakPolarHBondContact CD1-ND2 3.42Å; Y327-N371 WeakPolarHBondContact CE1-ND2 3.36Å; Y327-N371 WeakPolarHBondContact CE2-ND2 3.28Å; Y327-T447 PolarHBondContact OH-OG1 2.66Å; Y327-R450 PolarHBondContact O-NH1 3.08Å; Y327-R450 PolarHBondContact O-NH2 2.6Å
328	V	86	Confident	83.2	Confident	59 Å²	59	61 Å²	61	36%	0.358	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-57.3	174.8	-177.2	0	0	0	0	111.8	C326 F348 C352 R446	C326-V328 PolarHBondContact O-N 3.32Å; C326-V328 PolarHBondContact SG-N 3.48Å; V328-F348 HydrophobicContact CG2-CD1 4.07Å; V328-F348 HydrophobicContact CG2-CE1 4.04Å; V328-C352 HydrophobicContact CB-CB 3.95Å; V328-C352 HydrophobicContact CG2-CB 4.39Å; V328-C352 WeakPolarHBondContact CG2-O 3.4Å; V328-R446 PolarHBondContact O-NH1 3.04Å
329	C	84.6	Confident	84	Confident	43 Å²	43	55.5 Å²	55.5	29%	0.291	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-11.1	-174	77.9	0	0	0	0	115.2	C326 R331 H349	C326-C329 VanDerWaalsContact CB-SG 3.54Å; C329-R331 PolarHBondContact O-N 3.4Å; C329-R331 PolarHBondContact SG-N 3.05Å; C329-H349 PolarHBondContact SG-CE1 3.35Å; C329-H349 PolarHBondContact SG-ND1 3.42Å
330	V	83.9	Confident	84.6	Confident	50 Å²	50	54.7 Å²	54.7	30%	0.303	28%	0.277	S	S	.	.			trans	64.4	0.3	-179	-168.1	0	0	0	0	114.8	M135 R325 C326	M135-V330 HydrophobicContact CE-CG1 3.92Å; R325-V330 VanDerWaalsContact CD-O 3.23Å; R325-V330 WeakPolarHBondContact CD-O 3.42Å; R325-V330 WeakPolarHBondContact CG-O 3.33Å; C326-V330 VanDerWaalsContact O-CA 3.24Å; C326-V330 WeakPolarHBondContact O-CA 3.36Å; C326-V330 PolarHBondContact O-N 2.79Å
331	R	79.9	Confident	85	Confident	82 Å²	82	52.9 Å²	52.9	31%	0.309	26%	0.264	S	S	.	.			trans	-69.6	157.5	170.2	-60.2	179.7	-175.9	140.2	3.4	111.5	D115 R325 C326 C329 Y335	D115-R331 WeakPolarHBondContact OD2-CA 3.28Å; D115-R331 WeakPolarHBondContact OD2-CB 3.45Å; R325-R331 WeakPolarHBondContact CA-O 3.49Å; C326-R331 PolarHBondContact N-O 2.89Å; C329-R331 PolarHBondContact O-N 3.4Å; C329-R331 PolarHBondContact SG-N 3.05Å; R331-Y335 HydrophobicContact CB-CG 4.48Å
332	T	85.7	Confident	85.3	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	23%	0.231	C	C	.	.			trans	-80.6	-172.2	178.1	71.8	0	0	0	0	112	D115 I319 V323 R325 F334 H349	D115-T332 WeakPolarHBondContact OD1-CB 3.27Å; D115-T332 VanDerWaalsContact OD1-CG2 3.3Å; D115-T332 WeakPolarHBondContact OD1-CG2 3.47Å; D115-T332 PolarHBondContact OD1-OG1 3.37Å; D115-T332 PolarHBondContact OD2-N 3.04Å; D115-T332 VanDerWaalsContact OD2-N 3.15Å; I319-T332 HydrophobicContact CD1-CG2 4.02Å; I319-T332 VanDerWaalsContact CD1-OG1 3.31Å; I319-T332 WeakPolarHBondContact CD1-OG1 3.23Å; V323-T332 HydrophobicContact CG1-CG2 3.69Å; R325-T332 HydrophobicContact CG-CG2 4.17Å; T332-F334 PolarHBondContact O-N 3.36Å; T332-F334 WeakPolarHBondContact OG1-CB 3.25Å; T332-F334 PolarHBondContact OG1-N 3.36Å; T332-F334 VanDerWaalsContact OG1-N 3.08Å; T332-H349 PolarHBondContact O-CE1 2.93Å; T332-H349 PolarHBondContact O-NE2 2.77Å
333	C	86.7	Confident	85.3	Confident	1 Å²	1	43 Å²	43	1%	0.007	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-10.5	169.4	62.6	0	0	0	0	113.5	I312 L314 P320 Y335 A336 L338	I312-C333 HydrophobicContact CG2-CB 4.31Å; I312-C333 VanDerWaalsContact O-CB 3.25Å; I312-C333 WeakPolarHBondContact O-CB 3.27Å; L314-C333 VanDerWaalsContact CD1-O 3.23Å; L314-C333 WeakPolarHBondContact CD1-O 3.41Å; P320-C333 VanDerWaalsContact CD-SG 3.55Å; C333-Y335 VanDerWaalsContact C-N 3.26Å; C333-Y335 PolarHBondContact O-N 3.12Å; C333-A336 CarbonylContact C-O 3.58Å; C333-A336 VanDerWaalsContact CA-O 3.27Å; C333-A336 WeakPolarHBondContact CA-O 3.37Å; C333-A336 CarbonylContact O-C 3.43Å; C333-A336 PolarHBondContact O-N 2.85Å; C333-L338 HydrophobicContact CB-CD1 4.16Å; C333-L338 HydrophobicContact CB-CG 4.23Å
334	F	82.2	Confident	85.3	Confident	86 Å²	86	41.5 Å²	41.5	38%	0.377	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-32.4	175.2	-172.8	-94.9	0	0	0	113	P117 L314 I319 T332	P117-F334 HydrophobicContact CG-CD2 4.41Å; P117-F334 HydrophobicContact CG-CE1 3.96Å; P117-F334 HydrophobicContact CG-CE2 3.54Å; P117-F334 HydrophobicContact CG-CZ 3.28Å; L314-F334 HydrophobicContact CD2-CD2 3.73Å; L314-F334 HydrophobicContact CD2-CE2 4.36Å; I319-F334 HydrophobicContact CD1-CB 4.13Å; I319-F334 HydrophobicContact CG1-CB 4.28Å; T332-F334 PolarHBondContact O-N 3.36Å; T332-F334 WeakPolarHBondContact OG1-CB 3.25Å; T332-F334 PolarHBondContact OG1-N 3.36Å; T332-F334 VanDerWaalsContact OG1-N 3.08Å
335	Y	82.3	Confident	85.3	Confident	91 Å²	91	40.4 Å²	40.4	36%	0.357	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-42.7	178.7	176.4	-107	0	0	0	113.1	R331 C333 H349	R331-Y335 HydrophobicContact CB-CG 4.48Å; C333-Y335 VanDerWaalsContact C-N 3.26Å; C333-Y335 PolarHBondContact O-N 3.12Å; Y335-H349 AromaticContact CD1-CE1 3.83Å; Y335-H349 AromaticContact CD1-ND1 3.88Å
336	A	84.2	Confident	85.3	Confident	32 Å²	32	36.3 Å²	36.3	26%	0.264	20%	0.197	S	C	.	.	S	Bend	trans	-169.7	161.5	177.7	0	0	0	0	0	107.3	C333 H349	C333-A336 CarbonylContact C-O 3.58Å; C333-A336 VanDerWaalsContact CA-O 3.27Å; C333-A336 WeakPolarHBondContact CA-O 3.37Å; C333-A336 CarbonylContact O-C 3.43Å; C333-A336 PolarHBondContact O-N 2.85Å; A336-H349 PolarHBondContact O-CD2 3.17Å; A336-H349 PolarHBondContact O-NE2 2.82Å
337	P	88.9	Confident	85.3	Confident	38 Å²	38	36.5 Å²	36.5	25%	0.247	20%	0.198	C	C	.	.			trans	-68.7	142.2	-179	-10.9	24.2	0	0	0	112.6	I311 I312 E313 Y360	I311-P337 HydrophobicContact CG2-CB 3.88Å; I312-P337 WeakPolarHBondContact O-CA 3.25Å; E313-P337 HydrophobicContact CB-CB 4.48Å; E313-P337 HydrophobicContact CG-CB 3.52Å; E313-P337 HydrophobicContact CG-CG 3.84Å; P337-Y360 VanDerWaalsContact CB-OH 3.25Å; P337-Y360 WeakPolarHBondContact CB-OH 3.29Å; P337-Y360 WeakPolarHBondContact CG-OH 3.35Å; P337-Y360 PolarHBondContact O-OH 3.17Å
338	L	90	Very high	85.4	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125	-177.8	-66.4	167.5	0	0	0	110.6	I312 R324 C326 C333 P340 C347 F348 H349	I312-L338 HydrophobicContact CB-CB 4.18Å; I312-L338 PolarHBondContact N-O 3.21Å; I312-L338 PolarHBondContact O-N 3.1Å; R324-L338 HydrophobicContact CB-CD1 4.05Å; C326-L338 HydrophobicContact CB-CD2 3.66Å; C333-L338 HydrophobicContact CB-CD1 4.16Å; C333-L338 HydrophobicContact CB-CG 4.23Å; L338-P340 VanDerWaalsContact O-CD 3.27Å; L338-P340 WeakPolarHBondContact O-CD 3.24Å; L338-C347 HydrophobicContact CB-CB 4.12Å; L338-C347 HydrophobicContact CD1-CB 4.35Å; L338-C347 HydrophobicContact CD2-CB 4.41Å; L338-F348 CarbonylContact C-O 3.59Å; L338-F348 WeakPolarHBondContact CA-O 3.46Å; L338-H349 WeakPolarHBondContact CD2-NE2 3.27Å
339	L	91.1	Very high	85.6	Confident	12 Å²	12	32 Å²	32	6%	0.063	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	111.3	165.8	176.1	56.9	0	0	0	109.2	C347 F348 L350 L353 L357 Y360 P361 W367	L339-C347 CarbonylContact O-C 3.47Å; L339-C347 WeakPolarHBondContact O-CA 3.31Å; L339-F348 PolarHBondContact N-O 3.45Å; L339-F348 PolarHBondContact O-N 2.89Å; L339-L350 HydrophobicContact CD2-CD2 4.05Å; L339-L353 HydrophobicContact CD2-CD1 4.34Å; L339-L357 HydrophobicContact CD2-CD1 4.13Å; L339-Y360 HydrophobicContact CB-CD1 4.17Å; L339-Y360 HydrophobicContact CB-CE1 4.03Å; L339-Y360 HydrophobicContact CD1-CD1 4.28Å; L339-P361 HydrophobicContact CD2-CG 4.1Å; L339-W367 HydrophobicContact CD1-CD2 4.43Å; L339-W367 HydrophobicContact CD1-CE3 4.13Å; L339-W367 HydrophobicContact CD2-CD2 3.58Å; L339-W367 HydrophobicContact CD2-CE3 3.72Å; L339-W367 HydrophobicContact CD2-CG 4.1Å; L339-W367 HydrophobicContact CD2-CH2 4.12Å; L339-W367 HydrophobicContact CD2-CZ2 4.01Å; L339-W367 HydrophobicContact CD2-CZ3 3.98Å; L339-W367 HydrophobicContact CG-CD2 3.95Å; L339-W367 HydrophobicContact CG-CE3 3.56Å; L339-W367 HydrophobicContact CG-CH2 4.33Å; L339-W367 HydrophobicContact CG-CZ3 3.77Å
340	P	89.7	Confident	85.9	Confident	9 Å²	9	31 Å²	31	6%	0.058	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	142.9	172.2	31.7	-35.7	0	0	0	111.2	K309 S310 L338	K309-P340 HydrophobicContact CB-CB 3.9Å; K309-P340 HydrophobicContact CB-CG 3.49Å; K309-P340 VanDerWaalsContact CB-CG 3.49Å; K309-P340 HydrophobicContact CD-CB 4.13Å; S310-P340 WeakPolarHBondContact O-CG 3.49Å; L338-P340 VanDerWaalsContact O-CD 3.27Å; L338-P340 WeakPolarHBondContact O-CD 3.24Å
341	C	87.3	Confident	86.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.			trans	-71.3	130.6	165.7	-178	0	0	0	0	109.8	K309 Y343 C344 A346 W367 C369 H372	K309-C341 WeakPolarHBondContact CD-O 3.24Å; K309-C341 WeakPolarHBondContact CE-O 3.27Å; K309-C341 PolarHBondContact NZ-O 3.44Å; C341-Y343 PolarHBondContact O-N 2.96Å; C341-Y343 PolarHBondContact SG-N 3.03Å; C341-Y343 VanDerWaalsContact SG-N 3.36Å; C341-C344 VanDerWaalsContact CB-SG 3.59Å; C341-C344 VanDerWaalsContact SG-SG 3.62Å; C341-A346 PolarHBondContact N-O 3.04Å; C341-W367 HydrophobicContact CB-CE3 4.41Å; C341-W367 HydrophobicContact CB-CZ3 4.13Å; C341-C369 HydrophobicContact CB-CB 3.83Å; C341-C369 PolarHBondContact SG-N 2.89Å; C341-H372 PolarHBondContact SG-NE2 2.7Å
342	D	83.1	Confident	86.6	Confident	27 Å²	27	31.2 Å²	31.2	14%	0.144	17%	0.17	C	C	.	.	S	Bend	trans	-66.1	-26.1	176	-76.5	-54.9	0	0	0	112.6	K309 R366 W367	K309-D342 WeakPolarHBondContact CE-O 3.29Å; K309-D342 PolarHBondContact N-OD1 3.29Å; K309-D342 PolarHBondContact NZ-O 2.75Å; D342-R366 HydrophobicContact CB-CB 4.26Å; D342-R366 VanDerWaalsContact OD2-CA 3.25Å; D342-R366 WeakPolarHBondContact OD2-CA 3.37Å; D342-R366 WeakPolarHBondContact OD2-CB 3.08Å; D342-W367 PolarHBondContact N-O 2.97Å; D342-W367 PolarHBondContact OD2-N 3.05Å
343	Y	77.7	Confident	86.7	Confident	52 Å²	52	32 Å²	32	20%	0.204	17%	0.173	C	C	.	.	S	Bend	trans	-96	-22.5	-169.8	-60.8	-99.5	0	0	0	114	G298 C341 R366 M368 H372	G298-Y343 VanDerWaalsContact O-CE1 3.27Å; G298-Y343 WeakPolarHBondContact O-CE1 3.33Å; G298-Y343 PolarHBondContact O-OH 2.87Å; C341-Y343 PolarHBondContact O-N 2.96Å; C341-Y343 PolarHBondContact SG-N 3.03Å; C341-Y343 VanDerWaalsContact SG-N 3.36Å; Y343-R366 HydrophobicContact CE2-CB 3.93Å; Y343-M368 HydrophobicContact CD2-CB 3.68Å; Y343-M368 HydrophobicContact CD2-CG 3.93Å; Y343-M368 HydrophobicContact CE2-CB 3.83Å; Y343-M368 HydrophobicContact CE2-CG 4.43Å; Y343-M368 HydrophobicContact CG-CB 4.46Å; Y343-M368 HydrophobicContact CG-CG 4.23Å; Y343-H372 WeakPolarHBondContact CB-CE1 3.25Å; Y343-H372 WeakPolarHBondContact CB-NE2 3.43Å
344	C	79.9	Confident	86.4	Confident	39 Å²	39	39.5 Å²	39.5	26%	0.264	21%	0.213	S	C	.	.	S	Bend	trans	-139.2	-169	-178.2	75.5	0	0	0	0	114.9	K309 C341 A346 H372	K309-C344 PolarHBondContact NZ-O 2.81Å; C341-C344 VanDerWaalsContact CB-SG 3.59Å; C341-C344 VanDerWaalsContact SG-SG 3.62Å; C344-A346 PolarHBondContact SG-N 3.06Å; C344-H372 WeakPolarHBondContact CB-NE2 3.18Å; C344-H372 PolarHBondContact SG-NE2 3.46Å; C344-H372 VanDerWaalsContact SG-NE2 3.45Å
345	S	83.8	Confident	86.4	Confident	81 Å²	81	40 Å²	40	57%	0.566	23%	0.225	S	C	*	.	S	Bend	trans	-50.6	-42.4	170.9	139.1	0	0	0	0	117.9	R324	R324-S345 PolarHBondContact NH1-O 2.91Å
346	A	86.7	Confident	86.5	Confident	16 Å²	16	38.9 Å²	38.9	13%	0.132	23%	0.229	C	C	.	.			trans	-80.4	149.1	-152.5	0	0	0	0	0	112.7	Y327 C341 C344 F348	Y327-A346 HydrophobicContact CD2-CB 4.13Å; Y327-A346 HydrophobicContact CG-CB 4.37Å; C341-A346 PolarHBondContact N-O 3.04Å; C344-A346 PolarHBondContact SG-N 3.06Å; A346-F348 HydrophobicContact CB-CD2 4.42Å; A346-F348 HydrophobicContact CB-CE2 3.62Å; A346-F348 HydrophobicContact CB-CZ 4.31Å
347	C	89.4	Confident	86.6	Confident	6 Å²	6	40.2 Å²	40.2	4%	0.041	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	146.7	176.1	-58.2	0	0	0	0	108.1	C326 Y327 L338 L339	C326-C347 CarbonylContact C-O 3.13Å; C326-C347 VanDerWaalsContact CA-O 3.29Å; C326-C347 WeakPolarHBondContact CA-O 3.2Å; Y327-C347 PolarHBondContact N-O 3.39Å; L338-C347 HydrophobicContact CB-CB 4.12Å; L338-C347 HydrophobicContact CD1-CB 4.35Å; L338-C347 HydrophobicContact CD2-CB 4.41Å; L339-C347 CarbonylContact O-C 3.47Å; L339-C347 WeakPolarHBondContact O-CA 3.31Å
348	F	91.2	Very high	86.5	Confident	3 Å²	3	43.8 Å²	43.8	1%	0.013	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143.3	-176.7	-66.4	-106	0	0	0	110.1	Y327 V328 L338 L339 A346 L353 W367 C369 P370	Y327-F348 AromaticContact CD1-CE1 3.81Å; Y327-F348 HydrophobicContact CD1-CE1 3.81Å; Y327-F348 AromaticContact CD1-CZ 3.73Å; Y327-F348 HydrophobicContact CD1-CZ 3.73Å; Y327-F348 HydrophobicContact CG-CE1 4.11Å; Y327-F348 HydrophobicContact CG-CE2 4.46Å; Y327-F348 AromaticContact CG-CZ 3.81Å; Y327-F348 HydrophobicContact CG-CZ 3.81Å; V328-F348 HydrophobicContact CG2-CD1 4.07Å; V328-F348 HydrophobicContact CG2-CE1 4.04Å; L338-F348 CarbonylContact C-O 3.59Å; L338-F348 WeakPolarHBondContact CA-O 3.46Å; L339-F348 PolarHBondContact N-O 3.45Å; L339-F348 PolarHBondContact O-N 2.89Å; A346-F348 HydrophobicContact CB-CD2 4.42Å; A346-F348 HydrophobicContact CB-CE2 3.62Å; A346-F348 HydrophobicContact CB-CZ 4.31Å; F348-L353 HydrophobicContact CB-CD2 3.82Å; F348-L353 HydrophobicContact CB-CG 4.08Å; F348-L353 HydrophobicContact CD1-CD2 3.48Å; F348-L353 VanDerWaalsContact CD1-CD2 3.48Å; F348-L353 HydrophobicContact CD1-CG 4.39Å; F348-L353 HydrophobicContact CD2-CD2 4.43Å; F348-L353 HydrophobicContact CE1-CD2 4.09Å; F348-L353 HydrophobicContact CG-CD2 3.67Å; F348-L353 HydrophobicContact CG-CG 4.46Å; F348-W367 HydrophobicContact CB-CH2 4.29Å; F348-W367 AromaticContact CD2-CH2 3.66Å; F348-W367 HydrophobicContact CD2-CH2 3.66Å; F348-W367 HydrophobicContact CD2-CZ3 4.05Å; F348-W367 HydrophobicContact CE2-CH2 4.22Å; F348-W367 HydrophobicContact CG-CH2 4.1Å; F348-C369 HydrophobicContact CD2-CB 3.99Å; F348-C369 HydrophobicContact CE2-CB 3.34Å; F348-C369 HydrophobicContact CZ-CB 3.9Å; F348-P370 HydrophobicContact CE1-CG 4.43Å
349	H	90.2	Very high	86.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	150.1	158.1	-59.1	115.8	0	0	0	108.7	C326 C329 T332 Y335 A336 L338 E351 C352	C326-H349 VanDerWaalsContact CB-CE1 3.46Å; C326-H349 WeakPolarHBondContact CB-CE1 3.32Å; C326-H349 VanDerWaalsContact CB-ND1 3.27Å; C326-H349 WeakPolarHBondContact CB-ND1 3.45Å; C326-H349 PolarHBondContact SG-N 3.47Å; C326-H349 VanDerWaalsContact SG-N 3.45Å; C329-H349 PolarHBondContact SG-CE1 3.35Å; C329-H349 PolarHBondContact SG-ND1 3.42Å; T332-H349 PolarHBondContact O-CE1 2.93Å; T332-H349 PolarHBondContact O-NE2 2.77Å; Y335-H349 AromaticContact CD1-CE1 3.83Å; Y335-H349 AromaticContact CD1-ND1 3.88Å; A336-H349 PolarHBondContact O-CD2 3.17Å; A336-H349 PolarHBondContact O-NE2 2.82Å; L338-H349 WeakPolarHBondContact CD2-NE2 3.27Å; H349-E351 VanDerWaalsContact C-N 3.26Å; H349-E351 PolarHBondContact O-N 2.93Å; H349-C352 HydrophobicContact CB-CB 3.87Å; H349-C352 WeakPolarHBondContact O-CA 3.26Å; H349-C352 WeakPolarHBondContact O-CB 3.47Å; H349-C352 PolarHBondContact O-N 3.26Å
350	L	90.7	Very high	86	Confident	24 Å²	24	52 Å²	52	13%	0.126	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-56.8	-43.3	175.5	-65.4	179.7	0	0	0	111.8	L339 C352 L353 P356 L357 Y360	L339-L350 HydrophobicContact CD2-CD2 4.05Å; L350-C352 PolarHBondContact O-N 2.94Å; L350-L353 PolarHBondContact O-N 3.01Å; L350-P356 VanDerWaalsContact O-CA 3.31Å; L350-P356 WeakPolarHBondContact O-CA 3.43Å; L350-L357 HydrophobicContact CB-CB 4.31Å; L350-L357 WeakPolarHBondContact CB-O 3.22Å; L350-L357 HydrophobicContact CD2-CB 3.81Å; L350-L357 HydrophobicContact CD2-CD1 4.13Å; L350-L357 PolarHBondContact O-N 2.98Å; L350-L357 VanDerWaalsContact O-N 3.1Å; L350-Y360 HydrophobicContact CD1-CD1 4.15Å; L350-Y360 HydrophobicContact CD1-CD2 3.8Å; L350-Y360 HydrophobicContact CD1-CE1 3.9Å; L350-Y360 HydrophobicContact CD1-CE2 3.52Å; L350-Y360 HydrophobicContact CD1-CG 4.07Å; L350-Y360 HydrophobicContact CD2-CD1 3.69Å; L350-Y360 HydrophobicContact CD2-CE1 3.71Å; L350-Y360 HydrophobicContact CD2-CG 4.19Å; L350-Y360 HydrophobicContact CG-CD1 4.11Å; L350-Y360 HydrophobicContact CG-CE1 3.68Å; L350-Y360 HydrophobicContact CG-CE2 4.21Å
351	E	89.8	Confident	85.6	Confident	114 Å²	114	53 Å²	53	53%	0.533	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-65.5	-13.9	173.7	-173.8	54.6	-153	0	0	114.3	H349	H349-E351 VanDerWaalsContact C-N 3.26Å; H349-E351 PolarHBondContact O-N 2.93Å
352	C	87.3	Confident	84.8	Confident	22 Å²	22	56.4 Å²	56.4	15%	0.149	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-98.2	5.1	178.9	-79.4	0	0	0	0	113.1	C326 V328 H349 L350	C326-C352 WeakPolarHBondContact SG-CB 3.37Å; V328-C352 HydrophobicContact CB-CB 3.95Å; V328-C352 HydrophobicContact CG2-CB 4.39Å; V328-C352 WeakPolarHBondContact CG2-O 3.4Å; H349-C352 HydrophobicContact CB-CB 3.87Å; H349-C352 WeakPolarHBondContact O-CA 3.26Å; H349-C352 WeakPolarHBondContact O-CB 3.47Å; H349-C352 PolarHBondContact O-N 3.26Å; L350-C352 PolarHBondContact O-N 2.94Å
353	L	88	Confident	83.9	Confident	17 Å²	17	63.9 Å²	63.9	9%	0.089	35%	0.348	C	S	.	.	S	Bend	trans	-90.2	160.8	170.4	-65.4	168.6	0	0	0	109.7	L339 F348 L350 P355 P356 L357 W367 P370	L339-L353 HydrophobicContact CD2-CD1 4.34Å; F348-L353 HydrophobicContact CB-CD2 3.82Å; F348-L353 HydrophobicContact CB-CG 4.08Å; F348-L353 HydrophobicContact CD1-CD2 3.48Å; F348-L353 VanDerWaalsContact CD1-CD2 3.48Å; F348-L353 HydrophobicContact CD1-CG 4.39Å; F348-L353 HydrophobicContact CD2-CD2 4.43Å; F348-L353 HydrophobicContact CE1-CD2 4.09Å; F348-L353 HydrophobicContact CG-CD2 3.67Å; F348-L353 HydrophobicContact CG-CG 4.46Å; L350-L353 PolarHBondContact O-N 3.01Å; L353-P355 VanDerWaalsContact C-C 3.42Å; L353-P355 CarbonylContact C-O 3.59Å; L353-P355 VanDerWaalsContact C-O 3.22Å; L353-P355 WeakPolarHBondContact CB-O 3.32Å; L353-P355 CarbonylContact O-C 3.47Å; L353-P356 WeakPolarHBondContact O-CA 3.31Å; L353-P356 VanDerWaalsContact O-N 3.09Å; L353-L357 HydrophobicContact CD1-CB 4.4Å; L353-L357 HydrophobicContact CD1-CD1 3.42Å; L353-L357 VanDerWaalsContact CD1-CD1 3.42Å; L353-L357 HydrophobicContact CD1-CG 3.68Å; L353-W367 HydrophobicContact CD1-CH2 4.15Å; L353-W367 HydrophobicContact CD1-CZ2 3.6Å; L353-W367 HydrophobicContact CD2-CH2 3.81Å; L353-W367 HydrophobicContact CD2-CZ2 3.64Å; L353-W367 HydrophobicContact CG-CZ2 4.3Å; L353-P370 HydrophobicContact CD2-CG 4.25Å
354	N	81	Confident	82.9	Confident	159 Å²	159	66.1 Å²	66.1	85%	0.85	37%	0.371	S	S	*	.	S	Bend	trans	-126.9	108	176.1	-172.5	7.7	0	0	0	109.5
355	P	81.2	Confident	82.1	Confident	96 Å²	96	68.5 Å²	68.5	62%	0.623	38%	0.381	S	S	*	.	S	Bend	cis	-65.7	158.9	-5.9	30.5	-36.4	0	0	0	112.3	L353	L353-P355 VanDerWaalsContact C-C 3.42Å; L353-P355 CarbonylContact C-O 3.59Å; L353-P355 VanDerWaalsContact C-O 3.22Å; L353-P355 WeakPolarHBondContact CB-O 3.32Å; L353-P355 CarbonylContact O-C 3.47Å
356	P	86.5	Confident	81.6	Confident	68 Å²	68	66.9 Å²	66.9	44%	0.442	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-64.3	137.8	173.7	27.5	-34.4	0	0	0	110	L350 L353	L350-P356 VanDerWaalsContact O-CA 3.31Å; L350-P356 WeakPolarHBondContact O-CA 3.43Å; L353-P356 WeakPolarHBondContact O-CA 3.31Å; L353-P356 VanDerWaalsContact O-N 3.09Å
357	L	86.2	Confident	81.4	Confident	60 Å²	60	68 Å²	68	31%	0.314	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-82.6	130.6	-179.7	-70.5	-179.2	0	0	0	110.6	L339 L350 L353 H359 P361	L339-L357 HydrophobicContact CD2-CD1 4.13Å; L350-L357 HydrophobicContact CB-CB 4.31Å; L350-L357 WeakPolarHBondContact CB-O 3.22Å; L350-L357 HydrophobicContact CD2-CB 3.81Å; L350-L357 HydrophobicContact CD2-CD1 4.13Å; L350-L357 PolarHBondContact O-N 2.98Å; L350-L357 VanDerWaalsContact O-N 3.1Å; L353-L357 HydrophobicContact CD1-CB 4.4Å; L353-L357 HydrophobicContact CD1-CD1 3.42Å; L353-L357 VanDerWaalsContact CD1-CD1 3.42Å; L353-L357 HydrophobicContact CD1-CG 3.68Å; L357-H359 VanDerWaalsContact C-N 3.3Å; L357-H359 PolarHBondContact O-N 3.38Å; L357-P361 HydrophobicContact CD1-CG 4.22Å
358	S	85.9	Confident	81.2	Confident	113 Å²	113	69.2 Å²	69.2	79%	0.79	37%	0.369	S	S	*	.	S	Bend	trans	-73.6	-20.9	177.8	59.3	0	0	0	0	113.9
359	H	84.3	Confident	81	Confident	123 Å²	123	69.1 Å²	69.1	57%	0.569	37%	0.368	S	S	*	.	S	Bend	trans	-148.8	157.2	-179.9	56.9	-76	0	0	0	110.4	L357	L357-H359 VanDerWaalsContact C-N 3.3Å; L357-H359 PolarHBondContact O-N 3.38Å
360	Y	85.9	Confident	80.7	Confident	63 Å²	63	72.4 Å²	72.4	25%	0.247	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-65.4	137.6	170	-68.6	-81.5	0	0	0	109.7	I311 P337 L339 L350	I311-Y360 HydrophobicContact CD1-CD1 3.61Å; I311-Y360 HydrophobicContact CD1-CD2 4Å; I311-Y360 HydrophobicContact CD1-CE1 4.27Å; I311-Y360 HydrophobicContact CD1-CG 3.5Å; I311-Y360 VanDerWaalsContact CD1-CG 3.5Å; I311-Y360 HydrophobicContact CG1-CD1 3.82Å; I311-Y360 HydrophobicContact CG1-CE1 4.26Å; I311-Y360 HydrophobicContact CG1-CG 4.24Å; I311-Y360 HydrophobicContact CG2-CD1 4.07Å; I311-Y360 HydrophobicContact CG2-CE1 3.63Å; P337-Y360 VanDerWaalsContact CB-OH 3.25Å; P337-Y360 WeakPolarHBondContact CB-OH 3.29Å; P337-Y360 WeakPolarHBondContact CG-OH 3.35Å; P337-Y360 PolarHBondContact O-OH 3.17Å; L339-Y360 HydrophobicContact CB-CD1 4.17Å; L339-Y360 HydrophobicContact CB-CE1 4.03Å; L339-Y360 HydrophobicContact CD1-CD1 4.28Å; L350-Y360 HydrophobicContact CD1-CD1 4.15Å; L350-Y360 HydrophobicContact CD1-CD2 3.8Å; L350-Y360 HydrophobicContact CD1-CE1 3.9Å; L350-Y360 HydrophobicContact CD1-CE2 3.52Å; L350-Y360 HydrophobicContact CD1-CG 4.07Å; L350-Y360 HydrophobicContact CD2-CD1 3.69Å; L350-Y360 HydrophobicContact CD2-CE1 3.71Å; L350-Y360 HydrophobicContact CD2-CG 4.19Å; L350-Y360 HydrophobicContact CG-CD1 4.11Å; L350-Y360 HydrophobicContact CG-CE1 3.68Å; L350-Y360 HydrophobicContact CG-CE2 4.21Å
361	P	80.9	Confident	80.3	Confident	31 Å²	31	74.9 Å²	74.9	20%	0.201	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-51.7	144.7	173.5	-26.7	34.3	0	0	0	111.8	L339 L357 R363 W367	L339-P361 HydrophobicContact CD2-CG 4.1Å; L357-P361 HydrophobicContact CD1-CG 4.22Å; P361-R363 PolarHBondContact O-N 3.5Å; P361-W367 HydrophobicContact CB-CB 4.36Å; P361-W367 HydrophobicContact CG-CB 4.06Å; P361-W367 HydrophobicContact CG-CG 3.85Å
362	P	70.9	Confident	79.8	Confident	71 Å²	71	70.6 Å²	70.6	46%	0.461	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-52.3	131.7	177.5	-26.9	35.1	0	0	0	111.3	S364 D365	P362-S364 PolarHBondContact O-N 3.15Å; P362-D365 PolarHBondContact O-N 2.92Å
363	R	63.8	Low	79.1	Confident	184 Å²	184	74.3 Å²	74.3	69%	0.694	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-6.5	-177.8	-64.6	-172.7	-179.3	122.7	-4.2	114.5	N308 P361	N308-R363 PolarHBondContact ND2-O 3.46Å; P361-R363 PolarHBondContact O-N 3.5Å
364	S	56.8	Low	78.3	Confident	98 Å²	98	74.6 Å²	74.6	69%	0.685	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-33.4	168.2	49.9	0	0	0	0	112.6	P362	P362-S364 PolarHBondContact O-N 3.15Å
365	D	64.4	Low	77.8	Confident	89 Å²	89	70 Å²	70	48%	0.476	38%	0.38	S	S	.	.	S	Bend	trans	-103.2	146.9	-171.8	-59.5	-19.2	0	0	0	110	P362	P362-D365 PolarHBondContact O-N 2.92Å
366	R	72.8	Confident	77.2	Confident	48 Å²	48	69.1 Å²	69.1	18%	0.181	37%	0.372	C	S	.	.			trans	-88.9	137.8	176.4	-67.7	-161.7	-171.4	120.5	-1	110.5	K301 R306 D342 Y343	K301-R366 VanDerWaalsContact CB-NH1 3.28Å; K301-R366 PolarHBondContact O-NH1 3.3Å; K301-R366 PolarHBondContact O-NH2 3.03Å; R306-R366 VanDerWaalsContact CG-NH2 3.33Å; D342-R366 HydrophobicContact CB-CB 4.26Å; D342-R366 VanDerWaalsContact OD2-CA 3.25Å; D342-R366 WeakPolarHBondContact OD2-CA 3.37Å; D342-R366 WeakPolarHBondContact OD2-CB 3.08Å; Y343-R366 HydrophobicContact CE2-CB 3.93Å
367	W	82.5	Confident	76.2	Confident	38 Å²	38	67 Å²	67	14%	0.144	36%	0.358	C	S	.	.			trans	-104	126.1	-179.5	-176.4	77	0	0	0	112	L339 C341 D342 F348 L353 P361 C369	L339-W367 HydrophobicContact CD1-CD2 4.43Å; L339-W367 HydrophobicContact CD1-CE3 4.13Å; L339-W367 HydrophobicContact CD2-CD2 3.58Å; L339-W367 HydrophobicContact CD2-CE3 3.72Å; L339-W367 HydrophobicContact CD2-CG 4.1Å; L339-W367 HydrophobicContact CD2-CH2 4.12Å; L339-W367 HydrophobicContact CD2-CZ2 4.01Å; L339-W367 HydrophobicContact CD2-CZ3 3.98Å; L339-W367 HydrophobicContact CG-CD2 3.95Å; L339-W367 HydrophobicContact CG-CE3 3.56Å; L339-W367 HydrophobicContact CG-CH2 4.33Å; L339-W367 HydrophobicContact CG-CZ3 3.77Å; C341-W367 HydrophobicContact CB-CE3 4.41Å; C341-W367 HydrophobicContact CB-CZ3 4.13Å; D342-W367 PolarHBondContact N-O 2.97Å; D342-W367 PolarHBondContact OD2-N 3.05Å; F348-W367 HydrophobicContact CB-CH2 4.29Å; F348-W367 AromaticContact CD2-CH2 3.66Å; F348-W367 HydrophobicContact CD2-CH2 3.66Å; F348-W367 HydrophobicContact CD2-CZ3 4.05Å; F348-W367 HydrophobicContact CE2-CH2 4.22Å; F348-W367 HydrophobicContact CG-CH2 4.1Å; L353-W367 HydrophobicContact CD1-CH2 4.15Å; L353-W367 HydrophobicContact CD1-CZ2 3.6Å; L353-W367 HydrophobicContact CD2-CH2 3.81Å; L353-W367 HydrophobicContact CD2-CZ2 3.64Å; L353-W367 HydrophobicContact CG-CZ2 4.3Å; P361-W367 HydrophobicContact CB-CB 4.36Å; P361-W367 HydrophobicContact CG-CB 4.06Å; P361-W367 HydrophobicContact CG-CG 3.85Å; W367-C369 HydrophobicContact CE3-CB 4.44Å; W367-C369 HydrophobicContact CH2-CB 3.37Å; W367-C369 HydrophobicContact CZ2-CB 4.05Å; W367-C369 HydrophobicContact CZ3-CB 3.6Å
368	M	84.2	Confident	75.2	Confident	33 Å²	33	66.9 Å²	66.9	16%	0.163	36%	0.356	C	S	.	.			trans	-110.3	112.4	179.1	-174.2	173.3	69.8	0	0	109.7	Y343 H372 E374 H375	Y343-M368 HydrophobicContact CD2-CB 3.68Å; Y343-M368 HydrophobicContact CD2-CG 3.93Å; Y343-M368 HydrophobicContact CE2-CB 3.83Å; Y343-M368 HydrophobicContact CE2-CG 4.43Å; Y343-M368 HydrophobicContact CG-CB 4.46Å; Y343-M368 HydrophobicContact CG-CG 4.23Å; M368-H372 HydrophobicContact CE-CB 4.32Å; M368-H372 HydrophobicContact CG-CB 3.66Å; M368-H372 VanDerWaalsContact CG-CG 3.49Å; M368-H372 HydrophobicContact SD-CB 3.73Å; M368-E374 HydrophobicContact CE-CB 3.5Å; M368-E374 HydrophobicContact CE-CG 4.28Å; M368-E374 HydrophobicContact SD-CB 3.86Å; M368-E374 HydrophobicContact SD-CG 4Å; M368-H375 PolarHBondContact O-NE2 3.19Å
369	C	87.3	Confident	74.2	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.356	C	S	.	.			trans	-63.3	156.6	-177.8	72	0	0	0	0	112.8	C341 F348 W367 N371 H372 H375	C341-C369 HydrophobicContact CB-CB 3.83Å; C341-C369 PolarHBondContact SG-N 2.89Å; F348-C369 HydrophobicContact CD2-CB 3.99Å; F348-C369 HydrophobicContact CE2-CB 3.34Å; F348-C369 HydrophobicContact CZ-CB 3.9Å; W367-C369 HydrophobicContact CE3-CB 4.44Å; W367-C369 HydrophobicContact CH2-CB 3.37Å; W367-C369 HydrophobicContact CZ2-CB 4.05Å; W367-C369 HydrophobicContact CZ3-CB 3.6Å; C369-N371 PolarHBondContact O-N 3.28Å; C369-H372 PolarHBondContact O-CD2 3.05Å; C369-H372 PolarHBondContact O-N 2.69Å; C369-H372 VanDerWaalsContact SG-CD2 3.58Å; C369-H375 PolarHBondContact O-CD2 3.34Å; C369-H375 VanDerWaalsContact O-CD2 3.29Å; C369-H375 PolarHBondContact O-NE2 2.69Å
370	P	84.7	Confident	73.2	Confident	70 Å²	70	72.9 Å²	72.9	46%	0.455	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-15.4	-176.1	22.5	-35.1	0	0	0	115.5	F348 L353 H372	F348-P370 HydrophobicContact CE1-CG 4.43Å; L353-P370 HydrophobicContact CD2-CG 4.25Å; P370-H372 PolarHBondContact O-N 3.48Å
371	N	82.8	Confident	72.2	Confident	75 Å²	75	73.2 Å²	73.2	40%	0.401	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-2.6	179.2	-56.1	3.1	0	0	0	114.5	Y327 C369	Y327-N371 VanDerWaalsContact CD1-ND2 3.29Å; Y327-N371 WeakPolarHBondContact CD1-ND2 3.42Å; Y327-N371 WeakPolarHBondContact CE1-ND2 3.36Å; Y327-N371 WeakPolarHBondContact CE2-ND2 3.28Å; C369-N371 PolarHBondContact O-N 3.28Å
372	H	77.5	Confident	71.4	Confident	25 Å²	25	73.1 Å²	73.1	12%	0.116	37%	0.365	C	S	.	.	S	Bend	trans	-83.3	133.4	-177.5	-86.2	-85.8	0	0	0	112.5	C341 Y343 C344 M368 C369 P370 E374 H375	C341-H372 PolarHBondContact SG-NE2 2.7Å; Y343-H372 WeakPolarHBondContact CB-CE1 3.25Å; Y343-H372 WeakPolarHBondContact CB-NE2 3.43Å; C344-H372 WeakPolarHBondContact CB-NE2 3.18Å; C344-H372 PolarHBondContact SG-NE2 3.46Å; C344-H372 VanDerWaalsContact SG-NE2 3.45Å; M368-H372 HydrophobicContact CE-CB 4.32Å; M368-H372 HydrophobicContact CG-CB 3.66Å; M368-H372 VanDerWaalsContact CG-CG 3.49Å; M368-H372 HydrophobicContact SD-CB 3.73Å; C369-H372 PolarHBondContact O-CD2 3.05Å; C369-H372 PolarHBondContact O-N 2.69Å; C369-H372 VanDerWaalsContact SG-CD2 3.58Å; P370-H372 PolarHBondContact O-N 3.48Å; H372-E374 HydrophobicContact CB-CB 4.48Å; H372-E374 WeakPolarHBondContact CB-OE2 3.27Å; H372-E374 IonicContact CG-OE2 2.96Å; H372-E374 IonicContact ND1-OE1 3.79Å; H372-E374 IonicContact ND1-OE2 3.54Å; H372-E374 PolarHBondContact ND1-OE2 3.36Å; H372-E374 PolarHBondContact O-N 3.27Å; H372-E374 VanDerWaalsContact O-N 3.09Å; H372-H375 WeakPolarHBondContact O-CB 3.48Å; H372-H375 PolarHBondContact O-N 3.48Å
373	T	73.1	Confident	71.1	Confident	99 Å²	99	76.5 Å²	76.5	61%	0.607	37%	0.369	S	S	*	.	H	α-helix	trans	-56.1	-24.4	177.2	42.3	0	0	0	0	113.9	H375 T376 T377	T373-H375 VanDerWaalsContact C-N 3.33Å; T373-H375 PolarHBondContact O-N 2.86Å; T373-T376 WeakPolarHBondContact O-CB 3.28Å; T373-T376 PolarHBondContact O-N 2.88Å; T373-T377 WeakPolarHBondContact O-CB 3.25Å; T373-T377 PolarHBondContact O-N 3.21Å; T373-T377 PolarHBondContact O-OG1 3.37Å
374	E	71.7	Confident	71	Confident	24 Å²	24	69.1 Å²	69.1	11%	0.112	35%	0.345	C	S	.	.	H	α-helix	trans	-57.5	-44.8	175.6	-64.8	86.3	140.1	0	0	110.6	M368 H372 T376 T377 E378 W394	M368-E374 HydrophobicContact CE-CB 3.5Å; M368-E374 HydrophobicContact CE-CG 4.28Å; M368-E374 HydrophobicContact SD-CB 3.86Å; M368-E374 HydrophobicContact SD-CG 4Å; H372-E374 HydrophobicContact CB-CB 4.48Å; H372-E374 WeakPolarHBondContact CB-OE2 3.27Å; H372-E374 IonicContact CG-OE2 2.96Å; H372-E374 IonicContact ND1-OE1 3.79Å; H372-E374 IonicContact ND1-OE2 3.54Å; H372-E374 PolarHBondContact ND1-OE2 3.36Å; H372-E374 PolarHBondContact O-N 3.27Å; H372-E374 VanDerWaalsContact O-N 3.09Å; E374-T376 VanDerWaalsContact C-N 3.33Å; E374-T376 PolarHBondContact O-N 2.78Å; E374-T377 PolarHBondContact O-N 2.86Å; E374-E378 WeakPolarHBondContact O-CG 3.25Å; E374-E378 PolarHBondContact O-N 3.21Å; E374-W394 HydrophobicContact CB-CH2 4.45Å; E374-W394 HydrophobicContact CB-CZ2 4.19Å; E374-W394 HydrophobicContact CG-CH2 3.92Å; E374-W394 HydrophobicContact CG-CZ2 4.02Å
375	H	70.8	Confident	71.5	Confident	63 Å²	63	72.5 Å²	72.5	29%	0.292	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-35.9	175.6	-66.5	-65.2	0	0	0	112.5	M368 C369 H372 T373 R379	M368-H375 PolarHBondContact O-NE2 3.19Å; C369-H375 PolarHBondContact O-CD2 3.34Å; C369-H375 VanDerWaalsContact O-CD2 3.29Å; C369-H375 PolarHBondContact O-NE2 2.69Å; H372-H375 WeakPolarHBondContact O-CB 3.48Å; H372-H375 PolarHBondContact O-N 3.48Å; T373-H375 VanDerWaalsContact C-N 3.33Å; T373-H375 PolarHBondContact O-N 2.86Å; H375-R379 WeakPolarHBondContact O-CB 3.5Å; H375-R379 WeakPolarHBondContact O-CG 3.27Å; H375-R379 PolarHBondContact O-N 2.93Å; H375-R379 VanDerWaalsContact O-N 3.16Å
376	T	68	Low	71.5	Confident	76 Å²	76	75.9 Å²	75.9	47%	0.466	36%	0.36	S	S	.	.	H	α-helix	trans	-69	-47	175.5	-46.4	0	0	0	0	111	T373 E374 E378 R379 Y380	T373-T376 WeakPolarHBondContact O-CB 3.28Å; T373-T376 PolarHBondContact O-N 2.88Å; E374-T376 VanDerWaalsContact C-N 3.33Å; E374-T376 PolarHBondContact O-N 2.78Å; T376-E378 VanDerWaalsContact C-N 3.32Å; T376-E378 PolarHBondContact O-N 3.38Å; T376-R379 PolarHBondContact O-N 3.4Å; T376-Y380 HydrophobicContact CG2-CD2 3.72Å; T376-Y380 HydrophobicContact CG2-CE2 3.9Å; T376-Y380 VanDerWaalsContact O-CD2 3.26Å; T376-Y380 WeakPolarHBondContact O-CD2 3.08Å; T376-Y380 PolarHBondContact O-N 2.96Å; T376-Y380 VanDerWaalsContact O-N 3.12Å
377	T	65.3	Low	71.2	Confident	23 Å²	23	77.6 Å²	77.6	14%	0.141	37%	0.372	C	S	.	.	H	α-helix	trans	-57.7	-46.7	179.7	-57.3	0	0	0	0	110.3	T373 E374 L381 I393 W394 L397	T373-T377 WeakPolarHBondContact O-CB 3.25Å; T373-T377 PolarHBondContact O-N 3.21Å; T373-T377 PolarHBondContact O-OG1 3.37Å; E374-T377 PolarHBondContact O-N 2.86Å; T377-L381 HydrophobicContact CG2-CD1 4.01Å; T377-L381 VanDerWaalsContact O-CB 3.32Å; T377-L381 WeakPolarHBondContact O-CB 3.42Å; T377-L381 PolarHBondContact O-N 2.88Å; T377-I393 HydrophobicContact CG2-CG2 4.48Å; T377-W394 HydrophobicContact CG2-CH2 4.18Å; T377-W394 HydrophobicContact CG2-CZ2 3.9Å; T377-L397 HydrophobicContact CG2-CD1 3.47Å; T377-L397 VanDerWaalsContact CG2-CD1 3.47Å
378	E	65.7	Low	70.6	Confident	59 Å²	59	80.1 Å²	80.1	28%	0.276	39%	0.392	S	S	.	.	H	α-helix	trans	-70.2	-37.5	-179.8	-68.4	-175.6	170.6	0	0	113.2	E374 T376 A382 R390	E374-E378 WeakPolarHBondContact O-CG 3.25Å; E374-E378 PolarHBondContact O-N 3.21Å; T376-E378 VanDerWaalsContact C-N 3.32Å; T376-E378 PolarHBondContact O-N 3.38Å; E378-A382 WeakPolarHBondContact O-CB 3.46Å; E378-R390 IonicContact OE1-CZ 2.6Å; E378-R390 IonicContact OE1-NE 3.49Å; E378-R390 IonicContact OE1-NH2 3.84Å; E378-R390 PolarHBondContact OE1-NH2 3.11Å; E378-R390 IonicContact OE2-CZ 3.32Å; E378-R390 IonicContact OE2-NH2 2.66Å; E378-R390 PolarHBondContact OE2-NH2 2.91Å
379	R	65	Low	69.8	Low	210 Å²	210	80.3 Å²	80.3	79%	0.792	39%	0.393	S	S	*	.	H	α-helix	trans	-66.9	-35.6	177	-83.1	-178.3	174	174.1	-0.9	114.5	H375 T376	H375-R379 WeakPolarHBondContact O-CB 3.5Å; H375-R379 WeakPolarHBondContact O-CG 3.27Å; H375-R379 PolarHBondContact O-N 2.93Å; H375-R379 VanDerWaalsContact O-N 3.16Å; T376-R379 PolarHBondContact O-N 3.4Å
380	Y	62.6	Low	69	Low	152 Å²	152	84.3 Å²	84.3	60%	0.596	41%	0.408	S	S	*	.	H	α-helix	trans	-105.1	-24	-170.9	-68.5	-68.4	0	0	0	114.9	T376	T376-Y380 HydrophobicContact CG2-CD2 3.72Å; T376-Y380 HydrophobicContact CG2-CE2 3.9Å; T376-Y380 VanDerWaalsContact O-CD2 3.26Å; T376-Y380 WeakPolarHBondContact O-CD2 3.08Å; T376-Y380 PolarHBondContact O-N 2.96Å; T376-Y380 VanDerWaalsContact O-N 3.12Å
381	L	65	Low	68	Low	69 Å²	69	82.7 Å²	82.7	36%	0.361	40%	0.395	S	S	.	.	H	α-helix	trans	-107	-28.4	-175.1	-61.2	172.7	0	0	0	113.8	T377 R383 I393 L397	T377-L381 HydrophobicContact CG2-CD1 4.01Å; T377-L381 VanDerWaalsContact O-CB 3.32Å; T377-L381 WeakPolarHBondContact O-CB 3.42Å; T377-L381 PolarHBondContact O-N 2.88Å; L381-R383 PolarHBondContact O-N 3.32Å; L381-I393 HydrophobicContact CB-CD1 4.31Å; L381-I393 HydrophobicContact CB-CG2 3.85Å; L381-I393 HydrophobicContact CD1-CG2 4.09Å; L381-I393 WeakPolarHBondContact O-CD1 3.46Å; L381-L397 HydrophobicContact CD1-CD1 4.08Å
382	A	65	Low	67.5	Low	30 Å²	30	85.5 Å²	85.5	25%	0.248	41%	0.405	C	S	.	.			trans	-82.8	115	177.3	0	0	0	0	0	110.6	E378 R390 I393	E378-A382 WeakPolarHBondContact O-CB 3.46Å; A382-R390 HydrophobicContact CB-CG 4.11Å; A382-I393 HydrophobicContact CB-CD1 4.14Å
383	R	63.2	Low	67	Low	141 Å²	141	85.9 Å²	85.9	53%	0.532	41%	0.408	S	S	.	.			trans	-88.7	-18.9	178.1	-57.1	-178.9	176.9	174.7	0.6	112.6	L381 E389 I421	L381-R383 PolarHBondContact O-N 3.32Å; R383-E389 WeakPolarHBondContact CA-OE1 3.36Å; R383-E389 VanDerWaalsContact CB-OE1 3.29Å; R383-E389 WeakPolarHBondContact CB-OE1 3.18Å; R383-E389 PolarHBondContact N-OE1 3.28Å; R383-I421 PolarHBondContact NH2-O 2.79Å
384	S	62.2	Low	66.7	Low	30 Å²	30	82.4 Å²	82.4	21%	0.21	38%	0.383	C	S	.	.	S	Bend	trans	-138.9	163.2	171.8	81.1	0	0	0	0	112.9	R386 E389	S384-R386 PolarHBondContact O-N 3.23Å; S384-R386 VanDerWaalsContact O-N 3.07Å; S384-R386 WeakPolarHBondContact OG-CB 3.38Å; S384-R386 WeakPolarHBondContact OG-CG 3.49Å; S384-R386 PolarHBondContact OG-N 2.92Å; S384-R386 PolarHBondContact OG-NH1 2.81Å; S384-E389 WeakPolarHBondContact CA-OE2 3.34Å; S384-E389 VanDerWaalsContact CB-OE2 3.25Å; S384-E389 WeakPolarHBondContact CB-OE2 3.44Å; S384-E389 PolarHBondContact N-OE1 3.17Å; S384-E389 PolarHBondContact N-OE2 3.36Å; S384-E389 PolarHBondContact OG-OE2 3Å
385	I	67.5	Low	66.4	Low	168 Å²	168	84.6 Å²	84.6	86%	0.862	40%	0.399	S	S	*	.	S	Bend	trans	-66.1	-2.6	175.4	61.3	171.5	0	0	0	113.9	L387	I385-L387 PolarHBondContact O-N 3.02Å
386	R	65.6	Low	66.3	Low	161 Å²	161	85.8 Å²	85.8	61%	0.608	40%	0.403	S	S	*	.			trans	-64.9	124.2	-174.4	-70.5	-178.6	177.5	89.5	-2.2	111	S384 T388 E389 R390	S384-R386 PolarHBondContact O-N 3.23Å; S384-R386 VanDerWaalsContact O-N 3.07Å; S384-R386 WeakPolarHBondContact OG-CB 3.38Å; S384-R386 WeakPolarHBondContact OG-CG 3.49Å; S384-R386 PolarHBondContact OG-N 2.92Å; S384-R386 PolarHBondContact OG-NH1 2.81Å; R386-T388 PolarHBondContact O-N 3.48Å; R386-E389 HydrophobicContact CB-CB 4.12Å; R386-E389 PolarHBondContact O-N 2.93Å; R386-E389 VanDerWaalsContact O-N 3.12Å; R386-R390 PolarHBondContact O-N 3.24Å; R386-R390 VanDerWaalsContact O-N 3.09Å
387	L	65.2	Low	66.1	Low	84 Å²	84	83.8 Å²	83.8	44%	0.44	39%	0.389	S	S	.	.	H	α-helix	trans	-57	-38.7	174.2	-179.3	60.9	0	0	0	111.7	P292 L296 I385 E389 R390 M391	P292-L387 HydrophobicContact CG-CD2 3.95Å; L296-L387 HydrophobicContact CD1-CD1 4.05Å; I385-L387 PolarHBondContact O-N 3.02Å; L387-E389 VanDerWaalsContact C-N 3.35Å; L387-E389 PolarHBondContact O-N 2.96Å; L387-R390 PolarHBondContact O-N 3.06Å; L387-M391 HydrophobicContact CD1-CG 4.26Å; L387-M391 HydrophobicContact CG-CG 4.36Å; L387-M391 HydrophobicContact CG-SD 4.46Å; L387-M391 VanDerWaalsContact O-CB 3.3Å; L387-M391 WeakPolarHBondContact O-CB 3.3Å; L387-M391 VanDerWaalsContact O-CG 3.26Å; L387-M391 WeakPolarHBondContact O-CG 3.5Å; L387-M391 PolarHBondContact O-N 3.4Å
388	T	70.6	Confident	65.9	Low	91 Å²	91	88.9 Å²	88.9	56%	0.558	41%	0.407	S	S	*	.	H	α-helix	trans	-59.9	-41	176.3	44.5	0	0	0	0	112.8	R386 M391 Q392	R386-T388 PolarHBondContact O-N 3.48Å; T388-M391 PolarHBondContact O-N 2.92Å; T388-Q392 WeakPolarHBondContact O-CB 3.43Å; T388-Q392 VanDerWaalsContact O-CG 3.25Å; T388-Q392 WeakPolarHBondContact O-CG 3.25Å; T388-Q392 PolarHBondContact O-N 2.74Å
389	E	67.7	Low	65.4	Low	37 Å²	37	88.4 Å²	88.4	17%	0.173	41%	0.41	C	S	.	.	H	α-helix	trans	-68.7	-47.9	176.9	-169.9	-170.6	156.9	0	0	111	R383 S384 R386 L387 M391 Q392 I393	R383-E389 WeakPolarHBondContact CA-OE1 3.36Å; R383-E389 VanDerWaalsContact CB-OE1 3.29Å; R383-E389 WeakPolarHBondContact CB-OE1 3.18Å; R383-E389 PolarHBondContact N-OE1 3.28Å; S384-E389 WeakPolarHBondContact CA-OE2 3.34Å; S384-E389 VanDerWaalsContact CB-OE2 3.25Å; S384-E389 WeakPolarHBondContact CB-OE2 3.44Å; S384-E389 PolarHBondContact N-OE1 3.17Å; S384-E389 PolarHBondContact N-OE2 3.36Å; S384-E389 PolarHBondContact OG-OE2 3Å; R386-E389 HydrophobicContact CB-CB 4.12Å; R386-E389 PolarHBondContact O-N 2.93Å; R386-E389 VanDerWaalsContact O-N 3.12Å; L387-E389 VanDerWaalsContact C-N 3.35Å; L387-E389 PolarHBondContact O-N 2.96Å; E389-M391 PolarHBondContact O-N 2.61Å; E389-Q392 PolarHBondContact O-N 3.01Å; E389-Q392 VanDerWaalsContact O-N 3.11Å; E389-I393 HydrophobicContact CG-CD1 3.99Å; E389-I393 WeakPolarHBondContact O-CD1 3.34Å; E389-I393 VanDerWaalsContact O-CG1 3.31Å; E389-I393 WeakPolarHBondContact O-CG1 3.44Å; E389-I393 PolarHBondContact O-N 2.91Å
390	R	69.3	Low	64.7	Low	84 Å²	84	81.6 Å²	81.6	32%	0.317	39%	0.389	S	S	.	.	H	α-helix	trans	-55.8	-42.4	174.1	-72	172.8	70.7	168.9	0.4	111.1	E378 A382 R386 L387 W394	E378-R390 IonicContact OE1-CZ 2.6Å; E378-R390 IonicContact OE1-NE 3.49Å; E378-R390 IonicContact OE1-NH2 3.84Å; E378-R390 PolarHBondContact OE1-NH2 3.11Å; E378-R390 IonicContact OE2-CZ 3.32Å; E378-R390 IonicContact OE2-NH2 2.66Å; E378-R390 PolarHBondContact OE2-NH2 2.91Å; A382-R390 HydrophobicContact CB-CG 4.11Å; R386-R390 PolarHBondContact O-N 3.24Å; R386-R390 VanDerWaalsContact O-N 3.09Å; L387-R390 PolarHBondContact O-N 3.06Å; R390-W394 WeakPolarHBondContact O-CB 3.23Å; R390-W394 PolarHBondContact O-N 3.37Å
391	M	65	Low	63.9	Low	36 Å²	36	77.2 Å²	77.2	18%	0.177	38%	0.38	C	S	.	.	H	α-helix	trans	-66	-41.6	175.2	-78.8	-164.5	78.2	0	0	113.5	P292 V294 L296 L387 T388 E389 W394 T395	P292-M391 HydrophobicContact CB-CE 3.44Å; P292-M391 VanDerWaalsContact CB-CE 3.44Å; P292-M391 HydrophobicContact CB-SD 3.41Å; P292-M391 WeakPolarHBondContact CB-SD 3.39Å; P292-M391 HydrophobicContact CG-CE 4.31Å; P292-M391 HydrophobicContact CG-SD 3.59Å; P292-M391 VanDerWaalsContact CG-SD 3.59Å; V294-M391 HydrophobicContact CB-CE 3.97Å; V294-M391 HydrophobicContact CG2-CE 4.48Å; L296-M391 HydrophobicContact CD2-CG 4.09Å; L387-M391 HydrophobicContact CD1-CG 4.26Å; L387-M391 HydrophobicContact CG-CG 4.36Å; L387-M391 HydrophobicContact CG-SD 4.46Å; L387-M391 VanDerWaalsContact O-CB 3.3Å; L387-M391 WeakPolarHBondContact O-CB 3.3Å; L387-M391 VanDerWaalsContact O-CG 3.26Å; L387-M391 WeakPolarHBondContact O-CG 3.5Å; L387-M391 PolarHBondContact O-N 3.4Å; T388-M391 PolarHBondContact O-N 2.92Å; E389-M391 PolarHBondContact O-N 2.61Å; M391-W394 PolarHBondContact O-N 2.94Å; M391-T395 WeakPolarHBondContact O-CB 3.32Å; M391-T395 PolarHBondContact O-N 3.29Å; M391-T395 PolarHBondContact O-OG1 3.2Å
392	Q	71	Confident	63	Low	134 Å²	134	78.8 Å²	78.8	63%	0.626	39%	0.389	S	S	*	.	H	α-helix	trans	-63.2	-44.8	175.7	-77.6	168.2	-15.1	0	0	111.1	T388 E389 T395 K396	T388-Q392 WeakPolarHBondContact O-CB 3.43Å; T388-Q392 VanDerWaalsContact O-CG 3.25Å; T388-Q392 WeakPolarHBondContact O-CG 3.25Å; T388-Q392 PolarHBondContact O-N 2.74Å; E389-Q392 PolarHBondContact O-N 3.01Å; E389-Q392 VanDerWaalsContact O-N 3.11Å; Q392-T395 PolarHBondContact O-N 2.7Å; Q392-K396 VanDerWaalsContact O-CB 3.28Å; Q392-K396 WeakPolarHBondContact O-CB 3.41Å; Q392-K396 PolarHBondContact O-N 3.16Å
393	I	68	Low	61.8	Low	32 Å²	32	84 Å²	84	16%	0.164	41%	0.409	C	S	.	.	H	α-helix	trans	-58.9	-54.6	174.7	-66.2	158.1	0	0	0	109.9	T377 L381 A382 E389 T395 K396 L397	T377-I393 HydrophobicContact CG2-CG2 4.48Å; L381-I393 HydrophobicContact CB-CD1 4.31Å; L381-I393 HydrophobicContact CB-CG2 3.85Å; L381-I393 HydrophobicContact CD1-CG2 4.09Å; L381-I393 WeakPolarHBondContact O-CD1 3.46Å; A382-I393 HydrophobicContact CB-CD1 4.14Å; E389-I393 HydrophobicContact CG-CD1 3.99Å; E389-I393 WeakPolarHBondContact O-CD1 3.34Å; E389-I393 VanDerWaalsContact O-CG1 3.31Å; E389-I393 WeakPolarHBondContact O-CG1 3.44Å; E389-I393 PolarHBondContact O-N 2.91Å; I393-T395 VanDerWaalsContact C-N 3.34Å; I393-T395 PolarHBondContact O-N 2.82Å; I393-K396 PolarHBondContact O-N 3.03Å; I393-L397 HydrophobicContact CG2-CD1 3.91Å; I393-L397 HydrophobicContact CG2-CG 4.38Å; I393-L397 WeakPolarHBondContact O-CB 3.1Å; I393-L397 VanDerWaalsContact O-CG 3.26Å; I393-L397 WeakPolarHBondContact O-CG 3.43Å; I393-L397 PolarHBondContact O-N 3.06Å
394	W	65.3	Low	60.6	Low	27 Å²	27	81 Å²	81	10%	0.102	40%	0.403	C	S	.	.	H	α-helix	trans	-62	-39.8	180	-84.5	111.4	0	0	0	112.5	L296 P297 E374 T377 R390 M391 L397 Y398	L296-W394 HydrophobicContact CD2-CB 3.66Å; L296-W394 HydrophobicContact CD2-CG 3.73Å; P297-W394 HydrophobicContact CB-CE3 4.16Å; P297-W394 HydrophobicContact CB-CH2 3.95Å; P297-W394 HydrophobicContact CB-CZ2 4.48Å; P297-W394 HydrophobicContact CB-CZ3 3.77Å; P297-W394 HydrophobicContact CG-CD2 4.27Å; P297-W394 HydrophobicContact CG-CE3 3.6Å; P297-W394 HydrophobicContact CG-CH2 4.29Å; P297-W394 HydrophobicContact CG-CZ3 3.62Å; E374-W394 HydrophobicContact CB-CH2 4.45Å; E374-W394 HydrophobicContact CB-CZ2 4.19Å; E374-W394 HydrophobicContact CG-CH2 3.92Å; E374-W394 HydrophobicContact CG-CZ2 4.02Å; T377-W394 HydrophobicContact CG2-CH2 4.18Å; T377-W394 HydrophobicContact CG2-CZ2 3.9Å; R390-W394 WeakPolarHBondContact O-CB 3.23Å; R390-W394 PolarHBondContact O-N 3.37Å; M391-W394 PolarHBondContact O-N 2.94Å; W394-L397 HydrophobicContact CE3-CD1 4.36Å; W394-L397 PolarHBondContact O-N 3.36Å; W394-Y398 VanDerWaalsContact O-CB 3.28Å; W394-Y398 WeakPolarHBondContact O-CB 3.37Å; W394-Y398 PolarHBondContact O-N 3.19Å
395	T	66.9	Low	59.4	Low	70 Å²	70	86.3 Å²	86.3	43%	0.429	43%	0.429	S	S	.	.	H	α-helix	trans	-63.8	-44	175.9	-56.3	0	0	0	0	110.8	M391 Q392 I393 L397 Y398 S399	M391-T395 WeakPolarHBondContact O-CB 3.32Å; M391-T395 PolarHBondContact O-N 3.29Å; M391-T395 PolarHBondContact O-OG1 3.2Å; Q392-T395 PolarHBondContact O-N 2.7Å; I393-T395 VanDerWaalsContact C-N 3.34Å; I393-T395 PolarHBondContact O-N 2.82Å; T395-L397 VanDerWaalsContact C-N 3.33Å; T395-L397 PolarHBondContact O-N 2.96Å; T395-Y398 PolarHBondContact O-N 2.83Å; T395-S399 PolarHBondContact O-N 3Å; T395-S399 PolarHBondContact O-OG 3.46Å
396	K	68.3	Low	57.8	Low	87 Å²	87	88.2 Å²	88.2	38%	0.378	43%	0.427	S	S	.	.	H	α-helix	trans	-65	-35.6	175.7	-167.3	161.6	-172.3	161.4	0	111.8	Q392 I393 S399 L400	Q392-K396 VanDerWaalsContact O-CB 3.28Å; Q392-K396 WeakPolarHBondContact O-CB 3.41Å; Q392-K396 PolarHBondContact O-N 3.16Å; I393-K396 PolarHBondContact O-N 3.03Å; K396-S399 PolarHBondContact O-OG 3.34Å; K396-L400 HydrophobicContact CG-CD1 4.28Å; K396-L400 VanDerWaalsContact O-CB 3.25Å; K396-L400 WeakPolarHBondContact O-CB 3.38Å; K396-L400 WeakPolarHBondContact O-CD1 3.47Å; K396-L400 WeakPolarHBondContact O-CG 3.15Å; K396-L400 PolarHBondContact O-N 2.89Å
397	L	64.4	Low	56.1	Low	35 Å²	35	85.8 Å²	85.8	18%	0.183	43%	0.433	C	S	.	.	H	α-helix	trans	-70.5	-35.8	172.8	-67.5	175.8	0	0	0	112.7	T377 L381 I393 W394 T395 S401	T377-L397 HydrophobicContact CG2-CD1 3.47Å; T377-L397 VanDerWaalsContact CG2-CD1 3.47Å; L381-L397 HydrophobicContact CD1-CD1 4.08Å; I393-L397 HydrophobicContact CG2-CD1 3.91Å; I393-L397 HydrophobicContact CG2-CG 4.38Å; I393-L397 WeakPolarHBondContact O-CB 3.1Å; I393-L397 VanDerWaalsContact O-CG 3.26Å; I393-L397 WeakPolarHBondContact O-CG 3.43Å; I393-L397 PolarHBondContact O-N 3.06Å; W394-L397 HydrophobicContact CE3-CD1 4.36Å; W394-L397 PolarHBondContact O-N 3.36Å; T395-L397 VanDerWaalsContact C-N 3.33Å; T395-L397 PolarHBondContact O-N 2.96Å; L397-S401 PolarHBondContact O-N 2.97Å; L397-S401 VanDerWaalsContact O-N 3.16Å
398	Y	60.2	Low	54.3	Low	129 Å²	129	89.3 Å²	89.3	51%	0.506	45%	0.448	S	S	.	.	H	α-helix	trans	-78.6	-40.3	-177.6	-145.5	-87.7	0	0	0	112.2	P297 W394 T395 S401 N402	P297-Y398 HydrophobicContact CG-CD2 4.17Å; P297-Y398 HydrophobicContact CG-CE2 4.15Å; W394-Y398 VanDerWaalsContact O-CB 3.28Å; W394-Y398 WeakPolarHBondContact O-CB 3.37Å; W394-Y398 PolarHBondContact O-N 3.19Å; T395-Y398 PolarHBondContact O-N 2.83Å; Y398-S401 WeakPolarHBondContact CA-OG 3.39Å; Y398-S401 WeakPolarHBondContact O-CA 3.39Å; Y398-S401 WeakPolarHBondContact O-CB 3.19Å; Y398-S401 PolarHBondContact O-N 3.47Å; Y398-S401 PolarHBondContact O-OG 2.93Å; Y398-N402 PolarHBondContact O-N 2.76Å
399	S	54.8	Low	52.4	Low	49 Å²	49	93.2 Å²	93.2	34%	0.343	46%	0.459	S	S	.	.	H	α-helix	trans	-60.1	-47.5	169.2	56.3	0	0	0	0	110	T395 K396 S401 N402 E403	T395-S399 PolarHBondContact O-N 3Å; T395-S399 PolarHBondContact O-OG 3.46Å; K396-S399 PolarHBondContact O-OG 3.34Å; S399-S401 PolarHBondContact O-N 3.49Å; S399-N402 PolarHBondContact O-N 2.88Å; S399-E403 WeakPolarHBondContact O-CB 3.24Å; S399-E403 VanDerWaalsContact O-CG 3.25Å; S399-E403 WeakPolarHBondContact O-CG 3.26Å; S399-E403 PolarHBondContact O-N 3.29Å
400	L	51.3	Low	50.9	Low	67 Å²	67	100.3 Å²	100.3	35%	0.351	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-9.8	171.3	-69.8	169.6	0	0	0	114.6	K396 N404	K396-L400 HydrophobicContact CG-CD1 4.28Å; K396-L400 VanDerWaalsContact O-CB 3.25Å; K396-L400 WeakPolarHBondContact O-CB 3.38Å; K396-L400 WeakPolarHBondContact O-CD1 3.47Å; K396-L400 WeakPolarHBondContact O-CG 3.15Å; K396-L400 PolarHBondContact O-N 2.89Å; L400-N404 PolarHBondContact O-ND2 3.28Å
401	S	45.9	Very low	49.3	Very low	60 Å²	60	99.8 Å²	99.8	42%	0.42	50%	0.502	S	S	.	.	H	α-helix	trans	-96.5	-25.5	170.5	74.4	0	0	0	0	113.9	L397 Y398 S399	L397-S401 PolarHBondContact O-N 2.97Å; L397-S401 VanDerWaalsContact O-N 3.16Å; Y398-S401 WeakPolarHBondContact CA-OG 3.39Å; Y398-S401 WeakPolarHBondContact O-CA 3.39Å; Y398-S401 WeakPolarHBondContact O-CB 3.19Å; Y398-S401 PolarHBondContact O-N 3.47Å; Y398-S401 PolarHBondContact O-OG 2.93Å; S399-S401 PolarHBondContact O-N 3.49Å
402	N	44.9	Very low	48.2	Very low	102 Å²	102	105 Å²	105	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-97.5	-34.9	-178.6	-82.5	-1.7	0	0	0	114	Y398 S399 N404 N405	Y398-N402 PolarHBondContact O-N 2.76Å; S399-N402 PolarHBondContact O-N 2.88Å; N402-N404 PolarHBondContact O-N 2.97Å; N402-N404 VanDerWaalsContact O-N 3.17Å; N402-N405 PolarHBondContact O-N 3.26Å
403	E	40.1	Very low	46.9	Very low	141 Å²	141	104.8 Å²	104.8	66%	0.659	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-60.5	-24.1	176.7	-66.5	-68.4	127.2	0	0	111.8	S399 N405 Y406	S399-E403 WeakPolarHBondContact O-CB 3.24Å; S399-E403 VanDerWaalsContact O-CG 3.25Å; S399-E403 WeakPolarHBondContact O-CG 3.26Å; S399-E403 PolarHBondContact O-N 3.29Å; E403-N405 PolarHBondContact O-N 3.33Å; E403-Y406 PolarHBondContact O-N 2.73Å
404	N	38.8	Very low	45.7	Very low	78 Å²	78	110.4 Å²	110.4	42%	0.417	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-71.3	21.6	176.8	-78.6	-57.4	0	0	0	115.1	L400 N402 N546	L400-N404 PolarHBondContact O-ND2 3.28Å; N402-N404 PolarHBondContact O-N 2.97Å; N402-N404 VanDerWaalsContact O-N 3.17Å; N404-N546 WeakPolarHBondContact CB-ND2 3.49Å; N404-N546 PolarHBondContact ND2-ND2 3.18Å; N404-N546 WeakPolarHBondContact OD1-CB 3.21Å
405	N	37.5	Very low	44.8	Very low	140 Å²	140	113.3 Å²	113.3	75%	0.749	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-134.4	1	173.2	-90.5	-70.8	0	0	0	114.6	N402 E403	N402-N405 PolarHBondContact O-N 3.26Å; E403-N405 PolarHBondContact O-N 3.33Å
406	Y	32.6	Very low	43.6	Very low	209 Å²	209	114.7 Å²	114.7	82%	0.82	58%	0.583	S	S	*	*	S	Bend	trans	-148.4	134.6	174.8	-108.2	-90.8	0	0	0	112	E403	E403-Y406 PolarHBondContact O-N 2.73Å
407	C	29.8	Very low	42.6	Very low	110 Å²	110	116.4 Å²	116.4	74%	0.743	59%	0.592	S	S	*	*			trans	69	104.9	171.7	-144.1	0	0	0	0	117.7
408	E	28	Very low	41.8	Very low	158 Å²	158	116.8 Å²	116.8	74%	0.738	59%	0.594	S	S	*	*			trans	-64.2	162.5	153.9	-62.3	171.9	123.5	0	0	110.4
409	Q	31	Very low	41.2	Very low	173 Å²	173	113.7 Å²	113.7	81%	0.808	59%	0.589	S	S	*	*			trans	71.3	78.9	167.4	-55.1	144.2	23.6	0	0	116.3
410	Q	34.6	Very low	40.9	Very low	185 Å²	185	116.8 Å²	116.8	86%	0.864	60%	0.596	S	S	*	*			trans	-142.1	155.1	151.1	-113.7	149.4	72.9	0	0	111.5
411	S	36.1	Very low	40.7	Very low	74 Å²	74	117.6 Å²	117.6	52%	0.517	60%	0.6	S	S	.	*			trans	-49.8	145	-155.3	40	0	0	0	0	118.6	D413	S411-D413 PolarHBondContact O-N 3.2Å
412	I	42.3	Very low	40.6	Very low	146 Å²	146	117.9 Å²	117.9	75%	0.749	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-20	176.8	-71.5	166.5	0	0	0	113.1	E414 V415	I412-E414 PolarHBondContact O-N 2.98Å; I412-V415 PolarHBondContact O-N 3.45Å
413	D	43.5	Very low	40.3	Very low	128 Å²	128	119.6 Å²	119.6	68%	0.684	60%	0.601	S	S	*	*	H	α-helix	trans	-71.3	-24.1	-169.6	-51.9	-54.4	0	0	0	115	S411 V415	S411-D413 PolarHBondContact O-N 3.2Å; D413-V415 VanDerWaalsContact C-N 3.28Å; D413-V415 PolarHBondContact O-N 3.43Å
414	E	43.3	Very low	40.4	Very low	150 Å²	150	119.9 Å²	119.9	70%	0.701	60%	0.602	S	S	*	*	H	α-helix	trans	-73.6	-17.9	177	-84.7	-164.2	135.7	0	0	113.6	I412 D416	I412-E414 PolarHBondContact O-N 2.98Å; E414-D416 VanDerWaalsContact C-N 3.33Å
415	V	45.7	Very low	40.3	Very low	89 Å²	89	119.6 Å²	119.6	54%	0.539	60%	0.6	S	S	.	*	H	α-helix	trans	-69.6	-35.3	-179.3	-175.1	0	0	0	0	110.6	I412 D413 E417 I418 T419	I412-V415 PolarHBondContact O-N 3.45Å; D413-V415 VanDerWaalsContact C-N 3.28Å; D413-V415 PolarHBondContact O-N 3.43Å; V415-E417 PolarHBondContact O-N 2.83Å; V415-I418 WeakPolarHBondContact O-CB 3.39Å; V415-I418 PolarHBondContact O-N 3.47Å; V415-I418 VanDerWaalsContact O-N 3.14Å; V415-T419 PolarHBondContact O-N 2.89Å; V415-T419 VanDerWaalsContact O-N 3.14Å; V415-T419 PolarHBondContact O-OG1 2.94Å; V415-T419 VanDerWaalsContact O-OG1 3.08Å
416	D	43	Very low	40	Very low	98 Å²	98	117 Å²	117	52%	0.524	59%	0.591	S	S	.	*	H	α-helix	trans	-68.5	-31	-177.3	-102.3	14	0	0	0	113.9	E414 I418 T419 K420	E414-D416 VanDerWaalsContact C-N 3.33Å; D416-I418 VanDerWaalsContact C-N 3.31Å; D416-T419 PolarHBondContact O-N 2.78Å; D416-K420 WeakPolarHBondContact O-CB 3.28Å; D416-K420 WeakPolarHBondContact O-CG 3.34Å; D416-K420 PolarHBondContact O-N 3.09Å
417	E	47.3	Very low	40.2	Very low	123 Å²	123	113 Å²	113	58%	0.575	59%	0.59	S	S	*	*	H	α-helix	trans	-65.8	-36.1	171.3	-80	-155.7	149.6	0	0	112	V415 T419 K420 I421	V415-E417 PolarHBondContact O-N 2.83Å; E417-T419 VanDerWaalsContact C-N 3.34Å; E417-K420 PolarHBondContact O-N 3.19Å; E417-I421 WeakPolarHBondContact O-CB 3.39Å; E417-I421 WeakPolarHBondContact O-CD1 3.26Å; E417-I421 VanDerWaalsContact O-CG1 3.23Å; E417-I421 WeakPolarHBondContact O-CG1 3.48Å; E417-I421 PolarHBondContact O-N 2.87Å
418	I	46.2	Very low	40.3	Very low	44 Å²	44	117.1 Å²	117.1	23%	0.226	59%	0.591	C	S	.	*	H	α-helix	trans	-69.4	-37.2	178.4	-59.9	175.9	0	0	0	110.1	V415 D416 L422	V415-I418 WeakPolarHBondContact O-CB 3.39Å; V415-I418 PolarHBondContact O-N 3.47Å; V415-I418 VanDerWaalsContact O-N 3.14Å; D416-I418 VanDerWaalsContact C-N 3.31Å; I418-L422 HydrophobicContact CG2-CD1 4.24Å; I418-L422 WeakPolarHBondContact O-CG 3.38Å; I418-L422 PolarHBondContact O-N 3.21Å
419	T	49.2	Very low	40.6	Very low	63 Å²	63	117 Å²	117	39%	0.387	59%	0.591	S	S	.	*	H	α-helix	trans	-64.1	-49.4	172.7	-39.9	0	0	0	0	111	V415 D416 E417 I421 L422 E423	V415-T419 PolarHBondContact O-N 2.89Å; V415-T419 VanDerWaalsContact O-N 3.14Å; V415-T419 PolarHBondContact O-OG1 2.94Å; V415-T419 VanDerWaalsContact O-OG1 3.08Å; D416-T419 PolarHBondContact O-N 2.78Å; E417-T419 VanDerWaalsContact C-N 3.34Å; T419-I421 VanDerWaalsContact C-N 3.33Å; T419-I421 PolarHBondContact O-N 2.98Å; T419-L422 CarbonylContact O-C 3.37Å; T419-L422 PolarHBondContact O-N 3.44Å; T419-E423 WeakPolarHBondContact O-CG 3.5Å; T419-E423 PolarHBondContact O-N 3.27Å
420	K	48.3	Very low	40.7	Very low	114 Å²	114	113.5 Å²	113.5	50%	0.496	58%	0.577	S	S	.	*	H	α-helix	trans	-59.8	-37.9	177.4	-76.2	165.6	-177.8	157.2	0	113.3	D416 E417 L422 H424	D416-K420 WeakPolarHBondContact O-CB 3.28Å; D416-K420 WeakPolarHBondContact O-CG 3.34Å; D416-K420 PolarHBondContact O-N 3.09Å; E417-K420 PolarHBondContact O-N 3.19Å; K420-L422 VanDerWaalsContact C-N 3.34Å; K420-H424 PolarHBondContact O-ND1 3.02Å
421	I	46.6	Very low	40.5	Very low	84 Å²	84	110 Å²	110	43%	0.431	57%	0.569	S	S	.	*	H	α-helix	trans	-63.7	-41.5	174.1	-70.6	163.9	0	0	0	110.3	R383 E417 T419	R383-I421 PolarHBondContact NH2-O 2.79Å; E417-I421 WeakPolarHBondContact O-CB 3.39Å; E417-I421 WeakPolarHBondContact O-CD1 3.26Å; E417-I421 VanDerWaalsContact O-CG1 3.23Å; E417-I421 WeakPolarHBondContact O-CG1 3.48Å; E417-I421 PolarHBondContact O-N 2.87Å; T419-I421 VanDerWaalsContact C-N 3.33Å; T419-I421 PolarHBondContact O-N 2.98Å
422	L	43.2	Very low	40.7	Very low	66 Å²	66	111.1 Å²	111.1	35%	0.346	56%	0.562	S	S	.	*	H	α-helix	trans	-74.3	-29.6	-179.9	-70.6	167.9	0	0	0	113.6	I418 T419 K420 H424 I425	I418-L422 HydrophobicContact CG2-CD1 4.24Å; I418-L422 WeakPolarHBondContact O-CG 3.38Å; I418-L422 PolarHBondContact O-N 3.21Å; T419-L422 CarbonylContact O-C 3.37Å; T419-L422 PolarHBondContact O-N 3.44Å; K420-L422 VanDerWaalsContact C-N 3.34Å; L422-H424 VanDerWaalsContact C-N 3.32Å; L422-H424 PolarHBondContact O-N 2.91Å; L422-I425 HydrophobicContact CD2-CD1 4.41Å; L422-I425 PolarHBondContact O-N 3.39Å
423	E	39.8	Very low	40.8	Very low	139 Å²	139	107.4 Å²	107.4	65%	0.65	55%	0.547	S	S	*	.	H	α-helix	trans	-69	-24.5	177.7	-77.1	-177.7	137.3	0	0	114.3	T419 I425	T419-E423 WeakPolarHBondContact O-CG 3.5Å; T419-E423 PolarHBondContact O-N 3.27Å; E423-I425 PolarHBondContact O-N 2.85Å
424	H	40.8	Very low	41.1	Very low	146 Å²	146	106 Å²	106	68%	0.676	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	14	178.4	-75	77.5	0	0	0	114.1	K420 L422	K420-H424 PolarHBondContact O-ND1 3.02Å; L422-H424 VanDerWaalsContact C-N 3.32Å; L422-H424 PolarHBondContact O-N 2.91Å
425	I	36.9	Very low	41.1	Very low	72 Å²	72	103.1 Å²	103.1	37%	0.369	53%	0.534	S	S	.	.	S	Bend	trans	-98.2	113.9	172.3	-57.7	175	0	0	0	107.2	L422 E423	L422-I425 HydrophobicContact CD2-CD1 4.41Å; L422-I425 PolarHBondContact O-N 3.39Å; E423-I425 PolarHBondContact O-N 2.85Å
426	P	31.7	Very low	41.1	Very low	86 Å²	86	103.4 Å²	103.4	56%	0.558	53%	0.529	S	S	*	.			trans	-58.8	136.6	170.9	26.2	-33.1	0	0	0	108.3	Y428	P426-Y428 VanDerWaalsContact C-N 3.34Å; P426-Y428 HydrophobicContact CG-CE2 4.32Å; P426-Y428 PolarHBondContact O-N 3.21Å
427	P	36.4	Very low	41.3	Very low	124 Å²	124	101.9 Å²	101.9	81%	0.805	52%	0.519	S	S	*	.			trans	-67.9	96.7	-178.9	28.2	-33.7	0	0	0	108.7	E429	P427-E429 PolarHBondContact O-N 3.21Å
428	Y	33	Very low	41.5	Very low	197 Å²	197	99.2 Å²	99.2	77%	0.773	51%	0.514	S	S	*	.			trans	-62.5	95.2	157.5	-76.5	-82.4	0	0	0	106.4	P426 L430	P426-Y428 VanDerWaalsContact C-N 3.34Å; P426-Y428 HydrophobicContact CG-CE2 4.32Å; P426-Y428 PolarHBondContact O-N 3.21Å; Y428-L430 VanDerWaalsContact C-N 3.25Å; Y428-L430 PolarHBondContact O-N 2.88Å
429	E	33	Very low	41.7	Very low	156 Å²	156	100.7 Å²	100.7	73%	0.729	53%	0.528	S	S	*	.			trans	-64.7	93.3	169.9	-166.5	173.7	-157.2	0	0	106.9	P427 T431	P427-E429 PolarHBondContact O-N 3.21Å; E429-T431 HydrophobicContact CG-CG2 4.21Å; E429-T431 PolarHBondContact O-N 3.2Å; E429-T431 PolarHBondContact O-OG1 3.16Å
430	L	33.9	Very low	42.1	Very low	99 Å²	99	101.9 Å²	101.9	52%	0.518	53%	0.531	S	S	.	.			trans	-66.3	82.6	175.7	-73.1	170.2	0	0	0	108.2	Y428 Y432	Y428-L430 VanDerWaalsContact C-N 3.25Å; Y428-L430 PolarHBondContact O-N 2.88Å; L430-Y432 VanDerWaalsContact C-N 3.31Å; L430-Y432 HydrophobicContact CB-CE2 4.12Å; L430-Y432 WeakPolarHBondContact O-CD2 3.37Å; L430-Y432 PolarHBondContact O-N 3.12Å
431	T	30.1	Very low	42.5	Very low	113 Å²	113	101.4 Å²	101.4	69%	0.693	53%	0.533	S	S	*	.			trans	-75	86.8	173.3	37	0	0	0	0	108.1	E429 T433	E429-T431 HydrophobicContact CG-CG2 4.21Å; E429-T431 PolarHBondContact O-N 3.2Å; E429-T431 PolarHBondContact O-OG1 3.16Å; T431-T433 PolarHBondContact O-N 3.21Å
432	Y	40.9	Very low	42.9	Very low	97 Å²	97	100 Å²	100	38%	0.38	53%	0.532	S	S	.	.			trans	-64	131	168.7	-56.8	-71	0	0	0	109.2	L430 E436 E437 I440	L430-Y432 VanDerWaalsContact C-N 3.31Å; L430-Y432 HydrophobicContact CB-CE2 4.12Å; L430-Y432 WeakPolarHBondContact O-CD2 3.37Å; L430-Y432 PolarHBondContact O-N 3.12Å; Y432-E436 HydrophobicContact CD1-CB 4.33Å; Y432-E437 VanDerWaalsContact CB-CG 3.48Å; Y432-E437 HydrophobicContact CG-CG 4.42Å; Y432-I440 HydrophobicContact CD1-CD1 3.43Å; Y432-I440 VanDerWaalsContact CD1-CD1 3.43Å; Y432-I440 HydrophobicContact CE1-CD1 3.38Å; Y432-I440 HydrophobicContact CG-CD1 4.14Å
433	T	43	Very low	43.5	Very low	68 Å²	68	100.7 Å²	100.7	42%	0.417	54%	0.536	S	S	.	.			trans	-64.2	152.6	162.6	57.6	0	0	0	0	109.6	T431 D435 E436 E437	T431-T433 PolarHBondContact O-N 3.21Å; T433-D435 PolarHBondContact O-N 3.09Å; T433-E436 WeakPolarHBondContact CB-OE2 3.47Å; T433-E436 WeakPolarHBondContact CG2-OE2 3.24Å; T433-E436 PolarHBondContact N-OE2 3.05Å; T433-E436 WeakPolarHBondContact O-CA 3.31Å; T433-E436 WeakPolarHBondContact O-CB 3.45Å; T433-E436 PolarHBondContact O-N 2.96Å; T433-E436 WeakPolarHBondContact OG1-CB 3.37Å; T433-E436 VanDerWaalsContact OG1-CD 3.28Å; T433-E436 VanDerWaalsContact OG1-CG 3.25Å; T433-E436 WeakPolarHBondContact OG1-CG 3.43Å; T433-E436 PolarHBondContact OG1-N 2.88Å; T433-E436 PolarHBondContact OG1-OE2 3.33Å; T433-E437 WeakPolarHBondContact O-CG 3.44Å; T433-E437 PolarHBondContact O-N 2.63Å
434	P	50.6	Low	44.5	Very low	99 Å²	99	97.1 Å²	97.1	64%	0.643	52%	0.52	S	S	*	.	H	α-helix	trans	-53.8	-28.3	175.8	-27.9	35.9	0	0	0	113.6	S438	P434-S438 VanDerWaalsContact O-CB 3.32Å; P434-S438 WeakPolarHBondContact O-CB 3.5Å; P434-S438 PolarHBondContact O-N 3.16Å
435	D	44.3	Very low	45.3	Very low	89 Å²	89	94.5 Å²	94.5	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-71	-45.8	174.3	-68.2	-24.4	0	0	0	111.8	T433 S438 S439 C783	T433-D435 PolarHBondContact O-N 3.09Å; D435-S438 PolarHBondContact O-N 3.4Å; D435-S438 PolarHBondContact O-OG 2.77Å; D435-S439 WeakPolarHBondContact O-CB 3.37Å; D435-S439 PolarHBondContact O-N 3.42Å; D435-C783 PolarHBondContact OD2-SG 3.32Å
436	E	45.2	Very low	46.2	Very low	94 Å²	94	95.8 Å²	95.8	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-62.1	-42.8	172.5	-73.5	162.7	139.2	0	0	112	Y432 T433 S438 S439 I440	Y432-E436 HydrophobicContact CD1-CB 4.33Å; T433-E436 WeakPolarHBondContact CB-OE2 3.47Å; T433-E436 WeakPolarHBondContact CG2-OE2 3.24Å; T433-E436 PolarHBondContact N-OE2 3.05Å; T433-E436 WeakPolarHBondContact O-CA 3.31Å; T433-E436 WeakPolarHBondContact O-CB 3.45Å; T433-E436 PolarHBondContact O-N 2.96Å; T433-E436 WeakPolarHBondContact OG1-CB 3.37Å; T433-E436 VanDerWaalsContact OG1-CD 3.28Å; T433-E436 VanDerWaalsContact OG1-CG 3.25Å; T433-E436 WeakPolarHBondContact OG1-CG 3.43Å; T433-E436 PolarHBondContact OG1-N 2.88Å; T433-E436 PolarHBondContact OG1-OE2 3.33Å; E436-S438 VanDerWaalsContact C-N 3.32Å; E436-S438 PolarHBondContact O-N 3.5Å; E436-S439 WeakPolarHBondContact O-CB 3.49Å; E436-S439 PolarHBondContact O-N 3.13Å; E436-I440 WeakPolarHBondContact O-CB 3.42Å; E436-I440 WeakPolarHBondContact O-CD1 3.26Å; E436-I440 VanDerWaalsContact O-CG1 3.24Å; E436-I440 WeakPolarHBondContact O-CG1 3.24Å; E436-I440 PolarHBondContact O-N 3.23Å
437	E	47.8	Very low	47.6	Very low	66 Å²	66	94.1 Å²	94.1	31%	0.308	50%	0.498	S	S	.	.	H	α-helix	trans	-58	-45.3	173.4	-63.4	-176.2	-177.5	0	0	111.4	Y432 T433 S439 L441 Y535	Y432-E437 VanDerWaalsContact CB-CG 3.48Å; Y432-E437 HydrophobicContact CG-CG 4.42Å; T433-E437 WeakPolarHBondContact O-CG 3.44Å; T433-E437 PolarHBondContact O-N 2.63Å; E437-S439 VanDerWaalsContact C-N 3.31Å; E437-S439 PolarHBondContact O-N 3.29Å; E437-L441 VanDerWaalsContact O-CB 3.23Å; E437-L441 WeakPolarHBondContact O-CB 3.47Å; E437-L441 PolarHBondContact O-N 3.2Å; E437-Y535 VanDerWaalsContact CG-OH 3.24Å; E437-Y535 WeakPolarHBondContact CG-OH 3.18Å; E437-Y535 VanDerWaalsContact OE1-CE1 3.26Å; E437-Y535 WeakPolarHBondContact OE1-CE1 3.47Å; E437-Y535 PolarHBondContact OE1-OH 3.14Å; E437-Y535 PolarHBondContact OE2-OH 2.94Å
438	S	49.7	Very low	48.6	Very low	67 Å²	67	89.4 Å²	89.4	47%	0.469	47%	0.466	S	S	.	.	H	α-helix	trans	-66.2	-34.3	177.8	84.4	0	0	0	0	112.2	P434 D435 E436 S442	P434-S438 VanDerWaalsContact O-CB 3.32Å; P434-S438 WeakPolarHBondContact O-CB 3.5Å; P434-S438 PolarHBondContact O-N 3.16Å; D435-S438 PolarHBondContact O-N 3.4Å; D435-S438 PolarHBondContact O-OG 2.77Å; E436-S438 VanDerWaalsContact C-N 3.32Å; E436-S438 PolarHBondContact O-N 3.5Å; S438-S442 WeakPolarHBondContact O-CB 3.32Å; S438-S442 PolarHBondContact O-N 3.04Å
439	S	51.9	Low	50	Low	76 Å²	76	85.2 Å²	85.2	53%	0.531	45%	0.453	S	S	.	.	H	α-helix	trans	-68.9	-50.1	176.8	-168.9	0	0	0	0	111	D435 E436 E437 L441 S442 D443	D435-S439 WeakPolarHBondContact O-CB 3.37Å; D435-S439 PolarHBondContact O-N 3.42Å; E436-S439 WeakPolarHBondContact O-CB 3.49Å; E436-S439 PolarHBondContact O-N 3.13Å; E437-S439 VanDerWaalsContact C-N 3.31Å; E437-S439 PolarHBondContact O-N 3.29Å; S439-L441 VanDerWaalsContact C-N 3.35Å; S439-L441 PolarHBondContact O-N 2.84Å; S439-S442 WeakPolarHBondContact O-CB 3.24Å; S439-S442 PolarHBondContact O-N 3.47Å; S439-D443 WeakPolarHBondContact O-CB 3.45Å; S439-D443 PolarHBondContact O-N 3.18Å
440	I	56.3	Low	51.4	Low	87 Å²	87	80 Å²	80	45%	0.446	43%	0.427	S	S	.	.	H	α-helix	trans	-58.8	-45.7	175.4	-67.9	162.7	0	0	0	110.4	Y432 E436 D443 L444	Y432-I440 HydrophobicContact CD1-CD1 3.43Å; Y432-I440 VanDerWaalsContact CD1-CD1 3.43Å; Y432-I440 HydrophobicContact CE1-CD1 3.38Å; Y432-I440 HydrophobicContact CG-CD1 4.14Å; E436-I440 WeakPolarHBondContact O-CB 3.42Å; E436-I440 WeakPolarHBondContact O-CD1 3.26Å; E436-I440 VanDerWaalsContact O-CG1 3.24Å; E436-I440 WeakPolarHBondContact O-CG1 3.24Å; E436-I440 PolarHBondContact O-N 3.23Å; I440-D443 PolarHBondContact O-N 3Å; I440-L444 WeakPolarHBondContact O-CB 3.19Å; I440-L444 PolarHBondContact O-N 2.99Å
441	L	57.5	Low	52.6	Low	104 Å²	104	76.9 Å²	76.9	55%	0.545	41%	0.414	S	S	.	.	H	α-helix	trans	-66.8	-38.2	178	-175.9	62.1	0	0	0	112.3	E437 S439 L444 M445	E437-L441 VanDerWaalsContact O-CB 3.23Å; E437-L441 WeakPolarHBondContact O-CB 3.47Å; E437-L441 PolarHBondContact O-N 3.2Å; S439-L441 VanDerWaalsContact C-N 3.35Å; S439-L441 PolarHBondContact O-N 2.84Å; L441-L444 HydrophobicContact CD1-CD2 4.09Å; L441-M445 WeakPolarHBondContact O-CB 3.45Å; L441-M445 WeakPolarHBondContact O-CG 3.26Å; L441-M445 PolarHBondContact O-N 3.09Å
442	S	55.4	Low	54.3	Low	56 Å²	56	77.4 Å²	77.4	39%	0.392	40%	0.403	S	S	.	.	H	α-helix	trans	-63.4	-43	174.6	178.7	0	0	0	0	111.5	S438 S439 M445 R446	S438-S442 WeakPolarHBondContact O-CB 3.32Å; S438-S442 PolarHBondContact O-N 3.04Å; S439-S442 WeakPolarHBondContact O-CB 3.24Å; S439-S442 PolarHBondContact O-N 3.47Å; S442-M445 PolarHBondContact O-N 2.85Å; S442-R446 VanDerWaalsContact O-CG 3.31Å; S442-R446 WeakPolarHBondContact O-CG 3.47Å; S442-R446 PolarHBondContact O-N 2.73Å
443	D	56.1	Low	55.5	Low	80 Å²	80	75.5 Å²	75.5	43%	0.428	40%	0.399	S	S	.	.	H	α-helix	trans	-76.4	-35.2	-178.7	-151.1	46.3	0	0	0	112.6	S439 I440 R446 T447	S439-D443 WeakPolarHBondContact O-CB 3.45Å; S439-D443 PolarHBondContact O-N 3.18Å; I440-D443 PolarHBondContact O-N 3Å; D443-R446 PolarHBondContact O-N 3.42Å; D443-T447 WeakPolarHBondContact O-CB 3.36Å; D443-T447 PolarHBondContact O-N 3.42Å; D443-T447 PolarHBondContact O-OG1 3.05Å
444	L	59.1	Low	56.6	Low	63 Å²	63	76.5 Å²	76.5	33%	0.33	40%	0.399	S	S	.	.	H	α-helix	trans	-55.8	-50	165.9	-175	102.1	0	0	0	110.9	I440 L441 R446 T447 I448 Y577	I440-L444 WeakPolarHBondContact O-CB 3.19Å; I440-L444 PolarHBondContact O-N 2.99Å; L441-L444 HydrophobicContact CD1-CD2 4.09Å; L444-R446 PolarHBondContact O-N 3.34Å; L444-T447 PolarHBondContact O-N 3.32Å; L444-I448 HydrophobicContact CD2-CD1 4.13Å; L444-I448 HydrophobicContact CG-CD1 4.07Å; L444-I448 WeakPolarHBondContact O-CG1 3.19Å; L444-I448 PolarHBondContact O-N 3.49Å; L444-Y577 HydrophobicContact CD1-CE2 4.44Å; L444-Y577 WeakPolarHBondContact CD1-OH 3.35Å
445	M	57.7	Low	57.4	Low	91 Å²	91	75.2 Å²	75.2	45%	0.448	38%	0.384	S	S	.	.	H	α-helix	trans	-64.4	-39	179.2	-76.1	-65	-64.3	0	0	112.5	L441 S442 Q449	L441-M445 WeakPolarHBondContact O-CB 3.45Å; L441-M445 WeakPolarHBondContact O-CG 3.26Å; L441-M445 PolarHBondContact O-N 3.09Å; S442-M445 PolarHBondContact O-N 2.85Å; M445-Q449 WeakPolarHBondContact O-CB 3.21Å; M445-Q449 VanDerWaalsContact O-CG 3.26Å; M445-Q449 WeakPolarHBondContact O-CG 3.39Å; M445-Q449 PolarHBondContact O-N 2.82Å
446	R	56.8	Low	58.6	Low	100 Å²	100	73.5 Å²	73.5	38%	0.377	37%	0.374	S	S	.	.	H	α-helix	trans	-63.4	-40.7	172.3	-75.3	170.9	-180	-128.1	4.2	112.2	V328 S442 D443 L444 Q449 R450	V328-R446 PolarHBondContact O-NH1 3.04Å; S442-R446 VanDerWaalsContact O-CG 3.31Å; S442-R446 WeakPolarHBondContact O-CG 3.47Å; S442-R446 PolarHBondContact O-N 2.73Å; D443-R446 PolarHBondContact O-N 3.42Å; L444-R446 PolarHBondContact O-N 3.34Å; R446-Q449 PolarHBondContact O-N 3.12Å; R446-R450 WeakPolarHBondContact O-CG 3.37Å; R446-R450 PolarHBondContact O-N 3.31Å
447	T	60.3	Low	59.6	Low	51 Å²	51	75.1 Å²	75.1	31%	0.313	38%	0.381	S	S	.	.	H	α-helix	trans	-66.6	-43.3	179.1	-59.2	0	0	0	0	111	Y327 D443 L444 Q449 R450 S451	Y327-T447 PolarHBondContact OH-OG1 2.66Å; D443-T447 WeakPolarHBondContact O-CB 3.36Å; D443-T447 PolarHBondContact O-N 3.42Å; D443-T447 PolarHBondContact O-OG1 3.05Å; L444-T447 PolarHBondContact O-N 3.32Å; T447-Q449 PolarHBondContact O-N 3.38Å; T447-R450 PolarHBondContact O-N 3.18Å; T447-S451 PolarHBondContact O-N 3.14Å; T447-S451 PolarHBondContact O-OG 3.35Å
448	I	58.3	Low	60.3	Low	24 Å²	24	77.3 Å²	77.3	12%	0.123	39%	0.391	C	S	.	.	H	α-helix	trans	-63	-39.3	173.3	-67.8	166.3	0	0	0	111.7	L444 S451 R452	L444-I448 HydrophobicContact CD2-CD1 4.13Å; L444-I448 HydrophobicContact CG-CD1 4.07Å; L444-I448 WeakPolarHBondContact O-CG1 3.19Å; L444-I448 PolarHBondContact O-N 3.49Å; I448-S451 PolarHBondContact O-OG 3.24Å; I448-S451 VanDerWaalsContact O-OG 3.12Å; I448-R452 WeakPolarHBondContact O-CG 3.47Å; I448-R452 PolarHBondContact O-N 3.23Å
449	Q	63.1	Low	60.8	Low	109 Å²	109	80.2 Å²	80.2	51%	0.509	40%	0.398	S	S	.	.	H	α-helix	trans	-64.6	-44.6	175	-76.3	170.1	-9.4	0	0	111.3	M445 R446 T447 R452 N453	M445-Q449 WeakPolarHBondContact O-CB 3.21Å; M445-Q449 VanDerWaalsContact O-CG 3.26Å; M445-Q449 WeakPolarHBondContact O-CG 3.39Å; M445-Q449 PolarHBondContact O-N 2.82Å; R446-Q449 PolarHBondContact O-N 3.12Å; T447-Q449 PolarHBondContact O-N 3.38Å; Q449-R452 PolarHBondContact O-N 2.92Å; Q449-N453 PolarHBondContact O-N 3.1Å; Q449-N453 PolarHBondContact O-OD1 2.93Å
450	R	61.9	Low	61.2	Low	46 Å²	46	81.6 Å²	81.6	17%	0.174	40%	0.396	C	S	.	.	H	α-helix	trans	-64.5	-45	178.1	-76.1	178.7	-177.2	148.2	-0.3	113.5	Y327 R446 T447 R452 N453 E454	Y327-R450 PolarHBondContact O-NH1 3.08Å; Y327-R450 PolarHBondContact O-NH2 2.6Å; R446-R450 WeakPolarHBondContact O-CG 3.37Å; R446-R450 PolarHBondContact O-N 3.31Å; T447-R450 PolarHBondContact O-N 3.18Å; R450-R452 PolarHBondContact O-N 3.42Å; R450-N453 PolarHBondContact O-N 3.05Å; R450-N453 VanDerWaalsContact O-N 3.12Å; R450-E454 WeakPolarHBondContact O-CB 3.41Å; R450-E454 WeakPolarHBondContact O-CG 3.26Å; R450-E454 PolarHBondContact O-N 3.06Å
451	S	59.3	Low	60.9	Low	35 Å²	35	84 Å²	84	25%	0.245	41%	0.405	C	S	.	.	H	α-helix	trans	-60.5	-35.7	179.7	65.5	0	0	0	0	112	T447 I448 Q455	T447-S451 PolarHBondContact O-N 3.14Å; T447-S451 PolarHBondContact O-OG 3.35Å; I448-S451 PolarHBondContact O-OG 3.24Å; I448-S451 VanDerWaalsContact O-OG 3.12Å; S451-Q455 WeakPolarHBondContact O-CB 3.3Å; S451-Q455 VanDerWaalsContact O-CG 3.27Å; S451-Q455 WeakPolarHBondContact O-CG 3.44Å; S451-Q455 PolarHBondContact O-N 2.79Å
452	R	66	Low	60.4	Low	124 Å²	124	84.3 Å²	84.3	47%	0.468	41%	0.405	S	S	.	.	H	α-helix	trans	-65.4	-49.3	171.6	-73.1	178.4	175.3	139.9	4.1	112.3	I448 Q449 R450 E454 Q455 Q456	I448-R452 WeakPolarHBondContact O-CG 3.47Å; I448-R452 PolarHBondContact O-N 3.23Å; Q449-R452 PolarHBondContact O-N 2.92Å; R450-R452 PolarHBondContact O-N 3.42Å; R452-E454 VanDerWaalsContact C-N 3.3Å; R452-E454 PolarHBondContact O-N 3.43Å; R452-Q455 PolarHBondContact O-N 2.88Å; R452-Q456 WeakPolarHBondContact O-CG 3.19Å; R452-Q456 PolarHBondContact O-N 3.21Å
453	N	66.3	Low	59.9	Low	57 Å²	57	84.7 Å²	84.7	31%	0.305	41%	0.408	S	S	.	.	H	α-helix	trans	-66.4	-32.6	-178.8	-68.9	37.3	0	0	0	112	D139 Q449 R450 Q457	D139-N453 PolarHBondContact OD1-ND2 3.34Å; Q449-N453 PolarHBondContact O-N 3.1Å; Q449-N453 PolarHBondContact O-OD1 2.93Å; R450-N453 PolarHBondContact O-N 3.05Å; R450-N453 VanDerWaalsContact O-N 3.12Å; N453-Q457 WeakPolarHBondContact O-CG 3.47Å; N453-Q457 PolarHBondContact O-N 3.29Å
454	E	65.8	Low	59.4	Low	89 Å²	89	85.3 Å²	85.3	42%	0.416	42%	0.418	S	S	.	.	H	α-helix	trans	-70.8	-42.5	172.8	-72.8	177.6	179.3	0	0	111.9	R450 R452 Q456 Q457 Q458	R450-E454 WeakPolarHBondContact O-CB 3.41Å; R450-E454 WeakPolarHBondContact O-CG 3.26Å; R450-E454 PolarHBondContact O-N 3.06Å; R452-E454 VanDerWaalsContact C-N 3.3Å; R452-E454 PolarHBondContact O-N 3.43Å; E454-Q456 VanDerWaalsContact C-N 3.34Å; E454-Q456 PolarHBondContact O-N 3.18Å; E454-Q457 PolarHBondContact O-N 3.04Å; E454-Q458 WeakPolarHBondContact O-CG 3.23Å; E454-Q458 PolarHBondContact O-N 3.38Å
455	Q	67	Low	58.6	Low	71 Å²	71	85.7 Å²	85.7	33%	0.332	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-41.6	172.9	-78.7	177.9	1.2	0	0	112	S451 R452 Q458 Q459 N580	S451-Q455 WeakPolarHBondContact O-CB 3.3Å; S451-Q455 VanDerWaalsContact O-CG 3.27Å; S451-Q455 WeakPolarHBondContact O-CG 3.44Å; S451-Q455 PolarHBondContact O-N 2.79Å; R452-Q455 PolarHBondContact O-N 2.88Å; Q455-Q458 PolarHBondContact O-N 3.07Å; Q455-Q459 WeakPolarHBondContact O-CG 3.5Å; Q455-Q459 PolarHBondContact O-N 2.67Å; Q455-N580 PolarHBondContact NE2-OD1 2.94Å
456	Q	68.8	Low	57.7	Low	54 Å²	54	86.6 Å²	86.6	25%	0.252	43%	0.433	S	S	.	.	H	α-helix	trans	-63.7	-43.7	175.6	-73.6	172	-42.9	0	0	111.8	R452 E454 Q458 Q459 H460	R452-Q456 WeakPolarHBondContact O-CG 3.19Å; R452-Q456 PolarHBondContact O-N 3.21Å; E454-Q456 VanDerWaalsContact C-N 3.34Å; E454-Q456 PolarHBondContact O-N 3.18Å; Q456-Q458 PolarHBondContact O-N 2.73Å; Q456-Q459 PolarHBondContact O-N 3.26Å; Q456-H460 PolarHBondContact O-CD2 3.01Å; Q456-H460 PolarHBondContact O-N 2.97Å
457	Q	67	Low	56.7	Low	128 Å²	128	89.5 Å²	89.5	60%	0.598	46%	0.455	S	S	*	.	H	α-helix	trans	-63.4	-39.2	175.6	-76.6	-179	18.3	0	0	112.9	N453 E454 H460 Q461	N453-Q457 WeakPolarHBondContact O-CG 3.47Å; N453-Q457 PolarHBondContact O-N 3.29Å; E454-Q457 PolarHBondContact O-N 3.04Å; Q457-H460 PolarHBondContact O-N 3.15Å; Q457-Q461 WeakPolarHBondContact O-CG 3.38Å; Q457-Q461 PolarHBondContact O-N 3.44Å
458	Q	62.2	Low	55.4	Low	111 Å²	111	91.3 Å²	91.3	52%	0.519	47%	0.469	S	S	.	.	H	α-helix	trans	-66	-41.6	175.2	-70.8	175.3	25.2	0	0	111.6	E454 Q455 Q456 H460 Q461 M462	E454-Q458 WeakPolarHBondContact O-CG 3.23Å; E454-Q458 PolarHBondContact O-N 3.38Å; Q455-Q458 PolarHBondContact O-N 3.07Å; Q456-Q458 PolarHBondContact O-N 2.73Å; Q458-H460 PolarHBondContact O-N 3.09Å; Q458-Q461 PolarHBondContact O-N 3.46Å; Q458-M462 WeakPolarHBondContact O-CB 3.42Å; Q458-M462 WeakPolarHBondContact O-CG 3.32Å; Q458-M462 PolarHBondContact O-N 2.98Å
459	Q	60.7	Low	54.3	Low	129 Å²	129	97.6 Å²	97.6	60%	0.603	50%	0.503	S	S	*	.	H	α-helix	trans	-63	-39.9	174.1	-73.5	175.8	10.4	0	0	112.2	Q455 Q456 S463	Q455-Q459 WeakPolarHBondContact O-CG 3.5Å; Q455-Q459 PolarHBondContact O-N 2.67Å; Q456-Q459 PolarHBondContact O-N 3.26Å; Q459-S463 VanDerWaalsContact O-CB 3.3Å; Q459-S463 WeakPolarHBondContact O-CB 3.36Å; Q459-S463 PolarHBondContact O-N 3.3Å; Q459-S463 PolarHBondContact O-OG 2.95Å
460	H	58.8	Low	52.9	Low	105 Å²	105	98.9 Å²	98.9	49%	0.486	52%	0.519	S	S	.	.	H	α-helix	trans	-69.1	-33	174.8	-79.5	-61.8	0	0	0	113.8	Q456 Q457 Q458 S463 S464	Q456-H460 PolarHBondContact O-CD2 3.01Å; Q456-H460 PolarHBondContact O-N 2.97Å; Q457-H460 PolarHBondContact O-N 3.15Å; Q458-H460 PolarHBondContact O-N 3.09Å; H460-S463 WeakPolarHBondContact CA-OG 3.47Å; H460-S463 PolarHBondContact O-OG 3.41Å; H460-S464 WeakPolarHBondContact O-CB 3.34Å; H460-S464 PolarHBondContact O-N 3.28Å; H460-S464 PolarHBondContact O-OG 2.96Å
461	Q	50.8	Low	51.5	Low	137 Å²	137	101.4 Å²	101.4	64%	0.64	55%	0.55	S	S	*	.	H	α-helix	trans	-72.9	-38.6	174.3	-75	-178.6	5.3	0	0	112.4	Q457 Q458 S464 S465	Q457-Q461 WeakPolarHBondContact O-CG 3.38Å; Q457-Q461 PolarHBondContact O-N 3.44Å; Q458-Q461 PolarHBondContact O-N 3.46Å; Q461-S464 PolarHBondContact O-OG 3.16Å; Q461-S465 PolarHBondContact O-N 3.21Å; Q461-S465 PolarHBondContact O-OG 2.71Å
462	M	47.2	Very low	50.2	Low	111 Å²	111	108.2 Å²	108.2	55%	0.547	58%	0.58	S	S	.	*	H	α-helix	trans	-69	-45.8	175.8	-64.8	-105.3	54.7	0	0	111.7	Q458 S464 S465 D466	Q458-M462 WeakPolarHBondContact O-CB 3.42Å; Q458-M462 WeakPolarHBondContact O-CG 3.32Å; Q458-M462 PolarHBondContact O-N 2.98Å; M462-S464 PolarHBondContact O-N 3.32Å; M462-S465 PolarHBondContact O-N 2.89Å; M462-S465 PolarHBondContact O-OG 3.01Å; M462-D466 PolarHBondContact O-N 3.08Å
463	S	45.5	Very low	48.5	Very low	64 Å²	64	107.4 Å²	107.4	45%	0.448	59%	0.593	S	S	.	*	H	α-helix	trans	-69.3	-16.6	179.6	55.9	0	0	0	0	114.7	Q459 H460	Q459-S463 VanDerWaalsContact O-CB 3.3Å; Q459-S463 WeakPolarHBondContact O-CB 3.36Å; Q459-S463 PolarHBondContact O-N 3.3Å; Q459-S463 PolarHBondContact O-OG 2.95Å; H460-S463 WeakPolarHBondContact CA-OG 3.47Å; H460-S463 PolarHBondContact O-OG 3.41Å
464	S	45.5	Very low	47	Very low	93 Å²	93	109.6 Å²	109.6	65%	0.65	61%	0.613	S	S	*	*	H	α-helix	trans	-92.4	-12.4	174	52.3	0	0	0	0	114.3	H460 Q461 M462	H460-S464 WeakPolarHBondContact O-CB 3.34Å; H460-S464 PolarHBondContact O-N 3.28Å; H460-S464 PolarHBondContact O-OG 2.96Å; Q461-S464 PolarHBondContact O-OG 3.16Å; M462-S464 PolarHBondContact O-N 3.32Å
465	S	41.7	Very low	45.3	Very low	70 Å²	70	112.8 Å²	112.8	49%	0.49	63%	0.631	S	S	.	*	H	α-helix	trans	-95.2	-25.2	173.2	52	0	0	0	0	114.3	Q461 M462	Q461-S465 PolarHBondContact O-N 3.21Å; Q461-S465 PolarHBondContact O-OG 2.71Å; M462-S465 PolarHBondContact O-N 2.89Å; M462-S465 PolarHBondContact O-OG 3.01Å
466	D	38.3	Very low	43.5	Very low	111 Å²	111	117.5 Å²	117.5	59%	0.594	65%	0.651	S	S	*	*	S	Bend	trans	-94.7	2.4	-173.5	-66	-28.2	0	0	0	114.6	M462 S468	M462-D466 PolarHBondContact O-N 3.08Å; D466-S468 PolarHBondContact O-N 2.89Å
467	L	36.7	Very low	41.7	Very low	161 Å²	161	121 Å²	121	84%	0.843	67%	0.671	S	S	*	*			trans	-80.4	39.9	176.5	-112.6	78.6	0	0	0	114.2
468	S	33.7	Very low	40	Very low	88 Å²	88	118.9 Å²	118.9	62%	0.615	67%	0.671	S	S	*	*			trans	-151.1	82.2	164.9	62.6	0	0	0	0	111.1	D466	D466-S468 PolarHBondContact O-N 2.89Å
469	N	34.1	Very low	38.6	Very low	156 Å²	156	121 Å²	121	83%	0.834	68%	0.684	S	S	*	*			trans	173.5	91.5	142.4	-84.9	-30.7	0	0	0	112.5
470	T	33.7	Very low	37.1	Very low	136 Å²	136	121.2 Å²	121.2	83%	0.834	69%	0.689	S	S	*	*			trans	35.3	111.9	131.5	-44.4	0	0	0	0	120.6
471	A	32.6	Very low	35.7	Very low	100 Å²	100	125.6 Å²	125.6	83%	0.826	70%	0.702	S	S	*	*				169.4	143.8	117.9	0	0	0	0	0	113.9
472	M	31.8	Very low	34.7	Very low	177 Å²	177	124 Å²	124	87%	0.872	71%	0.706	S	S	*	*			trans	-76.9	146.5	-166.8	-59.9	-163.6	-68.1	0	0	117.8
473	S	30.9	Very low	34	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	72%	0.717	S	S	*	*				29.8	131.9	129.9	-47.5	0	0	0	0	121.9
474	S	34	Very low	33.1	Very low	103 Å²	103	128.8 Å²	128.8	72%	0.72	73%	0.734	S	S	*	*				165.4	168.6	103.1	55	0	0	0	0	113.7
475	I	31.4	Very low	32.4	Very low	155 Å²	155	132.5 Å²	132.5	80%	0.795	75%	0.746	S	S	*	*			trans	77.4	131.2	165.1	-54.2	165.1	0	0	0	115.5
476	F	29.1	Very low	31.7	Very low	170 Å²	170	135.3 Å²	135.3	75%	0.746	76%	0.76	S	S	*	*			cis	-173.1	149	-29.2	-135.2	-117.6	0	0	0	105.5
477	D	29.5	Very low	31.3	Very low	127 Å²	127	136.7 Å²	136.7	68%	0.679	77%	0.773	S	S	*	*			trans	43.6	156.4	138.4	-77.6	39.8	0	0	0	123.6
478	S	31.9	Very low	31	Very low	85 Å²	85	135 Å²	135	59%	0.594	77%	0.77	S	S	*	*			cis	-169.9	-169.4	-5.1	-110.4	0	0	0	0	109.1
479	I	32.8	Very low	30.8	Very low	156 Å²	156	138.4 Å²	138.4	80%	0.8	78%	0.779	S	S	*	*			trans	98.6	90.6	175.1	-54	160.7	0	0	0	111.7
480	L	29.2	Very low	30.5	Very low	132 Å²	132	140.7 Å²	140.7	69%	0.691	78%	0.782	S	S	*	*				66	139.7	62.5	-55.7	167.3	0	0	0	112.5
481	Y	29.8	Very low	30.4	Very low	198 Å²	198	140.7 Å²	140.7	78%	0.776	78%	0.777	S	S	*	*			cis	-137.1	148.2	10.8	-99.5	-97.4	0	0	0	108.2
482	S	29.2	Very low	30.3	Very low	102 Å²	102	144.6 Å²	144.6	71%	0.713	78%	0.775	S	S	*	*				51.8	138.1	78.9	-115.1	0	0	0	0	114.7
483	T	33	Very low	30.1	Very low	127 Å²	127	145.6 Å²	145.6	78%	0.779	78%	0.778	S	S	*	*			cis	-153.1	168.6	36.2	48.9	0	0	0	0	114.9
484	N	26.5	Very low	30	Very low	150 Å²	150	148.6 Å²	148.6	80%	0.802	78%	0.78	S	S	*	*			trans	-79.5	161	176.7	-60.3	-56.5	0	0	0	114.3
485	N	30.3	Very low	29.9	Very low	171 Å²	171	150.2 Å²	150.2	91%	0.914	78%	0.779	S	S	*	*			trans	-155.2	141.4	136	-113.2	-22.5	0	0	0	113.9
486	T	26.4	Very low	29.8	Very low	128 Å²	128	150.4 Å²	150.4	79%	0.785	78%	0.78	S	S	*	*			trans	-114	127.1	-174.2	40	0	0	0	0	112.3
487	T	31.6	Very low	29.8	Very low	140 Å²	140	146 Å²	146	86%	0.859	77%	0.771	S	S	*	*			trans	-146.8	129.3	151.3	35.8	0	0	0	0	113
488	T	29.6	Very low	29.7	Very low	126 Å²	126	146 Å²	146	77%	0.773	77%	0.771	S	S	*	*			trans	-30.7	134.6	162.3	51.8	0	0	0	0	117.4
489	I	29.2	Very low	29.6	Very low	159 Å²	159	153.2 Å²	153.2	82%	0.815	79%	0.785	S	S	*	*			trans	-167.3	158.1	131.8	-94.8	147.9	0	0	0	108.3	D491	I489-D491 VanDerWaalsContact C-N 3.34Å; I489-D491 PolarHBondContact O-N 2.67Å
490	K	28.5	Very low	29.5	Very low	205 Å²	205	153.2 Å²	153.2	89%	0.891	78%	0.781	S	S	*	*	S	Bend	trans	-77.1	57	-156.3	-60.2	171.2	178.2	172.7	0	115.9
491	D	30.4	Very low	29.5	Very low	136 Å²	136	153.3 Å²	153.3	73%	0.727	78%	0.782	S	S	*	*			trans	-144.4	95.8	175.4	-80.8	-59.3	0	0	0	112.1	I489	I489-D491 VanDerWaalsContact C-N 3.34Å; I489-D491 PolarHBondContact O-N 2.67Å
492	K	30.3	Very low	29.5	Very low	182 Å²	182	155.2 Å²	155.2	79%	0.791	79%	0.788	S	S	*	*			trans	-173.7	3.6	163.9	-105.8	142.7	-164.4	174.3	0	117.9	H494	K492-H494 VanDerWaalsContact C-N 3.25Å; K492-H494 PolarHBondContact O-N 3.05Å
493	Q	28.9	Very low	29.6	Very low	197 Å²	197	160.5 Å²	160.5	92%	0.921	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	1.7	-177.1	-93.8	-178.8	-22.2	0	0	116.3
494	H	29.1	Very low	29.5	Very low	172 Å²	172	162.7 Å²	162.7	80%	0.796	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	4.4	-175.6	-109.1	-85.5	0	0	0	116.5	K492	K492-H494 VanDerWaalsContact C-N 3.25Å; K492-H494 PolarHBondContact O-N 3.05Å
495	I	31	Very low	29.7	Very low	137 Å²	137	160.1 Å²	160.1	70%	0.703	79%	0.785	S	S	*	*	S	Bend	trans	-107.1	-9	-171.1	-62.1	178.3	0	0	0	113.6
496	L	28.8	Very low	30.1	Very low	158 Å²	158	160.1 Å²	160.1	83%	0.827	77%	0.772	S	S	*	*	S	Bend	trans	-101.5	-0.6	-178.8	-71.8	171.8	0	0	0	115.7
497	S	29	Very low	30.6	Very low	79 Å²	79	160.2 Å²	160.2	55%	0.552	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-85.2	-9.9	-175.7	-55.8	0	0	0	0	115.4	R499	S497-R499 VanDerWaalsContact C-N 3.3Å; S497-R499 PolarHBondContact O-N 2.86Å
498	N	27.8	Very low	30.9	Very low	127 Å²	127	159.2 Å²	159.2	68%	0.679	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-81.2	3.8	-173.1	-77.6	-15.6	0	0	0	115.6
499	R	30.5	Very low	31.1	Very low	235 Å²	235	156.7 Å²	156.7	89%	0.887	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-90	3.5	176.2	-68.6	-169.3	178.2	-159	-0.2	114.8	S497	S497-R499 VanDerWaalsContact C-N 3.3Å; S497-R499 PolarHBondContact O-N 2.86Å
500	H	30.1	Very low	31.5	Very low	156 Å²	156	152 Å²	152	72%	0.722	73%	0.729	S	S	*	*			trans	-106.8	0.7	-177.6	-88.1	-70.6	0	0	0	116.4	W502	H500-W502 VanDerWaalsContact C-N 3.27Å; H500-W502 PolarHBondContact O-N 2.69Å; H500-W502 VanDerWaalsContact O-N 3.12Å
501	L	30	Very low	31.9	Very low	135 Å²	135	149.7 Å²	149.7	71%	0.707	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	18.8	-170.3	-76.2	166.5	0	0	0	116.4
502	W	29.7	Very low	32.3	Very low	238 Å²	238	146.7 Å²	146.7	90%	0.902	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	21.7	178.8	-65.9	104.8	0	0	0	114.5	H500	H500-W502 VanDerWaalsContact C-N 3.27Å; H500-W502 PolarHBondContact O-N 2.69Å; H500-W502 VanDerWaalsContact O-N 3.12Å
503	R	31	Very low	32.5	Very low	212 Å²	212	148 Å²	148	80%	0.8	71%	0.709	S	S	*	*			trans	-96.1	110.7	164.9	-74.9	-175.6	174.6	178	-0.2	109.8	N505	R503-N505 PolarHBondContact O-N 3.48Å
504	L	30.4	Very low	33	Very low	173 Å²	173	145.7 Å²	145.7	91%	0.906	70%	0.703	S	S	*	*			trans	-52.5	109.6	153.4	-90.3	164.8	0	0	0	106.9	R506	L504-R506 VanDerWaalsContact C-N 3.28Å; L504-R506 PolarHBondContact O-N 2.91Å
505	N	31.4	Very low	33.2	Very low	97 Å²	97	143.7 Å²	143.7	52%	0.519	70%	0.698	S	S	.	*			trans	-76.8	85	-166.6	-156.1	-4.8	0	0	0	109.5	R503 E507 L508 A509	R503-N505 PolarHBondContact O-N 3.48Å; N505-E507 PolarHBondContact O-N 3.11Å; N505-L508 HydrophobicContact CB-CD1 4.18Å; N505-L508 HydrophobicContact CB-CG 4.44Å; N505-L508 PolarHBondContact O-N 2.88Å; N505-A509 PolarHBondContact O-N 2.86Å
506	R	38.4	Very low	33.6	Very low	171 Å²	171	145.8 Å²	145.8	65%	0.645	70%	0.704	S	S	*	*	H	α-helix	trans	-59.9	-22.6	-166	-162.2	172.4	-178.9	-171.6	-3.6	113.2	L504 A510	L504-R506 VanDerWaalsContact C-N 3.28Å; L504-R506 PolarHBondContact O-N 2.91Å; R506-A510 VanDerWaalsContact O-CB 3.25Å; R506-A510 WeakPolarHBondContact O-CB 3.45Å; R506-A510 PolarHBondContact O-N 3.29Å
507	E	35.9	Very low	33.9	Very low	129 Å²	129	145.7 Å²	145.7	60%	0.603	71%	0.705	S	S	*	*	H	α-helix	trans	-72	-32	173.1	-63.5	-168.1	154.4	0	0	113.7	N505 K511	N505-E507 PolarHBondContact O-N 3.11Å; E507-K511 WeakPolarHBondContact O-CB 3.24Å; E507-K511 VanDerWaalsContact O-CG 3.26Å; E507-K511 WeakPolarHBondContact O-CG 3.25Å; E507-K511 PolarHBondContact O-N 2.82Å
508	L	37.9	Very low	34.1	Very low	120 Å²	120	148.2 Å²	148.2	63%	0.628	70%	0.703	S	S	*	*	H	α-helix	trans	-75.9	-38	175.7	-65.3	177.2	0	0	0	111.2	N505 A510	N505-L508 HydrophobicContact CB-CD1 4.18Å; N505-L508 HydrophobicContact CB-CG 4.44Å; N505-L508 PolarHBondContact O-N 2.88Å; L508-A510 VanDerWaalsContact C-N 3.32Å; L508-A510 PolarHBondContact O-N 3.45Å
509	A	34.9	Very low	34.6	Very low	73 Å²	73	152.6 Å²	152.6	60%	0.603	71%	0.712	S	S	*	*	H	α-helix	trans	-67.2	-30.8	172.3	0	0	0	0	0	112.9	N505	N505-A509 PolarHBondContact O-N 2.86Å
510	A	37.9	Very low	34.8	Very low	61 Å²	61	148.5 Å²	148.5	50%	0.504	71%	0.707	S	S	.	*	H	α-helix	trans	-79.7	-37.5	178.2	0	0	0	0	0	113.3	R506 L508 S512	R506-A510 VanDerWaalsContact O-CB 3.25Å; R506-A510 WeakPolarHBondContact O-CB 3.45Å; R506-A510 PolarHBondContact O-N 3.29Å; L508-A510 VanDerWaalsContact C-N 3.32Å; L508-A510 PolarHBondContact O-N 3.45Å; A510-S512 PolarHBondContact O-N 2.82Å
511	K	36.6	Very low	34.9	Very low	155 Å²	155	147.9 Å²	147.9	67%	0.674	70%	0.703	S	S	*	*	H	α-helix	trans	-71	-11.9	178.6	-73.8	170	-179.6	170.8	0	113.8	E507 R513	E507-K511 WeakPolarHBondContact O-CB 3.24Å; E507-K511 VanDerWaalsContact O-CG 3.26Å; E507-K511 WeakPolarHBondContact O-CG 3.25Å; E507-K511 PolarHBondContact O-N 2.82Å; K511-R513 VanDerWaalsContact C-N 3.28Å; K511-R513 PolarHBondContact O-N 2.94Å
512	S	38	Very low	35.2	Very low	74 Å²	74	149.8 Å²	149.8	52%	0.517	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.5	-4.5	177.8	-166.9	0	0	0	0	115.2	A510	A510-S512 PolarHBondContact O-N 2.82Å
513	R	34.7	Very low	35.4	Very low	209 Å²	209	145.6 Å²	145.6	79%	0.789	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-9.5	-171.3	-76.3	-177	169.5	177.3	-5.9	116.3	K511	K511-R513 VanDerWaalsContact C-N 3.28Å; K511-R513 PolarHBondContact O-N 2.94Å
514	N	39.5	Very low	35.4	Very low	149 Å²	149	146.6 Å²	146.6	80%	0.797	71%	0.705	S	S	*	*	S	Bend	trans	-120	18.5	-170.3	-70.6	12	0	0	0	114.4
515	N	33.7	Very low	35.5	Very low	129 Å²	129	145 Å²	145	69%	0.69	70%	0.696	S	S	*	*			trans	-139.4	117.1	177.2	-102.3	-30.9	0	0	0	111.5	N517	N515-N517 PolarHBondContact O-N 3.44Å
516	H	39.3	Very low	35.7	Very low	181 Å²	181	146.4 Å²	146.4	84%	0.838	71%	0.708	S	S	*	*	S	Bend	trans	-73.5	-3.8	-171.6	-107.2	-60.3	0	0	0	115.6
517	N	35.8	Very low	35.6	Very low	157 Å²	157	141.6 Å²	141.6	84%	0.84	70%	0.697	S	S	*	*			trans	-108.1	35.8	-171.2	-75.6	3.4	0	0	0	114.7	N515	N515-N517 PolarHBondContact O-N 3.44Å
518	Y	33.7	Very low	35.7	Very low	131 Å²	131	138.6 Å²	138.6	51%	0.514	69%	0.69	S	S	.	*			trans	-119.2	18.8	-172.4	-117.9	-101.7	0	0	0	117	N520 K521	Y518-N520 PolarHBondContact O-N 3.14Å; Y518-K521 HydrophobicContact CD1-CB 4.12Å; Y518-K521 HydrophobicContact CD1-CG 4.3Å; Y518-K521 HydrophobicContact CE1-CB 3.92Å; Y518-K521 HydrophobicContact CE1-CD 3.6Å; Y518-K521 HydrophobicContact CE1-CG 3.86Å; Y518-K521 PolarHBondContact OH-NZ 3.46Å
519	Y	36.7	Very low	35.9	Very low	220 Å²	220	140.9 Å²	140.9	86%	0.863	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	-15.6	-178.8	-96	-84.2	0	0	0	115.6
520	N	34.9	Very low	36.2	Very low	149 Å²	149	138.3 Å²	138.3	80%	0.797	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	14.5	-173.3	-76.3	-5.6	0	0	0	116.2	Y518	Y518-N520 PolarHBondContact O-N 3.14Å
521	K	32.4	Very low	36.5	Very low	143 Å²	143	138 Å²	138	62%	0.622	67%	0.665	S	S	*	*			trans	-100.9	90.3	169.4	-68.7	-152.2	-172.1	167.8	0	112.2	Y518 I523	Y518-K521 HydrophobicContact CD1-CB 4.12Å; Y518-K521 HydrophobicContact CD1-CG 4.3Å; Y518-K521 HydrophobicContact CE1-CB 3.92Å; Y518-K521 HydrophobicContact CE1-CD 3.6Å; Y518-K521 HydrophobicContact CE1-CG 3.86Å; Y518-K521 PolarHBondContact OH-NZ 3.46Å; K521-I523 PolarHBondContact O-N 3.45Å; K521-I523 VanDerWaalsContact O-N 3.16Å
522	Q	37.2	Very low	37	Very low	174 Å²	174	136.9 Å²	136.9	81%	0.813	66%	0.66	S	S	*	*			trans	-49.5	117.4	170.4	-70.5	177	-4.5	0	0	111.3	R524	Q522-R524 PolarHBondContact O-N 3.16Å; Q522-R524 VanDerWaalsContact O-N 3.12Å
523	I	33.1	Very low	37.3	Very low	151 Å²	151	140.7 Å²	140.7	77%	0.774	66%	0.664	S	S	*	*			trans	-67.6	109.2	171	-62.3	172.5	0	0	0	107.3	K521 I525	K521-I523 PolarHBondContact O-N 3.45Å; K521-I523 VanDerWaalsContact O-N 3.16Å; I523-I525 HydrophobicContact CG2-CG1 4.45Å; I523-I525 PolarHBondContact O-N 3.01Å
524	R	30.2	Very low	37.7	Very low	232 Å²	232	134.2 Å²	134.2	88%	0.875	65%	0.645	S	S	*	*			trans	-67.8	91.9	174.4	-83.8	-172.1	171.3	-172.9	-1.7	110.6	Q522 V526	Q522-R524 PolarHBondContact O-N 3.16Å; Q522-R524 VanDerWaalsContact O-N 3.12Å; R524-V526 PolarHBondContact O-N 3.01Å
525	I	32.6	Very low	38	Very low	139 Å²	139	132.7 Å²	132.7	71%	0.713	63%	0.628	S	S	*	*			trans	-70.7	104.8	165.1	-58.1	177	0	0	0	107.6	I523 V527	I523-I525 HydrophobicContact CG2-CG1 4.45Å; I523-I525 PolarHBondContact O-N 3.01Å; I525-V527 VanDerWaalsContact C-N 3.33Å; I525-V527 HydrophobicContact CG2-CG2 4.02Å; I525-V527 PolarHBondContact O-N 3.19Å
526	V	36	Very low	38.6	Very low	128 Å²	128	132 Å²	132	78%	0.776	63%	0.625	S	S	*	*			trans	-79.7	85.2	174.5	-176.2	0	0	0	0	108.6	R524 P528	R524-V526 PolarHBondContact O-N 3.01Å; V526-P528 WeakPolarHBondContact O-CD 3.46Å
527	V	37	Very low	38.5	Very low	69 Å²	69	127 Å²	127	42%	0.418	61%	0.605	S	S	.	*			trans	-61.5	120.9	172.7	-179.2	0	0	0	0	108.9	I525 V531 K532	I525-V527 VanDerWaalsContact C-N 3.33Å; I525-V527 HydrophobicContact CG2-CG2 4.02Å; I525-V527 PolarHBondContact O-N 3.19Å; V527-V531 HydrophobicContact CG1-CB 3.75Å; V527-V531 HydrophobicContact CG1-CG1 3.69Å; V527-K532 HydrophobicContact CG1-CB 4.27Å
528	P	38.4	Very low	38.7	Very low	67 Å²	67	124.1 Å²	124.1	44%	0.435	59%	0.594	S	S	.	*			trans	-57.3	143.7	178.9	-25.6	34.7	0	0	0	111.6	V526 A530 V531 K532	V526-P528 WeakPolarHBondContact O-CD 3.46Å; P528-A530 PolarHBondContact O-N 3.34Å; P528-V531 HydrophobicContact CB-CG2 4.25Å; P528-V531 HydrophobicContact CG-CG2 4.25Å; P528-V531 PolarHBondContact O-N 3.48Å; P528-K532 PolarHBondContact O-N 2.89Å
529	K	41.1	Very low	38.8	Very low	167 Å²	167	122.5 Å²	122.5	73%	0.726	60%	0.598	S	S	*	*	H	α-helix	trans	-53.6	-33.4	-179.7	-73.8	-177.8	179.9	175.6	0	112.8	K532 Y533	K529-K532 PolarHBondContact O-N 3.42Å; K529-Y533 VanDerWaalsContact O-CB 3.24Å; K529-Y533 WeakPolarHBondContact O-CB 3.47Å; K529-Y533 PolarHBondContact O-N 2.73Å
530	A	42	Very low	39	Very low	19 Å²	19	122 Å²	122	16%	0.157	60%	0.6	C	S	.	*	H	α-helix	trans	-65.8	-41.9	175.3	0	0	0	0	0	113	P528 Y533 L534 F569	P528-A530 PolarHBondContact O-N 3.34Å; A530-Y533 PolarHBondContact O-N 2.93Å; A530-L534 WeakPolarHBondContact O-CG 3.4Å; A530-L534 PolarHBondContact O-N 3.44Å; A530-F569 HydrophobicContact CB-CD1 4.3Å
531	V	43.4	Very low	38.8	Very low	55 Å²	55	120.3 Å²	120.3	33%	0.333	58%	0.582	S	S	.	*	H	α-helix	trans	-66.1	-45.9	174.3	179.4	0	0	0	0	109.6	V527 P528 Y533 L534 Y535	V527-V531 HydrophobicContact CG1-CB 3.75Å; V527-V531 HydrophobicContact CG1-CG1 3.69Å; P528-V531 HydrophobicContact CB-CG2 4.25Å; P528-V531 HydrophobicContact CG-CG2 4.25Å; P528-V531 PolarHBondContact O-N 3.48Å; V531-Y533 PolarHBondContact O-N 2.86Å; V531-L534 WeakPolarHBondContact O-CB 3.41Å; V531-L534 PolarHBondContact O-N 2.75Å; V531-L534 VanDerWaalsContact O-N 3.09Å; V531-Y535 HydrophobicContact CG1-CD2 4.06Å; V531-Y535 HydrophobicContact CG1-CE2 4.09Å; V531-Y535 WeakPolarHBondContact O-CD2 3.49Å; V531-Y535 PolarHBondContact O-N 3.03Å
532	K	47.4	Very low	38.7	Very low	131 Å²	131	119.4 Å²	119.4	57%	0.57	58%	0.583	S	S	*	*	H	α-helix	trans	-61.1	-28.1	174.7	-162.3	166.8	-172.5	168.6	0	112.9	V527 P528 K529 N536	V527-K532 HydrophobicContact CG1-CB 4.27Å; P528-K532 PolarHBondContact O-N 2.89Å; K529-K532 PolarHBondContact O-N 3.42Å; K532-N536 WeakPolarHBondContact O-CB 3.42Å; K532-N536 PolarHBondContact O-N 2.94Å; K532-N536 PolarHBondContact O-OD1 3.45Å
533	Y	43.2	Very low	38.4	Very low	154 Å²	154	114.9 Å²	114.9	60%	0.604	57%	0.569	S	S	*	*	H	α-helix	trans	-78.9	-32.7	175.2	-165.3	-91.2	0	0	0	112.8	K529 A530 V531 N536 N537	K529-Y533 VanDerWaalsContact O-CB 3.24Å; K529-Y533 WeakPolarHBondContact O-CB 3.47Å; K529-Y533 PolarHBondContact O-N 2.73Å; A530-Y533 PolarHBondContact O-N 2.93Å; V531-Y533 PolarHBondContact O-N 2.86Å; Y533-N536 PolarHBondContact O-N 2.78Å; Y533-N537 HydrophobicContact CE1-CB 4.47Å; Y533-N537 WeakPolarHBondContact CE1-ND2 3.23Å; Y533-N537 WeakPolarHBondContact O-CB 3.27Å; Y533-N537 PolarHBondContact O-N 3.45Å; Y533-N537 PolarHBondContact O-ND2 3.44Å
534	L	43.9	Very low	38.2	Very low	73 Å²	73	112.6 Å²	112.6	38%	0.382	55%	0.55	S	S	.	*	H	α-helix	trans	-67.3	-35.8	169.4	-74.7	164.1	0	0	0	112	A530 V531 N537 V539	A530-L534 WeakPolarHBondContact O-CG 3.4Å; A530-L534 PolarHBondContact O-N 3.44Å; V531-L534 WeakPolarHBondContact O-CB 3.41Å; V531-L534 PolarHBondContact O-N 2.75Å; V531-L534 VanDerWaalsContact O-N 3.09Å; L534-N537 CarbonylContact O-C 3.54Å; L534-N537 PolarHBondContact O-N 2.85Å; L534-V539 HydrophobicContact CD2-CG2 3.88Å
535	Y	45.1	Very low	38.4	Very low	117 Å²	117	104.3 Å²	104.3	46%	0.459	53%	0.526	S	S	.	.	H	α-helix	trans	-64.2	-45	169.1	-92	-86.9	0	0	0	112.2	E437 V531 N537	E437-Y535 VanDerWaalsContact CG-OH 3.24Å; E437-Y535 WeakPolarHBondContact CG-OH 3.18Å; E437-Y535 VanDerWaalsContact OE1-CE1 3.26Å; E437-Y535 WeakPolarHBondContact OE1-CE1 3.47Å; E437-Y535 PolarHBondContact OE1-OH 3.14Å; E437-Y535 PolarHBondContact OE2-OH 2.94Å; V531-Y535 HydrophobicContact CG1-CD2 4.06Å; V531-Y535 HydrophobicContact CG1-CE2 4.09Å; V531-Y535 WeakPolarHBondContact O-CD2 3.49Å; V531-Y535 PolarHBondContact O-N 3.03Å; Y535-N537 VanDerWaalsContact C-N 3.25Å; Y535-N537 PolarHBondContact O-N 3.21Å
536	N	46.5	Very low	38.6	Very low	116 Å²	116	102 Å²	102	62%	0.62	52%	0.515	S	S	*	.	H	α-helix	trans	-72.2	-17.3	178.1	-67.7	-1	0	0	0	113.6	K532 Y533	K532-N536 WeakPolarHBondContact O-CB 3.42Å; K532-N536 PolarHBondContact O-N 2.94Å; K532-N536 PolarHBondContact O-OD1 3.45Å; Y533-N536 PolarHBondContact O-N 2.78Å
537	N	38.3	Very low	38.5	Very low	76 Å²	76	100.5 Å²	100.5	41%	0.406	50%	0.499	S	S	.	.	S	Bend	trans	-139.6	77.1	-178.5	-57.9	-86.1	0	0	0	109.3	Y533 L534 Y535 V539	Y533-N537 HydrophobicContact CE1-CB 4.47Å; Y533-N537 WeakPolarHBondContact CE1-ND2 3.23Å; Y533-N537 WeakPolarHBondContact O-CB 3.27Å; Y533-N537 PolarHBondContact O-N 3.45Å; Y533-N537 PolarHBondContact O-ND2 3.44Å; L534-N537 CarbonylContact O-C 3.54Å; L534-N537 PolarHBondContact O-N 2.85Å; Y535-N537 VanDerWaalsContact C-N 3.25Å; Y535-N537 PolarHBondContact O-N 3.21Å; N537-V539 PolarHBondContact O-N 3.05Å
538	P	38.8	Very low	38.3	Very low	96 Å²	96	99.7 Å²	99.7	62%	0.623	50%	0.496	S	S	*	.			trans	-59.3	123.5	178.4	23.6	-33.3	0	0	0	110.1	K540	P538-K540 PolarHBondContact O-N 3.33Å
539	V	35.9	Very low	37.9	Very low	96 Å²	96	101.9 Å²	101.9	58%	0.582	51%	0.514	S	S	*	.			trans	-69.4	96.9	179.6	177.1	0	0	0	0	108.5	L534 N537 R541	L534-V539 HydrophobicContact CD2-CG2 3.88Å; N537-V539 PolarHBondContact O-N 3.05Å; V539-R541 VanDerWaalsContact CG1-O 3.3Å; V539-R541 WeakPolarHBondContact CG1-O 3.36Å; V539-R541 PolarHBondContact O-N 3.36Å
540	K	40.9	Very low	37.4	Very low	210 Å²	210	98.9 Å²	98.9	91%	0.913	51%	0.505	S	S	*	.	S	Bend	trans	-58.8	-19.9	-173.8	-64.1	-173.9	177.6	-175.8	0	114.5	P538	P538-K540 PolarHBondContact O-N 3.33Å
541	R	31.1	Very low	37	Very low	113 Å²	113	103 Å²	103	43%	0.426	52%	0.524	S	S	.	.			trans	-155.9	129	178.3	-153.6	175.1	-171.1	-103.3	14.2	109.4	V539 P543 E547	V539-R541 VanDerWaalsContact CG1-O 3.3Å; V539-R541 WeakPolarHBondContact CG1-O 3.36Å; V539-R541 PolarHBondContact O-N 3.36Å; R541-P543 WeakPolarHBondContact O-CD 3.19Å; R541-E547 IonicContact CZ-OE1 3.87Å; R541-E547 IonicContact NH1-OE1 2.74Å; R541-E547 PolarHBondContact NH1-OE1 2.94Å; R541-E547 IonicContact NH1-OE2 3.53Å; R541-E547 PolarHBondContact NH1-OE2 3.14Å; R541-E547 IonicContact NH2-OE1 2.68Å
542	I	31	Very low	36.3	Very low	125 Å²	125	105.8 Å²	105.8	64%	0.641	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-78.8	120.4	169	-60.1	173.4	0	0	0	107
543	P	30.5	Very low	35.5	Very low	78 Å²	78	106.8 Å²	106.8	51%	0.506	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-62.8	139.1	178.3	-21.1	33.2	0	0	0	111.1	R541	R541-P543 WeakPolarHBondContact O-CD 3.19Å
544	R	29.5	Very low	34.9	Very low	103 Å²	103	106.3 Å²	106.3	39%	0.389	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-73.7	148.3	172	-62.4	-178	176.2	-166	-0.6	109.2	N546 E547	R544-N546 PolarHBondContact O-N 3.31Å; R544-E547 HydrophobicContact CB-CG 4.04Å; R544-E547 PolarHBondContact N-OE2 3.49Å; R544-E547 PolarHBondContact O-N 3.01Å
545	V	34.8	Very low	34.4	Very low	59 Å²	59	107.2 Å²	107.2	36%	0.358	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-53.3	-25.6	-179.7	-175.9	0	0	0	0	112.6	S548 L578 L582	V545-S548 PolarHBondContact O-OG 2.95Å; V545-L578 HydrophobicContact CG2-CB 3.89Å; V545-L578 HydrophobicContact CG2-CD1 4.18Å; V545-L578 HydrophobicContact CG2-CD2 3.67Å; V545-L578 HydrophobicContact CG2-CG 4.08Å; V545-L582 HydrophobicContact CB-CD1 4.39Å; V545-L582 HydrophobicContact CG1-CD1 4.04Å; V545-L582 HydrophobicContact CG2-CD1 4.03Å
546	N	35.4	Very low	33.7	Very low	91 Å²	91	108.1 Å²	108.1	49%	0.487	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.4	-4	-173.8	-50.6	-7.1	0	0	0	112.9	N404 R544 S548	N404-N546 WeakPolarHBondContact CB-ND2 3.49Å; N404-N546 PolarHBondContact ND2-ND2 3.18Å; N404-N546 WeakPolarHBondContact OD1-CB 3.21Å; R544-N546 PolarHBondContact O-N 3.31Å; N546-S548 PolarHBondContact O-N 3.28Å; N546-S548 VanDerWaalsContact O-N 3.17Å
547	E	33.9	Very low	32.8	Very low	96 Å²	96	110.8 Å²	110.8	45%	0.449	59%	0.593	S	S	.	*	S	Bend	trans	-84.9	34.2	177.1	-70.4	171.9	154.3	0	0	112.1	R541 R544	R541-E547 IonicContact CZ-OE1 3.87Å; R541-E547 IonicContact NH1-OE1 2.74Å; R541-E547 PolarHBondContact NH1-OE1 2.94Å; R541-E547 IonicContact NH1-OE2 3.53Å; R541-E547 PolarHBondContact NH1-OE2 3.14Å; R541-E547 IonicContact NH2-OE1 2.68Å; R544-E547 HydrophobicContact CB-CG 4.04Å; R544-E547 PolarHBondContact N-OE2 3.49Å; R544-E547 PolarHBondContact O-N 3.01Å
548	S	33.4	Very low	32.3	Very low	51 Å²	51	115.1 Å²	115.1	36%	0.357	62%	0.615	S	S	.	*			trans	-148.1	45.3	-172.5	61.7	0	0	0	0	115.9	V545 N546 N550 I551	V545-S548 PolarHBondContact O-OG 2.95Å; N546-S548 PolarHBondContact O-N 3.28Å; N546-S548 VanDerWaalsContact O-N 3.17Å; S548-N550 PolarHBondContact O-N 3.42Å; S548-I551 PolarHBondContact O-N 2.86Å; S548-I551 VanDerWaalsContact OG-CD1 3.25Å; S548-I551 WeakPolarHBondContact OG-CD1 3.32Å
549	S	29.9	Very low	31.8	Very low	114 Å²	114	118 Å²	118	80%	0.797	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	61.5	159	56.5	0	0	0	0	112
550	N	30.8	Very low	31.4	Very low	104 Å²	104	122 Å²	122	56%	0.556	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.5	6.4	168.4	-96.2	-29.9	0	0	0	113.2	S548 C552 Q553	S548-N550 PolarHBondContact O-N 3.42Å; N550-C552 PolarHBondContact O-N 2.86Å; N550-C552 VanDerWaalsContact O-N 3.1Å; N550-Q553 PolarHBondContact O-N 3.41Å; N550-Q553 VanDerWaalsContact O-N 3.1Å
551	I	32.6	Very low	30.8	Very low	106 Å²	106	116.5 Å²	116.5	54%	0.544	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.8	-20.4	-178.7	-75.2	174.3	0	0	0	113.4	S548	S548-I551 PolarHBondContact O-N 2.86Å; S548-I551 VanDerWaalsContact OG-CD1 3.25Å; S548-I551 WeakPolarHBondContact OG-CD1 3.32Å
552	C	29.1	Very low	30.8	Very low	112 Å²	112	116.8 Å²	116.8	76%	0.757	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-5.1	176.4	-68.2	0	0	0	0	115.6	N550 T555	N550-C552 PolarHBondContact O-N 2.86Å; N550-C552 VanDerWaalsContact O-N 3.1Å; C552-T555 PolarHBondContact O-OG1 3.19Å
553	Q	32	Very low	30.9	Very low	152 Å²	152	116.8 Å²	116.8	71%	0.71	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-18.8	173.3	-69.3	-174.2	-3.4	0	0	112.9	N550 T555	N550-Q553 PolarHBondContact O-N 3.41Å; N550-Q553 VanDerWaalsContact O-N 3.1Å; Q553-T555 PolarHBondContact O-N 2.9Å
554	L	30.4	Very low	31.5	Very low	144 Å²	144	117.6 Å²	117.6	75%	0.754	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	13	179.9	-98.4	151.5	0	0	0	114.6
555	T	32.5	Very low	31.9	Very low	93 Å²	93	119.3 Å²	119.3	57%	0.571	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	-4.8	-178.4	45	0	0	0	0	114.8	C552 Q553	C552-T555 PolarHBondContact O-OG1 3.19Å; Q553-T555 PolarHBondContact O-N 2.9Å
556	N	29.9	Very low	32.1	Very low	135 Å²	135	121 Å²	121	72%	0.722	67%	0.67	S	S	*	*	S	Bend	trans	-120.1	9.2	-170.3	-75.6	-9.3	0	0	0	115.8
557	L	29.3	Very low	32.2	Very low	172 Å²	172	120 Å²	120	90%	0.901	67%	0.671	S	S	*	*			trans	-114.8	80.1	168.6	-75.6	172.7	0	0	0	110.1
558	L	26.6	Very low	32.6	Very low	167 Å²	167	121.2 Å²	121.2	87%	0.874	68%	0.679	S	S	*	*			trans	-72.1	122.2	155.7	-69.9	160.1	0	0	0	107.6
559	D	28.2	Very low	33	Very low	158 Å²	158	124.6 Å²	124.6	85%	0.845	69%	0.688	S	S	*	*			trans	-152.1	161.5	135.2	-138.8	-19.6	0	0	0	112
560	E	28.2	Very low	33.6	Very low	178 Å²	178	121.7 Å²	121.7	83%	0.832	67%	0.665	S	S	*	*			trans	-76.8	123.2	-161.4	-56.6	-175.8	136.7	0	0	114.2
561	S	28.8	Very low	34.1	Very low	95 Å²	95	124.6 Å²	124.6	66%	0.664	67%	0.668	S	S	*	*			trans	171.3	129.9	132.1	43.9	0	0	0	0	115.3	T563	S561-T563 PolarHBondContact O-N 3.41Å
562	S	31.1	Very low	34.8	Very low	119 Å²	119	121.5 Å²	121.5	83%	0.832	66%	0.662	S	S	*	*			trans	31.8	77.1	151	62.9	0	0	0	0	120.3
563	T	32.5	Very low	35.6	Very low	125 Å²	125	120.6 Å²	120.6	77%	0.767	65%	0.649	S	S	*	*			trans	-138.9	84.9	173.4	40.7	0	0	0	0	116.1	S561	S561-T563 PolarHBondContact O-N 3.41Å
564	D	43.2	Very low	36.1	Very low	95 Å²	95	117.1 Å²	117.1	51%	0.508	64%	0.635	S	S	.	*			trans	43.8	115.5	145.7	-106.5	-32.3	0	0	0	121	K566 S567	D564-K566 HydrophobicContact CB-CB 4.22Å; D564-K566 HydrophobicContact CB-CD 4.47Å; D564-K566 HydrophobicContact CB-CG 4.17Å; D564-K566 PolarHBondContact O-N 3.09Å; D564-K566 IonicContact OD1-NZ 3.95Å; D564-K566 PolarHBondContact OD1-NZ 3.38Å; D564-K566 IonicContact OD2-NZ 3.73Å; D564-K566 PolarHBondContact OD2-NZ 3.45Å; D564-S567 PolarHBondContact O-N 3.11Å; D564-S567 VanDerWaalsContact O-N 3.11Å; D564-S567 PolarHBondContact O-OG 3.38Å; D564-S567 VanDerWaalsContact O-OG 3.06Å
565	D	36.9	Very low	36.8	Very low	140 Å²	140	115.1 Å²	115.1	75%	0.749	62%	0.622	S	S	*	*	H	α-helix	trans	-47.2	-22.3	165.5	-67.9	-39.1	0	0	0	114.4	S567 F569	D565-S567 VanDerWaalsContact C-N 3.31Å; D565-S567 PolarHBondContact O-N 2.96Å; D565-F569 PolarHBondContact O-N 3.21Å
566	K	38.5	Very low	37.4	Very low	93 Å²	93	114 Å²	114	40%	0.404	61%	0.609	S	S	.	*	H	α-helix	trans	-59.3	-38	179.9	-53.4	-176.1	-176	93.6	0	112.6	D564 V570	D564-K566 HydrophobicContact CB-CB 4.22Å; D564-K566 HydrophobicContact CB-CD 4.47Å; D564-K566 HydrophobicContact CB-CG 4.17Å; D564-K566 PolarHBondContact O-N 3.09Å; D564-K566 IonicContact OD1-NZ 3.95Å; D564-K566 PolarHBondContact OD1-NZ 3.38Å; D564-K566 IonicContact OD2-NZ 3.73Å; D564-K566 PolarHBondContact OD2-NZ 3.45Å; K566-V570 WeakPolarHBondContact O-CG2 3.34Å; K566-V570 PolarHBondContact O-N 3.45Å
567	S	39.4	Very low	37.8	Very low	71 Å²	71	112.4 Å²	112.4	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-71.1	-44.2	-176.5	64.3	0	0	0	0	111.7	D564 D565 R571	D564-S567 PolarHBondContact O-N 3.11Å; D564-S567 VanDerWaalsContact O-N 3.11Å; D564-S567 PolarHBondContact O-OG 3.38Å; D564-S567 VanDerWaalsContact O-OG 3.06Å; D565-S567 VanDerWaalsContact C-N 3.31Å; D565-S567 PolarHBondContact O-N 2.96Å; S567-R571 WeakPolarHBondContact O-CB 3.49Å; S567-R571 PolarHBondContact O-N 3.02Å; S567-R571 VanDerWaalsContact O-N 3.1Å
568	I	41.7	Very low	38.3	Very low	122 Å²	122	106.7 Å²	106.7	63%	0.626	56%	0.564	S	S	*	*	H	α-helix	trans	-63.7	-43.8	179.6	-57.3	175.1	0	0	0	110.5	R571 G572	I568-R571 PolarHBondContact O-N 2.85Å; I568-G572 PolarHBondContact O-N 2.99Å
569	F	41.9	Very low	39.1	Very low	121 Å²	121	104 Å²	104	53%	0.531	55%	0.547	S	S	.	.	H	α-helix	trans	-62.3	-47.3	179.7	179.3	-99.7	0	0	0	112.9	A530 D565 G572 L573	A530-F569 HydrophobicContact CB-CD1 4.3Å; D565-F569 PolarHBondContact O-N 3.21Å; F569-G572 PolarHBondContact O-N 3.41Å; F569-L573 HydrophobicContact CZ-CD1 4.17Å; F569-L573 PolarHBondContact O-N 3.03Å
570	V	41.9	Very low	39.6	Very low	54 Å²	54	98 Å²	98	33%	0.327	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-42.2	179.7	173.3	0	0	0	0	110.9	K566 G572 L573 L574	K566-V570 WeakPolarHBondContact O-CG2 3.34Å; K566-V570 PolarHBondContact O-N 3.45Å; V570-G572 PolarHBondContact O-N 2.92Å; V570-L573 PolarHBondContact O-N 3.47Å; V570-L574 HydrophobicContact CG1-CD1 4.06Å; V570-L574 PolarHBondContact O-N 3.2Å; V570-L574 VanDerWaalsContact O-N 3.08Å
571	R	41.2	Very low	40.2	Very low	165 Å²	165	93.5 Å²	93.5	62%	0.623	50%	0.5	S	S	*	.	H	α-helix	trans	-61.3	-41.8	175.9	-169.8	170.6	174.2	170.9	-2.4	111.9	S567 I568 Q575	S567-R571 WeakPolarHBondContact O-CB 3.49Å; S567-R571 PolarHBondContact O-N 3.02Å; S567-R571 VanDerWaalsContact O-N 3.1Å; I568-R571 PolarHBondContact O-N 2.85Å; R571-Q575 WeakPolarHBondContact O-CB 3.13Å; R571-Q575 PolarHBondContact O-N 3.21Å
572	G	47.5	Very low	40.5	Very low	40 Å²	40	94.1 Å²	94.1	41%	0.412	50%	0.495	S	S	.	.	H	α-helix	trans	-66	-39.1	175.1	0	0	0	0	0	114	I568 F569 V570 F576	I568-G572 PolarHBondContact O-N 2.99Å; F569-G572 PolarHBondContact O-N 3.41Å; V570-G572 PolarHBondContact O-N 2.92Å; G572-F576 WeakPolarHBondContact O-CB 3.29Å; G572-F576 PolarHBondContact O-N 2.99Å
573	L	45.7	Very low	40.8	Very low	93 Å²	93	95.8 Å²	95.8	49%	0.487	49%	0.487	S	S	.	.	H	α-helix	trans	-67.5	-42.4	179	-154.5	89.5	0	0	0	112	F569 V570 Y577	F569-L573 HydrophobicContact CZ-CD1 4.17Å; F569-L573 PolarHBondContact O-N 3.03Å; V570-L573 PolarHBondContact O-N 3.47Å; L573-Y577 PolarHBondContact O-N 2.97Å
574	L	42	Very low	40.9	Very low	79 Å²	79	96 Å²	96	41%	0.414	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-49.4	174	-88	155.6	0	0	0	111.3	V570 F576 Y577 L578	V570-L574 HydrophobicContact CG1-CD1 4.06Å; V570-L574 PolarHBondContact O-N 3.2Å; V570-L574 VanDerWaalsContact O-N 3.08Å; L574-F576 VanDerWaalsContact C-N 3.3Å; L574-F576 PolarHBondContact O-N 2.68Å; L574-Y577 PolarHBondContact O-N 3.44Å; L574-Y577 VanDerWaalsContact O-N 3.07Å; L574-L578 WeakPolarHBondContact O-CG 3.46Å; L574-L578 PolarHBondContact O-N 2.98Å
575	Q	45.7	Very low	40.2	Very low	103 Å²	103	98.8 Å²	98.8	48%	0.481	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-37.2	-179.7	-173.1	165.7	-7.3	0	0	112.6	R571 Y577 Q579	R571-Q575 WeakPolarHBondContact O-CB 3.13Å; R571-Q575 PolarHBondContact O-N 3.21Å; Q575-Y577 PolarHBondContact O-N 3.27Å; Q575-Q579 WeakPolarHBondContact O-CB 3.45Å; Q575-Q579 WeakPolarHBondContact O-CG 3.39Å; Q575-Q579 PolarHBondContact O-N 3.38Å; Q575-Q579 VanDerWaalsContact O-N 3.08Å
576	F	45.4	Very low	39.9	Very low	69 Å²	69	96.9 Å²	96.9	30%	0.303	50%	0.495	S	S	.	.	H	α-helix	trans	-61.3	-41.1	172.7	176.4	-94	0	0	0	112.5	G572 L574 N580	G572-F576 WeakPolarHBondContact O-CB 3.29Å; G572-F576 PolarHBondContact O-N 2.99Å; L574-F576 VanDerWaalsContact C-N 3.3Å; L574-F576 PolarHBondContact O-N 2.68Å; F576-N580 WeakPolarHBondContact CD2-ND2 3.28Å; F576-N580 VanDerWaalsContact CE2-ND2 3.28Å; F576-N580 WeakPolarHBondContact CE2-ND2 3.45Å; F576-N580 PolarHBondContact O-N 3.19Å; F576-N580 PolarHBondContact O-ND2 3.35Å
577	Y	38.5	Very low	39.7	Very low	101 Å²	101	98.4 Å²	98.4	40%	0.396	51%	0.514	S	S	.	.	H	α-helix	trans	-65.5	-49.7	178.2	-114.5	-85	0	0	0	111.6	L444 L573 L574 Q575 Q579 N580 T581	L444-Y577 HydrophobicContact CD1-CE2 4.44Å; L444-Y577 WeakPolarHBondContact CD1-OH 3.35Å; L573-Y577 PolarHBondContact O-N 2.97Å; L574-Y577 PolarHBondContact O-N 3.44Å; L574-Y577 VanDerWaalsContact O-N 3.07Å; Q575-Y577 PolarHBondContact O-N 3.27Å; Y577-Q579 PolarHBondContact O-N 3.36Å; Y577-N580 PolarHBondContact O-N 2.8Å; Y577-T581 PolarHBondContact O-N 2.94Å; Y577-T581 PolarHBondContact O-OG1 3.34Å; Y577-T581 VanDerWaalsContact O-OG1 3.12Å
578	L	40.3	Very low	39	Very low	53 Å²	53	100.7 Å²	100.7	28%	0.277	53%	0.53	S	S	.	.	H	α-helix	trans	-65.4	-36.4	-175.9	-59.8	174.1	0	0	0	112.9	V545 L574 T581	V545-L578 HydrophobicContact CG2-CB 3.89Å; V545-L578 HydrophobicContact CG2-CD1 4.18Å; V545-L578 HydrophobicContact CG2-CD2 3.67Å; V545-L578 HydrophobicContact CG2-CG 4.08Å; L574-L578 WeakPolarHBondContact O-CG 3.46Å; L574-L578 PolarHBondContact O-N 2.98Å; L578-T581 PolarHBondContact O-OG1 3.34Å
579	Q	43.2	Very low	38.6	Very low	109 Å²	109	100.2 Å²	100.2	51%	0.509	54%	0.538	S	S	.	.	H	α-helix	trans	-73.3	-23.1	177.5	-75.8	-176	-22.6	0	0	114.2	Q575 Y577 K583	Q575-Q579 WeakPolarHBondContact O-CB 3.45Å; Q575-Q579 WeakPolarHBondContact O-CG 3.39Å; Q575-Q579 PolarHBondContact O-N 3.38Å; Q575-Q579 VanDerWaalsContact O-N 3.08Å; Y577-Q579 PolarHBondContact O-N 3.36Å; Q579-K583 WeakPolarHBondContact O-CG 3.41Å
580	N	38.5	Very low	37.9	Very low	33 Å²	33	102.4 Å²	102.4	18%	0.176	56%	0.555	C	S	.	*	H	α-helix	trans	-94.3	-28.3	-177.5	-75.7	-65.2	0	0	0	113.5	Q455 F576 Y577	Q455-N580 PolarHBondContact NE2-OD1 2.94Å; F576-N580 WeakPolarHBondContact CD2-ND2 3.28Å; F576-N580 VanDerWaalsContact CE2-ND2 3.28Å; F576-N580 WeakPolarHBondContact CE2-ND2 3.45Å; F576-N580 PolarHBondContact O-N 3.19Å; F576-N580 PolarHBondContact O-ND2 3.35Å; Y577-N580 PolarHBondContact O-N 2.8Å
581	T	39.7	Very low	37.3	Very low	84 Å²	84	110.2 Å²	110.2	52%	0.515	58%	0.579	S	S	.	*	H	α-helix	trans	-70.1	-35.5	170.5	39.3	0	0	0	0	112.5	Y577 L578	Y577-T581 PolarHBondContact O-N 2.94Å; Y577-T581 PolarHBondContact O-OG1 3.34Å; Y577-T581 VanDerWaalsContact O-OG1 3.12Å; L578-T581 PolarHBondContact O-OG1 3.34Å
582	L	36.4	Very low	36.8	Very low	107 Å²	107	109.8 Å²	109.8	56%	0.56	59%	0.587	S	S	*	*	H	α-helix	trans	-74.1	-25.4	180	-73	173.4	0	0	0	114.4	V545 L584	V545-L582 HydrophobicContact CB-CD1 4.39Å; V545-L582 HydrophobicContact CG1-CD1 4.04Å; V545-L582 HydrophobicContact CG2-CD1 4.03Å; L582-L584 VanDerWaalsContact C-N 3.29Å; L582-L584 PolarHBondContact O-N 3.37Å
583	K	37.5	Very low	36	Very low	154 Å²	154	116.6 Å²	116.6	67%	0.67	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-10.1	-179.8	-79.4	-178	176.1	-177.9	0	115	Q579	Q579-K583 WeakPolarHBondContact O-CG 3.41Å
584	L	33.6	Very low	35.1	Very low	130 Å²	130	117 Å²	117	68%	0.681	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-4.5	179.2	-77.3	161.6	0	0	0	113.9	L582	L582-L584 VanDerWaalsContact C-N 3.29Å; L582-L584 PolarHBondContact O-N 3.37Å
585	L	29.5	Very low	34.4	Very low	154 Å²	154	120.4 Å²	120.4	81%	0.806	63%	0.633	S	S	*	*			trans	-116.2	96	170.1	-85.7	74.3	0	0	0	110
586	S	29.4	Very low	33.9	Very low	100 Å²	100	122.4 Å²	122.4	70%	0.699	65%	0.647	S	S	*	*			trans	-140.2	125.3	160.2	46.9	0	0	0	0	109.9
587	P	33.7	Very low	33.2	Very low	124 Å²	124	123.9 Å²	123.9	81%	0.805	67%	0.666	S	S	*	*			trans	-79.1	131.6	-176.4	30.4	-33.1	0	0	0	111	S589	P587-S589 PolarHBondContact O-N 3.22Å
588	S	25.6	Very low	32.9	Very low	119 Å²	119	124.6 Å²	124.6	83%	0.832	68%	0.681	S	S	*	*			trans	-66.1	113.9	170	54.8	0	0	0	0	110.6
589	S	33	Very low	32.6	Very low	112 Å²	112	127.9 Å²	127.9	78%	0.783	70%	0.703	S	S	*	*			trans	-147.9	126.3	164.3	-81.3	0	0	0	0	111.5	P587	P587-S589 PolarHBondContact O-N 3.22Å
590	N	27.5	Very low	31.9	Very low	167 Å²	167	126.5 Å²	126.5	89%	0.893	71%	0.711	S	S	*	*			trans	-55.8	130.3	-168.5	-56.1	-45	0	0	0	113.4
591	R	28.8	Very low	31.5	Very low	219 Å²	219	130.6 Å²	130.6	83%	0.826	74%	0.737	S	S	*	*			trans	-95.4	109.8	167.3	-169.8	176.5	-173.8	-173.8	1.7	109.4
592	I	30.2	Very low	31.1	Very low	155 Å²	155	133 Å²	133	80%	0.795	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-72.6	146.1	166.4	-67.5	175.4	0	0	0	108.6
593	Q	30.9	Very low	30.9	Very low	183 Å²	183	133.5 Å²	133.5	86%	0.855	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-60	139.5	-173.2	-73.2	163.9	-51	0	0	113.3
594	T	27.1	Very low	30.4	Very low	103 Å²	103	130.9 Å²	130.9	63%	0.632	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-92.6	144.6	162.2	48.4	0	0	0	0	109.6
595	D	28.7	Very low	30.2	Very low	149 Å²	149	129.6 Å²	129.6	80%	0.797	76%	0.757	S	S	*	*			trans	-142.9	158.3	157.4	-92.4	-40.1	0	0	0	110.8
596	N	33.4	Very low	30.3	Very low	145 Å²	145	129.2 Å²	129.2	78%	0.775	76%	0.755	S	S	*	*			trans	83	69.8	172.8	-55.5	-20.7	0	0	0	118.9
597	S	31.3	Very low	30.3	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	75%	0.754	S	S	*	*				51.3	153.4	107.4	71.3	0	0	0	0	123.6
598	T	33.2	Very low	30	Very low	116 Å²	116	131.3 Å²	131.3	71%	0.712	75%	0.754	S	S	*	*			trans	89.3	94.6	148.5	17.7	0	0	0	0	120.6
599	T	32.8	Very low	30.1	Very low	121 Å²	121	130.8 Å²	130.8	74%	0.742	75%	0.746	S	S	*	*				66.1	109.7	124.1	55.5	0	0	0	0	122.3
600	A	29.6	Very low	29.8	Very low	80 Å²	80	130.2 Å²	130.2	66%	0.661	74%	0.738	S	S	*	*				85.2	131.6	110.6	0	0	0	0	0	122
601	T	29.4	Very low	30.2	Very low	119 Å²	119	131.4 Å²	131.4	73%	0.73	74%	0.738	S	S	*	*			trans	74.9	123.9	139.2	45.2	0	0	0	0	121.8
602	D	30.8	Very low	30	Very low	134 Å²	134	126.1 Å²	126.1	72%	0.717	74%	0.735	S	S	*	*			trans	98.1	103.6	131.4	-63.4	-1.9	0	0	0	122.4
603	T	31.9	Very low	30.1	Very low	119 Å²	119	125.8 Å²	125.8	73%	0.73	74%	0.74	S	S	*	*				68	119	126.3	63	0	0	0	0	122.2
604	S	28.7	Very low	29.8	Very low	99 Å²	99	122.8 Å²	122.8	69%	0.692	74%	0.735	S	S	*	*			trans	65.3	118.1	132.4	64.4	0	0	0	0	121.4
605	S	28.3	Very low	29.9	Very low	102 Å²	102	125.6 Å²	125.6	71%	0.713	75%	0.745	S	S	*	*			trans	59.9	132.7	139.5	63.5	0	0	0	0	120
606	I	31.5	Very low	30	Very low	147 Å²	147	123 Å²	123	75%	0.754	74%	0.738	S	S	*	*				178.9	118.1	118.9	-93.4	160	0	0	0	112.5
607	I	30.1	Very low	29.6	Very low	135 Å²	135	122.4 Å²	122.4	69%	0.692	74%	0.74	S	S	*	*			trans	58.4	102.4	131.4	-52.4	-179	0	0	0	120.6
608	V	26.5	Very low	29.7	Very low	132 Å²	132	123 Å²	123	80%	0.8	74%	0.744	S	S	*	*				55.5	163.9	111.9	-177.8	0	0	0	0	120.9
609	T	29.1	Very low	29.5	Very low	109 Å²	109	121.7 Å²	121.7	67%	0.669	74%	0.74	S	S	*	*			trans	99.2	84.6	158.2	13.3	0	0	0	0	118.5
610	T	26.8	Very low	29.5	Very low	100 Å²	100	124.6 Å²	124.6	61%	0.613	74%	0.742	S	S	*	*				52.6	138	119.6	61	0	0	0	0	121.4
611	H	34.4	Very low	29.6	Very low	192 Å²	192	128.6 Å²	128.6	89%	0.889	75%	0.747	S	S	*	*				-168.2	139.6	108.6	-91.9	-61.9	0	0	0	111.6
612	S	26.3	Very low	29.8	Very low	108 Å²	108	127 Å²	127	76%	0.755	75%	0.746	S	S	*	*			trans	-99.5	155	-171.4	-29.8	0	0	0	0	112.6
613	T	30.9	Very low	29.9	Very low	147 Å²	147	127.1 Å²	127.1	90%	0.902	75%	0.752	S	S	*	*			trans	-155.7	138.8	139.4	-19.3	0	0	0	0	112.8
614	T	24.8	Very low	30.3	Very low	121 Å²	121	127.4 Å²	127.4	74%	0.742	76%	0.756	S	S	*	*			trans	-101.1	159.4	174.3	44.3	0	0	0	0	110.6
615	L	29.8	Very low	30.6	Very low	162 Å²	162	127.3 Å²	127.3	85%	0.848	76%	0.761	S	S	*	*			trans	170	149.7	132.2	-93	155.9	0	0	0	116
616	S	30.2	Very low	30.9	Very low	94 Å²	94	128.6 Å²	128.6	66%	0.657	77%	0.765	S	S	*	*			trans	77.4	91.6	144.8	50.8	0	0	0	0	124.5
617	T	26.1	Very low	31	Very low	133 Å²	133	128.4 Å²	128.4	82%	0.816	76%	0.764	S	S	*	*				67.2	145	113.3	55.3	0	0	0	0	125.2
618	S	32.3	Very low	31	Very low	112 Å²	112	128 Å²	128	78%	0.783	77%	0.767	S	S	*	*			trans	96.7	145.8	158.9	76.6	0	0	0	0	118.2
619	S	30.2	Very low	31.4	Very low	89 Å²	89	125.2 Å²	125.2	62%	0.622	76%	0.758	S	S	*	*			cis	-179.7	147.8	-39.1	50.6	0	0	0	0	111.3
620	F	32.6	Very low	31.6	Very low	183 Å²	183	125.4 Å²	125.4	80%	0.803	76%	0.76	S	S	*	*			trans	66.4	151.7	168.7	-60.2	-77.8	0	0	0	116.5
621	E	31.3	Very low	31.8	Very low	164 Å²	164	126.4 Å²	126.4	77%	0.766	77%	0.766	S	S	*	*			cis	-159.9	159.9	3.5	-141.2	153.2	-150	0	0	113.3
622	A	34.4	Very low	31.7	Very low	85 Å²	85	123.1 Å²	123.1	70%	0.702	76%	0.759	S	S	*	*			trans	51.7	139.7	152.3	0	0	0	0	0	121.8
623	T	32.1	Very low	32	Very low	136 Å²	136	122.3 Å²	122.3	83%	0.834	76%	0.759	S	S	*	*			cis	-162.7	150.5	8	8.6	0	0	0	0	111.1
624	P	40.2	Very low	32.2	Very low	126 Å²	126	122.4 Å²	122.4	82%	0.818	75%	0.752	S	S	*	*			trans	-121.4	175.1	-177.2	42.8	-32.6	0	0	0	116.5
625	A	35.4	Very low	32.4	Very low	96 Å²	96	123.8 Å²	123.8	79%	0.793	76%	0.755	S	S	*	*			trans	-144.9	-149.6	168.9	0	0	0	0	0	113.3
626	T	33.3	Very low	32.6	Very low	130 Å²	130	122.3 Å²	122.3	80%	0.798	75%	0.749	S	S	*	*			trans	-151.9	176.9	-151.6	11	0	0	0	0	112.2
627	I	34	Very low	32.6	Very low	143 Å²	143	124.1 Å²	124.1	73%	0.733	75%	0.75	S	S	*	*			cis	-149.9	132.7	18.5	-126	166	0	0	0	108.8
628	T	31.4	Very low	32.8	Very low	125 Å²	125	124.5 Å²	124.5	77%	0.767	75%	0.746	S	S	*	*				64.6	137.8	114.6	-37.9	0	0	0	0	116.9
629	A	34.1	Very low	32.7	Very low	74 Å²	74	124.6 Å²	124.6	61%	0.612	74%	0.738	S	S	*	*			cis	-157.7	145.1	23.7	0	0	0	0	0	116.7
630	T	32.6	Very low	32.7	Very low	114 Å²	114	126.3 Å²	126.3	70%	0.699	74%	0.74	S	S	*	*			trans	49.9	109.3	135.6	54.6	0	0	0	0	121.6
631	T	31.2	Very low	32.8	Very low	121 Å²	121	123.7 Å²	123.7	74%	0.742	74%	0.735	S	S	*	*				74.8	142.8	74.9	60.4	0	0	0	0	114.7
632	T	32.8	Very low	32.8	Very low	122 Å²	122	122 Å²	122	75%	0.748	73%	0.731	S	S	*	*			cis	-167.8	149.3	12.2	5.5	0	0	0	0	111.2
633	A	32.5	Very low	32.5	Very low	91 Å²	91	123.9 Å²	123.9	75%	0.752	73%	0.729	S	S	*	*			trans	40.9	162.5	131.5	0	0	0	0	0	121.4
634	I	34.7	Very low	32.5	Very low	149 Å²	149	123 Å²	123	76%	0.764	72%	0.719	S	S	*	*			cis	-149.1	128.8	23.3	-62	168.4	0	0	0	105.2
635	D	29.3	Very low	31.8	Very low	150 Å²	150	123 Å²	123	80%	0.802	71%	0.713	S	S	*	*				67.8	150.9	78.3	-103.8	-20.1	0	0	0	117.5
636	D	33.7	Very low	31.4	Very low	132 Å²	132	124 Å²	124	71%	0.706	71%	0.709	S	S	*	*			trans	76.7	141.4	174.2	-62.8	-18.3	0	0	0	120.7
637	L	31.5	Very low	31	Very low	131 Å²	131	122.8 Å²	122.8	69%	0.686	71%	0.705	S	S	*	*			cis	-178	137.1	-30.1	-111.9	174.1	0	0	0	107.4
638	L	30.5	Very low	30.6	Very low	141 Å²	141	121.4 Å²	121.4	74%	0.738	71%	0.709	S	S	*	*			trans	63.2	154.4	156.4	-56.5	164.2	0	0	0	117.1
639	N	29.7	Very low	30.3	Very low	115 Å²	115	119.8 Å²	119.8	62%	0.615	70%	0.703	S	S	*	*			cis	-156.7	164	3.2	-119.4	-18.7	0	0	0	108.6
640	N	29.3	Very low	29.8	Very low	124 Å²	124	125.8 Å²	125.8	66%	0.663	72%	0.715	S	S	*	*			trans	19.8	139.1	143.7	-46.3	-17.5	0	0	0	119.6
641	D	35.3	Very low	29.6	Very low	128 Å²	128	125.8 Å²	125.8	68%	0.684	72%	0.715	S	S	*	*			cis	-164.9	149.2	48.1	-97.7	-55.2	0	0	0	112.8
642	N	30.7	Very low	29.5	Very low	128 Å²	128	126.1 Å²	126.1	68%	0.684	71%	0.711	S	S	*	*			trans	45.8	127.3	138	-52.3	-36.1	0	0	0	123.6
643	N	29.3	Very low	29.4	Very low	125 Å²	125	126.4 Å²	126.4	67%	0.668	71%	0.708	S	S	*	*				92.9	129.6	125.5	-82.5	38.1	0	0	0	123.3
644	D	30.8	Very low	29.2	Very low	117 Å²	117	128.2 Å²	128.2	63%	0.626	71%	0.705	S	S	*	*			trans	79	98.8	133.2	-62.3	-24.3	0	0	0	121.5
645	N	26.6	Very low	29.1	Very low	128 Å²	128	130 Å²	130	68%	0.684	71%	0.707	S	S	*	*				79.9	127.7	112.3	-70.1	-37	0	0	0	121.7
646	T	26.1	Very low	29.2	Very low	116 Å²	116	127.9 Å²	127.9	71%	0.712	70%	0.7	S	S	*	*			trans	76.3	109.2	135.1	54.6	0	0	0	0	120.9
647	S	25.5	Very low	28.9	Very low	104 Å²	104	126.8 Å²	126.8	73%	0.727	70%	0.698	S	S	*	*				78.7	145	117.6	-57.6	0	0	0	0	120.5
648	S	25.3	Very low	28.9	Very low	114 Å²	114	127.4 Å²	127.4	80%	0.797	70%	0.702	S	S	*	*			trans	70.6	148.8	163.5	79	0	0	0	0	116.1
649	S	25.3	Very low	28.7	Very low	92 Å²	92	125 Å²	125	64%	0.643	70%	0.702	S	S	*	*			cis	-174.6	146.6	-16.3	46.4	0	0	0	0	111
650	F	24.1	Very low	28.8	Very low	199 Å²	199	127.2 Å²	127.2	87%	0.873	71%	0.713	S	S	*	*			trans	66	174.2	144.8	-93.1	-102.6	0	0	0	120.7
651	V	28.1	Very low	28.6	Very low	115 Å²	115	129.8 Å²	129.8	70%	0.697	72%	0.719	S	S	*	*			trans	87.1	95	169.3	-168.9	0	0	0	0	113.6
652	I	27.9	Very low	28.3	Very low	128 Å²	128	130.9 Å²	130.9	66%	0.656	72%	0.723	S	S	*	*				75.8	131.5	78.2	-66.7	160.9	0	0	0	109.9
653	D	31.3	Very low	28.3	Very low	127 Å²	127	129.7 Å²	129.7	68%	0.679	72%	0.721	S	S	*	*			cis	-141.2	150.4	41.2	-95.9	-53	0	0	0	111.1
654	N	28.1	Very low	28.2	Very low	129 Å²	129	128.8 Å²	128.8	69%	0.69	72%	0.72	S	S	*	*				69.6	143.6	64.2	-66.7	-45.6	0	0	0	117.9
655	K	33	Very low	28	Very low	187 Å²	187	129.3 Å²	129.3	81%	0.813	72%	0.723	S	S	*	*			trans	98.2	141.4	164.1	-61.7	-173.7	175.8	173.7	0	115.6
656	T	30.3	Very low	28	Very low	106 Å²	106	128 Å²	128	65%	0.65	72%	0.723	S	S	*	*			cis	-174.4	128.3	-0.1	19.1	0	0	0	0	105
657	T	27.8	Very low	28.2	Very low	109 Å²	109	130.5 Å²	130.5	67%	0.669	73%	0.731	S	S	*	*				63.1	155.3	100.8	69.8	0	0	0	0	117.9
658	D	31.3	Very low	28.3	Very low	143 Å²	143	128.8 Å²	128.8	77%	0.765	73%	0.73	S	S	*	*			trans	80	106.4	168.4	-46.7	-49.3	0	0	0	115.5
659	A	27.4	Very low	28.6	Very low	90 Å²	90	132.2 Å²	132.2	74%	0.744	74%	0.736	S	S	*	*				77.1	129.4	54.6	0	0	0	0	0	114
660	L	30.9	Very low	28.5	Very low	162 Å²	162	134.3 Å²	134.3	85%	0.848	74%	0.739	S	S	*	*			trans	150.1	107.5	158.3	-83.4	169.7	0	0	0	106.7
661	K	25.8	Very low	28.9	Very low	179 Å²	179	132.6 Å²	132.6	78%	0.778	74%	0.738	S	S	*	*				85.5	146.2	52.9	-170.6	-179.6	-176.2	-177.5	0	112.3
662	L	29.6	Very low	28.7	Very low	150 Å²	150	133.2 Å²	133.2	79%	0.785	74%	0.737	S	S	*	*			trans	100.6	131.9	175.9	-54.7	157.2	0	0	0	112.7
663	T	29.2	Very low	28.6	Very low	104 Å²	104	134.4 Å²	134.4	64%	0.638	75%	0.745	S	S	*	*			cis	-161.4	133.6	-13.4	16.6	0	0	0	0	104.9
664	T	27.1	Very low	28.3	Very low	105 Å²	105	133.3 Å²	133.3	64%	0.644	75%	0.747	S	S	*	*				34.8	125	97.9	79	0	0	0	0	113
665	D	26.5	Very low	28.1	Very low	128 Å²	128	135.4 Å²	135.4	68%	0.684	76%	0.757	S	S	*	*				-175.8	138.5	62.5	-107.8	-58.9	0	0	0	114.5
666	S	28.1	Very low	27.6	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	75%	0.752	S	S	*	*				76.9	160.2	127.9	-70.1	0	0	0	0	123.6
667	I	30.5	Very low	27.3	Very low	169 Å²	169	132.2 Å²	132.2	87%	0.867	76%	0.758	S	S	*	*			trans	80.1	83.2	168.6	-39.2	-173.4	0	0	0	116.1
668	G	26.1	Very low	27	Very low	68 Å²	68	134 Å²	134	70%	0.701	76%	0.762	S	S	*	*			trans	-90	-153.7	163.7	0	0	0	0	0	114.2
669	M	32.2	Very low	26.9	Very low	187 Å²	187	132.3 Å²	132.3	92%	0.921	76%	0.762	S	S	*	*			trans	-160.9	132.4	150.3	-124	169.7	155.8	0	0	109.8
670	D	24.2	Very low	26.6	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	76%	0.762	S	S	*	*			trans	-66.5	168.7	174.7	-48.3	-94.7	0	0	0	112.2
671	I	32.6	Very low	26.2	Very low	164 Å²	164	135.1 Å²	135.1	84%	0.841	75%	0.752	S	S	*	*				-171.6	135	112.7	-91.3	150.3	0	0	0	110.1
672	N	23.9	Very low	26.2	Very low	128 Å²	128	132.3 Å²	132.3	68%	0.684	75%	0.75	S	S	*	*			trans	-78	175.3	178.1	-66.2	-72.7	0	0	0	112.7
673	N	24.2	Very low	25.9	Very low	153 Å²	153	132.8 Å²	132.8	82%	0.818	75%	0.748	S	S	*	*			trans	69.5	120.6	162.5	-55	-28.3	0	0	0	116.6
674	S	26.2	Very low	25.6	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	75%	0.754	S	S	*	*				175.2	107.9	90.6	-72	0	0	0	0	112.4	S676	S674-S676 PolarHBondContact O-N 3.48Å
675	L	23	Very low	25.6	Very low	172 Å²	172	139.2 Å²	139.2	90%	0.901	77%	0.769	S	S	*	*				5.4	108.1	127.5	-168.1	85	0	0	0	116.5
676	S	23.5	Very low	25.6	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	77%	0.765	S	S	*	*			trans	-166	105.6	142.3	7.3	0	0	0	0	113	S674	S674-S676 PolarHBondContact O-N 3.48Å
677	T	22.4	Very low	25.5	Very low	124 Å²	124	141.1 Å²	141.1	76%	0.761	77%	0.769	S	S	*	*				4.9	128.5	127.3	52.2	0	0	0	0	117.8
678	L	22.9	Very low	25.3	Very low	147 Å²	147	139.8 Å²	139.8	77%	0.77	76%	0.764	S	S	*	*				-164.5	93.2	120.1	-102.9	161.6	0	0	0	110.1	Y680	L678-Y680 HydrophobicContact CD2-CD2 3.73Å; L678-Y680 HydrophobicContact CD2-CE2 3.6Å
679	S	28.5	Very low	25.4	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	77%	0.77	S	S	*	*			trans	-59.4	145.6	153.6	-41	0	0	0	0	108.9
680	Y	22.3	Very low	25	Very low	192 Å²	192	139.9 Å²	139.9	75%	0.753	76%	0.758	S	S	*	*			trans	-159.1	131	141.5	-95.5	-53.8	0	0	0	113.1	L678	L678-Y680 HydrophobicContact CD2-CD2 3.73Å; L678-Y680 HydrophobicContact CD2-CE2 3.6Å
681	N	21	Very low	25.1	Very low	120 Å²	120	142.2 Å²	142.2	64%	0.642	76%	0.763	S	S	*	*			trans	73.4	92	144	-60.1	-17.7	0	0	0	119.8
682	T	25.5	Very low	24.8	Very low	119 Å²	119	140 Å²	140	73%	0.73	75%	0.751	S	S	*	*				11.7	156.6	96.4	2.3	0	0	0	0	119.5
683	E	23.9	Very low	24.9	Very low	161 Å²	161	141.5 Å²	141.5	75%	0.752	75%	0.754	S	S	*	*			trans	100.8	111.9	158.7	-71.6	162.1	-163	0	0	118.8
684	E	23.7	Very low	25.2	Very low	162 Å²	162	140.5 Å²	140.5	76%	0.757	75%	0.749	S	S	*	*			trans	66.2	96	138.7	-57.8	-168.1	152.1	0	0	120.3
685	L	26	Very low	25.1	Very low	182 Å²	182	141.5 Å²	141.5	95%	0.953	75%	0.746	S	S	*	*				-141.2	86.4	108.6	-121.2	141.5	0	0	0	111.3
686	S	26.8	Very low	25.4	Very low	85 Å²	85	141.4 Å²	141.4	59%	0.594	75%	0.746	S	S	*	*			trans	-75.7	129.9	167.9	46.7	0	0	0	0	110.3
687	K	25.1	Very low	25.4	Very low	183 Å²	183	145.1 Å²	145.1	80%	0.796	75%	0.752	S	S	*	*			trans	-170.8	134.6	135.5	-105	153.4	-171	169.6	0	111.8
688	D	27.4	Very low	25.6	Very low	141 Å²	141	147.3 Å²	147.3	75%	0.754	76%	0.759	S	S	*	*	S	Bend	trans	64.1	117.5	157.8	-45.2	-27	0	0	0	116.6
689	L	28.2	Very low	25.9	Very low	160 Å²	160	146 Å²	146	84%	0.838	76%	0.762	S	S	*	*			cis	-151.4	139.3	5.6	-154.1	74.8	0	0	0	111
690	S	24.2	Very low	25.7	Very low	96 Å²	96	146.1 Å²	146.1	67%	0.671	76%	0.762	S	S	*	*			trans	-86.5	153.2	175	49.4	0	0	0	0	111.9
691	F	25	Very low	26.1	Very low	185 Å²	185	144.4 Å²	144.4	81%	0.811	76%	0.761	S	S	*	*				-163.6	112.5	129.2	-127.9	-121.7	0	0	0	114.3
692	I	27.7	Very low	26.6	Very low	117 Å²	117	142.9 Å²	142.9	60%	0.6	76%	0.759	S	S	*	*			trans	63.9	95	136.9	-59.4	-164.8	0	0	0	119.7
693	Q	26.1	Very low	27	Very low	159 Å²	159	143 Å²	143	74%	0.743	76%	0.755	S	S	*	*				0.3	136.9	123.7	-66.1	156.5	-83.5	0	0	118.4
694	D	29	Very low	27.5	Very low	132 Å²	132	142.1 Å²	142.1	71%	0.706	75%	0.751	S	S	*	*				-169.8	119.7	101.3	-98.2	-25.5	0	0	0	113.1
695	N	25.6	Very low	28.1	Very low	125 Å²	125	141 Å²	141	67%	0.668	75%	0.745	S	S	*	*			trans	26.5	117.9	142	-38.4	-45.6	0	0	0	119.5
696	N	27.7	Very low	28.5	Very low	170 Å²	170	137.1 Å²	137.1	91%	0.909	72%	0.718	S	S	*	*				-154.3	132.8	112.9	-99.9	-26.5	0	0	0	111.1
697	E	24.9	Very low	29.1	Very low	181 Å²	181	137.3 Å²	137.3	85%	0.846	71%	0.713	S	S	*	*			trans	-78.4	135.1	173.7	-56.7	175.1	134.3	0	0	109.3
698	D	26.9	Very low	30.1	Very low	169 Å²	169	132.4 Å²	132.4	90%	0.904	70%	0.698	S	S	*	*			trans	160.1	79.1	151.5	-90	-23.7	0	0	0	111.1
699	S	27.8	Very low	30.9	Very low	119 Å²	119	128.8 Å²	128.8	83%	0.832	68%	0.681	S	S	*	*			trans	175.9	74.6	155.6	174	0	0	0	0	112.2
700	C	25.7	Very low	31.5	Very low	111 Å²	111	122.9 Å²	122.9	75%	0.75	65%	0.652	S	S	*	*	S	Bend	trans	-141	-17	165.3	-158.5	0	0	0	0	115.3	S702	C700-S702 PolarHBondContact O-N 3.12Å
701	H	29.1	Very low	32.2	Very low	156 Å²	156	123.4 Å²	123.4	72%	0.722	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-11.2	-179.1	-88.7	-62	0	0	0	115.7	L703	H701-L703 PolarHBondContact O-N 3.28Å
702	S	32.9	Very low	33.2	Very low	87 Å²	87	119.1 Å²	119.1	61%	0.608	63%	0.631	S	S	*	*	H	α-helix	trans	-72.8	-27.2	-178.2	-170	0	0	0	0	113.7	C700 W706	C700-S702 PolarHBondContact O-N 3.12Å; S702-W706 WeakPolarHBondContact O-CB 3.33Å; S702-W706 PolarHBondContact O-N 3.3Å
703	L	32.5	Very low	33.9	Very low	122 Å²	122	119.9 Å²	119.9	64%	0.639	63%	0.629	S	S	*	*	H	α-helix	trans	-81.2	-40.3	-166.9	-159.4	68.7	0	0	0	113.2	H701 W706 N707	H701-L703 PolarHBondContact O-N 3.28Å; L703-W706 PolarHBondContact O-N 3.37Å; L703-N707 PolarHBondContact O-N 3.48Å; L703-N707 PolarHBondContact O-ND2 2.82Å
704	E	35.1	Very low	34.3	Very low	142 Å²	142	116.6 Å²	116.6	66%	0.664	62%	0.617	S	S	*	*	H	α-helix	trans	-69	-38.6	174.8	-67.1	-173.5	135.1	0	0	112.2	W706 N707 T708	E704-W706 VanDerWaalsContact C-N 3.31Å; E704-N707 PolarHBondContact O-N 2.7Å; E704-T708 PolarHBondContact O-N 3.18Å; E704-T708 PolarHBondContact O-OG1 3.44Å
705	Q	37.1	Very low	34.7	Very low	138 Å²	138	115 Å²	115	65%	0.645	61%	0.608	S	S	*	*	H	α-helix	trans	-69	-32.1	176.8	-151.5	170.5	46.8	0	0	111.5	T708 T709	Q705-T708 WeakPolarHBondContact CA-OG1 3.44Å; Q705-T708 PolarHBondContact O-OG1 3.31Å; Q705-T709 VanDerWaalsContact O-CB 3.29Å; Q705-T709 WeakPolarHBondContact O-CB 3.45Å; Q705-T709 PolarHBondContact O-N 3.32Å; Q705-T709 PolarHBondContact O-OG1 3.09Å
706	W	34.5	Very low	35.3	Very low	102 Å²	102	115 Å²	115	39%	0.386	61%	0.608	S	S	.	*	H	α-helix	trans	-71.1	-43.9	172.7	-163.8	85.4	0	0	0	111.7	S702 L703 E704 T708 T709 V710 L747	S702-W706 WeakPolarHBondContact O-CB 3.33Å; S702-W706 PolarHBondContact O-N 3.3Å; L703-W706 PolarHBondContact O-N 3.37Å; E704-W706 VanDerWaalsContact C-N 3.31Å; W706-T708 PolarHBondContact O-N 3.12Å; W706-T709 PolarHBondContact O-N 3.5Å; W706-V710 HydrophobicContact CD2-CG2 3.94Å; W706-V710 HydrophobicContact CE3-CG2 3.97Å; W706-V710 HydrophobicContact CH2-CG2 3.78Å; W706-V710 HydrophobicContact CZ2-CG2 3.8Å; W706-V710 HydrophobicContact CZ3-CG2 3.9Å; W706-V710 WeakPolarHBondContact O-CB 3.47Å; W706-V710 WeakPolarHBondContact O-CG2 3.34Å; W706-V710 PolarHBondContact O-N 2.73Å; W706-L747 HydrophobicContact CH2-CD1 3.47Å; W706-L747 VanDerWaalsContact CH2-CD1 3.47Å; W706-L747 HydrophobicContact CH2-CD2 3.32Å; W706-L747 HydrophobicContact CH2-CG 4.01Å; W706-L747 HydrophobicContact CZ2-CD1 4.36Å; W706-L747 HydrophobicContact CZ2-CD2 3.34Å; W706-L747 HydrophobicContact CZ2-CG 4.48Å; W706-L747 HydrophobicContact CZ3-CD1 3.94Å; W706-L747 HydrophobicContact CZ3-CD2 4.4Å
707	N	38.8	Very low	35.8	Very low	88 Å²	88	112.9 Å²	112.9	47%	0.471	60%	0.595	S	S	.	*	H	α-helix	trans	-59.4	-44	174.1	-75.8	-24.3	0	0	0	112.5	L703 E704 M711	L703-N707 PolarHBondContact O-N 3.48Å; L703-N707 PolarHBondContact O-ND2 2.82Å; E704-N707 PolarHBondContact O-N 2.7Å; N707-M711 WeakPolarHBondContact O-CB 3.45Å; N707-M711 WeakPolarHBondContact O-CG 3.43Å; N707-M711 PolarHBondContact O-N 2.87Å
708	T	45.8	Very low	36.1	Very low	80 Å²	80	109 Å²	109	49%	0.491	58%	0.584	S	S	.	*	H	α-helix	trans	-67	-39	174.2	34.2	0	0	0	0	112.6	E704 Q705 W706 M711 N712	E704-T708 PolarHBondContact O-N 3.18Å; E704-T708 PolarHBondContact O-OG1 3.44Å; Q705-T708 WeakPolarHBondContact CA-OG1 3.44Å; Q705-T708 PolarHBondContact O-OG1 3.31Å; W706-T708 PolarHBondContact O-N 3.12Å; T708-M711 PolarHBondContact O-N 3.33Å; T708-N712 WeakPolarHBondContact O-CB 3.41Å; T708-N712 PolarHBondContact O-N 3.21Å; T708-N712 PolarHBondContact O-ND2 2.8Å
709	T	44.4	Very low	36.6	Very low	66 Å²	66	107.8 Å²	107.8	41%	0.405	58%	0.578	S	S	.	*	H	α-helix	trans	-66.1	-38	176.8	-58.7	0	0	0	0	112.5	Q705 W706 K713	Q705-T709 VanDerWaalsContact O-CB 3.29Å; Q705-T709 WeakPolarHBondContact O-CB 3.45Å; Q705-T709 PolarHBondContact O-N 3.32Å; Q705-T709 PolarHBondContact O-OG1 3.09Å; W706-T709 PolarHBondContact O-N 3.5Å; T709-K713 HydrophobicContact CG2-CD 4.41Å; T709-K713 WeakPolarHBondContact O-CB 3.31Å; T709-K713 WeakPolarHBondContact O-CG 3.25Å; T709-K713 PolarHBondContact O-N 3.18Å
710	V	40.7	Very low	36.8	Very low	35 Å²	35	109.4 Å²	109.4	21%	0.212	58%	0.577	C	S	.	*	H	α-helix	trans	-69.4	-43	176.2	169.8	0	0	0	0	111.1	W706 K713 L714	W706-V710 HydrophobicContact CD2-CG2 3.94Å; W706-V710 HydrophobicContact CE3-CG2 3.97Å; W706-V710 HydrophobicContact CH2-CG2 3.78Å; W706-V710 HydrophobicContact CZ2-CG2 3.8Å; W706-V710 HydrophobicContact CZ3-CG2 3.9Å; W706-V710 WeakPolarHBondContact O-CB 3.47Å; W706-V710 WeakPolarHBondContact O-CG2 3.34Å; W706-V710 PolarHBondContact O-N 2.73Å; V710-K713 PolarHBondContact O-N 3.46Å; V710-L714 HydrophobicContact CG1-CD1 3.95Å; V710-L714 WeakPolarHBondContact O-CB 3.29Å; V710-L714 WeakPolarHBondContact O-CG 3.41Å; V710-L714 PolarHBondContact O-N 3.12Å
711	M	39.7	Very low	37	Very low	108 Å²	108	111.4 Å²	111.4	53%	0.532	58%	0.58	S	S	.	*	H	α-helix	trans	-66.1	-40.7	177	-67.7	-69.8	-84.4	0	0	112.1	N707 T708 L714 N715	N707-M711 WeakPolarHBondContact O-CB 3.45Å; N707-M711 WeakPolarHBondContact O-CG 3.43Å; N707-M711 PolarHBondContact O-N 2.87Å; T708-M711 PolarHBondContact O-N 3.33Å; M711-L714 PolarHBondContact O-N 3.08Å; M711-N715 PolarHBondContact O-N 3.02Å; M711-N715 VanDerWaalsContact O-N 3.09Å; M711-N715 PolarHBondContact O-ND2 3.17Å
712	N	45.4	Very low	37.1	Very low	95 Å²	95	109.3 Å²	109.3	51%	0.508	58%	0.583	S	S	.	*	H	α-helix	trans	-65.2	-43.7	175.1	-69.4	-12.6	0	0	0	111.6	T708 L714 N715 D716	T708-N712 WeakPolarHBondContact O-CB 3.41Å; T708-N712 PolarHBondContact O-N 3.21Å; T708-N712 PolarHBondContact O-ND2 2.8Å; N712-L714 VanDerWaalsContact C-N 3.27Å; N712-L714 PolarHBondContact O-N 2.82Å; N712-N715 PolarHBondContact O-N 2.89Å; N712-N715 VanDerWaalsContact O-N 3.11Å; N712-D716 PolarHBondContact O-N 3.11Å
713	K	42.7	Very low	37.1	Very low	133 Å²	133	111.9 Å²	111.9	58%	0.578	59%	0.589	S	S	*	*	H	α-helix	trans	-66.8	-23.5	175.2	-77.7	-175.7	175.2	-176.7	0	114.2	T709 V710 I717	T709-K713 HydrophobicContact CG2-CD 4.41Å; T709-K713 WeakPolarHBondContact O-CB 3.31Å; T709-K713 WeakPolarHBondContact O-CG 3.25Å; T709-K713 PolarHBondContact O-N 3.18Å; V710-K713 PolarHBondContact O-N 3.46Å; K713-I717 WeakPolarHBondContact O-CD1 3.31Å; K713-I717 WeakPolarHBondContact O-CG1 3.42Å
714	L	34.6	Very low	37.2	Very low	90 Å²	90	110.2 Å²	110.2	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-76.1	-33.5	171.6	-77.7	163.8	0	0	0	111.7	V710 M711 N712 I717	V710-L714 HydrophobicContact CG1-CD1 3.95Å; V710-L714 WeakPolarHBondContact O-CB 3.29Å; V710-L714 WeakPolarHBondContact O-CG 3.41Å; V710-L714 PolarHBondContact O-N 3.12Å; M711-L714 PolarHBondContact O-N 3.08Å; N712-L714 VanDerWaalsContact C-N 3.27Å; N712-L714 PolarHBondContact O-N 2.82Å; L714-I717 PolarHBondContact O-N 3.02Å
715	N	37.3	Very low	37.1	Very low	98 Å²	98	108.8 Å²	108.8	52%	0.524	59%	0.591	S	S	.	*	H	α-helix	trans	-73.6	-33.8	173.1	-65.4	-23.9	0	0	0	112.4	M711 N712 I717 T718	M711-N715 PolarHBondContact O-N 3.02Å; M711-N715 VanDerWaalsContact O-N 3.09Å; M711-N715 PolarHBondContact O-ND2 3.17Å; N712-N715 PolarHBondContact O-N 2.89Å; N712-N715 VanDerWaalsContact O-N 3.11Å; N715-I717 PolarHBondContact O-N 3.07Å; N715-T718 PolarHBondContact O-N 2.88Å; N715-T718 VanDerWaalsContact O-N 3.16Å; N715-T718 PolarHBondContact O-OG1 3.41Å
716	D	37.4	Very low	37.2	Very low	125 Å²	125	110.6 Å²	110.6	67%	0.668	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-14	173	-67.2	-27.3	0	0	0	113	N712	N712-D716 PolarHBondContact O-N 3.11Å
717	I	37.9	Very low	37.5	Very low	126 Å²	126	110 Å²	110	65%	0.646	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-9.5	177	-69.9	166.7	0	0	0	111.7	K713 L714 N715	K713-I717 WeakPolarHBondContact O-CD1 3.31Å; K713-I717 WeakPolarHBondContact O-CG1 3.42Å; L714-I717 PolarHBondContact O-N 3.02Å; N715-I717 PolarHBondContact O-N 3.07Å
718	T	32.9	Very low	37.4	Very low	99 Å²	99	110.2 Å²	110.2	61%	0.607	61%	0.614	S	S	*	*	S	Bend	trans	-89.6	-2.7	-176.4	39	0	0	0	0	116.3	N715	N715-T718 PolarHBondContact O-N 2.88Å; N715-T718 VanDerWaalsContact O-N 3.16Å; N715-T718 PolarHBondContact O-OG1 3.41Å
719	D	36.6	Very low	37	Very low	144 Å²	144	117.3 Å²	117.3	77%	0.77	63%	0.632	S	S	*	*	S	Bend	trans	-93.8	-10.5	-177.1	-82.5	-13.7	0	0	0	115.5
720	D	32.4	Very low	36.8	Very low	152 Å²	152	117.8 Å²	117.8	81%	0.813	63%	0.632	S	S	*	*	S	Bend	trans	-108.6	112.7	-178.9	-101.8	-34.5	0	0	0	114.4	S722	D720-S722 PolarHBondContact O-N 3.41Å
721	N	28.9	Very low	37.4	Very low	154 Å²	154	120.3 Å²	120.3	82%	0.824	64%	0.644	S	S	*	*	S	Bend	trans	-43.8	107.8	-179.3	-63.4	-83.8	0	0	0	115.9
722	S	32.2	Very low	37.8	Very low	112 Å²	112	120.2 Å²	120.2	78%	0.783	65%	0.652	S	S	*	*			trans	170.7	57.5	137.5	49.2	0	0	0	0	115.6	D720 P724	D720-S722 PolarHBondContact O-N 3.41Å; S722-P724 WeakPolarHBondContact O-CD 3.32Å
723	I	32.8	Very low	37.8	Very low	141 Å²	141	122.9 Å²	122.9	72%	0.723	66%	0.661	S	S	*	*			trans	-72.7	122.9	171.6	-61	178.8	0	0	0	110.2	S725 L727	I723-S725 PolarHBondContact O-N 3.42Å; I723-L727 HydrophobicContact CG2-CB 4.48Å
724	P	34.2	Very low	38.3	Very low	87 Å²	87	120.4 Å²	120.4	57%	0.565	65%	0.653	S	S	*	*			trans	-66.2	134.1	178.8	-20.6	33.3	0	0	0	111.9	S722 K726 L727	S722-P724 WeakPolarHBondContact O-CD 3.32Å; P724-K726 PolarHBondContact O-N 2.99Å; P724-L727 PolarHBondContact O-N 3.49Å; P724-L727 VanDerWaalsContact O-N 3.09Å
725	S	32.6	Very low	39.4	Very low	112 Å²	112	120 Å²	120	78%	0.783	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	8.8	-177.5	54.8	0	0	0	0	116.8	I723	I723-S725 PolarHBondContact O-N 3.42Å
726	K	39.3	Very low	40.1	Very low	176 Å²	176	123.4 Å²	123.4	77%	0.765	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-16.2	173.5	-74.7	-178.2	174.8	177.4	0	114.4	P724	P724-K726 PolarHBondContact O-N 2.99Å
727	L	41.1	Very low	41	Very low	90 Å²	90	120.9 Å²	120.9	47%	0.471	65%	0.647	S	S	.	*	S	Bend	trans	-82.2	-26.6	176.9	-93	71.4	0	0	0	113.1	I723 P724 R729 L730	I723-L727 HydrophobicContact CG2-CB 4.48Å; P724-L727 PolarHBondContact O-N 3.49Å; P724-L727 VanDerWaalsContact O-N 3.09Å; L727-R729 PolarHBondContact O-N 3.48Å; L727-L730 PolarHBondContact O-N 2.83Å
728	A	37.4	Very low	41.7	Very low	92 Å²	92	119 Å²	119	76%	0.76	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	8.7	-179.4	0	0	0	0	0	115.2
729	R	37.3	Very low	42.5	Very low	228 Å²	228	116.7 Å²	116.7	86%	0.86	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	3.4	177	-57.6	-176.5	77.3	158.3	3.9	112.8	L727	L727-R729 PolarHBondContact O-N 3.48Å
730	L	39.4	Very low	43.3	Very low	76 Å²	76	111.3 Å²	111.3	40%	0.398	61%	0.605	S	S	.	*	S	Bend	trans	-94.7	135.9	174.5	-70.3	162.5	0	0	0	109.2	L727 L734 L735	L727-L730 PolarHBondContact O-N 2.83Å; L730-L734 HydrophobicContact CD2-CD2 3.9Å; L730-L735 HydrophobicContact CD1-CD1 4.31Å
731	D	53.4	Low	44.5	Very low	89 Å²	89	110 Å²	110	48%	0.476	59%	0.594	S	S	.	*			trans	-53.8	129	171.2	175.9	-7.8	0	0	0	109.9	Q733 L734 L735	D731-Q733 PolarHBondContact O-N 3.28Å; D731-Q733 VanDerWaalsContact O-N 3.11Å; D731-Q733 VanDerWaalsContact OD1-CB 3.31Å; D731-Q733 WeakPolarHBondContact OD1-CB 3.2Å; D731-Q733 PolarHBondContact OD1-N 3.4Å; D731-L734 HydrophobicContact CB-CB 3.93Å; D731-L734 WeakPolarHBondContact O-CB 3.39Å; D731-L734 PolarHBondContact O-N 3.25Å; D731-L735 PolarHBondContact O-N 3.36Å
732	P	47.9	Very low	45.3	Very low	106 Å²	106	109.5 Å²	109.5	69%	0.688	58%	0.58	S	S	*	*	H	α-helix	trans	-49.7	-34.3	174.3	-28.2	35.3	0	0	0	113.6	L735 Y736	P732-L735 PolarHBondContact O-N 3.05Å; P732-Y736 VanDerWaalsContact O-CB 3.32Å; P732-Y736 WeakPolarHBondContact O-CB 3.46Å; P732-Y736 PolarHBondContact O-N 3.02Å
733	Q	44.8	Very low	46.4	Very low	151 Å²	151	107.6 Å²	107.6	71%	0.706	56%	0.561	S	S	*	*	H	α-helix	trans	-75.9	-32.2	-178.9	-147	156.3	5.3	0	0	111.9	D731 T737	D731-Q733 PolarHBondContact O-N 3.28Å; D731-Q733 VanDerWaalsContact O-N 3.11Å; D731-Q733 VanDerWaalsContact OD1-CB 3.31Å; D731-Q733 WeakPolarHBondContact OD1-CB 3.2Å; D731-Q733 PolarHBondContact OD1-N 3.4Å; Q733-T737 PolarHBondContact O-N 3.07Å; Q733-T737 VanDerWaalsContact O-N 3.07Å; Q733-T737 PolarHBondContact O-OG1 3.4Å
734	L	54.4	Low	47.2	Very low	80 Å²	80	110.3 Å²	110.3	42%	0.419	56%	0.563	S	S	.	*	H	α-helix	trans	-71.5	-38.8	169.3	-177.2	62.1	0	0	0	111.6	L730 D731 T737 L738	L730-L734 HydrophobicContact CD2-CD2 3.9Å; D731-L734 HydrophobicContact CB-CB 3.93Å; D731-L734 WeakPolarHBondContact O-CB 3.39Å; D731-L734 PolarHBondContact O-N 3.25Å; L734-T737 WeakPolarHBondContact CA-OG1 3.33Å; L734-T737 PolarHBondContact O-OG1 2.55Å; L734-T737 VanDerWaalsContact O-OG1 3.08Å; L734-L738 HydrophobicContact CD1-CD1 4.25Å; L734-L738 HydrophobicContact CD1-CG 4.41Å; L734-L738 HydrophobicContact CG-CD1 4.11Å; L734-L738 WeakPolarHBondContact O-CB 3.41Å; L734-L738 VanDerWaalsContact O-CG 3.27Å; L734-L738 WeakPolarHBondContact O-CG 3.49Å; L734-L738 PolarHBondContact O-N 3.4Å
735	L	57.6	Low	47.8	Very low	82 Å²	82	111.5 Å²	111.5	43%	0.429	56%	0.561	S	S	.	*	H	α-helix	trans	-65.8	-40.6	175.6	-162.8	72.1	0	0	0	111.1	L730 D731 P732 A739	L730-L735 HydrophobicContact CD1-CD1 4.31Å; D731-L735 PolarHBondContact O-N 3.36Å; P732-L735 PolarHBondContact O-N 3.05Å; L735-A739 VanDerWaalsContact O-CB 3.23Å; L735-A739 WeakPolarHBondContact O-CB 3.25Å; L735-A739 PolarHBondContact O-N 2.98Å
736	Y	51.8	Low	48.3	Very low	169 Å²	169	111.5 Å²	111.5	66%	0.663	55%	0.552	S	S	*	*	H	α-helix	trans	-65.6	-42.8	176.7	-161.9	-88	0	0	0	112.4	P732 A739 A740	P732-Y736 VanDerWaalsContact O-CB 3.32Å; P732-Y736 WeakPolarHBondContact O-CB 3.46Å; P732-Y736 PolarHBondContact O-N 3.02Å; Y736-A739 PolarHBondContact O-N 3.35Å; Y736-A740 VanDerWaalsContact O-CB 3.31Å; Y736-A740 WeakPolarHBondContact O-CB 3.46Å; Y736-A740 PolarHBondContact O-N 2.73Å
737	T	56.2	Low	48.3	Very low	72 Å²	72	106.5 Å²	106.5	44%	0.442	53%	0.533	S	S	.	.	H	α-helix	trans	-67.9	-40.4	177	40.6	0	0	0	0	112.7	Q733 L734 A740 Q741	Q733-T737 PolarHBondContact O-N 3.07Å; Q733-T737 VanDerWaalsContact O-N 3.07Å; Q733-T737 PolarHBondContact O-OG1 3.4Å; L734-T737 WeakPolarHBondContact CA-OG1 3.33Å; L734-T737 PolarHBondContact O-OG1 2.55Å; L734-T737 VanDerWaalsContact O-OG1 3.08Å; T737-A740 PolarHBondContact O-N 2.74Å; T737-Q741 WeakPolarHBondContact O-CB 3.37Å; T737-Q741 WeakPolarHBondContact O-CG 3.31Å; T737-Q741 PolarHBondContact O-N 2.83Å
738	L	53.1	Low	47.9	Very low	87 Å²	87	108.6 Å²	108.6	46%	0.455	55%	0.545	S	S	.	.	H	α-helix	trans	-66.6	-38.2	173.4	-70.6	170.6	0	0	0	112.2	L734 R742	L734-L738 HydrophobicContact CD1-CD1 4.25Å; L734-L738 HydrophobicContact CD1-CG 4.41Å; L734-L738 HydrophobicContact CG-CD1 4.11Å; L734-L738 WeakPolarHBondContact O-CB 3.41Å; L734-L738 VanDerWaalsContact O-CG 3.27Å; L734-L738 WeakPolarHBondContact O-CG 3.49Å; L734-L738 PolarHBondContact O-N 3.4Å; L738-R742 VanDerWaalsContact O-CB 3.26Å; L738-R742 WeakPolarHBondContact O-CB 3.16Å; L738-R742 PolarHBondContact O-N 3.28Å
739	A	48.5	Very low	47.7	Very low	50 Å²	50	110 Å²	110	41%	0.413	54%	0.544	S	S	.	.	H	α-helix	trans	-66.1	-42.3	174.1	0	0	0	0	0	112	L735 Y736 R742 L743	L735-A739 VanDerWaalsContact O-CB 3.23Å; L735-A739 WeakPolarHBondContact O-CB 3.25Å; L735-A739 PolarHBondContact O-N 2.98Å; Y736-A739 PolarHBondContact O-N 3.35Å; A739-R742 PolarHBondContact O-N 2.87Å; A739-L743 WeakPolarHBondContact O-CG 3.24Å; A739-L743 PolarHBondContact O-N 3.38Å
740	A	53.9	Low	47.3	Very low	32 Å²	32	105.7 Å²	105.7	26%	0.264	54%	0.538	S	S	.	.	H	α-helix	trans	-63.4	-49.2	176.3	0	0	0	0	0	111.8	Y736 T737 R742 L743 Y744	Y736-A740 VanDerWaalsContact O-CB 3.31Å; Y736-A740 WeakPolarHBondContact O-CB 3.46Å; Y736-A740 PolarHBondContact O-N 2.73Å; T737-A740 PolarHBondContact O-N 2.74Å; A740-R742 PolarHBondContact O-N 3.11Å; A740-L743 PolarHBondContact O-N 2.68Å; A740-L743 VanDerWaalsContact O-N 3.14Å; A740-Y744 WeakPolarHBondContact O-CD2 3.36Å; A740-Y744 PolarHBondContact O-N 3.26Å
741	Q	57.4	Low	46.8	Very low	125 Å²	125	109.6 Å²	109.6	58%	0.584	56%	0.559	S	S	*	*	H	α-helix	trans	-55.1	-42.9	173.3	-77.1	179.5	-18.4	0	0	111.3	T737 L743 Y744 E745	T737-Q741 WeakPolarHBondContact O-CB 3.37Å; T737-Q741 WeakPolarHBondContact O-CG 3.31Å; T737-Q741 PolarHBondContact O-N 2.83Å; Q741-L743 PolarHBondContact O-N 3.21Å; Q741-Y744 PolarHBondContact O-N 2.8Å; Q741-E745 WeakPolarHBondContact O-CG 3.48Å; Q741-E745 PolarHBondContact O-N 3.29Å
742	R	46.8	Very low	45.5	Very low	143 Å²	143	113.4 Å²	113.4	54%	0.54	57%	0.574	S	S	.	*	H	α-helix	trans	-70.2	-30.6	179.6	-166.6	57.9	176.8	160.5	9.9	113.6	L738 A739 A740 E745 L746	L738-R742 VanDerWaalsContact O-CB 3.26Å; L738-R742 WeakPolarHBondContact O-CB 3.16Å; L738-R742 PolarHBondContact O-N 3.28Å; A739-R742 PolarHBondContact O-N 2.87Å; A740-R742 PolarHBondContact O-N 3.11Å; R742-E745 VanDerWaalsContact CD-OE2 3.24Å; R742-E745 WeakPolarHBondContact CD-OE2 3.2Å; R742-E745 IonicContact CZ-OE2 3.91Å; R742-E745 IonicContact NE-OE2 2.69Å; R742-E745 IonicContact NH1-OE2 3.99Å; R742-E745 PolarHBondContact NH1-OE2 3.24Å; R742-L746 HydrophobicContact CG-CD1 4.21Å; R742-L746 WeakPolarHBondContact O-CB 3.1Å; R742-L746 WeakPolarHBondContact O-CD1 3.46Å; R742-L746 WeakPolarHBondContact O-CG 3.42Å; R742-L746 PolarHBondContact O-N 3.44Å
743	L	55.6	Low	44.6	Very low	72 Å²	72	115.6 Å²	115.6	38%	0.377	58%	0.58	S	S	.	*	H	α-helix	trans	-70.1	-43.7	171.8	-78.4	164.8	0	0	0	111.2	A739 A740 Q741 E745 L746 L747	A739-L743 WeakPolarHBondContact O-CG 3.24Å; A739-L743 PolarHBondContact O-N 3.38Å; A740-L743 PolarHBondContact O-N 2.68Å; A740-L743 VanDerWaalsContact O-N 3.14Å; Q741-L743 PolarHBondContact O-N 3.21Å; L743-E745 VanDerWaalsContact C-N 3.27Å; L743-E745 PolarHBondContact O-N 2.93Å; L743-L746 PolarHBondContact O-N 3.07Å; L743-L747 HydrophobicContact CB-CD1 4.34Å; L743-L747 WeakPolarHBondContact O-CD1 3.43Å; L743-L747 WeakPolarHBondContact O-CG 3.41Å; L743-L747 PolarHBondContact O-N 3.28Å; L743-L747 VanDerWaalsContact O-N 3.15Å
744	Y	48.6	Very low	43.7	Very low	197 Å²	197	113.3 Å²	113.3	77%	0.773	58%	0.581	S	S	*	*	H	α-helix	trans	-58.8	-37.2	173.3	-79.1	-68.1	0	0	0	112.6	A740 Q741 L746	A740-Y744 WeakPolarHBondContact O-CD2 3.36Å; A740-Y744 PolarHBondContact O-N 3.26Å; Q741-Y744 PolarHBondContact O-N 2.8Å; Y744-L746 VanDerWaalsContact C-N 3.3Å; Y744-L746 PolarHBondContact O-N 2.84Å
745	E	46.9	Very low	42.4	Very low	112 Å²	112	117.2 Å²	117.2	52%	0.523	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.5	-20.6	172.9	-72.7	-179.1	159.2	0	0	114.7	Q741 R742 L743	Q741-E745 WeakPolarHBondContact O-CG 3.48Å; Q741-E745 PolarHBondContact O-N 3.29Å; R742-E745 VanDerWaalsContact CD-OE2 3.24Å; R742-E745 WeakPolarHBondContact CD-OE2 3.2Å; R742-E745 IonicContact CZ-OE2 3.91Å; R742-E745 IonicContact NE-OE2 2.69Å; R742-E745 IonicContact NH1-OE2 3.99Å; R742-E745 PolarHBondContact NH1-OE2 3.24Å; L743-E745 VanDerWaalsContact C-N 3.27Å; L743-E745 PolarHBondContact O-N 2.93Å
746	L	42.7	Very low	40.9	Very low	113 Å²	113	119.8 Å²	119.8	59%	0.592	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-12.7	-175.3	-76.3	170.1	0	0	0	113.9	R742 L743 Y744	R742-L746 HydrophobicContact CG-CD1 4.21Å; R742-L746 WeakPolarHBondContact O-CB 3.1Å; R742-L746 WeakPolarHBondContact O-CD1 3.46Å; R742-L746 WeakPolarHBondContact O-CG 3.42Å; R742-L746 PolarHBondContact O-N 3.44Å; L743-L746 PolarHBondContact O-N 3.07Å; Y744-L746 VanDerWaalsContact C-N 3.3Å; Y744-L746 PolarHBondContact O-N 2.84Å
747	L	39.5	Very low	39.9	Very low	70 Å²	70	116.7 Å²	116.7	37%	0.366	61%	0.614	S	S	.	*	S	Bend	trans	-102.2	-6.9	-170.7	-67.1	166.8	0	0	0	115.2	W706 L743 V749	W706-L747 HydrophobicContact CH2-CD1 3.47Å; W706-L747 VanDerWaalsContact CH2-CD1 3.47Å; W706-L747 HydrophobicContact CH2-CD2 3.32Å; W706-L747 HydrophobicContact CH2-CG 4.01Å; W706-L747 HydrophobicContact CZ2-CD1 4.36Å; W706-L747 HydrophobicContact CZ2-CD2 3.34Å; W706-L747 HydrophobicContact CZ2-CG 4.48Å; W706-L747 HydrophobicContact CZ3-CD1 3.94Å; W706-L747 HydrophobicContact CZ3-CD2 4.4Å; L743-L747 HydrophobicContact CB-CD1 4.34Å; L743-L747 WeakPolarHBondContact O-CD1 3.43Å; L743-L747 WeakPolarHBondContact O-CG 3.41Å; L743-L747 PolarHBondContact O-N 3.28Å; L743-L747 VanDerWaalsContact O-N 3.15Å; L747-V749 HydrophobicContact CB-CG2 4.29Å; L747-V749 WeakPolarHBondContact O-CG2 3.5Å; L747-V749 PolarHBondContact O-N 2.81Å
748	D	32	Very low	38.5	Very low	134 Å²	134	120.4 Å²	120.4	72%	0.717	63%	0.632	S	S	*	*			trans	40.5	46.1	166.7	-141.7	17.7	0	0	0	114.5	N750	D748-N750 PolarHBondContact O-N 3.26Å; D748-N750 PolarHBondContact O-ND2 3.22Å
749	V	34	Very low	37.3	Very low	123 Å²	123	123.7 Å²	123.7	75%	0.745	65%	0.645	S	S	*	*			trans	-75.5	91.9	-177.2	-175.8	0	0	0	0	109.3	L747 N751	L747-V749 HydrophobicContact CB-CG2 4.29Å; L747-V749 WeakPolarHBondContact O-CG2 3.5Å; L747-V749 PolarHBondContact O-N 2.81Å; V749-N751 PolarHBondContact O-N 3.12Å
750	N	28.6	Very low	36.3	Very low	136 Å²	136	128.7 Å²	128.7	73%	0.727	66%	0.664	S	S	*	*			trans	-55.6	114.8	173.8	-70.4	-77.2	0	0	0	111.3	D748	D748-N750 PolarHBondContact O-N 3.26Å; D748-N750 PolarHBondContact O-ND2 3.22Å
751	N	29.2	Very low	35.2	Very low	158 Å²	158	135 Å²	135	85%	0.845	69%	0.694	S	S	*	*			trans	-115.7	81.8	165.7	-111	-8.7	0	0	0	110.1	V749	V749-N751 PolarHBondContact O-N 3.12Å
752	Q	27.3	Very low	33.7	Very low	170 Å²	170	136.3 Å²	136.3	79%	0.794	70%	0.703	S	S	*	*			trans	-90.7	118	151	-67.9	-166.4	10.6	0	0	107.6
753	N	27.1	Very low	32.8	Very low	151 Å²	151	137.4 Å²	137.4	81%	0.807	72%	0.715	S	S	*	*			trans	174.5	128.8	142.2	-88	-25.9	0	0	0	110.7
754	S	26.9	Very low	31.5	Very low	103 Å²	103	141.8 Å²	141.8	72%	0.72	73%	0.733	S	S	*	*			trans	27.4	138.3	150	57.8	0	0	0	0	120.5
755	I	27.1	Very low	30.6	Very low	162 Å²	162	140.6 Å²	140.6	83%	0.831	74%	0.74	S	S	*	*				-153.7	140.5	66.7	-78.6	153.6	0	0	0	112
756	L	26.5	Very low	29.7	Very low	136 Å²	136	140.1 Å²	140.1	71%	0.712	75%	0.749	S	S	*	*			trans	-106.3	159	165.2	-104.6	155.2	0	0	0	107.4
757	P	30.5	Very low	28.8	Very low	104 Å²	104	139.7 Å²	139.7	68%	0.675	75%	0.754	S	S	*	*				-148.5	162.1	63.3	39.4	-17.8	0	0	0	115
758	N	26.9	Very low	28.3	Very low	150 Å²	150	146.1 Å²	146.1	80%	0.802	78%	0.779	S	S	*	*				-152	124.2	75.7	-86.1	-19.5	0	0	0	111.4
759	Q	27.8	Very low	28.1	Very low	157 Å²	157	151.3 Å²	151.3	73%	0.734	79%	0.789	S	S	*	*			trans	-91.7	122.7	163.9	-72.2	173.4	-39	0	0	108.3
760	D	26.8	Very low	28	Very low	154 Å²	154	155.8 Å²	155.8	82%	0.824	80%	0.798	S	S	*	*			trans	-159	150.7	147.4	-95.2	-36.3	0	0	0	108
761	N	31	Very low	27.9	Very low	165 Å²	165	156.8 Å²	156.8	88%	0.882	80%	0.796	S	S	*	*			trans	78.7	55.8	-171.1	-47.6	-60.8	0	0	0	116.4
762	I	26.8	Very low	28.1	Very low	152 Å²	152	156.3 Å²	156.3	78%	0.779	79%	0.794	S	S	*	*			trans	-91	120.5	146	-58	176.7	0	0	0	107.2
763	E	26.4	Very low	28.1	Very low	167 Å²	167	153 Å²	153	78%	0.78	79%	0.789	S	S	*	*			trans	156.8	153	138.7	-85.6	-168.3	-178.8	0	0	111.8
764	Q	29.6	Very low	28.4	Very low	164 Å²	164	151 Å²	151	77%	0.766	79%	0.787	S	S	*	*			trans	67.6	86.2	173	-50.3	-175.5	19.2	0	0	117.9
765	N	29.6	Very low	28.6	Very low	171 Å²	171	152.2 Å²	152.2	91%	0.914	78%	0.779	S	S	*	*				-166	108.2	103	-98.1	-48.6	0	0	0	112.6
766	S	27.6	Very low	29.1	Very low	103 Å²	103	147.3 Å²	147.3	72%	0.72	76%	0.763	S	S	*	*			trans	-93.9	148.1	179.5	-175.2	0	0	0	0	112
767	C	23.5	Very low	29.7	Very low	103 Å²	103	148.5 Å²	148.5	70%	0.696	77%	0.769	S	S	*	*			trans	55.5	112.1	152	70.7	0	0	0	0	120.6
768	K	30	Very low	30	Very low	206 Å²	206	150.4 Å²	150.4	90%	0.896	77%	0.774	S	S	*	*				-162.2	119.7	111.4	-102.8	152.2	-170	169.8	0	111.7
769	R	27.3	Very low	30.8	Very low	243 Å²	243	148.3 Å²	148.3	92%	0.917	76%	0.762	S	S	*	*			trans	-73.6	135.8	175.1	-60.2	174.6	-177.9	169.6	-0.1	109.8
770	K	30.7	Very low	31.5	Very low	216 Å²	216	144.5 Å²	144.5	94%	0.939	75%	0.75	S	S	*	*			trans	-133.1	137.6	146	-93	-168.9	175.2	-176.4	0	110.7
771	K	28.1	Very low	32.6	Very low	157 Å²	157	143.4 Å²	143.4	68%	0.683	74%	0.74	S	S	*	*			trans	-78.1	143	-178.2	165.2	-171.7	179.4	-177.1	0	109.3
772	D	32.1	Very low	33.6	Very low	148 Å²	148	140.9 Å²	140.9	79%	0.791	74%	0.736	S	S	*	*			trans	175.8	159.3	144.2	-80.9	-21.2	0	0	0	108.1
773	S	27.8	Very low	34.5	Very low	101 Å²	101	136.8 Å²	136.8	71%	0.706	72%	0.72	S	S	*	*				-174.8	74.1	-57.8	49.8	0	0	0	0	109.1
774	S	33.5	Very low	36.4	Very low	109 Å²	109	131 Å²	131	76%	0.762	69%	0.694	S	S	*	*			trans	-154.6	110.1	168.2	46.5	0	0	0	0	111
775	K	31.9	Very low	38.5	Very low	128 Å²	128	131.2 Å²	131.2	56%	0.557	69%	0.688	S	S	*	*			trans	-98.8	83.6	176	-75.9	177.3	179.4	169.3	0	110	S91	S91-K775 PolarHBondContact O-NZ 3.34Å
776	A	36.5	Very low	41	Very low	59 Å²	59	123.5 Å²	123.5	49%	0.488	65%	0.647	S	S	.	*			trans	-70.3	163.6	154.1	0	0	0	0	0	109.9	N778	A776-N778 PolarHBondContact O-N 3.31Å
777	L	38.6	Very low	43.8	Very low	161 Å²	161	122.2 Å²	122.2	84%	0.843	63%	0.627	S	S	*	*			trans	-77.8	90.3	176.3	-74.9	165.8	0	0	0	109.3	I779	L777-I779 VanDerWaalsContact C-N 3.28Å; L777-I779 PolarHBondContact O-N 3.06Å
778	N	37.4	Very low	47	Very low	145 Å²	145	117.3 Å²	117.3	78%	0.775	59%	0.594	S	S	*	*			trans	-63.4	88.8	173.6	-74.2	-0.4	0	0	0	110.8	A776	A776-N778 PolarHBondContact O-N 3.31Å
779	I	43.3	Very low	50	Low	105 Å²	105	108.5 Å²	108.5	54%	0.538	56%	0.557	S	S	.	*			trans	-56.8	122.9	140.2	-57.8	173.5	0	0	0	104.6	L777 E781 C783 I784	L777-I779 VanDerWaalsContact C-N 3.28Å; L777-I779 PolarHBondContact O-N 3.06Å; I779-E781 PolarHBondContact O-N 3.23Å; I779-C783 HydrophobicContact CG2-CB 3.47Å; I779-C783 VanDerWaalsContact CG2-CB 3.47Å; I779-I784 HydrophobicContact CG2-CG1 4.21Å
780	P	43.5	Very low	53.2	Low	77 Å²	77	96.9 Å²	96.9	50%	0.5	51%	0.513	S	S	.	.			trans	-60.8	139.7	177.5	27	-33.8	0	0	0	108.7	S782 C783	P780-S782 PolarHBondContact O-N 2.84Å; P780-C783 WeakPolarHBondContact O-CB 3.31Å; P780-C783 PolarHBondContact O-N 3.06Å
781	E	49.4	Very low	56.2	Low	131 Å²	131	89 Å²	89	61%	0.612	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-54.1	-26.7	-176	-63	-178.4	135.3	0	0	112.6	I779 C783 I784	I779-E781 PolarHBondContact O-N 3.23Å; E781-C783 PolarHBondContact O-N 2.82Å; E781-C783 VanDerWaalsContact O-N 3.14Å; E781-I784 PolarHBondContact O-N 3.02Å; E781-I784 VanDerWaalsContact O-N 3.12Å
782	S	51.8	Low	59.4	Low	112 Å²	112	82.7 Å²	82.7	78%	0.783	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-58.4	-17.3	172.1	62.2	0	0	0	0	116.1	P780	P780-S782 PolarHBondContact O-N 2.84Å
783	C	46.2	Very low	62.1	Low	66 Å²	66	77 Å²	77	45%	0.446	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-91.5	-17.3	177.3	-119.9	0	0	0	0	112.9	D435 I779 P780 E781	D435-C783 PolarHBondContact OD2-SG 3.32Å; I779-C783 HydrophobicContact CG2-CB 3.47Å; I779-C783 VanDerWaalsContact CG2-CB 3.47Å; P780-C783 WeakPolarHBondContact O-CB 3.31Å; P780-C783 PolarHBondContact O-N 3.06Å; E781-C783 PolarHBondContact O-N 2.82Å; E781-C783 VanDerWaalsContact O-N 3.14Å
784	I	65.4	Low	64.7	Low	47 Å²	47	77.5 Å²	77.5	24%	0.241	42%	0.424	C	S	.	.	S	Bend	trans	-97.6	126.6	-178.8	-57.4	175.6	0	0	0	107.8	I779 E781 H804 Y805	I779-I784 HydrophobicContact CG2-CG1 4.21Å; E781-I784 PolarHBondContact O-N 3.02Å; E781-I784 VanDerWaalsContact O-N 3.12Å; I784-H804 HydrophobicContact CB-CB 4.46Å; I784-H804 HydrophobicContact CG2-CB 3.93Å; I784-H804 PolarHBondContact O-CD2 3.48Å; I784-Y805 HydrophobicContact CD1-CE1 3.84Å; I784-Y805 VanDerWaalsContact CD1-OH 3.24Å; I784-Y805 WeakPolarHBondContact CD1-OH 3.39Å
785	R	74.5	Confident	66.9	Low	168 Å²	168	73.4 Å²	73.4	63%	0.634	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-75.2	130.7	-177.8	-161.6	166.7	-173.6	-167.2	-2.4	110.3	H1004	R785-H1004 WeakPolarHBondContact CD-NE2 3.46Å; R785-H1004 VanDerWaalsContact CZ-CE1 3.48Å; R785-H1004 PolarHBondContact NE-CE1 2.98Å; R785-H1004 PolarHBondContact NE-NE2 3.04Å; R785-H1004 VanDerWaalsContact NE-NE2 3.12Å; R785-H1004 PolarHBondContact NH1-CD2 2.99Å; R785-H1004 PolarHBondContact NH2-ND1 3.4Å
786	A	82.5	Confident	69.5	Low	8 Å²	8	67.5 Å²	67.5	7%	0.066	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-69.2	138.9	176.5	0	0	0	0	0	111.2	R802 I1002	A786-R802 HydrophobicContact CB-CB 3.83Å; A786-R802 HydrophobicContact CB-CG 4.18Å; A786-I1002 HydrophobicContact CB-CD1 3.5Å; A786-I1002 WeakPolarHBondContact O-CD1 3.37Å
787	R	86.5	Confident	71.8	Confident	77 Å²	77	69 Å²	69	29%	0.291	37%	0.373	S	S	.	.	S	Bend	trans	-90.5	-36.9	178.2	-53.8	179.3	68.1	165.2	4	111.3	M803 D849 Y854 I1002	R787-M803 PolarHBondContact N-O 3.25Å; R787-D849 IonicContact NH2-OD1 2.65Å; R787-Y854 WeakPolarHBondContact CB-OH 3.41Å; R787-I1002 PolarHBondContact O-N 3.18Å
788	A	91.3	Very high	74	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	167.2	176	0	0	0	0	0	111.3	M803 Y854 F999 G1000 L1001	A788-M803 HydrophobicContact CB-CB 4.23Å; A788-M803 PolarHBondContact O-N 3.32Å; A788-Y854 HydrophobicContact CB-CE1 4.27Å; A788-F999 HydrophobicContact CB-CD2 4.38Å; A788-F999 HydrophobicContact CB-CE1 4.42Å; A788-F999 HydrophobicContact CB-CE2 3.47Å; A788-F999 VanDerWaalsContact CB-CE2 3.47Å; A788-F999 HydrophobicContact CB-CZ 3.49Å; A788-F999 VanDerWaalsContact CB-CZ 3.49Å; A788-G1000 CarbonylContact C-O 3.55Å; A788-G1000 VanDerWaalsContact CA-O 3.24Å; A788-G1000 WeakPolarHBondContact CA-O 3.17Å; A788-L1001 HydrophobicContact CB-CD2 4.28Å
789	V	92.6	Very high	76.4	Confident	20 Å²	20	61.9 Å²	61.9	12%	0.121	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.2	177.1	-170.5	0	0	0	0	109.2	E800 T801 R802 G1000 I1002	V789-E800 HydrophobicContact CG1-CB 3.88Å; V789-T801 CarbonylContact C-O 3.22Å; V789-T801 WeakPolarHBondContact CA-O 3.44Å; V789-R802 HydrophobicContact CG2-CG 4.39Å; V789-G1000 PolarHBondContact N-O 3.23Å; V789-G1000 PolarHBondContact O-N 2.99Å; V789-I1002 HydrophobicContact CG2-CD1 3.47Å; V789-I1002 VanDerWaalsContact CG2-CD1 3.47Å; V789-I1002 HydrophobicContact CG2-CG1 3.72Å
790	L	94.6	Very high	78.6	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	109.3	164.9	-76.7	74.9	0	0	0	107.7	T801 L808 L818 I845 F997 V998 F999	L790-T801 PolarHBondContact N-O 2.87Å; L790-T801 PolarHBondContact O-N 3.21Å; L790-L808 HydrophobicContact CD1-CD2 3.81Å; L790-L808 HydrophobicContact CD2-CD2 3.98Å; L790-L818 HydrophobicContact CB-CD1 4.08Å; L790-L818 HydrophobicContact CD2-CD1 3.63Å; L790-L818 HydrophobicContact CG-CD1 4.47Å; L790-I845 HydrophobicContact CD1-CD1 4.2Å; L790-I845 HydrophobicContact CD2-CD1 3.88Å; L790-F997 HydrophobicContact CB-CB 4.37Å; L790-F997 HydrophobicContact CB-CD1 4.32Å; L790-V998 WeakPolarHBondContact CA-O 3.32Å; L790-F999 HydrophobicContact CD1-CD2 3.79Å; L790-F999 HydrophobicContact CD1-CE2 4.21Å; L790-F999 HydrophobicContact CG-CD2 4.28Å
791	T	94	Very high	80.8	Confident	51 Å²	51	58.6 Å²	58.6	31%	0.313	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124.1	178.1	-61.9	0	0	0	0	108.5	E800 F997 V998	T791-E800 HydrophobicContact CG2-CG 4.25Å; T791-E800 PolarHBondContact OG1-OE1 3.41Å; T791-F997 CarbonylContact O-C 3.52Å; T791-F997 WeakPolarHBondContact O-CA 3.26Å; T791-V998 PolarHBondContact N-O 3.49Å; T791-V998 PolarHBondContact O-N 2.98Å
792	P	93.3	Very high	82.8	Confident	24 Å²	24	59.2 Å²	59.2	16%	0.156	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	143.9	-179	29.8	-36.1	0	0	0	111.5	T796 Y823 F997	P792-T796 HydrophobicContact CB-CG2 3.84Å; P792-T796 WeakPolarHBondContact CB-O 3.24Å; P792-Y823 HydrophobicContact CB-CD1 4.27Å; P792-Y823 HydrophobicContact CB-CE1 4.1Å; P792-Y823 HydrophobicContact CG-CE1 4.16Å; P792-F997 HydrophobicContact CB-CD1 4.04Å; P792-F997 HydrophobicContact CB-CE1 3.95Å
793	C	90.5	Very high	84.7	Confident	27 Å²	27	53.9 Å²	53.9	18%	0.182	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	178.8	-177	64.8	0	0	0	0	112.6	G795 T796 K996 V998	C793-G795 PolarHBondContact O-N 2.78Å; C793-T796 VanDerWaalsContact O-CB 3.26Å; C793-T796 WeakPolarHBondContact O-CB 3.25Å; C793-T796 PolarHBondContact O-N 3.16Å; C793-T796 PolarHBondContact O-OG1 3.35Å; C793-K996 PolarHBondContact N-O 2.95Å; C793-K996 VanDerWaalsContact SG-C 3.6Å; C793-V998 HydrophobicContact CB-CG2 4.02Å
794	D	81.4	Confident	86.5	Confident	113 Å²	113	52.3 Å²	52.3	60%	0.604	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	50.4	172.3	-76.4	7.8	0	0	0	114.6	T796 K996	D794-T796 VanDerWaalsContact C-N 3.3Å; D794-T796 PolarHBondContact O-N 3.41Å; D794-K996 HydrophobicContact CB-CB 4.11Å; D794-K996 HydrophobicContact CB-CD 3.29Å; D794-K996 HydrophobicContact CB-CG 4.35Å; D794-K996 WeakPolarHBondContact OD2-CD 3.4Å; D794-K996 IonicContact OD2-NZ 3.64Å; D794-K996 PolarHBondContact OD2-NZ 3.19Å
795	G	78.9	Confident	87.5	Confident	22 Å²	22	55.5 Å²	55.5	23%	0.227	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	7.2	178.7	0	0	0	0	0	115.1	C793 L825 S826	C793-G795 PolarHBondContact O-N 2.78Å; G795-L825 CarbonylContact O-C 3.57Å; G795-L825 WeakPolarHBondContact O-CA 3.45Å; G795-S826 WeakPolarHBondContact CA-OG 3.15Å; G795-S826 PolarHBondContact O-N 3.21Å; G795-S826 PolarHBondContact O-OG 3.34Å
796	T	87.4	Confident	88.1	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	123.1	162.8	-57.3	0	0	0	0	109.4	P792 C793 D794 Y823 Y995 K996 F997	P792-T796 HydrophobicContact CB-CG2 3.84Å; P792-T796 WeakPolarHBondContact CB-O 3.24Å; C793-T796 VanDerWaalsContact O-CB 3.26Å; C793-T796 WeakPolarHBondContact O-CB 3.25Å; C793-T796 PolarHBondContact O-N 3.16Å; C793-T796 PolarHBondContact O-OG1 3.35Å; D794-T796 VanDerWaalsContact C-N 3.3Å; D794-T796 PolarHBondContact O-N 3.41Å; T796-Y823 HydrophobicContact CG2-CD1 3.92Å; T796-Y823 HydrophobicContact CG2-CG 4.33Å; T796-Y995 HydrophobicContact CG2-CD1 3.98Å; T796-K996 WeakPolarHBondContact CB-O 3.47Å; T796-K996 PolarHBondContact OG1-N 3.35Å; T796-K996 PolarHBondContact OG1-O 3.47Å; T796-F997 HydrophobicContact CG2-CE1 4.34Å; T796-F997 HydrophobicContact CG2-CZ 4.1Å
797	N	84.6	Confident	88.6	Confident	89 Å²	89	56.1 Å²	56.1	48%	0.476	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.4	-179.2	-72.9	-17.5	0	0	0	110.5	Y823 N824	N797-Y823 WeakPolarHBondContact O-CA 3.23Å; N797-N824 HydrophobicContact CB-CB 4.46Å; N797-N824 PolarHBondContact N-O 2.81Å; N797-N824 PolarHBondContact O-N 2.8Å
798	G	85.5	Confident	88.9	Confident	44 Å²	44	52.5 Å²	52.5	45%	0.454	26%	0.262	S	S	.	.	S	Bend	trans	171.7	-165.3	175.3	0	0	0	0	0	112
799	Y	86.4	Confident	89.1	Confident	114 Å²	114	53.2 Å²	53.2	45%	0.447	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-83.2	156	178.6	54.6	-92.2	0	0	0	112.2	T801 N822 Y823	Y799-T801 WeakPolarHBondContact CE2-OG1 3.3Å; Y799-T801 PolarHBondContact O-N 3.07Å; Y799-N822 HydrophobicContact CE1-CB 4.06Å; Y799-N822 PolarHBondContact OH-ND2 3.18Å; Y799-Y823 VanDerWaalsContact O-CE1 3.23Å; Y799-Y823 WeakPolarHBondContact O-CE1 3.43Å; Y799-Y823 VanDerWaalsContact O-CZ 3.32Å; Y799-Y823 PolarHBondContact O-OH 2.82Å
800	E	90	Very high	89.2	Confident	105 Å²	105	52.3 Å²	52.3	49%	0.491	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-68.6	128.4	168.6	-58.9	-171.6	136	0	0	110.3	V789 T791	V789-E800 HydrophobicContact CG1-CB 3.88Å; T791-E800 HydrophobicContact CG2-CG 4.25Å; T791-E800 PolarHBondContact OG1-OE1 3.41Å
801	T	91	Very high	89.2	Confident	7 Å²	7	52.3 Å²	52.3	4%	0.043	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	126.2	177.6	-76.1	0	0	0	0	110.4	V789 L790 Y799 L808 L818 Y823	V789-T801 CarbonylContact C-O 3.22Å; V789-T801 WeakPolarHBondContact CA-O 3.44Å; L790-T801 PolarHBondContact N-O 2.87Å; L790-T801 PolarHBondContact O-N 3.21Å; Y799-T801 WeakPolarHBondContact CE2-OG1 3.3Å; Y799-T801 PolarHBondContact O-N 3.07Å; T801-L808 HydrophobicContact CG2-CD1 3.75Å; T801-L818 HydrophobicContact CG2-CB 4.07Å; T801-L818 HydrophobicContact CG2-CD1 4.07Å; T801-L818 HydrophobicContact CG2-CG 4.14Å; T801-Y823 PolarHBondContact OG1-OH 2.89Å
802	R	90.7	Very high	89.1	Confident	144 Å²	144	52.2 Å²	52.2	54%	0.543	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	124.5	-178	-69.5	-178.6	-177	175.2	1.8	111.7	A786 V789 H804	A786-R802 HydrophobicContact CB-CB 3.83Å; A786-R802 HydrophobicContact CB-CG 4.18Å; V789-R802 HydrophobicContact CG2-CG 4.39Å; R802-H804 VanDerWaalsContact CB-CE1 3.48Å; R802-H804 WeakPolarHBondContact CB-CE1 3.49Å; R802-H804 PolarHBondContact O-N 2.84Å; R802-H804 PolarHBondContact O-ND1 3.39Å
803	M	90.5	Very high	88.8	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	94.4	173.6	-179	170.7	-179.3	0	0	109.7	R787 A788 Y805 R806 L808 I845 Y854	R787-M803 PolarHBondContact N-O 3.25Å; A788-M803 HydrophobicContact CB-CB 4.23Å; A788-M803 PolarHBondContact O-N 3.32Å; M803-Y805 WeakPolarHBondContact CE-O 3.44Å; M803-Y805 WeakPolarHBondContact CG-O 3.4Å; M803-R806 WeakPolarHBondContact CE-O 3.47Å; M803-L808 HydrophobicContact CB-CB 4.41Å; M803-L808 HydrophobicContact CB-CD1 4.13Å; M803-L808 HydrophobicContact CE-CB 4.45Å; M803-L808 HydrophobicContact CG-CB 4.01Å; M803-L808 HydrophobicContact SD-CB 4.02Å; M803-I845 HydrophobicContact CE-CG2 4.22Å; M803-I845 HydrophobicContact SD-CG2 3.97Å; M803-Y854 HydrophobicContact CE-CD1 4.2Å; M803-Y854 HydrophobicContact CE-CE1 4.06Å; M803-Y854 HydrophobicContact SD-CD1 4.13Å; M803-Y854 HydrophobicContact SD-CE1 3.91Å
804	H	84.8	Confident	88.6	Confident	32 Å²	32	56.5 Å²	56.5	15%	0.148	29%	0.288	C	S	.	.			trans	-80.2	-34.4	178	-59.1	109.5	0	0	0	113	I784 R802	I784-H804 HydrophobicContact CB-CB 4.46Å; I784-H804 HydrophobicContact CG2-CB 3.93Å; I784-H804 PolarHBondContact O-CD2 3.48Å; R802-H804 VanDerWaalsContact CB-CE1 3.48Å; R802-H804 WeakPolarHBondContact CB-CE1 3.49Å; R802-H804 PolarHBondContact O-N 2.84Å; R802-H804 PolarHBondContact O-ND1 3.39Å
805	Y	86.3	Confident	88.7	Confident	114 Å²	114	57.7 Å²	57.7	45%	0.447	30%	0.295	S	S	.	.	S	Bend	trans	-102.4	179.2	-173.9	-59.2	-69.6	0	0	0	112.6	I784 M803 Q807	I784-Y805 HydrophobicContact CD1-CE1 3.84Å; I784-Y805 VanDerWaalsContact CD1-OH 3.24Å; I784-Y805 WeakPolarHBondContact CD1-OH 3.39Å; M803-Y805 WeakPolarHBondContact CE-O 3.44Å; M803-Y805 WeakPolarHBondContact CG-O 3.4Å; Y805-Q807 PolarHBondContact O-N 3.28Å
806	R	88.3	Confident	89.3	Confident	88 Å²	88	57.2 Å²	57.2	33%	0.332	29%	0.288	S	S	.	.	S	Bend	trans	-68.3	-12.1	175.2	-172.5	171.5	165.3	172.7	-7.8	113	M803 F846 Y847 D848 D849	M803-R806 WeakPolarHBondContact CE-O 3.47Å; R806-F846 CarbonylContact O-C 3.55Å; R806-F846 VanDerWaalsContact O-CA 3.31Å; R806-F846 WeakPolarHBondContact O-CA 3.4Å; R806-Y847 VanDerWaalsContact CG-O 3.24Å; R806-Y847 WeakPolarHBondContact CG-O 3.49Å; R806-Y847 PolarHBondContact NE-O 3.21Å; R806-Y847 PolarHBondContact NH2-O 3.23Å; R806-Y847 PolarHBondContact O-N 2.83Å; R806-D848 IonicContact CZ-OD1 3.53Å; R806-D848 IonicContact NH2-OD1 2.73Å; R806-D848 PolarHBondContact NH2-OD1 3.3Å; R806-D849 IonicContact CZ-OD2 3.33Å; R806-D849 IonicContact NE-OD2 3.73Å; R806-D849 IonicContact NH1-OD1 3.82Å; R806-D849 IonicContact NH1-OD2 3.22Å; R806-D849 PolarHBondContact NH1-OD2 2.9Å
807	Q	92.2	Very high	89.4	Confident	101 Å²	101	61.4 Å²	61.4	47%	0.472	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	143.6	-179.4	-172.3	-179.9	-19.7	0	0	110.8	Y805 T809 T844 I845	Y805-Q807 PolarHBondContact O-N 3.28Å; Q807-T809 HydrophobicContact CG-CG2 4.49Å; Q807-T844 HydrophobicContact CG-CG2 3.38Å; Q807-I845 CarbonylContact C-O 3.58Å; Q807-I845 WeakPolarHBondContact CA-O 3.49Å
808	L	93.8	Very high	89.8	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	124.6	170.8	-177.2	105.1	0	0	0	108.7	L790 T801 M803 V810 H817 T844 I845	L790-L808 HydrophobicContact CD1-CD2 3.81Å; L790-L808 HydrophobicContact CD2-CD2 3.98Å; T801-L808 HydrophobicContact CG2-CD1 3.75Å; M803-L808 HydrophobicContact CB-CB 4.41Å; M803-L808 HydrophobicContact CB-CD1 4.13Å; M803-L808 HydrophobicContact CE-CB 4.45Å; M803-L808 HydrophobicContact CG-CB 4.01Å; M803-L808 HydrophobicContact SD-CB 4.02Å; L808-V810 HydrophobicContact CD2-CG2 4.11Å; L808-H817 HydrophobicContact CD1-CB 3.74Å; L808-H817 HydrophobicContact CG-CB 4Å; L808-T844 WeakPolarHBondContact O-CA 3.37Å; L808-I845 HydrophobicContact CB-CB 4.41Å; L808-I845 HydrophobicContact CD2-CD1 4.16Å; L808-I845 PolarHBondContact N-O 2.99Å; L808-I845 PolarHBondContact O-N 3.42Å
809	T	95.1	Very high	90.2	Very high	15 Å²	15	55.6 Å²	55.6	9%	0.092	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	139.4	-179.8	56.3	0	0	0	0	111.1	Q807 C816 H817 L818 T844	Q807-T809 HydrophobicContact CG-CG2 4.49Å; T809-C816 WeakPolarHBondContact OG1-CA 3.38Å; T809-H817 PolarHBondContact N-ND1 3.46Å; T809-H817 PolarHBondContact O-N 2.91Å; T809-H817 PolarHBondContact OG1-N 3.28Å; T809-H817 PolarHBondContact OG1-ND1 3.06Å; T809-L818 PolarHBondContact O-N 3.19Å; T809-T844 HydrophobicContact CG2-CG2 4.33Å
810	V	94.9	Very high	90.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.5	-175.9	-173.3	0	0	0	0	110.1	L808 L818 L820 H842 A843 F992	L808-V810 HydrophobicContact CD2-CG2 4.11Å; V810-L818 HydrophobicContact CG1-CB 4.31Å; V810-L818 HydrophobicContact CG1-CD2 4.18Å; V810-L818 HydrophobicContact CG2-CB 4.1Å; V810-L820 HydrophobicContact CG1-CD1 3.9Å; V810-L820 HydrophobicContact CG1-CD2 4.22Å; V810-L820 HydrophobicContact CG1-CG 3.99Å; V810-H842 PolarHBondContact O-N 3.15Å; V810-A843 PolarHBondContact N-O 2.94Å; V810-A843 PolarHBondContact O-N 2.79Å; V810-F992 HydrophobicContact CB-CE2 4.39Å; V810-F992 HydrophobicContact CB-CZ 4.2Å; V810-F992 HydrophobicContact CG1-CD2 3.84Å; V810-F992 HydrophobicContact CG1-CE1 4.38Å; V810-F992 HydrophobicContact CG1-CE2 3.69Å; V810-F992 HydrophobicContact CG1-CG 4.25Å; V810-F992 HydrophobicContact CG1-CZ 3.95Å; V810-F992 HydrophobicContact CG2-CE2 4.27Å; V810-F992 HydrophobicContact CG2-CZ 4.05Å
811	G	93.4	Very high	90.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.2	-170.7	174.4	0	0	0	0	0	113.1	L818 C819 L820 P840	G811-L818 PolarHBondContact N-O 3.35Å; G811-C819 CarbonylContact O-C 3.21Å; G811-C819 WeakPolarHBondContact O-CA 3.44Å; G811-L820 PolarHBondContact O-N 3.41Å; G811-P840 CarbonylContact C-O 3.43Å; G811-P840 WeakPolarHBondContact CA-O 3.42Å
812	T	91.6	Very high	90	Very high	50 Å²	50	50.4 Å²	50.4	31%	0.307	25%	0.253	S	S	.	.	S	Bend	trans	-88.1	-5.1	175.7	54	0	0	0	0	114.6	L820 V838 S839 P840	T812-L820 HydrophobicContact CG2-CB 4.43Å; T812-V838 HydrophobicContact CG2-CB 4.14Å; T812-V838 HydrophobicContact CG2-CG1 3.68Å; T812-S839 PolarHBondContact N-O 3.48Å; T812-S839 PolarHBondContact OG1-O 2.95Å; T812-P840 PolarHBondContact N-O 2.9Å; T812-P840 VanDerWaalsContact OG1-CA 3.3Å; T812-P840 WeakPolarHBondContact OG1-CA 3.46Å
813	S	88.8	Confident	89.9	Confident	26 Å²	26	43.6 Å²	43.6	18%	0.182	23%	0.227	C	C	.	.	S	Bend	trans	-69	140.5	174.2	-171.3	0	0	0	0	111.7	D815 C816 P840	S813-D815 PolarHBondContact O-N 3.23Å; S813-D815 PolarHBondContact OG-N 2.87Å; S813-D815 PolarHBondContact OG-OD2 2.86Å; S813-C816 WeakPolarHBondContact O-CB 3.4Å; S813-C816 PolarHBondContact O-N 2.83Å; S813-C816 VanDerWaalsContact O-N 3.11Å; S813-P840 VanDerWaalsContact CB-O 3.25Å; S813-P840 WeakPolarHBondContact CB-O 3.46Å; S813-P840 PolarHBondContact N-O 2.96Å
814	P	84.5	Confident	89.7	Confident	114 Å²	114	49 Å²	49	74%	0.74	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.9	170	28.4	-36.9	0	0	0	113.7	C816	P814-C816 VanDerWaalsContact C-N 3.29Å
815	D	85.3	Confident	89.6	Confident	138 Å²	138	50.3 Å²	50.3	74%	0.738	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-6	175.9	-49	-47.7	0	0	0	113.1	S813	S813-D815 PolarHBondContact O-N 3.23Å; S813-D815 PolarHBondContact OG-N 2.87Å; S813-D815 PolarHBondContact OG-OD2 2.86Å
816	C	89.8	Confident	88.5	Confident	12 Å²	12	48.4 Å²	48.4	8%	0.081	27%	0.267	C	S	.	.	S	Bend	trans	-82.8	133	177.5	-73.2	0	0	0	0	111.3	T809 S813 P814 L818 C819 P840	T809-C816 WeakPolarHBondContact OG1-CA 3.38Å; S813-C816 WeakPolarHBondContact O-CB 3.4Å; S813-C816 PolarHBondContact O-N 2.83Å; S813-C816 VanDerWaalsContact O-N 3.11Å; P814-C816 VanDerWaalsContact C-N 3.29Å; C816-L818 PolarHBondContact O-N 2.83Å; C816-C819 PolarHBondContact O-N 2.82Å; C816-P840 PolarHBondContact SG-O 2.95Å
817	H	90.8	Very high	87	Confident	94 Å²	94	47 Å²	47	44%	0.435	27%	0.271	S	S	.	.	S	Bend	trans	-56	-41.1	177	-62.8	86.6	0	0	0	111.7	L808 T809	L808-H817 HydrophobicContact CD1-CB 3.74Å; L808-H817 HydrophobicContact CG-CB 4Å; T809-H817 PolarHBondContact N-ND1 3.46Å; T809-H817 PolarHBondContact O-N 2.91Å; T809-H817 PolarHBondContact OG1-N 3.28Å; T809-H817 PolarHBondContact OG1-ND1 3.06Å
818	L	92.8	Very high	85	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	93.5	166.4	-158.2	162	0	0	0	108.7	L790 T801 T809 V810 G811 C816 L820 Y823 F997	L790-L818 HydrophobicContact CB-CD1 4.08Å; L790-L818 HydrophobicContact CD2-CD1 3.63Å; L790-L818 HydrophobicContact CG-CD1 4.47Å; T801-L818 HydrophobicContact CG2-CB 4.07Å; T801-L818 HydrophobicContact CG2-CD1 4.07Å; T801-L818 HydrophobicContact CG2-CG 4.14Å; T809-L818 PolarHBondContact O-N 3.19Å; V810-L818 HydrophobicContact CG1-CB 4.31Å; V810-L818 HydrophobicContact CG1-CD2 4.18Å; V810-L818 HydrophobicContact CG2-CB 4.1Å; G811-L818 PolarHBondContact N-O 3.35Å; C816-L818 PolarHBondContact O-N 2.83Å; L818-L820 HydrophobicContact CD2-CD2 3.51Å; L818-L820 HydrophobicContact CD2-CG 4.04Å; L818-L820 PolarHBondContact O-N 2.84Å; L818-Y823 HydrophobicContact CD2-CD2 4.05Å; L818-Y823 HydrophobicContact CD2-CE2 3.54Å; L818-Y823 HydrophobicContact CG-CE2 4.01Å; L818-F997 HydrophobicContact CD1-CD1 4.23Å; L818-F997 HydrophobicContact CD1-CE1 3.96Å; L818-F997 HydrophobicContact CD1-CZ 4.16Å; L818-F997 HydrophobicContact CD2-CE1 4.2Å; L818-F997 HydrophobicContact CD2-CE2 4.29Å; L818-F997 HydrophobicContact CD2-CZ 3.73Å
819	C	92.5	Very high	82.9	Confident	11 Å²	11	55.4 Å²	55.4	7%	0.074	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	103.9	174	-176	0	0	0	0	110.2	G811 C816 A821 N822 Y823	G811-C819 CarbonylContact O-C 3.21Å; G811-C819 WeakPolarHBondContact O-CA 3.44Å; C816-C819 PolarHBondContact O-N 2.82Å; C819-A821 PolarHBondContact O-N 3.02Å; C819-A821 VanDerWaalsContact O-N 3.11Å; C819-N822 WeakPolarHBondContact O-CB 3.24Å; C819-N822 PolarHBondContact O-N 3.11Å; C819-Y823 WeakPolarHBondContact O-CD2 3.32Å
820	L	90.8	Very high	80.4	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-61.1	-21.3	-179.9	-67	171.3	0	0	0	112.6	V810 G811 T812 L818 N822 Y823 V838 F992 Y995 F997	V810-L820 HydrophobicContact CG1-CD1 3.9Å; V810-L820 HydrophobicContact CG1-CD2 4.22Å; V810-L820 HydrophobicContact CG1-CG 3.99Å; G811-L820 PolarHBondContact O-N 3.41Å; T812-L820 HydrophobicContact CG2-CB 4.43Å; L818-L820 HydrophobicContact CD2-CD2 3.51Å; L818-L820 HydrophobicContact CD2-CG 4.04Å; L818-L820 PolarHBondContact O-N 2.84Å; L820-N822 PolarHBondContact O-N 3.41Å; L820-Y823 PolarHBondContact O-N 3.05Å; L820-V838 HydrophobicContact CB-CG1 4.44Å; L820-V838 HydrophobicContact CD1-CG1 3.34Å; L820-F992 HydrophobicContact CD1-CB 3.91Å; L820-F992 HydrophobicContact CD1-CG 4.42Å; L820-F992 HydrophobicContact CD2-CD2 4.44Å; L820-Y995 HydrophobicContact CB-CD2 4.31Å; L820-Y995 HydrophobicContact CB-CE2 4.24Å; L820-Y995 HydrophobicContact CD1-CD2 4.41Å; L820-Y995 HydrophobicContact CD2-CD1 4.27Å; L820-Y995 HydrophobicContact CD2-CD2 4.2Å; L820-Y995 HydrophobicContact CD2-CG 3.86Å; L820-Y995 PolarHBondContact O-OH 3.22Å; L820-F997 HydrophobicContact CD2-CE2 3.64Å; L820-F997 HydrophobicContact CD2-CZ 3.77Å
821	A	86.5	Confident	78	Confident	28 Å²	28	65.2 Å²	65.2	23%	0.231	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-68.2	-11.8	175	0	0	0	0	0	114.3	C819 K834	C819-A821 PolarHBondContact O-N 3.02Å; C819-A821 VanDerWaalsContact O-N 3.11Å; A821-K834 PolarHBondContact O-NZ 2.86Å
822	N	86.4	Confident	76	Confident	89 Å²	89	73.7 Å²	73.7	48%	0.476	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-92.1	-8.2	175.1	-63.3	-10.6	0	0	0	113.4	Y799 C819 L820	Y799-N822 HydrophobicContact CE1-CB 4.06Å; Y799-N822 PolarHBondContact OH-ND2 3.18Å; C819-N822 WeakPolarHBondContact O-CB 3.24Å; C819-N822 PolarHBondContact O-N 3.11Å; L820-N822 PolarHBondContact O-N 3.41Å
823	Y	89.5	Confident	74.5	Confident	1 Å²	1	77.5 Å²	77.5	0%	0.004	43%	0.431	C	S	.	.			trans	-102	143.5	179.9	-68.9	-95.9	0	0	0	110.2	P792 T796 N797 Y799 T801 L818 C819 L820 Y995 F997	P792-Y823 HydrophobicContact CB-CD1 4.27Å; P792-Y823 HydrophobicContact CB-CE1 4.1Å; P792-Y823 HydrophobicContact CG-CE1 4.16Å; T796-Y823 HydrophobicContact CG2-CD1 3.92Å; T796-Y823 HydrophobicContact CG2-CG 4.33Å; N797-Y823 WeakPolarHBondContact O-CA 3.23Å; Y799-Y823 VanDerWaalsContact O-CE1 3.23Å; Y799-Y823 WeakPolarHBondContact O-CE1 3.43Å; Y799-Y823 VanDerWaalsContact O-CZ 3.32Å; Y799-Y823 PolarHBondContact O-OH 2.82Å; T801-Y823 PolarHBondContact OG1-OH 2.89Å; L818-Y823 HydrophobicContact CD2-CD2 4.05Å; L818-Y823 HydrophobicContact CD2-CE2 3.54Å; L818-Y823 HydrophobicContact CG-CE2 4.01Å; C819-Y823 WeakPolarHBondContact O-CD2 3.32Å; L820-Y823 PolarHBondContact O-N 3.05Å; Y823-Y995 WeakPolarHBondContact O-CE1 3.45Å; Y823-F997 HydrophobicContact CD1-CE1 4.03Å; Y823-F997 HydrophobicContact CD1-CZ 4.21Å; Y823-F997 HydrophobicContact CD2-CZ 4.38Å; Y823-F997 AromaticContact CE1-CE1 3.69Å; Y823-F997 HydrophobicContact CE1-CE1 3.69Å; Y823-F997 HydrophobicContact CE1-CZ 4.25Å; Y823-F997 HydrophobicContact CE2-CE1 4.37Å; Y823-F997 HydrophobicContact CE2-CZ 4.4Å; Y823-F997 HydrophobicContact CG-CZ 4.3Å; Y823-F997 AromaticContact CZ-CE1 3.86Å
824	N	85.7	Confident	73.8	Confident	114 Å²	114	82.5 Å²	82.5	61%	0.61	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	149.5	176.9	-64.6	-41.4	0	0	0	110	N797	N797-N824 HydrophobicContact CB-CB 4.46Å; N797-N824 PolarHBondContact N-O 2.81Å; N797-N824 PolarHBondContact O-N 2.8Å
825	L	82	Confident	73.7	Confident	60 Å²	60	77.8 Å²	77.8	31%	0.314	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.1	168.6	-89.6	92.5	0	0	0	111.4	G795 C994 Y995	G795-L825 CarbonylContact O-C 3.57Å; G795-L825 WeakPolarHBondContact O-CA 3.45Å; L825-C994 HydrophobicContact CD1-CB 4.37Å; L825-C994 HydrophobicContact CD2-CB 3.51Å; L825-C994 WeakPolarHBondContact CD2-SG 3.48Å; L825-Y995 HydrophobicContact CD1-CD1 3.64Å; L825-Y995 HydrophobicContact CD1-CD2 4.36Å; L825-Y995 HydrophobicContact CD1-CE1 3.38Å; L825-Y995 HydrophobicContact CD1-CE2 4.15Å; L825-Y995 HydrophobicContact CD1-CG 4.13Å
826	S	65.1	Low	73.5	Confident	74 Å²	74	73.9 Å²	73.9	52%	0.517	40%	0.402	S	S	.	.			trans	-109.9	5	-178.9	77.8	0	0	0	0	114.9	G795	G795-S826 WeakPolarHBondContact CA-OG 3.15Å; G795-S826 PolarHBondContact O-N 3.21Å; G795-S826 PolarHBondContact O-OG 3.34Å
827	S	56.7	Low	73.2	Confident	58 Å²	58	74.4 Å²	74.4	41%	0.406	40%	0.403	S	S	.	.	S	Bend	trans	-100.4	106.5	-176.5	52.6	0	0	0	0	113.3	Y829	S827-Y829 PolarHBondContact O-N 3.25Å
828	T	48.7	Very low	73.1	Confident	142 Å²	142	70.6 Å²	70.6	87%	0.871	39%	0.387	S	S	*	.	S	Bend	trans	32.1	-9	140.7	7.6	0	0	0	0	124.8
829	Y	50	Low	72.9	Confident	138 Å²	138	71.3 Å²	71.3	54%	0.541	39%	0.392	S	S	.	.	S	Bend	trans	-106.1	92.5	179.3	-71.4	-72.1	0	0	0	111.5	S827 D943	S827-Y829 PolarHBondContact O-N 3.25Å; Y829-D943 WeakPolarHBondContact CE2-OD2 3.47Å; Y829-D943 PolarHBondContact OH-OD2 3.17Å
830	N	43.1	Very low	72.8	Confident	89 Å²	89	74.8 Å²	74.8	48%	0.476	41%	0.414	S	S	.	.	S	Bend	trans	50.3	106.7	166.1	-64.5	-50	0	0	0	118.7	M941	N830-M941 HydrophobicContact CB-CE 3.4Å
831	N	45	Very low	72.8	Confident	132 Å²	132	78.2 Å²	78.2	71%	0.706	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	67.9	146.9	-65	-13.2	0	0	0	119.2	D833	N831-D833 PolarHBondContact O-N 3.19Å
832	N	49.9	Very low	73.1	Confident	177 Å²	177	76.9 Å²	76.9	95%	0.947	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	7.1	158	-74.5	-12.4	0	0	0	117.9
833	D	61	Low	73.5	Confident	131 Å²	131	72.7 Å²	72.7	70%	0.701	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-84.5	135.3	-170.3	-81	-33.6	0	0	0	110.8	N831	N831-D833 PolarHBondContact O-N 3.19Å
834	K	73.1	Confident	73.8	Confident	130 Å²	130	72.9 Å²	72.9	57%	0.565	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-66.1	141	179.7	-62.5	-175.8	-178.2	-167.7	0	109.5	A821 S836	A821-K834 PolarHBondContact O-NZ 2.86Å; K834-S836 PolarHBondContact O-N 2.88Å
835	C	82.4	Confident	74.2	Confident	15 Å²	15	67.5 Å²	67.5	10%	0.101	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-52.4	124	177.4	177.7	0	0	0	0	111.3	F837 V838 C944 C994 Y995	C835-F837 VanDerWaalsContact C-N 3.34Å; C835-F837 PolarHBondContact SG-N 3.27Å; C835-V838 HydrophobicContact CB-CG2 3.84Å; C835-C944 PolarHBondContact SG-SG 2.93Å; C835-C994 HydrophobicContact CB-CB 3.83Å; C835-C994 PolarHBondContact SG-N 3.47Å; C835-C994 VanDerWaalsContact SG-N 3.39Å; C835-Y995 HydrophobicContact CB-CD2 4.31Å; C835-Y995 HydrophobicContact CB-CE2 3.82Å
836	S	81	Confident	74.8	Confident	56 Å²	56	66.9 Å²	66.9	39%	0.392	36%	0.364	S	S	.	.	S	Bend	trans	-72.4	-25.5	178.8	49.7	0	0	0	0	113.4	K834 V838	K834-S836 PolarHBondContact O-N 2.88Å; S836-V838 PolarHBondContact O-N 2.63Å
837	F	84.9	Confident	76.1	Confident	23 Å²	23	64.5 Å²	64.5	10%	0.101	34%	0.344	C	S	.	.	S	Bend	trans	-83.7	44.3	-179.8	-61.2	-82.9	0	0	0	112.3	C835 Y862 C944 T945	C835-F837 VanDerWaalsContact C-N 3.34Å; C835-F837 PolarHBondContact SG-N 3.27Å; F837-Y862 HydrophobicContact CB-CD1 4.47Å; F837-Y862 HydrophobicContact CB-CD2 4.48Å; F837-Y862 HydrophobicContact CB-CG 4.12Å; F837-Y862 AromaticContact CD1-CD1 3.86Å; F837-Y862 HydrophobicContact CD1-CD1 3.86Å; F837-Y862 HydrophobicContact CD1-CE1 4.45Å; F837-Y862 HydrophobicContact CD1-CG 4.32Å; F837-Y862 WeakPolarHBondContact O-CD2 3.47Å; F837-C944 WeakPolarHBondContact CD2-O 3.43Å; F837-C944 VanDerWaalsContact CD2-SG 3.6Å; F837-T945 HydrophobicContact CE2-CG2 4.02Å; F837-T945 HydrophobicContact CZ-CG2 3.82Å
838	V	88.2	Confident	77.5	Confident	14 Å²	14	62.5 Å²	62.5	9%	0.085	33%	0.329	C	S	.	.			trans	-140.1	122.5	179.6	-169	0	0	0	0	111.3	T812 L820 C835 S836 H842 Y995	T812-V838 HydrophobicContact CG2-CB 4.14Å; T812-V838 HydrophobicContact CG2-CG1 3.68Å; L820-V838 HydrophobicContact CB-CG1 4.44Å; L820-V838 HydrophobicContact CD1-CG1 3.34Å; C835-V838 HydrophobicContact CB-CG2 3.84Å; S836-V838 PolarHBondContact O-N 2.63Å; V838-H842 WeakPolarHBondContact CG1-ND1 3.42Å; V838-Y995 HydrophobicContact CG2-CD2 3.99Å; V838-Y995 HydrophobicContact CG2-CE2 4.02Å
839	S	88.5	Confident	79	Confident	16 Å²	16	59.3 Å²	59.3	11%	0.112	31%	0.306	C	S	.	.			trans	-86.3	163.5	177.9	62.8	0	0	0	0	113.7	T812 H841 H842	T812-S839 PolarHBondContact N-O 3.48Å; T812-S839 PolarHBondContact OG1-O 2.95Å; S839-H841 PolarHBondContact O-N 3.38Å; S839-H841 VanDerWaalsContact OG-C 3.22Å; S839-H841 PolarHBondContact OG-O 2.88Å; S839-H842 WeakPolarHBondContact OG-CA 3.36Å; S839-H842 PolarHBondContact OG-N 2.87Å
840	P	89.4	Confident	80.2	Confident	83 Å²	83	63.6 Å²	63.6	54%	0.539	32%	0.321	S	S	.	.	S	Bend	trans	-56.7	-35.6	174.2	-27.6	36.8	0	0	0	114	G811 T812 S813 C816	G811-P840 CarbonylContact C-O 3.43Å; G811-P840 WeakPolarHBondContact CA-O 3.42Å; T812-P840 PolarHBondContact N-O 2.9Å; T812-P840 VanDerWaalsContact OG1-CA 3.3Å; T812-P840 WeakPolarHBondContact OG1-CA 3.46Å; S813-P840 VanDerWaalsContact CB-O 3.25Å; S813-P840 WeakPolarHBondContact CB-O 3.46Å; S813-P840 PolarHBondContact N-O 2.96Å; C816-P840 PolarHBondContact SG-O 2.95Å
841	H	92.4	Very high	82.1	Confident	73 Å²	73	62.5 Å²	62.5	34%	0.338	32%	0.318	S	S	.	.	S	Bend	trans	-129.1	103.1	170.9	-169.9	69.8	0	0	0	107.7	S839 T844 Y859	S839-H841 PolarHBondContact O-N 3.38Å; S839-H841 VanDerWaalsContact OG-C 3.22Å; S839-H841 PolarHBondContact OG-O 2.88Å; H841-T844 PolarHBondContact CE1-OG1 3.33Å; H841-T844 VanDerWaalsContact CE1-OG1 3.26Å; H841-T844 PolarHBondContact NE2-OG1 3.15Å; H841-Y859 AromaticContact CD2-CD2 3.95Å; H841-Y859 AromaticContact CD2-CG 3.82Å; H841-Y859 AromaticContact NE2-CD2 3.73Å
842	H	92.5	Very high	84	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.312	C	S	.	.			trans	-96.1	-48.6	-167.4	-163.6	122.5	0	0	0	111.5	V810 V838 S839 Y859 S860 G863 T864 F992	V810-H842 PolarHBondContact O-N 3.15Å; V838-H842 WeakPolarHBondContact CG1-ND1 3.42Å; S839-H842 WeakPolarHBondContact OG-CA 3.36Å; S839-H842 PolarHBondContact OG-N 2.87Å; H842-Y859 CarbonylContact O-C 3.52Å; H842-Y859 PolarHBondContact O-N 3.49Å; H842-S860 WeakPolarHBondContact CD2-CB 3.36Å; H842-S860 PolarHBondContact CE1-OG 2.92Å; H842-S860 WeakPolarHBondContact NE2-CB 3.19Å; H842-S860 PolarHBondContact NE2-OG 2.8Å; H842-S860 PolarHBondContact O-N 2.97Å; H842-G863 PolarHBondContact NE2-O 3.02Å; H842-G863 VanDerWaalsContact NE2-O 3.12Å; H842-T864 PolarHBondContact CD2-OG1 3.21Å; H842-F992 AromaticContact CD2-CD1 3.49Å; H842-F992 VanDerWaalsContact CD2-CD1 3.49Å; H842-F992 WeakPolarHBondContact CD2-CD1 3.24Å; H842-F992 AromaticContact NE2-CD1 3.84Å
843	A	94.3	Very high	85.8	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	161.9	177.6	0	0	0	0	0	110.7	V810 L856 I857 F992	V810-A843 PolarHBondContact N-O 2.94Å; V810-A843 PolarHBondContact O-N 2.79Å; A843-L856 HydrophobicContact CB-CD1 4.47Å; A843-L856 HydrophobicContact CB-CD2 4.04Å; A843-L856 HydrophobicContact CB-CG 4.18Å; A843-I857 CarbonylContact C-O 3.17Å; A843-I857 VanDerWaalsContact CA-O 3.24Å; A843-I857 WeakPolarHBondContact CA-O 3.29Å; A843-I857 WeakPolarHBondContact CB-O 3.46Å; A843-F992 HydrophobicContact CB-CD1 4.29Å; A843-F992 HydrophobicContact CB-CE1 3.5Å; A843-F992 VanDerWaalsContact CB-CE1 3.5Å; A843-F992 HydrophobicContact CB-CZ 4.23Å
844	T	95	Very high	87.3	Confident	6 Å²	6	51.6 Å²	51.6	4%	0.037	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	127.4	167.3	-68	0	0	0	0	109.2	Q807 L808 T809 H841 L856 I857	Q807-T844 HydrophobicContact CG-CG2 3.38Å; L808-T844 WeakPolarHBondContact O-CA 3.37Å; T809-T844 HydrophobicContact CG2-CG2 4.33Å; H841-T844 PolarHBondContact CE1-OG1 3.33Å; H841-T844 VanDerWaalsContact CE1-OG1 3.26Å; H841-T844 PolarHBondContact NE2-OG1 3.15Å; T844-L856 WeakPolarHBondContact O-CA 3.5Å; T844-I857 PolarHBondContact N-O 3.4Å; T844-I857 PolarHBondContact O-N 2.8Å
845	I	95.6	Very high	88.3	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	129.4	166.4	-60.2	172.1	0	0	0	107.3	L790 M803 Q807 L808 Y854 E855 L856 L984 I990 F999	L790-I845 HydrophobicContact CD1-CD1 4.2Å; L790-I845 HydrophobicContact CD2-CD1 3.88Å; M803-I845 HydrophobicContact CE-CG2 4.22Å; M803-I845 HydrophobicContact SD-CG2 3.97Å; Q807-I845 CarbonylContact C-O 3.58Å; Q807-I845 WeakPolarHBondContact CA-O 3.49Å; L808-I845 HydrophobicContact CB-CB 4.41Å; L808-I845 HydrophobicContact CD2-CD1 4.16Å; L808-I845 PolarHBondContact N-O 2.99Å; L808-I845 PolarHBondContact O-N 3.42Å; I845-Y854 HydrophobicContact CG2-CD1 4.4Å; I845-E855 CarbonylContact C-O 3.52Å; I845-E855 WeakPolarHBondContact CA-O 3.19Å; I845-L856 HydrophobicContact CD1-CD1 4.37Å; I845-L856 HydrophobicContact CG1-CB 4.21Å; I845-L856 HydrophobicContact CG1-CD1 3.94Å; I845-L856 HydrophobicContact CG1-CG 4.16Å; I845-L984 HydrophobicContact CB-CD1 4.45Å; I845-L984 HydrophobicContact CD1-CD1 3.71Å; I845-L984 HydrophobicContact CG1-CD1 3.82Å; I845-L984 HydrophobicContact CG2-CD1 3.81Å; I845-I990 HydrophobicContact CD1-CD1 4.08Å; I845-F999 HydrophobicContact CG2-CE2 4.47Å
846	F	93.6	Very high	88.9	Confident	47 Å²	47	46.1 Å²	46.1	21%	0.206	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	152.5	168.9	67.1	-77.6	0	0	0	110	R806 D848 Y854 E855 I857	R806-F846 CarbonylContact O-C 3.55Å; R806-F846 VanDerWaalsContact O-CA 3.31Å; R806-F846 WeakPolarHBondContact O-CA 3.4Å; F846-D848 HydrophobicContact CD2-CB 4.44Å; F846-D848 HydrophobicContact CE2-CB 4.2Å; F846-Y854 CarbonylContact O-C 3.56Å; F846-Y854 WeakPolarHBondContact O-CA 3.48Å; F846-E855 HydrophobicContact CD1-CB 4.02Å; F846-E855 WeakPolarHBondContact CD1-O 3.38Å; F846-E855 HydrophobicContact CD2-CB 4.4Å; F846-E855 HydrophobicContact CE1-CB 3.39Å; F846-E855 HydrophobicContact CE2-CB 3.85Å; F846-E855 HydrophobicContact CE2-CG 4.46Å; F846-E855 HydrophobicContact CG-CB 4.49Å; F846-E855 HydrophobicContact CZ-CB 3.32Å; F846-E855 HydrophobicContact CZ-CG 4.13Å; F846-E855 VanDerWaalsContact CZ-OE2 3.24Å; F846-E855 WeakPolarHBondContact CZ-OE2 3.44Å; F846-E855 PolarHBondContact N-O 3.22Å; F846-E855 PolarHBondContact O-N 2.83Å; F846-I857 HydrophobicContact CD1-CD1 4.13Å; F846-I857 HydrophobicContact CE1-CD1 3.41Å; F846-I857 VanDerWaalsContact CE1-CD1 3.41Å; F846-I857 HydrophobicContact CE1-CG1 3.81Å; F846-I857 HydrophobicContact CZ-CD1 4.13Å
847	Y	91.8	Very high	89.4	Confident	25 Å²	25	46 Å²	46	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	136.6	163.8	178.7	-97.4	0	0	0	108.1	R806 D849 Q852 H853 Y854	R806-Y847 VanDerWaalsContact CG-O 3.24Å; R806-Y847 WeakPolarHBondContact CG-O 3.49Å; R806-Y847 PolarHBondContact NE-O 3.21Å; R806-Y847 PolarHBondContact NH2-O 3.23Å; R806-Y847 PolarHBondContact O-N 2.83Å; Y847-D849 WeakPolarHBondContact CD1-OD1 3.37Å; Y847-D849 WeakPolarHBondContact CE1-OD1 3.46Å; Y847-Q852 VanDerWaalsContact OH-CD 3.26Å; Y847-Q852 PolarHBondContact OH-NE2 3.43Å; Y847-Q852 PolarHBondContact OH-OE1 3.43Å; Y847-H853 WeakPolarHBondContact CD2-O 3.43Å; Y847-Y854 AromaticContact CD2-CD1 3.93Å; Y847-Y854 HydrophobicContact CD2-CD1 3.93Å; Y847-Y854 AromaticContact CD2-CD2 3.66Å; Y847-Y854 HydrophobicContact CD2-CD2 3.66Å; Y847-Y854 AromaticContact CD2-CE1 3.73Å; Y847-Y854 HydrophobicContact CD2-CE1 3.73Å; Y847-Y854 AromaticContact CD2-CE2 3.4Å; Y847-Y854 HydrophobicContact CD2-CE2 3.4Å; Y847-Y854 AromaticContact CD2-CG 3.92Å; Y847-Y854 HydrophobicContact CD2-CG 3.92Å; Y847-Y854 AromaticContact CD2-CZ 3.46Å; Y847-Y854 VanDerWaalsContact CD2-CZ 3.46Å; Y847-Y854 HydrophobicContact CE2-CD2 4.15Å; Y847-Y854 AromaticContact CE2-CE2 3.74Å; Y847-Y854 HydrophobicContact CE2-CE2 3.74Å; Y847-Y854 HydrophobicContact CG-CD1 4.42Å; Y847-Y854 HydrophobicContact CG-CE1 4.16Å
848	D	86.2	Confident	89.7	Confident	16 Å²	16	45.4 Å²	45.4	9%	0.086	22%	0.22	C	C	.	.			trans	-101.6	123.5	167.8	-175.8	37.3	0	0	0	112.5	R806 F846 W850 T851 Q852 H853	R806-D848 IonicContact CZ-OD1 3.53Å; R806-D848 IonicContact NH2-OD1 2.73Å; R806-D848 PolarHBondContact NH2-OD1 3.3Å; F846-D848 HydrophobicContact CD2-CB 4.44Å; F846-D848 HydrophobicContact CE2-CB 4.2Å; D848-W850 VanDerWaalsContact C-N 3.29Å; D848-W850 PolarHBondContact O-N 2.96Å; D848-W850 PolarHBondContact OD1-N 2.91Å; D848-W850 WeakPolarHBondContact OD2-CB 3.44Å; D848-W850 PolarHBondContact OD2-N 2.84Å; D848-T851 WeakPolarHBondContact OD2-CG2 3.43Å; D848-T851 PolarHBondContact OD2-N 3.35Å; D848-T851 PolarHBondContact OD2-OG1 2.83Å; D848-Q852 WeakPolarHBondContact O-CA 3.46Å; D848-Q852 PolarHBondContact O-N 3.34Å; D848-H853 PolarHBondContact N-O 3.01Å
849	D	81.1	Confident	89.8	Confident	75 Å²	75	50.2 Å²	50.2	40%	0.401	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-21.3	177.9	-60.7	-27.1	0	0	0	111.6	R787 R806 Y847 Q852	R787-D849 IonicContact NH2-OD1 2.65Å; R806-D849 IonicContact CZ-OD2 3.33Å; R806-D849 IonicContact NE-OD2 3.73Å; R806-D849 IonicContact NH1-OD1 3.82Å; R806-D849 IonicContact NH1-OD2 3.22Å; R806-D849 PolarHBondContact NH1-OD2 2.9Å; Y847-D849 WeakPolarHBondContact CD1-OD1 3.37Å; Y847-D849 WeakPolarHBondContact CE1-OD1 3.46Å; D849-Q852 PolarHBondContact O-NE2 3.16Å
850	W	75	Confident	89.7	Confident	227 Å²	227	49.5 Å²	49.5	86%	0.86	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-50.2	177	-63.7	-67.6	0	0	0	112.8	D848 Q852	D848-W850 VanDerWaalsContact C-N 3.29Å; D848-W850 PolarHBondContact O-N 2.96Å; D848-W850 PolarHBondContact OD1-N 2.91Å; D848-W850 WeakPolarHBondContact OD2-CB 3.44Å; D848-W850 PolarHBondContact OD2-N 2.84Å; W850-Q852 VanDerWaalsContact C-N 3.33Å
851	T	82.5	Confident	89.3	Confident	67 Å²	67	51.4 Å²	51.4	41%	0.411	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-18	175.8	67.8	0	0	0	0	113	D848 H853 E855	D848-T851 WeakPolarHBondContact OD2-CG2 3.43Å; D848-T851 PolarHBondContact OD2-N 3.35Å; D848-T851 PolarHBondContact OD2-OG1 2.83Å; T851-H853 PolarHBondContact O-CE1 3.47Å; T851-H853 PolarHBondContact O-N 3.47Å; T851-H853 PolarHBondContact O-ND1 3.34Å; T851-H853 PolarHBondContact OG1-N 2.76Å; T851-E855 PolarHBondContact OG1-OE1 3.12Å
852	Q	85.3	Confident	88.9	Confident	123 Å²	123	50.8 Å²	50.8	58%	0.575	23%	0.229	S	C	*	.			trans	63.1	17.1	-171.7	-62.2	-77.9	-60.6	0	0	114.3	Y847 D848 D849 W850	Y847-Q852 VanDerWaalsContact OH-CD 3.26Å; Y847-Q852 PolarHBondContact OH-NE2 3.43Å; Y847-Q852 PolarHBondContact OH-OE1 3.43Å; D848-Q852 WeakPolarHBondContact O-CA 3.46Å; D848-Q852 PolarHBondContact O-N 3.34Å; D849-Q852 PolarHBondContact O-NE2 3.16Å; W850-Q852 VanDerWaalsContact C-N 3.33Å
853	H	87.6	Confident	88.7	Confident	67 Å²	67	50.9 Å²	50.9	31%	0.31	23%	0.23	S	C	.	.			trans	-104.5	160.6	179.9	-70.7	75.8	0	0	0	112.2	Y847 D848 T851 I983	Y847-H853 WeakPolarHBondContact CD2-O 3.43Å; D848-H853 PolarHBondContact N-O 3.01Å; T851-H853 PolarHBondContact O-CE1 3.47Å; T851-H853 PolarHBondContact O-N 3.47Å; T851-H853 PolarHBondContact O-ND1 3.34Å; T851-H853 PolarHBondContact OG1-N 2.76Å; H853-I983 HydrophobicContact CB-CG2 4.26Å
854	Y	93.7	Very high	88.5	Confident	20 Å²	20	50.9 Å²	50.9	8%	0.078	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	135.2	163.5	-69.6	-96.6	0	0	0	108.3	R787 A788 M803 I845 F846 Y847 I983 L984 F999 L1001	R787-Y854 WeakPolarHBondContact CB-OH 3.41Å; A788-Y854 HydrophobicContact CB-CE1 4.27Å; M803-Y854 HydrophobicContact CE-CD1 4.2Å; M803-Y854 HydrophobicContact CE-CE1 4.06Å; M803-Y854 HydrophobicContact SD-CD1 4.13Å; M803-Y854 HydrophobicContact SD-CE1 3.91Å; I845-Y854 HydrophobicContact CG2-CD1 4.4Å; F846-Y854 CarbonylContact O-C 3.56Å; F846-Y854 WeakPolarHBondContact O-CA 3.48Å; Y847-Y854 AromaticContact CD2-CD1 3.93Å; Y847-Y854 HydrophobicContact CD2-CD1 3.93Å; Y847-Y854 AromaticContact CD2-CD2 3.66Å; Y847-Y854 HydrophobicContact CD2-CD2 3.66Å; Y847-Y854 AromaticContact CD2-CE1 3.73Å; Y847-Y854 HydrophobicContact CD2-CE1 3.73Å; Y847-Y854 AromaticContact CD2-CE2 3.4Å; Y847-Y854 HydrophobicContact CD2-CE2 3.4Å; Y847-Y854 AromaticContact CD2-CG 3.92Å; Y847-Y854 HydrophobicContact CD2-CG 3.92Å; Y847-Y854 AromaticContact CD2-CZ 3.46Å; Y847-Y854 VanDerWaalsContact CD2-CZ 3.46Å; Y847-Y854 HydrophobicContact CE2-CD2 4.15Å; Y847-Y854 AromaticContact CE2-CE2 3.74Å; Y847-Y854 HydrophobicContact CE2-CE2 3.74Å; Y847-Y854 HydrophobicContact CG-CD1 4.42Å; Y847-Y854 HydrophobicContact CG-CE1 4.16Å; Y854-I983 CarbonylContact O-C 3.53Å; Y854-I983 WeakPolarHBondContact O-CA 3.5Å; Y854-L984 PolarHBondContact O-N 3.36Å; Y854-F999 HydrophobicContact CD1-CE1 4.5Å; Y854-F999 HydrophobicContact CD1-CE2 4.37Å; Y854-F999 AromaticContact CD1-CZ 3.61Å; Y854-F999 HydrophobicContact CD1-CZ 3.61Å; Y854-F999 HydrophobicContact CD2-CE1 4.17Å; Y854-F999 HydrophobicContact CD2-CZ 4.01Å; Y854-F999 HydrophobicContact CE1-CZ 4.01Å; Y854-F999 HydrophobicContact CE2-CZ 4.41Å; Y854-F999 HydrophobicContact CG-CE1 4.05Å; Y854-F999 AromaticContact CG-CZ 3.59Å; Y854-F999 HydrophobicContact CG-CZ 3.59Å; Y854-L1001 HydrophobicContact CD2-CD2 3.64Å; Y854-L1001 HydrophobicContact CE2-CD2 3.2Å
855	E	93.3	Very high	88.3	Confident	30 Å²	30	51.1 Å²	51.1	14%	0.14	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	134.1	-175.3	-73.9	176.7	-136.5	0	0	109	I845 F846 T851 P981 A982 I983	I845-E855 CarbonylContact C-O 3.52Å; I845-E855 WeakPolarHBondContact CA-O 3.19Å; F846-E855 HydrophobicContact CD1-CB 4.02Å; F846-E855 WeakPolarHBondContact CD1-O 3.38Å; F846-E855 HydrophobicContact CD2-CB 4.4Å; F846-E855 HydrophobicContact CE1-CB 3.39Å; F846-E855 HydrophobicContact CE2-CB 3.85Å; F846-E855 HydrophobicContact CE2-CG 4.46Å; F846-E855 HydrophobicContact CG-CB 4.49Å; F846-E855 HydrophobicContact CZ-CB 3.32Å; F846-E855 HydrophobicContact CZ-CG 4.13Å; F846-E855 VanDerWaalsContact CZ-OE2 3.24Å; F846-E855 WeakPolarHBondContact CZ-OE2 3.44Å; F846-E855 PolarHBondContact N-O 3.22Å; F846-E855 PolarHBondContact O-N 2.83Å; T851-E855 PolarHBondContact OG1-OE1 3.12Å; E855-P981 HydrophobicContact CB-CB 4.27Å; E855-A982 CarbonylContact C-O 3.59Å; E855-A982 WeakPolarHBondContact CA-O 3.5Å; E855-I983 HydrophobicContact CG-CG1 4.41Å
856	L	94.5	Very high	88.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.1	176.6	179.8	157.3	0	0	0	108.7	A843 T844 I845 T864 V866 P981 A982 L984 I990 F992	A843-L856 HydrophobicContact CB-CD1 4.47Å; A843-L856 HydrophobicContact CB-CD2 4.04Å; A843-L856 HydrophobicContact CB-CG 4.18Å; T844-L856 WeakPolarHBondContact O-CA 3.5Å; I845-L856 HydrophobicContact CD1-CD1 4.37Å; I845-L856 HydrophobicContact CG1-CB 4.21Å; I845-L856 HydrophobicContact CG1-CD1 3.94Å; I845-L856 HydrophobicContact CG1-CG 4.16Å; L856-T864 HydrophobicContact CD1-CG2 4.16Å; L856-T864 HydrophobicContact CD2-CG2 3.83Å; L856-V866 HydrophobicContact CD1-CG2 4.2Å; L856-V866 HydrophobicContact CD2-CG2 4.45Å; L856-P981 CarbonylContact O-C 3.59Å; L856-P981 WeakPolarHBondContact O-CA 3.46Å; L856-A982 HydrophobicContact CB-CB 4.27Å; L856-A982 PolarHBondContact N-O 3.39Å; L856-A982 PolarHBondContact O-N 3.39Å; L856-L984 HydrophobicContact CB-CD1 4.1Å; L856-L984 HydrophobicContact CB-CD2 4.27Å; L856-L984 HydrophobicContact CB-CG 4.14Å; L856-L984 HydrophobicContact CD1-CD1 4.43Å; L856-L984 HydrophobicContact CD1-CD2 4.46Å; L856-I990 HydrophobicContact CD1-CD1 4.21Å; L856-I990 HydrophobicContact CD1-CG2 3.73Å; L856-F992 HydrophobicContact CD1-CE1 4.12Å; L856-F992 HydrophobicContact CD1-CZ 4.02Å
857	I	92.2	Very high	88	Confident	55 Å²	55	53.1 Å²	53.1	28%	0.282	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.6	169.7	-68.1	159.4	0	0	0	108.6	A843 T844 F846 Y859 P981	A843-I857 CarbonylContact C-O 3.17Å; A843-I857 VanDerWaalsContact CA-O 3.24Å; A843-I857 WeakPolarHBondContact CA-O 3.29Å; A843-I857 WeakPolarHBondContact CB-O 3.46Å; T844-I857 PolarHBondContact N-O 3.4Å; T844-I857 PolarHBondContact O-N 2.8Å; F846-I857 HydrophobicContact CD1-CD1 4.13Å; F846-I857 HydrophobicContact CE1-CD1 3.41Å; F846-I857 VanDerWaalsContact CE1-CD1 3.41Å; F846-I857 HydrophobicContact CE1-CG1 3.81Å; F846-I857 HydrophobicContact CZ-CD1 4.13Å; I857-Y859 HydrophobicContact CB-CE2 3.81Å; I857-Y859 HydrophobicContact CG2-CD2 4.02Å; I857-Y859 HydrophobicContact CG2-CE1 4.21Å; I857-Y859 HydrophobicContact CG2-CE2 3.44Å; I857-Y859 VanDerWaalsContact CG2-CE2 3.44Å; I857-Y859 WeakPolarHBondContact O-CD2 3.37Å; I857-P981 HydrophobicContact CG1-CB 4.14Å
858	N	91.4	Very high	87.6	Confident	10 Å²	10	55 Å²	55	5%	0.053	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	133	169.3	177.6	73.4	0	0	0	110.3	S860 G863 T864 N873	N858-S860 PolarHBondContact ND2-N 2.82Å; N858-S860 PolarHBondContact ND2-O 3.33Å; N858-S860 WeakPolarHBondContact OD1-CB 3.33Å; N858-S860 PolarHBondContact OD1-N 2.82Å; N858-G863 WeakPolarHBondContact OD1-CA 3.23Å; N858-T864 PolarHBondContact OD1-N 2.82Å; N858-T864 VanDerWaalsContact OD1-N 3.16Å; N858-T864 PolarHBondContact OD1-OG1 3.03Å; N858-N873 PolarHBondContact ND2-OD1 3.43Å; N858-N873 PolarHBondContact O-OD1 3.25Å
859	Y	90.4	Very high	87.6	Confident	115 Å²	115	57.8 Å²	57.8	45%	0.451	29%	0.286	S	S	.	.			trans	-118	-3.5	170	-67.8	-87.4	0	0	0	112.1	H841 H842 I857	H841-Y859 AromaticContact CD2-CD2 3.95Å; H841-Y859 AromaticContact CD2-CG 3.82Å; H841-Y859 AromaticContact NE2-CD2 3.73Å; H842-Y859 CarbonylContact O-C 3.52Å; H842-Y859 PolarHBondContact O-N 3.49Å; I857-Y859 HydrophobicContact CB-CE2 3.81Å; I857-Y859 HydrophobicContact CG2-CD2 4.02Å; I857-Y859 HydrophobicContact CG2-CE1 4.21Å; I857-Y859 HydrophobicContact CG2-CE2 3.44Å; I857-Y859 VanDerWaalsContact CG2-CE2 3.44Å; I857-Y859 WeakPolarHBondContact O-CD2 3.37Å
860	S	86.9	Confident	87.8	Confident	1 Å²	1	55 Å²	55	1%	0.007	27%	0.27	C	S	.	.			trans	-82	134	-177.7	-175.6	0	0	0	0	112.2	H842 N858 Y862 G863	H842-S860 WeakPolarHBondContact CD2-CB 3.36Å; H842-S860 PolarHBondContact CE1-OG 2.92Å; H842-S860 WeakPolarHBondContact NE2-CB 3.19Å; H842-S860 PolarHBondContact NE2-OG 2.8Å; H842-S860 PolarHBondContact O-N 2.97Å; N858-S860 PolarHBondContact ND2-N 2.82Å; N858-S860 PolarHBondContact ND2-O 3.33Å; N858-S860 WeakPolarHBondContact OD1-CB 3.33Å; N858-S860 PolarHBondContact OD1-N 2.82Å; S860-Y862 PolarHBondContact O-N 3.1Å; S860-Y862 WeakPolarHBondContact OG-CB 3.43Å; S860-Y862 WeakPolarHBondContact OG-CD2 3.4Å; S860-Y862 PolarHBondContact OG-N 2.94Å; S860-Y862 VanDerWaalsContact OG-N 3.14Å; S860-G863 PolarHBondContact O-N 3.36Å
861	E	80.5	Confident	88.4	Confident	123 Å²	123	45.7 Å²	45.7	58%	0.575	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.1	167.3	61.9	-175.9	-151.8	0	0	113.3	I875	E861-I875 HydrophobicContact CB-CD1 4.05Å
862	Y	84.3	Confident	88.4	Confident	59 Å²	59	42.7 Å²	42.7	23%	0.231	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-11.5	176.9	-46	-57	0	0	0	113.6	F837 S860	F837-Y862 HydrophobicContact CB-CD1 4.47Å; F837-Y862 HydrophobicContact CB-CD2 4.48Å; F837-Y862 HydrophobicContact CB-CG 4.12Å; F837-Y862 AromaticContact CD1-CD1 3.86Å; F837-Y862 HydrophobicContact CD1-CD1 3.86Å; F837-Y862 HydrophobicContact CD1-CE1 4.45Å; F837-Y862 HydrophobicContact CD1-CG 4.32Å; F837-Y862 WeakPolarHBondContact O-CD2 3.47Å; S860-Y862 PolarHBondContact O-N 3.1Å; S860-Y862 WeakPolarHBondContact OG-CB 3.43Å; S860-Y862 WeakPolarHBondContact OG-CD2 3.4Å; S860-Y862 PolarHBondContact OG-N 2.94Å; S860-Y862 VanDerWaalsContact OG-N 3.14Å
863	G	86.9	Confident	87.7	Confident	2 Å²	2	39.5 Å²	39.5	2%	0.021	21%	0.205	C	C	.	.			trans	74.9	161.6	-173.1	0	0	0	0	0	114.5	H842 N858 S860 Y871	H842-G863 PolarHBondContact NE2-O 3.02Å; H842-G863 VanDerWaalsContact NE2-O 3.12Å; N858-G863 WeakPolarHBondContact OD1-CA 3.23Å; S860-G863 PolarHBondContact O-N 3.36Å; G863-Y871 CarbonylContact C-O 3.56Å; G863-Y871 VanDerWaalsContact CA-O 3.23Å; G863-Y871 WeakPolarHBondContact CA-O 3.49Å
864	T	91.3	Very high	86.5	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	140.6	172.6	-60.5	0	0	0	0	108.5	H842 L856 N858 V866 Y871 I990 F992	H842-T864 PolarHBondContact CD2-OG1 3.21Å; L856-T864 HydrophobicContact CD1-CG2 4.16Å; L856-T864 HydrophobicContact CD2-CG2 3.83Å; N858-T864 PolarHBondContact OD1-N 2.82Å; N858-T864 VanDerWaalsContact OD1-N 3.16Å; N858-T864 PolarHBondContact OD1-OG1 3.03Å; T864-V866 HydrophobicContact CG2-CG2 4.19Å; T864-Y871 PolarHBondContact N-O 3.29Å; T864-Y871 PolarHBondContact O-N 2.94Å; T864-I990 HydrophobicContact CG2-CG2 4.07Å; T864-F992 HydrophobicContact CG2-CD1 3.62Å; T864-F992 HydrophobicContact CG2-CE1 3.42Å; T864-F992 VanDerWaalsContact CG2-CE1 3.42Å; T864-F992 HydrophobicContact CG2-CZ 4.39Å
865	C	90.6	Very high	84.7	Confident	12 Å²	12	45.2 Å²	45.2	8%	0.081	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	134.7	170.5	171.9	0	0	0	0	110.4	G868 I869 L947 I990 Q991	C865-G868 VanDerWaalsContact SG-C 3.58Å; C865-G868 VanDerWaalsContact SG-CA 3.55Å; C865-I869 CarbonylContact C-O 3.59Å; C865-I869 VanDerWaalsContact CA-O 3.31Å; C865-I869 WeakPolarHBondContact CA-O 3.39Å; C865-L947 HydrophobicContact CB-CD1 3.86Å; C865-L947 HydrophobicContact CB-CD2 4.4Å; C865-I990 CarbonylContact O-C 3.53Å; C865-I990 WeakPolarHBondContact O-CA 3.36Å; C865-Q991 HydrophobicContact CB-CB 4.11Å; C865-Q991 PolarHBondContact N-O 3.12Å; C865-Q991 PolarHBondContact O-N 3.37Å
866	V	91.6	Very high	82.5	Confident	3 Å²	3	52 Å²	52	2%	0.018	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	122.1	175.5	179.9	0	0	0	0	108.2	L856 T864 G868 I869 Y871 A982 L984 V989 I990	L856-V866 HydrophobicContact CD1-CG2 4.2Å; L856-V866 HydrophobicContact CD2-CG2 4.45Å; T864-V866 HydrophobicContact CG2-CG2 4.19Å; V866-G868 PolarHBondContact O-N 3.3Å; V866-G868 VanDerWaalsContact O-N 3.12Å; V866-I869 PolarHBondContact N-O 3.31Å; V866-I869 WeakPolarHBondContact O-CB 3.27Å; V866-I869 PolarHBondContact O-N 3.24Å; V866-Y871 HydrophobicContact CB-CD2 4.15Å; V866-Y871 HydrophobicContact CB-CE2 3.89Å; V866-Y871 HydrophobicContact CG2-CD2 4.2Å; V866-Y871 HydrophobicContact CG2-CE2 4.36Å; V866-A982 HydrophobicContact CB-CB 4.2Å; V866-A982 HydrophobicContact CG1-CB 4.44Å; V866-A982 HydrophobicContact CG2-CB 3.85Å; V866-L984 HydrophobicContact CG1-CD2 3.61Å; V866-L984 HydrophobicContact CG2-CD2 4.24Å; V866-V989 CarbonylContact C-O 3.59Å; V866-V989 WeakPolarHBondContact CA-O 3.36Å; V866-I990 HydrophobicContact CG2-CG2 4.32Å
867	D	90.9	Very high	80.1	Confident	85 Å²	85	60.9 Å²	60.9	46%	0.455	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	34.2	180	-62.6	-39.2	0	0	0	113.5	I869 S988 V989	D867-I869 VanDerWaalsContact C-N 3.32Å; D867-S988 VanDerWaalsContact OD1-CA 3.24Å; D867-S988 WeakPolarHBondContact OD1-CA 3.07Å; D867-S988 VanDerWaalsContact OD2-CB 3.26Å; D867-S988 WeakPolarHBondContact OD2-CB 3.14Å; D867-S988 PolarHBondContact OD2-OG 3.18Å; D867-V989 PolarHBondContact N-O 3.37Å; D867-V989 PolarHBondContact OD1-N 2.85Å
868	G	84.3	Confident	77.2	Confident	65 Å²	65	67.3 Å²	67.3	67%	0.67	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	-10.3	-177.4	0	0	0	0	0	115.1	C865 V866	C865-G868 VanDerWaalsContact SG-C 3.58Å; C865-G868 VanDerWaalsContact SG-CA 3.55Å; V866-G868 PolarHBondContact O-N 3.3Å; V866-G868 VanDerWaalsContact O-N 3.12Å
869	I	84.9	Confident	74.5	Confident	75 Å²	75	74.4 Å²	74.4	39%	0.385	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.8	179.8	-57.4	173.6	0	0	0	109.9	C865 V866 D867 Y871 W978	C865-I869 CarbonylContact C-O 3.59Å; C865-I869 VanDerWaalsContact CA-O 3.31Å; C865-I869 WeakPolarHBondContact CA-O 3.39Å; V866-I869 PolarHBondContact N-O 3.31Å; V866-I869 WeakPolarHBondContact O-CB 3.27Å; V866-I869 PolarHBondContact O-N 3.24Å; D867-I869 VanDerWaalsContact C-N 3.32Å; I869-Y871 HydrophobicContact CB-CE2 3.82Å; I869-Y871 HydrophobicContact CG2-CD2 4.27Å; I869-Y871 HydrophobicContact CG2-CE2 3.62Å; I869-Y871 WeakPolarHBondContact O-CD2 3.37Å; I869-W978 HydrophobicContact CG2-CG 4.46Å
870	I	86.2	Confident	71.6	Confident	15 Å²	15	75.9 Å²	75.9	8%	0.077	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	129.7	178.7	-60.2	163.7	0	0	0	109.4	L947 L974 G977 W978	I870-L947 HydrophobicContact CB-CB 4.45Å; I870-L947 HydrophobicContact CD1-CB 3.78Å; I870-L947 HydrophobicContact CD1-CD2 4.25Å; I870-L947 HydrophobicContact CG1-CB 3.88Å; I870-L947 HydrophobicContact CG1-CD1 4.25Å; I870-L947 HydrophobicContact CG1-CD2 4.08Å; I870-L947 HydrophobicContact CG1-CG 4.28Å; I870-L947 HydrophobicContact CG2-CB 3.71Å; I870-L947 HydrophobicContact CG2-CD1 4.13Å; I870-L974 HydrophobicContact CD1-CD2 4.16Å; I870-G977 CarbonylContact O-C 3.56Å; I870-G977 VanDerWaalsContact O-CA 3.27Å; I870-G977 WeakPolarHBondContact O-CA 3.29Å; I870-W978 PolarHBondContact O-N 3.32Å
871	Y	87.3	Confident	68.9	Low	32 Å²	32	85.5 Å²	85.5	13%	0.125	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.3	171.9	-66.8	-94	0	0	0	108.7	G863 T864 V866 I869 W978 G980 A982	G863-Y871 CarbonylContact C-O 3.56Å; G863-Y871 VanDerWaalsContact CA-O 3.23Å; G863-Y871 WeakPolarHBondContact CA-O 3.49Å; T864-Y871 PolarHBondContact N-O 3.29Å; T864-Y871 PolarHBondContact O-N 2.94Å; V866-Y871 HydrophobicContact CB-CD2 4.15Å; V866-Y871 HydrophobicContact CB-CE2 3.89Å; V866-Y871 HydrophobicContact CG2-CD2 4.2Å; V866-Y871 HydrophobicContact CG2-CE2 4.36Å; I869-Y871 HydrophobicContact CB-CE2 3.82Å; I869-Y871 HydrophobicContact CG2-CD2 4.27Å; I869-Y871 HydrophobicContact CG2-CE2 3.62Å; I869-Y871 WeakPolarHBondContact O-CD2 3.37Å; Y871-W978 WeakPolarHBondContact CA-O 3.27Å; Y871-W978 HydrophobicContact CD1-CB 3.79Å; Y871-W978 HydrophobicContact CE1-CB 3.88Å; Y871-W978 HydrophobicContact CE1-CG 4.5Å; Y871-G980 WeakPolarHBondContact CD1-O 3.31Å; Y871-A982 HydrophobicContact CD1-CB 3.78Å; Y871-A982 HydrophobicContact CD2-CB 3.73Å; Y871-A982 HydrophobicContact CE1-CB 3.53Å; Y871-A982 HydrophobicContact CE2-CB 3.5Å; Y871-A982 VanDerWaalsContact CE2-CB 3.5Å; Y871-A982 HydrophobicContact CG-CB 3.86Å
872	G	82	Confident	66.7	Low	4 Å²	4	86.1 Å²	86.1	4%	0.041	43%	0.429	C	S	.	.			trans	-142.7	165.3	-171.8	0	0	0	0	0	111	W978 E979	G872-W978 PolarHBondContact N-O 2.69Å; G872-W978 VanDerWaalsContact N-O 3.07Å; G872-E979 WeakPolarHBondContact O-CA 3.26Å
873	N	71.9	Confident	64.4	Low	57 Å²	57	87.1 Å²	87.1	31%	0.305	44%	0.443	S	S	.	.			trans	-90.7	132.9	175.4	-59.8	5.6	0	0	0	108	N858 I875	N858-N873 PolarHBondContact ND2-OD1 3.43Å; N858-N873 PolarHBondContact O-OD1 3.25Å; N873-I875 HydrophobicContact CB-CG1 4.11Å; N873-I875 PolarHBondContact O-N 2.73Å
874	D	62	Low	62.2	Low	97 Å²	97	96.2 Å²	96.2	52%	0.519	49%	0.485	S	S	.	.			trans	-73.5	76.7	170.1	-91.4	-7.5	0	0	0	109.3	E876 E979	D874-E876 PolarHBondContact O-N 2.96Å; D874-E979 HydrophobicContact CB-CG 4.19Å
875	I	55.2	Low	60.2	Low	110 Å²	110	98.3 Å²	98.3	56%	0.564	50%	0.499	S	S	*	.			trans	-72.2	78.5	167.4	-50.9	175.5	0	0	0	106.6	E861 N873 K877	E861-I875 HydrophobicContact CB-CD1 4.05Å; N873-I875 HydrophobicContact CB-CG1 4.11Å; N873-I875 PolarHBondContact O-N 2.73Å; I875-K877 PolarHBondContact O-N 2.77Å
876	E	48.4	Very low	59	Low	172 Å²	172	101.2 Å²	101.2	80%	0.804	52%	0.52	S	S	*	.			trans	-46.9	114	156.5	-82.3	-161.7	157.6	0	0	106.4	D874 K878	D874-E876 PolarHBondContact O-N 2.96Å; E876-K878 PolarHBondContact O-N 2.75Å
877	K	42.8	Very low	58	Low	187 Å²	187	105.8 Å²	105.8	81%	0.813	54%	0.544	S	S	*	.			trans	-64.9	86.9	169.7	-73.6	176.9	-177.4	167.2	0	106.4	I875 L879	I875-K877 PolarHBondContact O-N 2.77Å; K877-L879 VanDerWaalsContact C-N 3.29Å; K877-L879 PolarHBondContact O-N 2.69Å
878	K	32	Very low	57.2	Low	189 Å²	189	107.3 Å²	107.3	82%	0.822	55%	0.552	S	S	*	*			trans	-51.8	101.3	169.8	-178.5	173.8	-173	168.4	0	105.9	E876 I880	E876-K878 PolarHBondContact O-N 2.75Å; K878-I880 VanDerWaalsContact C-N 3.33Å; K878-I880 PolarHBondContact O-N 2.92Å
879	L	33.8	Very low	56.6	Low	160 Å²	160	106.9 Å²	106.9	84%	0.838	54%	0.536	S	S	*	.			trans	-60.1	102.2	-172.4	-72.3	172.1	0	0	0	106.5	K877 Y881	K877-L879 VanDerWaalsContact C-N 3.29Å; K877-L879 PolarHBondContact O-N 2.69Å; L879-Y881 PolarHBondContact O-N 2.82Å
880	I	30.3	Very low	55.9	Low	146 Å²	146	107.5 Å²	107.5	75%	0.749	54%	0.537	S	S	*	.			trans	-59.2	112.6	165.5	-61.9	175.5	0	0	0	103.1	K878 I882	K878-I880 VanDerWaalsContact C-N 3.33Å; K878-I880 PolarHBondContact O-N 2.92Å; I880-I882 HydrophobicContact CG2-CG1 4.2Å; I880-I882 PolarHBondContact O-N 2.78Å
881	Y	30.3	Very low	55.1	Low	202 Å²	202	113.6 Å²	113.6	79%	0.792	56%	0.559	S	S	*	*			trans	-63.5	91	173.8	178.1	-97.1	0	0	0	107.5	L879 P883	L879-Y881 PolarHBondContact O-N 2.82Å; Y881-P883 HydrophobicContact CE1-CB 3.87Å; Y881-P883 VanDerWaalsContact O-CD 3.29Å; Y881-P883 WeakPolarHBondContact O-CD 3.24Å
882	I	34.3	Very low	54.5	Low	136 Å²	136	115.5 Å²	115.5	70%	0.697	57%	0.574	S	S	*	*			trans	-82.2	107.2	166.5	-60.9	170.4	0	0	0	103.4	I880 E884	I880-I882 HydrophobicContact CG2-CG1 4.2Å; I880-I882 PolarHBondContact O-N 2.78Å; I882-E884 PolarHBondContact O-N 3.07Å
883	P	35.9	Very low	54	Low	80 Å²	80	120.6 Å²	120.6	52%	0.519	59%	0.592	S	S	.	*			trans	-57.1	132.7	176.5	23.9	-32.9	0	0	0	108.4	Y881 S885	Y881-P883 HydrophobicContact CE1-CB 3.87Å; Y881-P883 VanDerWaalsContact O-CD 3.29Å; Y881-P883 WeakPolarHBondContact O-CD 3.24Å; P883-S885 PolarHBondContact O-N 3.45Å
884	E	40.8	Very low	53.9	Low	193 Å²	193	121.7 Å²	121.7	90%	0.902	60%	0.598	S	S	*	*			trans	-51.5	112.6	179.7	-72	-171	138.1	0	0	109.3	I882 S886	I882-E884 PolarHBondContact O-N 3.07Å; E884-S886 PolarHBondContact O-N 3.04Å; E884-S886 VanDerWaalsContact O-N 3.1Å
885	S	47.9	Very low	54.3	Low	44 Å²	44	122.8 Å²	122.8	31%	0.308	60%	0.603	S	S	.	*			trans	-67.9	117.9	-177.1	60.7	0	0	0	0	108.1	P883 R893	P883-S885 PolarHBondContact O-N 3.45Å; S885-R893 PolarHBondContact OG-NH1 3.03Å; S885-R893 PolarHBondContact OG-NH2 2.82Å
886	S	66.7	Low	55	Low	74 Å²	74	123.4 Å²	123.4	52%	0.517	61%	0.607	S	S	.	*			trans	-43.2	150.8	-175.2	68.5	0	0	0	0	113.4	E884 L888 V889 Q890	E884-S886 PolarHBondContact O-N 3.04Å; E884-S886 VanDerWaalsContact O-N 3.1Å; S886-L888 CarbonylContact O-C 3.57Å; S886-L888 PolarHBondContact O-N 3.06Å; S886-V889 WeakPolarHBondContact O-CA 3.32Å; S886-V889 WeakPolarHBondContact O-CB 3.49Å; S886-V889 PolarHBondContact O-N 3.22Å; S886-Q890 PolarHBondContact O-N 3.14Å
887	D	69.3	Low	55.9	Low	99 Å²	99	123.5 Å²	123.5	53%	0.529	60%	0.604	S	S	.	*	H	α-helix	trans	-49.1	-30.1	-176.3	-179.7	52.4	0	0	0	114.4	Q890 R891	D887-Q890 PolarHBondContact O-N 3.12Å; D887-R891 PolarHBondContact O-N 2.87Å; D887-R891 IonicContact OD1-NE 3.95Å; D887-R891 IonicContact OD2-CZ 2.67Å; D887-R891 IonicContact OD2-NE 2.99Å; D887-R891 PolarHBondContact OD2-NE 2.84Å; D887-R891 IonicContact OD2-NH2 3.88Å; D887-R891 PolarHBondContact OD2-NH2 3.49Å
888	L	73.9	Confident	57.1	Low	117 Å²	117	119.8 Å²	119.8	61%	0.613	60%	0.598	S	S	*	*	H	α-helix	trans	-57.8	-47.2	170.6	-169.1	86	0	0	0	112.8	S886 Q890 R891 V892	S886-L888 CarbonylContact O-C 3.57Å; S886-L888 PolarHBondContact O-N 3.06Å; L888-Q890 VanDerWaalsContact C-N 3.33Å; L888-R891 PolarHBondContact O-N 2.93Å; L888-V892 WeakPolarHBondContact O-CG2 3.26Å; L888-V892 PolarHBondContact O-N 3.39Å
889	V	71.9	Confident	57.8	Low	56 Å²	56	113.6 Å²	113.6	34%	0.339	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-37.2	-179.2	-175	0	0	0	0	110.4	S886 V892 R893	S886-V889 WeakPolarHBondContact O-CA 3.32Å; S886-V889 WeakPolarHBondContact O-CB 3.49Å; S886-V889 PolarHBondContact O-N 3.22Å; V889-V892 PolarHBondContact O-N 3.46Å; V889-R893 WeakPolarHBondContact O-CG 3.48Å; V889-R893 PolarHBondContact O-N 3.47Å
890	Q	70.4	Confident	58.6	Low	88 Å²	88	111.6 Å²	111.6	41%	0.411	58%	0.578	S	S	.	*	H	α-helix	trans	-68	-42.7	176	-161.4	69.2	-16.7	0	0	111.5	S886 D887 L888 V892 R893 N894	S886-Q890 PolarHBondContact O-N 3.14Å; D887-Q890 PolarHBondContact O-N 3.12Å; L888-Q890 VanDerWaalsContact C-N 3.33Å; Q890-V892 PolarHBondContact O-N 3.2Å; Q890-R893 PolarHBondContact O-N 2.84Å; Q890-N894 WeakPolarHBondContact O-CB 3.43Å; Q890-N894 VanDerWaalsContact O-CG 3.25Å; Q890-N894 PolarHBondContact O-N 2.8Å
891	R	70.8	Confident	59	Low	142 Å²	142	114.8 Å²	114.8	54%	0.536	59%	0.586	S	S	.	*	H	α-helix	trans	-60	-41.9	171.2	-81.5	-172.7	-91.8	158.3	-9.2	112.8	D887 L888 N894 L895	D887-R891 PolarHBondContact O-N 2.87Å; D887-R891 IonicContact OD1-NE 3.95Å; D887-R891 IonicContact OD2-CZ 2.67Å; D887-R891 IonicContact OD2-NE 2.99Å; D887-R891 PolarHBondContact OD2-NE 2.84Å; D887-R891 IonicContact OD2-NH2 3.88Å; D887-R891 PolarHBondContact OD2-NH2 3.49Å; L888-R891 PolarHBondContact O-N 2.93Å; R891-N894 PolarHBondContact O-N 2.86Å; R891-L895 PolarHBondContact O-N 2.86Å
892	V	73.5	Confident	59.4	Low	73 Å²	73	112.9 Å²	112.9	44%	0.442	59%	0.585	S	S	.	*	H	α-helix	trans	-64.9	-43	175.9	170.1	0	0	0	0	111.8	L888 V889 Q890 N894 L895 I896	L888-V892 WeakPolarHBondContact O-CG2 3.26Å; L888-V892 PolarHBondContact O-N 3.39Å; V889-V892 PolarHBondContact O-N 3.46Å; Q890-V892 PolarHBondContact O-N 3.2Å; V892-N894 VanDerWaalsContact C-N 3.31Å; V892-N894 PolarHBondContact O-N 3.39Å; V892-L895 PolarHBondContact O-N 3.01Å; V892-I896 HydrophobicContact CG1-CD1 3.77Å; V892-I896 HydrophobicContact CG1-CG1 4.46Å; V892-I896 VanDerWaalsContact O-CG1 3.29Å; V892-I896 WeakPolarHBondContact O-CG1 3.36Å; V892-I896 PolarHBondContact O-N 3.28Å
893	R	71.1	Confident	59.5	Low	110 Å²	110	114.5 Å²	114.5	42%	0.415	59%	0.594	S	S	.	*	H	α-helix	trans	-61.5	-39.6	173.8	-71.9	-171.7	-159.9	108.1	-0.8	112.1	S885 V889 Q890 I896 K897	S885-R893 PolarHBondContact OG-NH1 3.03Å; S885-R893 PolarHBondContact OG-NH2 2.82Å; V889-R893 WeakPolarHBondContact O-CG 3.48Å; V889-R893 PolarHBondContact O-N 3.47Å; Q890-R893 PolarHBondContact O-N 2.84Å; R893-I896 PolarHBondContact O-N 3.42Å; R893-K897 WeakPolarHBondContact O-CG 3.2Å; R893-K897 PolarHBondContact O-N 3.06Å
894	N	70.2	Confident	59.4	Low	81 Å²	81	116 Å²	116	43%	0.433	61%	0.606	S	S	.	*	H	α-helix	trans	-66.8	-42.2	178.1	-70	-7.6	0	0	0	111.3	Q890 R891 V892 I896 K897 T898	Q890-N894 WeakPolarHBondContact O-CB 3.43Å; Q890-N894 VanDerWaalsContact O-CG 3.25Å; Q890-N894 PolarHBondContact O-N 2.8Å; R891-N894 PolarHBondContact O-N 2.86Å; V892-N894 VanDerWaalsContact C-N 3.31Å; V892-N894 PolarHBondContact O-N 3.39Å; N894-I896 PolarHBondContact O-N 3.34Å; N894-K897 PolarHBondContact O-N 2.7Å; N894-T898 WeakPolarHBondContact O-CG2 3.24Å; N894-T898 PolarHBondContact O-N 3.13Å; N894-T898 PolarHBondContact O-OG1 2.81Å
895	L	71.1	Confident	59	Low	120 Å²	120	112.6 Å²	112.6	63%	0.628	60%	0.601	S	S	*	*	H	α-helix	trans	-59.6	-41.9	171.5	-98.1	148.2	0	0	0	113	R891 V892 K897 T898 A899	R891-L895 PolarHBondContact O-N 2.86Å; V892-L895 PolarHBondContact O-N 3.01Å; L895-K897 VanDerWaalsContact C-N 3.3Å; L895-K897 PolarHBondContact O-N 2.95Å; L895-T898 PolarHBondContact O-N 2.89Å; L895-T898 PolarHBondContact O-OG1 2.77Å; L895-A899 WeakPolarHBondContact O-CB 3.24Å; L895-A899 PolarHBondContact O-N 2.99Å
896	I	70	Confident	58.3	Low	123 Å²	123	118 Å²	118	63%	0.631	63%	0.626	S	S	*	*	H	α-helix	trans	-66.9	-33	176.5	-67.8	165.4	0	0	0	111.4	V892 R893 N894	V892-I896 HydrophobicContact CG1-CD1 3.77Å; V892-I896 HydrophobicContact CG1-CG1 4.46Å; V892-I896 VanDerWaalsContact O-CG1 3.29Å; V892-I896 WeakPolarHBondContact O-CG1 3.36Å; V892-I896 PolarHBondContact O-N 3.28Å; R893-I896 PolarHBondContact O-N 3.42Å; N894-I896 PolarHBondContact O-N 3.34Å
897	K	65.8	Low	56.6	Low	174 Å²	174	125.7 Å²	125.7	76%	0.757	65%	0.646	S	S	*	*	H	α-helix	trans	-76	-27.4	175.6	-76.1	-178.4	175.2	-172.7	0	113.8	R893 N894 L895	R893-K897 WeakPolarHBondContact O-CG 3.2Å; R893-K897 PolarHBondContact O-N 3.06Å; N894-K897 PolarHBondContact O-N 2.7Å; L895-K897 VanDerWaalsContact C-N 3.3Å; L895-K897 PolarHBondContact O-N 2.95Å
898	T	69.5	Low	54.7	Low	109 Å²	109	129.1 Å²	129.1	67%	0.669	66%	0.658	S	S	*	*	H	α-helix	trans	-98.4	-7.1	-179.2	55.8	0	0	0	0	114.4	N894 L895	N894-T898 WeakPolarHBondContact O-CG2 3.24Å; N894-T898 PolarHBondContact O-N 3.13Å; N894-T898 PolarHBondContact O-OG1 2.81Å; L895-T898 PolarHBondContact O-N 2.89Å; L895-T898 PolarHBondContact O-OG1 2.77Å
899	A	45.7	Very low	52.7	Low	58 Å²	58	129.9 Å²	129.9	48%	0.479	67%	0.668	S	S	.	*	S	Bend	trans	-66	123.6	173.9	0	0	0	0	0	111.2	L895 K901	L895-A899 WeakPolarHBondContact O-CB 3.24Å; L895-A899 PolarHBondContact O-N 2.99Å; A899-K901 PolarHBondContact O-N 3.49Å
900	P	50.6	Low	50.8	Low	118 Å²	118	131.8 Å²	131.8	77%	0.766	68%	0.684	S	S	*	*			trans	-67.8	126.7	179.6	26.8	-33.3	0	0	0	110.8	E902	P900-E902 VanDerWaalsContact C-N 3.27Å; P900-E902 PolarHBondContact O-N 2.87Å
901	K	39.7	Very low	49.1	Very low	214 Å²	214	132.7 Å²	132.7	93%	0.93	70%	0.7	S	S	*	*			trans	-82.7	70.1	175.1	-68.9	-178.6	179.9	175.9	0	110.8	A899	A899-K901 PolarHBondContact O-N 3.49Å
902	E	37.7	Very low	47.5	Very low	162 Å²	162	132.5 Å²	132.5	76%	0.757	71%	0.714	S	S	*	*			trans	-114.3	153.8	168.4	-79.7	-64.7	163.6	0	0	110.4	P900	P900-E902 VanDerWaalsContact C-N 3.27Å; P900-E902 PolarHBondContact O-N 2.87Å
903	L	37.9	Very low	45.6	Very low	169 Å²	169	136.7 Å²	136.7	89%	0.885	73%	0.732	S	S	*	*			trans	81.8	114.3	-179.7	-58	146.3	0	0	0	116.5
904	S	32	Very low	43.8	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	75%	0.754	S	S	*	*			trans	-77.4	160.5	178.2	45.2	0	0	0	0	113.2	N906	S904-N906 PolarHBondContact O-N 2.82Å
905	P	32.6	Very low	42.1	Very low	122 Å²	122	142.5 Å²	142.5	79%	0.792	78%	0.776	S	S	*	*			trans	-88	112.3	-161.5	32.8	-34	0	0	0	113.3
906	N	33.7	Very low	40.3	Very low	158 Å²	158	144.8 Å²	144.8	85%	0.845	79%	0.788	S	S	*	*			trans	-155.4	95.4	160.4	-96.1	-34.2	0	0	0	109.7	S904	S904-N906 PolarHBondContact O-N 2.82Å
907	Y	31.6	Very low	38.4	Very low	235 Å²	235	144.7 Å²	144.7	92%	0.922	80%	0.796	S	S	*	*			trans	-179.2	143.2	131.6	-117.5	-97.4	0	0	0	110.9
908	Q	28.8	Very low	36.9	Very low	171 Å²	171	141.7 Å²	141.7	80%	0.799	80%	0.804	S	S	*	*			trans	-89.7	142.8	171.9	-63.8	163.3	-19	0	0	109.4
909	T	31.3	Very low	35.4	Very low	133 Å²	133	141.2 Å²	141.2	82%	0.816	81%	0.805	S	S	*	*				178.4	114	124.9	26.2	0	0	0	0	113.9
910	S	32.5	Very low	35.2	Very low	97 Å²	97	143.8 Å²	143.8	68%	0.678	82%	0.817	S	S	*	*			trans	31.2	123.6	133.9	63.1	0	0	0	0	123.2
911	S	34	Very low	34.7	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	81%	0.811	S	S	*	*				71	84.7	122.3	72	0	0	0	0	121.5
912	V	37.4	Very low	34.8	Very low	138 Å²	138	141.7 Å²	141.7	84%	0.836	81%	0.806	S	S	*	*	S	Bend		-141.2	159.3	127.1	-169	0	0	0	0	107
913	I	35.2	Very low	34.8	Very low	161 Å²	161	144.2 Å²	144.2	83%	0.826	81%	0.809	S	S	*	*			trans	78.2	91.2	179.3	-44.6	166.6	0	0	0	113.6
914	S	32.1	Very low	34.8	Very low	125 Å²	125	140.8 Å²	140.8	87%	0.874	79%	0.791	S	S	*	*			trans	-151.2	34.3	174	-70.9	0	0	0	0	114
915	E	34.1	Very low	35.2	Very low	188 Å²	188	142.8 Å²	142.8	88%	0.879	79%	0.79	S	S	*	*	S	Bend	trans	-140.3	4.9	-169.9	-138	161.8	-152.7	0	0	117.2
916	L	33.4	Very low	35.8	Very low	169 Å²	169	145.2 Å²	145.2	89%	0.885	79%	0.788	S	S	*	*	S	Bend	trans	-134.2	136.6	175	-69.4	167.7	0	0	0	110.6
917	C	31.4	Very low	35.8	Very low	120 Å²	120	142.3 Å²	142.3	81%	0.811	77%	0.77	S	S	*	*			trans	76.9	87.5	-175.4	-56.3	0	0	0	0	116.4	S919	C917-S919 PolarHBondContact O-N 2.73Å
918	A	33.5	Very low	36.1	Very low	112 Å²	112	135.3 Å²	135.3	93%	0.926	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-56.4	119.6	157.2	0	0	0	0	0	109.5
919	S	39.1	Very low	36.6	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-103.2	144	-164.3	28.8	0	0	0	0	113.1	C917	C917-S919 PolarHBondContact O-N 2.73Å
920	P	40.7	Very low	37.1	Very low	112 Å²	112	130.5 Å²	130.5	73%	0.727	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-61.6	155.7	169.7	-19.4	32	0	0	0	111.8	K922	P920-K922 PolarHBondContact O-N 2.91Å
921	P	40.5	Very low	37.2	Very low	100 Å²	100	133.5 Å²	133.5	65%	0.649	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-67.6	131.2	-167.5	25.6	-34.3	0	0	0	113.2	R923 L924	P921-R923 PolarHBondContact O-N 3.33Å; P921-L924 PolarHBondContact O-N 3.44Å
922	K	40.8	Very low	37.3	Very low	189 Å²	189	135.4 Å²	135.4	82%	0.822	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-4.1	179.8	-62.5	176.4	178.9	176.8	0	115.8	P920	P920-K922 PolarHBondContact O-N 2.91Å
923	R	39	Very low	37.3	Very low	214 Å²	214	135.2 Å²	135.2	81%	0.808	71%	0.706	S	S	*	*	H	α-helix	trans	-76.7	-28.9	178.2	-157.8	169.5	-175.4	158.6	-0.8	112.7	P921 M927	P921-R923 PolarHBondContact O-N 3.33Å; R923-M927 PolarHBondContact O-N 3.2Å
924	L	37.9	Very low	37.4	Very low	98 Å²	98	131.6 Å²	131.6	51%	0.513	69%	0.688	S	S	.	*	H	α-helix	trans	-78.3	-44.5	-175	-135.3	165.3	0	0	0	112.5	P921 K926 M927 L928	P921-L924 PolarHBondContact O-N 3.44Å; L924-K926 VanDerWaalsContact C-N 3.29Å; L924-K926 PolarHBondContact O-N 2.84Å; L924-M927 HydrophobicContact CG-CE 4.45Å; L924-M927 PolarHBondContact O-N 3.3Å; L924-M927 VanDerWaalsContact O-N 3.16Å; L924-L928 HydrophobicContact CD2-CD1 3.71Å; L924-L928 HydrophobicContact CD2-CG 4.04Å; L924-L928 PolarHBondContact O-N 3.35Å; L924-L928 VanDerWaalsContact O-N 3.07Å
925	M	40.2	Very low	37.9	Very low	153 Å²	153	131.9 Å²	131.9	75%	0.754	68%	0.679	S	S	*	*	H	α-helix	trans	-58.5	-39.1	172.4	-86.1	-173.8	174.1	0	0	112.4	M927 L928 S929	M925-M927 VanDerWaalsContact C-N 3.28Å; M925-M927 PolarHBondContact O-N 3.21Å; M925-L928 PolarHBondContact O-N 2.81Å; M925-L928 VanDerWaalsContact O-N 3.15Å; M925-S929 PolarHBondContact O-N 3.34Å; M925-S929 PolarHBondContact O-OG 2.99Å
926	K	44	Very low	38	Very low	173 Å²	173	126.7 Å²	126.7	75%	0.752	66%	0.664	S	S	*	*	H	α-helix	trans	-70.2	-21.8	179.8	-157.4	166.6	-174.1	174	0	113.5	L924 K930	L924-K926 VanDerWaalsContact C-N 3.29Å; L924-K926 PolarHBondContact O-N 2.84Å; K926-K930 WeakPolarHBondContact O-CB 3.47Å
927	M	34	Very low	38.4	Very low	97 Å²	97	125.8 Å²	125.8	48%	0.478	66%	0.655	S	S	.	*	H	α-helix	trans	-78.9	-38.3	167.5	-66.6	-164.7	-50.6	0	0	112.3	R923 L924 M925 R931	R923-M927 PolarHBondContact O-N 3.2Å; L924-M927 HydrophobicContact CG-CE 4.45Å; L924-M927 PolarHBondContact O-N 3.3Å; L924-M927 VanDerWaalsContact O-N 3.16Å; M925-M927 VanDerWaalsContact C-N 3.28Å; M925-M927 PolarHBondContact O-N 3.21Å; M927-R931 WeakPolarHBondContact O-CG 3.43Å; M927-R931 PolarHBondContact O-N 2.86Å; M927-R931 VanDerWaalsContact O-N 3.15Å
928	L	37.7	Very low	38.6	Very low	88 Å²	88	125.4 Å²	125.4	46%	0.461	64%	0.642	S	S	.	*	H	α-helix	trans	-73.8	-39.2	-177.6	-69.4	172.7	0	0	0	113	L924 M925 K930 H932	L924-L928 HydrophobicContact CD2-CD1 3.71Å; L924-L928 HydrophobicContact CD2-CG 4.04Å; L924-L928 PolarHBondContact O-N 3.35Å; L924-L928 VanDerWaalsContact O-N 3.07Å; M925-L928 PolarHBondContact O-N 2.81Å; M925-L928 VanDerWaalsContact O-N 3.15Å; L928-K930 VanDerWaalsContact C-N 3.34Å; L928-H932 PolarHBondContact O-N 3.41Å
929	S	40.7	Very low	38.9	Very low	72 Å²	72	125.3 Å²	125.3	50%	0.503	63%	0.631	S	S	.	*	H	α-helix	trans	-64.8	-39.1	172.2	-64.6	0	0	0	0	111.7	M925 H932 E933	M925-S929 PolarHBondContact O-N 3.34Å; M925-S929 PolarHBondContact O-OG 2.99Å; S929-H932 PolarHBondContact O-N 3.07Å; S929-E933 PolarHBondContact O-N 3.1Å
930	K	40.2	Very low	38.7	Very low	131 Å²	131	124.2 Å²	124.2	57%	0.57	62%	0.623	S	S	*	*	H	α-helix	trans	-62.1	-48.6	178.3	-165	168.1	-176.4	-178.3	0	111.6	K926 L928 H932 E933 D934	K926-K930 WeakPolarHBondContact O-CB 3.47Å; L928-K930 VanDerWaalsContact C-N 3.34Å; K930-H932 PolarHBondContact O-N 3.37Å; K930-E933 PolarHBondContact O-N 2.92Å; K930-D934 WeakPolarHBondContact O-CB 3.39Å; K930-D934 PolarHBondContact O-N 2.74Å; K930-D934 VanDerWaalsContact O-OD2 3.09Å
931	R	34.6	Very low	39.1	Very low	159 Å²	159	123.9 Å²	123.9	60%	0.6	61%	0.613	S	S	*	*	H	α-helix	trans	-56	-22.6	172.4	-71.2	-178.1	-161.4	161.7	2.4	114.8	M927	M927-R931 WeakPolarHBondContact O-CG 3.43Å; M927-R931 PolarHBondContact O-N 2.86Å; M927-R931 VanDerWaalsContact O-N 3.15Å
932	H	37.9	Very low	39.7	Very low	146 Å²	146	120.2 Å²	120.2	68%	0.676	59%	0.589	S	S	*	*	H	α-helix	trans	-98.9	-19.8	-175.6	-146.5	-51.2	0	0	0	113.5	L928 S929 K930	L928-H932 PolarHBondContact O-N 3.41Å; S929-H932 PolarHBondContact O-N 3.07Å; K930-H932 PolarHBondContact O-N 3.37Å
933	E	36.7	Very low	40.3	Very low	135 Å²	135	116.5 Å²	116.5	63%	0.631	58%	0.578	S	S	*	*	H	α-helix	trans	-82.4	-40.2	166.2	-71.5	175.7	147.4	0	0	110.6	S929 K930 L935 S936 H937	S929-E933 PolarHBondContact O-N 3.1Å; K930-E933 PolarHBondContact O-N 2.92Å; E933-L935 PolarHBondContact O-N 2.92Å; E933-S936 PolarHBondContact O-N 2.93Å; E933-S936 VanDerWaalsContact O-N 3.12Å; E933-S936 PolarHBondContact O-OG 3.27Å; E933-H937 PolarHBondContact O-N 2.81Å
934	D	38.1	Very low	41.4	Very low	84 Å²	84	107.1 Å²	107.1	45%	0.449	55%	0.545	S	S	.	.	H	α-helix	trans	-56.7	-34	174.9	-64.5	-24	0	0	0	111.4	K930 S936 M938	K930-D934 WeakPolarHBondContact O-CB 3.39Å; K930-D934 PolarHBondContact O-N 2.74Å; K930-D934 VanDerWaalsContact O-OD2 3.09Å; D934-S936 PolarHBondContact O-N 3.39Å; D934-M938 WeakPolarHBondContact O-CG 3.05Å
935	L	40.8	Very low	41.9	Very low	132 Å²	132	106.2 Å²	106.2	69%	0.691	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-16.2	-178.8	-148.7	72.6	0	0	0	114.6	E933	E933-L935 PolarHBondContact O-N 2.92Å
936	S	37.1	Very low	42.4	Very low	79 Å²	79	101.5 Å²	101.5	55%	0.552	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-13.6	178	45	0	0	0	0	114.3	E933 D934 T939	E933-S936 PolarHBondContact O-N 2.93Å; E933-S936 VanDerWaalsContact O-N 3.12Å; E933-S936 PolarHBondContact O-OG 3.27Å; D934-S936 PolarHBondContact O-N 3.39Å; S936-T939 PolarHBondContact O-OG1 3.33Å
937	H	40.9	Very low	42.6	Very low	150 Å²	150	95.3 Å²	95.3	69%	0.694	50%	0.501	S	S	*	.	S	Bend	trans	-98.1	-3.1	175.6	-101.3	-74.9	0	0	0	113.7	E933 T939	E933-H937 PolarHBondContact O-N 2.81Å; H937-T939 VanDerWaalsContact C-N 3.33Å
938	M	36.6	Very low	43.1	Very low	111 Å²	111	97.8 Å²	97.8	55%	0.547	51%	0.511	S	S	.	.	S	Bend	trans	-80.7	-6.6	179	-74.3	-79.2	121.3	0	0	114.4	D934 S940	D934-M938 WeakPolarHBondContact O-CG 3.05Å; M938-S940 VanDerWaalsContact C-N 3.34Å; M938-S940 PolarHBondContact O-N 3.25Å
939	T	39.1	Very low	43	Very low	111 Å²	111	99.2 Å²	99.2	68%	0.681	51%	0.514	S	S	*	.	S	Bend	trans	-91.7	26.1	-176.1	30.8	0	0	0	0	114.5	S936 H937	S936-T939 PolarHBondContact O-OG1 3.33Å; H937-T939 VanDerWaalsContact C-N 3.33Å
940	S	36.3	Very low	42.4	Very low	74 Å²	74	98.7 Å²	98.7	52%	0.517	52%	0.52	S	S	.	.	S	Bend	trans	-139.2	135.1	175.4	61.2	0	0	0	0	112.1	M938	M938-S940 VanDerWaalsContact C-N 3.34Å; M938-S940 PolarHBondContact O-N 3.25Å
941	M	48.6	Very low	41.9	Very low	106 Å²	106	102.5 Å²	102.5	52%	0.522	53%	0.53	S	S	.	.	S	Bend	trans	89.3	33.4	159.1	-51.6	157.7	72.4	0	0	118.8	N830	N830-M941 HydrophobicContact CB-CE 3.4Å
942	C	52	Low	41.5	Very low	22 Å²	22	101.7 Å²	101.7	15%	0.149	54%	0.538	C	S	.	.			trans	-158.7	131.5	149.5	-171.2	0	0	0	0	111.3	C944 T945	C942-C944 HydrophobicContact CB-CB 4.39Å; C942-C944 WeakPolarHBondContact CB-SG 3.47Å; C942-C944 PolarHBondContact O-N 3.35Å; C942-C944 VanDerWaalsContact O-N 3.13Å; C942-C944 WeakPolarHBondContact SG-CB 3.4Å; C942-C944 PolarHBondContact SG-N 2.94Å; C942-C944 CovalentContact SG-SG 2.04Å; C942-C944 PolarHBondContact SG-SG 2.86Å; C942-T945 WeakPolarHBondContact O-CG2 3.35Å; C942-T945 PolarHBondContact O-N 3.43Å
943	D	53.1	Low	41.2	Very low	111 Å²	111	100.8 Å²	100.8	59%	0.594	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-9.6	173.4	-70.9	2.2	0	0	0	112.9	Y829 T945	Y829-D943 WeakPolarHBondContact CE2-OD2 3.47Å; Y829-D943 PolarHBondContact OH-OD2 3.17Å; D943-T945 PolarHBondContact O-N 2.88Å; D943-T945 VanDerWaalsContact O-N 3.09Å
944	C	63	Low	40.8	Very low	17 Å²	17	103.9 Å²	103.9	12%	0.115	55%	0.55	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	17.3	171.3	64.8	0	0	0	0	114.4	C835 F837 C942 S946 C994	C835-C944 PolarHBondContact SG-SG 2.93Å; F837-C944 WeakPolarHBondContact CD2-O 3.43Å; F837-C944 VanDerWaalsContact CD2-SG 3.6Å; C942-C944 HydrophobicContact CB-CB 4.39Å; C942-C944 WeakPolarHBondContact CB-SG 3.47Å; C942-C944 PolarHBondContact O-N 3.35Å; C942-C944 VanDerWaalsContact O-N 3.13Å; C942-C944 WeakPolarHBondContact SG-CB 3.4Å; C942-C944 PolarHBondContact SG-N 2.94Å; C942-C944 CovalentContact SG-SG 2.04Å; C942-C944 PolarHBondContact SG-SG 2.86Å; C944-S946 PolarHBondContact O-N 2.78Å; C944-S946 VanDerWaalsContact O-N 3.11Å; C944-C994 HydrophobicContact CB-CB 3.97Å
945	T	48.5	Very low	40.4	Very low	79 Å²	79	104.3 Å²	104.3	49%	0.485	56%	0.559	S	S	.	*			trans	-53.2	113.5	175.6	34.5	0	0	0	0	111.6	F837 C942 D943	F837-T945 HydrophobicContact CE2-CG2 4.02Å; F837-T945 HydrophobicContact CZ-CG2 3.82Å; C942-T945 WeakPolarHBondContact O-CG2 3.35Å; C942-T945 PolarHBondContact O-N 3.43Å; D943-T945 PolarHBondContact O-N 2.88Å; D943-T945 VanDerWaalsContact O-N 3.09Å
946	S	50.7	Low	39.9	Very low	55 Å²	55	106.1 Å²	106.1	39%	0.385	56%	0.564	S	S	.	*			trans	21.1	96.7	169.1	-66.9	0	0	0	0	115.1	C944 H948	C944-S946 PolarHBondContact O-N 2.78Å; C944-S946 VanDerWaalsContact O-N 3.11Å; S946-H948 VanDerWaalsContact O-CA 3.26Å; S946-H948 WeakPolarHBondContact O-CA 3.43Å; S946-H948 PolarHBondContact O-N 3.48Å; S946-H948 VanDerWaalsContact O-N 3.09Å
947	L	48.6	Very low	39.6	Very low	42 Å²	42	109 Å²	109	22%	0.22	57%	0.574	C	S	.	*	S	Bend	trans	-37.1	119.1	163.7	-65.3	172.9	0	0	0	109.3	C865 I870 F949	C865-L947 HydrophobicContact CB-CD1 3.86Å; C865-L947 HydrophobicContact CB-CD2 4.4Å; I870-L947 HydrophobicContact CB-CB 4.45Å; I870-L947 HydrophobicContact CD1-CB 3.78Å; I870-L947 HydrophobicContact CD1-CD2 4.25Å; I870-L947 HydrophobicContact CG1-CB 3.88Å; I870-L947 HydrophobicContact CG1-CD1 4.25Å; I870-L947 HydrophobicContact CG1-CD2 4.08Å; I870-L947 HydrophobicContact CG1-CG 4.28Å; I870-L947 HydrophobicContact CG2-CB 3.71Å; I870-L947 HydrophobicContact CG2-CD1 4.13Å; L947-F949 PolarHBondContact O-N 3.4Å
948	H	43.9	Very low	38.9	Very low	150 Å²	150	108.9 Å²	108.9	69%	0.694	58%	0.577	S	S	*	*			trans	-60.8	83.7	-136.4	-126.7	-113.7	0	0	0	116.6	S946 G950 L974	S946-H948 VanDerWaalsContact O-CA 3.26Å; S946-H948 WeakPolarHBondContact O-CA 3.43Å; S946-H948 PolarHBondContact O-N 3.48Å; S946-H948 VanDerWaalsContact O-N 3.09Å; H948-G950 PolarHBondContact O-N 3.09Å; H948-L974 HydrophobicContact CB-CD2 4.17Å
949	F	34.8	Very low	38.6	Very low	117 Å²	117	112.2 Å²	112.2	51%	0.513	59%	0.589	S	S	.	*			trans	-74.2	105.1	165.8	-87.7	-78.9	0	0	0	110.4	L947 R951	L947-F949 PolarHBondContact O-N 3.4Å; F949-R951 PolarHBondContact O-N 2.87Å
950	G	29.5	Very low	38.1	Very low	61 Å²	61	113 Å²	113	63%	0.629	59%	0.589	S	S	*	*			trans	-54.6	116.9	-165.5	0	0	0	0	0	116.2	H948 N952	H948-G950 PolarHBondContact O-N 3.09Å; G950-N952 VanDerWaalsContact C-N 3.31Å; G950-N952 PolarHBondContact O-N 3.11Å
951	R	28.9	Very low	38	Very low	211 Å²	211	116.1 Å²	116.1	80%	0.796	60%	0.6	S	S	*	*			trans	-83.3	68.2	173.2	-164.8	178.6	-174.8	171.6	1.6	111.8	F949 D953	F949-R951 PolarHBondContact O-N 2.87Å; R951-D953 PolarHBondContact O-N 3.12Å
952	N	26	Very low	37	Very low	143 Å²	143	117.9 Å²	117.9	77%	0.765	61%	0.612	S	S	*	*			trans	-78.4	58.5	175.9	-94.2	-28.3	0	0	0	113	G950 K954	G950-N952 VanDerWaalsContact C-N 3.31Å; G950-N952 PolarHBondContact O-N 3.11Å; N952-K954 VanDerWaalsContact C-N 3.31Å; N952-K954 PolarHBondContact O-N 2.88Å
953	D	32.8	Very low	36.1	Very low	127 Å²	127	123.5 Å²	123.5	68%	0.679	65%	0.645	S	S	*	*			trans	-85.9	69.9	168.2	-78.6	-40	0	0	0	110.6	R951 S955	R951-D953 PolarHBondContact O-N 3.12Å; D953-S955 PolarHBondContact O-N 3.35Å
954	K	28.3	Very low	34.9	Very low	200 Å²	200	125.8 Å²	125.8	87%	0.87	66%	0.658	S	S	*	*			trans	-72.5	77.2	167	-82.8	-174.8	176.6	174.9	0	110.5	N952	N952-K954 VanDerWaalsContact C-N 3.31Å; N952-K954 PolarHBondContact O-N 2.88Å
955	S	29.4	Very low	33.4	Very low	93 Å²	93	133.2 Å²	133.2	65%	0.65	69%	0.694	S	S	*	*			trans	-155.2	132.6	158.4	72.4	0	0	0	0	114.6	D953	D953-S955 PolarHBondContact O-N 3.35Å
956	Q	29.7	Very low	32.4	Very low	169 Å²	169	134.5 Å²	134.5	79%	0.79	71%	0.707	S	S	*	*			trans	88.7	121.8	159.5	-51.5	-170.7	-7.3	0	0	119.9
957	N	30.9	Very low	31.5	Very low	141 Å²	141	139.2 Å²	139.2	75%	0.754	73%	0.728	S	S	*	*			trans	77.9	93.8	163.5	-46.8	-35.2	0	0	0	115.8
958	L	27.3	Very low	30.5	Very low	146 Å²	146	146 Å²	146	76%	0.764	76%	0.755	S	S	*	*				40.8	101.7	78.4	-83.3	83.9	0	0	0	113.4
959	F	30.2	Very low	29.8	Very low	182 Å²	182	145.5 Å²	145.5	80%	0.798	76%	0.763	S	S	*	*				-175.1	149.1	94.3	-98.4	-75.9	0	0	0	110.6
960	N	28.2	Very low	29.4	Very low	128 Å²	128	148 Å²	148	68%	0.684	78%	0.781	S	S	*	*			trans	-4.1	148.7	161	-63.1	24.9	0	0	0	119.3
961	D	32.8	Very low	29.4	Very low	138 Å²	138	150.4 Å²	150.4	74%	0.738	79%	0.789	S	S	*	*			cis	-151.6	170.2	38	-116.7	-39.5	0	0	0	115.2
962	N	27.5	Very low	29.6	Very low	144 Å²	144	145.3 Å²	145.3	77%	0.77	79%	0.786	S	S	*	*			trans	-89.4	134.5	-175.3	-47.6	-88	0	0	0	113.1
963	T	34.1	Very low	29.9	Very low	140 Å²	140	145.8 Å²	145.8	86%	0.859	79%	0.788	S	S	*	*			trans	-150.7	119.1	144.8	46.5	0	0	0	0	110.3
964	D	27.4	Very low	30.3	Very low	159 Å²	159	145 Å²	145	85%	0.85	78%	0.784	S	S	*	*			trans	-62.8	143	165.1	-63.5	-65.2	0	0	0	111.1
965	I	32.5	Very low	31	Very low	172 Å²	172	141.6 Å²	141.6	88%	0.882	77%	0.773	S	S	*	*			trans	-165.8	129.9	132.4	-96.1	147.5	0	0	0	107.9
966	S	27.5	Very low	32	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	78%	0.778	S	S	*	*			trans	-82.9	136.3	176.8	54.2	0	0	0	0	111.8
967	D	31.4	Very low	33.3	Very low	154 Å²	154	137 Å²	137	82%	0.824	75%	0.754	S	S	*	*			trans	-154.2	162.8	131.4	-127.2	-30.5	0	0	0	113.4
968	K	28	Very low	35	Very low	184 Å²	184	137.7 Å²	137.7	80%	0.8	75%	0.745	S	S	*	*			trans	-96.3	143.8	-164	-56.8	158.6	-176.1	166.7	0	112.4
969	T	27.7	Very low	37.1	Very low	140 Å²	140	137.4 Å²	137.4	86%	0.859	74%	0.74	S	S	*	*			trans	-175.1	149.6	136.9	15	0	0	0	0	111.7	S971	T969-S971 PolarHBondContact O-N 3.13Å
970	D	27	Very low	39.5	Very low	168 Å²	168	130.3 Å²	130.3	90%	0.898	72%	0.719	S	S	*	*			trans	-57.2	122	-164.7	-52.5	-57.4	0	0	0	116.1
971	S	29.3	Very low	42.3	Very low	112 Å²	112	127.4 Å²	127.4	78%	0.783	71%	0.707	S	S	*	*			trans	-113.8	102.4	161.4	61.6	0	0	0	0	109	T969	T969-S971 PolarHBondContact O-N 3.13Å
972	S	33.1	Very low	45.1	Very low	105 Å²	105	120.9 Å²	120.9	73%	0.734	67%	0.672	S	S	*	*			trans	-64.9	134.2	-179.1	42.3	0	0	0	0	112.2	L974	S972-L974 PolarHBondContact O-N 3.09Å; S972-L974 VanDerWaalsContact O-N 3.15Å
973	D	33.1	Very low	48.1	Very low	153 Å²	153	117.8 Å²	117.8	82%	0.818	66%	0.655	S	S	*	*			trans	-58.2	115.8	177	-66.5	-59.4	0	0	0	111	I975	D973-I975 PolarHBondContact O-N 2.04Å
974	L	39.9	Very low	51	Low	111 Å²	111	111.4 Å²	111.4	58%	0.581	62%	0.615	S	S	*	*			trans	-68.6	99.8	169.2	-94.4	75.1	0	0	0	108.8	I870 H948 S972	I870-L974 HydrophobicContact CD1-CD2 4.16Å; H948-L974 HydrophobicContact CB-CD2 4.17Å; S972-L974 PolarHBondContact O-N 3.09Å; S972-L974 VanDerWaalsContact O-N 3.15Å
975	I	43.4	Very low	54	Low	128 Å²	128	111 Å²	111	66%	0.656	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-61.8	134.7	178.2	-61.3	171.5	0	0	0	109.7	D973	D973-I975 PolarHBondContact O-N 2.04Å
976	N	51	Low	56.8	Low	139 Å²	139	108.6 Å²	108.6	74%	0.743	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-47.4	144.3	177.7	-62.1	-7.6	0	0	0	112.1
977	G	56.9	Low	59.8	Low	27 Å²	27	105.4 Å²	105.4	28%	0.278	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-59.9	142.5	-176.3	0	0	0	0	0	113.7	I870	I870-G977 CarbonylContact O-C 3.56Å; I870-G977 VanDerWaalsContact O-CA 3.27Å; I870-G977 WeakPolarHBondContact O-CA 3.29Å
978	W	66.3	Low	62.8	Low	154 Å²	154	98.2 Å²	98.2	58%	0.583	53%	0.532	S	S	*	.	B	Isolated β-bridge	trans	-88.9	133.7	175.1	-71.5	77.6	0	0	0	111.1	I869 I870 Y871 G872 G980	I869-W978 HydrophobicContact CG2-CG 4.46Å; I870-W978 PolarHBondContact O-N 3.32Å; Y871-W978 WeakPolarHBondContact CA-O 3.27Å; Y871-W978 HydrophobicContact CD1-CB 3.79Å; Y871-W978 HydrophobicContact CE1-CB 3.88Å; Y871-W978 HydrophobicContact CE1-CG 4.5Å; G872-W978 PolarHBondContact N-O 2.69Å; G872-W978 VanDerWaalsContact N-O 3.07Å; W978-G980 VanDerWaalsContact C-N 3.27Å; W978-G980 PolarHBondContact O-N 2.69Å
979	E	71.3	Confident	65.9	Low	140 Å²	140	92.2 Å²	92.2	65%	0.654	51%	0.511	S	S	*	.			trans	-83.1	2.1	176.3	-149.7	-163.7	179.1	0	0	113.6	G872 D874	G872-E979 WeakPolarHBondContact O-CA 3.26Å; D874-E979 HydrophobicContact CB-CG 4.19Å
980	G	80.4	Confident	69	Low	34 Å²	34	85.5 Å²	85.5	35%	0.351	47%	0.47	S	S	.	.	S	Bend	trans	-91	171.4	-175.5	0	0	0	0	0	114.9	Y871 W978	Y871-G980 WeakPolarHBondContact CD1-O 3.31Å; W978-G980 VanDerWaalsContact C-N 3.27Å; W978-G980 PolarHBondContact O-N 2.69Å
981	P	87.9	Confident	72.1	Confident	67 Å²	67	79.7 Å²	79.7	44%	0.435	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-67.3	135.8	165.7	29.4	-33.4	0	0	0	110.7	E855 L856 I857	E855-P981 HydrophobicContact CB-CB 4.27Å; L856-P981 CarbonylContact O-C 3.59Å; L856-P981 WeakPolarHBondContact O-CA 3.46Å; I857-P981 HydrophobicContact CG1-CB 4.14Å
982	A	91	Very high	75.1	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	121.4	175	0	0	0	0	0	110.6	E855 L856 V866 Y871 L984	E855-A982 CarbonylContact C-O 3.59Å; E855-A982 WeakPolarHBondContact CA-O 3.5Å; L856-A982 HydrophobicContact CB-CB 4.27Å; L856-A982 PolarHBondContact N-O 3.39Å; L856-A982 PolarHBondContact O-N 3.39Å; V866-A982 HydrophobicContact CB-CB 4.2Å; V866-A982 HydrophobicContact CG1-CB 4.44Å; V866-A982 HydrophobicContact CG2-CB 3.85Å; Y871-A982 HydrophobicContact CD1-CB 3.78Å; Y871-A982 HydrophobicContact CD2-CB 3.73Å; Y871-A982 HydrophobicContact CE1-CB 3.53Å; Y871-A982 HydrophobicContact CE2-CB 3.5Å; Y871-A982 VanDerWaalsContact CE2-CB 3.5Å; Y871-A982 HydrophobicContact CG-CB 3.86Å; A982-L984 PolarHBondContact O-N 2.89Å
983	I	91.5	Very high	77.8	Confident	80 Å²	80	69.8 Å²	69.8	41%	0.41	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	118.1	178.3	-61.2	174.4	0	0	0	109.7	H853 Y854 E855	H853-I983 HydrophobicContact CB-CG2 4.26Å; Y854-I983 CarbonylContact O-C 3.53Å; Y854-I983 WeakPolarHBondContact O-CA 3.5Å; E855-I983 HydrophobicContact CG-CG1 4.41Å
984	L	93.7	Very high	80.4	Confident	5 Å²	5	63.9 Å²	63.9	3%	0.026	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	136	177.7	-57.9	-178.2	0	0	0	111.7	I845 Y854 L856 V866 A982 I990 F999	I845-L984 HydrophobicContact CB-CD1 4.45Å; I845-L984 HydrophobicContact CD1-CD1 3.71Å; I845-L984 HydrophobicContact CG1-CD1 3.82Å; I845-L984 HydrophobicContact CG2-CD1 3.81Å; Y854-L984 PolarHBondContact O-N 3.36Å; L856-L984 HydrophobicContact CB-CD1 4.1Å; L856-L984 HydrophobicContact CB-CD2 4.27Å; L856-L984 HydrophobicContact CB-CG 4.14Å; L856-L984 HydrophobicContact CD1-CD1 4.43Å; L856-L984 HydrophobicContact CD1-CD2 4.46Å; V866-L984 HydrophobicContact CG1-CD2 3.61Å; V866-L984 HydrophobicContact CG2-CD2 4.24Å; A982-L984 PolarHBondContact O-N 2.89Å; L984-I990 HydrophobicContact CD1-CD1 3.65Å; L984-I990 HydrophobicContact CD2-CD1 3.68Å; L984-I990 HydrophobicContact CD2-CG1 3.93Å; L984-I990 HydrophobicContact CG-CD1 4.32Å; L984-F999 HydrophobicContact CB-CD1 3.93Å; L984-F999 HydrophobicContact CB-CE1 4Å; L984-F999 HydrophobicContact CB-CG 4.42Å; L984-F999 HydrophobicContact CD1-CD2 4.14Å; L984-F999 HydrophobicContact CD1-CE2 4.3Å; L984-F999 HydrophobicContact CD1-CG 4.25Å
985	R	90.7	Very high	82.9	Confident	150 Å²	150	58.9 Å²	58.9	57%	0.566	31%	0.313	S	S	*	.			trans	-119.9	162	174.4	-60.3	-175.3	-176.9	-77.5	-5.4	110.1	G987 S988 F999	R985-G987 PolarHBondContact O-N 3.42Å; R985-G987 VanDerWaalsContact O-N 3.13Å; R985-S988 PolarHBondContact N-OG 3.5Å; R985-S988 WeakPolarHBondContact O-CB 3.33Å; R985-S988 PolarHBondContact O-N 3.16Å; R985-S988 PolarHBondContact O-OG 3.18Å; R985-F999 WeakPolarHBondContact O-CD1 3.4Å
986	H	91.2	Very high	85.2	Confident	123 Å²	123	55.3 Å²	55.3	57%	0.569	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	121.2	170.8	-177.5	105.7	0	0	0	109.2	L1001	H986-L1001 HydrophobicContact CB-CB 4.15Å; H986-L1001 HydrophobicContact CB-CD1 4.05Å; H986-L1001 HydrophobicContact CB-CG 3.88Å; H986-L1001 PolarHBondContact ND1-N 3.27Å; H986-L1001 PolarHBondContact ND1-O 3.07Å
987	G	90.6	Very high	87.3	Confident	39 Å²	39	48.7 Å²	48.7	40%	0.402	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.6	-8.2	-175.2	0	0	0	0	0	115.3	R985 V989 F999	R985-G987 PolarHBondContact O-N 3.42Å; R985-G987 VanDerWaalsContact O-N 3.13Å; G987-V989 PolarHBondContact O-N 2.92Å; G987-F999 PolarHBondContact N-O 3.45Å
988	S	94.2	Very high	89.2	Confident	4 Å²	4	49.9 Å²	49.9	3%	0.028	26%	0.259	C	S	.	.			trans	-60.1	132.8	179.7	-77.5	0	0	0	0	111.9	D867 R985 F999	D867-S988 VanDerWaalsContact OD1-CA 3.24Å; D867-S988 WeakPolarHBondContact OD1-CA 3.07Å; D867-S988 VanDerWaalsContact OD2-CB 3.26Å; D867-S988 WeakPolarHBondContact OD2-CB 3.14Å; D867-S988 PolarHBondContact OD2-OG 3.18Å; R985-S988 PolarHBondContact N-OG 3.5Å; R985-S988 WeakPolarHBondContact O-CB 3.33Å; R985-S988 PolarHBondContact O-N 3.16Å; R985-S988 PolarHBondContact O-OG 3.18Å; S988-F999 PolarHBondContact O-N 3.37Å
989	V	93.2	Very high	90.5	Very high	57 Å²	57	42.6 Å²	42.6	35%	0.345	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.7	178.2	-176.9	0	0	0	0	109.2	V866 D867 G987 F997	V866-V989 CarbonylContact C-O 3.59Å; V866-V989 WeakPolarHBondContact CA-O 3.36Å; D867-V989 PolarHBondContact N-O 3.37Å; D867-V989 PolarHBondContact OD1-N 2.85Å; G987-V989 PolarHBondContact O-N 2.92Å; V989-F997 WeakPolarHBondContact CA-O 3.08Å
990	I	94.4	Very high	91.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.4	-175.2	-50.4	172.9	0	0	0	109.1	I845 L856 T864 C865 V866 L984 F992 K996 F997 F999	I845-I990 HydrophobicContact CD1-CD1 4.08Å; L856-I990 HydrophobicContact CD1-CD1 4.21Å; L856-I990 HydrophobicContact CD1-CG2 3.73Å; T864-I990 HydrophobicContact CG2-CG2 4.07Å; C865-I990 CarbonylContact O-C 3.53Å; C865-I990 WeakPolarHBondContact O-CA 3.36Å; V866-I990 HydrophobicContact CG2-CG2 4.32Å; L984-I990 HydrophobicContact CD1-CD1 3.65Å; L984-I990 HydrophobicContact CD2-CD1 3.68Å; L984-I990 HydrophobicContact CD2-CG1 3.93Å; L984-I990 HydrophobicContact CG-CD1 4.32Å; I990-F992 HydrophobicContact CG2-CD2 4.35Å; I990-F992 HydrophobicContact CG2-CE1 3.82Å; I990-F992 HydrophobicContact CG2-CE2 3.6Å; I990-F992 HydrophobicContact CG2-CZ 3.31Å; I990-K996 CarbonylContact O-C 3.58Å; I990-K996 WeakPolarHBondContact O-CA 3.36Å; I990-F997 PolarHBondContact N-O 2.93Å; I990-F997 PolarHBondContact O-N 2.9Å; I990-F999 HydrophobicContact CD1-CB 3.93Å
991	Q	92	Very high	91.9	Very high	45 Å²	45	37.6 Å²	37.6	21%	0.21	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	124.7	-179.1	179.9	176	-19.6	0	0	111.9	C865 G993 Y995 K996	C865-Q991 HydrophobicContact CB-CB 4.11Å; C865-Q991 PolarHBondContact N-O 3.12Å; C865-Q991 PolarHBondContact O-N 3.37Å; Q991-G993 WeakPolarHBondContact CG-O 3.37Å; Q991-G993 PolarHBondContact NE2-O 2.95Å; Q991-Y995 CarbonylContact C-O 3.6Å; Q991-Y995 VanDerWaalsContact CA-O 3.27Å; Q991-Y995 WeakPolarHBondContact CA-O 3.22Å; Q991-K996 HydrophobicContact CB-CG 3.89Å; Q991-K996 HydrophobicContact CG-CG 3.76Å
992	F	92.1	Very high	91.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	96.2	177.4	-54.8	-67.8	0	0	0	109.3	V810 L820 H842 A843 L856 T864 I990 C994 Y995 F997	V810-F992 HydrophobicContact CB-CE2 4.39Å; V810-F992 HydrophobicContact CB-CZ 4.2Å; V810-F992 HydrophobicContact CG1-CD2 3.84Å; V810-F992 HydrophobicContact CG1-CE1 4.38Å; V810-F992 HydrophobicContact CG1-CE2 3.69Å; V810-F992 HydrophobicContact CG1-CG 4.25Å; V810-F992 HydrophobicContact CG1-CZ 3.95Å; V810-F992 HydrophobicContact CG2-CE2 4.27Å; V810-F992 HydrophobicContact CG2-CZ 4.05Å; L820-F992 HydrophobicContact CD1-CB 3.91Å; L820-F992 HydrophobicContact CD1-CG 4.42Å; L820-F992 HydrophobicContact CD2-CD2 4.44Å; H842-F992 AromaticContact CD2-CD1 3.49Å; H842-F992 VanDerWaalsContact CD2-CD1 3.49Å; H842-F992 WeakPolarHBondContact CD2-CD1 3.24Å; H842-F992 AromaticContact NE2-CD1 3.84Å; A843-F992 HydrophobicContact CB-CD1 4.29Å; A843-F992 HydrophobicContact CB-CE1 3.5Å; A843-F992 VanDerWaalsContact CB-CE1 3.5Å; A843-F992 HydrophobicContact CB-CZ 4.23Å; L856-F992 HydrophobicContact CD1-CE1 4.12Å; L856-F992 HydrophobicContact CD1-CZ 4.02Å; T864-F992 HydrophobicContact CG2-CD1 3.62Å; T864-F992 HydrophobicContact CG2-CE1 3.42Å; T864-F992 VanDerWaalsContact CG2-CE1 3.42Å; T864-F992 HydrophobicContact CG2-CZ 4.39Å; I990-F992 HydrophobicContact CG2-CD2 4.35Å; I990-F992 HydrophobicContact CG2-CE1 3.82Å; I990-F992 HydrophobicContact CG2-CE2 3.6Å; I990-F992 HydrophobicContact CG2-CZ 3.31Å; F992-C994 PolarHBondContact O-N 3Å; F992-Y995 PolarHBondContact N-O 2.92Å; F992-Y995 PolarHBondContact O-N 3.31Å; F992-F997 AromaticContact CD2-CD2 3.95Å; F992-F997 HydrophobicContact CD2-CD2 3.95Å; F992-F997 AromaticContact CD2-CE2 3.98Å; F992-F997 HydrophobicContact CD2-CE2 3.98Å; F992-F997 HydrophobicContact CE2-CD2 4.07Å; F992-F997 HydrophobicContact CE2-CE2 4.4Å
993	G	88.7	Confident	89.9	Confident	9 Å²	9	44.1 Å²	44.1	9%	0.093	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	-107.6	-169.4	0	0	0	0	0	110.6	Q991	Q991-G993 WeakPolarHBondContact CG-O 3.37Å; Q991-G993 PolarHBondContact NE2-O 2.95Å
994	C	88.6	Confident	87.5	Confident	30 Å²	30	44 Å²	44	20%	0.203	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-11.3	178.1	-136.7	0	0	0	0	114.4	L825 C835 C944 F992	L825-C994 HydrophobicContact CD1-CB 4.37Å; L825-C994 HydrophobicContact CD2-CB 3.51Å; L825-C994 WeakPolarHBondContact CD2-SG 3.48Å; C835-C994 HydrophobicContact CB-CB 3.83Å; C835-C994 PolarHBondContact SG-N 3.47Å; C835-C994 VanDerWaalsContact SG-N 3.39Å; C944-C994 HydrophobicContact CB-CB 3.97Å; F992-C994 PolarHBondContact O-N 3Å
995	Y	91.5	Very high	84.6	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	133.5	-178.7	-62.3	-88.1	0	0	0	111.1	T796 L820 Y823 L825 C835 V838 Q991 F992	T796-Y995 HydrophobicContact CG2-CD1 3.98Å; L820-Y995 HydrophobicContact CB-CD2 4.31Å; L820-Y995 HydrophobicContact CB-CE2 4.24Å; L820-Y995 HydrophobicContact CD1-CD2 4.41Å; L820-Y995 HydrophobicContact CD2-CD1 4.27Å; L820-Y995 HydrophobicContact CD2-CD2 4.2Å; L820-Y995 HydrophobicContact CD2-CG 3.86Å; L820-Y995 PolarHBondContact O-OH 3.22Å; Y823-Y995 WeakPolarHBondContact O-CE1 3.45Å; L825-Y995 HydrophobicContact CD1-CD1 3.64Å; L825-Y995 HydrophobicContact CD1-CD2 4.36Å; L825-Y995 HydrophobicContact CD1-CE1 3.38Å; L825-Y995 HydrophobicContact CD1-CE2 4.15Å; L825-Y995 HydrophobicContact CD1-CG 4.13Å; C835-Y995 HydrophobicContact CB-CD2 4.31Å; C835-Y995 HydrophobicContact CB-CE2 3.82Å; V838-Y995 HydrophobicContact CG2-CD2 3.99Å; V838-Y995 HydrophobicContact CG2-CE2 4.02Å; Q991-Y995 CarbonylContact C-O 3.6Å; Q991-Y995 VanDerWaalsContact CA-O 3.27Å; Q991-Y995 WeakPolarHBondContact CA-O 3.22Å; F992-Y995 PolarHBondContact N-O 2.92Å; F992-Y995 PolarHBondContact O-N 3.31Å
996	K	92.1	Very high	81.7	Confident	53 Å²	53	49.2 Å²	49.2	23%	0.23	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	141.1	-177.2	-77.7	-179.9	164.2	-173.7	0	112.4	C793 D794 T796 I990 Q991	C793-K996 PolarHBondContact N-O 2.95Å; C793-K996 VanDerWaalsContact SG-C 3.6Å; D794-K996 HydrophobicContact CB-CB 4.11Å; D794-K996 HydrophobicContact CB-CD 3.29Å; D794-K996 HydrophobicContact CB-CG 4.35Å; D794-K996 WeakPolarHBondContact OD2-CD 3.4Å; D794-K996 IonicContact OD2-NZ 3.64Å; D794-K996 PolarHBondContact OD2-NZ 3.19Å; T796-K996 WeakPolarHBondContact CB-O 3.47Å; T796-K996 PolarHBondContact OG1-N 3.35Å; T796-K996 PolarHBondContact OG1-O 3.47Å; I990-K996 CarbonylContact O-C 3.58Å; I990-K996 WeakPolarHBondContact O-CA 3.36Å; Q991-K996 HydrophobicContact CB-CG 3.89Å; Q991-K996 HydrophobicContact CG-CG 3.76Å
997	F	95.7	Very high	78.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	148	-178.1	-58	-89.9	0	0	0	111.3	L790 T791 P792 T796 L818 L820 Y823 V989 I990 F992	L790-F997 HydrophobicContact CB-CB 4.37Å; L790-F997 HydrophobicContact CB-CD1 4.32Å; T791-F997 CarbonylContact O-C 3.52Å; T791-F997 WeakPolarHBondContact O-CA 3.26Å; P792-F997 HydrophobicContact CB-CD1 4.04Å; P792-F997 HydrophobicContact CB-CE1 3.95Å; T796-F997 HydrophobicContact CG2-CE1 4.34Å; T796-F997 HydrophobicContact CG2-CZ 4.1Å; L818-F997 HydrophobicContact CD1-CD1 4.23Å; L818-F997 HydrophobicContact CD1-CE1 3.96Å; L818-F997 HydrophobicContact CD1-CZ 4.16Å; L818-F997 HydrophobicContact CD2-CE1 4.2Å; L818-F997 HydrophobicContact CD2-CE2 4.29Å; L818-F997 HydrophobicContact CD2-CZ 3.73Å; L820-F997 HydrophobicContact CD2-CE2 3.64Å; L820-F997 HydrophobicContact CD2-CZ 3.77Å; Y823-F997 HydrophobicContact CD1-CE1 4.03Å; Y823-F997 HydrophobicContact CD1-CZ 4.21Å; Y823-F997 HydrophobicContact CD2-CZ 4.38Å; Y823-F997 AromaticContact CE1-CE1 3.69Å; Y823-F997 HydrophobicContact CE1-CE1 3.69Å; Y823-F997 HydrophobicContact CE1-CZ 4.25Å; Y823-F997 HydrophobicContact CE2-CE1 4.37Å; Y823-F997 HydrophobicContact CE2-CZ 4.4Å; Y823-F997 HydrophobicContact CG-CZ 4.3Å; Y823-F997 AromaticContact CZ-CE1 3.86Å; V989-F997 WeakPolarHBondContact CA-O 3.08Å; I990-F997 PolarHBondContact N-O 2.93Å; I990-F997 PolarHBondContact O-N 2.9Å; F992-F997 AromaticContact CD2-CD2 3.95Å; F992-F997 HydrophobicContact CD2-CD2 3.95Å; F992-F997 AromaticContact CD2-CE2 3.98Å; F992-F997 HydrophobicContact CD2-CE2 3.98Å; F992-F997 HydrophobicContact CE2-CD2 4.07Å; F992-F997 HydrophobicContact CE2-CE2 4.4Å
998	V	95.6	Very high	75.7	Confident	53 Å²	53	52.1 Å²	52.1	32%	0.321	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.1	166	-174.9	0	0	0	0	109	L790 T791 C793	L790-V998 WeakPolarHBondContact CA-O 3.32Å; T791-V998 PolarHBondContact N-O 3.49Å; T791-V998 PolarHBondContact O-N 2.98Å; C793-V998 HydrophobicContact CB-CG2 4.02Å
999	F	95.5	Very high	72.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116	177.8	179.8	-99	0	0	0	111.5	A788 L790 I845 Y854 L984 R985 G987 S988 I990 L1001	A788-F999 HydrophobicContact CB-CD2 4.38Å; A788-F999 HydrophobicContact CB-CE1 4.42Å; A788-F999 HydrophobicContact CB-CE2 3.47Å; A788-F999 VanDerWaalsContact CB-CE2 3.47Å; A788-F999 HydrophobicContact CB-CZ 3.49Å; A788-F999 VanDerWaalsContact CB-CZ 3.49Å; L790-F999 HydrophobicContact CD1-CD2 3.79Å; L790-F999 HydrophobicContact CD1-CE2 4.21Å; L790-F999 HydrophobicContact CG-CD2 4.28Å; I845-F999 HydrophobicContact CG2-CE2 4.47Å; Y854-F999 HydrophobicContact CD1-CE1 4.5Å; Y854-F999 HydrophobicContact CD1-CE2 4.37Å; Y854-F999 AromaticContact CD1-CZ 3.61Å; Y854-F999 HydrophobicContact CD1-CZ 3.61Å; Y854-F999 HydrophobicContact CD2-CE1 4.17Å; Y854-F999 HydrophobicContact CD2-CZ 4.01Å; Y854-F999 HydrophobicContact CE1-CZ 4.01Å; Y854-F999 HydrophobicContact CE2-CZ 4.41Å; Y854-F999 HydrophobicContact CG-CE1 4.05Å; Y854-F999 AromaticContact CG-CZ 3.59Å; Y854-F999 HydrophobicContact CG-CZ 3.59Å; L984-F999 HydrophobicContact CB-CD1 3.93Å; L984-F999 HydrophobicContact CB-CE1 4Å; L984-F999 HydrophobicContact CB-CG 4.42Å; L984-F999 HydrophobicContact CD1-CD2 4.14Å; L984-F999 HydrophobicContact CD1-CE2 4.3Å; L984-F999 HydrophobicContact CD1-CG 4.25Å; R985-F999 WeakPolarHBondContact O-CD1 3.4Å; G987-F999 PolarHBondContact N-O 3.45Å; S988-F999 PolarHBondContact O-N 3.37Å; I990-F999 HydrophobicContact CD1-CB 3.93Å; F999-L1001 HydrophobicContact CE1-CD2 3.53Å; F999-L1001 HydrophobicContact CE1-CG 4.29Å; F999-L1001 HydrophobicContact CZ-CD2 3.86Å
1000	G	91.5	Very high	69.5	Low	19 Å²	19	63.9 Å²	63.9	20%	0.196	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.6	-178.6	0	0	0	0	0	113.1	A788 V789	A788-G1000 CarbonylContact C-O 3.55Å; A788-G1000 VanDerWaalsContact CA-O 3.24Å; A788-G1000 WeakPolarHBondContact CA-O 3.17Å; V789-G1000 PolarHBondContact N-O 3.23Å; V789-G1000 PolarHBondContact O-N 2.99Å
1001	L	89.4	Confident	66.5	Low	51 Å²	51	69.3 Å²	69.3	27%	0.267	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	134.1	168.3	-60.3	-176.8	0	0	0	111.4	A788 Y854 H986 F999 N1003	A788-L1001 HydrophobicContact CB-CD2 4.28Å; Y854-L1001 HydrophobicContact CD2-CD2 3.64Å; Y854-L1001 HydrophobicContact CE2-CD2 3.2Å; H986-L1001 HydrophobicContact CB-CB 4.15Å; H986-L1001 HydrophobicContact CB-CD1 4.05Å; H986-L1001 HydrophobicContact CB-CG 3.88Å; H986-L1001 PolarHBondContact ND1-N 3.27Å; H986-L1001 PolarHBondContact ND1-O 3.07Å; F999-L1001 HydrophobicContact CE1-CD2 3.53Å; F999-L1001 HydrophobicContact CE1-CG 4.29Å; F999-L1001 HydrophobicContact CZ-CD2 3.86Å; L1001-N1003 PolarHBondContact O-N 3.37Å
1002	I	79.7	Confident	63.4	Low	60 Å²	60	72 Å²	72	31%	0.308	42%	0.423	S	S	.	.			trans	-89.1	87.9	175.2	-48.3	-171.2	0	0	0	109.3	A786 R787 V789 H1004	A786-I1002 HydrophobicContact CB-CD1 3.5Å; A786-I1002 WeakPolarHBondContact O-CD1 3.37Å; R787-I1002 PolarHBondContact O-N 3.18Å; V789-I1002 HydrophobicContact CG2-CD1 3.47Å; V789-I1002 VanDerWaalsContact CG2-CD1 3.47Å; V789-I1002 HydrophobicContact CG2-CG1 3.72Å; I1002-H1004 PolarHBondContact O-CE1 3.31Å; I1002-H1004 VanDerWaalsContact O-CE1 3.26Å; I1002-H1004 PolarHBondContact O-N 3.05Å; I1002-H1004 VanDerWaalsContact O-N 3.17Å; I1002-H1004 PolarHBondContact O-ND1 2.7Å
1003	N	57.1	Low	60.6	Low	143 Å²	143	77.9 Å²	77.9	77%	0.765	46%	0.459	S	S	*	.			trans	-59.2	122.5	174.8	-76.5	-13.7	0	0	0	110.4	L1001	L1001-N1003 PolarHBondContact O-N 3.37Å
1004	H	41.2	Very low	57.7	Low	78 Å²	78	83.4 Å²	83.4	36%	0.361	49%	0.491	S	S	.	.			trans	-95.2	116.9	164.5	-56.6	-5	0	0	0	105.8	R785 I1002 L1006	R785-H1004 WeakPolarHBondContact CD-NE2 3.46Å; R785-H1004 VanDerWaalsContact CZ-CE1 3.48Å; R785-H1004 PolarHBondContact NE-CE1 2.98Å; R785-H1004 PolarHBondContact NE-NE2 3.04Å; R785-H1004 VanDerWaalsContact NE-NE2 3.12Å; R785-H1004 PolarHBondContact NH1-CD2 2.99Å; R785-H1004 PolarHBondContact NH2-ND1 3.4Å; I1002-H1004 PolarHBondContact O-CE1 3.31Å; I1002-H1004 VanDerWaalsContact O-CE1 3.26Å; I1002-H1004 PolarHBondContact O-N 3.05Å; I1002-H1004 VanDerWaalsContact O-N 3.17Å; I1002-H1004 PolarHBondContact O-ND1 2.7Å; H1004-L1006 VanDerWaalsContact C-N 3.32Å; H1004-L1006 PolarHBondContact O-N 2.76Å
1005	S	31	Very low	55	Low	116 Å²	116	88 Å²	88	81%	0.811	52%	0.518	S	S	*	.			trans	-59.6	100.4	165.2	53.3	0	0	0	0	108.1
1006	L	29.7	Very low	51.9	Low	148 Å²	148	93.9 Å²	93.9	78%	0.775	56%	0.555	S	S	*	*			trans	-48.2	142.4	152.9	-78.2	157.5	0	0	0	107.4	H1004 S1008	H1004-L1006 VanDerWaalsContact C-N 3.32Å; H1004-L1006 PolarHBondContact O-N 2.76Å; L1006-S1008 PolarHBondContact O-N 2.99Å
1007	P	28.4	Very low	49.2	Very low	110 Å²	110	96 Å²	96	71%	0.714	58%	0.583	S	S	*	*			trans	-54.9	111.8	171.4	-21.6	32.5	0	0	0	108.3	Y1009	P1007-Y1009 VanDerWaalsContact C-N 3.3Å; P1007-Y1009 PolarHBondContact O-N 2.65Å
1008	S	28	Very low	46	Very low	114 Å²	114	102.4 Å²	102.4	80%	0.797	62%	0.622	S	S	*	*			trans	-69.1	91.9	178.7	52.3	0	0	0	0	108.1	L1006 S1010	L1006-S1008 PolarHBondContact O-N 2.99Å; S1008-S1010 PolarHBondContact O-N 2.97Å
1009	Y	30.1	Very low	43	Very low	207 Å²	207	108.6 Å²	108.6	81%	0.812	65%	0.649	S	S	*	*			trans	-63.1	103.9	173.4	-103.2	-86.4	0	0	0	108.8	P1007 S1011	P1007-Y1009 VanDerWaalsContact C-N 3.3Å; P1007-Y1009 PolarHBondContact O-N 2.65Å; Y1009-S1011 VanDerWaalsContact C-N 3.33Å; Y1009-S1011 PolarHBondContact O-N 3.18Å
1010	S	27.3	Very low	39.9	Very low	100 Å²	100	114.2 Å²	114.2	70%	0.699	68%	0.684	S	S	*	*			trans	-68.1	90.4	170.4	54.5	0	0	0	0	109.1	S1008 S1012	S1008-S1010 PolarHBondContact O-N 2.97Å; S1010-S1012 PolarHBondContact O-N 3.15Å
1011	S	30.9	Very low	37.3	Very low	114 Å²	114	119 Å²	119	80%	0.797	71%	0.714	S	S	*	*			trans	-75.6	64.7	174.2	59.4	0	0	0	0	111.2	Y1009 T1013	Y1009-S1011 VanDerWaalsContact C-N 3.33Å; Y1009-S1011 PolarHBondContact O-N 3.18Å; S1011-T1013 PolarHBondContact O-N 3.41Å
1012	S	28	Very low	34.4	Very low	102 Å²	102	124.1 Å²	124.1	71%	0.713	74%	0.742	S	S	*	*			trans	-85.6	81.1	167.7	60	0	0	0	0	109.5	S1010	S1010-S1012 PolarHBondContact O-N 3.15Å
1013	T	32.6	Very low	31.9	Very low	124 Å²	124	127.7 Å²	127.7	76%	0.761	77%	0.771	S	S	*	*			trans	-106.9	98.5	168	-51.2	0	0	0	0	109	S1011 T1015	S1011-T1013 PolarHBondContact O-N 3.41Å; T1013-T1015 PolarHBondContact O-N 3.06Å
1014	T	27.2	Very low	30.6	Very low	124 Å²	124	125.4 Å²	125.4	76%	0.761	77%	0.766	S	S	*	*			trans	-59	123.8	175.3	-49.1	0	0	0	0	110.3
1015	T	32	Very low	30	Very low	126 Å²	126	128.2 Å²	128.2	77%	0.773	79%	0.789	S	S	*	*			trans	-140.3	104.9	159.2	-55.8	0	0	0	0	109	T1013 A1017	T1013-T1015 PolarHBondContact O-N 3.06Å; T1015-A1017 PolarHBondContact O-N 2.89Å
1016	T	28	Very low	30.1	Very low	129 Å²	129	128.8 Å²	128.8	79%	0.791	79%	0.793	S	S	*	*			trans	-70.6	120.1	177.3	40.3	0	0	0	0	111.3
1017	A	34	Very low	30.1	Very low	99 Å²	99	127.1 Å²	127.1	82%	0.818	79%	0.793	S	S	*	*			trans	-142	94.8	159.3	0	0	0	0	0	109.2	T1015	T1015-A1017 PolarHBondContact O-N 2.89Å
1018	T	29.1	Very low	30.2	Very low	133 Å²	133	127.5 Å²	127.5	82%	0.816	80%	0.799	S	S	*	*			trans	-68.8	132.5	170	19.2	0	0	0	0	110.6
1019	M	32.9	Very low	30.2	Very low	183 Å²	183	131.1 Å²	131.1	90%	0.901	80%	0.803	S	S	*	*			trans	-160.6	137.4	140.8	-100.2	-72.2	121.6	0	0	108.8
1020	T	29.9	Very low	30.2	Very low	119 Å²	119	130.9 Å²	130.9	73%	0.73	81%	0.809	S	S	*	*			trans	-99.5	140.4	-168	49.1	0	0	0	0	112.3
1021	S	36.1	Very low	30.4	Very low	118 Å²	118	131.3 Å²	131.3	83%	0.825	81%	0.808	S	S	*	*				171	143.2	116.3	46.1	0	0	0	0	114.8
1022	N	29.4	Very low	30.2	Very low	159 Å²	159	135.1 Å²	135.1	85%	0.85	81%	0.813	S	S	*	*			trans	-47.1	143	-179.7	-45.5	-27.1	0	0	0	116.9
1023	C	27.2	Very low	30.3	Very low	136 Å²	136	136.5 Å²	136.5	92%	0.919	81%	0.811	S	S	*	*				-152.3	157.4	124.2	-148	0	0	0	0	111.6
1024	S	29.5	Very low	30.1	Very low	95 Å²	95	136.6 Å²	136.6	66%	0.664	81%	0.811	S	S	*	*			trans	-113.6	150.4	-156.4	-49.6	0	0	0	0	114.4
1025	T	29.3	Very low	30.2	Very low	136 Å²	136	137.8 Å²	137.8	83%	0.834	81%	0.812	S	S	*	*			trans	56.7	110.2	145.6	52	0	0	0	0	120.6
1026	S	32.8	Very low	30	Very low	128 Å²	128	139.1 Å²	139.1	90%	0.895	81%	0.813	S	S	*	*				-164.7	151.1	111	41.4	0	0	0	0	110.2
1027	S	28.5	Very low	30.2	Very low	113 Å²	113	139.3 Å²	139.3	79%	0.79	82%	0.815	S	S	*	*			trans	-130.1	135.5	-154.8	53.3	0	0	0	0	114.8
1028	S	32	Very low	29.9	Very low	118 Å²	118	141.6 Å²	141.6	83%	0.825	81%	0.813	S	S	*	*			trans	-174.5	100.6	142.4	23.1	0	0	0	0	110.4
1029	H	27.2	Very low	29.9	Very low	190 Å²	190	140.6 Å²	140.6	88%	0.88	81%	0.812	S	S	*	*			trans	-151.1	108.4	168	-121.9	-81.8	0	0	0	106.2
1030	E	30	Very low	29.7	Very low	203 Å²	203	139.9 Å²	139.9	95%	0.949	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-83.6	136.3	-177.8	-97.3	-178.7	144.7	0	0	112.5
1031	T	30.8	Very low	29.5	Very low	109 Å²	109	139 Å²	139	67%	0.669	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-85.1	138.1	-162.1	42.9	0	0	0	0	113.6	I1033	T1031-I1033 PolarHBondContact O-N 3.2Å
1032	Q	27.7	Very low	29.1	Very low	193 Å²	193	140.2 Å²	140.2	90%	0.902	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-66.2	122.3	153.4	-70.9	177.1	-13.8	0	0	109.2
1033	I	30.2	Very low	29.1	Very low	131 Å²	131	138.4 Å²	138.4	67%	0.672	81%	0.806	S	S	*	*			trans	-102.9	113.8	170.4	-64.4	178	0	0	0	108.3	T1031 L1035	T1031-I1033 PolarHBondContact O-N 3.2Å; I1033-L1035 HydrophobicContact CG2-CD1 4.19Å; I1033-L1035 HydrophobicContact CG2-CG 4.39Å
1034	V	27.7	Very low	29.2	Very low	127 Å²	127	139.1 Å²	139.1	77%	0.77	80%	0.801	S	S	*	*			trans	-87.6	117.4	168.6	175.4	0	0	0	0	108
1035	L	30.2	Very low	29.3	Very low	148 Å²	148	142.2 Å²	142.2	78%	0.775	81%	0.81	S	S	*	*			trans	-118.7	107.5	172.6	-109.3	160.9	0	0	0	109.9	I1033	I1033-L1035 HydrophobicContact CG2-CD1 4.19Å; I1033-L1035 HydrophobicContact CG2-CG 4.39Å
1036	L	26.8	Very low	29.3	Very low	154 Å²	154	142.5 Å²	142.5	81%	0.806	81%	0.807	S	S	*	*			trans	-77.6	122.9	171.2	-74.4	144	0	0	0	109.4
1037	T	33.4	Very low	29.3	Very low	133 Å²	133	143.4 Å²	143.4	82%	0.816	80%	0.801	S	S	*	*			trans	-136.1	131.4	155.3	47.2	0	0	0	0	110.4
1038	N	27.6	Very low	29.3	Very low	147 Å²	147	145 Å²	145	79%	0.786	80%	0.8	S	S	*	*			trans	-82.8	155.6	175.9	-72.4	-44	0	0	0	110.5
1039	S	29	Very low	29.2	Very low	113 Å²	113	146.2 Å²	146.2	79%	0.79	80%	0.797	S	S	*	*			trans	50.2	107.5	148.9	-54.4	0	0	0	0	118.3
1040	L	27.7	Very low	29.2	Very low	168 Å²	168	143.6 Å²	143.6	88%	0.88	79%	0.794	S	S	*	*			trans	-157.6	126.5	144.8	-107.2	153.1	0	0	0	111.5
1041	S	25.7	Very low	29.1	Very low	100 Å²	100	146 Å²	146	70%	0.699	80%	0.804	S	S	*	*			trans	-72.3	125.9	170.8	49.4	0	0	0	0	110.5	T1043	S1041-T1043 PolarHBondContact O-N 2.92Å
1042	V	29.3	Very low	29	Very low	143 Å²	143	147.8 Å²	147.8	87%	0.867	81%	0.811	S	S	*	*			trans	-86.3	99.8	176.7	-178.4	0	0	0	0	110.1
1043	T	28.3	Very low	29.1	Very low	121 Å²	121	145.4 Å²	145.4	74%	0.742	81%	0.806	S	S	*	*			trans	-80.4	140.3	157.6	47.3	0	0	0	0	109.8	S1041 N1045	S1041-T1043 PolarHBondContact O-N 2.92Å; T1043-N1045 PolarHBondContact O-N 3.49Å
1044	N	29	Very low	29	Very low	151 Å²	151	146.2 Å²	146.2	81%	0.807	81%	0.814	S	S	*	*			trans	-42.5	131.5	172.6	-78.7	-22.7	0	0	0	112.9
1045	N	31.7	Very low	29.1	Very low	160 Å²	160	147.4 Å²	147.4	86%	0.856	82%	0.816	S	S	*	*				-166.5	146.2	126.1	-96.9	-30.2	0	0	0	112.4	T1043	T1043-N1045 PolarHBondContact O-N 3.49Å
1046	N	29.6	Very low	29.1	Very low	143 Å²	143	147.3 Å²	147.3	77%	0.765	82%	0.819	S	S	*	*			trans	-71.2	138.2	179.4	-50.3	-59.7	0	0	0	111.1
1047	N	33.1	Very low	29.2	Very low	147 Å²	147	146.9 Å²	146.9	79%	0.786	82%	0.82	S	S	*	*				170.4	126.7	121.2	-87.6	-27.2	0	0	0	113.9
1048	L	27.9	Very low	28.9	Very low	146 Å²	146	147.9 Å²	147.9	76%	0.764	82%	0.82	S	S	*	*			trans	50.5	140.4	139	-94.4	69.1	0	0	0	123.7
1049	L	30.3	Very low	29	Very low	144 Å²	144	147.9 Å²	147.9	75%	0.754	82%	0.823	S	S	*	*			trans	83.3	87.2	144.3	-72.9	163.2	0	0	0	120.1
1050	V	26.6	Very low	29	Very low	134 Å²	134	150.8 Å²	150.8	81%	0.812	83%	0.825	S	S	*	*				39.3	112.9	116.3	-175.9	0	0	0	0	117.9
1051	H	29	Very low	29.1	Very low	253 Å²	253	149.3 Å²	149.3	100%	1.171	82%	0.82	S	S	*	*				-146.9	0	124.8	-151.6	-46.2	0	0	0	110.6

Retrieved 1,051 of 1,051 residues in 137.5 ms (Link to these results)

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