A0A5K4F046_SCHMA Loading...

VASt domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F046, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 890 aa.

						>A0A5K4F046_SCHMA|A0A5K4F046
MPVNHSSLRSTSSKGSSPFKRRHPRSLIHVPLSGDLNWTEEMFWTLNNCNNNNNSTITTKSTSITTTPNKSVYSPSSPHKINSSFRRRHPYYQSLTPSYRTKLEQFRRIFRDTPVDTERLLDSFLFSSHYSCALSKNNNGLLLQGRMYITETWVCFYSKILYEQKIFLAVNEIVAITKEKTARVIPNAIQILYSKNHERFFFTSFASRERSYAILRKVWENCRNHQTMSIDEILQQIRDMYGDYSLAMVEDEEDTDGDAELVPTTFPHRPRTLSDSSLSSQLTGRSKSASLEDVCHSDQPVNLDRSSKCSVLGTTDDELKVVSDADIPFKRVPSFSDPSHFSTIGDEPKSQQLNTIKRCTTPEVKCHLTSGTTPNEVMSDSFQVPHKSVKEKKKRTRKKRLGSHHHDEVSNSKLMQPNYLSTHDPSPPDTSVVSSVEPPITCGPGHDHPGRVYANTDIPLNVNALFRCIFTDSEFFSRFSEHRGTFGMIQSPWPVFKWSSPSECLNQLETSSKIERTITYTLTLKQKLGPRTCTAVEQQTLLPSESISGKRYIIDAKVTNHAVPLSNCFYVVSRYCLLYVNRTTSRLHVSSQVIYEKPVFFGAKSIIENTCHSGLSDFFDTITIKLKEFATNLSLEERLTGGWLTQQRGYLNNITPPLNPSNIQNNSLLIQSVNGNQNNRKLNKADAFFTGNVNSNKVPASRYSDQAKSSIFNSCINDNTNVKKQNKTTLFGSGDMTYLFMRPDRAWLLLVIIGLLLCLFLSMVYNRLVVLEKLAEQFPPLSARDRNHFQDLFGTSPQEDRGSIPIYKDHLASKSPEWARTRLKVMKDLIHLLSKTLIQMQQTLTQVQQGIELLEFPPSNLEDNIKTSMNVKTPTNTDTNCPDTQTKHVP
					

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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	34.3	Very low	40	Very low	229 Å²	229	142.8 Å²	142.8	100%	1.128	78%	0.783	S	S	*	*				0	138.1	0	-64.7	-59.5	-167.7	0	0	107.8
2	P	51.6	Low	39.8	Very low	122 Å²	122	140.1 Å²	140.1	79%	0.792	78%	0.782	S	S	*	*			cis	-82.6	179.4	-27.4	-1	23.6	0	0	0	110.3
3	V	36.6	Very low	39.9	Very low	115 Å²	115	138.5 Å²	138.5	70%	0.697	79%	0.786	S	S	*	*			cis	100.1	105.8	21.2	-177.5	0	0	0	0	115.6
4	N	37.2	Very low	39.5	Very low	137 Å²	137	143.9 Å²	143.9	73%	0.733	80%	0.797	S	S	*	*			trans	36.1	143.5	146.9	-57.1	-12	0	0	0	123.2
5	H	44.3	Very low	39	Very low	169 Å²	169	138.7 Å²	138.7	78%	0.782	79%	0.789	S	S	*	*				-173.8	123.7	103.9	-106.9	-81.5	0	0	0	117.5
6	S	40.5	Very low	38.8	Very low	89 Å²	89	138.4 Å²	138.4	62%	0.622	80%	0.798	S	S	*	*			trans	35.4	111.7	141.2	52.8	0	0	0	0	125.8
7	S	40.2	Very low	38.5	Very low	103 Å²	103	136.5 Å²	136.5	72%	0.72	79%	0.794	S	S	*	*				105	143.4	110.9	83.6	0	0	0	0	124.8
8	L	40.6	Very low	38.5	Very low	151 Å²	151	134.7 Å²	134.7	79%	0.791	79%	0.788	S	S	*	*			trans	84	122.5	145.6	-73	163.9	0	0	0	125.5
9	R	38.1	Very low	38	Very low	223 Å²	223	137.3 Å²	137.3	84%	0.842	79%	0.789	S	S	*	*			trans	65.1	92.3	142	-79	-175.3	174.3	-165.7	-1.4	123.7
10	S	36	Very low	37.7	Very low	93 Å²	93	141.2 Å²	141.2	65%	0.65	80%	0.796	S	S	*	*				41.2	125.9	115.4	63.3	0	0	0	0	122.4
11	T	40.5	Very low	37.2	Very low	140 Å²	140	144.3 Å²	144.3	86%	0.859	80%	0.796	S	S	*	*				-176.7	150.8	103.9	25.5	0	0	0	0	115.3
12	S	37.9	Very low	36.9	Very low	110 Å²	110	142.6 Å²	142.6	77%	0.769	78%	0.776	S	S	*	*			trans	67.8	140.4	146.7	-153.8	0	0	0	0	124.3
13	S	40.2	Very low	35.8	Very low	119 Å²	119	144.2 Å²	144.2	83%	0.832	77%	0.773	S	S	*	*			trans	90.5	158.5	155	82	0	0	0	0	119.6
14	K	35.4	Very low	35.8	Very low	215 Å²	215	143.7 Å²	143.7	94%	0.935	77%	0.772	S	S	*	*			trans	-121.1	140	-155.2	-61.2	172.7	179.1	173.9	0	112.4
15	G	32	Very low	35.3	Very low	66 Å²	66	148.6 Å²	148.6	68%	0.68	78%	0.78	S	S	*	*			trans	173.2	137.6	162	0	0	0	0	0	115.4
16	S	35.9	Very low	34.7	Very low	133 Å²	133	146 Å²	146	93%	0.93	78%	0.781	S	S	*	*			trans	66.3	175.2	167.3	73.9	0	0	0	0	118.6
17	S	32.5	Very low	34	Very low	106 Å²	106	149.7 Å²	149.7	74%	0.741	79%	0.793	S	S	*	*			trans	-122.1	-168.5	-170.5	67.1	0	0	0	0	109.7
18	P	39.3	Very low	33.5	Very low	104 Å²	104	152 Å²	152	68%	0.675	80%	0.796	S	S	*	*			cis	-134.1	-162.6	-8.6	37.7	-16.7	0	0	0	113.5
19	F	28.1	Very low	32.8	Very low	184 Å²	184	153.4 Å²	153.4	81%	0.807	80%	0.798	S	S	*	*			trans	51.2	110.1	150.7	-101.4	-85	0	0	0	121
20	K	31.8	Very low	32.4	Very low	215 Å²	215	148.5 Å²	148.5	94%	0.935	79%	0.793	S	S	*	*			trans	-161.9	179.1	131.1	-116.3	170.1	-175	178.8	0	113.7
21	R	27.3	Very low	32	Very low	208 Å²	208	149.6 Å²	149.6	79%	0.785	80%	0.797	S	S	*	*			trans	-118.7	152.7	-155.4	-74.1	177.3	173.3	162.3	-3	114.9
22	R	28.5	Very low	31.3	Very low	192 Å²	192	151.6 Å²	151.6	73%	0.725	80%	0.802	S	S	*	*			trans	73	121.7	139.8	-80.9	179.3	169.9	-174.6	-1.5	122.5
23	H	29.9	Very low	30.8	Very low	156 Å²	156	152 Å²	152	72%	0.722	81%	0.805	S	S	*	*				76.8	162.6	129.1	-67.4	-39.8	0	0	0	120
24	P	36	Very low	30.2	Very low	105 Å²	105	149.6 Å²	149.6	68%	0.682	80%	0.799	S	S	*	*				-141.6	-171.2	-66.1	40.3	-21.2	0	0	0	114.1
25	R	26.3	Very low	29.8	Very low	239 Å²	239	147.6 Å²	147.6	90%	0.902	80%	0.798	S	S	*	*			trans	104.9	110.6	163.3	-62.3	175.9	172.4	177.5	-2.2	116.8
26	S	31.1	Very low	29.7	Very low	115 Å²	115	150.9 Å²	150.9	80%	0.804	80%	0.8	S	S	*	*				-163.3	158.2	109.9	55	0	0	0	0	109.7
27	L	25.7	Very low	29.4	Very low	166 Å²	166	151.7 Å²	151.7	87%	0.869	79%	0.794	S	S	*	*			trans	-93.4	142.9	174.2	-73.5	129.4	0	0	0	109.5
28	I	30.6	Very low	29.2	Very low	151 Å²	151	156.1 Å²	156.1	77%	0.774	79%	0.794	S	S	*	*			trans	-120.6	116.3	162.1	-61.6	-179.3	0	0	0	107.4	V30	I28-V30 HydrophobicContact CG2-CG2 4.29Å
29	H	25.4	Very low	28.7	Very low	181 Å²	181	155.8 Å²	155.8	84%	0.838	79%	0.79	S	S	*	*			trans	-75.5	137.3	169	-109.6	-101.7	0	0	0	109.4
30	V	30	Very low	29	Very low	121 Å²	121	154.5 Å²	154.5	73%	0.733	79%	0.787	S	S	*	*			trans	-129.8	137.9	166	-176.7	0	0	0	0	107.8	I28	I28-V30 HydrophobicContact CG2-CG2 4.29Å
31	P	27.8	Very low	29	Very low	115 Å²	115	152 Å²	152	75%	0.747	78%	0.779	S	S	*	*			trans	-83.6	153.1	-162	-12.9	31	0	0	0	115	S33	P31-S33 PolarHBondContact O-N 3.5Å
32	L	25.1	Very low	29.3	Very low	182 Å²	182	148.6 Å²	148.6	95%	0.953	77%	0.773	S	S	*	*	S	Bend	trans	-84.3	80.4	165.5	-80.5	160.4	0	0	0	110.5
33	S	27.4	Very low	29.5	Very low	119 Å²	119	147.5 Å²	147.5	83%	0.832	77%	0.774	S	S	*	*			trans	-165.6	131.6	160.5	-88.3	0	0	0	0	109.4	P31	P31-S33 PolarHBondContact O-N 3.5Å
34	G	29.1	Very low	29.5	Very low	69 Å²	69	147.6 Å²	147.6	71%	0.711	77%	0.768	S	S	*	*			trans	158.3	108	177.7	0	0	0	0	0	111.8
35	D	26.2	Very low	29.4	Very low	172 Å²	172	147.2 Å²	147.2	92%	0.92	76%	0.764	S	S	*	*			trans	-72	131.4	179.5	-57.1	-81.7	0	0	0	111.5
36	L	29.2	Very low	29.6	Very low	136 Å²	136	142.8 Å²	142.8	71%	0.712	76%	0.758	S	S	*	*			trans	-136.6	103.9	174.4	-95	158.5	0	0	0	108.8	W38	L36-W38 VanDerWaalsContact O-CD1 3.26Å; L36-W38 PolarHBondContact O-N 3.42Å
37	N	29.3	Very low	29.9	Very low	149 Å²	149	142.9 Å²	142.9	80%	0.797	75%	0.749	S	S	*	*			trans	-66.6	117.3	170.9	-99.6	-11.6	0	0	0	109.3	T39	N37-T39 PolarHBondContact O-N 3.08Å
38	W	28.4	Very low	30.2	Very low	199 Å²	199	141.3 Å²	141.3	75%	0.754	74%	0.741	S	S	*	*			trans	-93.7	78.6	172.6	-70.9	92.5	0	0	0	110.2	L36 M42	L36-W38 VanDerWaalsContact O-CD1 3.26Å; L36-W38 PolarHBondContact O-N 3.42Å; W38-M42 HydrophobicContact CE3-CG 4.45Å; W38-M42 HydrophobicContact CE3-SD 4.31Å; W38-M42 HydrophobicContact CZ3-CG 4.05Å; W38-M42 HydrophobicContact CZ3-SD 3.7Å
39	T	30.2	Very low	30.1	Very low	97 Å²	97	139.2 Å²	139.2	60%	0.595	74%	0.739	S	S	*	*			trans	-122.9	130.3	175.2	46.8	0	0	0	0	110.8	N37 E41	N37-T39 PolarHBondContact O-N 3.08Å; T39-E41 VanDerWaalsContact C-N 3.31Å; T39-E41 PolarHBondContact O-N 3.47Å
40	E	33.1	Very low	30.4	Very low	158 Å²	158	137.7 Å²	137.7	74%	0.738	74%	0.737	S	S	*	*	S	Bend	trans	59.6	-41	168.6	-57.4	-162.8	100.5	0	0	120.5	M42 F43	E40-M42 VanDerWaalsContact C-N 3.34Å; E40-M42 PolarHBondContact O-N 2.79Å; E40-M42 VanDerWaalsContact O-N 3.13Å; E40-F43 WeakPolarHBondContact O-CB 3.34Å; E40-F43 PolarHBondContact O-N 2.58Å
41	E	33.5	Very low	30.3	Very low	162 Å²	162	139.4 Å²	139.4	76%	0.757	74%	0.742	S	S	*	*	H	α-helix	trans	-61.5	-32.6	-163.1	-69.5	-157.3	125.1	0	0	115.6	T39 F43 T45	T39-E41 VanDerWaalsContact C-N 3.31Å; T39-E41 PolarHBondContact O-N 3.47Å; E41-F43 VanDerWaalsContact C-N 3.28Å; E41-F43 PolarHBondContact O-N 2.94Å; E41-T45 PolarHBondContact O-N 3.34Å; E41-T45 PolarHBondContact O-OG1 3.12Å
42	M	33.3	Very low	30.4	Very low	136 Å²	136	141.6 Å²	141.6	67%	0.67	75%	0.748	S	S	*	*	H	α-helix	trans	-74.1	-14.6	177.3	-68.2	-154.2	78.6	0	0	114.1	W38 E40	W38-M42 HydrophobicContact CE3-CG 4.45Å; W38-M42 HydrophobicContact CE3-SD 4.31Å; W38-M42 HydrophobicContact CZ3-CG 4.05Å; W38-M42 HydrophobicContact CZ3-SD 3.7Å; E40-M42 VanDerWaalsContact C-N 3.34Å; E40-M42 PolarHBondContact O-N 2.79Å; E40-M42 VanDerWaalsContact O-N 3.13Å
43	F	31.4	Very low	30.7	Very low	169 Å²	169	140.6 Å²	140.6	74%	0.741	74%	0.743	S	S	*	*	H	α-helix	trans	-84.9	-27.9	177.9	-146	-94.4	0	0	0	111.9	E40 E41	E40-F43 WeakPolarHBondContact O-CB 3.34Å; E40-F43 PolarHBondContact O-N 2.58Å; E41-F43 VanDerWaalsContact C-N 3.28Å; E41-F43 PolarHBondContact O-N 2.94Å
44	W	30.7	Very low	30.8	Very low	159 Å²	159	142.8 Å²	142.8	60%	0.602	75%	0.745	S	S	*	*	H	α-helix	trans	-86.3	-33.1	178.8	-81.5	106.4	0	0	0	114.2	L46 N47	W44-L46 PolarHBondContact O-N 2.82Å; W44-N47 PolarHBondContact O-N 3.08Å; W44-N47 VanDerWaalsContact O-N 3.11Å
45	T	34.3	Very low	31	Very low	97 Å²	97	144.9 Å²	144.9	60%	0.595	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-16.1	-175.6	32.9	0	0	0	0	114.8	E41	E41-T45 PolarHBondContact O-N 3.34Å; E41-T45 PolarHBondContact O-OG1 3.12Å
46	L	30.7	Very low	31	Very low	146 Å²	146	142.5 Å²	142.5	76%	0.764	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-17.8	172.9	-95.9	158.3	0	0	0	114.3	W44	W44-L46 PolarHBondContact O-N 2.82Å
47	N	35.7	Very low	31.2	Very low	117 Å²	117	143.8 Å²	143.8	63%	0.626	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-14.6	-176.2	-86.3	-18.3	0	0	0	114.6	W44	W44-N47 PolarHBondContact O-N 3.08Å; W44-N47 VanDerWaalsContact O-N 3.11Å
48	N	33.9	Very low	31.1	Very low	132 Å²	132	142.4 Å²	142.4	71%	0.706	74%	0.744	S	S	*	*	S	Bend	trans	-95.7	7.1	-174.6	-91.5	-18.6	0	0	0	115.4	N50	N48-N50 PolarHBondContact O-N 3.08Å
49	C	28.2	Very low	31.3	Very low	108 Å²	108	139.7 Å²	139.7	73%	0.73	75%	0.75	S	S	*	*			trans	-95.6	39.6	-173.2	-71.9	0	0	0	0	115.1
50	N	30.7	Very low	31.4	Very low	149 Å²	149	144.5 Å²	144.5	80%	0.797	76%	0.762	S	S	*	*	S	Bend	trans	-165.3	98.9	158.2	-123.3	-13.7	0	0	0	113.6	N48	N48-N50 PolarHBondContact O-N 3.08Å
51	N	28.4	Very low	31.3	Very low	156 Å²	156	142.1 Å²	142.1	83%	0.834	76%	0.763	S	S	*	*			trans	171.2	91.8	146.5	-94.1	-31.2	0	0	0	110.7
52	N	28.6	Very low	31.3	Very low	162 Å²	162	141.3 Å²	141.3	87%	0.866	77%	0.769	S	S	*	*			trans	-165.1	85.1	159.6	-104.1	-29.5	0	0	0	110
53	N	32.2	Very low	31.1	Very low	160 Å²	160	139.7 Å²	139.7	86%	0.856	77%	0.771	S	S	*	*			trans	-158.9	62.9	169	-98.6	-28.6	0	0	0	110
54	N	30	Very low	31.3	Very low	165 Å²	165	139 Å²	139	88%	0.882	77%	0.774	S	S	*	*			trans	-116.4	85	168.1	-90.4	-15.6	0	0	0	108.7	T56	N54-T56 PolarHBondContact O-N 3.11Å
55	S	32.2	Very low	31.3	Very low	114 Å²	114	136.6 Å²	136.6	80%	0.797	78%	0.777	S	S	*	*			trans	-83.9	106.4	173.1	31.1	0	0	0	0	110.4
56	T	26.3	Very low	31.3	Very low	122 Å²	122	137.8 Å²	137.8	75%	0.748	78%	0.784	S	S	*	*			trans	-65.7	130.6	-178.8	-44.7	0	0	0	0	112.3	N54 T58	N54-T56 PolarHBondContact O-N 3.11Å; T56-T58 HydrophobicContact CG2-CG2 3.96Å
57	I	33.8	Very low	31.5	Very low	163 Å²	163	137 Å²	137	84%	0.836	79%	0.786	S	S	*	*			trans	-125.5	131.1	161	-61.9	-178.1	0	0	0	108.3
58	T	26.9	Very low	31.5	Very low	120 Å²	120	136.7 Å²	136.7	74%	0.736	79%	0.79	S	S	*	*			trans	-115.7	128.7	-171.8	44.2	0	0	0	0	112.2	T56	T56-T58 HydrophobicContact CG2-CG2 3.96Å
59	T	34.3	Very low	31.6	Very low	141 Å²	141	137.5 Å²	137.5	87%	0.865	80%	0.795	S	S	*	*			trans	-140.5	151	163.9	35.5	0	0	0	0	111.5
60	K	32.1	Very low	32	Very low	198 Å²	198	141.3 Å²	141.3	86%	0.861	80%	0.799	S	S	*	*			trans	-84.9	130.7	-166.6	-65.3	169	-178.4	174.4	0	110.6
61	S	29.2	Very low	32.2	Very low	108 Å²	108	138.9 Å²	138.9	76%	0.755	79%	0.793	S	S	*	*				65.8	119.3	93.3	-42.6	0	0	0	0	115.9
62	T	33.7	Very low	32.6	Very low	145 Å²	145	137.1 Å²	137.1	89%	0.89	79%	0.788	S	S	*	*				-176.8	158.5	128.2	-70.9	0	0	0	0	108.7
63	S	29.6	Very low	33	Very low	102 Å²	102	140.2 Å²	140.2	71%	0.713	79%	0.789	S	S	*	*			trans	-123.9	-165.3	-169.8	57.5	0	0	0	0	113.1
64	I	36.9	Very low	32.8	Very low	155 Å²	155	137.6 Å²	137.6	80%	0.795	78%	0.783	S	S	*	*			trans	96.8	142.1	178.5	-54.9	159.4	0	0	0	113.5
65	T	29	Very low	33.1	Very low	108 Å²	108	135.6 Å²	135.6	66%	0.663	78%	0.78	S	S	*	*			cis	173.5	154.2	-46.4	-83.6	0	0	0	0	107.3
66	T	34.6	Very low	33.1	Very low	122 Å²	122	135.7 Å²	135.7	75%	0.748	78%	0.78	S	S	*	*			trans	63.4	152.2	169	47.4	0	0	0	0	117.9
67	T	35.4	Very low	33.6	Very low	129 Å²	129	135.3 Å²	135.3	79%	0.791	78%	0.783	S	S	*	*			cis	-161.1	160.3	-19.4	17.6	0	0	0	0	109.5
68	P	35.5	Very low	33.6	Very low	112 Å²	112	133 Å²	133	73%	0.727	78%	0.778	S	S	*	*			trans	-110.3	153.7	-175.9	39.3	-32.2	0	0	0	116
69	N	35.3	Very low	33.9	Very low	149 Å²	149	136.3 Å²	136.3	80%	0.797	78%	0.784	S	S	*	*			trans	-177.8	143.5	145.1	-112.5	-56.1	0	0	0	115.2
70	K	37.8	Very low	33.9	Very low	187 Å²	187	139 Å²	139	81%	0.813	78%	0.784	S	S	*	*			trans	61.4	149.9	157.7	-64.8	177.6	-177.3	179.7	0	118.6
71	S	34.7	Very low	34	Very low	98 Å²	98	137 Å²	137	69%	0.685	78%	0.781	S	S	*	*			cis	-172.5	152.4	-16.8	50.9	0	0	0	0	113
72	V	36	Very low	34	Very low	119 Å²	119	139.3 Å²	139.3	72%	0.721	79%	0.785	S	S	*	*			trans	84.7	140.8	146.8	160.1	0	0	0	0	121.5
73	Y	36.5	Very low	33.8	Very low	228 Å²	228	136.8 Å²	136.8	89%	0.894	77%	0.774	S	S	*	*			trans	74.6	155.4	174.1	-72.6	-55.9	0	0	0	121.4
74	S	29	Very low	34	Very low	105 Å²	105	137 Å²	137	73%	0.734	78%	0.775	S	S	*	*			trans	-122.8	-167.5	-153.3	-28.4	0	0	0	0	111.6
75	P	35.9	Very low	33.9	Very low	123 Å²	123	138.6 Å²	138.6	80%	0.799	78%	0.777	S	S	*	*			cis	-134.2	154	-19.2	36.6	-20.3	0	0	0	114.8
76	S	33.6	Very low	34.3	Very low	116 Å²	116	144.4 Å²	144.4	81%	0.811	79%	0.786	S	S	*	*			trans	-174.2	151.5	153	54.1	0	0	0	0	115.9
77	S	36.4	Very low	34.4	Very low	114 Å²	114	150 Å²	150	80%	0.797	79%	0.794	S	S	*	*			trans	68.6	168.6	153.5	-114.8	0	0	0	0	118.4
78	P	32.5	Very low	34.4	Very low	113 Å²	113	154.6 Å²	154.6	73%	0.734	80%	0.797	S	S	*	*				-110.6	168.9	-120.9	13	10.2	0	0	0	115	K80	P78-K80 PolarHBondContact O-N 3.11Å
79	H	33.7	Very low	34.6	Very low	190 Å²	190	156.7 Å²	156.7	88%	0.88	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-61.6	124.6	178	-73.2	-84.3	0	0	0	112.6	I81	H79-I81 PolarHBondContact O-N 3.49Å
80	K	34.5	Very low	34.7	Very low	199 Å²	199	154.5 Å²	154.5	87%	0.865	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-68.6	116.7	169	-70.3	-178.3	176.5	179.5	0	110.1	P78	P78-K80 PolarHBondContact O-N 3.11Å
81	I	34.7	Very low	34.5	Very low	154 Å²	154	153.3 Å²	153.3	79%	0.79	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-71	129	163.3	-64.1	173.9	0	0	0	107.8	H79 S83	H79-I81 PolarHBondContact O-N 3.49Å; I81-S83 VanDerWaalsContact C-N 3.28Å; I81-S83 PolarHBondContact O-N 3.23Å
82	N	28.5	Very low	34.5	Very low	158 Å²	158	157 Å²	157	85%	0.845	78%	0.782	S	S	*	*			trans	-74.4	80.2	173.6	-91.4	-26	0	0	0	110.4	S84	N82-S84 VanDerWaalsContact C-N 3.32Å; N82-S84 PolarHBondContact O-N 3.23Å
83	S	30.1	Very low	34.4	Very low	92 Å²	92	158.4 Å²	158.4	64%	0.643	78%	0.781	S	S	*	*			trans	-69.8	88.2	167.4	47.4	0	0	0	0	109.9	I81 F85	I81-S83 VanDerWaalsContact C-N 3.28Å; I81-S83 PolarHBondContact O-N 3.23Å; S83-F85 PolarHBondContact O-N 3.22Å
84	S	33.5	Very low	34.5	Very low	107 Å²	107	151.6 Å²	151.6	75%	0.748	77%	0.766	S	S	*	*			trans	-72.2	63.5	169.4	62.8	0	0	0	0	110.6	N82 R86	N82-S84 VanDerWaalsContact C-N 3.32Å; N82-S84 PolarHBondContact O-N 3.23Å; S84-R86 PolarHBondContact O-N 3.31Å
85	F	35.5	Very low	35.2	Very low	188 Å²	188	151.3 Å²	151.3	83%	0.825	76%	0.756	S	S	*	*			trans	-63.5	101.4	-176.8	-134.9	-96.3	0	0	0	108.8	S83 R87	S83-F85 PolarHBondContact O-N 3.22Å; F85-R87 PolarHBondContact O-N 2.92Å
86	R	37.6	Very low	35.5	Very low	230 Å²	230	150.2 Å²	150.2	87%	0.868	75%	0.747	S	S	*	*			trans	-69.2	93	179.3	-73.4	-169	-179.6	-161.1	3	109	S84 R88	S84-R86 PolarHBondContact O-N 3.31Å; R86-R88 PolarHBondContact O-N 3.28Å
87	R	35	Very low	36.2	Very low	240 Å²	240	148 Å²	148	91%	0.906	73%	0.73	S	S	*	*			trans	-46.3	103.6	167.8	-76.8	-171.8	-84.7	170.2	-8	109.4	F85	F85-R87 PolarHBondContact O-N 2.92Å
88	R	36.7	Very low	36.7	Very low	224 Å²	224	145.5 Å²	145.5	85%	0.845	71%	0.713	S	S	*	*			trans	-73.8	143.8	172.3	-65.2	-170.3	-177.4	-169.3	5.4	108.2	R86	R86-R88 PolarHBondContact O-N 3.28Å
89	H	39.7	Very low	37.3	Very low	157 Å²	157	145 Å²	145	73%	0.727	70%	0.697	S	S	*	*			trans	-68.5	140.9	-177	-99.6	-105	0	0	0	111.6	Y91 Y92	H89-Y91 PolarHBondContact O-N 2.99Å; H89-Y92 PolarHBondContact O-N 2.95Å
90	P	37.8	Very low	38	Very low	103 Å²	103	145.2 Å²	145.2	67%	0.669	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-63.1	-9.7	-179.7	24.9	-34.6	0	0	0	114.5	Y92 Q93	P90-Y92 PolarHBondContact O-N 3.22Å; P90-Y92 VanDerWaalsContact O-N 3.16Å; P90-Q93 PolarHBondContact O-N 2.86Å
91	Y	33.7	Very low	39.4	Very low	162 Å²	162	139.3 Å²	139.3	64%	0.635	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-58.5	-22	173.2	-173.3	-108.9	0	0	0	114	H89 S94 L95	H89-Y91 PolarHBondContact O-N 2.99Å; Y91-S94 PolarHBondContact O-OG 2.89Å; Y91-L95 HydrophobicContact CD1-CD1 4.17Å; Y91-L95 HydrophobicContact CE1-CD1 3.91Å
92	Y	33.1	Very low	40.7	Very low	174 Å²	174	134 Å²	134	68%	0.682	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-69.4	-36.5	-179.8	-127.9	-92.5	0	0	0	113	H89 P90 S94 L95	H89-Y92 PolarHBondContact O-N 2.95Å; P90-Y92 PolarHBondContact O-N 3.22Å; P90-Y92 VanDerWaalsContact O-N 3.16Å; Y92-S94 VanDerWaalsContact C-N 3.25Å; Y92-S94 PolarHBondContact O-N 3.04Å; Y92-L95 PolarHBondContact O-N 3.38Å
93	Q	35.2	Very low	42.3	Very low	150 Å²	150	127.3 Å²	127.3	70%	0.701	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-20.1	-179.3	-79.8	174.8	-19.9	0	0	113.3	P90 L95	P90-Q93 PolarHBondContact O-N 2.86Å; Q93-L95 VanDerWaalsContact C-N 3.32Å; Q93-L95 PolarHBondContact O-N 3.22Å
94	S	39.1	Very low	44	Very low	84 Å²	84	127.2 Å²	127.2	59%	0.587	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-11.4	174.4	31.3	0	0	0	0	115.1	Y91 Y92	Y91-S94 PolarHBondContact O-OG 2.89Å; Y92-S94 VanDerWaalsContact C-N 3.25Å; Y92-S94 PolarHBondContact O-N 3.04Å
95	L	42.2	Very low	45.8	Very low	100 Å²	100	125.6 Å²	125.6	52%	0.524	58%	0.576	S	S	.	*	S	Bend	trans	-96.3	-11.5	-169.2	-67.8	169.9	0	0	0	114.9	Y91 Y92 Q93	Y91-L95 HydrophobicContact CD1-CD1 4.17Å; Y91-L95 HydrophobicContact CE1-CD1 3.91Å; Y92-L95 PolarHBondContact O-N 3.38Å; Q93-L95 VanDerWaalsContact C-N 3.32Å; Q93-L95 PolarHBondContact O-N 3.22Å
96	T	42	Very low	47.5	Very low	100 Å²	100	116.7 Å²	116.7	61%	0.613	54%	0.537	S	S	*	.	S	Bend	trans	-137.2	104.8	177.9	33.7	0	0	0	0	111.1	S98	T96-S98 PolarHBondContact O-N 3.14Å
97	P	49.3	Very low	49.1	Very low	69 Å²	69	108.5 Å²	108.5	45%	0.448	51%	0.506	S	S	.	.			trans	-64	137.7	179.7	22	-30.1	0	0	0	111.5	T101 K102	P97-T101 HydrophobicContact CB-CG2 4.07Å; P97-K102 HydrophobicContact CG-CG 4.47Å; P97-K102 WeakPolarHBondContact O-CE 3.24Å; P97-K102 PolarHBondContact O-NZ 2.82Å
98	S	45.9	Very low	51.1	Low	62 Å²	62	104.8 Å²	104.8	43%	0.434	49%	0.492	S	S	.	.			trans	-58	160.7	-176.6	78.3	0	0	0	0	113.2	T96 R100 T101 K102	T96-S98 PolarHBondContact O-N 3.14Å; S98-R100 VanDerWaalsContact C-N 3.25Å; S98-R100 PolarHBondContact O-N 2.88Å; S98-R100 PolarHBondContact OG-N 2.88Å; S98-T101 WeakPolarHBondContact O-CB 3.33Å; S98-T101 PolarHBondContact O-N 2.94Å; S98-T101 VanDerWaalsContact O-N 3.13Å; S98-T101 PolarHBondContact OG-N 3.2Å; S98-T101 VanDerWaalsContact OG-N 3.15Å; S98-T101 PolarHBondContact OG-OG1 3.07Å; S98-K102 WeakPolarHBondContact O-CG 3.39Å; S98-K102 PolarHBondContact O-N 2.77Å
99	Y	45.8	Very low	53	Low	102 Å²	102	94.7 Å²	94.7	40%	0.4	46%	0.455	S	S	.	.	H	α-helix	trans	-49.3	-47	171.6	169.7	-108.5	0	0	0	112.1	T101 K102 L103 F124	Y99-T101 PolarHBondContact O-N 2.61Å; Y99-K102 PolarHBondContact O-N 3.05Å; Y99-L103 HydrophobicContact CE1-CD2 4.21Å; Y99-L103 WeakPolarHBondContact O-CB 3.49Å; Y99-L103 PolarHBondContact O-N 2.8Å; Y99-F124 PolarHBondContact OH-O 2.82Å
100	R	48.5	Very low	54.9	Low	195 Å²	195	87.2 Å²	87.2	74%	0.736	42%	0.42	S	S	*	.	H	α-helix	trans	-59.6	-45.4	178.8	-64.3	-178.4	180	173.3	1.8	111.8	S98 K102 L103 E104	S98-R100 VanDerWaalsContact C-N 3.25Å; S98-R100 PolarHBondContact O-N 2.88Å; S98-R100 PolarHBondContact OG-N 2.88Å; R100-K102 VanDerWaalsContact C-N 3.32Å; R100-K102 PolarHBondContact O-N 3.01Å; R100-L103 PolarHBondContact O-N 2.97Å; R100-E104 WeakPolarHBondContact O-CB 3.26Å; R100-E104 PolarHBondContact O-N 3.01Å
101	T	64	Low	56.2	Low	75 Å²	75	90.4 Å²	90.4	46%	0.46	42%	0.419	S	S	.	.	H	α-helix	trans	-61.2	-39	177.5	-44.7	0	0	0	0	112.3	P97 S98 Y99 Q105	P97-T101 HydrophobicContact CB-CG2 4.07Å; S98-T101 WeakPolarHBondContact O-CB 3.33Å; S98-T101 PolarHBondContact O-N 2.94Å; S98-T101 VanDerWaalsContact O-N 3.13Å; S98-T101 PolarHBondContact OG-N 3.2Å; S98-T101 VanDerWaalsContact OG-N 3.15Å; S98-T101 PolarHBondContact OG-OG1 3.07Å; Y99-T101 PolarHBondContact O-N 2.61Å; T101-Q105 PolarHBondContact O-N 2.97Å
102	K	62.2	Low	57.9	Low	43 Å²	43	90.2 Å²	90.2	19%	0.187	43%	0.429	C	S	.	.	H	α-helix	trans	-70.7	-43.8	178.2	-66	170.8	172.6	132.7	0	112.1	P97 S98 Y99 R100 Q105 F106	P97-K102 HydrophobicContact CG-CG 4.47Å; P97-K102 WeakPolarHBondContact O-CE 3.24Å; P97-K102 PolarHBondContact O-NZ 2.82Å; S98-K102 WeakPolarHBondContact O-CG 3.39Å; S98-K102 PolarHBondContact O-N 2.77Å; Y99-K102 PolarHBondContact O-N 3.05Å; R100-K102 VanDerWaalsContact C-N 3.32Å; R100-K102 PolarHBondContact O-N 3.01Å; K102-Q105 PolarHBondContact O-N 2.84Å; K102-F106 PolarHBondContact O-N 2.68Å
103	L	61.7	Low	59.7	Low	16 Å²	16	83.4 Å²	83.4	8%	0.084	41%	0.405	C	S	.	.	H	α-helix	trans	-61.7	-44.5	174.7	175.8	58.1	0	0	0	111.2	Y99 R100 Q105 F106 R107 F124	Y99-L103 HydrophobicContact CE1-CD2 4.21Å; Y99-L103 WeakPolarHBondContact O-CB 3.49Å; Y99-L103 PolarHBondContact O-N 2.8Å; R100-L103 PolarHBondContact O-N 2.97Å; L103-Q105 VanDerWaalsContact C-N 3.33Å; L103-Q105 PolarHBondContact O-N 2.81Å; L103-F106 PolarHBondContact O-N 3.42Å; L103-R107 HydrophobicContact CD1-CG 4.35Å; L103-R107 WeakPolarHBondContact O-CG 3.33Å; L103-R107 PolarHBondContact O-N 2.75Å; L103-F124 HydrophobicContact CD1-CB 3.79Å; L103-F124 HydrophobicContact CD1-CD1 3.6Å; L103-F124 HydrophobicContact CD1-CE1 4.38Å; L103-F124 HydrophobicContact CD1-CG 3.67Å
104	E	64.9	Low	61.1	Low	90 Å²	90	79.8 Å²	79.8	42%	0.421	40%	0.395	S	S	.	.	H	α-helix	trans	-59.6	-40.9	172.1	-82.4	-167	-121.1	0	0	112.7	R100 R107 R108	R100-E104 WeakPolarHBondContact O-CB 3.26Å; R100-E104 PolarHBondContact O-N 3.01Å; E104-R107 PolarHBondContact O-N 2.76Å; E104-R108 WeakPolarHBondContact O-CB 3.18Å; E104-R108 WeakPolarHBondContact O-CD 3.22Å; E104-R108 WeakPolarHBondContact O-CG 3.1Å; E104-R108 PolarHBondContact O-N 2.89Å; E104-R108 IonicContact OE2-CZ 3.08Å; E104-R108 IonicContact OE2-NE 2.71Å; E104-R108 IonicContact OE2-NH2 3.85Å; E104-R108 PolarHBondContact OE2-NH2 3.19Å
105	Q	72.9	Confident	62.4	Low	73 Å²	73	75.9 Å²	75.9	34%	0.341	37%	0.367	S	S	.	.	H	α-helix	trans	-61.6	-45	175.5	-175.1	173.9	16.9	0	0	111.3	T101 K102 L103 R108 I109	T101-Q105 PolarHBondContact O-N 2.97Å; K102-Q105 PolarHBondContact O-N 2.84Å; L103-Q105 VanDerWaalsContact C-N 3.33Å; L103-Q105 PolarHBondContact O-N 2.81Å; Q105-R108 PolarHBondContact O-N 2.85Å; Q105-I109 HydrophobicContact CG-CD1 3.8Å; Q105-I109 WeakPolarHBondContact O-CD1 3.36Å; Q105-I109 VanDerWaalsContact O-CG1 3.26Å; Q105-I109 WeakPolarHBondContact O-CG1 3.24Å; Q105-I109 PolarHBondContact O-N 3.2Å; Q105-I109 VanDerWaalsContact O-N 3.08Å
106	F	71.3	Confident	63.2	Low	1 Å²	1	75.9 Å²	75.9	0%	0.004	37%	0.368	C	S	.	.	H	α-helix	trans	-58.9	-50.8	175.2	175.4	-98.1	0	0	0	111.6	K102 L103 R108 I109 F110 V115 L120 F124 Y148 C155	K102-F106 PolarHBondContact O-N 2.68Å; L103-F106 PolarHBondContact O-N 3.42Å; F106-R108 VanDerWaalsContact C-N 3.31Å; F106-R108 PolarHBondContact O-N 2.66Å; F106-I109 PolarHBondContact O-N 2.98Å; F106-F110 AromaticContact CD2-CD2 3.45Å; F106-F110 HydrophobicContact CD2-CD2 3.45Å; F106-F110 VanDerWaalsContact CD2-CD2 3.45Å; F106-F110 AromaticContact CD2-CE2 3.83Å; F106-F110 HydrophobicContact CD2-CE2 3.83Å; F106-F110 HydrophobicContact CD2-CG 4.43Å; F106-F110 HydrophobicContact CE2-CB 4.39Å; F106-F110 AromaticContact CE2-CD2 3.31Å; F106-F110 HydrophobicContact CE2-CD2 3.31Å; F106-F110 AromaticContact CE2-CE2 3.73Å; F106-F110 HydrophobicContact CE2-CE2 3.73Å; F106-F110 AromaticContact CE2-CG 3.95Å; F106-F110 HydrophobicContact CE2-CG 3.95Å; F106-F110 HydrophobicContact CG-CD2 4.26Å; F106-F110 HydrophobicContact CZ-CB 4.25Å; F106-F110 HydrophobicContact CZ-CD2 4.01Å; F106-F110 HydrophobicContact CZ-CG 4.25Å; F106-F110 PolarHBondContact O-N 3.41Å; F106-V115 HydrophobicContact CZ-CG1 4.16Å; F106-L120 HydrophobicContact CE1-CD1 4Å; F106-L120 HydrophobicContact CZ-CD1 4.4Å; F106-F124 HydrophobicContact CB-CE1 3.98Å; F106-F124 HydrophobicContact CB-CE2 4.39Å; F106-F124 HydrophobicContact CB-CZ 3.67Å; F106-F124 HydrophobicContact CD1-CD2 4Å; F106-F124 HydrophobicContact CD1-CE1 4.33Å; F106-F124 AromaticContact CD1-CE2 3.37Å; F106-F124 HydrophobicContact CD1-CE2 3.37Å; F106-F124 AromaticContact CD1-CZ 3.56Å; F106-F124 HydrophobicContact CD1-CZ 3.56Å; F106-F124 AromaticContact CD2-CE2 3.77Å; F106-F124 HydrophobicContact CD2-CE2 3.77Å; F106-F124 AromaticContact CD2-CZ 3.48Å; F106-F124 HydrophobicContact CD2-CZ 3.48Å; F106-F124 VanDerWaalsContact CD2-CZ 3.48Å; F106-F124 HydrophobicContact CE1-CD2 4.01Å; F106-F124 AromaticContact CE1-CE2 3.41Å; F106-F124 HydrophobicContact CE1-CE2 3.41Å; F106-F124 VanDerWaalsContact CE1-CE2 3.41Å; F106-F124 HydrophobicContact CE1-CZ 4.04Å; F106-F124 AromaticContact CE2-CE2 3.8Å; F106-F124 HydrophobicContact CE2-CE2 3.8Å; F106-F124 AromaticContact CE2-CZ 3.96Å; F106-F124 HydrophobicContact CE2-CZ 3.96Å; F106-F124 HydrophobicContact CG-CE1 4.04Å; F106-F124 AromaticContact CG-CE2 3.56Å; F106-F124 HydrophobicContact CG-CE2 3.56Å; F106-F124 AromaticContact CG-CZ 3.25Å; F106-F124 HydrophobicContact CG-CZ 3.25Å; F106-F124 AromaticContact CZ-CE2 3.62Å; F106-F124 HydrophobicContact CZ-CE2 3.62Å; F106-F124 HydrophobicContact CZ-CZ 4.22Å; F106-Y148 HydrophobicContact CB-CD1 4.4Å; F106-Y148 HydrophobicContact CB-CE1 4.32Å; F106-Y148 AromaticContact CD2-CD1 3.79Å; F106-Y148 HydrophobicContact CD2-CD1 3.79Å; F106-Y148 HydrophobicContact CD2-CD2 4.09Å; F106-Y148 HydrophobicContact CD2-CE1 4.29Å; F106-Y148 AromaticContact CD2-CG 3.68Å; F106-Y148 HydrophobicContact CD2-CG 3.68Å; F106-Y148 HydrophobicContact CE2-CD2 4.5Å; F106-Y148 HydrophobicContact CE2-CG 4.13Å; F106-Y148 HydrophobicContact CG-CD1 4.49Å; F106-C155 HydrophobicContact CE2-CB 4.36Å
107	R	70.7	Confident	64	Low	59 Å²	59	72.1 Å²	72.1	22%	0.223	35%	0.345	C	S	.	.	H	α-helix	trans	-58	-41.8	177.7	-67.4	-170.7	172.7	141.3	6.6	111.9	L103 E104 I109 R111 T117 L120 L121	L103-R107 HydrophobicContact CD1-CG 4.35Å; L103-R107 WeakPolarHBondContact O-CG 3.33Å; L103-R107 PolarHBondContact O-N 2.75Å; E104-R107 PolarHBondContact O-N 2.76Å; R107-I109 VanDerWaalsContact C-N 3.29Å; R107-I109 PolarHBondContact O-N 2.99Å; R107-R111 WeakPolarHBondContact O-CD 3.48Å; R107-R111 WeakPolarHBondContact O-CG 3.27Å; R107-R111 PolarHBondContact O-N 3.2Å; R107-T117 HydrophobicContact CB-CG2 3.99Å; R107-T117 HydrophobicContact CG-CG2 3.64Å; R107-L120 PolarHBondContact NH2-O 2.93Å; R107-L121 VanDerWaalsContact NH2-CD2 3.31Å
108	R	76	Confident	64	Low	162 Å²	162	77.2 Å²	77.2	61%	0.611	36%	0.363	S	S	*	.	H	α-helix	trans	-65.3	-28	176.5	-70.1	167.6	-167.3	-146.4	9.3	113	E104 Q105 F106	E104-R108 WeakPolarHBondContact O-CB 3.18Å; E104-R108 WeakPolarHBondContact O-CD 3.22Å; E104-R108 WeakPolarHBondContact O-CG 3.1Å; E104-R108 PolarHBondContact O-N 2.89Å; E104-R108 IonicContact OE2-CZ 3.08Å; E104-R108 IonicContact OE2-NE 2.71Å; E104-R108 IonicContact OE2-NH2 3.85Å; E104-R108 PolarHBondContact OE2-NH2 3.19Å; Q105-R108 PolarHBondContact O-N 2.85Å; F106-R108 VanDerWaalsContact C-N 3.31Å; F106-R108 PolarHBondContact O-N 2.66Å
109	I	78	Confident	64.1	Low	12 Å²	12	84 Å²	84	6%	0.062	38%	0.379	C	S	.	.	H	α-helix	trans	-82.3	-41.7	179.1	-68.4	165	0	0	0	112.1	Q105 F106 R107 Y157 K165	Q105-I109 HydrophobicContact CG-CD1 3.8Å; Q105-I109 WeakPolarHBondContact O-CD1 3.36Å; Q105-I109 VanDerWaalsContact O-CG1 3.26Å; Q105-I109 WeakPolarHBondContact O-CG1 3.24Å; Q105-I109 PolarHBondContact O-N 3.2Å; Q105-I109 VanDerWaalsContact O-N 3.08Å; F106-I109 PolarHBondContact O-N 2.98Å; R107-I109 VanDerWaalsContact C-N 3.29Å; R107-I109 PolarHBondContact O-N 2.99Å; I109-Y157 HydrophobicContact CD1-CD1 3.77Å; I109-Y157 HydrophobicContact CD1-CD2 4.35Å; I109-Y157 HydrophobicContact CD1-CE1 3.9Å; I109-Y157 HydrophobicContact CD1-CE2 4.44Å; I109-Y157 HydrophobicContact CD1-CG 3.99Å; I109-Y157 HydrophobicContact CG1-CD2 4.42Å; I109-Y157 HydrophobicContact CG1-CE1 4.37Å; I109-Y157 HydrophobicContact CG1-CE2 4.22Å; I109-Y157 HydrophobicContact CG2-CD2 3.33Å; I109-Y157 HydrophobicContact CG2-CE2 3.64Å; I109-Y157 HydrophobicContact CG2-CG 3.85Å; I109-K165 HydrophobicContact CG2-CD 4.33Å; I109-K165 HydrophobicContact CG2-CG 4.43Å; I109-K165 WeakPolarHBondContact O-CE 3.3Å; I109-K165 PolarHBondContact O-NZ 2.65Å
110	F	77.7	Confident	64.5	Low	0 Å²	0	79.7 Å²	79.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-106.8	3.5	-166.7	-70.9	-80.7	0	0	0	115.9	F106 D112 T113 Y148 C155 K165	F106-F110 AromaticContact CD2-CD2 3.45Å; F106-F110 HydrophobicContact CD2-CD2 3.45Å; F106-F110 VanDerWaalsContact CD2-CD2 3.45Å; F106-F110 AromaticContact CD2-CE2 3.83Å; F106-F110 HydrophobicContact CD2-CE2 3.83Å; F106-F110 HydrophobicContact CD2-CG 4.43Å; F106-F110 HydrophobicContact CE2-CB 4.39Å; F106-F110 AromaticContact CE2-CD2 3.31Å; F106-F110 HydrophobicContact CE2-CD2 3.31Å; F106-F110 AromaticContact CE2-CE2 3.73Å; F106-F110 HydrophobicContact CE2-CE2 3.73Å; F106-F110 AromaticContact CE2-CG 3.95Å; F106-F110 HydrophobicContact CE2-CG 3.95Å; F106-F110 HydrophobicContact CG-CD2 4.26Å; F106-F110 HydrophobicContact CZ-CB 4.25Å; F106-F110 HydrophobicContact CZ-CD2 4.01Å; F106-F110 HydrophobicContact CZ-CG 4.25Å; F106-F110 PolarHBondContact O-N 3.41Å; F110-D112 PolarHBondContact O-N 2.73Å; F110-T113 HydrophobicContact CD1-CG2 4.09Å; F110-T113 WeakPolarHBondContact O-CB 3.41Å; F110-T113 PolarHBondContact O-N 2.89Å; F110-T113 VanDerWaalsContact O-N 3.09Å; F110-T113 PolarHBondContact O-OG1 2.89Å; F110-Y148 AromaticContact CE2-CD2 3.97Å; F110-Y148 HydrophobicContact CE2-CD2 3.97Å; F110-Y148 HydrophobicContact CE2-CE2 4.12Å; F110-C155 HydrophobicContact CE1-CB 3.9Å; F110-C155 HydrophobicContact CE2-CB 4.18Å; F110-C155 HydrophobicContact CZ-CB 3.68Å; F110-K165 HydrophobicContact CE1-CB 4.32Å; F110-K165 HydrophobicContact CE1-CG 4.4Å
111	R	66.9	Low	64.3	Low	169 Å²	169	75.4 Å²	75.4	64%	0.638	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39	-41.3	177.1	-101.1	156.1	-165.9	-157.6	1.1	116.4	R107	R107-R111 WeakPolarHBondContact O-CD 3.48Å; R107-R111 WeakPolarHBondContact O-CG 3.27Å; R107-R111 PolarHBondContact O-N 3.2Å
112	D	67.7	Low	63.4	Low	159 Å²	159	79.5 Å²	79.5	85%	0.85	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	31.1	-173.1	-47.7	-69	0	0	0	113.1	F110	F110-D112 PolarHBondContact O-N 2.73Å
113	T	70.8	Confident	62.6	Low	30 Å²	30	78.6 Å²	78.6	18%	0.184	37%	0.372	C	S	.	.	S	Bend	trans	-124.2	159.5	-175.8	70.2	0	0	0	0	111.4	F110 V115 F167	F110-T113 HydrophobicContact CD1-CG2 4.09Å; F110-T113 WeakPolarHBondContact O-CB 3.41Å; F110-T113 PolarHBondContact O-N 2.89Å; F110-T113 VanDerWaalsContact O-N 3.09Å; F110-T113 PolarHBondContact O-OG1 2.89Å; T113-V115 PolarHBondContact O-N 2.62Å; T113-F167 HydrophobicContact CG2-CD1 4.35Å; T113-F167 HydrophobicContact CG2-CE1 4.26Å
114	P	65.9	Low	61.7	Low	75 Å²	75	78.8 Å²	78.8	49%	0.487	37%	0.372	S	S	.	.	S	Bend	trans	-69.8	12.5	178.9	31	-38.2	0	0	0	114.4	D116 W153 F167	P114-D116 PolarHBondContact O-N 3.17Å; P114-W153 HydrophobicContact CB-CH2 4.4Å; P114-W153 HydrophobicContact CB-CZ2 4.39Å; P114-W153 HydrophobicContact CG-CH2 4.08Å; P114-W153 HydrophobicContact CG-CZ2 4.47Å; P114-W153 WeakPolarHBondContact O-CZ2 3.04Å; P114-F167 HydrophobicContact CG-CD2 3.89Å; P114-F167 HydrophobicContact CG-CE2 3.54Å; P114-F167 HydrophobicContact CG-CZ 4.2Å
115	V	66.9	Low	60.9	Low	1 Å²	1	75.5 Å²	75.5	1%	0.006	36%	0.357	C	S	.	.	S	Bend	trans	-85.1	100.2	171.5	-174.6	0	0	0	0	107.1	F106 T113 T117 L120 W153 F167	F106-V115 HydrophobicContact CZ-CG1 4.16Å; T113-V115 PolarHBondContact O-N 2.62Å; V115-T117 VanDerWaalsContact C-N 3.29Å; V115-T117 WeakPolarHBondContact O-CA 3.24Å; V115-T117 PolarHBondContact O-N 3.05Å; V115-T117 PolarHBondContact O-OG1 2.88Å; V115-L120 HydrophobicContact CG1-CD1 3.79Å; V115-W153 HydrophobicContact CB-CG 4.48Å; V115-W153 HydrophobicContact CG1-CB 4.45Å; V115-W153 HydrophobicContact CG1-CG 4.12Å; V115-W153 HydrophobicContact CG2-CB 4.39Å; V115-W153 HydrophobicContact CG2-CD2 3.83Å; V115-W153 HydrophobicContact CG2-CE3 4.23Å; V115-W153 HydrophobicContact CG2-CG 3.9Å; V115-F167 HydrophobicContact CG2-CB 4.01Å
116	D	58.7	Low	59.3	Low	101 Å²	101	77.1 Å²	77.1	54%	0.54	36%	0.363	S	S	.	.			trans	-52.5	84.3	-177.1	-89	-2.8	0	0	0	112.5	P114 E118 R119 L120	P114-D116 PolarHBondContact O-N 3.17Å; D116-E118 PolarHBondContact O-N 2.99Å; D116-E118 VanDerWaalsContact O-N 3.16Å; D116-R119 HydrophobicContact CB-CB 4.32Å; D116-R119 PolarHBondContact O-N 2.87Å; D116-R119 IonicContact OD2-NH1 2.76Å; D116-L120 PolarHBondContact O-N 2.84Å
117	T	58.8	Low	57.7	Low	21 Å²	21	78.9 Å²	78.9	13%	0.129	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-16.9	-165.4	-60.5	0	0	0	0	112.3	R107 V115	R107-T117 HydrophobicContact CB-CG2 3.99Å; R107-T117 HydrophobicContact CG-CG2 3.64Å; V115-T117 VanDerWaalsContact C-N 3.29Å; V115-T117 WeakPolarHBondContact O-CA 3.24Å; V115-T117 PolarHBondContact O-N 3.05Å; V115-T117 PolarHBondContact O-OG1 2.88Å
118	E	48.6	Very low	56.6	Low	176 Å²	176	77.7 Å²	77.7	82%	0.822	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-23	178	-56.7	-166.3	153.2	0	0	113.4	D116	D116-E118 PolarHBondContact O-N 2.99Å; D116-E118 VanDerWaalsContact O-N 3.16Å
119	R	48.5	Very low	55.6	Low	204 Å²	204	72.8 Å²	72.8	77%	0.77	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-23.5	172.1	-91.6	179.7	164.9	151.2	-5.9	113.3	D116 L121	D116-R119 HydrophobicContact CB-CB 4.32Å; D116-R119 PolarHBondContact O-N 2.87Å; D116-R119 IonicContact OD2-NH1 2.76Å; R119-L121 PolarHBondContact O-N 2.82Å
120	L	53	Low	55	Low	11 Å²	11	72.9 Å²	72.9	6%	0.058	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	50.3	173.2	-62.8	169.8	0	0	0	111.8	F106 R107 V115 D116 F124 T150	F106-L120 HydrophobicContact CE1-CD1 4Å; F106-L120 HydrophobicContact CZ-CD1 4.4Å; R107-L120 PolarHBondContact NH2-O 2.93Å; V115-L120 HydrophobicContact CG1-CD1 3.79Å; D116-L120 PolarHBondContact O-N 2.84Å; L120-F124 HydrophobicContact CD1-CD2 4.5Å; L120-T150 HydrophobicContact CD1-CG2 3.98Å; L120-T150 HydrophobicContact CD2-CG2 3.97Å
121	L	45.8	Very low	54.8	Low	105 Å²	105	75.4 Å²	75.4	55%	0.55	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-37.1	172	-94.3	163.2	0	0	0	111.8	R107 R119	R107-L121 VanDerWaalsContact NH2-CD2 3.31Å; R119-L121 PolarHBondContact O-N 2.82Å
122	D	44.2	Very low	55.8	Low	162 Å²	162	67.4 Å²	67.4	87%	0.866	35%	0.347	S	S	*	.	S	Bend	trans	-107.7	-4.5	-178.6	-58.6	-43.8	0	0	0	114.2
123	S	46.6	Very low	56.7	Low	23 Å²	23	59.9 Å²	59.9	16%	0.161	31%	0.307	C	S	.	.			trans	-133.1	51.2	179	68.2	0	0	0	0	115.2	E151 I230	S123-E151 WeakPolarHBondContact CB-OE1 3.36Å; S123-E151 WeakPolarHBondContact CB-OE2 3.28Å; S123-E151 PolarHBondContact OG-OE2 3Å; S123-I230 WeakPolarHBondContact O-CD1 3.46Å
124	F	42.9	Very low	57.4	Low	20 Å²	20	58.5 Å²	58.5	9%	0.088	30%	0.299	C	S	.	.			trans	-113.6	134.7	170.6	-157	-95.2	0	0	0	113.6	Y99 L103 F106 L120 Y148 T150	Y99-F124 PolarHBondContact OH-O 2.82Å; L103-F124 HydrophobicContact CD1-CB 3.79Å; L103-F124 HydrophobicContact CD1-CD1 3.6Å; L103-F124 HydrophobicContact CD1-CE1 4.38Å; L103-F124 HydrophobicContact CD1-CG 3.67Å; F106-F124 HydrophobicContact CB-CE1 3.98Å; F106-F124 HydrophobicContact CB-CE2 4.39Å; F106-F124 HydrophobicContact CB-CZ 3.67Å; F106-F124 HydrophobicContact CD1-CD2 4Å; F106-F124 HydrophobicContact CD1-CE1 4.33Å; F106-F124 AromaticContact CD1-CE2 3.37Å; F106-F124 HydrophobicContact CD1-CE2 3.37Å; F106-F124 AromaticContact CD1-CZ 3.56Å; F106-F124 HydrophobicContact CD1-CZ 3.56Å; F106-F124 AromaticContact CD2-CE2 3.77Å; F106-F124 HydrophobicContact CD2-CE2 3.77Å; F106-F124 AromaticContact CD2-CZ 3.48Å; F106-F124 HydrophobicContact CD2-CZ 3.48Å; F106-F124 VanDerWaalsContact CD2-CZ 3.48Å; F106-F124 HydrophobicContact CE1-CD2 4.01Å; F106-F124 AromaticContact CE1-CE2 3.41Å; F106-F124 HydrophobicContact CE1-CE2 3.41Å; F106-F124 VanDerWaalsContact CE1-CE2 3.41Å; F106-F124 HydrophobicContact CE1-CZ 4.04Å; F106-F124 AromaticContact CE2-CE2 3.8Å; F106-F124 HydrophobicContact CE2-CE2 3.8Å; F106-F124 AromaticContact CE2-CZ 3.96Å; F106-F124 HydrophobicContact CE2-CZ 3.96Å; F106-F124 HydrophobicContact CG-CE1 4.04Å; F106-F124 AromaticContact CG-CE2 3.56Å; F106-F124 HydrophobicContact CG-CE2 3.56Å; F106-F124 AromaticContact CG-CZ 3.25Å; F106-F124 HydrophobicContact CG-CZ 3.25Å; F106-F124 AromaticContact CZ-CE2 3.62Å; F106-F124 HydrophobicContact CZ-CE2 3.62Å; F106-F124 HydrophobicContact CZ-CZ 4.22Å; L120-F124 HydrophobicContact CD1-CD2 4.5Å; F124-Y148 HydrophobicContact CZ-CD1 4.03Å; F124-T150 HydrophobicContact CD2-CG2 3.96Å; F124-T150 HydrophobicContact CE2-CG2 3.83Å
125	L	47.9	Very low	58.2	Low	22 Å²	22	56.8 Å²	56.8	12%	0.115	29%	0.289	C	S	.	.			trans	-74.5	136.1	-151.3	-141.5	160.9	0	0	0	115.4	I149 I214 I230 L234	L125-I149 HydrophobicContact CD1-CB 3.9Å; L125-I149 HydrophobicContact CD1-CG2 4.38Å; L125-I149 WeakPolarHBondContact CD1-O 3.35Å; L125-I214 HydrophobicContact CD1-CG2 4.45Å; L125-I230 HydrophobicContact CB-CD1 4.33Å; L125-I230 HydrophobicContact CD1-CD1 4.24Å; L125-I230 HydrophobicContact CD1-CG2 3.72Å; L125-I230 HydrophobicContact CD2-CG2 4.33Å; L125-I230 HydrophobicContact CG-CB 4.44Å; L125-I230 HydrophobicContact CG-CD1 4.15Å; L125-I230 HydrophobicContact CG-CG2 3.64Å; L125-L234 HydrophobicContact CD2-CD1 3.96Å
126	F	38.2	Very low	58.4	Low	107 Å²	107	60.7 Å²	60.7	47%	0.469	31%	0.306	S	S	.	.			trans	-49.2	140.3	163.8	-94.6	-102.1	0	0	0	114.4	S128 D231 L234	F126-S128 VanDerWaalsContact C-N 3.33Å; F126-S128 PolarHBondContact O-N 3.29Å; F126-S128 PolarHBondContact O-OG 3.27Å; F126-D231 WeakPolarHBondContact CD2-OD1 3.5Å; F126-D231 WeakPolarHBondContact CE2-OD1 3.39Å; F126-L234 HydrophobicContact CB-CD1 3.99Å
127	S	37.3	Very low	58.5	Low	37 Å²	37	61.4 Å²	61.4	26%	0.259	31%	0.31	S	S	.	.	S	Bend	trans	38.7	40.4	138.9	-54.8	0	0	0	0	120.2	V249	S127-V249 WeakPolarHBondContact OG-CG2 3.44Å
128	S	47.6	Very low	58.3	Low	34 Å²	34	68 Å²	68	24%	0.238	34%	0.344	C	S	.	.			trans	-158.2	98.4	160.9	38.4	0	0	0	0	113	F126 Y130	F126-S128 VanDerWaalsContact C-N 3.33Å; F126-S128 PolarHBondContact O-N 3.29Å; F126-S128 PolarHBondContact O-OG 3.27Å; S128-Y130 WeakPolarHBondContact CB-OH 3.23Å; S128-Y130 PolarHBondContact O-N 3.35Å; S128-Y130 WeakPolarHBondContact OG-CE2 3.5Å; S128-Y130 PolarHBondContact OG-OH 3.18Å
129	H	55.4	Low	58.8	Low	60 Å²	60	64.7 Å²	64.7	28%	0.278	33%	0.332	S	S	.	.			trans	-71.8	108.6	157.6	-71.5	-49.9	0	0	0	107.9	S131 Y148	H129-S131 PolarHBondContact O-N 2.92Å; H129-Y148 AromaticContact ND1-CE1 3.89Å
130	Y	65.7	Low	59.5	Low	14 Å²	14	58.1 Å²	58.1	6%	0.055	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	83.4	168.2	-63	-68.5	0	0	0	108.6	S128 C132 R146 M147 I149 F205 R210 S211 I214	S128-Y130 WeakPolarHBondContact CB-OH 3.23Å; S128-Y130 PolarHBondContact O-N 3.35Å; S128-Y130 WeakPolarHBondContact OG-CE2 3.5Å; S128-Y130 PolarHBondContact OG-OH 3.18Å; Y130-C132 PolarHBondContact O-N 2.75Å; Y130-C132 PolarHBondContact O-SG 3.46Å; Y130-R146 WeakPolarHBondContact O-CA 3.47Å; Y130-M147 PolarHBondContact O-N 2.74Å; Y130-I149 HydrophobicContact CD2-CD1 4.15Å; Y130-I149 HydrophobicContact CE2-CD1 4.05Å; Y130-F205 HydrophobicContact CD1-CD1 4.34Å; Y130-R210 HydrophobicContact CE1-CG 4.42Å; Y130-R210 PolarHBondContact OH-NE 3.25Å; Y130-S211 WeakPolarHBondContact CD1-OG 3.41Å; Y130-S211 WeakPolarHBondContact CE1-OG 3.22Å; Y130-I214 WeakPolarHBondContact OH-CD1 3.44Å
131	S	74.8	Confident	60.1	Low	53 Å²	53	61.8 Å²	61.8	37%	0.371	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	115.7	160.9	-65.7	0	0	0	0	107.6	H129 G145 S204	H129-S131 PolarHBondContact O-N 2.92Å; S131-G145 WeakPolarHBondContact CA-O 3.49Å; S131-S204 VanDerWaalsContact O-O 3.13Å
132	C	86.4	Confident	61.5	Low	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	160.7	-179.4	64.1	0	0	0	0	109.2	Y130 Q144 G145 T203 F205	Y130-C132 PolarHBondContact O-N 2.75Å; Y130-C132 PolarHBondContact O-SG 3.46Å; C132-Q144 PolarHBondContact O-OE1 3.45Å; C132-G145 PolarHBondContact N-O 2.81Å; C132-G145 CarbonylContact O-C 3.42Å; C132-G145 PolarHBondContact O-N 3.03Å; C132-G145 VanDerWaalsContact O-O 3.13Å; C132-T203 CarbonylContact C-O 3.53Å; C132-T203 WeakPolarHBondContact CA-O 3.27Å; C132-T203 WeakPolarHBondContact CB-O 3.24Å; C132-F205 HydrophobicContact CB-CD1 3.92Å; C132-F205 HydrophobicContact CB-CD2 4.38Å; C132-F205 HydrophobicContact CB-CE1 3.85Å; C132-F205 HydrophobicContact CB-CE2 4.31Å; C132-F205 HydrophobicContact CB-CG 4.2Å; C132-F205 HydrophobicContact CB-CZ 4.05Å
133	A	86.6	Confident	63.3	Low	1 Å²	1	53.7 Å²	53.7	1%	0.008	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.7	173.3	0	0	0	0	0	111.3	L142 L143 Q144 F202 T203	A133-L142 HydrophobicContact CB-CB 3.82Å; A133-L142 HydrophobicContact CB-CD2 4.29Å; A133-L142 HydrophobicContact CB-CG 4.5Å; A133-L143 WeakPolarHBondContact CA-O 3.37Å; A133-Q144 HydrophobicContact CB-CB 4.15Å; A133-F202 CarbonylContact O-C 3.58Å; A133-F202 VanDerWaalsContact O-CA 3.3Å; A133-F202 WeakPolarHBondContact O-CA 3.31Å; A133-T203 PolarHBondContact N-O 2.73Å; A133-T203 PolarHBondContact O-N 2.88Å
134	L	86.9	Confident	65.1	Low	1 Å²	1	56.1 Å²	56.1	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.3	166.3	179.6	74.5	0	0	0	109.1	K136 L143 F156 I166 F200 F202	L134-K136 HydrophobicContact CD2-CB 4.3Å; L134-K136 HydrophobicContact CD2-CD 4.46Å; L134-K136 HydrophobicContact CG-CB 4.49Å; L134-K136 PolarHBondContact O-N 2.92Å; L134-L143 HydrophobicContact CB-CB 4.35Å; L134-L143 HydrophobicContact CD2-CD1 4.45Å; L134-L143 PolarHBondContact N-O 2.81Å; L134-L143 WeakPolarHBondContact O-CB 3.32Å; L134-L143 PolarHBondContact O-N 2.89Å; L134-F156 HydrophobicContact CB-CD1 4.4Å; L134-F156 HydrophobicContact CB-CE1 3.88Å; L134-F156 HydrophobicContact CB-CZ 4.15Å; L134-I166 HydrophobicContact CD2-CD1 3.42Å; L134-I166 VanDerWaalsContact CD2-CD1 3.42Å; L134-F200 HydrophobicContact CD1-CB 4.04Å; L134-F200 HydrophobicContact CD1-CD1 4.08Å; L134-F202 HydrophobicContact CB-CD1 4.35Å; L134-F202 HydrophobicContact CB-CE1 4.34Å; L134-F202 HydrophobicContact CD1-CD1 4.08Å; L134-F202 HydrophobicContact CD1-CE1 3.85Å; L134-F202 HydrophobicContact CD1-CZ 4.08Å
135	S	82.7	Confident	67.1	Low	40 Å²	40	55.8 Å²	55.8	28%	0.28	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	116.8	163.1	-170	0	0	0	0	108.7	F201	S135-F201 PolarHBondContact N-O 2.84Å
136	K	69.9	Low	68.9	Low	82 Å²	82	58.8 Å²	58.8	36%	0.357	32%	0.324	S	S	.	.			trans	-124.6	120.4	177.5	-171.6	163.4	-176.3	166.1	0	110.7	L134 L143	L134-K136 HydrophobicContact CD2-CB 4.3Å; L134-K136 HydrophobicContact CD2-CD 4.46Å; L134-K136 HydrophobicContact CG-CB 4.49Å; L134-K136 PolarHBondContact O-N 2.92Å; K136-L143 HydrophobicContact CB-CD1 4.06Å
137	N	60.4	Low	71.2	Confident	117 Å²	117	53.8 Å²	53.8	63%	0.626	30%	0.302	S	S	*	.	S	Bend	trans	66.7	162.9	-176.7	-53	-2.6	0	0	0	114.3	N139	N137-N139 PolarHBondContact O-N 2.92Å
138	N	55.9	Low	73.5	Confident	159 Å²	159	52.5 Å²	52.5	85%	0.85	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	5.5	-169.4	-60.2	-9.7	0	0	0	115.5
139	N	58.2	Low	75.2	Confident	106 Å²	106	51 Å²	51	57%	0.567	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	13.2	-162.1	-62.4	15.8	0	0	0	113.6	N137 L141 K773	N137-N139 PolarHBondContact O-N 2.92Å; N139-L141 VanDerWaalsContact C-N 3.27Å; N139-L141 PolarHBondContact O-N 2.87Å; N139-K773 PolarHBondContact O-NZ 2.92Å
140	G	62.6	Low	76.3	Confident	66 Å²	66	48.2 Å²	48.2	68%	0.68	27%	0.268	S	S	*	.			trans	74.1	2.6	175.8	0	0	0	0	0	116.2	L142	G140-L142 PolarHBondContact O-N 3.14Å
141	L	65.7	Low	77	Confident	88 Å²	88	50.4 Å²	50.4	46%	0.461	28%	0.279	S	S	.	.			trans	-81.6	108.4	-173.2	-174.8	62.4	0	0	0	111.9	N139 L161	N139-L141 VanDerWaalsContact C-N 3.27Å; N139-L141 PolarHBondContact O-N 2.87Å; L141-L161 HydrophobicContact CD1-CD1 4.29Å; L141-L161 HydrophobicContact CD2-CD1 4.14Å
142	L	75.1	Confident	77.3	Confident	75 Å²	75	51.3 Å²	51.3	39%	0.393	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	106.9	174.4	-69.6	178.7	0	0	0	110.7	A133 G140 Q144 T203	A133-L142 HydrophobicContact CB-CB 3.82Å; A133-L142 HydrophobicContact CB-CD2 4.29Å; A133-L142 HydrophobicContact CB-CG 4.5Å; G140-L142 PolarHBondContact O-N 3.14Å; L142-Q144 VanDerWaalsContact C-N 3.34Å; L142-Q144 PolarHBondContact O-N 3.02Å; L142-T203 HydrophobicContact CD2-CG2 4Å
143	L	82.5	Confident	77.3	Confident	23 Å²	23	53.6 Å²	53.6	12%	0.12	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	81.8	173.7	-67.9	167.9	0	0	0	109.6	A133 L134 K136 F156	A133-L143 WeakPolarHBondContact CA-O 3.37Å; L134-L143 HydrophobicContact CB-CB 4.35Å; L134-L143 HydrophobicContact CD2-CD1 4.45Å; L134-L143 PolarHBondContact N-O 2.81Å; L134-L143 WeakPolarHBondContact O-CB 3.32Å; L134-L143 PolarHBondContact O-N 2.89Å; K136-L143 HydrophobicContact CB-CD1 4.06Å; L143-F156 VanDerWaalsContact O-CZ 3.3Å; L143-F156 WeakPolarHBondContact O-CZ 3.41Å
144	Q	84	Confident	77.4	Confident	74 Å²	74	53.8 Å²	53.8	35%	0.346	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	136.1	176.3	176	73	-0.3	0	0	111	C132 A133 L142 S158 I160	C132-Q144 PolarHBondContact O-OE1 3.45Å; A133-Q144 HydrophobicContact CB-CB 4.15Å; L142-Q144 VanDerWaalsContact C-N 3.34Å; L142-Q144 PolarHBondContact O-N 3.02Å; Q144-S158 WeakPolarHBondContact O-CB 3.38Å; Q144-S158 PolarHBondContact O-OG 2.83Å; Q144-I160 HydrophobicContact CB-CD1 3.57Å; Q144-I160 HydrophobicContact CG-CD1 4.08Å; Q144-I160 WeakPolarHBondContact O-CD1 3.36Å
145	G	85.9	Confident	77.5	Confident	12 Å²	12	53.8 Å²	53.8	12%	0.124	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	-155.1	-170.9	0	0	0	0	0	112.9	S131 C132 Y157	S131-G145 WeakPolarHBondContact CA-O 3.49Å; C132-G145 PolarHBondContact N-O 2.81Å; C132-G145 CarbonylContact O-C 3.42Å; C132-G145 PolarHBondContact O-N 3.03Å; C132-G145 VanDerWaalsContact O-O 3.13Å; G145-Y157 CarbonylContact C-O 3.46Å; G145-Y157 WeakPolarHBondContact CA-O 3.28Å
146	R	85.3	Confident	77.8	Confident	86 Å²	86	52 Å²	52	33%	0.325	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	128.9	179.2	-62.9	179.8	-175	170	0.2	110.4	Y130 Y148 F156 Y157	Y130-R146 WeakPolarHBondContact O-CA 3.47Å; R146-Y148 HydrophobicContact CB-CE2 4.03Å; R146-F156 WeakPolarHBondContact O-CA 3.45Å; R146-F156 WeakPolarHBondContact O-CD2 3.4Å; R146-Y157 PolarHBondContact N-O 2.95Å; R146-Y157 PolarHBondContact O-N 3.38Å
147	M	87.6	Confident	78.6	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	142	165.9	-172.9	-165.4	-61.8	0	0	110.2	Y130 I149 V154 C155 F156 F202 F205 L215	Y130-M147 PolarHBondContact O-N 2.74Å; M147-I149 HydrophobicContact CG-CG1 4.35Å; M147-I149 HydrophobicContact SD-CD1 4.18Å; M147-I149 HydrophobicContact SD-CG1 4.09Å; M147-V154 HydrophobicContact CG-CG1 3.96Å; M147-V154 HydrophobicContact SD-CG1 3.82Å; M147-C155 CarbonylContact C-O 3.59Å; M147-C155 VanDerWaalsContact CA-O 3.29Å; M147-C155 WeakPolarHBondContact CA-O 3.47Å; M147-C155 WeakPolarHBondContact CG-O 3.4Å; M147-F156 HydrophobicContact CB-CD2 4.25Å; M147-F202 HydrophobicContact CE-CB 4.28Å; M147-F202 HydrophobicContact CE-CD1 3.87Å; M147-F202 HydrophobicContact CE-CD2 3.9Å; M147-F202 HydrophobicContact CE-CE1 4.13Å; M147-F202 HydrophobicContact CE-CE2 4.15Å; M147-F202 HydrophobicContact CE-CG 3.75Å; M147-F202 HydrophobicContact CE-CZ 4.26Å; M147-F205 HydrophobicContact CE-CE1 3.86Å; M147-F205 HydrophobicContact CE-CZ 3.81Å; M147-L215 HydrophobicContact CE-CD1 4.31Å; M147-L215 HydrophobicContact SD-CD1 4.03Å; M147-L215 HydrophobicContact SD-CD2 3.98Å; M147-L215 HydrophobicContact SD-CG 4.39Å
148	Y	84.5	Confident	79.7	Confident	11 Å²	11	43.9 Å²	43.9	4%	0.043	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.6	170.8	-53	-95.2	0	0	0	107.5	F106 F110 F124 H129 R146 C155	F106-Y148 HydrophobicContact CB-CD1 4.4Å; F106-Y148 HydrophobicContact CB-CE1 4.32Å; F106-Y148 AromaticContact CD2-CD1 3.79Å; F106-Y148 HydrophobicContact CD2-CD1 3.79Å; F106-Y148 HydrophobicContact CD2-CD2 4.09Å; F106-Y148 HydrophobicContact CD2-CE1 4.29Å; F106-Y148 AromaticContact CD2-CG 3.68Å; F106-Y148 HydrophobicContact CD2-CG 3.68Å; F106-Y148 HydrophobicContact CE2-CD2 4.5Å; F106-Y148 HydrophobicContact CE2-CG 4.13Å; F106-Y148 HydrophobicContact CG-CD1 4.49Å; F110-Y148 AromaticContact CE2-CD2 3.97Å; F110-Y148 HydrophobicContact CE2-CD2 3.97Å; F110-Y148 HydrophobicContact CE2-CE2 4.12Å; F124-Y148 HydrophobicContact CZ-CD1 4.03Å; H129-Y148 AromaticContact ND1-CE1 3.89Å; R146-Y148 HydrophobicContact CB-CE2 4.03Å; Y148-C155 PolarHBondContact N-O 3.38Å; Y148-C155 PolarHBondContact O-N 2.82Å; Y148-C155 VanDerWaalsContact O-O 3.1Å
149	I	82.9	Confident	80.9	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.015	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.2	-178.5	-56.1	167.5	0	0	0	107.2	L125 Y130 M147 I214 L215 V218	L125-I149 HydrophobicContact CD1-CB 3.9Å; L125-I149 HydrophobicContact CD1-CG2 4.38Å; L125-I149 WeakPolarHBondContact CD1-O 3.35Å; Y130-I149 HydrophobicContact CD2-CD1 4.15Å; Y130-I149 HydrophobicContact CE2-CD1 4.05Å; M147-I149 HydrophobicContact CG-CG1 4.35Å; M147-I149 HydrophobicContact SD-CD1 4.18Å; M147-I149 HydrophobicContact SD-CG1 4.09Å; I149-I214 HydrophobicContact CD1-CG2 4.01Å; I149-L215 HydrophobicContact CD1-CD2 3.61Å; I149-L215 HydrophobicContact CD1-CG 3.75Å; I149-L215 HydrophobicContact CG1-CD2 3.94Å; I149-V218 HydrophobicContact CG2-CG1 4.33Å; I149-V218 HydrophobicContact CG2-CG2 4.07Å
150	T	79.4	Confident	81.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.			trans	-126.4	177.4	167.2	75.5	0	0	0	0	108.9	L120 F124 T152 W153 V218	L120-T150 HydrophobicContact CD1-CG2 3.98Å; L120-T150 HydrophobicContact CD2-CG2 3.97Å; F124-T150 HydrophobicContact CD2-CG2 3.96Å; F124-T150 HydrophobicContact CE2-CG2 3.83Å; T150-T152 PolarHBondContact O-N 2.89Å; T150-T152 VanDerWaalsContact O-N 3.15Å; T150-T152 PolarHBondContact OG1-N 2.77Å; T150-W153 PolarHBondContact N-O 2.83Å; T150-W153 PolarHBondContact OG1-N 2.83Å; T150-W153 PolarHBondContact OG1-O 2.73Å; T150-V218 WeakPolarHBondContact O-CG1 3.43Å
151	E	78.9	Confident	81.6	Confident	61 Å²	61	45.5 Å²	45.5	29%	0.285	22%	0.222	S	C	.	.	S	Bend	trans	-58.9	-24.2	176.8	-64.2	158.1	161.4	0	0	113.3	S123 S229 I230	S123-E151 WeakPolarHBondContact CB-OE1 3.36Å; S123-E151 WeakPolarHBondContact CB-OE2 3.28Å; S123-E151 PolarHBondContact OG-OE2 3Å; E151-S229 WeakPolarHBondContact OE1-CA 3.39Å; E151-I230 HydrophobicContact CG-CD1 4.1Å; E151-I230 HydrophobicContact CG-CG1 3.55Å
152	T	81.7	Confident	81.8	Confident	72 Å²	72	50.5 Å²	50.5	44%	0.442	24%	0.237	S	C	.	.	S	Bend	trans	-125.4	-16.1	-170.5	47.3	0	0	0	0	114.5	T150 V170	T150-T152 PolarHBondContact O-N 2.89Å; T150-T152 VanDerWaalsContact O-N 3.15Å; T150-T152 PolarHBondContact OG1-N 2.77Å; T152-V170 VanDerWaalsContact C-CG2 3.42Å; T152-V170 WeakPolarHBondContact O-CG2 3.29Å; T152-V170 PolarHBondContact O-N 2.77Å
153	W	86.1	Confident	82	Confident	48 Å²	48	52 Å²	52	18%	0.182	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.9	-176.4	-63.6	93.9	0	0	0	113.3	P114 V115 T150 F167 L168 A169	P114-W153 HydrophobicContact CB-CH2 4.4Å; P114-W153 HydrophobicContact CB-CZ2 4.39Å; P114-W153 HydrophobicContact CG-CH2 4.08Å; P114-W153 HydrophobicContact CG-CZ2 4.47Å; P114-W153 WeakPolarHBondContact O-CZ2 3.04Å; V115-W153 HydrophobicContact CB-CG 4.48Å; V115-W153 HydrophobicContact CG1-CB 4.45Å; V115-W153 HydrophobicContact CG1-CG 4.12Å; V115-W153 HydrophobicContact CG2-CB 4.39Å; V115-W153 HydrophobicContact CG2-CD2 3.83Å; V115-W153 HydrophobicContact CG2-CE3 4.23Å; V115-W153 HydrophobicContact CG2-CG 3.9Å; T150-W153 PolarHBondContact N-O 2.83Å; T150-W153 PolarHBondContact OG1-N 2.83Å; T150-W153 PolarHBondContact OG1-O 2.73Å; W153-F167 HydrophobicContact CE3-CB 4.02Å; W153-F167 HydrophobicContact CE3-CD2 4.36Å; W153-F167 HydrophobicContact CH2-CD2 4.37Å; W153-F167 HydrophobicContact CZ3-CB 4.28Å; W153-F167 AromaticContact CZ3-CD2 3.77Å; W153-F167 HydrophobicContact CZ3-CD2 3.77Å; W153-L168 WeakPolarHBondContact CA-O 3.43Å; W153-A169 HydrophobicContact CE3-CB 3.94Å; W153-A169 HydrophobicContact CH2-CB 3.98Å; W153-A169 HydrophobicContact CZ3-CB 3.6Å
154	V	88.9	Confident	82	Confident	5 Å²	5	53 Å²	53	3%	0.03	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	108.9	163	-179.3	0	0	0	0	108.1	M147 L168 V170 I173 I191 L215	M147-V154 HydrophobicContact CG-CG1 3.96Å; M147-V154 HydrophobicContact SD-CG1 3.82Å; V154-L168 HydrophobicContact CB-CB 4.38Å; V154-L168 PolarHBondContact N-O 2.99Å; V154-L168 PolarHBondContact O-N 3.41Å; V154-V170 HydrophobicContact CG2-CG2 4.1Å; V154-I173 HydrophobicContact CG2-CD1 4.08Å; V154-I191 HydrophobicContact CG1-CD1 4.2Å; V154-L215 HydrophobicContact CB-CD2 4.45Å; V154-L215 HydrophobicContact CG1-CD2 3.88Å; V154-L215 HydrophobicContact CG2-CD2 3.63Å
155	C	88.8	Confident	82.1	Confident	1 Å²	1	53 Å²	53	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	146.8	-176.7	-58.4	0	0	0	0	111.2	F106 F110 M147 Y148 I166	F106-C155 HydrophobicContact CE2-CB 4.36Å; F110-C155 HydrophobicContact CE1-CB 3.9Å; F110-C155 HydrophobicContact CE2-CB 4.18Å; F110-C155 HydrophobicContact CZ-CB 3.68Å; M147-C155 CarbonylContact C-O 3.59Å; M147-C155 VanDerWaalsContact CA-O 3.29Å; M147-C155 WeakPolarHBondContact CA-O 3.47Å; M147-C155 WeakPolarHBondContact CG-O 3.4Å; Y148-C155 PolarHBondContact N-O 3.38Å; Y148-C155 PolarHBondContact O-N 2.82Å; Y148-C155 VanDerWaalsContact O-O 3.1Å; C155-I166 CarbonylContact C-O 3.54Å; C155-I166 VanDerWaalsContact CA-O 3.27Å; C155-I166 WeakPolarHBondContact CA-O 3.25Å
156	F	89	Confident	82.2	Confident	1 Å²	1	53.2 Å²	53.2	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141	174.9	177.3	-97	0	0	0	111.5	L134 L143 R146 M147 K165 I166 F202	L134-F156 HydrophobicContact CB-CD1 4.4Å; L134-F156 HydrophobicContact CB-CE1 3.88Å; L134-F156 HydrophobicContact CB-CZ 4.15Å; L143-F156 VanDerWaalsContact O-CZ 3.3Å; L143-F156 WeakPolarHBondContact O-CZ 3.41Å; R146-F156 WeakPolarHBondContact O-CA 3.45Å; R146-F156 WeakPolarHBondContact O-CD2 3.4Å; M147-F156 HydrophobicContact CB-CD2 4.25Å; F156-K165 WeakPolarHBondContact O-CA 3.39Å; F156-I166 HydrophobicContact CB-CB 4.31Å; F156-I166 PolarHBondContact N-O 3.19Å; F156-I166 PolarHBondContact O-N 2.8Å; F156-F202 HydrophobicContact CB-CE1 3.95Å; F156-F202 HydrophobicContact CB-CZ 4.41Å; F156-F202 HydrophobicContact CD1-CE1 4.38Å; F156-F202 HydrophobicContact CD2-CD1 4.19Å; F156-F202 AromaticContact CD2-CE1 3.77Å; F156-F202 HydrophobicContact CD2-CE1 3.77Å; F156-F202 HydrophobicContact CE2-CD1 4.47Å; F156-F202 HydrophobicContact CE2-CE1 4.4Å; F156-F202 AromaticContact CG-CE1 3.76Å; F156-F202 HydrophobicContact CG-CE1 3.76Å
157	Y	86.8	Confident	82.3	Confident	29 Å²	29	52.9 Å²	52.9	11%	0.114	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.5	-179.2	-179.1	-106	0	0	0	111.8	I109 G145 R146 K159 E163 Q164 K165	I109-Y157 HydrophobicContact CD1-CD1 3.77Å; I109-Y157 HydrophobicContact CD1-CD2 4.35Å; I109-Y157 HydrophobicContact CD1-CE1 3.9Å; I109-Y157 HydrophobicContact CD1-CE2 4.44Å; I109-Y157 HydrophobicContact CD1-CG 3.99Å; I109-Y157 HydrophobicContact CG1-CD2 4.42Å; I109-Y157 HydrophobicContact CG1-CE1 4.37Å; I109-Y157 HydrophobicContact CG1-CE2 4.22Å; I109-Y157 HydrophobicContact CG2-CD2 3.33Å; I109-Y157 HydrophobicContact CG2-CE2 3.64Å; I109-Y157 HydrophobicContact CG2-CG 3.85Å; G145-Y157 CarbonylContact C-O 3.46Å; G145-Y157 WeakPolarHBondContact CA-O 3.28Å; R146-Y157 PolarHBondContact N-O 2.95Å; R146-Y157 PolarHBondContact O-N 3.38Å; Y157-K159 HydrophobicContact CE1-CB 4.01Å; Y157-E163 HydrophobicContact CE2-CG 3.6Å; Y157-E163 WeakPolarHBondContact CE2-OE1 3.43Å; Y157-Q164 WeakPolarHBondContact CA-O 3.45Å; Y157-K165 HydrophobicContact CD2-CG 3.94Å; Y157-K165 HydrophobicContact CE2-CG 4.38Å
158	S	85	Confident	82.4	Confident	1 Å²	1	53 Å²	53	1%	0.007	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.8	166.7	-176.5	0	0	0	0	110.7	Q144 E163 Q164	Q144-S158 WeakPolarHBondContact O-CB 3.38Å; Q144-S158 PolarHBondContact O-OG 2.83Å; S158-E163 WeakPolarHBondContact O-CA 3.42Å; S158-Q164 PolarHBondContact N-O 3.39Å; S158-Q164 PolarHBondContact O-N 3.11Å
159	K	79.3	Confident	82.7	Confident	145 Å²	145	52.9 Å²	52.9	63%	0.63	25%	0.245	S	C	*	.			trans	-140.8	17.9	-177.6	-153	-158	176.1	-175.4	0	113.5	Y157	Y157-K159 HydrophobicContact CE1-CB 4.01Å
160	I	70.6	Confident	82.9	Confident	111 Å²	111	52.8 Å²	52.8	57%	0.569	25%	0.245	S	C	*	.	S	Bend	trans	-80.7	-34	-168.1	-64.8	179.6	0	0	0	112.9	Q144	Q144-I160 HydrophobicContact CB-CD1 3.57Å; Q144-I160 HydrophobicContact CG-CD1 4.08Å; Q144-I160 WeakPolarHBondContact O-CD1 3.36Å
161	L	65.7	Low	83.4	Confident	109 Å²	109	58.7 Å²	58.7	57%	0.571	28%	0.276	S	S	*	.	S	Bend	trans	-125.1	-45.8	175.7	-63.9	174.5	0	0	0	110.9	L141	L141-L161 HydrophobicContact CD1-CD1 4.29Å; L141-L161 HydrophobicContact CD2-CD1 4.14Å
162	Y	69.3	Low	83.9	Confident	193 Å²	193	58 Å²	58	76%	0.757	27%	0.273	S	S	*	.	S	Bend	trans	-134.7	154.9	173	-60.3	-79.6	0	0	0	108.8	Q164	Y162-Q164 PolarHBondContact O-N 2.8Å
163	E	79.9	Confident	84.4	Confident	105 Å²	105	55 Å²	55	49%	0.491	26%	0.255	S	S	.	.			trans	-75.9	102.1	172.7	-173.3	168.9	165.4	0	0	109.5	Y157 S158 K165	Y157-E163 HydrophobicContact CE2-CG 3.6Å; Y157-E163 WeakPolarHBondContact CE2-OE1 3.43Å; S158-E163 WeakPolarHBondContact O-CA 3.42Å; E163-K165 WeakPolarHBondContact OE1-CE 3.29Å; E163-K165 IonicContact OE1-NZ 3.42Å; E163-K165 PolarHBondContact OE1-NZ 3.43Å
164	Q	82.6	Confident	84.7	Confident	45 Å²	45	56 Å²	56	21%	0.21	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121	178.6	-172.1	171.6	-51.6	0	0	110.4	Y157 S158 Y162	Y157-Q164 WeakPolarHBondContact CA-O 3.45Å; S158-Q164 PolarHBondContact N-O 3.39Å; S158-Q164 PolarHBondContact O-N 3.11Å; Y162-Q164 PolarHBondContact O-N 2.8Å
165	K	85.8	Confident	84.8	Confident	73 Å²	73	57.2 Å²	57.2	32%	0.317	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.2	172.3	-67	170.8	-164.6	-178.8	0	109	I109 F110 F156 Y157 E163	I109-K165 HydrophobicContact CG2-CD 4.33Å; I109-K165 HydrophobicContact CG2-CG 4.43Å; I109-K165 WeakPolarHBondContact O-CE 3.3Å; I109-K165 PolarHBondContact O-NZ 2.65Å; F110-K165 HydrophobicContact CE1-CB 4.32Å; F110-K165 HydrophobicContact CE1-CG 4.4Å; F156-K165 WeakPolarHBondContact O-CA 3.39Å; Y157-K165 HydrophobicContact CD2-CG 3.94Å; Y157-K165 HydrophobicContact CE2-CG 4.38Å; E163-K165 WeakPolarHBondContact OE1-CE 3.29Å; E163-K165 IonicContact OE1-NZ 3.42Å; E163-K165 PolarHBondContact OE1-NZ 3.43Å
166	I	87.6	Confident	85	Confident	18 Å²	18	57.6 Å²	57.6	9%	0.092	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	142.7	167.4	-63	174.9	0	0	0	107.2	L134 C155 F156 L168 F200	L134-I166 HydrophobicContact CD2-CD1 3.42Å; L134-I166 VanDerWaalsContact CD2-CD1 3.42Å; C155-I166 CarbonylContact C-O 3.54Å; C155-I166 VanDerWaalsContact CA-O 3.27Å; C155-I166 WeakPolarHBondContact CA-O 3.25Å; F156-I166 HydrophobicContact CB-CB 4.31Å; F156-I166 PolarHBondContact N-O 3.19Å; F156-I166 PolarHBondContact O-N 2.8Å; I166-L168 HydrophobicContact CG2-CD2 3.6Å; I166-L168 HydrophobicContact CG2-CG 3.85Å; I166-F200 HydrophobicContact CD1-CD1 4Å; I166-F200 HydrophobicContact CD1-CE1 3.88Å; I166-F200 HydrophobicContact CG2-CE1 4.36Å
167	F	88	Confident	85.2	Confident	79 Å²	79	59.9 Å²	59.9	35%	0.346	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	114.2	171.5	44.6	-88.2	0	0	0	106.9	T113 P114 V115 W153	T113-F167 HydrophobicContact CG2-CD1 4.35Å; T113-F167 HydrophobicContact CG2-CE1 4.26Å; P114-F167 HydrophobicContact CG-CD2 3.89Å; P114-F167 HydrophobicContact CG-CE2 3.54Å; P114-F167 HydrophobicContact CG-CZ 4.2Å; V115-F167 HydrophobicContact CG2-CB 4.01Å; W153-F167 HydrophobicContact CE3-CB 4.02Å; W153-F167 HydrophobicContact CE3-CD2 4.36Å; W153-F167 HydrophobicContact CH2-CD2 4.37Å; W153-F167 HydrophobicContact CZ3-CB 4.28Å; W153-F167 AromaticContact CZ3-CD2 3.77Å; W153-F167 HydrophobicContact CZ3-CD2 3.77Å
168	L	89.8	Confident	85.5	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	121.1	178.1	-54.7	-177.3	0	0	0	107.3	W153 V154 I166 V170 I191 Y193 F200	W153-L168 WeakPolarHBondContact CA-O 3.43Å; V154-L168 HydrophobicContact CB-CB 4.38Å; V154-L168 PolarHBondContact N-O 2.99Å; V154-L168 PolarHBondContact O-N 3.41Å; I166-L168 HydrophobicContact CG2-CD2 3.6Å; I166-L168 HydrophobicContact CG2-CG 3.85Å; L168-V170 PolarHBondContact O-N 2.89Å; L168-I191 HydrophobicContact CD1-CB 4.46Å; L168-I191 HydrophobicContact CD1-CD1 4.48Å; L168-I191 HydrophobicContact CD1-CG2 4.04Å; L168-Y193 HydrophobicContact CB-CD2 3.92Å; L168-Y193 HydrophobicContact CB-CE2 3.56Å; L168-Y193 HydrophobicContact CD1-CD2 4.39Å; L168-Y193 HydrophobicContact CD2-CD1 4.44Å; L168-Y193 HydrophobicContact CD2-CD2 3.82Å; L168-Y193 HydrophobicContact CD2-CE2 3.87Å; L168-Y193 HydrophobicContact CD2-CG 4.1Å; L168-Y193 HydrophobicContact CG-CD2 4.24Å; L168-Y193 HydrophobicContact CG-CE2 4.24Å; L168-F200 HydrophobicContact CD1-CD2 3.75Å; L168-F200 HydrophobicContact CD1-CE2 4.21Å; L168-F200 HydrophobicContact CD1-CG 4.16Å; L168-F200 HydrophobicContact CD2-CD2 3.95Å; L168-F200 HydrophobicContact CD2-CE2 3.51Å; L168-F200 HydrophobicContact CD2-CZ 3.85Å
169	A	89.7	Confident	85.7	Confident	7 Å²	7	65.4 Å²	65.4	6%	0.058	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	130.8	174.5	0	0	0	0	0	108.7	W153 N171 E172 I173 Y193	W153-A169 HydrophobicContact CE3-CB 3.94Å; W153-A169 HydrophobicContact CH2-CB 3.98Å; W153-A169 HydrophobicContact CZ3-CB 3.6Å; A169-N171 WeakPolarHBondContact CB-OD1 3.42Å; A169-N171 PolarHBondContact O-N 2.88Å; A169-E172 HydrophobicContact CB-CB 4.32Å; A169-E172 HydrophobicContact CB-CG 4.37Å; A169-E172 PolarHBondContact O-N 3.29Å; A169-I173 PolarHBondContact O-N 2.83Å; A169-Y193 PolarHBondContact N-OH 2.9Å; A169-Y193 VanDerWaalsContact N-OH 3.14Å
170	V	88.6	Confident	85.9	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.006	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-63.2	-31.9	-172.3	173	0	0	0	0	111.7	T152 V154 L168 E172 I173 V218 W219 C222	T152-V170 VanDerWaalsContact C-CG2 3.42Å; T152-V170 WeakPolarHBondContact O-CG2 3.29Å; T152-V170 PolarHBondContact O-N 2.77Å; V154-V170 HydrophobicContact CG2-CG2 4.1Å; L168-V170 PolarHBondContact O-N 2.89Å; V170-E172 VanDerWaalsContact C-N 3.32Å; V170-E172 PolarHBondContact O-N 3.11Å; V170-I173 WeakPolarHBondContact O-CB 3.25Å; V170-I173 PolarHBondContact O-N 3.47Å; V170-V218 HydrophobicContact CG1-CG1 4.08Å; V170-V218 HydrophobicContact CG2-CG1 3.94Å; V170-W219 HydrophobicContact CG1-CB 4.27Å; V170-C222 HydrophobicContact CB-CB 4.35Å; V170-C222 HydrophobicContact CG1-CB 3.5Å; V170-C222 VanDerWaalsContact CG1-CB 3.5Å
171	N	88.6	Confident	86.2	Confident	124 Å²	124	61.8 Å²	61.8	66%	0.663	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-69.7	-21.3	173	63.8	-18.3	0	0	0	114.3	A169	A169-N171 WeakPolarHBondContact CB-OD1 3.42Å; A169-N171 PolarHBondContact O-N 2.88Å
172	E	90.6	Very high	86.3	Confident	48 Å²	48	59.3 Å²	59.3	22%	0.224	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-89.4	1.7	173.5	-72.8	-172.8	-175	0	0	112.2	A169 V170 Y193 S194 K195	A169-E172 HydrophobicContact CB-CB 4.32Å; A169-E172 HydrophobicContact CB-CG 4.37Å; A169-E172 PolarHBondContact O-N 3.29Å; V170-E172 VanDerWaalsContact C-N 3.32Å; V170-E172 PolarHBondContact O-N 3.11Å; E172-Y193 HydrophobicContact CB-CD2 4.21Å; E172-Y193 HydrophobicContact CB-CE1 4.12Å; E172-Y193 HydrophobicContact CB-CE2 3.48Å; E172-Y193 VanDerWaalsContact CB-CE2 3.48Å; E172-Y193 VanDerWaalsContact CB-CZ 3.43Å; E172-Y193 WeakPolarHBondContact CB-OH 3.49Å; E172-Y193 WeakPolarHBondContact OE2-CE1 3.43Å; E172-Y193 PolarHBondContact OE2-OH 2.97Å; E172-S194 WeakPolarHBondContact CB-OG 3.46Å; E172-S194 WeakPolarHBondContact O-CB 3.34Å; E172-S194 PolarHBondContact O-N 3.42Å; E172-S194 PolarHBondContact O-OG 3.03Å; E172-S194 VanDerWaalsContact O-OG 3.13Å; E172-K195 IonicContact OE1-NZ 3.04Å; E172-K195 PolarHBondContact OE1-NZ 3.03Å; E172-K195 IonicContact OE2-NZ 2.62Å; E172-K195 PolarHBondContact OE2-NZ 2.84Å; E172-K195 VanDerWaalsContact OE2-NZ 3.16Å
173	I	92.2	Very high	85.9	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.046	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	126	174.1	-61.8	175.4	0	0	0	110.7	V154 A169 V170 I176 I191 Y193 W219	V154-I173 HydrophobicContact CG2-CD1 4.08Å; A169-I173 PolarHBondContact O-N 2.83Å; V170-I173 WeakPolarHBondContact O-CB 3.25Å; V170-I173 PolarHBondContact O-N 3.47Å; I173-I176 HydrophobicContact CG2-CD1 4.1Å; I173-I176 HydrophobicContact CG2-CG1 3.68Å; I173-I191 HydrophobicContact CB-CG2 4.45Å; I173-I191 HydrophobicContact CD1-CG2 3.97Å; I173-I191 HydrophobicContact CG1-CG2 3.91Å; I173-I191 HydrophobicContact CG2-CG2 3.79Å; I173-Y193 HydrophobicContact CG1-CD2 4.34Å; I173-W219 HydrophobicContact CG2-CD2 4.49Å; I173-W219 HydrophobicContact CG2-CG 4.34Å; I173-W219 PolarHBondContact O-NE1 3.36Å
174	V	91.6	Very high	84.9	Confident	69 Å²	69	61.3 Å²	61.3	42%	0.418	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-36.8	-179.8	-177.6	0	0	0	0	112.1	L192 W219	V174-L192 HydrophobicContact CB-CB 4.42Å; V174-L192 HydrophobicContact CB-CD2 4.01Å; V174-L192 HydrophobicContact CB-CG 4.06Å; V174-L192 HydrophobicContact CG1-CD2 3.92Å; V174-L192 PolarHBondContact N-O 3.23Å; V174-W219 VanDerWaalsContact O-CZ2 3.24Å; V174-W219 WeakPolarHBondContact O-CZ2 3.46Å
175	A	92	Very high	84.5	Confident	30 Å²	30	63.7 Å²	63.7	25%	0.248	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	153.1	179.4	0	0	0	0	0	111.9	L192	A175-L192 HydrophobicContact CB-CB 4.2Å; A175-L192 HydrophobicContact CB-CD2 4.44Å; A175-L192 PolarHBondContact O-N 3.13Å
176	I	93.2	Very high	84.3	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.041	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	114.1	174.2	-52.9	178.6	0	0	0	108	I173 I189 Q190 I191 Y212 L215 W219	I173-I176 HydrophobicContact CG2-CD1 4.1Å; I173-I176 HydrophobicContact CG2-CG1 3.68Å; I176-I189 HydrophobicContact CG2-CG2 3.73Å; I176-Q190 WeakPolarHBondContact CA-O 3.36Å; I176-I191 HydrophobicContact CG2-CG1 4.5Å; I176-Y212 HydrophobicContact CG2-CD2 4.06Å; I176-Y212 HydrophobicContact CG2-CE2 3.93Å; I176-Y212 WeakPolarHBondContact O-CE2 3.46Å; I176-Y212 PolarHBondContact O-OH 2.89Å; I176-L215 HydrophobicContact CD1-CB 4.21Å; I176-L215 HydrophobicContact CG2-CB 4.47Å; I176-W219 HydrophobicContact CD1-CB 3.75Å; I176-W219 HydrophobicContact CD1-CD2 4.11Å; I176-W219 HydrophobicContact CD1-CE3 4.19Å; I176-W219 HydrophobicContact CD1-CG 3.95Å; I176-W219 HydrophobicContact CG1-CD2 4.36Å; I176-W219 HydrophobicContact CG1-CE3 4.31Å
177	T	92.4	Very high	84.2	Confident	50 Å²	50	64.5 Å²	64.5	31%	0.307	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.9	-175.2	59.6	0	0	0	0	112.9	E179 I189 Q190	T177-E179 VanDerWaalsContact CB-OE1 3.28Å; T177-E179 WeakPolarHBondContact CB-OE1 3.48Å; T177-E179 PolarHBondContact OG1-OE1 3.39Å; T177-I189 WeakPolarHBondContact O-CA 3.25Å; T177-Q190 PolarHBondContact N-O 3.48Å; T177-Q190 PolarHBondContact O-N 3.36Å; T177-Q190 VanDerWaalsContact O-N 3.09Å; T177-Q190 PolarHBondContact OG1-NE2 3.43Å
178	K	92.1	Very high	84.3	Confident	90 Å²	90	60.7 Å²	60.7	39%	0.391	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	106.5	175.5	-74.3	-167.2	-179.9	-170.7	0	109.9	E209 Y212	K178-E209 IonicContact NZ-OE1 2.78Å; K178-Y212 HydrophobicContact CD-CD1 4.21Å; K178-Y212 HydrophobicContact CD-CD2 4.46Å; K178-Y212 HydrophobicContact CD-CE1 4.36Å; K178-Y212 HydrophobicContact CD-CG 4.26Å; K178-Y212 HydrophobicContact CG-CD1 4.02Å; K178-Y212 HydrophobicContact CG-CD2 3.45Å; K178-Y212 VanDerWaalsContact CG-CD2 3.45Å; K178-Y212 HydrophobicContact CG-CE1 4.11Å; K178-Y212 HydrophobicContact CG-CE2 3.56Å; K178-Y212 HydrophobicContact CG-CG 3.69Å
179	E	89.3	Confident	84.4	Confident	55 Å²	55	60.5 Å²	60.5	26%	0.257	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	175.3	-174.6	-62.3	-55.7	153.8	0	0	113.4	T177 A188 Q190 F201 R208	T177-E179 VanDerWaalsContact CB-OE1 3.28Å; T177-E179 WeakPolarHBondContact CB-OE1 3.48Å; T177-E179 PolarHBondContact OG1-OE1 3.39Å; E179-A188 CarbonylContact C-O 3.52Å; E179-A188 WeakPolarHBondContact CA-O 3.5Å; E179-A188 HydrophobicContact CB-CB 3.69Å; E179-A188 PolarHBondContact N-O 3.24Å; E179-A188 PolarHBondContact O-N 3.22Å; E179-A188 VanDerWaalsContact O-O 3.1Å; E179-Q190 HydrophobicContact CG-CB 3.55Å; E179-Q190 PolarHBondContact OE1-NE2 3.45Å; E179-F201 HydrophobicContact CB-CD2 4.44Å; E179-F201 HydrophobicContact CB-CE2 3.64Å; E179-F201 HydrophobicContact CB-CZ 4.16Å; E179-F201 HydrophobicContact CG-CD2 4.25Å; E179-F201 HydrophobicContact CG-CE2 3.8Å; E179-R208 PolarHBondContact O-NH1 3.49Å
180	K	85	Confident	84.5	Confident	122 Å²	122	62.1 Å²	62.1	53%	0.53	33%	0.327	S	S	.	.			trans	-126.5	135.2	172.7	-48.9	-179.1	-179.5	174	0	109.9	A182 I185 P186	K180-A182 VanDerWaalsContact C-N 3.27Å; K180-A182 VanDerWaalsContact CB-O 3.26Å; K180-A182 WeakPolarHBondContact CB-O 3.35Å; K180-A182 PolarHBondContact O-N 2.81Å; K180-I185 CarbonylContact C-O 3.51Å; K180-I185 VanDerWaalsContact CA-O 3.25Å; K180-I185 WeakPolarHBondContact CA-O 3.19Å; K180-I185 WeakPolarHBondContact CB-O 3.19Å; K180-P186 HydrophobicContact CG-CB 4.42Å
181	T	75.8	Confident	84.7	Confident	59 Å²	59	62.1 Å²	62.1	36%	0.362	33%	0.327	S	S	.	.	S	Bend	trans	-72	-25.1	178.7	-38.3	0	0	0	0	112.3	I185 N187 T203	T181-I185 PolarHBondContact N-O 3.24Å; T181-N187 PolarHBondContact OG1-O 3.02Å; T181-T203 HydrophobicContact CG2-CG2 4.03Å
182	A	67.9	Low	84.9	Confident	57 Å²	57	58.2 Å²	58.2	47%	0.471	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-152.1	171.8	171.6	0	0	0	0	0	108.3	K180 V184 I185	K180-A182 VanDerWaalsContact C-N 3.27Å; K180-A182 VanDerWaalsContact CB-O 3.26Å; K180-A182 WeakPolarHBondContact CB-O 3.35Å; K180-A182 PolarHBondContact O-N 2.81Å; A182-V184 PolarHBondContact O-N 3.48Å; A182-I185 PolarHBondContact O-N 3.09Å
183	R	60.5	Low	84.9	Confident	210 Å²	210	56.9 Å²	56.9	79%	0.792	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46	-34.5	-177.3	-79.6	-175.2	170.9	-177.5	-4.2	114.6
184	V	59.8	Low	84.7	Confident	129 Å²	129	58.7 Å²	58.7	78%	0.782	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-24	-171.8	-172.2	0	0	0	0	114.3	A182 P186	A182-V184 PolarHBondContact O-N 3.48Å; V184-P186 WeakPolarHBondContact O-CD 3.31Å
185	I	75.2	Confident	83.9	Confident	96 Å²	96	61.9 Å²	61.9	49%	0.492	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-105.4	101.5	-168.3	-57.3	178.7	0	0	0	110.8	K180 T181 A182 N187	K180-I185 CarbonylContact C-O 3.51Å; K180-I185 VanDerWaalsContact CA-O 3.25Å; K180-I185 WeakPolarHBondContact CA-O 3.19Å; K180-I185 WeakPolarHBondContact CB-O 3.19Å; T181-I185 PolarHBondContact N-O 3.24Å; A182-I185 PolarHBondContact O-N 3.09Å; I185-N187 HydrophobicContact CG2-CB 3.72Å; I185-N187 PolarHBondContact O-N 3.05Å
186	P	80.7	Confident	83.1	Confident	66 Å²	66	65.8 Å²	65.8	43%	0.429	34%	0.338	S	S	.	.			trans	-81.2	59.1	-178.8	37.2	-38.4	0	0	0	111.3	K180 V184 R208	K180-P186 HydrophobicContact CG-CB 4.42Å; V184-P186 WeakPolarHBondContact O-CD 3.31Å; P186-R208 WeakPolarHBondContact O-CD 3.4Å; P186-R208 PolarHBondContact O-NE 3.12Å
187	N	85.5	Confident	82.5	Confident	41 Å²	41	72.4 Å²	72.4	22%	0.219	37%	0.368	C	S	.	.			trans	-126.6	47.6	-173.6	-162.4	0.7	0	0	0	113.1	T181 I185 T203 S204 F205	T181-N187 PolarHBondContact OG1-O 3.02Å; I185-N187 HydrophobicContact CG2-CB 3.72Å; I185-N187 PolarHBondContact O-N 3.05Å; N187-T203 CarbonylContact O-C 3.59Å; N187-T203 VanDerWaalsContact O-CA 3.3Å; N187-T203 WeakPolarHBondContact O-CA 3.34Å; N187-S204 PolarHBondContact O-N 3.18Å; N187-F205 VanDerWaalsContact CG-O 3.29Å; N187-F205 PolarHBondContact ND2-O 3.37Å; N187-F205 WeakPolarHBondContact OD1-CA 3.27Å; N187-F205 WeakPolarHBondContact OD1-CB 3.33Å; N187-F205 PolarHBondContact OD1-N 3.32Å; N187-F205 PolarHBondContact OD1-O 2.86Å
188	A	89.5	Confident	82.2	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	153.9	173.7	0	0	0	0	0	112.6	E179 F201 F202 T203 R208	E179-A188 CarbonylContact C-O 3.52Å; E179-A188 WeakPolarHBondContact CA-O 3.5Å; E179-A188 HydrophobicContact CB-CB 3.69Å; E179-A188 PolarHBondContact N-O 3.24Å; E179-A188 PolarHBondContact O-N 3.22Å; E179-A188 VanDerWaalsContact O-O 3.1Å; A188-F201 HydrophobicContact CB-CE1 3.89Å; A188-F201 HydrophobicContact CB-CE2 4.25Å; A188-F201 HydrophobicContact CB-CZ 3.68Å; A188-F202 CarbonylContact C-O 3.57Å; A188-F202 WeakPolarHBondContact CA-O 3.1Å; A188-F202 VanDerWaalsContact CB-O 3.25Å; A188-F202 WeakPolarHBondContact CB-O 3.49Å; A188-T203 HydrophobicContact CB-CG2 4.26Å; A188-R208 WeakPolarHBondContact O-CD 3.4Å
189	I	92.1	Very high	82	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.1	173.3	-58.6	177.8	0	0	0	106.9	I176 T177 F202 F205 R208 Y212 L215	I176-I189 HydrophobicContact CG2-CG2 3.73Å; T177-I189 WeakPolarHBondContact O-CA 3.25Å; I189-F202 PolarHBondContact N-O 2.9Å; I189-F202 PolarHBondContact O-N 2.85Å; I189-F205 HydrophobicContact CB-CE2 3.88Å; I189-F205 HydrophobicContact CB-CZ 4.06Å; I189-F205 HydrophobicContact CD1-CD2 4.42Å; I189-F205 HydrophobicContact CD1-CE1 4.24Å; I189-F205 HydrophobicContact CD1-CE2 3.92Å; I189-F205 HydrophobicContact CD1-CZ 3.82Å; I189-F205 HydrophobicContact CG1-CD2 4.31Å; I189-F205 HydrophobicContact CG1-CE2 3.72Å; I189-F205 HydrophobicContact CG1-CZ 4.04Å; I189-R208 HydrophobicContact CD1-CG 4.07Å; I189-R208 HydrophobicContact CG1-CG 3.7Å; I189-Y212 HydrophobicContact CG2-CD2 4.39Å; I189-L215 HydrophobicContact CD1-CD1 4.07Å; I189-L215 HydrophobicContact CG2-CD1 4.2Å
190	Q	92.1	Very high	82	Confident	41 Å²	41	75.1 Å²	75.1	19%	0.192	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.3	174.6	173.9	-179.5	-113.3	0	0	110	I176 T177 E179 R199 F200 F201	I176-Q190 WeakPolarHBondContact CA-O 3.36Å; T177-Q190 PolarHBondContact N-O 3.48Å; T177-Q190 PolarHBondContact O-N 3.36Å; T177-Q190 VanDerWaalsContact O-N 3.09Å; T177-Q190 PolarHBondContact OG1-NE2 3.43Å; E179-Q190 HydrophobicContact CG-CB 3.55Å; E179-Q190 PolarHBondContact OE1-NE2 3.45Å; Q190-R199 HydrophobicContact CG-CB 4.46Å; Q190-F200 WeakPolarHBondContact CA-O 3.21Å; Q190-F201 HydrophobicContact CB-CD2 4.12Å
191	I	93	Very high	82.2	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.7	174.4	-55.8	-176.1	0	0	0	107.9	V154 L168 I173 I176 F200 F202 L215	V154-I191 HydrophobicContact CG1-CD1 4.2Å; L168-I191 HydrophobicContact CD1-CB 4.46Å; L168-I191 HydrophobicContact CD1-CD1 4.48Å; L168-I191 HydrophobicContact CD1-CG2 4.04Å; I173-I191 HydrophobicContact CB-CG2 4.45Å; I173-I191 HydrophobicContact CD1-CG2 3.97Å; I173-I191 HydrophobicContact CG1-CG2 3.91Å; I173-I191 HydrophobicContact CG2-CG2 3.79Å; I176-I191 HydrophobicContact CG2-CG1 4.5Å; I191-F200 PolarHBondContact N-O 3.3Å; I191-F200 PolarHBondContact O-N 3.31Å; I191-F202 HydrophobicContact CD1-CD2 4.29Å; I191-F202 HydrophobicContact CD1-CE2 3.9Å; I191-F202 HydrophobicContact CG1-CD2 4.35Å; I191-F202 HydrophobicContact CG1-CE2 4.21Å; I191-L215 HydrophobicContact CD1-CD1 4.42Å; I191-L215 HydrophobicContact CD1-CD2 4.35Å
192	L	92.1	Very high	82.9	Confident	42 Å²	42	68.9 Å²	68.9	22%	0.22	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.6	174	179.7	66.5	0	0	0	109.2	V174 A175 R199	V174-L192 HydrophobicContact CB-CB 4.42Å; V174-L192 HydrophobicContact CB-CD2 4.01Å; V174-L192 HydrophobicContact CB-CG 4.06Å; V174-L192 HydrophobicContact CG1-CD2 3.92Å; V174-L192 PolarHBondContact N-O 3.23Å; A175-L192 HydrophobicContact CB-CB 4.2Å; A175-L192 HydrophobicContact CB-CD2 4.44Å; A175-L192 PolarHBondContact O-N 3.13Å; L192-R199 HydrophobicContact CD1-CG 3.78Å
193	Y	91.8	Very high	83.9	Confident	20 Å²	20	66.2 Å²	66.2	8%	0.078	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.8	-173.5	-160.2	-109.2	0	0	0	111.8	L168 A169 E172 I173 K195 H197 E198 F200	L168-Y193 HydrophobicContact CB-CD2 3.92Å; L168-Y193 HydrophobicContact CB-CE2 3.56Å; L168-Y193 HydrophobicContact CD1-CD2 4.39Å; L168-Y193 HydrophobicContact CD2-CD1 4.44Å; L168-Y193 HydrophobicContact CD2-CD2 3.82Å; L168-Y193 HydrophobicContact CD2-CE2 3.87Å; L168-Y193 HydrophobicContact CD2-CG 4.1Å; L168-Y193 HydrophobicContact CG-CD2 4.24Å; L168-Y193 HydrophobicContact CG-CE2 4.24Å; A169-Y193 PolarHBondContact N-OH 2.9Å; A169-Y193 VanDerWaalsContact N-OH 3.14Å; E172-Y193 HydrophobicContact CB-CD2 4.21Å; E172-Y193 HydrophobicContact CB-CE1 4.12Å; E172-Y193 HydrophobicContact CB-CE2 3.48Å; E172-Y193 VanDerWaalsContact CB-CE2 3.48Å; E172-Y193 VanDerWaalsContact CB-CZ 3.43Å; E172-Y193 WeakPolarHBondContact CB-OH 3.49Å; E172-Y193 WeakPolarHBondContact OE2-CE1 3.43Å; E172-Y193 PolarHBondContact OE2-OH 2.97Å; I173-Y193 HydrophobicContact CG1-CD2 4.34Å; Y193-K195 HydrophobicContact CD1-CB 3.97Å; Y193-K195 HydrophobicContact CE1-CB 3.8Å; Y193-H197 CarbonylContact O-C 3.59Å; Y193-H197 WeakPolarHBondContact O-CA 3.36Å; Y193-H197 PolarHBondContact O-N 2.79Å; Y193-H197 VanDerWaalsContact O-N 3.16Å; Y193-E198 PolarHBondContact N-O 2.81Å; Y193-E198 PolarHBondContact O-N 3.06Å; Y193-F200 HydrophobicContact CG-CE2 4.21Å
194	S	86.7	Confident	85.1	Confident	48 Å²	48	58.6 Å²	58.6	34%	0.336	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-64.2	-48.4	-168.2	64.1	0	0	0	0	112.8	E172 N196 H197	E172-S194 WeakPolarHBondContact CB-OG 3.46Å; E172-S194 WeakPolarHBondContact O-CB 3.34Å; E172-S194 PolarHBondContact O-N 3.42Å; E172-S194 PolarHBondContact O-OG 3.03Å; E172-S194 VanDerWaalsContact O-OG 3.13Å; S194-N196 PolarHBondContact O-N 2.97Å; S194-H197 PolarHBondContact O-N 2.69Å
195	K	75.5	Confident	86.4	Confident	136 Å²	136	52.6 Å²	52.6	59%	0.591	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-53	-32.9	-165.6	-157.5	178.9	-141.9	108.7	0	115.3	E172 Y193	E172-K195 IonicContact OE1-NZ 3.04Å; E172-K195 PolarHBondContact OE1-NZ 3.03Å; E172-K195 IonicContact OE2-NZ 2.62Å; E172-K195 PolarHBondContact OE2-NZ 2.84Å; E172-K195 VanDerWaalsContact OE2-NZ 3.16Å; Y193-K195 HydrophobicContact CD1-CB 3.97Å; Y193-K195 HydrophobicContact CE1-CB 3.8Å
196	N	75.8	Confident	86.5	Confident	112 Å²	112	53.2 Å²	53.2	60%	0.599	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-130.2	2.8	-177.4	-65.6	-18.1	0	0	0	113	S194 E198	S194-N196 PolarHBondContact O-N 2.97Å; N196-E198 HydrophobicContact CB-CB 3.98Å; N196-E198 PolarHBondContact ND2-OE2 3.18Å; N196-E198 PolarHBondContact O-N 2.91Å; N196-E198 VanDerWaalsContact O-N 3.16Å
197	H	80.3	Confident	86.4	Confident	146 Å²	146	52.5 Å²	52.5	68%	0.676	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	25.1	-158.8	-66	-79	0	0	0	114.5	Y193 S194	Y193-H197 CarbonylContact O-C 3.59Å; Y193-H197 WeakPolarHBondContact O-CA 3.36Å; Y193-H197 PolarHBondContact O-N 2.79Å; Y193-H197 VanDerWaalsContact O-N 3.16Å; S194-H197 PolarHBondContact O-N 2.69Å
198	E	85.2	Confident	86.5	Confident	68 Å²	68	52 Å²	52	32%	0.318	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	139	-176.4	-169.4	171	176.8	0	0	111	Y193 N196 F200	Y193-E198 PolarHBondContact N-O 2.81Å; Y193-E198 PolarHBondContact O-N 3.06Å; N196-E198 HydrophobicContact CB-CB 3.98Å; N196-E198 PolarHBondContact ND2-OE2 3.18Å; N196-E198 PolarHBondContact O-N 2.91Å; N196-E198 VanDerWaalsContact O-N 3.16Å; E198-F200 HydrophobicContact CB-CE2 3.98Å; E198-F200 HydrophobicContact CB-CZ 4.17Å; E198-F200 HydrophobicContact CG-CE1 4.15Å; E198-F200 HydrophobicContact CG-CE2 3.84Å; E198-F200 HydrophobicContact CG-CZ 3.62Å; E198-F200 WeakPolarHBondContact OE1-CE1 3.32Å; E198-F200 WeakPolarHBondContact OE1-CZ 3.37Å
199	R	87.3	Confident	86.2	Confident	173 Å²	173	55.9 Å²	55.9	65%	0.653	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	111.1	-177.9	-63.9	-177.7	-171.2	-171.9	2.1	110	Q190 L192	Q190-R199 HydrophobicContact CG-CB 4.46Å; L192-R199 HydrophobicContact CD1-CG 3.78Å
200	F	89.8	Confident	85.5	Confident	12 Å²	12	58.1 Å²	58.1	5%	0.053	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	103.3	177	-62	-81.9	0	0	0	109.7	L134 I166 L168 Q190 I191 Y193 E198 F202	L134-F200 HydrophobicContact CD1-CB 4.04Å; L134-F200 HydrophobicContact CD1-CD1 4.08Å; I166-F200 HydrophobicContact CD1-CD1 4Å; I166-F200 HydrophobicContact CD1-CE1 3.88Å; I166-F200 HydrophobicContact CG2-CE1 4.36Å; L168-F200 HydrophobicContact CD1-CD2 3.75Å; L168-F200 HydrophobicContact CD1-CE2 4.21Å; L168-F200 HydrophobicContact CD1-CG 4.16Å; L168-F200 HydrophobicContact CD2-CD2 3.95Å; L168-F200 HydrophobicContact CD2-CE2 3.51Å; L168-F200 HydrophobicContact CD2-CZ 3.85Å; Q190-F200 WeakPolarHBondContact CA-O 3.21Å; I191-F200 PolarHBondContact N-O 3.3Å; I191-F200 PolarHBondContact O-N 3.31Å; Y193-F200 HydrophobicContact CG-CE2 4.21Å; E198-F200 HydrophobicContact CB-CE2 3.98Å; E198-F200 HydrophobicContact CB-CZ 4.17Å; E198-F200 HydrophobicContact CG-CE1 4.15Å; E198-F200 HydrophobicContact CG-CE2 3.84Å; E198-F200 HydrophobicContact CG-CZ 3.62Å; E198-F200 WeakPolarHBondContact OE1-CE1 3.32Å; E198-F200 WeakPolarHBondContact OE1-CZ 3.37Å; F200-F202 HydrophobicContact CB-CD2 4.27Å; F200-F202 HydrophobicContact CB-CE2 3.55Å; F200-F202 HydrophobicContact CB-CZ 4.01Å
201	F	90.1	Very high	85.2	Confident	49 Å²	49	56.1 Å²	56.1	22%	0.215	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	98.7	-179.6	-169.8	-91.6	0	0	0	110.1	S135 E179 A188 Q190 T203	S135-F201 PolarHBondContact N-O 2.84Å; E179-F201 HydrophobicContact CB-CD2 4.44Å; E179-F201 HydrophobicContact CB-CE2 3.64Å; E179-F201 HydrophobicContact CB-CZ 4.16Å; E179-F201 HydrophobicContact CG-CD2 4.25Å; E179-F201 HydrophobicContact CG-CE2 3.8Å; A188-F201 HydrophobicContact CB-CE1 3.89Å; A188-F201 HydrophobicContact CB-CE2 4.25Å; A188-F201 HydrophobicContact CB-CZ 3.68Å; Q190-F201 HydrophobicContact CB-CD2 4.12Å; F201-T203 HydrophobicContact CD1-CG2 3.49Å; F201-T203 VanDerWaalsContact CD1-CG2 3.49Å; F201-T203 HydrophobicContact CE1-CG2 3.41Å; F201-T203 VanDerWaalsContact CE1-CG2 3.41Å
202	F	90.8	Very high	85	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	138.9	176.4	-61.4	-83.9	0	0	0	110.4	A133 L134 M147 F156 A188 I189 I191 F200 F205	A133-F202 CarbonylContact O-C 3.58Å; A133-F202 VanDerWaalsContact O-CA 3.3Å; A133-F202 WeakPolarHBondContact O-CA 3.31Å; L134-F202 HydrophobicContact CB-CD1 4.35Å; L134-F202 HydrophobicContact CB-CE1 4.34Å; L134-F202 HydrophobicContact CD1-CD1 4.08Å; L134-F202 HydrophobicContact CD1-CE1 3.85Å; L134-F202 HydrophobicContact CD1-CZ 4.08Å; M147-F202 HydrophobicContact CE-CB 4.28Å; M147-F202 HydrophobicContact CE-CD1 3.87Å; M147-F202 HydrophobicContact CE-CD2 3.9Å; M147-F202 HydrophobicContact CE-CE1 4.13Å; M147-F202 HydrophobicContact CE-CE2 4.15Å; M147-F202 HydrophobicContact CE-CG 3.75Å; M147-F202 HydrophobicContact CE-CZ 4.26Å; F156-F202 HydrophobicContact CB-CE1 3.95Å; F156-F202 HydrophobicContact CB-CZ 4.41Å; F156-F202 HydrophobicContact CD1-CE1 4.38Å; F156-F202 HydrophobicContact CD2-CD1 4.19Å; F156-F202 AromaticContact CD2-CE1 3.77Å; F156-F202 HydrophobicContact CD2-CE1 3.77Å; F156-F202 HydrophobicContact CE2-CD1 4.47Å; F156-F202 HydrophobicContact CE2-CE1 4.4Å; F156-F202 AromaticContact CG-CE1 3.76Å; F156-F202 HydrophobicContact CG-CE1 3.76Å; A188-F202 CarbonylContact C-O 3.57Å; A188-F202 WeakPolarHBondContact CA-O 3.1Å; A188-F202 VanDerWaalsContact CB-O 3.25Å; A188-F202 WeakPolarHBondContact CB-O 3.49Å; I189-F202 PolarHBondContact N-O 2.9Å; I189-F202 PolarHBondContact O-N 2.85Å; I191-F202 HydrophobicContact CD1-CD2 4.29Å; I191-F202 HydrophobicContact CD1-CE2 3.9Å; I191-F202 HydrophobicContact CG1-CD2 4.35Å; I191-F202 HydrophobicContact CG1-CE2 4.21Å; F200-F202 HydrophobicContact CB-CD2 4.27Å; F200-F202 HydrophobicContact CB-CE2 3.55Å; F200-F202 HydrophobicContact CB-CZ 4.01Å; F202-F205 HydrophobicContact CB-CE2 3.69Å; F202-F205 HydrophobicContact CB-CZ 3.55Å; F202-F205 HydrophobicContact CG-CZ 4.44Å
203	T	89	Confident	84.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	173.3	-177.1	82.1	0	0	0	0	111.3	C132 A133 L142 T181 N187 A188 F201 F205	C132-T203 CarbonylContact C-O 3.53Å; C132-T203 WeakPolarHBondContact CA-O 3.27Å; C132-T203 WeakPolarHBondContact CB-O 3.24Å; A133-T203 PolarHBondContact N-O 2.73Å; A133-T203 PolarHBondContact O-N 2.88Å; L142-T203 HydrophobicContact CD2-CG2 4Å; T181-T203 HydrophobicContact CG2-CG2 4.03Å; N187-T203 CarbonylContact O-C 3.59Å; N187-T203 VanDerWaalsContact O-CA 3.3Å; N187-T203 WeakPolarHBondContact O-CA 3.34Å; A188-T203 HydrophobicContact CB-CG2 4.26Å; F201-T203 HydrophobicContact CD1-CG2 3.49Å; F201-T203 VanDerWaalsContact CD1-CG2 3.49Å; F201-T203 HydrophobicContact CE1-CG2 3.41Å; F201-T203 VanDerWaalsContact CE1-CG2 3.41Å; T203-F205 VanDerWaalsContact C-N 3.34Å; T203-F205 PolarHBondContact O-N 3.48Å
204	S	85.7	Confident	84.4	Confident	50 Å²	50	55 Å²	55	35%	0.35	28%	0.281	S	S	.	.			trans	66.9	29.4	163.4	-44.2	0	0	0	0	114.8	S131 N187	S131-S204 VanDerWaalsContact O-O 3.13Å; N187-S204 PolarHBondContact O-N 3.18Å
205	F	85.5	Confident	84.5	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.018	27%	0.266	C	S	.	.			trans	-64.7	151.5	171.6	-62.3	-93.1	0	0	0	111.2	Y130 C132 M147 N187 I189 F202 T203 S211	Y130-F205 HydrophobicContact CD1-CD1 4.34Å; C132-F205 HydrophobicContact CB-CD1 3.92Å; C132-F205 HydrophobicContact CB-CD2 4.38Å; C132-F205 HydrophobicContact CB-CE1 3.85Å; C132-F205 HydrophobicContact CB-CE2 4.31Å; C132-F205 HydrophobicContact CB-CG 4.2Å; C132-F205 HydrophobicContact CB-CZ 4.05Å; M147-F205 HydrophobicContact CE-CE1 3.86Å; M147-F205 HydrophobicContact CE-CZ 3.81Å; N187-F205 VanDerWaalsContact CG-O 3.29Å; N187-F205 PolarHBondContact ND2-O 3.37Å; N187-F205 WeakPolarHBondContact OD1-CA 3.27Å; N187-F205 WeakPolarHBondContact OD1-CB 3.33Å; N187-F205 PolarHBondContact OD1-N 3.32Å; N187-F205 PolarHBondContact OD1-O 2.86Å; I189-F205 HydrophobicContact CB-CE2 3.88Å; I189-F205 HydrophobicContact CB-CZ 4.06Å; I189-F205 HydrophobicContact CD1-CD2 4.42Å; I189-F205 HydrophobicContact CD1-CE1 4.24Å; I189-F205 HydrophobicContact CD1-CE2 3.92Å; I189-F205 HydrophobicContact CD1-CZ 3.82Å; I189-F205 HydrophobicContact CG1-CD2 4.31Å; I189-F205 HydrophobicContact CG1-CE2 3.72Å; I189-F205 HydrophobicContact CG1-CZ 4.04Å; F202-F205 HydrophobicContact CB-CE2 3.69Å; F202-F205 HydrophobicContact CB-CZ 3.55Å; F202-F205 HydrophobicContact CG-CZ 4.44Å; T203-F205 VanDerWaalsContact C-N 3.34Å; T203-F205 PolarHBondContact O-N 3.48Å; F205-S211 WeakPolarHBondContact CD1-OG 3.47Å
206	A	78.6	Confident	85.2	Confident	108 Å²	108	51.5 Å²	51.5	89%	0.893	26%	0.257	S	S	*	.	S	Bend	trans	-73.4	-33.5	170.5	0	0	0	0	0	112.4
207	S	78.6	Confident	85.7	Confident	51 Å²	51	48.1 Å²	48.1	36%	0.357	24%	0.237	S	C	.	.			trans	-143.1	101	171.1	174.2	0	0	0	0	108.7	E209 R210 S211	S207-E209 VanDerWaalsContact C-N 3.28Å; S207-E209 PolarHBondContact O-N 3.24Å; S207-R210 WeakPolarHBondContact OG-CB 3.17Å; S207-R210 PolarHBondContact OG-N 2.94Å; S207-S211 WeakPolarHBondContact O-CB 3.26Å; S207-S211 PolarHBondContact O-N 3.37Å; S207-S211 PolarHBondContact O-OG 3.2Å
208	R	86.7	Confident	86	Confident	32 Å²	32	41.3 Å²	41.3	12%	0.121	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-42.3	178.6	-176.7	-166	62.7	167.9	2	110.4	E179 P186 A188 I189 S211 Y212	E179-R208 PolarHBondContact O-NH1 3.49Å; P186-R208 WeakPolarHBondContact O-CD 3.4Å; P186-R208 PolarHBondContact O-NE 3.12Å; A188-R208 WeakPolarHBondContact O-CD 3.4Å; I189-R208 HydrophobicContact CD1-CG 4.07Å; I189-R208 HydrophobicContact CG1-CG 3.7Å; R208-S211 PolarHBondContact O-N 3.3Å; R208-Y212 VanDerWaalsContact O-CB 3.26Å; R208-Y212 WeakPolarHBondContact O-CB 3.24Å; R208-Y212 PolarHBondContact O-N 2.59Å
209	E	83.7	Confident	86.3	Confident	81 Å²	81	39.9 Å²	39.9	38%	0.379	20%	0.198	S	C	.	.	H	α-helix	trans	-59.9	-49.4	-177.1	-79.1	48	-122	0	0	111.9	K178 S207 Y212 A213	K178-E209 IonicContact NZ-OE1 2.78Å; S207-E209 VanDerWaalsContact C-N 3.28Å; S207-E209 PolarHBondContact O-N 3.24Å; E209-Y212 PolarHBondContact O-N 2.98Å; E209-A213 WeakPolarHBondContact O-CB 3.4Å; E209-A213 PolarHBondContact O-N 2.88Å
210	R	78.3	Confident	86.4	Confident	46 Å²	46	34.4 Å²	34.4	17%	0.174	18%	0.179	C	C	.	.	H	α-helix	trans	-58.9	-48.6	174.2	179.4	-177.2	-179.8	147.3	9.5	111.5	Y130 S207 Y212 A213 I214 L246	Y130-R210 HydrophobicContact CE1-CG 4.42Å; Y130-R210 PolarHBondContact OH-NE 3.25Å; S207-R210 WeakPolarHBondContact OG-CB 3.17Å; S207-R210 PolarHBondContact OG-N 2.94Å; R210-Y212 VanDerWaalsContact C-N 3.34Å; R210-Y212 PolarHBondContact O-N 3.15Å; R210-A213 PolarHBondContact O-N 3.3Å; R210-I214 HydrophobicContact CG-CD1 4.07Å; R210-I214 PolarHBondContact O-N 3.02Å; R210-I214 VanDerWaalsContact O-N 3.16Å; R210-L246 HydrophobicContact CB-CD2 4.47Å; R210-L246 VanDerWaalsContact CD-CD2 3.48Å; R210-L246 HydrophobicContact CG-CD2 3.74Å; R210-L246 PolarHBondContact NH2-O 3.1Å
211	S	85.2	Confident	86.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-45.4	-179.7	-48.1	0	0	0	0	111.3	Y130 F205 S207 R208 L215	Y130-S211 WeakPolarHBondContact CD1-OG 3.41Å; Y130-S211 WeakPolarHBondContact CE1-OG 3.22Å; F205-S211 WeakPolarHBondContact CD1-OG 3.47Å; S207-S211 WeakPolarHBondContact O-CB 3.26Å; S207-S211 PolarHBondContact O-N 3.37Å; S207-S211 PolarHBondContact O-OG 3.2Å; R208-S211 PolarHBondContact O-N 3.3Å; S211-L215 WeakPolarHBondContact O-CB 3.05Å; S211-L215 VanDerWaalsContact O-CG 3.27Å; S211-L215 WeakPolarHBondContact O-CG 3.21Å; S211-L215 PolarHBondContact O-N 3.47Å
212	Y	89.3	Confident	86	Confident	31 Å²	31	33.6 Å²	33.6	12%	0.122	18%	0.181	C	C	.	.	H	α-helix	trans	-67.1	-43.4	179.1	179.6	-89.5	0	0	0	112.2	I176 K178 I189 R208 E209 R210 I214 L215 R216	I176-Y212 HydrophobicContact CG2-CD2 4.06Å; I176-Y212 HydrophobicContact CG2-CE2 3.93Å; I176-Y212 WeakPolarHBondContact O-CE2 3.46Å; I176-Y212 PolarHBondContact O-OH 2.89Å; K178-Y212 HydrophobicContact CD-CD1 4.21Å; K178-Y212 HydrophobicContact CD-CD2 4.46Å; K178-Y212 HydrophobicContact CD-CE1 4.36Å; K178-Y212 HydrophobicContact CD-CG 4.26Å; K178-Y212 HydrophobicContact CG-CD1 4.02Å; K178-Y212 HydrophobicContact CG-CD2 3.45Å; K178-Y212 VanDerWaalsContact CG-CD2 3.45Å; K178-Y212 HydrophobicContact CG-CE1 4.11Å; K178-Y212 HydrophobicContact CG-CE2 3.56Å; K178-Y212 HydrophobicContact CG-CG 3.69Å; I189-Y212 HydrophobicContact CG2-CD2 4.39Å; R208-Y212 VanDerWaalsContact O-CB 3.26Å; R208-Y212 WeakPolarHBondContact O-CB 3.24Å; R208-Y212 PolarHBondContact O-N 2.59Å; E209-Y212 PolarHBondContact O-N 2.98Å; R210-Y212 VanDerWaalsContact C-N 3.34Å; R210-Y212 PolarHBondContact O-N 3.15Å; Y212-I214 PolarHBondContact O-N 2.75Å; Y212-L215 PolarHBondContact O-N 3.04Å; Y212-R216 HydrophobicContact CE1-CB 4.23Å; Y212-R216 WeakPolarHBondContact O-CB 3.16Å; Y212-R216 PolarHBondContact O-N 3.49Å
213	A	86.1	Confident	85.6	Confident	6 Å²	6	41.8 Å²	41.8	5%	0.05	21%	0.211	C	C	.	.	H	α-helix	trans	-58.4	-47.2	178.5	0	0	0	0	0	111.6	E209 R210 K217 I237 Y241	E209-A213 WeakPolarHBondContact O-CB 3.4Å; E209-A213 PolarHBondContact O-N 2.88Å; R210-A213 PolarHBondContact O-N 3.3Å; A213-K217 VanDerWaalsContact O-CB 3.24Å; A213-K217 WeakPolarHBondContact O-CB 3.37Å; A213-K217 PolarHBondContact O-N 2.81Å; A213-I237 HydrophobicContact CB-CD1 4.21Å; A213-I237 HydrophobicContact CB-CG2 4.34Å; A213-Y241 HydrophobicContact CB-CD2 4.37Å; A213-Y241 HydrophobicContact CB-CE2 3.58Å
214	I	84.6	Confident	85.4	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68.4	-48.1	179.9	-68.6	161.5	0	0	0	110.9	L125 Y130 I149 R210 Y212 R216 K217 V218 L234 I237	L125-I214 HydrophobicContact CD1-CG2 4.45Å; Y130-I214 WeakPolarHBondContact OH-CD1 3.44Å; I149-I214 HydrophobicContact CD1-CG2 4.01Å; R210-I214 HydrophobicContact CG-CD1 4.07Å; R210-I214 PolarHBondContact O-N 3.02Å; R210-I214 VanDerWaalsContact O-N 3.16Å; Y212-I214 PolarHBondContact O-N 2.75Å; I214-R216 VanDerWaalsContact C-N 3.33Å; I214-R216 PolarHBondContact O-N 3.36Å; I214-K217 PolarHBondContact O-N 2.94Å; I214-V218 HydrophobicContact CG2-CG2 4.42Å; I214-V218 WeakPolarHBondContact O-CB 3.44Å; I214-V218 WeakPolarHBondContact O-CG2 3.46Å; I214-V218 PolarHBondContact O-N 2.92Å; I214-L234 HydrophobicContact CD1-CD2 3.62Å; I214-L234 HydrophobicContact CG1-CD2 4.08Å; I214-I237 HydrophobicContact CB-CD1 4.27Å; I214-I237 HydrophobicContact CG1-CD1 3.53Å
215	L	89.4	Confident	84.9	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-56.3	-46	176.1	-79.4	170.4	0	0	0	112.3	M147 I149 V154 I176 I189 I191 S211 Y212 W219	M147-L215 HydrophobicContact CE-CD1 4.31Å; M147-L215 HydrophobicContact SD-CD1 4.03Å; M147-L215 HydrophobicContact SD-CD2 3.98Å; M147-L215 HydrophobicContact SD-CG 4.39Å; I149-L215 HydrophobicContact CD1-CD2 3.61Å; I149-L215 HydrophobicContact CD1-CG 3.75Å; I149-L215 HydrophobicContact CG1-CD2 3.94Å; V154-L215 HydrophobicContact CB-CD2 4.45Å; V154-L215 HydrophobicContact CG1-CD2 3.88Å; V154-L215 HydrophobicContact CG2-CD2 3.63Å; I176-L215 HydrophobicContact CD1-CB 4.21Å; I176-L215 HydrophobicContact CG2-CB 4.47Å; I189-L215 HydrophobicContact CD1-CD1 4.07Å; I189-L215 HydrophobicContact CG2-CD1 4.2Å; I191-L215 HydrophobicContact CD1-CD1 4.42Å; I191-L215 HydrophobicContact CD1-CD2 4.35Å; S211-L215 WeakPolarHBondContact O-CB 3.05Å; S211-L215 VanDerWaalsContact O-CG 3.27Å; S211-L215 WeakPolarHBondContact O-CG 3.21Å; S211-L215 PolarHBondContact O-N 3.47Å; Y212-L215 PolarHBondContact O-N 3.04Å; L215-W219 WeakPolarHBondContact O-CB 3.39Å; L215-W219 PolarHBondContact O-N 3.27Å; L215-W219 VanDerWaalsContact O-N 3.11Å
216	R	89.5	Confident	84.2	Confident	108 Å²	108	57 Å²	57	41%	0.408	28%	0.28	S	S	.	.	H	α-helix	trans	-64.9	-46.1	178.8	178.4	175.2	171.7	158.3	3.2	111.6	Y212 I214 W219 E220	Y212-R216 HydrophobicContact CE1-CB 4.23Å; Y212-R216 WeakPolarHBondContact O-CB 3.16Å; Y212-R216 PolarHBondContact O-N 3.49Å; I214-R216 VanDerWaalsContact C-N 3.33Å; I214-R216 PolarHBondContact O-N 3.36Å; R216-W219 PolarHBondContact O-N 3.25Å; R216-E220 HydrophobicContact CG-CG 4.3Å; R216-E220 IonicContact CZ-OE1 3.99Å; R216-E220 IonicContact NE-OE1 3.16Å; R216-E220 PolarHBondContact NE-OE1 3.06Å; R216-E220 IonicContact NE-OE2 2.73Å; R216-E220 IonicContact NH2-OE1 2.85Å; R216-E220 PolarHBondContact NH2-OE1 3.26Å; R216-E220 WeakPolarHBondContact O-CB 3.2Å; R216-E220 WeakPolarHBondContact O-CG 3.42Å; R216-E220 PolarHBondContact O-N 2.86Å
217	K	86.6	Confident	83.6	Confident	42 Å²	42	58.7 Å²	58.7	18%	0.183	28%	0.28	C	S	.	.	H	α-helix	trans	-67.9	-39.5	-177.7	-176.2	57.1	171.2	176.5	0	112.5	A213 I214 W219 E220 N221 I233 I237	A213-K217 VanDerWaalsContact O-CB 3.24Å; A213-K217 WeakPolarHBondContact O-CB 3.37Å; A213-K217 PolarHBondContact O-N 2.81Å; I214-K217 PolarHBondContact O-N 2.94Å; K217-W219 VanDerWaalsContact C-N 3.34Å; K217-E220 PolarHBondContact O-N 2.79Å; K217-N221 WeakPolarHBondContact CE-OD1 3.33Å; K217-N221 PolarHBondContact NZ-OD1 3.38Å; K217-N221 WeakPolarHBondContact O-CB 3.31Å; K217-N221 PolarHBondContact O-N 3.39Å; K217-N221 PolarHBondContact O-OD1 3.45Å; K217-I233 HydrophobicContact CB-CG2 4.13Å; K217-I233 HydrophobicContact CG-CB 4.38Å; K217-I233 HydrophobicContact CG-CG1 4.21Å; K217-I233 HydrophobicContact CG-CG2 3.74Å; K217-I237 HydrophobicContact CB-CD1 4.04Å; K217-I237 HydrophobicContact CG-CD1 4.36Å
218	V	87	Confident	83	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-60	-44.3	171.5	166.7	0	0	0	0	110.9	I149 T150 V170 I214 C222 I233	I149-V218 HydrophobicContact CG2-CG1 4.33Å; I149-V218 HydrophobicContact CG2-CG2 4.07Å; T150-V218 WeakPolarHBondContact O-CG1 3.43Å; V170-V218 HydrophobicContact CG1-CG1 4.08Å; V170-V218 HydrophobicContact CG2-CG1 3.94Å; I214-V218 HydrophobicContact CG2-CG2 4.42Å; I214-V218 WeakPolarHBondContact O-CB 3.44Å; I214-V218 WeakPolarHBondContact O-CG2 3.46Å; I214-V218 PolarHBondContact O-N 2.92Å; V218-C222 WeakPolarHBondContact O-CB 3.43Å; V218-C222 PolarHBondContact O-N 3.12Å; V218-I233 HydrophobicContact CG2-CD1 3.75Å
219	W	90	Very high	82.2	Confident	37 Å²	37	57.7 Å²	57.7	14%	0.14	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-44.6	177.4	177.1	58.2	0	0	0	113.4	V170 I173 V174 I176 L215 R216 K217 C222 R223	V170-W219 HydrophobicContact CG1-CB 4.27Å; I173-W219 HydrophobicContact CG2-CD2 4.49Å; I173-W219 HydrophobicContact CG2-CG 4.34Å; I173-W219 PolarHBondContact O-NE1 3.36Å; V174-W219 VanDerWaalsContact O-CZ2 3.24Å; V174-W219 WeakPolarHBondContact O-CZ2 3.46Å; I176-W219 HydrophobicContact CD1-CB 3.75Å; I176-W219 HydrophobicContact CD1-CD2 4.11Å; I176-W219 HydrophobicContact CD1-CE3 4.19Å; I176-W219 HydrophobicContact CD1-CG 3.95Å; I176-W219 HydrophobicContact CG1-CD2 4.36Å; I176-W219 HydrophobicContact CG1-CE3 4.31Å; L215-W219 WeakPolarHBondContact O-CB 3.39Å; L215-W219 PolarHBondContact O-N 3.27Å; L215-W219 VanDerWaalsContact O-N 3.11Å; R216-W219 PolarHBondContact O-N 3.25Å; K217-W219 VanDerWaalsContact C-N 3.34Å; W219-C222 PolarHBondContact O-N 3.06Å; W219-R223 VanDerWaalsContact O-CB 3.31Å; W219-R223 WeakPolarHBondContact O-CB 3.42Å; W219-R223 PolarHBondContact O-N 3.36Å
220	E	89.4	Confident	81.5	Confident	58 Å²	58	54.1 Å²	54.1	27%	0.271	26%	0.259	S	S	.	.	H	α-helix	trans	-62.9	-44.4	175.7	-74.1	171.3	158.9	0	0	111.7	R216 K217 R223 N224	R216-E220 HydrophobicContact CG-CG 4.3Å; R216-E220 IonicContact CZ-OE1 3.99Å; R216-E220 IonicContact NE-OE1 3.16Å; R216-E220 PolarHBondContact NE-OE1 3.06Å; R216-E220 IonicContact NE-OE2 2.73Å; R216-E220 IonicContact NH2-OE1 2.85Å; R216-E220 PolarHBondContact NH2-OE1 3.26Å; R216-E220 WeakPolarHBondContact O-CB 3.2Å; R216-E220 WeakPolarHBondContact O-CG 3.42Å; R216-E220 PolarHBondContact O-N 2.86Å; K217-E220 PolarHBondContact O-N 2.79Å; E220-R223 PolarHBondContact O-N 2.9Å; E220-N224 WeakPolarHBondContact O-CB 3.48Å; E220-N224 PolarHBondContact O-N 3.02Å; E220-N224 PolarHBondContact O-ND2 3.11Å; E220-N224 PolarHBondContact O-OD1 2.97Å
221	N	85.7	Confident	81.1	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.032	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-49.8	175.6	-74.7	10.3	0	0	0	112	K217 R223 N224 H225 Q226 M228 I233	K217-N221 WeakPolarHBondContact CE-OD1 3.33Å; K217-N221 PolarHBondContact NZ-OD1 3.38Å; K217-N221 WeakPolarHBondContact O-CB 3.31Å; K217-N221 PolarHBondContact O-N 3.39Å; K217-N221 PolarHBondContact O-OD1 3.45Å; N221-R223 VanDerWaalsContact C-N 3.29Å; N221-R223 PolarHBondContact O-N 2.87Å; N221-N224 PolarHBondContact O-N 3.25Å; N221-H225 PolarHBondContact O-N 2.81Å; N221-Q226 PolarHBondContact O-N 3.09Å; N221-M228 VanDerWaalsContact ND2-CE 3.32Å; N221-M228 WeakPolarHBondContact ND2-CE 3.3Å; N221-M228 VanDerWaalsContact OD1-CE 3.26Å; N221-M228 WeakPolarHBondContact OD1-CE 3.49Å; N221-I233 VanDerWaalsContact ND2-CD1 3.26Å; N221-I233 WeakPolarHBondContact ND2-CD1 3.37Å; N221-I233 WeakPolarHBondContact ND2-CG1 3.17Å
222	C	85.6	Confident	80.7	Confident	39 Å²	39	60 Å²	60	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-39	178.6	-177.3	0	0	0	0	112	V170 V218 W219 H225	V170-C222 HydrophobicContact CB-CB 4.35Å; V170-C222 HydrophobicContact CG1-CB 3.5Å; V170-C222 VanDerWaalsContact CG1-CB 3.5Å; V218-C222 WeakPolarHBondContact O-CB 3.43Å; V218-C222 PolarHBondContact O-N 3.12Å; W219-C222 PolarHBondContact O-N 3.06Å; C222-H225 PolarHBondContact O-N 3.45Å
223	R	83.8	Confident	80	Confident	172 Å²	172	58.6 Å²	58.6	65%	0.649	29%	0.286	S	S	*	.	H	α-helix	trans	-72	-30.6	178.2	-176.7	173.6	177.9	167.1	-0.1	113.2	W219 E220 N221 H225	W219-R223 VanDerWaalsContact O-CB 3.31Å; W219-R223 WeakPolarHBondContact O-CB 3.42Å; W219-R223 PolarHBondContact O-N 3.36Å; E220-R223 PolarHBondContact O-N 2.9Å; N221-R223 VanDerWaalsContact C-N 3.29Å; N221-R223 PolarHBondContact O-N 2.87Å; R223-H225 VanDerWaalsContact C-N 3.26Å; R223-H225 PolarHBondContact O-N 2.8Å
224	N	83.8	Confident	79.1	Confident	109 Å²	109	58.7 Å²	58.7	58%	0.583	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	5.6	176.8	-65.7	-10	0	0	0	113	E220 N221 Q226	E220-N224 WeakPolarHBondContact O-CB 3.48Å; E220-N224 PolarHBondContact O-N 3.02Å; E220-N224 PolarHBondContact O-ND2 3.11Å; E220-N224 PolarHBondContact O-OD1 2.97Å; N221-N224 PolarHBondContact O-N 3.25Å; N224-Q226 HydrophobicContact CB-CB 4.27Å; N224-Q226 PolarHBondContact O-N 3.39Å; N224-Q226 VanDerWaalsContact O-N 3.12Å
225	H	75.9	Confident	78.5	Confident	172 Å²	172	62.6 Å²	62.6	80%	0.796	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	24.1	-169.9	-58	-63.4	0	0	0	114.1	N221 C222 R223 T227	N221-H225 PolarHBondContact O-N 2.81Å; C222-H225 PolarHBondContact O-N 3.45Å; R223-H225 VanDerWaalsContact C-N 3.26Å; R223-H225 PolarHBondContact O-N 2.8Å; H225-T227 PolarHBondContact O-N 2.96Å
226	Q	71.7	Confident	77.7	Confident	93 Å²	93	65.9 Å²	65.9	44%	0.435	32%	0.319	S	S	.	.			trans	-94	102.4	-174.6	-164	-175.2	5.1	0	0	110.4	N221 N224 M228	N221-Q226 PolarHBondContact O-N 3.09Å; N224-Q226 HydrophobicContact CB-CB 4.27Å; N224-Q226 PolarHBondContact O-N 3.39Å; N224-Q226 VanDerWaalsContact O-N 3.12Å; Q226-M228 VanDerWaalsContact C-N 3.33Å; Q226-M228 HydrophobicContact CG-CG 4.07Å; Q226-M228 PolarHBondContact NE2-SD 3.39Å; Q226-M228 VanDerWaalsContact NE2-SD 3.43Å; Q226-M228 PolarHBondContact O-N 3.36Å
227	T	64.7	Low	76.7	Confident	143 Å²	143	60.9 Å²	60.9	88%	0.877	30%	0.3	S	S	*	.			trans	-75.4	81.8	173.5	54.8	0	0	0	0	110.6	H225	H225-T227 PolarHBondContact O-N 2.96Å
228	M	65.6	Low	75.8	Confident	20 Å²	20	62.2 Å²	62.2	10%	0.099	30%	0.304	C	S	.	.			trans	-99	136.9	161.1	-64.3	-171.8	-62.8	0	0	109.2	N221 Q226 E232 Q236	N221-M228 VanDerWaalsContact ND2-CE 3.32Å; N221-M228 WeakPolarHBondContact ND2-CE 3.3Å; N221-M228 VanDerWaalsContact OD1-CE 3.26Å; N221-M228 WeakPolarHBondContact OD1-CE 3.49Å; Q226-M228 VanDerWaalsContact C-N 3.33Å; Q226-M228 HydrophobicContact CG-CG 4.07Å; Q226-M228 PolarHBondContact NE2-SD 3.39Å; Q226-M228 VanDerWaalsContact NE2-SD 3.43Å; Q226-M228 PolarHBondContact O-N 3.36Å; M228-E232 HydrophobicContact CB-CB 4.24Å; M228-Q236 PolarHBondContact SD-NE2 3.45Å
229	S	71	Confident	75	Confident	43 Å²	43	67.3 Å²	67.3	30%	0.301	33%	0.331	S	S	.	.			trans	-59.7	157.2	174.1	64.7	0	0	0	0	111.3	E151 D231 E232 I233	E151-S229 WeakPolarHBondContact OE1-CA 3.39Å; S229-D231 PolarHBondContact O-N 3.27Å; S229-E232 WeakPolarHBondContact CB-OE2 3.29Å; S229-E232 PolarHBondContact N-OE2 2.97Å; S229-E232 PolarHBondContact O-N 3.2Å; S229-E232 VanDerWaalsContact OG-CD 3.32Å; S229-E232 VanDerWaalsContact OG-CG 3.28Å; S229-E232 WeakPolarHBondContact OG-CG 3.3Å; S229-E232 PolarHBondContact OG-N 2.97Å; S229-E232 PolarHBondContact OG-OE2 3.16Å; S229-I233 WeakPolarHBondContact O-CG1 3.08Å; S229-I233 PolarHBondContact O-N 3.35Å
230	I	68.2	Low	73.7	Confident	6 Å²	6	71.4 Å²	71.4	3%	0.031	35%	0.353	C	S	.	.	H	α-helix	trans	-65.7	-24.1	178.3	-38.9	174.2	0	0	0	111.9	S123 L125 E151 I233 L234	S123-I230 WeakPolarHBondContact O-CD1 3.46Å; L125-I230 HydrophobicContact CB-CD1 4.33Å; L125-I230 HydrophobicContact CD1-CD1 4.24Å; L125-I230 HydrophobicContact CD1-CG2 3.72Å; L125-I230 HydrophobicContact CD2-CG2 4.33Å; L125-I230 HydrophobicContact CG-CB 4.44Å; L125-I230 HydrophobicContact CG-CD1 4.15Å; L125-I230 HydrophobicContact CG-CG2 3.64Å; E151-I230 HydrophobicContact CG-CD1 4.1Å; E151-I230 HydrophobicContact CG-CG1 3.55Å; I230-I233 HydrophobicContact CG2-CB 4.46Å; I230-I233 WeakPolarHBondContact O-CB 3.46Å; I230-I233 PolarHBondContact O-N 2.71Å; I230-L234 HydrophobicContact CG2-CG 4.45Å; I230-L234 WeakPolarHBondContact O-CB 3.44Å; I230-L234 VanDerWaalsContact O-CG 3.22Å; I230-L234 WeakPolarHBondContact O-CG 3.48Å; I230-L234 PolarHBondContact O-N 3.26Å
231	D	69.6	Low	72.5	Confident	74 Å²	74	74.7 Å²	74.7	40%	0.396	36%	0.364	S	S	.	.	H	α-helix	trans	-75.1	-33.2	177.3	-65.7	-33	0	0	0	112.5	F126 S229 L234 Q235	F126-D231 WeakPolarHBondContact CD2-OD1 3.5Å; F126-D231 WeakPolarHBondContact CE2-OD1 3.39Å; S229-D231 PolarHBondContact O-N 3.27Å; D231-L234 PolarHBondContact O-N 2.8Å; D231-Q235 WeakPolarHBondContact O-CB 3.5Å; D231-Q235 PolarHBondContact O-N 3.08Å
232	E	78.1	Confident	71.2	Confident	94 Å²	94	75.8 Å²	75.8	44%	0.439	38%	0.376	S	S	.	.	H	α-helix	trans	-68.1	-38.9	167.6	-69.9	163.5	120.1	0	0	111.7	M228 S229 L234 Q235 Q236	M228-E232 HydrophobicContact CB-CB 4.24Å; S229-E232 WeakPolarHBondContact CB-OE2 3.29Å; S229-E232 PolarHBondContact N-OE2 2.97Å; S229-E232 PolarHBondContact O-N 3.2Å; S229-E232 VanDerWaalsContact OG-CD 3.32Å; S229-E232 VanDerWaalsContact OG-CG 3.28Å; S229-E232 WeakPolarHBondContact OG-CG 3.3Å; S229-E232 PolarHBondContact OG-N 2.97Å; S229-E232 PolarHBondContact OG-OE2 3.16Å; E232-L234 VanDerWaalsContact C-N 3.34Å; E232-Q235 PolarHBondContact O-N 2.84Å; E232-Q236 WeakPolarHBondContact O-CG 3.34Å; E232-Q236 PolarHBondContact O-N 2.76Å
233	I	73.1	Confident	69.7	Low	2 Å²	2	76.1 Å²	76.1	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-58.6	-47.2	171.5	-70.9	174.4	0	0	0	110.3	K217 V218 N221 S229 I230 Q236 I237	K217-I233 HydrophobicContact CB-CG2 4.13Å; K217-I233 HydrophobicContact CG-CB 4.38Å; K217-I233 HydrophobicContact CG-CG1 4.21Å; K217-I233 HydrophobicContact CG-CG2 3.74Å; V218-I233 HydrophobicContact CG2-CD1 3.75Å; N221-I233 VanDerWaalsContact ND2-CD1 3.26Å; N221-I233 WeakPolarHBondContact ND2-CD1 3.37Å; N221-I233 WeakPolarHBondContact ND2-CG1 3.17Å; S229-I233 WeakPolarHBondContact O-CG1 3.08Å; S229-I233 PolarHBondContact O-N 3.35Å; I230-I233 HydrophobicContact CG2-CB 4.46Å; I230-I233 WeakPolarHBondContact O-CB 3.46Å; I230-I233 PolarHBondContact O-N 2.71Å; I233-Q236 PolarHBondContact O-N 2.93Å; I233-I237 HydrophobicContact CG2-CD1 3.85Å; I233-I237 WeakPolarHBondContact O-CB 3.2Å; I233-I237 VanDerWaalsContact O-CG1 3.23Å; I233-I237 WeakPolarHBondContact O-CG1 3.27Å; I233-I237 PolarHBondContact O-N 2.84Å
234	L	68	Low	68	Low	9 Å²	9	76 Å²	76	5%	0.047	38%	0.377	C	S	.	.	H	α-helix	trans	-67.2	-35.7	178.2	-72.5	171.1	0	0	0	111.9	L125 F126 I214 I230 D231 E232 I237 R238	L125-L234 HydrophobicContact CD2-CD1 3.96Å; F126-L234 HydrophobicContact CB-CD1 3.99Å; I214-L234 HydrophobicContact CD1-CD2 3.62Å; I214-L234 HydrophobicContact CG1-CD2 4.08Å; I230-L234 HydrophobicContact CG2-CG 4.45Å; I230-L234 WeakPolarHBondContact O-CB 3.44Å; I230-L234 VanDerWaalsContact O-CG 3.22Å; I230-L234 WeakPolarHBondContact O-CG 3.48Å; I230-L234 PolarHBondContact O-N 3.26Å; D231-L234 PolarHBondContact O-N 2.8Å; E232-L234 VanDerWaalsContact C-N 3.34Å; L234-I237 PolarHBondContact O-N 2.84Å; L234-R238 WeakPolarHBondContact O-CG 3.17Å; L234-R238 PolarHBondContact O-N 2.84Å
235	Q	72.1	Confident	66.2	Low	81 Å²	81	73.5 Å²	73.5	38%	0.379	37%	0.367	S	S	.	.	H	α-helix	trans	-64.3	-51.2	174.2	-171.6	57.8	43.6	0	0	111.2	D231 E232 I237 R238 D239	D231-Q235 WeakPolarHBondContact O-CB 3.5Å; D231-Q235 PolarHBondContact O-N 3.08Å; E232-Q235 PolarHBondContact O-N 2.84Å; Q235-I237 PolarHBondContact O-N 2.8Å; Q235-I237 VanDerWaalsContact O-N 3.12Å; Q235-R238 CarbonylContact O-C 3.53Å; Q235-R238 WeakPolarHBondContact O-CA 3.17Å; Q235-R238 WeakPolarHBondContact O-CB 3.21Å; Q235-R238 PolarHBondContact O-N 2.85Å; Q235-R238 VanDerWaalsContact OE1-CZ 3.25Å; Q235-D239 PolarHBondContact NE2-OD1 2.91Å; Q235-D239 PolarHBondContact O-N 3.03Å; Q235-D239 VanDerWaalsContact O-OD2 3.13Å
236	Q	73.3	Confident	64.7	Low	73 Å²	73	66 Å²	66	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-59.7	-28.4	177.1	-69.7	174.2	19.5	0	0	112.5	M228 E232 I233 M240	M228-Q236 PolarHBondContact SD-NE2 3.45Å; E232-Q236 WeakPolarHBondContact O-CG 3.34Å; E232-Q236 PolarHBondContact O-N 2.76Å; I233-Q236 PolarHBondContact O-N 2.93Å; Q236-M240 WeakPolarHBondContact O-CB 3.33Å; Q236-M240 PolarHBondContact O-N 2.76Å
237	I	67.9	Low	62.9	Low	3 Å²	3	62.9 Å²	62.9	2%	0.015	32%	0.323	C	S	.	.	H	α-helix	trans	-78.9	-34.7	174.4	-71.7	172.6	0	0	0	111.9	A213 I214 K217 I233 L234 Q235 Y241 L246	A213-I237 HydrophobicContact CB-CD1 4.21Å; A213-I237 HydrophobicContact CB-CG2 4.34Å; I214-I237 HydrophobicContact CB-CD1 4.27Å; I214-I237 HydrophobicContact CG1-CD1 3.53Å; K217-I237 HydrophobicContact CB-CD1 4.04Å; K217-I237 HydrophobicContact CG-CD1 4.36Å; I233-I237 HydrophobicContact CG2-CD1 3.85Å; I233-I237 WeakPolarHBondContact O-CB 3.2Å; I233-I237 VanDerWaalsContact O-CG1 3.23Å; I233-I237 WeakPolarHBondContact O-CG1 3.27Å; I233-I237 PolarHBondContact O-N 2.84Å; L234-I237 PolarHBondContact O-N 2.84Å; Q235-I237 PolarHBondContact O-N 2.8Å; Q235-I237 VanDerWaalsContact O-N 3.12Å; I237-Y241 HydrophobicContact CG2-CD2 3.95Å; I237-Y241 HydrophobicContact CG2-CE2 4.45Å; I237-Y241 WeakPolarHBondContact O-CB 3.38Å; I237-Y241 WeakPolarHBondContact O-CD2 3.17Å; I237-Y241 PolarHBondContact O-N 3.42Å; I237-L246 HydrophobicContact CG2-CD1 4.19Å
238	R	66.9	Low	61.5	Low	70 Å²	70	63.4 Å²	63.4	26%	0.264	32%	0.318	S	S	.	.	H	α-helix	trans	-61.8	-45.6	167.5	-75.3	-177.4	-69.4	-97.4	3.9	110.8	L234 Q235 G242 L246	L234-R238 WeakPolarHBondContact O-CG 3.17Å; L234-R238 PolarHBondContact O-N 2.84Å; Q235-R238 CarbonylContact O-C 3.53Å; Q235-R238 WeakPolarHBondContact O-CA 3.17Å; Q235-R238 WeakPolarHBondContact O-CB 3.21Å; Q235-R238 PolarHBondContact O-N 2.85Å; Q235-R238 VanDerWaalsContact OE1-CZ 3.25Å; R238-G242 VanDerWaalsContact O-CA 3.31Å; R238-G242 WeakPolarHBondContact O-CA 3.33Å; R238-G242 PolarHBondContact O-N 2.86Å; R238-L246 HydrophobicContact CG-CB 4.27Å; R238-L246 HydrophobicContact CG-CD1 3.95Å
239	D	71.4	Confident	60.2	Low	110 Å²	110	65.7 Å²	65.7	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-66	-40.2	-179.8	-57	-30.1	0	0	0	111.8	Q235	Q235-D239 PolarHBondContact NE2-OD1 2.91Å; Q235-D239 PolarHBondContact O-N 3.03Å; Q235-D239 VanDerWaalsContact O-OD2 3.13Å
240	M	62.5	Low	58.4	Low	122 Å²	122	71.1 Å²	71.1	60%	0.601	35%	0.353	S	S	*	.	H	α-helix	trans	-79.5	-26.6	-177.9	-177.8	164.4	60	0	0	114.5	Q236	Q236-M240 WeakPolarHBondContact O-CB 3.33Å; Q236-M240 PolarHBondContact O-N 2.76Å
241	Y	64	Low	56.9	Low	128 Å²	128	78 Å²	78	50%	0.502	39%	0.39	S	S	.	.	H	α-helix	trans	-115.7	-4.8	-178.3	-65.6	-68.6	0	0	0	114.9	A213 I237 D243	A213-Y241 HydrophobicContact CB-CD2 4.37Å; A213-Y241 HydrophobicContact CB-CE2 3.58Å; I237-Y241 HydrophobicContact CG2-CD2 3.95Å; I237-Y241 HydrophobicContact CG2-CE2 4.45Å; I237-Y241 WeakPolarHBondContact O-CB 3.38Å; I237-Y241 WeakPolarHBondContact O-CD2 3.17Å; I237-Y241 PolarHBondContact O-N 3.42Å; Y241-D243 PolarHBondContact O-N 2.83Å; Y241-D243 VanDerWaalsContact O-N 3.12Å
242	G	57.3	Low	55.5	Low	28 Å²	28	82.7 Å²	82.7	29%	0.289	41%	0.41	S	S	.	.			trans	66.4	10.8	171.9	0	0	0	0	0	115.9	R238 R451	R238-G242 VanDerWaalsContact O-CA 3.31Å; R238-G242 WeakPolarHBondContact O-CA 3.33Å; R238-G242 PolarHBondContact O-N 2.86Å; G242-R451 VanDerWaalsContact O-CZ 3.28Å; G242-R451 PolarHBondContact O-NH1 2.95Å; G242-R451 PolarHBondContact O-NH2 3.34Å
243	D	55.5	Low	53.5	Low	47 Å²	47	86.3 Å²	86.3	25%	0.251	43%	0.427	S	S	.	.			trans	-96.8	106.6	-168.6	-178.3	11.9	0	0	0	112.4	Y241 S245 L246	Y241-D243 PolarHBondContact O-N 2.83Å; Y241-D243 VanDerWaalsContact O-N 3.12Å; D243-S245 VanDerWaalsContact C-N 3.31Å; D243-S245 WeakPolarHBondContact OD1-CA 3.25Å; D243-S245 WeakPolarHBondContact OD1-CB 3.46Å; D243-S245 PolarHBondContact OD1-N 3.43Å; D243-S245 PolarHBondContact OD1-OG 3.09Å; D243-S245 PolarHBondContact OD2-OG 3.31Å; D243-L246 HydrophobicContact CB-CD1 4.09Å; D243-L246 HydrophobicContact CB-CG 3.9Å; D243-L246 VanDerWaalsContact O-CB 3.26Å; D243-L246 WeakPolarHBondContact O-CB 3.35Å; D243-L246 WeakPolarHBondContact O-CD1 3.45Å; D243-L246 WeakPolarHBondContact O-CG 3.3Å; D243-L246 PolarHBondContact O-N 2.91Å
244	Y	48.2	Very low	51.9	Low	169 Å²	169	93 Å²	93	66%	0.663	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-76.9	-14.5	174.9	-80.3	-109.6	0	0	0	112.7	L246 A247	Y244-L246 PolarHBondContact O-N 3.39Å; Y244-L246 VanDerWaalsContact O-N 3.11Å; Y244-A247 PolarHBondContact O-N 2.74Å; Y244-A247 VanDerWaalsContact O-N 3.07Å
245	S	46.1	Very low	50.6	Low	56 Å²	56	98.2 Å²	98.2	39%	0.392	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-67	-9.3	169.9	84.7	0	0	0	0	112.6	D243 A247	D243-S245 VanDerWaalsContact C-N 3.31Å; D243-S245 WeakPolarHBondContact OD1-CA 3.25Å; D243-S245 WeakPolarHBondContact OD1-CB 3.46Å; D243-S245 PolarHBondContact OD1-N 3.43Å; D243-S245 PolarHBondContact OD1-OG 3.09Å; D243-S245 PolarHBondContact OD2-OG 3.31Å; S245-A247 PolarHBondContact O-N 3.4Å
246	L	43.4	Very low	48.9	Very low	15 Å²	15	102.6 Å²	102.6	8%	0.079	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-61.1	-24.4	168.7	-61.7	178.6	0	0	0	113	R210 I237 R238 D243 Y244	R210-L246 HydrophobicContact CB-CD2 4.47Å; R210-L246 VanDerWaalsContact CD-CD2 3.48Å; R210-L246 HydrophobicContact CG-CD2 3.74Å; R210-L246 PolarHBondContact NH2-O 3.1Å; I237-L246 HydrophobicContact CG2-CD1 4.19Å; R238-L246 HydrophobicContact CG-CB 4.27Å; R238-L246 HydrophobicContact CG-CD1 3.95Å; D243-L246 HydrophobicContact CB-CD1 4.09Å; D243-L246 HydrophobicContact CB-CG 3.9Å; D243-L246 VanDerWaalsContact O-CB 3.26Å; D243-L246 WeakPolarHBondContact O-CB 3.35Å; D243-L246 WeakPolarHBondContact O-CD1 3.45Å; D243-L246 WeakPolarHBondContact O-CG 3.3Å; D243-L246 PolarHBondContact O-N 2.91Å; Y244-L246 PolarHBondContact O-N 3.39Å; Y244-L246 VanDerWaalsContact O-N 3.11Å
247	A	34.5	Very low	47.2	Very low	27 Å²	27	102.3 Å²	102.3	22%	0.223	54%	0.537	C	S	.	.	G	3₁₀ helix	trans	-107	22.8	-170.7	0	0	0	0	0	115.7	Y244 S245 V249	Y244-A247 PolarHBondContact O-N 2.74Å; Y244-A247 VanDerWaalsContact O-N 3.07Å; S245-A247 PolarHBondContact O-N 3.4Å; A247-V249 PolarHBondContact O-N 2.93Å
248	M	34	Very low	45.8	Very low	155 Å²	155	110.5 Å²	110.5	76%	0.764	58%	0.581	S	S	*	*			trans	-70.9	55.2	179.8	-68.7	-60.6	-51	0	0	115.4
249	V	38.2	Very low	44.5	Very low	67 Å²	67	111.5 Å²	111.5	41%	0.406	61%	0.605	S	S	.	*			trans	-144.9	70.4	145.4	-173.7	0	0	0	0	107	S127 A247	S127-V249 WeakPolarHBondContact OG-CG2 3.44Å; A247-V249 PolarHBondContact O-N 2.93Å
250	E	34.6	Very low	42.9	Very low	157 Å²	157	115.1 Å²	115.1	73%	0.734	62%	0.618	S	S	*	*			trans	-100.5	86.4	159.4	-75.8	170.1	174.8	0	0	106.3	E252	E250-E252 PolarHBondContact O-N 2.87Å
251	D	36.9	Very low	41.9	Very low	150 Å²	150	117.4 Å²	117.4	80%	0.802	63%	0.632	S	S	*	*			trans	-84.4	94.1	162.8	-69.6	-44.6	0	0	0	106.3	E253	D251-E253 PolarHBondContact O-N 3.38Å
252	E	40.3	Very low	40.6	Very low	174 Å²	174	117.4 Å²	117.4	81%	0.813	65%	0.645	S	S	*	*			trans	-71.5	123.5	174.7	-68.2	-152.9	137.5	0	0	111.2	E250 D254	E250-E252 PolarHBondContact O-N 2.87Å; E252-D254 PolarHBondContact O-N 3.02Å
253	E	36.1	Very low	39.5	Very low	170 Å²	170	121.1 Å²	121.1	79%	0.794	66%	0.663	S	S	*	*			trans	41.4	63.4	154	-54.4	-161.9	152.6	0	0	119.2	D251 T255	D251-E253 PolarHBondContact O-N 3.38Å; E253-T255 PolarHBondContact O-N 2.95Å
254	D	37.9	Very low	38.4	Very low	143 Å²	143	123.8 Å²	123.8	77%	0.765	68%	0.682	S	S	*	*			trans	-85.8	74.3	150.5	-89	-24.2	0	0	0	109.5	E252	E252-D254 PolarHBondContact O-N 3.02Å
255	T	40.8	Very low	37.8	Very low	118 Å²	118	122.4 Å²	122.4	72%	0.724	69%	0.691	S	S	*	*			trans	-114.1	33.9	174.3	48.1	0	0	0	0	113.9	E253 G257	E253-T255 PolarHBondContact O-N 2.95Å; T255-G257 PolarHBondContact O-N 3.45Å
256	D	36.8	Very low	37.1	Very low	172 Å²	172	128.5 Å²	128.5	92%	0.92	71%	0.711	S	S	*	*			trans	-68	91.5	166.2	-79.6	-13.3	0	0	0	110.4
257	G	38.2	Very low	36.6	Very low	67 Å²	67	133 Å²	133	69%	0.691	74%	0.741	S	S	*	*			trans	-147.4	73.4	-174.7	0	0	0	0	0	113.3	T255 A259	T255-G257 PolarHBondContact O-N 3.45Å; G257-A259 PolarHBondContact O-N 3.25Å; G257-A259 VanDerWaalsContact O-N 3.11Å
258	D	39.1	Very low	36.5	Very low	175 Å²	175	141.2 Å²	141.2	94%	0.936	77%	0.774	S	S	*	*			trans	-59.5	106.7	178.3	-73.3	-53	0	0	0	113.3
259	A	37.8	Very low	36.2	Very low	92 Å²	92	142.7 Å²	142.7	76%	0.76	77%	0.771	S	S	*	*			trans	-165.5	87	155	0	0	0	0	0	112.7	G257 L261	G257-A259 PolarHBondContact O-N 3.25Å; G257-A259 VanDerWaalsContact O-N 3.11Å; A259-L261 PolarHBondContact O-N 2.85Å
260	E	39.1	Very low	36	Very low	185 Å²	185	145.5 Å²	145.5	86%	0.864	79%	0.791	S	S	*	*			trans	12.7	100.5	139.6	-169.2	-179.9	-172	0	0	118.1
261	L	40.5	Very low	35.8	Very low	171 Å²	171	147.8 Å²	147.8	90%	0.895	79%	0.793	S	S	*	*			trans	176.1	102.8	130	-93.4	165.1	0	0	0	113.9	A259	A259-L261 PolarHBondContact O-N 2.85Å
262	V	38	Very low	35.7	Very low	128 Å²	128	146.4 Å²	146.4	78%	0.776	79%	0.79	S	S	*	*			trans	-74.7	159.5	169.8	158.4	0	0	0	0	110.3
263	P	34.2	Very low	35.4	Very low	105 Å²	105	145.8 Å²	145.8	68%	0.682	79%	0.792	S	S	*	*			cis	-137.3	148.8	23.6	16.5	11.3	0	0	0	120.7
264	T	32	Very low	35.2	Very low	104 Å²	104	142 Å²	142	64%	0.638	78%	0.784	S	S	*	*			trans	30.1	135.1	133.3	68.9	0	0	0	0	123.4	F266	T264-F266 HydrophobicContact CG2-CE2 4.41Å
265	T	34.7	Very low	35.2	Very low	139 Å²	139	142.4 Å²	142.4	85%	0.853	79%	0.786	S	S	*	*				-155	135.6	120	-69	0	0	0	0	108.9
266	F	31.8	Very low	35	Very low	184 Å²	184	142 Å²	142	81%	0.807	79%	0.788	S	S	*	*			trans	-104.4	-154.4	-178.6	-67.9	-89	0	0	0	111.8	T264	T264-F266 HydrophobicContact CG2-CE2 4.41Å
267	P	32.9	Very low	34.9	Very low	111 Å²	111	138.7 Å²	138.7	72%	0.721	78%	0.778	S	S	*	*				-126.3	177.2	-104.5	40	-21.9	0	0	0	114.2
268	H	32.6	Very low	34.6	Very low	198 Å²	198	142.9 Å²	142.9	92%	0.917	78%	0.784	S	S	*	*			trans	-113.3	108	170.8	-75	-49.3	0	0	0	113.4
269	R	27.7	Very low	34.3	Very low	186 Å²	186	139.4 Å²	139.4	70%	0.702	77%	0.773	S	S	*	*			trans	-110.3	127.3	158.4	161.7	-171.3	-94.5	174.8	-3.1	107.6	R271	R269-R271 HydrophobicContact CG-CG 4.39Å
270	P	34	Very low	34.2	Very low	126 Å²	126	140.1 Å²	140.1	82%	0.818	77%	0.773	S	S	*	*			trans	-76.7	128.6	160.5	-7.7	25.1	0	0	0	109.8
271	R	31.2	Very low	34.2	Very low	205 Å²	205	138.9 Å²	138.9	77%	0.774	77%	0.767	S	S	*	*			trans	-136.6	137.5	156.4	-94	-172.6	175.4	176.4	-4	107.9	R269	R269-R271 HydrophobicContact CG-CG 4.39Å
272	T	34.9	Very low	33.9	Very low	122 Å²	122	137.5 Å²	137.5	75%	0.748	76%	0.76	S	S	*	*			trans	-83	143.4	177.4	47.7	0	0	0	0	111.1
273	L	32.7	Very low	33.7	Very low	161 Å²	161	137.5 Å²	137.5	84%	0.843	76%	0.76	S	S	*	*			trans	47.5	132.6	132.2	-58.9	173.7	0	0	0	118.7
274	S	33.4	Very low	33.6	Very low	89 Å²	89	136.3 Å²	136.3	62%	0.622	77%	0.767	S	S	*	*			cis	-151.8	161.1	12.4	-56.6	0	0	0	0	111
275	D	37.2	Very low	33.8	Very low	153 Å²	153	143 Å²	143	82%	0.818	78%	0.781	S	S	*	*				157.4	151.9	107.4	-90.5	-26.4	0	0	0	116.2
276	S	36	Very low	33.9	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	77%	0.773	S	S	*	*			trans	71.3	115.1	158.9	64.3	0	0	0	0	121.9
277	S	35	Very low	34.2	Very low	103 Å²	103	142.1 Å²	142.1	72%	0.72	78%	0.777	S	S	*	*				96.4	97.7	127.7	64.2	0	0	0	0	124.4
278	L	32.7	Very low	34.4	Very low	156 Å²	156	142 Å²	142	82%	0.817	78%	0.779	S	S	*	*				74.9	99.5	122.2	-59.9	176.2	0	0	0	122.8
279	S	32	Very low	34.7	Very low	101 Å²	101	136.8 Å²	136.8	71%	0.706	77%	0.77	S	S	*	*				93.9	144.1	111.3	-64	0	0	0	0	123.4
280	S	36.9	Very low	35.1	Very low	108 Å²	108	133 Å²	133	76%	0.755	77%	0.772	S	S	*	*			trans	76.8	142	163.8	77.9	0	0	0	0	118.3
281	Q	37.4	Very low	35.3	Very low	159 Å²	159	133.7 Å²	133.7	74%	0.743	77%	0.768	S	S	*	*			cis	-163.3	145.6	-11.8	-117.5	-178.5	49.8	0	0	111.2
282	L	33.9	Very low	35.5	Very low	142 Å²	142	131.1 Å²	131.1	74%	0.743	77%	0.765	S	S	*	*			trans	62.5	148.7	152.2	-55.6	172	0	0	0	119
283	T	34.3	Very low	35.5	Very low	127 Å²	127	131.6 Å²	131.6	78%	0.779	76%	0.763	S	S	*	*			cis	-156.7	136.3	-1.2	18.4	0	0	0	0	112.3
284	G	33.4	Very low	35.6	Very low	81 Å²	81	129.6 Å²	129.6	84%	0.835	76%	0.758	S	S	*	*			trans	78.4	162	154.9	0	0	0	0	0	118.4
285	R	34.7	Very low	35.4	Very low	245 Å²	245	130 Å²	130	93%	0.925	76%	0.759	S	S	*	*			cis	-175.8	139.9	-9.2	-172.8	-177.4	-167.7	179.3	3.6	108.5
286	S	38.3	Very low	35.4	Very low	98 Å²	98	130.2 Å²	130.2	69%	0.685	76%	0.755	S	S	*	*			cis	-171.8	173.3	-20.4	-77.8	0	0	0	0	108
287	K	36.9	Very low	35.2	Very low	205 Å²	205	129.5 Å²	129.5	89%	0.891	75%	0.75	S	S	*	*			trans	97.7	144	171.6	-61.6	179.5	176.4	-175.6	0	117.1
288	S	36.9	Very low	35.2	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	75%	0.751	S	S	*	*			cis	179.5	162.2	-32.6	45.7	0	0	0	0	111.4
289	A	38.8	Very low	35.4	Very low	90 Å²	90	132.8 Å²	132.8	74%	0.744	75%	0.754	S	S	*	*			trans	79.8	113.4	175.5	0	0	0	0	0	115.3
290	S	37.1	Very low	35.6	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	76%	0.755	S	S	*	*				86	138.2	51.8	71.8	0	0	0	0	112.4
291	L	37.4	Very low	35.5	Very low	140 Å²	140	134.8 Å²	134.8	73%	0.733	76%	0.759	S	S	*	*			cis	-156.8	130.8	30.3	-164	64.5	0	0	0	107.4
292	E	35.6	Very low	35.2	Very low	151 Å²	151	133.8 Å²	133.8	71%	0.706	76%	0.759	S	S	*	*				55.8	141.2	88.9	-63.7	157.2	-144.8	0	0	114
293	D	35.7	Very low	35.2	Very low	132 Å²	132	134.4 Å²	134.4	71%	0.706	76%	0.762	S	S	*	*			cis	-163.3	151.5	7	-123.8	19.4	0	0	0	111.9
294	V	34	Very low	35.1	Very low	120 Å²	120	134.8 Å²	134.8	73%	0.727	76%	0.76	S	S	*	*				64.2	147	100	172.3	0	0	0	0	117.1
295	C	29.3	Very low	35	Very low	98 Å²	98	141.4 Å²	141.4	66%	0.662	76%	0.759	S	S	*	*			cis	-173	-175.2	-34.7	-162	0	0	0	0	110
296	H	36.8	Very low	34.7	Very low	157 Å²	157	134.7 Å²	134.7	73%	0.727	75%	0.75	S	S	*	*			trans	75.5	122.6	167.2	-54.7	-65.5	0	0	0	118
297	S	32.3	Very low	34.6	Very low	93 Å²	93	136 Å²	136	65%	0.65	76%	0.76	S	S	*	*				104.2	149.2	81.3	-87.8	0	0	0	0	112.1
298	D	35.5	Very low	34.2	Very low	140 Å²	140	136.2 Å²	136.2	75%	0.749	76%	0.76	S	S	*	*			cis	-153	152.8	0.1	-89.9	-30.2	0	0	0	113
299	Q	35.7	Very low	33.8	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	77%	0.768	S	S	*	*			trans	59.2	163.3	147.7	-72.1	-147.7	1.5	0	0	123.7
300	P	37.6	Very low	33.3	Very low	111 Å²	111	137.4 Å²	137.4	72%	0.721	76%	0.762	S	S	*	*			trans	-126.1	-179.4	-154	45.2	-32.8	0	0	0	116.5
301	V	34.8	Very low	33.2	Very low	139 Å²	139	139.5 Å²	139.5	84%	0.842	77%	0.77	S	S	*	*			trans	-160.6	158.6	146	131.1	0	0	0	0	111
302	N	30.4	Very low	32.8	Very low	139 Å²	139	140.5 Å²	140.5	74%	0.743	78%	0.775	S	S	*	*			trans	-64.2	163.6	179.5	-50.5	-80.1	0	0	0	112.8
303	L	34.8	Very low	32.5	Very low	154 Å²	154	136.7 Å²	136.7	81%	0.806	78%	0.776	S	S	*	*				-170.4	142.9	69.5	-151.6	76.9	0	0	0	114.2
304	D	32.2	Very low	32.5	Very low	136 Å²	136	137.3 Å²	137.3	73%	0.727	79%	0.785	S	S	*	*			trans	53.9	127.3	147.1	-98.3	-41	0	0	0	126.7
305	R	30.8	Very low	32.4	Very low	219 Å²	219	136.7 Å²	136.7	83%	0.826	78%	0.782	S	S	*	*				89.1	94.7	120.1	-156.4	167.7	-163.9	-141	6.6	122.1
306	S	28.8	Very low	32.8	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	79%	0.785	S	S	*	*			trans	64.5	115.8	130.3	175.9	0	0	0	0	120.9
307	S	35.9	Very low	32.9	Very low	126 Å²	126	138.3 Å²	138.3	88%	0.881	79%	0.789	S	S	*	*			trans	-149.1	132.5	138.6	-80.2	0	0	0	0	111.2
308	K	28.3	Very low	33.2	Very low	208 Å²	208	142.2 Å²	142.2	90%	0.904	80%	0.797	S	S	*	*			trans	-79	152.3	163.5	-74.7	176.1	176.3	173.7	0	109
309	C	29.2	Very low	33	Very low	135 Å²	135	142 Å²	142	91%	0.912	80%	0.795	S	S	*	*			trans	-136.1	144.9	152	-150.3	0	0	0	0	110
310	S	27.6	Very low	33	Very low	89 Å²	89	142.3 Å²	142.3	62%	0.622	79%	0.793	S	S	*	*			trans	-123.9	159.8	-169.5	49.6	0	0	0	0	111.4
311	V	34.6	Very low	32.6	Very low	150 Å²	150	142.5 Å²	142.5	91%	0.909	79%	0.792	S	S	*	*			trans	-123.5	138.2	163.5	-178.7	0	0	0	0	107.6
312	L	28.1	Very low	32.8	Very low	160 Å²	160	142.8 Å²	142.8	84%	0.838	79%	0.794	S	S	*	*			trans	-104.7	166.6	-163.5	-63.8	97.6	0	0	0	113.7
313	G	29.4	Very low	33.1	Very low	71 Å²	71	140.5 Å²	140.5	73%	0.732	79%	0.789	S	S	*	*			trans	122.2	127.4	154.9	0	0	0	0	0	114.4
314	T	37	Very low	33	Very low	145 Å²	145	140.7 Å²	140.7	89%	0.89	79%	0.791	S	S	*	*			cis	-143.6	171.2	-5.1	52.6	0	0	0	0	110.6
315	T	31.8	Very low	33.2	Very low	107 Å²	107	138.7 Å²	138.7	66%	0.656	79%	0.793	S	S	*	*			trans	-80.3	174.9	-176.3	45.6	0	0	0	0	114.3
316	D	37.4	Very low	33.4	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	79%	0.794	S	S	*	*				160.4	91.6	122.3	-74.3	1	0	0	0	106.1
317	D	38.6	Very low	33.6	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	80%	0.799	S	S	*	*				67.2	139.7	95.8	-71.9	-38.2	0	0	0	113.8
318	E	39.6	Very low	33.5	Very low	176 Å²	176	137.4 Å²	137.4	82%	0.822	79%	0.788	S	S	*	*			cis	-135.5	161.1	31.4	-168.8	-173.9	140.4	0	0	112.5
319	L	30.7	Very low	33.6	Very low	134 Å²	134	136.3 Å²	136.3	70%	0.702	78%	0.784	S	S	*	*			trans	-129.3	136.3	-175.1	-175.4	149.1	0	0	0	111.9	V321	L319-V321 HydrophobicContact CD2-CB 4.36Å; L319-V321 HydrophobicContact CD2-CG2 4.04Å; L319-V321 HydrophobicContact CG-CG2 4.45Å
320	K	35.8	Very low	33.8	Very low	195 Å²	195	138.2 Å²	138.2	85%	0.848	78%	0.777	S	S	*	*			trans	-139.7	118.3	161.1	-108.3	172.4	-175.1	165.2	0	111.7
321	V	29	Very low	33.9	Very low	115 Å²	115	144.5 Å²	144.5	70%	0.697	79%	0.787	S	S	*	*			trans	-131.2	133	174.4	174.3	0	0	0	0	107.1	L319	L319-V321 HydrophobicContact CD2-CB 4.36Å; L319-V321 HydrophobicContact CD2-CG2 4.04Å; L319-V321 HydrophobicContact CG-CG2 4.45Å
322	V	39.1	Very low	33.9	Very low	146 Å²	146	143.8 Å²	143.8	89%	0.885	78%	0.783	S	S	*	*			trans	-138.1	145.7	159.4	-176.9	0	0	0	0	106.5
323	S	35.7	Very low	34.2	Very low	91 Å²	91	141.7 Å²	141.7	64%	0.636	78%	0.779	S	S	*	*			trans	-100.5	152.8	-160.2	50	0	0	0	0	115.3
324	D	33.7	Very low	34.3	Very low	157 Å²	157	142.8 Å²	142.8	84%	0.84	78%	0.775	S	S	*	*			trans	31.7	121.4	138.1	-46.2	-33.5	0	0	0	120.8
325	A	36.6	Very low	34.1	Very low	94 Å²	94	145 Å²	145	78%	0.777	77%	0.773	S	S	*	*				-174.9	112.5	119	0	0	0	0	0	113.2
326	D	34.1	Very low	34.3	Very low	156 Å²	156	144.4 Å²	144.4	83%	0.834	77%	0.773	S	S	*	*			trans	39.1	158.1	143.6	-62.1	-39.4	0	0	0	126.4
327	I	34	Very low	34	Very low	165 Å²	165	145.6 Å²	145.6	85%	0.846	78%	0.779	S	S	*	*			trans	88.9	131.2	161.5	-48.9	-169.6	0	0	0	117.7
328	P	33.2	Very low	33.9	Very low	102 Å²	102	143.7 Å²	143.7	66%	0.662	78%	0.775	S	S	*	*			trans	-129	-173.2	-157.9	26.1	0.4	0	0	0	116.6
329	F	30.1	Very low	33.5	Very low	186 Å²	186	140 Å²	140	82%	0.816	77%	0.769	S	S	*	*			trans	76.6	106.6	163.5	-65.9	-80	0	0	0	120.7
330	K	33.1	Very low	33.9	Very low	174 Å²	174	142 Å²	142	76%	0.757	77%	0.774	S	S	*	*				178.5	136.2	101.5	-95.2	154.9	-171.2	164.8	0	115.7
331	R	31.1	Very low	33.6	Very low	221 Å²	221	141.1 Å²	141.1	83%	0.834	77%	0.771	S	S	*	*			trans	58.7	93.7	139.8	-62.5	178.5	-170.8	163.4	-0.1	121.9
332	V	34	Very low	33.8	Very low	135 Å²	135	140.2 Å²	140.2	82%	0.818	77%	0.769	S	S	*	*				-8.3	144.7	108.7	169.2	0	0	0	0	115.2
333	P	34.2	Very low	33.5	Very low	116 Å²	116	138.7 Å²	138.7	75%	0.753	76%	0.761	S	S	*	*			cis	-135.8	-179.2	32.4	21.1	5.8	0	0	0	119.2
334	S	30.6	Very low	33.4	Very low	94 Å²	94	142.2 Å²	142.2	66%	0.657	77%	0.771	S	S	*	*			trans	-58.7	166.4	169.4	53.7	0	0	0	0	117.8
335	F	33.2	Very low	33.4	Very low	192 Å²	192	138 Å²	138	84%	0.842	76%	0.764	S	S	*	*				-167.1	151.1	116.4	-115.5	-77.6	0	0	0	115.3
336	S	36.5	Very low	33.5	Very low	94 Å²	94	141.5 Å²	141.5	66%	0.657	77%	0.77	S	S	*	*			trans	46.5	113.6	153.2	56.5	0	0	0	0	123.9
337	D	31.6	Very low	33.5	Very low	163 Å²	163	142.6 Å²	142.6	87%	0.872	77%	0.77	S	S	*	*			trans	29.8	153	131.1	-69.4	-57.5	0	0	0	126.1
338	P	36.4	Very low	33.7	Very low	111 Å²	111	138.6 Å²	138.6	72%	0.721	76%	0.755	S	S	*	*			trans	-107.7	162	-178.6	41.6	-34.5	0	0	0	115.5
339	S	31.7	Very low	33.7	Very low	100 Å²	100	143 Å²	143	70%	0.699	76%	0.763	S	S	*	*			trans	-175.9	160.5	146.5	45.7	0	0	0	0	113.2
340	H	37.3	Very low	33.6	Very low	175 Å²	175	139.4 Å²	139.4	81%	0.81	76%	0.761	S	S	*	*			trans	65.6	156.2	170.3	-58.6	-79.9	0	0	0	119.1
341	F	31	Very low	33.7	Very low	177 Å²	177	140.8 Å²	140.8	78%	0.776	77%	0.771	S	S	*	*			cis	-171.3	138.1	-36	-169.2	-107.5	0	0	0	108.7
342	S	32.3	Very low	33.8	Very low	95 Å²	95	139.4 Å²	139.4	66%	0.664	77%	0.773	S	S	*	*			trans	65.5	157.8	163.7	77.1	0	0	0	0	117.8
343	T	33.2	Very low	33.4	Very low	115 Å²	115	140.5 Å²	140.5	71%	0.706	77%	0.774	S	S	*	*			cis	-169	152.2	-11.4	-108	0	0	0	0	112.2
344	I	34	Very low	33.3	Very low	165 Å²	165	142.7 Å²	142.7	85%	0.846	78%	0.779	S	S	*	*			trans	67.3	138.9	167.5	-77.3	158.4	0	0	0	118.5
345	G	34.1	Very low	33.2	Very low	67 Å²	67	143.6 Å²	143.6	69%	0.691	78%	0.781	S	S	*	*			trans	162.5	45.1	174	0	0	0	0	0	119.3
346	D	37.4	Very low	33.2	Very low	168 Å²	168	141.1 Å²	141.1	90%	0.898	78%	0.775	S	S	*	*			trans	63.4	157	159.3	-57.7	-35.1	0	0	0	123.6
347	E	35.2	Very low	33	Very low	180 Å²	180	145.8 Å²	145.8	84%	0.841	78%	0.783	S	S	*	*			trans	-113.1	-176.5	-173.9	-108	-139.5	140.9	0	0	111.1
348	P	36.7	Very low	32.7	Very low	81 Å²	81	149.5 Å²	149.5	53%	0.526	79%	0.785	S	S	.	*			cis	-135.8	170.1	-42.3	35.4	-19.6	0	0	0	113.8
349	K	33.9	Very low	32.4	Very low	193 Å²	193	150.5 Å²	150.5	84%	0.839	79%	0.793	S	S	*	*				177.2	125.4	127.3	-97	150.1	-170.1	164.4	0	115.1
350	S	29	Very low	32.3	Very low	111 Å²	111	152.2 Å²	152.2	78%	0.776	80%	0.8	S	S	*	*			trans	36.4	104.6	138.8	-54.9	0	0	0	0	121.1
351	Q	35.3	Very low	32.1	Very low	204 Å²	204	149.4 Å²	149.4	95%	0.953	80%	0.795	S	S	*	*				-152.5	148.2	128.2	-111.4	162	58.3	0	0	111
352	Q	32	Very low	32.2	Very low	191 Å²	191	146.7 Å²	146.7	89%	0.893	80%	0.796	S	S	*	*			trans	-99.7	160.1	-160.4	-74.8	-175.1	-19	0	0	115.4	N354	Q352-N354 PolarHBondContact O-N 3.19Å
353	L	26.5	Very low	31.9	Very low	159 Å²	159	151 Å²	151	83%	0.832	81%	0.805	S	S	*	*			trans	-49.9	127.9	171.6	-102.9	63.1	0	0	0	113.2	T355	L353-T355 VanDerWaalsContact C-N 3.34Å; L353-T355 PolarHBondContact O-N 2.92Å
354	N	31.4	Very low	31.8	Very low	162 Å²	162	151.7 Å²	151.7	87%	0.866	81%	0.809	S	S	*	*			trans	-78.1	80.6	166.6	-94.6	-43.1	0	0	0	111.5	Q352 I356	Q352-N354 PolarHBondContact O-N 3.19Å; N354-I356 PolarHBondContact O-N 2.64Å; N354-I356 VanDerWaalsContact O-N 3.1Å
355	T	28.9	Very low	31.4	Very low	113 Å²	113	152 Å²	152	69%	0.693	80%	0.804	S	S	*	*			trans	-68.4	101.5	170.8	-58.6	0	0	0	0	110.3	L353 K357	L353-T355 VanDerWaalsContact C-N 3.34Å; L353-T355 PolarHBondContact O-N 2.92Å; T355-K357 PolarHBondContact O-N 2.93Å
356	I	33.3	Very low	31.2	Very low	140 Å²	140	154.1 Å²	154.1	72%	0.718	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-69.5	122.1	179.9	-61.9	-178.7	0	0	0	110.1	N354	N354-I356 PolarHBondContact O-N 2.64Å; N354-I356 VanDerWaalsContact O-N 3.1Å
357	K	31.5	Very low	30.9	Very low	191 Å²	191	153.9 Å²	153.9	83%	0.83	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.4	146.7	-166.3	-63.4	168.1	-179.8	172.7	0	113	T355	T355-K357 PolarHBondContact O-N 2.93Å
358	R	26.7	Very low	30.5	Very low	241 Å²	241	153.4 Å²	153.4	91%	0.909	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-64.8	138.7	160.6	-64.8	177.6	-178.1	163.4	0.6	108.6	T360	R358-T360 PolarHBondContact O-N 3.19Å
359	C	28.5	Very low	30.2	Very low	132 Å²	132	156.5 Å²	156.5	89%	0.892	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-68.9	130.2	172.9	-62.5	0	0	0	0	110.4
360	T	31	Very low	29.9	Very low	136 Å²	136	153.2 Å²	153.2	83%	0.834	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-80	136.1	174.6	36	0	0	0	0	111.2	R358	R358-T360 PolarHBondContact O-N 3.19Å
361	T	32.3	Very low	29.9	Very low	116 Å²	116	151.3 Å²	151.3	71%	0.712	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-74.4	137.2	161.2	44.1	0	0	0	0	109.3	E363	T361-E363 PolarHBondContact O-N 3.27Å
362	P	33.1	Very low	29.7	Very low	121 Å²	121	148.2 Å²	148.2	79%	0.786	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.6	129.5	174.9	28.7	-33.5	0	0	0	110.6
363	E	26.3	Very low	29.5	Very low	184 Å²	184	145.2 Å²	145.2	86%	0.86	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-73.4	127.1	167.7	-65	-172.2	130.9	0	0	109.8	T361	T361-E363 PolarHBondContact O-N 3.27Å
364	V	31.7	Very low	29.8	Very low	130 Å²	130	143.4 Å²	143.4	79%	0.788	81%	0.807	S	S	*	*			trans	-104.3	113.4	162.1	178.7	0	0	0	0	107.6
365	K	25.4	Very low	29.6	Very low	171 Å²	171	142.2 Å²	142.2	74%	0.743	80%	0.801	S	S	*	*			trans	-101	103.1	-169.4	-174.2	175.6	-176.7	173.1	0	110.3
366	C	29	Very low	29.7	Very low	112 Å²	112	145.4 Å²	145.4	76%	0.757	81%	0.808	S	S	*	*			trans	-112	143.2	170.8	-66.1	0	0	0	0	110.1
367	H	30.9	Very low	29.5	Very low	163 Å²	163	144.7 Å²	144.7	76%	0.755	81%	0.81	S	S	*	*			trans	-85.7	157	-161.9	-83	-124.1	0	0	0	114.2
368	L	26.5	Very low	29.4	Very low	170 Å²	170	144.3 Å²	144.3	89%	0.89	81%	0.813	S	S	*	*			trans	-64.6	134.9	172.8	-74.4	66.6	0	0	0	111.1
369	T	30.6	Very low	29.5	Very low	146 Å²	146	137.7 Å²	137.7	90%	0.896	80%	0.804	S	S	*	*			trans	-131.4	148.4	133.1	48.6	0	0	0	0	109.3
370	S	27.6	Very low	29.8	Very low	125 Å²	125	138.8 Å²	138.8	87%	0.874	80%	0.801	S	S	*	*			trans	-103	142.4	-170.8	54.3	0	0	0	0	112.3
371	G	28.4	Very low	29.8	Very low	70 Å²	70	136.7 Å²	136.7	72%	0.722	79%	0.791	S	S	*	*			trans	174	97.3	167	0	0	0	0	0	117
372	T	32	Very low	29.8	Very low	140 Å²	140	139.7 Å²	139.7	86%	0.859	80%	0.795	S	S	*	*			trans	43.4	114.5	134.6	-47.9	0	0	0	0	120.3
373	T	27.5	Very low	29.8	Very low	128 Å²	128	142.1 Å²	142.1	79%	0.785	80%	0.796	S	S	*	*			trans	-71.7	151.7	160.7	53.2	0	0	0	0	111.8
374	P	32.1	Very low	29.9	Very low	120 Å²	120	139.3 Å²	139.3	78%	0.779	79%	0.791	S	S	*	*				-143.3	-169.1	107.4	37.7	-22.7	0	0	0	114
375	N	28.8	Very low	30.2	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	79%	0.793	S	S	*	*			trans	-106.7	176.1	-176.3	-55.3	-92.1	0	0	0	112.6
376	E	29.7	Very low	30.4	Very low	180 Å²	180	139.5 Å²	139.5	84%	0.841	80%	0.797	S	S	*	*			trans	90.8	120.6	148.9	-71.5	-170.1	146	0	0	121.5
377	V	29.2	Very low	30.8	Very low	124 Å²	124	143.8 Å²	143.8	75%	0.752	80%	0.803	S	S	*	*			trans	61	111.5	135.1	-175.9	0	0	0	0	119.6
378	M	30.6	Very low	30.9	Very low	183 Å²	183	141 Å²	141	90%	0.901	80%	0.801	S	S	*	*				-145.9	151.7	124.2	-161.2	64.6	161.1	0	0	108.7
379	S	29.3	Very low	31.1	Very low	102 Å²	102	139.1 Å²	139.1	71%	0.713	80%	0.797	S	S	*	*			trans	-109.2	156	174	-55.9	0	0	0	0	109.8
380	D	34.3	Very low	31.2	Very low	156 Å²	156	142.2 Å²	142.2	83%	0.834	80%	0.797	S	S	*	*			trans	-150.8	170.4	137.7	-135.9	-33.4	0	0	0	112.8
381	S	29.9	Very low	31.2	Very low	91 Å²	91	144.7 Å²	144.7	64%	0.636	80%	0.795	S	S	*	*			trans	-98.9	170.9	-164.6	-52.3	0	0	0	0	113.3
382	F	32.8	Very low	31.4	Very low	180 Å²	180	151.1 Å²	151.1	79%	0.789	80%	0.803	S	S	*	*				-172.9	113.9	115.3	-103.4	-71.1	0	0	0	113.8
383	Q	32.9	Very low	31.5	Very low	171 Å²	171	153.7 Å²	153.7	80%	0.799	80%	0.803	S	S	*	*			trans	55.8	138.7	147.9	-72.8	173.2	8.7	0	0	124.1
384	V	28.6	Very low	31.5	Very low	125 Å²	125	157.2 Å²	157.2	76%	0.758	81%	0.807	S	S	*	*			trans	-140.5	141.8	166	172.4	0	0	0	0	108.3
385	P	38.8	Very low	31.6	Very low	127 Å²	127	163.2 Å²	163.2	83%	0.825	81%	0.814	S	S	*	*			trans	-106.6	126.2	167	34.4	-26.5	0	0	0	113.4
386	H	29.8	Very low	31.6	Very low	178 Å²	178	163 Å²	163	82%	0.824	82%	0.818	S	S	*	*			trans	-83	149.1	170.1	-83.9	-110	0	0	0	112.8
387	K	35.4	Very low	31.9	Very low	203 Å²	203	166.1 Å²	166.1	88%	0.883	82%	0.822	S	S	*	*			trans	175.8	154.1	145.7	-97.2	150.7	-174.9	177.4	0	110.4
388	S	33.6	Very low	31.9	Very low	104 Å²	104	169.4 Å²	169.4	73%	0.727	83%	0.826	S	S	*	*			cis	-171.1	130	-29.7	50.3	0	0	0	0	110.8
389	V	30.1	Very low	32	Very low	131 Å²	131	169 Å²	169	79%	0.794	82%	0.82	S	S	*	*			trans	0.6	132.6	160.7	-177.7	0	0	0	0	119.6
390	K	33.8	Very low	32.1	Very low	210 Å²	210	174.7 Å²	174.7	91%	0.913	83%	0.825	S	S	*	*			trans	-159.7	120.4	140.3	-115.6	164.8	-171	171	0	114
391	E	27.3	Very low	31.9	Very low	178 Å²	178	175.9 Å²	175.9	83%	0.832	83%	0.831	S	S	*	*			trans	-90	150.9	167.3	-60.1	177.9	97.6	0	0	112.3
392	K	33.4	Very low	32	Very low	204 Å²	204	174.9 Å²	174.9	89%	0.887	84%	0.835	S	S	*	*			trans	165.3	155.7	145.3	-94.4	158.2	-179.1	178.5	0	109.7
393	K	33.6	Very low	32	Very low	194 Å²	194	171.5 Å²	171.5	84%	0.843	83%	0.833	S	S	*	*			cis	-169.6	138.6	-29	178.1	167.6	-177.3	171.5	0	107.7
394	K	28.4	Very low	32.1	Very low	202 Å²	202	170.3 Å²	170.3	88%	0.878	83%	0.827	S	S	*	*			trans	-47.6	139.2	176	-86.1	176	170.9	172	0	113.6
395	R	32.6	Very low	32.4	Very low	247 Å²	247	170.8 Å²	170.8	93%	0.932	82%	0.821	S	S	*	*			trans	-154.5	150.8	145.8	-141.1	172.1	-174.2	176.9	1.7	112.6
396	T	30.1	Very low	32.3	Very low	134 Å²	134	171.6 Å²	171.6	82%	0.822	81%	0.814	S	S	*	*			trans	-139.1	144.1	-171.7	42.6	0	0	0	0	112.6
397	R	34.5	Very low	32.4	Very low	244 Å²	244	168.9 Å²	168.9	92%	0.921	81%	0.805	S	S	*	*			trans	178.7	130.9	164.2	-101.9	172.1	177.2	-169.6	-2.6	105.5
398	K	31.1	Very low	32.3	Very low	193 Å²	193	167.4 Å²	167.4	84%	0.839	80%	0.802	S	S	*	*			cis	77.4	102.3	12.2	-149.6	174.9	-169.4	171.2	0	116.2
399	K	30.8	Very low	32.4	Very low	175 Å²	175	168.7 Å²	168.7	76%	0.761	81%	0.805	S	S	*	*				139.1	148.5	114.3	-146.3	178.3	-174.9	-179.1	0	114.7
400	R	32.2	Very low	32.7	Very low	222 Å²	222	167.3 Å²	167.3	84%	0.838	80%	0.801	S	S	*	*			trans	79.7	131.1	169	-59.2	174.8	169.4	151.4	-6.1	115.7
401	L	30.7	Very low	32.6	Very low	181 Å²	181	164 Å²	164	95%	0.948	79%	0.793	S	S	*	*			cis	95.1	127.3	12	-159.1	115.3	0	0	0	116.1
402	G	32	Very low	33.1	Very low	70 Å²	70	160.5 Å²	160.5	72%	0.722	79%	0.789	S	S	*	*			trans	116.6	124.8	-172.4	0	0	0	0	0	110.5
403	S	31.9	Very low	33.2	Very low	108 Å²	108	159.8 Å²	159.8	76%	0.755	79%	0.785	S	S	*	*			cis	119.3	141.5	-3	-157.7	0	0	0	0	114.5
404	H	34.7	Very low	33.2	Very low	146 Å²	146	157.8 Å²	157.8	68%	0.676	78%	0.783	S	S	*	*			trans	82.1	133.3	166.3	-82.9	-81	0	0	0	123.5
405	H	35.9	Very low	33.4	Very low	135 Å²	135	156.6 Å²	156.6	63%	0.625	78%	0.783	S	S	*	*			trans	74.3	121.4	140.6	-67.1	-37.6	0	0	0	119.7
406	H	36	Very low	33.5	Very low	144 Å²	144	153.1 Å²	153.1	67%	0.667	78%	0.777	S	S	*	*				86.5	146.3	92.1	-74.4	-44.7	0	0	0	112.5
407	D	32.4	Very low	33.8	Very low	122 Å²	122	152 Å²	152	65%	0.652	77%	0.772	S	S	*	*			cis	-159.1	157	-1.5	-116.3	-18.8	0	0	0	114.1
408	E	33.2	Very low	33.8	Very low	172 Å²	172	146.1 Å²	146.1	80%	0.804	76%	0.759	S	S	*	*			trans	68.3	168.8	135.1	-155.7	173.7	-166.5	0	0	122.7
409	V	35.7	Very low	34.3	Very low	131 Å²	131	146.7 Å²	146.7	79%	0.794	76%	0.757	S	S	*	*			trans	91.8	118.4	166.8	-174.7	0	0	0	0	114.6
410	S	35.8	Very low	34.6	Very low	101 Å²	101	145.3 Å²	145.3	71%	0.706	76%	0.757	S	S	*	*			cis	-160.4	-164.1	-3.7	-149.9	0	0	0	0	114.8
411	N	32.2	Very low	34.8	Very low	140 Å²	140	139.4 Å²	139.4	75%	0.749	75%	0.75	S	S	*	*			trans	-52.8	172.2	172.2	-69.7	-70.2	0	0	0	117.1
412	S	38.5	Very low	35.1	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	75%	0.745	S	S	*	*			cis	-159.9	152.9	2.7	28.7	0	0	0	0	108.3
413	K	34.8	Very low	35.8	Very low	188 Å²	188	142 Å²	142	82%	0.817	75%	0.748	S	S	*	*			cis	85.6	94.4	33	-160.7	-171.5	-169.9	-176.2	0	116.1
414	L	33.2	Very low	36.1	Very low	153 Å²	153	144.8 Å²	144.8	80%	0.801	75%	0.754	S	S	*	*			trans	177.8	119.5	144.5	-117.2	60	0	0	0	108.6
415	M	34.2	Very low	36.5	Very low	176 Å²	176	143 Å²	143	87%	0.867	76%	0.755	S	S	*	*				99.6	136	75.9	-77.6	-170.8	93.7	0	0	115.7
416	Q	34.5	Very low	36.8	Very low	175 Å²	175	142 Å²	142	82%	0.818	76%	0.764	S	S	*	*			trans	-94.5	165.3	171.2	-75.4	179.3	-23.5	0	0	110.1
417	P	35.3	Very low	37.4	Very low	110 Å²	110	140.6 Å²	140.6	71%	0.714	77%	0.768	S	S	*	*				-158.8	153.3	77.5	41.2	-19.2	0	0	0	120.9
418	N	34.7	Very low	37.9	Very low	120 Å²	120	140.2 Å²	140.2	64%	0.642	77%	0.772	S	S	*	*			trans	57.3	158.5	136.7	-63.3	-3.7	0	0	0	125.6
419	Y	41.2	Very low	38	Very low	206 Å²	206	139.4 Å²	139.4	81%	0.808	77%	0.773	S	S	*	*			trans	80.2	141.5	162.8	-50.5	-71.3	0	0	0	117.9
420	L	38.2	Very low	38.1	Very low	145 Å²	145	139 Å²	139	76%	0.759	77%	0.771	S	S	*	*			cis	-167.7	137.1	-19.1	176.6	62.7	0	0	0	110.5
421	S	35.2	Very low	38.2	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	77%	0.77	S	S	*	*			trans	53.3	137.7	162.3	-62.1	0	0	0	0	120.4
422	T	38.2	Very low	38.6	Very low	136 Å²	136	137.9 Å²	137.9	83%	0.834	77%	0.769	S	S	*	*				-163.5	165.5	77	-62.8	0	0	0	0	111.7
423	H	45.2	Very low	38.7	Very low	170 Å²	170	139 Å²	139	79%	0.787	77%	0.771	S	S	*	*			trans	-71.4	152.5	-169.8	-67.6	-108.1	0	0	0	117
424	D	38.6	Very low	39.1	Very low	165 Å²	165	134 Å²	134	88%	0.882	76%	0.76	S	S	*	*				-154.5	145.3	119.3	-141.2	3.5	0	0	0	110.4
425	P	43.6	Very low	39.8	Very low	108 Å²	108	132 Å²	132	70%	0.701	76%	0.758	S	S	*	*			trans	-114.4	140.7	-170.4	38.4	-28	0	0	0	115.8
426	S	42.8	Very low	41.4	Very low	116 Å²	116	129.9 Å²	129.9	81%	0.811	76%	0.755	S	S	*	*			trans	-151	174.4	168.1	84.7	0	0	0	0	110.2
427	P	47.3	Very low	43.4	Very low	114 Å²	114	125 Å²	125	74%	0.74	73%	0.732	S	S	*	*			trans	-81.2	164.9	-133.2	-10.3	28.6	0	0	0	116.7
428	P	43.7	Very low	45.9	Very low	114 Å²	114	124.1 Å²	124.1	74%	0.74	73%	0.727	S	S	*	*			trans	-80	121.7	-169.8	30.9	-35.2	0	0	0	114.9	T430	P428-T430 PolarHBondContact O-N 2.88Å
429	D	34.8	Very low	48.5	Very low	154 Å²	154	122.8 Å²	122.8	82%	0.824	72%	0.724	S	S	*	*			trans	-62.6	99	168.5	-79.6	-48.8	0	0	0	112	S431	D429-S431 PolarHBondContact O-N 2.82Å
430	T	37.8	Very low	50.9	Low	122 Å²	122	114.8 Å²	114.8	75%	0.748	70%	0.695	S	S	*	*			trans	-78.7	72.4	171.7	-53.3	0	0	0	0	109.7	P428 V432	P428-T430 PolarHBondContact O-N 2.88Å; T430-V432 VanDerWaalsContact C-N 3.3Å; T430-V432 HydrophobicContact CG2-CG2 4.06Å; T430-V432 PolarHBondContact O-N 2.81Å
431	S	39.1	Very low	53.4	Low	98 Å²	98	112.7 Å²	112.7	69%	0.685	69%	0.689	S	S	*	*			trans	-71.2	80.7	178	45.7	0	0	0	0	111.2	D429 V433	D429-S431 PolarHBondContact O-N 2.82Å; S431-V433 VanDerWaalsContact C-N 3.27Å; S431-V433 PolarHBondContact O-N 2.82Å
432	V	40.1	Very low	56	Low	121 Å²	121	109.3 Å²	109.3	73%	0.733	66%	0.664	S	S	*	*			trans	-68.6	86	172.5	-174.5	0	0	0	0	109.3	T430 S434	T430-V432 VanDerWaalsContact C-N 3.3Å; T430-V432 HydrophobicContact CG2-CG2 4.06Å; T430-V432 PolarHBondContact O-N 2.81Å; V432-S434 PolarHBondContact O-N 2.79Å
433	V	40	Very low	58	Low	130 Å²	130	103.8 Å²	103.8	79%	0.788	64%	0.635	S	S	*	*			trans	-65.9	85.7	169.9	-178.3	0	0	0	0	108.4	S431 S435	S431-V433 VanDerWaalsContact C-N 3.27Å; S431-V433 PolarHBondContact O-N 2.82Å; V433-S435 PolarHBondContact O-N 2.99Å
434	S	42.6	Very low	59.5	Low	82 Å²	82	102.5 Å²	102.5	57%	0.573	64%	0.641	S	S	*	*			trans	-67.8	103.7	176.4	58	0	0	0	0	109.9	V432 V436	V432-S434 PolarHBondContact O-N 2.79Å; S434-V436 PolarHBondContact O-N 3.46Å
435	S	49.4	Very low	61.4	Low	111 Å²	111	98.8 Å²	98.8	78%	0.776	64%	0.642	S	S	*	*			trans	-62.4	108.5	174.6	42.7	0	0	0	0	109.9	V433 E437	V433-S435 PolarHBondContact O-N 2.99Å; S435-E437 PolarHBondContact O-N 2.62Å; S435-E437 VanDerWaalsContact O-N 3.07Å
436	V	66.7	Low	63.4	Low	131 Å²	131	95 Å²	95	79%	0.794	62%	0.615	S	S	*	*			trans	-73.8	100.9	178.8	-176.4	0	0	0	0	108.5	S434	S434-V436 PolarHBondContact O-N 3.46Å
437	E	77.6	Confident	65.7	Low	73 Å²	73	94.3 Å²	94.3	34%	0.341	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-62.4	128.8	174.9	-176.8	162.8	-151	0	0	110.3	S435 K550 Y579	S435-E437 PolarHBondContact O-N 2.62Å; S435-E437 VanDerWaalsContact O-N 3.07Å; E437-K550 WeakPolarHBondContact OE1-CE 3.22Å; E437-K550 IonicContact OE1-NZ 3.58Å; E437-K550 PolarHBondContact OE1-NZ 3.43Å; E437-K550 IonicContact OE2-NZ 3.12Å; E437-Y579 HydrophobicContact CB-CE1 4.16Å; E437-Y579 HydrophobicContact CG-CE1 4.19Å
438	P	86.9	Confident	67.9	Low	92 Å²	92	91.6 Å²	91.6	60%	0.597	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-68.5	155.6	-174.2	26.5	-36.2	0	0	0	113.2
439	P	90.3	Very high	70.1	Confident	92 Å²	92	87 Å²	87	60%	0.597	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-56.5	138.7	172.1	-23.9	33.6	0	0	0	112.3	V580	P439-V580 HydrophobicContact CB-CG1 4.46Å; P439-V580 HydrophobicContact CG-CG1 4.46Å
440	I	90.4	Very high	72.8	Confident	37 Å²	37	82 Å²	82	19%	0.19	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-101.6	141.2	-174	-62.5	-176.4	0	0	0	110.1	K550 R551 L578 Y579	I440-K550 HydrophobicContact CD1-CB 3.55Å; I440-K550 HydrophobicContact CD1-CD 3.86Å; I440-K550 HydrophobicContact CD1-CG 3.81Å; I440-R551 HydrophobicContact CG2-CB 4.41Å; I440-L578 WeakPolarHBondContact O-CB 3.01Å; I440-Y579 HydrophobicContact CD1-CD1 4.35Å; I440-Y579 HydrophobicContact CG1-CD1 4.33Å; I440-Y579 PolarHBondContact N-O 2.87Å
441	T	91.6	Very high	75.5	Confident	102 Å²	102	79.6 Å²	79.6	63%	0.626	51%	0.512	S	S	*	.			trans	-111.8	171.7	176.7	58.2	0	0	0	0	111.9	R551	T441-R551 WeakPolarHBondContact O-CD 3.42Å; T441-R551 PolarHBondContact O-NH1 2.86Å
442	C	90.2	Very high	78.2	Confident	27 Å²	27	78.1 Å²	78.1	18%	0.182	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-55.8	151.1	160	-55.9	0	0	0	0	110.3	H446 H448	C442-H446 HydrophobicContact CB-CB 4Å; C442-H448 PolarHBondContact SG-CE1 3.37Å; C442-H448 PolarHBondContact SG-NE2 3.16Å; C442-H448 VanDerWaalsContact SG-NE2 3.36Å
443	G	80.1	Confident	80.9	Confident	20 Å²	20	74 Å²	74	21%	0.206	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-76.4	157.3	-177.3	0	0	0	0	0	112.8	G445 H446	G443-G445 PolarHBondContact O-N 3.36Å; G443-H446 VanDerWaalsContact O-CB 3.23Å; G443-H446 WeakPolarHBondContact O-CB 3.45Å; G443-H446 PolarHBondContact O-N 2.94Å
444	P	76.1	Confident	83.6	Confident	143 Å²	143	68 Å²	68	93%	0.929	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	121.9	168.2	26.9	-33.2	0	0	0	109.3
445	G	77.7	Confident	86.1	Confident	88 Å²	88	68.7 Å²	68.7	91%	0.907	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.3	-0.9	-173.5	0	0	0	0	0	115.6	G443	G443-G445 PolarHBondContact O-N 3.36Å
446	H	87.2	Confident	88.4	Confident	27 Å²	27	65.1 Å²	65.1	13%	0.125	41%	0.405	C	S	.	.			trans	-74.2	126.2	170.6	178.6	89.3	0	0	0	111.2	C442 G443 H448 E545 C576	C442-H446 HydrophobicContact CB-CB 4Å; G443-H446 VanDerWaalsContact O-CB 3.23Å; G443-H446 WeakPolarHBondContact O-CB 3.45Å; G443-H446 PolarHBondContact O-N 2.94Å; H446-H448 AromaticContact CD2-CE1 3.18Å; H446-H448 PolarHBondContact CD2-CE1 3.46Å; H446-H448 AromaticContact CD2-ND1 3.61Å; H446-H448 AromaticContact CD2-NE2 3.59Å; H446-H448 AromaticContact NE2-CE1 3Å; H446-H448 PolarHBondContact NE2-CE1 2.76Å; H446-H448 AromaticContact NE2-ND1 3.29Å; H446-H448 PolarHBondContact NE2-ND1 3.37Å; H446-H448 AromaticContact NE2-NE2 3.89Å; H446-E545 IonicContact CE1-OE2 2.74Å; H446-E545 IonicContact CG-OE2 2.81Å; H446-E545 IonicContact ND1-OE2 3.66Å; H446-E545 PolarHBondContact ND1-OE2 3.16Å; H446-C576 PolarHBondContact NE2-SG 3.29Å
447	D	90.7	Very high	89.8	Confident	103 Å²	103	61.9 Å²	61.9	55%	0.551	38%	0.384	S	S	*	.			trans	-97.3	148.9	178.1	-177.5	34.9	0	0	0	112.8	R574	D447-R574 WeakPolarHBondContact O-CD 3.45Å; D447-R574 PolarHBondContact O-NH1 3.23Å
448	H	92.3	Very high	90.6	Very high	56 Å²	56	58.5 Å²	58.5	26%	0.259	37%	0.368	S	S	.	.			trans	-117.9	87.5	179.3	-74.1	-47	0	0	0	110	C442 H446 G450 H588 S590	C442-H448 PolarHBondContact SG-CE1 3.37Å; C442-H448 PolarHBondContact SG-NE2 3.16Å; C442-H448 VanDerWaalsContact SG-NE2 3.36Å; H446-H448 AromaticContact CD2-CE1 3.18Å; H446-H448 PolarHBondContact CD2-CE1 3.46Å; H446-H448 AromaticContact CD2-ND1 3.61Å; H446-H448 AromaticContact CD2-NE2 3.59Å; H446-H448 AromaticContact NE2-CE1 3Å; H446-H448 PolarHBondContact NE2-CE1 2.76Å; H446-H448 AromaticContact NE2-ND1 3.29Å; H446-H448 PolarHBondContact NE2-ND1 3.37Å; H446-H448 AromaticContact NE2-NE2 3.89Å; H448-G450 PolarHBondContact O-N 3.48Å; H448-H588 AromaticContact CD2-CE1 3.52Å; H448-H588 AromaticContact CD2-ND1 3.97Å; H448-H588 AromaticContact CE1-CE1 3.45Å; H448-H588 PolarHBondContact CE1-CE1 2.88Å; H448-H588 VanDerWaalsContact CE1-CE1 3.45Å; H448-H588 AromaticContact CE1-ND1 3.13Å; H448-H588 PolarHBondContact CE1-ND1 3Å; H448-H588 AromaticContact CG-CE1 3.58Å; H448-H588 AromaticContact ND1-CE1 3.53Å; H448-H588 AromaticContact ND1-ND1 3.51Å; H448-H588 AromaticContact NE2-CE1 3.43Å; H448-H588 PolarHBondContact NE2-CE1 2.83Å; H448-H588 AromaticContact NE2-ND1 3.42Å; H448-H588 PolarHBondContact NE2-ND1 3.37Å; H448-S590 WeakPolarHBondContact CA-OG 3.49Å
449	P	90.4	Very high	91	Very high	17 Å²	17	55.7 Å²	55.7	11%	0.11	35%	0.35	C	S	.	.			trans	-65.3	123.6	-167.6	24.8	-34.7	0	0	0	112.9	R574 S590 S591 Q592	P449-R574 HydrophobicContact CG-CB 3.79Å; P449-S590 CarbonylContact O-C 3.57Å; P449-S591 CarbonylContact O-C 3.57Å; P449-S591 VanDerWaalsContact O-C 3.28Å; P449-S591 PolarHBondContact O-N 2.97Å; P449-Q592 HydrophobicContact CB-CB 4.48Å
450	G	92.1	Very high	91.1	Very high	50 Å²	50	51.3 Å²	51.3	52%	0.515	32%	0.321	S	S	.	.	S	Bend	trans	80.4	-128.9	173.8	0	0	0	0	0	113.5	H448	H448-G450 PolarHBondContact O-N 3.48Å
451	R	93.7	Very high	91.2	Very high	71 Å²	71	50.4 Å²	50.4	27%	0.268	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.1	-174.4	177.1	170.6	173.6	171.9	-0.7	110.5	G242 Y453 S590 S591 H612	G242-R451 VanDerWaalsContact O-CZ 3.28Å; G242-R451 PolarHBondContact O-NH1 2.95Å; G242-R451 PolarHBondContact O-NH2 3.34Å; R451-Y453 HydrophobicContact CB-CE2 4.04Å; R451-Y453 HydrophobicContact CG-CE2 4.34Å; R451-Y453 WeakPolarHBondContact O-CD2 3.18Å; R451-Y453 VanDerWaalsContact O-CE2 3.29Å; R451-Y453 WeakPolarHBondContact O-CE2 3.49Å; R451-S590 CarbonylContact O-C 3.42Å; R451-S590 VanDerWaalsContact O-CA 3.3Å; R451-S590 WeakPolarHBondContact O-CA 3.4Å; R451-S591 PolarHBondContact N-O 2.68Å; R451-S591 PolarHBondContact O-N 3.37Å; R451-H612 PolarHBondContact NH1-CE1 2.88Å; R451-H612 PolarHBondContact NH1-NE2 3.13Å
452	V	96.2	Very high	91.3	Very high	67 Å²	67	45.5 Å²	45.5	41%	0.406	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130	170.8	-179.8	0	0	0	0	110.2	A454 N455 H588 V589	V452-A454 WeakPolarHBondContact CG1-O 3.47Å; V452-N455 HydrophobicContact CG1-CB 4.18Å; V452-H588 WeakPolarHBondContact CG1-NE2 3.23Å; V452-H588 WeakPolarHBondContact CG2-NE2 3.21Å; V452-V589 WeakPolarHBondContact CA-O 3.44Å
453	Y	96.7	Very high	91.4	Very high	34 Å²	34	45.8 Å²	45.8	13%	0.133	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	-25.8	176.8	-73.4	-88.9	0	0	0	113.2	R451 V589 H612 L615 F619	R451-Y453 HydrophobicContact CB-CE2 4.04Å; R451-Y453 HydrophobicContact CG-CE2 4.34Å; R451-Y453 WeakPolarHBondContact O-CD2 3.18Å; R451-Y453 VanDerWaalsContact O-CE2 3.29Å; R451-Y453 WeakPolarHBondContact O-CE2 3.49Å; Y453-V589 PolarHBondContact N-O 3.25Å; Y453-H612 AromaticContact CE1-CE1 3.66Å; Y453-H612 AromaticContact CE1-ND1 3.21Å; Y453-H612 WeakPolarHBondContact CE1-ND1 3.35Å; Y453-H612 AromaticContact CZ-ND1 3.42Å; Y453-H612 WeakPolarHBondContact OH-CA 3.15Å; Y453-H612 PolarHBondContact OH-ND1 2.85Å; Y453-L615 HydrophobicContact CD1-CB 3.77Å; Y453-L615 HydrophobicContact CE1-CB 3.36Å; Y453-L615 HydrophobicContact CE1-CD1 4.4Å; Y453-L615 HydrophobicContact CE2-CB 4.29Å; Y453-L615 HydrophobicContact CE2-CD1 4.13Å; Y453-L615 HydrophobicContact CG-CB 4.36Å; Y453-F619 HydrophobicContact CD1-CD2 4.16Å; Y453-F619 HydrophobicContact CD2-CD2 4.41Å; Y453-F619 AromaticContact CG-CD2 3.74Å; Y453-F619 HydrophobicContact CG-CD2 3.74Å; Y453-F619 HydrophobicContact CG-CE2 4.29Å
454	A	96.1	Very high	91.9	Very high	5 Å²	5	44.8 Å²	44.8	4%	0.041	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	137.3	171.9	0	0	0	0	0	109.9	V452 H588 V589	V452-A454 WeakPolarHBondContact CG1-O 3.47Å; A454-H588 CarbonylContact O-C 3.56Å; A454-H588 VanDerWaalsContact O-CA 3.3Å; A454-H588 WeakPolarHBondContact O-CA 3.2Å; A454-H588 PolarHBondContact O-CD2 3.34Å; A454-V589 HydrophobicContact CB-CB 4.17Å; A454-V589 HydrophobicContact CB-CG2 4.15Å; A454-V589 PolarHBondContact N-O 2.92Å; A454-V589 PolarHBondContact O-N 2.91Å
455	N	96.2	Very high	92.8	Very high	96 Å²	96	38 Å²	38	51%	0.513	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	73.9	167.9	-166.8	-3	0	0	0	108.5	V452 L587 H588	V452-N455 HydrophobicContact CG1-CB 4.18Å; N455-L587 WeakPolarHBondContact CA-O 3.36Å; N455-H588 VanDerWaalsContact CG-CD2 3.45Å
456	T	96.4	Very high	93.5	Very high	36 Å²	36	35.2 Å²	35.2	22%	0.221	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.3	-169	72.9	0	0	0	0	113.3	L587 T623	T456-L587 PolarHBondContact N-O 2.72Å; T456-L587 PolarHBondContact O-N 2.86Å; T456-T623 HydrophobicContact CG2-CG2 4.04Å; T456-T623 WeakPolarHBondContact OG1-CG2 3.23Å
457	D	96.4	Very high	93.7	Very high	64 Å²	64	35.7 Å²	35.7	34%	0.342	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	128.8	172.2	-62.7	-32	0	0	0	110.1	R586 K627	D457-R586 VanDerWaalsContact CG-NH2 3.35Å; D457-R586 WeakPolarHBondContact OD1-CB 3.4Å; D457-R586 IonicContact OD1-CZ 2.75Å; D457-R586 VanDerWaalsContact OD1-CZ 3.32Å; D457-R586 IonicContact OD1-NE 2.73Å; D457-R586 PolarHBondContact OD1-NE 2.89Å; D457-R586 IonicContact OD1-NH2 3.59Å; D457-R586 PolarHBondContact OD1-NH2 3.42Å; D457-R586 VanDerWaalsContact OD1-NH2 3.08Å; D457-R586 IonicContact OD2-CZ 3.53Å; D457-R586 IonicContact OD2-NE 2.73Å; D457-R586 IonicContact OD2-NH2 3.46Å; D457-R586 PolarHBondContact OD2-NH2 3.04Å; D457-K627 WeakPolarHBondContact O-CE 3.24Å
458	I	95.6	Very high	93.8	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.7	178.6	-52.2	-59.3	0	0	0	108.2	L460 L465 T584 S585 L587 T623 L626 K627	I458-L460 HydrophobicContact CG2-CB 4.28Å; I458-L460 HydrophobicContact CG2-CD1 4.08Å; I458-L460 HydrophobicContact CG2-CG 4.03Å; I458-L460 PolarHBondContact O-N 3.11Å; I458-L465 HydrophobicContact CB-CD1 4.31Å; I458-L465 HydrophobicContact CG1-CD1 4.21Å; I458-L465 HydrophobicContact CG2-CD1 4.08Å; I458-T584 VanDerWaalsContact O-CA 3.31Å; I458-T584 WeakPolarHBondContact O-CA 3.45Å; I458-S585 PolarHBondContact N-O 2.88Å; I458-S585 PolarHBondContact O-N 2.83Å; I458-L587 HydrophobicContact CD1-CB 4.43Å; I458-L587 HydrophobicContact CG1-CB 3.82Å; I458-T623 HydrophobicContact CD1-CG2 4.28Å; I458-L626 HydrophobicContact CD1-CB 4.27Å; I458-L626 HydrophobicContact CD1-CD1 4.49Å; I458-L626 HydrophobicContact CG2-CB 4.01Å; I458-K627 HydrophobicContact CD1-CG 4.15Å
459	P	94.1	Very high	93.9	Very high	33 Å²	33	28.3 Å²	28.3	21%	0.214	16%	0.158	C	C	.	.	S	Bend	trans	-75.4	39.9	-179.9	6.3	5.2	0	0	0	114.6	T583 A630 R638	P459-T583 CarbonylContact C-O 3.44Å; P459-T583 VanDerWaalsContact O-O 3.14Å; P459-A630 HydrophobicContact CB-CB 4.06Å; P459-A630 HydrophobicContact CG-CB 3.85Å; P459-R638 VanDerWaalsContact O-CZ 3.28Å; P459-R638 PolarHBondContact O-NE 3.34Å; P459-R638 PolarHBondContact O-NH2 3.32Å
460	L	92.6	Very high	94	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	-121.6	150.4	175.8	-64	175.4	0	0	0	110.3	I458 A464 L465 C468 T583 T584 S585 L626 A630 L633 R638	I458-L460 HydrophobicContact CG2-CB 4.28Å; I458-L460 HydrophobicContact CG2-CD1 4.08Å; I458-L460 HydrophobicContact CG2-CG 4.03Å; I458-L460 PolarHBondContact O-N 3.11Å; L460-A464 HydrophobicContact CB-CB 4.26Å; L460-L465 HydrophobicContact CB-CB 4.28Å; L460-L465 HydrophobicContact CD1-CD1 4.35Å; L460-C468 HydrophobicContact CD1-CB 4.46Å; L460-T583 PolarHBondContact N-O 2.81Å; L460-T584 CarbonylContact O-C 3.57Å; L460-T584 WeakPolarHBondContact O-CA 3.28Å; L460-S585 WeakPolarHBondContact O-CB 3.22Å; L460-S585 PolarHBondContact O-N 3.34Å; L460-S585 PolarHBondContact O-OG 3.34Å; L460-L626 HydrophobicContact CD1-CD2 4.31Å; L460-A630 HydrophobicContact CD2-CB 3.69Å; L460-A630 HydrophobicContact CG-CB 3.81Å; L460-L633 HydrophobicContact CD2-CD1 4.05Å; L460-R638 HydrophobicContact CD2-CB 4.42Å; L460-R638 HydrophobicContact CD2-CG 4.2Å
461	N	92.6	Very high	93.9	Very high	18 Å²	18	26.3 Å²	26.3	10%	0.096	14%	0.136	C	C	.	.			trans	-59.2	149.1	162.6	-176	-84.9	0	0	0	110.3	N463 A464 L465 R582 R638 L639	N461-N463 PolarHBondContact O-N 2.83Å; N461-N463 VanDerWaalsContact O-N 3.14Å; N461-N463 WeakPolarHBondContact OD1-CB 3.41Å; N461-N463 PolarHBondContact OD1-N 3.43Å; N461-A464 HydrophobicContact CB-CB 4.29Å; N461-A464 WeakPolarHBondContact O-CA 3.43Å; N461-A464 PolarHBondContact O-N 3.47Å; N461-L465 PolarHBondContact O-N 2.84Å; N461-R582 WeakPolarHBondContact CB-O 3.17Å; N461-R582 PolarHBondContact ND2-O 3.44Å; N461-R638 VanDerWaalsContact CB-O 3.29Å; N461-R638 WeakPolarHBondContact CB-O 2.76Å; N461-R638 PolarHBondContact N-O 3.31Å; N461-L639 WeakPolarHBondContact CB-O 3.39Å
462	V	93.6	Very high	93.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.1	-30.2	-178.7	72.8	0	0	0	0	113.2	F466 G549 Y552 L577	V462-F466 WeakPolarHBondContact O-CB 3.45Å; V462-F466 PolarHBondContact O-N 2.97Å; V462-G549 VanDerWaalsContact CG1-C 3.48Å; V462-G549 VanDerWaalsContact CG1-O 3.24Å; V462-G549 WeakPolarHBondContact CG1-O 3.49Å; V462-Y552 HydrophobicContact CG1-CE2 4.39Å; V462-Y552 HydrophobicContact CG2-CD2 4.01Å; V462-Y552 HydrophobicContact CG2-CE2 4.22Å; V462-L577 HydrophobicContact CG2-CB 3.97Å; V462-L577 WeakPolarHBondContact CG2-O 3.34Å
463	N	91.7	Very high	93.2	Very high	32 Å²	32	24.4 Å²	24.4	17%	0.171	13%	0.129	C	C	.	.	H	α-helix	trans	-73.6	-39	173.5	-65.3	-25.9	0	0	0	112.7	N461 F466 R467 G549 Y552	N461-N463 PolarHBondContact O-N 2.83Å; N461-N463 VanDerWaalsContact O-N 3.14Å; N461-N463 WeakPolarHBondContact OD1-CB 3.41Å; N461-N463 PolarHBondContact OD1-N 3.43Å; N463-F466 PolarHBondContact O-N 3.46Å; N463-R467 WeakPolarHBondContact O-CG 3.5Å; N463-R467 PolarHBondContact O-N 2.92Å; N463-G549 WeakPolarHBondContact OD1-CA 3.48Å; N463-Y552 WeakPolarHBondContact OD1-CE2 3.19Å; N463-Y552 PolarHBondContact OD1-OH 2.78Å
464	A	91.6	Very high	92.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-68.5	-39.9	175.3	0	0	0	0	0	110.9	L460 N461 R467 C468	L460-A464 HydrophobicContact CB-CB 4.26Å; N461-A464 HydrophobicContact CB-CB 4.29Å; N461-A464 WeakPolarHBondContact O-CA 3.43Å; N461-A464 PolarHBondContact O-N 3.47Å; A464-R467 PolarHBondContact O-N 2.99Å; A464-C468 PolarHBondContact O-N 3.15Å; A464-C468 PolarHBondContact O-SG 3.42Å; A464-C468 VanDerWaalsContact O-SG 3.37Å
465	L	94.8	Very high	92.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.3	-43.6	172.5	-177.5	64.4	0	0	0	111.9	I458 L460 N461 R467 C468 I469 L577 S585 L587 L626	I458-L465 HydrophobicContact CB-CD1 4.31Å; I458-L465 HydrophobicContact CG1-CD1 4.21Å; I458-L465 HydrophobicContact CG2-CD1 4.08Å; L460-L465 HydrophobicContact CB-CB 4.28Å; L460-L465 HydrophobicContact CD1-CD1 4.35Å; N461-L465 PolarHBondContact O-N 2.84Å; L465-R467 VanDerWaalsContact C-N 3.34Å; L465-R467 PolarHBondContact O-N 2.95Å; L465-C468 PolarHBondContact O-N 3.32Å; L465-I469 HydrophobicContact CD1-CD1 3.74Å; L465-I469 HydrophobicContact CD1-CG1 4.38Å; L465-I469 HydrophobicContact CG-CD1 4.16Å; L465-I469 PolarHBondContact O-N 3.26Å; L465-L577 HydrophobicContact CB-CD2 4.43Å; L465-L577 HydrophobicContact CD2-CB 4.26Å; L465-L577 HydrophobicContact CD2-CD2 4.15Å; L465-L577 HydrophobicContact CD2-CG 4.04Å; L465-L577 HydrophobicContact CG-CD2 3.93Å; L465-L577 HydrophobicContact CG-CG 4.34Å; L465-S585 WeakPolarHBondContact CD2-OG 3.39Å; L465-L587 HydrophobicContact CD2-CB 4.23Å; L465-L626 HydrophobicContact CD1-CD1 3.97Å; L465-L626 HydrophobicContact CD1-CD2 4.1Å
466	F	93.4	Very high	92.4	Very high	30 Å²	30	20.9 Å²	20.9	13%	0.132	11%	0.109	C	C	.	.	H	α-helix	trans	-58	-46.3	173.3	178.7	-81.5	0	0	0	111.1	V462 N463 I469 F470 Y552 I554 L577	V462-F466 WeakPolarHBondContact O-CB 3.45Å; V462-F466 PolarHBondContact O-N 2.97Å; N463-F466 PolarHBondContact O-N 3.46Å; F466-I469 PolarHBondContact O-N 3.23Å; F466-F470 HydrophobicContact CD1-CB 4.44Å; F466-F470 HydrophobicContact CD2-CB 4.39Å; F466-F470 HydrophobicContact CD2-CD2 4.29Å; F466-F470 HydrophobicContact CE1-CB 4.23Å; F466-F470 HydrophobicContact CE2-CB 4.2Å; F466-F470 HydrophobicContact CZ-CB 4.1Å; F466-F470 WeakPolarHBondContact O-CA 3.14Å; F466-F470 WeakPolarHBondContact O-CB 3.47Å; F466-F470 PolarHBondContact O-N 3.03Å; F466-Y552 HydrophobicContact CB-CD2 3.92Å; F466-Y552 HydrophobicContact CB-CE2 4.03Å; F466-Y552 HydrophobicContact CD2-CD1 4.13Å; F466-Y552 AromaticContact CD2-CD2 3.82Å; F466-Y552 HydrophobicContact CD2-CD2 3.82Å; F466-Y552 HydrophobicContact CD2-CE2 4.33Å; F466-Y552 AromaticContact CD2-CG 3.71Å; F466-Y552 HydrophobicContact CD2-CG 3.71Å; F466-Y552 HydrophobicContact CE2-CD1 4.37Å; F466-Y552 HydrophobicContact CE2-CG 4.32Å; F466-Y552 HydrophobicContact CG-CD2 4.19Å; F466-Y552 HydrophobicContact CG-CE2 4.36Å; F466-I554 HydrophobicContact CD2-CD1 4.06Å; F466-I554 HydrophobicContact CE2-CD1 3.72Å; F466-L577 HydrophobicContact CB-CD2 3.98Å
467	R	90.9	Very high	92.1	Very high	36 Å²	36	22.4 Å²	22.4	14%	0.136	12%	0.122	C	C	.	.	H	α-helix	trans	-63.1	-42.2	176.7	-72.7	169.5	175.1	-170.2	-12.5	112.6	N463 A464 L465 I469 T471 S473 T640 L644 T655	N463-R467 WeakPolarHBondContact O-CG 3.5Å; N463-R467 PolarHBondContact O-N 2.92Å; A464-R467 PolarHBondContact O-N 2.99Å; L465-R467 VanDerWaalsContact C-N 3.34Å; L465-R467 PolarHBondContact O-N 2.95Å; R467-I469 VanDerWaalsContact C-N 3.33Å; R467-I469 PolarHBondContact O-N 3.24Å; R467-T471 PolarHBondContact O-N 3.45Å; R467-T471 PolarHBondContact O-OG1 3.01Å; R467-S473 WeakPolarHBondContact O-CB 3.38Å; R467-S473 PolarHBondContact O-OG 2.79Å; R467-T640 PolarHBondContact NH1-O 2.91Å; R467-L644 HydrophobicContact CB-CD1 3.93Å; R467-T655 PolarHBondContact NH2-OG1 3.21Å
468	C	92.1	Very high	91.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.1	-42.9	176.1	-75	0	0	0	0	112.8	L460 A464 L465 S473 F475 L626 L644	L460-C468 HydrophobicContact CD1-CB 4.46Å; A464-C468 PolarHBondContact O-N 3.15Å; A464-C468 PolarHBondContact O-SG 3.42Å; A464-C468 VanDerWaalsContact O-SG 3.37Å; L465-C468 PolarHBondContact O-N 3.32Å; C468-S473 PolarHBondContact O-OG 3.28Å; C468-F475 HydrophobicContact CB-CD1 3.92Å; C468-F475 HydrophobicContact CB-CG 4.35Å; C468-F475 WeakPolarHBondContact O-CD1 3.21Å; C468-L626 HydrophobicContact CB-CD2 3.76Å; C468-L644 VanDerWaalsContact SG-CD1 3.55Å
469	I	93.9	Very high	91.8	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-97.7	-33.2	-171.1	-54.2	171	0	0	0	112.7	L465 F466 R467 L587 I622 L626	L465-I469 HydrophobicContact CD1-CD1 3.74Å; L465-I469 HydrophobicContact CD1-CG1 4.38Å; L465-I469 HydrophobicContact CG-CD1 4.16Å; L465-I469 PolarHBondContact O-N 3.26Å; F466-I469 PolarHBondContact O-N 3.23Å; R467-I469 VanDerWaalsContact C-N 3.33Å; R467-I469 PolarHBondContact O-N 3.24Å; I469-L587 HydrophobicContact CD1-CD1 4Å; I469-L587 HydrophobicContact CD1-CD2 4.11Å; I469-I622 HydrophobicContact CG1-CD1 4.5Å; I469-I622 HydrophobicContact CG2-CD1 4.49Å; I469-L626 HydrophobicContact CD1-CD1 3.91Å; I469-L626 HydrophobicContact CG1-CD1 4.23Å; I469-L626 HydrophobicContact CG1-CD2 4.36Å
470	F	93.2	Very high	91.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-115.7	17.2	-166.4	-60.9	-80.3	0	0	0	114.8	F466 W493 R516 I554 Y575 L577	F466-F470 HydrophobicContact CD1-CB 4.44Å; F466-F470 HydrophobicContact CD2-CB 4.39Å; F466-F470 HydrophobicContact CD2-CD2 4.29Å; F466-F470 HydrophobicContact CE1-CB 4.23Å; F466-F470 HydrophobicContact CE2-CB 4.2Å; F466-F470 HydrophobicContact CZ-CB 4.1Å; F466-F470 WeakPolarHBondContact O-CA 3.14Å; F466-F470 WeakPolarHBondContact O-CB 3.47Å; F466-F470 PolarHBondContact O-N 3.03Å; F470-W493 HydrophobicContact CB-CZ2 4.19Å; F470-W493 HydrophobicContact CD1-CZ2 4.15Å; F470-W493 PolarHBondContact O-NE1 2.86Å; F470-R516 PolarHBondContact O-NH2 3.24Å; F470-I554 HydrophobicContact CB-CD1 4.44Å; F470-I554 HydrophobicContact CD1-CD1 3.56Å; F470-I554 HydrophobicContact CD1-CG2 4.24Å; F470-I554 HydrophobicContact CD2-CD1 3.65Å; F470-I554 HydrophobicContact CE1-CB 4.19Å; F470-I554 HydrophobicContact CE1-CD1 3.63Å; F470-I554 HydrophobicContact CE1-CG2 3.82Å; F470-I554 HydrophobicContact CE2-CD1 3.74Å; F470-I554 HydrophobicContact CG-CD1 3.57Å; F470-I554 HydrophobicContact CZ-CB 4.4Å; F470-I554 HydrophobicContact CZ-CD1 3.72Å; F470-Y575 HydrophobicContact CE1-CD2 4.38Å; F470-Y575 HydrophobicContact CE1-CG 4.45Å; F470-Y575 AromaticContact CZ-CD1 3.79Å; F470-Y575 HydrophobicContact CZ-CD1 3.79Å; F470-Y575 HydrophobicContact CZ-CD2 4.04Å; F470-Y575 HydrophobicContact CZ-CE1 4.24Å; F470-Y575 HydrophobicContact CZ-CE2 4.47Å; F470-Y575 AromaticContact CZ-CG 3.67Å; F470-Y575 HydrophobicContact CZ-CG 3.67Å; F470-L577 HydrophobicContact CD2-CD2 4.21Å; F470-L577 HydrophobicContact CE2-CD1 3.84Å; F470-L577 HydrophobicContact CE2-CD2 4.01Å; F470-L577 HydrophobicContact CZ-CD1 4.46Å
471	T	89.3	Confident	91.6	Very high	25 Å²	25	32.3 Å²	32.3	15%	0.153	16%	0.158	C	C	.	.	S	Bend	trans	-131.2	177.5	164.1	74.8	0	0	0	0	111.1	R467 S473	R467-T471 PolarHBondContact O-N 3.45Å; R467-T471 PolarHBondContact O-OG1 3.01Å; T471-S473 PolarHBondContact O-N 2.95Å
472	D	87	Confident	91.6	Very high	99 Å²	99	37.1 Å²	37.1	53%	0.529	18%	0.179	S	C	.	.	S	Bend	trans	-69	43.9	168.5	56.9	-26.7	0	0	0	113.1
473	S	88.8	Confident	91.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.189	C	C	.	.			trans	-70.6	152.6	-177.5	75.7	0	0	0	0	112.7	R467 C468 T471 F475 F476 S477 L644	R467-S473 WeakPolarHBondContact O-CB 3.38Å; R467-S473 PolarHBondContact O-OG 2.79Å; C468-S473 PolarHBondContact O-OG 3.28Å; T471-S473 PolarHBondContact O-N 2.95Å; S473-F475 PolarHBondContact O-N 3.48Å; S473-F476 PolarHBondContact O-N 3.14Å; S473-F476 PolarHBondContact OG-N 3.25Å; S473-F476 VanDerWaalsContact OG-N 3.11Å; S473-S477 PolarHBondContact O-N 2.93Å; S473-L644 VanDerWaalsContact CA-O 3.31Å; S473-L644 WeakPolarHBondContact CA-O 3.37Å
474	E	87.9	Confident	91.5	Very high	37 Å²	37	39.7 Å²	39.7	17%	0.173	20%	0.196	C	C	.	.	H	α-helix	trans	-60	-32.6	174.7	-177.1	162.2	167.4	0	0	112.3	R478	E474-R478 HydrophobicContact CG-CG 4.4Å; E474-R478 WeakPolarHBondContact O-CB 3.22Å; E474-R478 WeakPolarHBondContact O-CG 3.5Å; E474-R478 PolarHBondContact O-N 3.38Å; E474-R478 IonicContact OE1-CZ 2.8Å; E474-R478 IonicContact OE1-NE 3.32Å; E474-R478 PolarHBondContact OE1-NE 3.1Å; E474-R478 IonicContact OE1-NH2 3.72Å; E474-R478 PolarHBondContact OE1-NH2 2.82Å
475	F	92.2	Very high	91.5	Very high	9 Å²	9	40.7 Å²	40.7	4%	0.039	20%	0.202	C	C	.	.	H	α-helix	trans	-58.8	-52.7	170.3	173.2	-95.2	0	0	0	111.7	C468 S473 S477 R478 F479 I622 K625 L626 F629	C468-F475 HydrophobicContact CB-CD1 3.92Å; C468-F475 HydrophobicContact CB-CG 4.35Å; C468-F475 WeakPolarHBondContact O-CD1 3.21Å; S473-F475 PolarHBondContact O-N 3.48Å; F475-S477 VanDerWaalsContact C-N 3.3Å; F475-S477 PolarHBondContact O-N 2.94Å; F475-R478 PolarHBondContact O-N 2.88Å; F475-F479 HydrophobicContact CE1-CB 4.3Å; F475-F479 HydrophobicContact CZ-CB 4.28Å; F475-F479 VanDerWaalsContact O-CB 3.25Å; F475-F479 WeakPolarHBondContact O-CB 3.26Å; F475-F479 PolarHBondContact O-N 3.05Å; F475-I622 HydrophobicContact CE1-CG1 4.17Å; F475-I622 HydrophobicContact CZ-CG1 4.24Å; F475-K625 HydrophobicContact CE2-CB 3.96Å; F475-K625 WeakPolarHBondContact CE2-O 3.37Å; F475-K625 HydrophobicContact CZ-CB 4.09Å; F475-L626 HydrophobicContact CD1-CD2 4.02Å; F475-L626 HydrophobicContact CE1-CD2 3.5Å; F475-L626 VanDerWaalsContact CE1-CD2 3.5Å; F475-L626 HydrophobicContact CE1-CG 3.87Å; F475-L626 HydrophobicContact CE2-CD2 4.18Å; F475-L626 HydrophobicContact CE2-CG 4.34Å; F475-L626 HydrophobicContact CZ-CB 4.36Å; F475-L626 HydrophobicContact CZ-CD2 3.6Å; F475-L626 HydrophobicContact CZ-CG 3.59Å; F475-F629 HydrophobicContact CB-CD1 4.09Å; F475-F629 HydrophobicContact CB-CE1 3.81Å; F475-F629 HydrophobicContact CB-CE2 4.44Å; F475-F629 HydrophobicContact CB-CZ 4.01Å; F475-F629 HydrophobicContact CD2-CB 3.73Å; F475-F629 AromaticContact CD2-CD1 3.64Å; F475-F629 HydrophobicContact CD2-CD1 3.64Å; F475-F629 HydrophobicContact CD2-CD2 4.1Å; F475-F629 HydrophobicContact CD2-CE1 4.25Å; F475-F629 AromaticContact CD2-CG 3.56Å; F475-F629 HydrophobicContact CD2-CG 3.56Å; F475-F629 HydrophobicContact CE2-CB 3.94Å; F475-F629 HydrophobicContact CE2-CD1 4.49Å; F475-F629 HydrophobicContact CE2-CG 4.28Å; F475-F629 HydrophobicContact CG-CD1 4.08Å; F475-F629 HydrophobicContact CG-CE1 4.3Å; F475-F629 HydrophobicContact CG-CG 4.38Å
476	F	91.5	Very high	91.4	Very high	15 Å²	15	45.7 Å²	45.7	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-65.1	-36.1	-176.7	-163.2	-103.1	0	0	0	112	S473 F479 S480 M488	S473-F476 PolarHBondContact O-N 3.14Å; S473-F476 PolarHBondContact OG-N 3.25Å; S473-F476 VanDerWaalsContact OG-N 3.11Å; F476-F479 HydrophobicContact CD2-CD1 4.48Å; F476-S480 WeakPolarHBondContact O-CB 3.32Å; F476-S480 PolarHBondContact O-N 3.24Å; F476-S480 PolarHBondContact O-OG 3.46Å; F476-M488 HydrophobicContact CE1-CE 3.74Å; F476-M488 HydrophobicContact CE1-SD 4.22Å; F476-M488 HydrophobicContact CZ-CE 4.44Å
477	S	91	Very high	91.2	Very high	68 Å²	68	46.6 Å²	46.6	48%	0.476	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-56.6	174	-169.3	0	0	0	0	111.5	S473 F475 F479 S480 E481	S473-S477 PolarHBondContact O-N 2.93Å; F475-S477 VanDerWaalsContact C-N 3.3Å; F475-S477 PolarHBondContact O-N 2.94Å; S477-F479 VanDerWaalsContact C-N 3.31Å; S477-F479 PolarHBondContact O-N 3.25Å; S477-S480 WeakPolarHBondContact O-CB 3.4Å; S477-S480 PolarHBondContact O-N 3.17Å; S477-S480 VanDerWaalsContact O-N 3.17Å; S477-E481 PolarHBondContact O-N 2.87Å
478	R	92	Very high	91.3	Very high	141 Å²	141	47.7 Å²	47.7	53%	0.532	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-36.6	178	-69.5	177.4	-179	-158.7	1.1	112.6	E474 F475 H482	E474-R478 HydrophobicContact CG-CG 4.4Å; E474-R478 WeakPolarHBondContact O-CB 3.22Å; E474-R478 WeakPolarHBondContact O-CG 3.5Å; E474-R478 PolarHBondContact O-N 3.38Å; E474-R478 IonicContact OE1-CZ 2.8Å; E474-R478 IonicContact OE1-NE 3.32Å; E474-R478 PolarHBondContact OE1-NE 3.1Å; E474-R478 IonicContact OE1-NH2 3.72Å; E474-R478 PolarHBondContact OE1-NH2 2.82Å; F475-R478 PolarHBondContact O-N 2.88Å; R478-H482 WeakPolarHBondContact O-CB 3.35Å; R478-H482 PolarHBondContact O-N 3.13Å
479	F	93.7	Very high	91.3	Very high	7 Å²	7	53.3 Å²	53.3	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-66.2	-41.8	175.4	168.1	-103.7	0	0	0	112.4	F475 F476 S477 H482 R483 F618 T621 I622 K625	F475-F479 HydrophobicContact CE1-CB 4.3Å; F475-F479 HydrophobicContact CZ-CB 4.28Å; F475-F479 VanDerWaalsContact O-CB 3.25Å; F475-F479 WeakPolarHBondContact O-CB 3.26Å; F475-F479 PolarHBondContact O-N 3.05Å; F476-F479 HydrophobicContact CD2-CD1 4.48Å; S477-F479 VanDerWaalsContact C-N 3.31Å; S477-F479 PolarHBondContact O-N 3.25Å; F479-H482 PolarHBondContact O-N 3.26Å; F479-R483 HydrophobicContact CE2-CG 4.15Å; F479-R483 HydrophobicContact CZ-CG 4.38Å; F479-R483 PolarHBondContact O-N 3.34Å; F479-R483 VanDerWaalsContact O-N 3.1Å; F479-F618 HydrophobicContact CE1-CD2 4.34Å; F479-F618 AromaticContact CE1-CE2 3.55Å; F479-F618 HydrophobicContact CE1-CE2 3.55Å; F479-F618 AromaticContact CE1-CZ 3.8Å; F479-F618 HydrophobicContact CE1-CZ 3.8Å; F479-F618 AromaticContact CZ-CD2 3.98Å; F479-F618 HydrophobicContact CZ-CD2 3.98Å; F479-F618 AromaticContact CZ-CE2 3.64Å; F479-F618 HydrophobicContact CZ-CE2 3.64Å; F479-F618 HydrophobicContact CZ-CZ 4.02Å; F479-T621 HydrophobicContact CD2-CG2 4.46Å; F479-T621 HydrophobicContact CE2-CG2 3.89Å; F479-I622 HydrophobicContact CD1-CD1 4.26Å; F479-I622 HydrophobicContact CD1-CG1 4.29Å; F479-I622 HydrophobicContact CD2-CB 4.37Å; F479-I622 HydrophobicContact CD2-CG1 4.17Å; F479-I622 HydrophobicContact CE1-CB 4.26Å; F479-I622 HydrophobicContact CE1-CD1 3.81Å; F479-I622 HydrophobicContact CE1-CG1 3.95Å; F479-I622 HydrophobicContact CE2-CB 3.6Å; F479-I622 HydrophobicContact CE2-CG1 3.83Å; F479-I622 HydrophobicContact CG-CG1 4.39Å; F479-I622 HydrophobicContact CZ-CB 3.54Å; F479-I622 HydrophobicContact CZ-CD1 4Å; F479-I622 HydrophobicContact CZ-CG1 3.72Å; F479-K625 HydrophobicContact CD2-CB 4.48Å
480	S	92	Very high	91.2	Very high	9 Å²	9	55.4 Å²	55.4	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-63.7	-47.4	176.6	-60.4	0	0	0	0	111.2	F476 S477 R483 G484 T485	F476-S480 WeakPolarHBondContact O-CB 3.32Å; F476-S480 PolarHBondContact O-N 3.24Å; F476-S480 PolarHBondContact O-OG 3.46Å; S477-S480 WeakPolarHBondContact O-CB 3.4Å; S477-S480 PolarHBondContact O-N 3.17Å; S477-S480 VanDerWaalsContact O-N 3.17Å; S480-R483 CarbonylContact O-C 3.57Å; S480-R483 PolarHBondContact O-N 2.93Å; S480-G484 PolarHBondContact O-N 3.32Å; S480-T485 WeakPolarHBondContact O-CB 3.38Å; S480-T485 PolarHBondContact O-N 3.13Å
481	E	91	Very high	91.1	Very high	149 Å²	149	57.5 Å²	57.5	70%	0.696	30%	0.302	S	S	*	.	H	α-helix	trans	-59.2	-47.7	175.3	-178	175.2	-143.6	0	0	111.6	S477 R483 G484	S477-E481 PolarHBondContact O-N 2.87Å; E481-R483 VanDerWaalsContact C-N 3.26Å; E481-R483 PolarHBondContact O-N 3.04Å; E481-G484 PolarHBondContact O-N 2.89Å
482	H	91.9	Very high	91.1	Very high	118 Å²	118	60 Å²	60	55%	0.546	32%	0.319	S	S	.	.	H	α-helix	trans	-58.1	-34.7	177.4	176.5	60.7	0	0	0	113.3	R478 F479 G484	R478-H482 WeakPolarHBondContact O-CB 3.35Å; R478-H482 PolarHBondContact O-N 3.13Å; F479-H482 PolarHBondContact O-N 3.26Å; H482-G484 VanDerWaalsContact C-N 3.3Å
483	R	91.7	Very high	91.1	Very high	57 Å²	57	56.4 Å²	56.4	22%	0.215	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	8.2	174.4	-71.6	-163	62.6	81.2	3.1	114	F479 S480 E481 T485 D617 T621	F479-R483 HydrophobicContact CE2-CG 4.15Å; F479-R483 HydrophobicContact CZ-CG 4.38Å; F479-R483 PolarHBondContact O-N 3.34Å; F479-R483 VanDerWaalsContact O-N 3.1Å; S480-R483 CarbonylContact O-C 3.57Å; S480-R483 PolarHBondContact O-N 2.93Å; E481-R483 VanDerWaalsContact C-N 3.26Å; E481-R483 PolarHBondContact O-N 3.04Å; R483-T485 VanDerWaalsContact C-N 3.29Å; R483-T485 PolarHBondContact O-N 2.94Å; R483-D617 IonicContact CZ-OD1 3.54Å; R483-D617 IonicContact CZ-OD2 2.69Å; R483-D617 VanDerWaalsContact NH1-CG 3.32Å; R483-D617 PolarHBondContact NH1-O 3.47Å; R483-D617 IonicContact NH1-OD1 3.51Å; R483-D617 PolarHBondContact NH1-OD1 2.88Å; R483-D617 IonicContact NH1-OD2 3.59Å; R483-D617 IonicContact NH2-OD1 3.82Å; R483-D617 PolarHBondContact NH2-OD1 2.99Å; R483-D617 IonicContact NH2-OD2 2.71Å; R483-D617 PolarHBondContact NH2-OD2 3.15Å; R483-T621 HydrophobicContact CG-CG2 4.19Å; R483-T621 PolarHBondContact NH1-OG1 3.11Å
484	G	90.8	Very high	91	Very high	30 Å²	30	59.1 Å²	59.1	31%	0.309	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	36.4	-179	0	0	0	0	0	112.9	S480 E481 H482 T523	S480-G484 PolarHBondContact O-N 3.32Å; E481-G484 PolarHBondContact O-N 2.89Å; H482-G484 VanDerWaalsContact C-N 3.3Å; G484-T523 VanDerWaalsContact O-CG2 3.32Å; G484-T523 WeakPolarHBondContact O-CG2 3.21Å; G484-T523 PolarHBondContact O-OG1 3.27Å
485	T	92.4	Very high	90.4	Very high	20 Å²	20	62.7 Å²	62.7	12%	0.123	34%	0.34	C	S	.	.			trans	-102.5	125.4	176.7	-57.5	0	0	0	0	109.2	S480 R483 M488 Y520 T521 L522	S480-T485 WeakPolarHBondContact O-CB 3.38Å; S480-T485 PolarHBondContact O-N 3.13Å; R483-T485 VanDerWaalsContact C-N 3.29Å; R483-T485 PolarHBondContact O-N 2.94Å; T485-M488 HydrophobicContact CG2-CE 4.19Å; T485-Y520 HydrophobicContact CG2-CD2 3.8Å; T485-Y520 HydrophobicContact CG2-CG 4.03Å; T485-T521 WeakPolarHBondContact CA-O 3.48Å; T485-L522 HydrophobicContact CG2-CD2 4.01Å
486	F	92.2	Very high	89.6	Confident	105 Å²	105	64.4 Å²	64.4	46%	0.461	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	171	-171.2	64.9	-90.5	0	0	0	112	M488 T521 T523 T532	F486-M488 VanDerWaalsContact C-N 3.28Å; F486-M488 PolarHBondContact O-N 3.41Å; F486-T521 HydrophobicContact CE1-CG2 3.94Å; F486-T521 HydrophobicContact CE2-CG2 3.82Å; F486-T521 HydrophobicContact CZ-CG2 3.45Å; F486-T521 VanDerWaalsContact CZ-CG2 3.45Å; F486-T521 PolarHBondContact N-O 2.83Å; F486-T521 PolarHBondContact O-N 3.07Å; F486-T523 HydrophobicContact CD1-CG2 4.48Å; F486-T523 HydrophobicContact CE1-CG2 3.99Å; F486-T532 HydrophobicContact CE1-CG2 4.13Å; F486-T532 HydrophobicContact CZ-CG2 4Å
487	G	90.2	Very high	88.5	Confident	49 Å²	49	72.7 Å²	72.7	51%	0.505	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	65.4	32.2	-176.7	0	0	0	0	0	113.2	I489	G487-I489 PolarHBondContact O-N 3.46Å
488	M	92.4	Very high	87.3	Confident	59 Å²	59	73.7 Å²	73.7	29%	0.291	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	121	-179.1	-176.9	66.7	70.7	0	0	111.1	F476 T485 F486 Q490 I518 T519 Y520	F476-M488 HydrophobicContact CE1-CE 3.74Å; F476-M488 HydrophobicContact CE1-SD 4.22Å; F476-M488 HydrophobicContact CZ-CE 4.44Å; T485-M488 HydrophobicContact CG2-CE 4.19Å; F486-M488 VanDerWaalsContact C-N 3.28Å; F486-M488 PolarHBondContact O-N 3.41Å; M488-Q490 HydrophobicContact CG-CG 4.31Å; M488-Q490 HydrophobicContact SD-CG 4.22Å; M488-I518 HydrophobicContact SD-CG2 3.52Å; M488-I518 VanDerWaalsContact SD-CG2 3.52Å; M488-T519 CarbonylContact C-O 3.03Å; M488-T519 WeakPolarHBondContact CA-O 3.3Å; M488-Y520 HydrophobicContact CE-CD1 3.99Å; M488-Y520 HydrophobicContact CE-CG 4.08Å; M488-Y520 HydrophobicContact SD-CD1 3.99Å; M488-Y520 HydrophobicContact SD-CG 4.38Å
489	I	92.4	Very high	85.6	Confident	118 Å²	118	69.5 Å²	69.5	61%	0.605	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127	107.6	174.8	-59.2	172.6	0	0	0	107.1	G487 I518 T519	G487-I489 PolarHBondContact O-N 3.46Å; I489-I518 CarbonylContact O-C 3.59Å; I489-I518 WeakPolarHBondContact O-CA 3.32Å; I489-T519 PolarHBondContact N-O 3.28Å; I489-T519 PolarHBondContact O-N 2.92Å
490	Q	91.6	Very high	83.6	Confident	48 Å²	48	71 Å²	71	22%	0.224	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.7	174.1	-65.9	-172.2	60.3	0	0	109.5	M488 I518	M488-Q490 HydrophobicContact CG-CG 4.31Å; M488-Q490 HydrophobicContact SD-CG 4.22Å; Q490-I518 HydrophobicContact CG-CD1 4.27Å; Q490-I518 HydrophobicContact CG-CG1 4.16Å; Q490-I518 HydrophobicContact CG-CG2 3.77Å
491	S	91.5	Very high	81.6	Confident	45 Å²	45	75.8 Å²	75.8	32%	0.315	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-74.8	148.8	160.8	61.5	0	0	0	0	110.2	R516 T517	S491-R516 WeakPolarHBondContact O-CD 3.37Å; S491-T517 WeakPolarHBondContact CB-O 3.47Å; S491-T517 PolarHBondContact N-O 3.19Å; S491-T517 PolarHBondContact OG-N 3.11Å; S491-T517 PolarHBondContact OG-O 2.98Å
492	P	88.8	Confident	79.5	Confident	77 Å²	77	73.3 Å²	73.3	50%	0.5	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-68.7	153.3	177.1	29.8	-35.4	0	0	0	111
493	W	87.5	Confident	77.4	Confident	23 Å²	23	72.5 Å²	72.5	9%	0.087	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-62.7	136.2	166.7	-72.7	105.7	0	0	0	110.1	F470 I514 R516 Q539 L541 I554 I654	F470-W493 HydrophobicContact CB-CZ2 4.19Å; F470-W493 HydrophobicContact CD1-CZ2 4.15Å; F470-W493 PolarHBondContact O-NE1 2.86Å; W493-I514 HydrophobicContact CE3-CG2 4.17Å; W493-I514 HydrophobicContact CZ3-CG2 4.46Å; W493-R516 HydrophobicContact CD2-CB 4.44Å; W493-R516 HydrophobicContact CD2-CG 3.91Å; W493-R516 VanDerWaalsContact CE2-CD 3.46Å; W493-R516 VanDerWaalsContact CE2-NE 3.28Å; W493-R516 HydrophobicContact CE3-CB 4.2Å; W493-R516 HydrophobicContact CE3-CG 3.85Å; W493-R516 HydrophobicContact CH2-CG 4.05Å; W493-R516 HydrophobicContact CZ2-CG 4.09Å; W493-R516 HydrophobicContact CZ3-CG 3.92Å; W493-Q539 HydrophobicContact CH2-CB 3.83Å; W493-Q539 HydrophobicContact CZ2-CB 4.36Å; W493-L541 HydrophobicContact CH2-CB 4.32Å; W493-L541 HydrophobicContact CZ3-CB 3.98Å; W493-I554 HydrophobicContact CH2-CG2 4.1Å; W493-I654 HydrophobicContact CB-CD1 3.66Å
494	P	85.6	Confident	75.1	Confident	57 Å²	57	72.4 Å²	72.4	37%	0.37	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-64.7	140.6	174.1	26.6	-33.1	0	0	0	110.5	F496 I514 E515	P494-F496 PolarHBondContact O-N 2.87Å; P494-I514 HydrophobicContact CG-CG2 4.05Å; P494-E515 WeakPolarHBondContact CD-O 3.41Å
495	V	75.5	Confident	73	Confident	112 Å²	112	77.6 Å²	77.6	68%	0.679	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-66.1	119	-179.3	-180	0	0	0	0	109.6
496	F	76	Confident	70.5	Confident	46 Å²	46	83.7 Å²	83.7	20%	0.202	47%	0.466	C	S	.	.			trans	-129.9	158.9	174.9	88.3	-81	0	0	0	111.7	P494 W498 I514 L541	P494-F496 PolarHBondContact O-N 2.87Å; F496-W498 HydrophobicContact CE1-CZ2 4.21Å; F496-W498 AromaticContact CE2-CD2 3.7Å; F496-W498 HydrophobicContact CE2-CD2 3.7Å; F496-W498 AromaticContact CE2-CE2 3.84Å; F496-W498 AromaticContact CE2-CE3 3.94Å; F496-W498 HydrophobicContact CE2-CE3 3.94Å; F496-W498 HydrophobicContact CE2-CG 4.09Å; F496-W498 HydrophobicContact CE2-CH2 4.42Å; F496-W498 HydrophobicContact CE2-CZ2 4.22Å; F496-W498 HydrophobicContact CE2-CZ3 4.29Å; F496-W498 AromaticContact CZ-CD2 3.74Å; F496-W498 HydrophobicContact CZ-CD2 3.74Å; F496-W498 AromaticContact CZ-CE2 3.37Å; F496-W498 HydrophobicContact CZ-CE3 4.08Å; F496-W498 HydrophobicContact CZ-CG 4.39Å; F496-W498 AromaticContact CZ-CH2 3.77Å; F496-W498 HydrophobicContact CZ-CH2 3.77Å; F496-W498 AromaticContact CZ-CZ2 3.41Å; F496-W498 HydrophobicContact CZ-CZ2 3.41Å; F496-W498 VanDerWaalsContact CZ-CZ2 3.41Å; F496-W498 HydrophobicContact CZ-CZ3 4.09Å; F496-W498 AromaticContact CZ-NE1 3.81Å; F496-I514 HydrophobicContact CB-CD1 3.77Å; F496-I514 HydrophobicContact CD1-CD1 3.72Å; F496-I514 HydrophobicContact CD1-CG2 4.38Å; F496-I514 HydrophobicContact CD2-CD1 3.39Å; F496-I514 HydrophobicContact CE1-CD1 4.02Å; F496-I514 HydrophobicContact CE2-CD1 3.72Å; F496-I514 HydrophobicContact CG-CD1 3.38Å; F496-I514 HydrophobicContact CZ-CD1 4Å; F496-L541 HydrophobicContact CE1-CD2 3.63Å; F496-L541 HydrophobicContact CZ-CD2 3.55Å
497	K	68.5	Low	68.1	Low	188 Å²	188	83.6 Å²	83.6	82%	0.817	47%	0.467	S	S	*	.			trans	-105.9	136.4	171.6	-64.9	-179.3	-179.4	178.7	0	108.7	S499	K497-S499 PolarHBondContact O-N 3.42Å; K497-S499 VanDerWaalsContact O-N 3.11Å
498	W	66.1	Low	65.5	Low	89 Å²	89	87.7 Å²	87.7	34%	0.337	48%	0.477	S	S	.	.			trans	-70.4	103	173	-66.8	92.8	0	0	0	109.7	F496 L541 Y552	F496-W498 HydrophobicContact CE1-CZ2 4.21Å; F496-W498 AromaticContact CE2-CD2 3.7Å; F496-W498 HydrophobicContact CE2-CD2 3.7Å; F496-W498 AromaticContact CE2-CE2 3.84Å; F496-W498 AromaticContact CE2-CE3 3.94Å; F496-W498 HydrophobicContact CE2-CE3 3.94Å; F496-W498 HydrophobicContact CE2-CG 4.09Å; F496-W498 HydrophobicContact CE2-CH2 4.42Å; F496-W498 HydrophobicContact CE2-CZ2 4.22Å; F496-W498 HydrophobicContact CE2-CZ3 4.29Å; F496-W498 AromaticContact CZ-CD2 3.74Å; F496-W498 HydrophobicContact CZ-CD2 3.74Å; F496-W498 AromaticContact CZ-CE2 3.37Å; F496-W498 HydrophobicContact CZ-CE3 4.08Å; F496-W498 HydrophobicContact CZ-CG 4.39Å; F496-W498 AromaticContact CZ-CH2 3.77Å; F496-W498 HydrophobicContact CZ-CH2 3.77Å; F496-W498 AromaticContact CZ-CZ2 3.41Å; F496-W498 HydrophobicContact CZ-CZ2 3.41Å; F496-W498 VanDerWaalsContact CZ-CZ2 3.41Å; F496-W498 HydrophobicContact CZ-CZ3 4.09Å; F496-W498 AromaticContact CZ-NE1 3.81Å; W498-L541 HydrophobicContact CH2-CD2 4.39Å; W498-Y552 AromaticContact CH2-CD1 3.85Å; W498-Y552 HydrophobicContact CH2-CD1 3.85Å; W498-Y552 AromaticContact CH2-CE1 3.56Å; W498-Y552 HydrophobicContact CH2-CE1 3.56Å; W498-Y552 HydrophobicContact CZ2-CD1 4.28Å; W498-Y552 AromaticContact CZ2-CE1 3.62Å; W498-Y552 HydrophobicContact CZ2-CE1 3.62Å
499	S	55.5	Low	63	Low	54 Å²	54	94.3 Å²	94.3	38%	0.378	51%	0.507	S	S	.	.			trans	-58.5	149.7	166.1	-47.4	0	0	0	0	110	K497	K497-S499 PolarHBondContact O-N 3.42Å; K497-S499 VanDerWaalsContact O-N 3.11Å
500	S	51.8	Low	60.4	Low	38 Å²	38	94.8 Å²	94.8	27%	0.266	52%	0.516	S	S	.	.			trans	-66.5	151	170.3	68.6	0	0	0	0	110.3	S502 E503	S500-S502 WeakPolarHBondContact CB-OG 3.32Å; S500-S502 PolarHBondContact O-N 3.27Å; S500-S502 VanDerWaalsContact O-N 3.08Å; S500-S502 PolarHBondContact OG-OG 2.92Å; S500-E503 VanDerWaalsContact CB-OE2 3.24Å; S500-E503 WeakPolarHBondContact CB-OE2 3.14Å; S500-E503 PolarHBondContact N-OE2 2.93Å; S500-E503 PolarHBondContact O-N 3.29Å; S500-E503 VanDerWaalsContact OG-CD 3.25Å; S500-E503 WeakPolarHBondContact OG-CG 3.48Å; S500-E503 PolarHBondContact OG-N 3.32Å; S500-E503 PolarHBondContact OG-OE2 2.89Å
501	P	49.6	Very low	58.4	Low	110 Å²	110	96.2 Å²	96.2	71%	0.714	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.8	174.8	-27.1	36.1	0	0	0	113.4
502	S	47	Very low	56.8	Low	96 Å²	96	99 Å²	99	67%	0.671	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-25	174	24.3	0	0	0	0	115	S500	S500-S502 WeakPolarHBondContact CB-OG 3.32Å; S500-S502 PolarHBondContact O-N 3.27Å; S500-S502 VanDerWaalsContact O-N 3.08Å; S500-S502 PolarHBondContact OG-OG 2.92Å
503	E	47.7	Very low	56.2	Low	102 Å²	102	101.3 Å²	101.3	48%	0.477	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.5	-22.8	-177.3	-72.3	160.3	124.2	0	0	113.1	S500 L505 N506	S500-E503 VanDerWaalsContact CB-OE2 3.24Å; S500-E503 WeakPolarHBondContact CB-OE2 3.14Å; S500-E503 PolarHBondContact N-OE2 2.93Å; S500-E503 PolarHBondContact O-N 3.29Å; S500-E503 VanDerWaalsContact OG-CD 3.25Å; S500-E503 WeakPolarHBondContact OG-CG 3.48Å; S500-E503 PolarHBondContact OG-N 3.32Å; S500-E503 PolarHBondContact OG-OE2 2.89Å; E503-L505 PolarHBondContact O-N 2.99Å; E503-L505 VanDerWaalsContact O-N 3.12Å; E503-N506 PolarHBondContact O-N 3.49Å; E503-N506 VanDerWaalsContact O-N 3.08Å
504	C	44.8	Very low	56.3	Low	55 Å²	55	100.7 Å²	100.7	37%	0.372	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-59.4	-25.1	-177.7	-90.1	0	0	0	0	114.3	N506	C504-N506 VanDerWaalsContact C-N 3.27Å; C504-N506 PolarHBondContact O-N 3.04Å
505	L	45.3	Very low	56.7	Low	139 Å²	139	100.5 Å²	100.5	73%	0.728	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-73.6	-18	179.8	-164.2	62.4	0	0	0	113.1	E503 L508	E503-L505 PolarHBondContact O-N 2.99Å; E503-L505 VanDerWaalsContact O-N 3.12Å; L505-L508 WeakPolarHBondContact O-CD1 3.21Å
506	N	40.1	Very low	57.5	Low	147 Å²	147	95.6 Å²	95.6	79%	0.786	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-106.3	12	-178.3	-68	-21.5	0	0	0	113.3	E503 C504	E503-N506 PolarHBondContact O-N 3.49Å; E503-N506 VanDerWaalsContact O-N 3.08Å; C504-N506 VanDerWaalsContact C-N 3.27Å; C504-N506 PolarHBondContact O-N 3.04Å
507	Q	42.2	Very low	58.4	Low	103 Å²	103	96.1 Å²	96.1	48%	0.481	52%	0.521	S	S	.	.			trans	-116.3	34.9	176.9	-70.3	-169.4	-20.1	0	0	113.2
508	L	36.5	Very low	59.7	Low	136 Å²	136	87.1 Å²	87.1	71%	0.712	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	144.8	156.4	-72.2	96.1	0	0	0	109.1	L505	L505-L508 WeakPolarHBondContact O-CD1 3.21Å
509	E	39.3	Very low	61.1	Low	198 Å²	198	85 Å²	85	93%	0.925	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	-1.5	176.4	-50.8	-171	169.3	0	0	119.4
510	T	38	Very low	63	Low	128 Å²	128	83.7 Å²	83.7	79%	0.785	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.1	17	175.1	-15.9	0	0	0	0	117.5	S512	T510-S512 PolarHBondContact O-N 3.5Å; T510-S512 VanDerWaalsContact O-N 3.08Å
511	S	48.7	Very low	65	Low	78 Å²	78	83 Å²	83	55%	0.545	46%	0.46	S	S	.	.			trans	-70.4	105.5	174.8	-166.2	0	0	0	0	111.6	K513	S511-K513 PolarHBondContact O-N 3.34Å
512	S	59.4	Low	67	Low	102 Å²	102	80 Å²	80	71%	0.713	44%	0.437	S	S	*	.			trans	-66.3	114.2	172.7	57	0	0	0	0	110.3	T510 I514	T510-S512 PolarHBondContact O-N 3.5Å; T510-S512 VanDerWaalsContact O-N 3.08Å; S512-I514 PolarHBondContact O-N 2.85Å
513	K	75.4	Confident	69	Low	126 Å²	126	78.7 Å²	78.7	55%	0.548	43%	0.426	S	S	.	.			trans	-52.9	119.8	-179	-172.6	-174.1	176	-153.4	0	111.3	S511 E515 T540	S511-K513 PolarHBondContact O-N 3.34Å; K513-E515 WeakPolarHBondContact CD-OE2 3.3Å; K513-E515 VanDerWaalsContact CE-OE2 3.24Å; K513-E515 WeakPolarHBondContact CE-OE2 3.44Å; K513-E515 HydrophobicContact CG-CB 4.46Å; K513-E515 IonicContact NZ-OE1 3.84Å; K513-E515 IonicContact NZ-OE2 2.78Å; K513-E515 PolarHBondContact NZ-OE2 2.73Å; K513-E515 PolarHBondContact O-N 3.47Å; K513-T540 HydrophobicContact CD-CG2 4.19Å; K513-T540 WeakPolarHBondContact CE-OG1 3.46Å; K513-T540 HydrophobicContact CG-CG2 3.76Å; K513-T540 PolarHBondContact NZ-OG1 3.16Å
514	I	90	Very high	70.8	Confident	11 Å²	11	76.1 Å²	76.1	6%	0.056	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	90.9	-179.6	-53.5	-172.8	0	0	0	108.8	W493 P494 F496 S512 T540 L541 P543	W493-I514 HydrophobicContact CE3-CG2 4.17Å; W493-I514 HydrophobicContact CZ3-CG2 4.46Å; P494-I514 HydrophobicContact CG-CG2 4.05Å; F496-I514 HydrophobicContact CB-CD1 3.77Å; F496-I514 HydrophobicContact CD1-CD1 3.72Å; F496-I514 HydrophobicContact CD1-CG2 4.38Å; F496-I514 HydrophobicContact CD2-CD1 3.39Å; F496-I514 HydrophobicContact CE1-CD1 4.02Å; F496-I514 HydrophobicContact CE2-CD1 3.72Å; F496-I514 HydrophobicContact CG-CD1 3.38Å; F496-I514 HydrophobicContact CZ-CD1 4Å; S512-I514 PolarHBondContact O-N 2.85Å; I514-T540 CarbonylContact O-C 3.52Å; I514-T540 WeakPolarHBondContact O-CA 3.42Å; I514-L541 HydrophobicContact CB-CB 4.2Å; I514-L541 HydrophobicContact CD1-CD2 4.47Å; I514-L541 HydrophobicContact CG2-CB 4.01Å; I514-L541 HydrophobicContact CG2-CD2 4.28Å; I514-L541 PolarHBondContact O-N 3.47Å; I514-P543 HydrophobicContact CD1-CB 4.35Å; I514-P543 HydrophobicContact CD1-CG 3.68Å; I514-P543 HydrophobicContact CG1-CG 3.99Å
515	E	92.6	Very high	72.4	Confident	53 Å²	53	81.9 Å²	81.9	25%	0.248	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	143.3	-174	-173.8	173.1	166.9	0	0	111.8	P494 K513 Q538 Q539	P494-E515 WeakPolarHBondContact CD-O 3.41Å; K513-E515 WeakPolarHBondContact CD-OE2 3.3Å; K513-E515 VanDerWaalsContact CE-OE2 3.24Å; K513-E515 WeakPolarHBondContact CE-OE2 3.44Å; K513-E515 HydrophobicContact CG-CB 4.46Å; K513-E515 IonicContact NZ-OE1 3.84Å; K513-E515 IonicContact NZ-OE2 2.78Å; K513-E515 PolarHBondContact NZ-OE2 2.73Å; K513-E515 PolarHBondContact O-N 3.47Å; E515-Q538 WeakPolarHBondContact OE1-CB 3.18Å; E515-Q538 PolarHBondContact OE1-NE2 3.47Å; E515-Q539 CarbonylContact C-O 3.52Å; E515-Q539 VanDerWaalsContact CA-O 3.28Å; E515-Q539 WeakPolarHBondContact CA-O 3.48Å
516	R	94	Very high	73.7	Confident	9 Å²	9	79 Å²	79	3%	0.034	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152.4	164.3	70.6	169.4	-173.3	152.2	3	110.7	F470 S491 W493 Q539	F470-R516 PolarHBondContact O-NH2 3.24Å; S491-R516 WeakPolarHBondContact O-CD 3.37Å; W493-R516 HydrophobicContact CD2-CB 4.44Å; W493-R516 HydrophobicContact CD2-CG 3.91Å; W493-R516 VanDerWaalsContact CE2-CD 3.46Å; W493-R516 VanDerWaalsContact CE2-NE 3.28Å; W493-R516 HydrophobicContact CE3-CB 4.2Å; W493-R516 HydrophobicContact CE3-CG 3.85Å; W493-R516 HydrophobicContact CH2-CG 4.05Å; W493-R516 HydrophobicContact CZ2-CG 4.09Å; W493-R516 HydrophobicContact CZ3-CG 3.92Å; R516-Q539 HydrophobicContact CG-CB 4.05Å; R516-Q539 VanDerWaalsContact CZ-OE1 3.25Å; R516-Q539 PolarHBondContact N-O 3.08Å; R516-Q539 PolarHBondContact O-N 3.47Å
517	T	94.9	Very high	75	Confident	56 Å²	56	82 Å²	82	34%	0.344	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.9	175.1	-54.8	0	0	0	0	110.9	S491 V536 E537	S491-T517 WeakPolarHBondContact CB-O 3.47Å; S491-T517 PolarHBondContact N-O 3.19Å; S491-T517 PolarHBondContact OG-N 3.11Å; S491-T517 PolarHBondContact OG-O 2.98Å; T517-V536 HydrophobicContact CG2-CG1 3.61Å; T517-E537 CarbonylContact C-O 3.56Å; T517-E537 WeakPolarHBondContact CA-O 3.26Å
518	I	95.1	Very high	76.3	Confident	0 Å²	0	84.3 Å²	84.3	0%	0	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	141.7	172.8	-50	175	0	0	0	108	M488 I489 Q490 Y520 V536 E537 Q539	M488-I518 HydrophobicContact SD-CG2 3.52Å; M488-I518 VanDerWaalsContact SD-CG2 3.52Å; I489-I518 CarbonylContact O-C 3.59Å; I489-I518 WeakPolarHBondContact O-CA 3.32Å; Q490-I518 HydrophobicContact CG-CD1 4.27Å; Q490-I518 HydrophobicContact CG-CG1 4.16Å; Q490-I518 HydrophobicContact CG-CG2 3.77Å; I518-Y520 HydrophobicContact CG2-CD1 3.96Å; I518-Y520 HydrophobicContact CG2-CE1 4.41Å; I518-V536 CarbonylContact O-C 3.45Å; I518-V536 WeakPolarHBondContact O-CA 3.49Å; I518-E537 HydrophobicContact CB-CB 4.34Å; I518-E537 PolarHBondContact N-O 3.14Å; I518-E537 PolarHBondContact O-N 2.77Å; I518-Q539 HydrophobicContact CD1-CG 4.25Å
519	T	95.7	Very high	77.8	Confident	44 Å²	44	80.5 Å²	80.5	27%	0.27	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137	172.8	-57.3	0	0	0	0	109.4	M488 I489 T534 A535 V536	M488-T519 CarbonylContact C-O 3.03Å; M488-T519 WeakPolarHBondContact CA-O 3.3Å; I489-T519 PolarHBondContact N-O 3.28Å; I489-T519 PolarHBondContact O-N 2.92Å; T519-T534 HydrophobicContact CG2-CG2 4.16Å; T519-A535 WeakPolarHBondContact CA-O 3.18Å; T519-V536 HydrophobicContact CG2-CG2 4.26Å
520	Y	95.3	Very high	79.6	Confident	27 Å²	27	73.3 Å²	73.3	11%	0.106	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	168	176	50.5	-96.4	0	0	0	111.4	T485 M488 I518 L522 T534 A535 E537	T485-Y520 HydrophobicContact CG2-CD2 3.8Å; T485-Y520 HydrophobicContact CG2-CG 4.03Å; M488-Y520 HydrophobicContact CE-CD1 3.99Å; M488-Y520 HydrophobicContact CE-CG 4.08Å; M488-Y520 HydrophobicContact SD-CD1 3.99Å; M488-Y520 HydrophobicContact SD-CG 4.38Å; I518-Y520 HydrophobicContact CG2-CD1 3.96Å; I518-Y520 HydrophobicContact CG2-CE1 4.41Å; Y520-L522 HydrophobicContact CD2-CD2 3.84Å; Y520-L522 HydrophobicContact CD2-CG 3.92Å; Y520-L522 HydrophobicContact CE2-CD1 4.12Å; Y520-L522 HydrophobicContact CE2-CD2 3.69Å; Y520-L522 HydrophobicContact CE2-CG 3.77Å; Y520-T534 CarbonylContact O-C 3.53Å; Y520-T534 WeakPolarHBondContact O-CA 3.3Å; Y520-A535 HydrophobicContact CD2-CB 4Å; Y520-A535 HydrophobicContact CE2-CB 3.51Å; Y520-A535 PolarHBondContact N-O 3.14Å; Y520-A535 PolarHBondContact O-N 2.88Å; Y520-E537 HydrophobicContact CE1-CB 4.02Å
521	T	93.8	Very high	81.8	Confident	22 Å²	22	77.2 Å²	77.2	14%	0.135	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.4	173.3	-59	0	0	0	0	110.4	T485 F486 T532 C533 T534	T485-T521 WeakPolarHBondContact CA-O 3.48Å; F486-T521 HydrophobicContact CE1-CG2 3.94Å; F486-T521 HydrophobicContact CE2-CG2 3.82Å; F486-T521 HydrophobicContact CZ-CG2 3.45Å; F486-T521 VanDerWaalsContact CZ-CG2 3.45Å; F486-T521 PolarHBondContact N-O 2.83Å; F486-T521 PolarHBondContact O-N 3.07Å; T521-T532 HydrophobicContact CG2-CG2 4.27Å; T521-C533 WeakPolarHBondContact CA-O 3.41Å; T521-T534 PolarHBondContact OG1-OG1 3.16Å
522	L	92.4	Very high	83.8	Confident	47 Å²	47	76.4 Å²	76.4	25%	0.246	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	146.5	175.2	-62.1	173.9	0	0	0	110.8	T485 Y520 T532 C533 A535	T485-L522 HydrophobicContact CG2-CD2 4.01Å; Y520-L522 HydrophobicContact CD2-CD2 3.84Å; Y520-L522 HydrophobicContact CD2-CG 3.92Å; Y520-L522 HydrophobicContact CE2-CD1 4.12Å; Y520-L522 HydrophobicContact CE2-CD2 3.69Å; Y520-L522 HydrophobicContact CE2-CG 3.77Å; L522-T532 CarbonylContact O-C 3.48Å; L522-T532 WeakPolarHBondContact O-CA 3.49Å; L522-C533 HydrophobicContact CB-CB 4.47Å; L522-C533 PolarHBondContact N-O 3.09Å; L522-C533 PolarHBondContact O-N 2.67Å; L522-A535 HydrophobicContact CD1-CB 4.5Å
523	T	88.7	Confident	85.3	Confident	70 Å²	70	71.6 Å²	71.6	43%	0.429	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	140.2	164.2	44	0	0	0	0	110.8	G484 F486 T532	G484-T523 VanDerWaalsContact O-CG2 3.32Å; G484-T523 WeakPolarHBondContact O-CG2 3.21Å; G484-T523 PolarHBondContact O-OG1 3.27Å; F486-T523 HydrophobicContact CD1-CG2 4.48Å; F486-T523 HydrophobicContact CE1-CG2 3.99Å; T523-T532 HydrophobicContact CG2-CG2 4.34Å
524	L	84.8	Confident	86.2	Confident	47 Å²	47	68.5 Å²	68.5	25%	0.246	35%	0.352	C	S	.	.			trans	-113.1	126.4	-174.5	-60.2	-176.5	0	0	0	111.9	Q526 R531 C533 V563	L524-Q526 HydrophobicContact CB-CG 4.12Å; L524-Q526 PolarHBondContact O-N 3.36Å; L524-R531 PolarHBondContact N-O 3.11Å; L524-C533 HydrophobicContact CD1-CB 3.93Å; L524-C533 HydrophobicContact CD2-CB 4.07Å; L524-C533 HydrophobicContact CG-CB 4.13Å; L524-V563 HydrophobicContact CD1-CG1 3.86Å
525	K	78.4	Confident	86.5	Confident	176 Å²	176	68 Å²	68	77%	0.765	35%	0.349	S	S	*	.			trans	-76.6	16.6	-178.2	-59.7	170.6	-177.6	168.3	0	114	D617	K525-D617 IonicContact NZ-OD1 2.68Å; K525-D617 IonicContact NZ-OD2 3.47Å; K525-D617 PolarHBondContact NZ-OD2 3.29Å
526	Q	72.4	Confident	86.6	Confident	79 Å²	79	67.1 Å²	67.1	37%	0.369	35%	0.347	S	S	.	.			trans	-90.1	146	-172.5	65	-178.1	-3.2	0	0	113.7	L524 L528 P530	L524-Q526 HydrophobicContact CB-CG 4.12Å; L524-Q526 PolarHBondContact O-N 3.36Å; Q526-L528 VanDerWaalsContact CD-O 3.26Å; Q526-L528 VanDerWaalsContact CG-O 3.3Å; Q526-L528 WeakPolarHBondContact CG-O 3.22Å; Q526-P530 PolarHBondContact NE2-O 3.01Å
527	K	68.3	Low	86.8	Confident	210 Å²	210	67.1 Å²	67.1	91%	0.913	35%	0.348	S	S	*	.	S	Bend	trans	-82.5	-21.2	-176.4	-66.6	-166.9	177.3	-169.2	0	114.8
528	L	68.2	Low	86.9	Confident	151 Å²	151	67.6 Å²	67.6	79%	0.791	35%	0.346	S	S	*	.	S	Bend	trans	-135	156.8	174.1	-72.5	95.3	0	0	0	108.9	Q526	Q526-L528 VanDerWaalsContact CD-O 3.26Å; Q526-L528 VanDerWaalsContact CG-O 3.3Å; Q526-L528 WeakPolarHBondContact CG-O 3.22Å
529	G	69.1	Low	87	Confident	57 Å²	57	67.8 Å²	67.8	59%	0.588	35%	0.347	S	S	*	.	S	Bend	trans	89.8	-174.2	-171.4	0	0	0	0	0	112.7
530	P	76.3	Confident	86.9	Confident	47 Å²	47	66.3 Å²	66.3	31%	0.305	34%	0.338	S	S	.	.			trans	-65.4	143.9	179.5	28.3	-35.3	0	0	0	111.2	Q526 T532	Q526-P530 PolarHBondContact NE2-O 3.01Å; P530-T532 VanDerWaalsContact C-N 3.29Å
531	R	85.7	Confident	86.9	Confident	209 Å²	209	65.2 Å²	65.2	79%	0.789	33%	0.334	S	S	*	.	S	Bend	trans	-82.8	-6.6	176.5	-66.1	-174.9	179.3	-175.9	0.6	113.5	L524	L524-R531 PolarHBondContact N-O 3.11Å
532	T	89.5	Confident	86.8	Confident	61 Å²	61	65.5 Å²	65.5	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	157.5	-178	48.8	0	0	0	0	110.9	F486 T521 L522 T523 P530	F486-T532 HydrophobicContact CE1-CG2 4.13Å; F486-T532 HydrophobicContact CZ-CG2 4Å; T521-T532 HydrophobicContact CG2-CG2 4.27Å; L522-T532 CarbonylContact O-C 3.48Å; L522-T532 WeakPolarHBondContact O-CA 3.49Å; T523-T532 HydrophobicContact CG2-CG2 4.34Å; P530-T532 VanDerWaalsContact C-N 3.29Å
533	C	91.7	Very high	86.5	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.014	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	117.1	177.2	168	0	0	0	0	108.9	T521 L522 L524 H561 V563	T521-C533 WeakPolarHBondContact CA-O 3.41Å; L522-C533 HydrophobicContact CB-CB 4.47Å; L522-C533 PolarHBondContact N-O 3.09Å; L522-C533 PolarHBondContact O-N 2.67Å; L524-C533 HydrophobicContact CD1-CB 3.93Å; L524-C533 HydrophobicContact CD2-CB 4.07Å; L524-C533 HydrophobicContact CG-CB 4.13Å; C533-H561 PolarHBondContact SG-O 2.87Å; C533-V563 HydrophobicContact CB-CG1 3.92Å
534	T	93.8	Very high	86.3	Confident	61 Å²	61	66.4 Å²	66.4	37%	0.374	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	131.8	167.1	-54.3	0	0	0	0	108.6	T519 Y520 T521 H561	T519-T534 HydrophobicContact CG2-CG2 4.16Å; Y520-T534 CarbonylContact O-C 3.53Å; Y520-T534 WeakPolarHBondContact O-CA 3.3Å; T521-T534 PolarHBondContact OG1-OG1 3.16Å; T534-H561 WeakPolarHBondContact O-CB 3.47Å; T534-H561 PolarHBondContact O-N 3.32Å
535	A	95.3	Very high	86.4	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145	-179.8	0	0	0	0	0	110	T519 Y520 L522 V558 T559 N560	T519-A535 WeakPolarHBondContact CA-O 3.18Å; Y520-A535 HydrophobicContact CD2-CB 4Å; Y520-A535 HydrophobicContact CE2-CB 3.51Å; Y520-A535 PolarHBondContact N-O 3.14Å; Y520-A535 PolarHBondContact O-N 2.88Å; L522-A535 HydrophobicContact CD1-CB 4.5Å; A535-V558 HydrophobicContact CB-CG1 4.33Å; A535-T559 WeakPolarHBondContact CA-O 3.33Å; A535-N560 WeakPolarHBondContact CB-OD1 3.31Å
536	V	96.4	Very high	87	Confident	34 Å²	34	58.5 Å²	58.5	21%	0.206	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.3	173.9	-177.9	0	0	0	0	107.6	T517 I518 T519 V558 T559	T517-V536 HydrophobicContact CG2-CG1 3.61Å; I518-V536 CarbonylContact O-C 3.45Å; I518-V536 WeakPolarHBondContact O-CA 3.49Å; T519-V536 HydrophobicContact CG2-CG2 4.26Å; V536-V558 WeakPolarHBondContact O-CA 3.44Å; V536-T559 PolarHBondContact N-O 2.89Å; V536-T559 PolarHBondContact O-N 2.71Å; V536-T559 PolarHBondContact O-OG1 3.22Å
537	E	97	Very high	87.8	Confident	10 Å²	10	58 Å²	58	5%	0.047	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.4	-178.3	-179.5	-176.2	-179.3	0	0	109.7	T517 I518 Y520 Q539 A556 K557 V558	T517-E537 CarbonylContact C-O 3.56Å; T517-E537 WeakPolarHBondContact CA-O 3.26Å; I518-E537 HydrophobicContact CB-CB 4.34Å; I518-E537 PolarHBondContact N-O 3.14Å; I518-E537 PolarHBondContact O-N 2.77Å; Y520-E537 HydrophobicContact CE1-CB 4.02Å; E537-Q539 HydrophobicContact CG-CG 3.87Å; E537-Q539 WeakPolarHBondContact OE1-CG 3.31Å; E537-Q539 PolarHBondContact OE1-NE2 3.43Å; E537-A556 HydrophobicContact CG-CB 4.03Å; E537-A556 VanDerWaalsContact OE1-CB 3.24Å; E537-A556 WeakPolarHBondContact OE1-CB 3.3Å; E537-K557 CarbonylContact C-O 3.59Å; E537-K557 WeakPolarHBondContact CA-O 3.3Å; E537-V558 HydrophobicContact CB-CG2 4.16Å; E537-V558 HydrophobicContact CG-CG2 3.89Å
538	Q	96.5	Very high	88.6	Confident	66 Å²	66	50 Å²	50	31%	0.308	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	106.2	172.9	-65.2	-179.5	-91.3	0	0	109.1	E515 A556 K557	E515-Q538 WeakPolarHBondContact OE1-CB 3.18Å; E515-Q538 PolarHBondContact OE1-NE2 3.47Å; Q538-A556 CarbonylContact O-C 3.56Å; Q538-A556 WeakPolarHBondContact O-CA 3.32Å; Q538-K557 HydrophobicContact CB-CB 4.37Å; Q538-K557 PolarHBondContact N-O 3.38Å; Q538-K557 PolarHBondContact O-N 2.96Å
539	Q	97.2	Very high	89.5	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.014	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.6	179.3	-63.1	-171.1	-20.8	0	0	110.9	W493 E515 R516 I518 E537 I554 D555 A556	W493-Q539 HydrophobicContact CH2-CB 3.83Å; W493-Q539 HydrophobicContact CZ2-CB 4.36Å; E515-Q539 CarbonylContact C-O 3.52Å; E515-Q539 VanDerWaalsContact CA-O 3.28Å; E515-Q539 WeakPolarHBondContact CA-O 3.48Å; R516-Q539 HydrophobicContact CG-CB 4.05Å; R516-Q539 VanDerWaalsContact CZ-OE1 3.25Å; R516-Q539 PolarHBondContact N-O 3.08Å; R516-Q539 PolarHBondContact O-N 3.47Å; I518-Q539 HydrophobicContact CD1-CG 4.25Å; E537-Q539 HydrophobicContact CG-CG 3.87Å; E537-Q539 WeakPolarHBondContact OE1-CG 3.31Å; E537-Q539 PolarHBondContact OE1-NE2 3.43Å; Q539-I554 HydrophobicContact CB-CG2 4.27Å; Q539-D555 CarbonylContact C-O 3.56Å; Q539-D555 WeakPolarHBondContact CA-O 3.37Å; Q539-A556 HydrophobicContact CG-CB 4.24Å
540	T	95.4	Very high	90.5	Very high	13 Å²	13	44.7 Å²	44.7	8%	0.08	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.1	179.3	-55	0	0	0	0	110.3	K513 I514 L542 I554 D555	K513-T540 HydrophobicContact CD-CG2 4.19Å; K513-T540 WeakPolarHBondContact CE-OG1 3.46Å; K513-T540 HydrophobicContact CG-CG2 3.76Å; K513-T540 PolarHBondContact NZ-OG1 3.16Å; I514-T540 CarbonylContact O-C 3.52Å; I514-T540 WeakPolarHBondContact O-CA 3.42Å; T540-L542 HydrophobicContact CG2-CD2 4.03Å; T540-I554 CarbonylContact O-C 3.55Å; T540-I554 VanDerWaalsContact O-CA 3.27Å; T540-I554 WeakPolarHBondContact O-CA 3.44Å; T540-D555 PolarHBondContact N-O 2.63Å; T540-D555 PolarHBondContact O-N 3.39Å
541	L	93.9	Very high	91.3	Very high	4 Å²	4	44 Å²	44	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	127.2	168.3	178.9	70.2	0	0	0	109.1	W493 F496 W498 I514 P543 I554	W493-L541 HydrophobicContact CH2-CB 4.32Å; W493-L541 HydrophobicContact CZ3-CB 3.98Å; F496-L541 HydrophobicContact CE1-CD2 3.63Å; F496-L541 HydrophobicContact CZ-CD2 3.55Å; W498-L541 HydrophobicContact CH2-CD2 4.39Å; I514-L541 HydrophobicContact CB-CB 4.2Å; I514-L541 HydrophobicContact CD1-CD2 4.47Å; I514-L541 HydrophobicContact CG2-CB 4.01Å; I514-L541 HydrophobicContact CG2-CD2 4.28Å; I514-L541 PolarHBondContact O-N 3.47Å; L541-P543 VanDerWaalsContact O-CD 3.26Å; L541-P543 WeakPolarHBondContact O-CD 3.29Å; L541-I554 HydrophobicContact CD1-CD1 4.37Å; L541-I554 HydrophobicContact CD1-CG1 3.71Å
542	L	91.7	Very high	91.7	Very high	29 Å²	29	34.5 Å²	34.5	15%	0.152	20%	0.198	C	C	.	.			trans	-89	106	176.9	-59.1	-172.7	0	0	0	110.1	T540 E545 S546 I553	T540-L542 HydrophobicContact CG2-CD2 4.03Å; L542-E545 HydrophobicContact CB-CB 4.34Å; L542-E545 PolarHBondContact O-N 3.27Å; L542-S546 VanDerWaalsContact O-CB 3.22Å; L542-S546 WeakPolarHBondContact O-CB 3.38Å; L542-S546 PolarHBondContact O-N 3.49Å; L542-S546 PolarHBondContact O-OG 2.99Å; L542-I553 HydrophobicContact CB-CB 4.35Å; L542-I553 HydrophobicContact CB-CG2 4.31Å; L542-I553 HydrophobicContact CD1-CG2 3.8Å; L542-I553 HydrophobicContact CG-CG2 4.26Å; L542-I553 PolarHBondContact N-O 3.47Å
543	P	86.8	Confident	92	Very high	41 Å²	41	31.6 Å²	31.6	27%	0.266	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-32.4	-170.5	-12.5	30.3	0	0	0	112.4	I514 L541 E545	I514-P543 HydrophobicContact CD1-CB 4.35Å; I514-P543 HydrophobicContact CD1-CG 3.68Å; I514-P543 HydrophobicContact CG1-CG 3.99Å; L541-P543 VanDerWaalsContact O-CD 3.26Å; L541-P543 WeakPolarHBondContact O-CD 3.29Å; P543-E545 PolarHBondContact O-N 3.35Å
544	S	84.8	Confident	92.2	Very high	94 Å²	94	31.5 Å²	31.5	66%	0.657	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.8	174.6	46.5	0	0	0	0	113.6
545	E	86.8	Confident	92.4	Very high	49 Å²	49	30 Å²	30	23%	0.229	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-18	-176.8	-61.4	-176.3	-134.7	0	0	113.2	H446 L542 P543 R551 I553	H446-E545 IonicContact CE1-OE2 2.74Å; H446-E545 IonicContact CG-OE2 2.81Å; H446-E545 IonicContact ND1-OE2 3.66Å; H446-E545 PolarHBondContact ND1-OE2 3.16Å; L542-E545 HydrophobicContact CB-CB 4.34Å; L542-E545 PolarHBondContact O-N 3.27Å; P543-E545 PolarHBondContact O-N 3.35Å; E545-R551 VanDerWaalsContact O-CZ 3.25Å; E545-R551 PolarHBondContact O-NE 3.28Å; E545-R551 PolarHBondContact O-NH2 2.74Å; E545-I553 HydrophobicContact CB-CB 4.22Å; E545-I553 HydrophobicContact CB-CG1 3.87Å
546	S	90.2	Very high	92.4	Very high	8 Å²	8	30 Å²	30	6%	0.056	17%	0.17	C	C	.	.			trans	-89.9	142.7	179.2	-59.4	0	0	0	0	111.9	L542 R551 I553	L542-S546 VanDerWaalsContact O-CB 3.22Å; L542-S546 WeakPolarHBondContact O-CB 3.38Å; L542-S546 PolarHBondContact O-N 3.49Å; L542-S546 PolarHBondContact O-OG 2.99Å; S546-R551 CarbonylContact C-O 3.48Å; S546-R551 VanDerWaalsContact CA-O 3.3Å; S546-R551 WeakPolarHBondContact CA-O 3.25Å; S546-I553 PolarHBondContact OG-N 3.35Å
547	I	88.8	Confident	92.5	Very high	70 Å²	70	30.9 Å²	30.9	36%	0.359	17%	0.171	S	C	.	.	B	Isolated β-bridge	trans	-131.9	116.5	177.5	-53.5	174.8	0	0	0	107.3	G549 K550 R551	I547-G549 PolarHBondContact O-N 3.29Å; I547-K550 HydrophobicContact CB-CB 4.05Å; I547-K550 HydrophobicContact CG2-CB 3.93Å; I547-K550 HydrophobicContact CG2-CD 4.1Å; I547-K550 HydrophobicContact CG2-CG 4.37Å; I547-K550 PolarHBondContact O-N 3.49Å; I547-R551 CarbonylContact C-O 3.59Å; I547-R551 PolarHBondContact N-O 3.08Å; I547-R551 PolarHBondContact O-N 2.96Å; I547-R551 VanDerWaalsContact O-O 3.07Å
548	S	86.8	Confident	92.5	Very high	41 Å²	41	31.3 Å²	31.3	29%	0.287	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	135.2	-177.1	-157.3	0	0	0	0	112.2	K550	S548-K550 PolarHBondContact O-N 3.14Å
549	G	85.3	Confident	92.4	Very high	23 Å²	23	29.9 Å²	29.9	24%	0.237	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	-0.3	-176.6	0	0	0	0	0	115.9	V462 N463 I547 Y552	V462-G549 VanDerWaalsContact CG1-C 3.48Å; V462-G549 VanDerWaalsContact CG1-O 3.24Å; V462-G549 WeakPolarHBondContact CG1-O 3.49Å; N463-G549 WeakPolarHBondContact OD1-CA 3.48Å; I547-G549 PolarHBondContact O-N 3.29Å; G549-Y552 PolarHBondContact N-OH 3.47Å
550	K	90.9	Very high	92.2	Very high	73 Å²	73	31.2 Å²	31.2	32%	0.317	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.2	-44.9	-168.4	-70.6	-168	-171.2	-165	0	114.5	E437 I440 I547 S548 Y579	E437-K550 WeakPolarHBondContact OE1-CE 3.22Å; E437-K550 IonicContact OE1-NZ 3.58Å; E437-K550 PolarHBondContact OE1-NZ 3.43Å; E437-K550 IonicContact OE2-NZ 3.12Å; I440-K550 HydrophobicContact CD1-CB 3.55Å; I440-K550 HydrophobicContact CD1-CD 3.86Å; I440-K550 HydrophobicContact CD1-CG 3.81Å; I547-K550 HydrophobicContact CB-CB 4.05Å; I547-K550 HydrophobicContact CG2-CB 3.93Å; I547-K550 HydrophobicContact CG2-CD 4.1Å; I547-K550 HydrophobicContact CG2-CG 4.37Å; I547-K550 PolarHBondContact O-N 3.49Å; S548-K550 PolarHBondContact O-N 3.14Å; K550-Y579 VanDerWaalsContact O-CB 3.27Å; K550-Y579 WeakPolarHBondContact O-CB 3.44Å; K550-Y579 PolarHBondContact O-N 2.75Å
551	R	93.6	Very high	91.9	Very high	33 Å²	33	34.9 Å²	34.9	13%	0.125	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	130.6	-179.3	-173.3	166	74.4	-155.5	0.2	111.2	I440 T441 E545 S546 I547 I553 L577 L578	I440-R551 HydrophobicContact CG2-CB 4.41Å; T441-R551 WeakPolarHBondContact O-CD 3.42Å; T441-R551 PolarHBondContact O-NH1 2.86Å; E545-R551 VanDerWaalsContact O-CZ 3.25Å; E545-R551 PolarHBondContact O-NE 3.28Å; E545-R551 PolarHBondContact O-NH2 2.74Å; S546-R551 CarbonylContact C-O 3.48Å; S546-R551 VanDerWaalsContact CA-O 3.3Å; S546-R551 WeakPolarHBondContact CA-O 3.25Å; I547-R551 CarbonylContact C-O 3.59Å; I547-R551 PolarHBondContact N-O 3.08Å; I547-R551 PolarHBondContact O-N 2.96Å; I547-R551 VanDerWaalsContact O-O 3.07Å; R551-I553 HydrophobicContact CG-CD1 3.82Å; R551-I553 HydrophobicContact CG-CG1 4.18Å; R551-L577 CarbonylContact C-O 3.58Å; R551-L577 VanDerWaalsContact CA-O 3.28Å; R551-L577 WeakPolarHBondContact CA-O 3.42Å; R551-L578 HydrophobicContact CG-CD2 3.73Å
552	Y	94.2	Very high	91.4	Very high	10 Å²	10	38.2 Å²	38.2	4%	0.039	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126.7	169	-56.9	-69.1	0	0	0	110	V462 N463 F466 W498 G549 C576 L577	V462-Y552 HydrophobicContact CG1-CE2 4.39Å; V462-Y552 HydrophobicContact CG2-CD2 4.01Å; V462-Y552 HydrophobicContact CG2-CE2 4.22Å; N463-Y552 WeakPolarHBondContact OD1-CE2 3.19Å; N463-Y552 PolarHBondContact OD1-OH 2.78Å; F466-Y552 HydrophobicContact CB-CD2 3.92Å; F466-Y552 HydrophobicContact CB-CE2 4.03Å; F466-Y552 HydrophobicContact CD2-CD1 4.13Å; F466-Y552 AromaticContact CD2-CD2 3.82Å; F466-Y552 HydrophobicContact CD2-CD2 3.82Å; F466-Y552 HydrophobicContact CD2-CE2 4.33Å; F466-Y552 AromaticContact CD2-CG 3.71Å; F466-Y552 HydrophobicContact CD2-CG 3.71Å; F466-Y552 HydrophobicContact CE2-CD1 4.37Å; F466-Y552 HydrophobicContact CE2-CG 4.32Å; F466-Y552 HydrophobicContact CG-CD2 4.19Å; F466-Y552 HydrophobicContact CG-CE2 4.36Å; W498-Y552 AromaticContact CH2-CD1 3.85Å; W498-Y552 HydrophobicContact CH2-CD1 3.85Å; W498-Y552 AromaticContact CH2-CE1 3.56Å; W498-Y552 HydrophobicContact CH2-CE1 3.56Å; W498-Y552 HydrophobicContact CZ2-CD1 4.28Å; W498-Y552 AromaticContact CZ2-CE1 3.62Å; W498-Y552 HydrophobicContact CZ2-CE1 3.62Å; G549-Y552 PolarHBondContact N-OH 3.47Å; Y552-C576 WeakPolarHBondContact O-CA 3.35Å; Y552-L577 HydrophobicContact CD2-CB 4.46Å; Y552-L577 PolarHBondContact N-O 3.06Å; Y552-L577 PolarHBondContact O-N 2.81Å
553	I	95.5	Very high	91	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	118.3	177.2	-53.1	-56	0	0	0	108.7	L542 E545 S546 R551 R574 Y575 C576	L542-I553 HydrophobicContact CB-CB 4.35Å; L542-I553 HydrophobicContact CB-CG2 4.31Å; L542-I553 HydrophobicContact CD1-CG2 3.8Å; L542-I553 HydrophobicContact CG-CG2 4.26Å; L542-I553 PolarHBondContact N-O 3.47Å; E545-I553 HydrophobicContact CB-CB 4.22Å; E545-I553 HydrophobicContact CB-CG1 3.87Å; S546-I553 PolarHBondContact OG-N 3.35Å; R551-I553 HydrophobicContact CG-CD1 3.82Å; R551-I553 HydrophobicContact CG-CG1 4.18Å; I553-R574 HydrophobicContact CG2-CG 4.46Å; I553-Y575 WeakPolarHBondContact CA-O 3.39Å; I553-C576 HydrophobicContact CD1-CB 3.7Å
554	I	95.9	Very high	90.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	124.6	-173.7	-55.4	166.5	0	0	0	110.1	F466 F470 W493 Q539 T540 L541 Y575	F466-I554 HydrophobicContact CD2-CD1 4.06Å; F466-I554 HydrophobicContact CE2-CD1 3.72Å; F470-I554 HydrophobicContact CB-CD1 4.44Å; F470-I554 HydrophobicContact CD1-CD1 3.56Å; F470-I554 HydrophobicContact CD1-CG2 4.24Å; F470-I554 HydrophobicContact CD2-CD1 3.65Å; F470-I554 HydrophobicContact CE1-CB 4.19Å; F470-I554 HydrophobicContact CE1-CD1 3.63Å; F470-I554 HydrophobicContact CE1-CG2 3.82Å; F470-I554 HydrophobicContact CE2-CD1 3.74Å; F470-I554 HydrophobicContact CG-CD1 3.57Å; F470-I554 HydrophobicContact CZ-CB 4.4Å; F470-I554 HydrophobicContact CZ-CD1 3.72Å; W493-I554 HydrophobicContact CH2-CG2 4.1Å; Q539-I554 HydrophobicContact CB-CG2 4.27Å; T540-I554 CarbonylContact O-C 3.55Å; T540-I554 VanDerWaalsContact O-CA 3.27Å; T540-I554 WeakPolarHBondContact O-CA 3.44Å; L541-I554 HydrophobicContact CD1-CD1 4.37Å; L541-I554 HydrophobicContact CD1-CG1 3.71Å; I554-Y575 PolarHBondContact N-O 2.93Å; I554-Y575 PolarHBondContact O-N 3.05Å
555	D	96.7	Very high	90.9	Very high	30 Å²	30	38.4 Å²	38.4	16%	0.16	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121	174.2	-76	-22.9	0	0	0	110.9	Q539 T540 R574	Q539-D555 CarbonylContact C-O 3.56Å; Q539-D555 WeakPolarHBondContact CA-O 3.37Å; T540-D555 PolarHBondContact N-O 2.63Å; T540-D555 PolarHBondContact O-N 3.39Å; D555-R574 VanDerWaalsContact OD1-CB 3.25Å; D555-R574 WeakPolarHBondContact OD1-CB 3.31Å; D555-R574 VanDerWaalsContact OD1-CG 3.32Å; D555-R574 WeakPolarHBondContact OD1-CG 3.27Å; D555-R574 IonicContact OD1-CZ 3.52Å; D555-R574 IonicContact OD1-NE 3.92Å; D555-R574 PolarHBondContact OD1-NE 3.43Å; D555-R574 IonicContact OD1-NH2 3.73Å; D555-R574 PolarHBondContact OD1-NH2 3.13Å; D555-R574 IonicContact OD2-CZ 2.61Å; D555-R574 IonicContact OD2-NE 2.65Å; D555-R574 IonicContact OD2-NH2 2.68Å; D555-R574 PolarHBondContact OD2-NH2 3.47Å
556	A	97	Very high	91	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.5	175	0	0	0	0	0	111.1	E537 Q538 Q539 V572 S573 Y575	E537-A556 HydrophobicContact CG-CB 4.03Å; E537-A556 VanDerWaalsContact OE1-CB 3.24Å; E537-A556 WeakPolarHBondContact OE1-CB 3.3Å; Q538-A556 CarbonylContact O-C 3.56Å; Q538-A556 WeakPolarHBondContact O-CA 3.32Å; Q539-A556 HydrophobicContact CG-CB 4.24Å; A556-V572 CarbonylContact O-C 3.48Å; A556-V572 VanDerWaalsContact O-CA 3.32Å; A556-V572 WeakPolarHBondContact O-CA 3.26Å; A556-S573 PolarHBondContact N-O 2.8Å; A556-S573 PolarHBondContact O-N 3.45Å; A556-Y575 HydrophobicContact CB-CD2 4.46Å; A556-Y575 HydrophobicContact CB-CE2 3.88Å
557	K	97	Very high	90.9	Very high	52 Å²	52	42 Å²	42	23%	0.226	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113.5	167	167.9	165.5	-177.6	164.2	0	109	E537 Q538 Y570 V571 E596	E537-K557 CarbonylContact C-O 3.59Å; E537-K557 WeakPolarHBondContact CA-O 3.3Å; Q538-K557 HydrophobicContact CB-CB 4.37Å; Q538-K557 PolarHBondContact N-O 3.38Å; Q538-K557 PolarHBondContact O-N 2.96Å; K557-Y570 HydrophobicContact CD-CD2 3.65Å; K557-Y570 HydrophobicContact CD-CE2 3.56Å; K557-Y570 HydrophobicContact CD-CG 4.23Å; K557-Y570 VanDerWaalsContact CE-CD2 3.45Å; K557-Y570 VanDerWaalsContact CE-CG 3.49Å; K557-Y570 HydrophobicContact CG-CD2 3.61Å; K557-Y570 HydrophobicContact CG-CE2 3.92Å; K557-Y570 HydrophobicContact CG-CG 4.33Å; K557-Y570 VanDerWaalsContact NZ-CE1 3.31Å; K557-V571 CarbonylContact C-O 3.43Å; K557-V571 WeakPolarHBondContact CA-O 3.42Å; K557-E596 IonicContact NZ-OE1 3.6Å; K557-E596 PolarHBondContact NZ-OE1 2.69Å
558	V	96.9	Very high	91.1	Very high	19 Å²	19	39.2 Å²	39.2	12%	0.115	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.7	176.5	-176.7	0	0	0	0	110	A535 V536 E537 V571	A535-V558 HydrophobicContact CB-CG1 4.33Å; V536-V558 WeakPolarHBondContact O-CA 3.44Å; E537-V558 HydrophobicContact CB-CG2 4.16Å; E537-V558 HydrophobicContact CG-CG2 3.89Å; V558-V571 PolarHBondContact N-O 2.77Å; V558-V571 PolarHBondContact O-N 2.9Å
559	T	95	Very high	91.5	Very high	35 Å²	35	38.1 Å²	38.1	22%	0.215	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.5	168.2	50.9	0	0	0	0	110.1	A535 V536	A535-T559 WeakPolarHBondContact CA-O 3.33Å; V536-T559 PolarHBondContact N-O 2.89Å; V536-T559 PolarHBondContact O-N 2.71Å; V536-T559 PolarHBondContact O-OG1 3.22Å
560	N	92.7	Very high	91.9	Very high	32 Å²	32	39 Å²	39	17%	0.171	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	142	179.5	-73.7	-37.2	0	0	0	110.1	A535 V563 S566	A535-N560 WeakPolarHBondContact CB-OD1 3.31Å; N560-V563 HydrophobicContact CB-CG2 3.85Å; N560-S566 WeakPolarHBondContact O-CB 3.37Å
561	H	90.2	Very high	92.2	Very high	89 Å²	89	35.9 Å²	35.9	41%	0.412	20%	0.201	S	C	.	.			trans	-116.1	161.8	178	-59.1	-75.2	0	0	0	111.6	C533 T534 V563	C533-H561 PolarHBondContact SG-O 2.87Å; T534-H561 WeakPolarHBondContact O-CB 3.47Å; T534-H561 PolarHBondContact O-N 3.32Å; H561-V563 PolarHBondContact O-N 3.45Å
562	A	83.3	Confident	92.4	Very high	75 Å²	75	35.4 Å²	35.4	62%	0.62	20%	0.202	S	C	*	.	S	Bend	trans	62	-19.7	-175.4	0	0	0	0	0	117.3
563	V	82.6	Confident	92.5	Very high	22 Å²	22	35.1 Å²	35.1	13%	0.133	20%	0.201	C	C	.	.	S	Bend	trans	-68.6	148.1	171.9	-63.3	0	0	0	0	111.8	L524 C533 N560 H561 L565 S566	L524-V563 HydrophobicContact CD1-CG1 3.86Å; C533-V563 HydrophobicContact CB-CG1 3.92Å; N560-V563 HydrophobicContact CB-CG2 3.85Å; H561-V563 PolarHBondContact O-N 3.45Å; V563-L565 PolarHBondContact O-N 2.82Å; V563-S566 VanDerWaalsContact O-CB 3.22Å; V563-S566 WeakPolarHBondContact O-CB 3.49Å; V563-S566 PolarHBondContact O-N 2.84Å; V563-S566 PolarHBondContact O-OG 2.85Å
564	P	83.8	Confident	92.6	Very high	93 Å²	93	36.6 Å²	36.6	60%	0.604	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	137.4	176.8	-25.6	34.9	0	0	0	112.4	S566	P564-S566 PolarHBondContact O-N 2.87Å; P564-S566 VanDerWaalsContact O-N 3.13Å
565	L	86.3	Confident	92.7	Very high	53 Å²	53	37.3 Å²	37.3	28%	0.277	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	15.6	-178.9	-54.4	171.8	0	0	0	115.2	V563 N567 C568 F569 V599 F600 A603 I607	V563-L565 PolarHBondContact O-N 2.82Å; L565-N567 PolarHBondContact O-N 3.07Å; L565-N567 VanDerWaalsContact O-N 3.1Å; L565-C568 HydrophobicContact CB-CB 4.48Å; L565-C568 WeakPolarHBondContact O-CB 3.42Å; L565-C568 PolarHBondContact O-N 3.28Å; L565-F569 HydrophobicContact CB-CE1 4.4Å; L565-F569 WeakPolarHBondContact O-CD1 3.49Å; L565-F569 WeakPolarHBondContact O-CE1 3.18Å; L565-V599 HydrophobicContact CD1-CG1 4.49Å; L565-F600 HydrophobicContact CD1-CD1 4.44Å; L565-F600 HydrophobicContact CD1-CE1 3.87Å; L565-F600 HydrophobicContact CD1-CZ 4.5Å; L565-F600 HydrophobicContact CD2-CE1 4.44Å; L565-A603 HydrophobicContact CD1-CB 3.86Å; L565-I607 HydrophobicContact CB-CD1 4.18Å; L565-I607 HydrophobicContact CD1-CD1 3.87Å
566	S	87.9	Confident	92.7	Very high	32 Å²	32	35.9 Å²	35.9	22%	0.224	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-47	-36.2	172.6	32.6	0	0	0	0	114.2	N560 V563 P564 C568	N560-S566 WeakPolarHBondContact O-CB 3.37Å; V563-S566 VanDerWaalsContact O-CB 3.22Å; V563-S566 WeakPolarHBondContact O-CB 3.49Å; V563-S566 PolarHBondContact O-N 2.84Å; V563-S566 PolarHBondContact O-OG 2.85Å; P564-S566 PolarHBondContact O-N 2.87Å; P564-S566 VanDerWaalsContact O-N 3.13Å; S566-C568 PolarHBondContact O-N 2.94Å
567	N	89.7	Confident	92.7	Very high	99 Å²	99	35.9 Å²	35.9	53%	0.529	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-79.5	5	180	69.4	-22.4	0	0	0	114.4	L565 K597	L565-N567 PolarHBondContact O-N 3.07Å; L565-N567 VanDerWaalsContact O-N 3.1Å; N567-K597 WeakPolarHBondContact O-CD 3.14Å; N567-K597 WeakPolarHBondContact O-CE 3.46Å; N567-K597 PolarHBondContact O-NZ 3.35Å
568	C	92.1	Very high	92.7	Very high	12 Å²	12	33.8 Å²	33.8	8%	0.081	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-110.7	-20.9	179.2	-60.3	0	0	0	0	114	L565 S566 Y595 E596 K597 V599	L565-C568 HydrophobicContact CB-CB 4.48Å; L565-C568 WeakPolarHBondContact O-CB 3.42Å; L565-C568 PolarHBondContact O-N 3.28Å; S566-C568 PolarHBondContact O-N 2.94Å; C568-Y595 CarbonylContact O-C 3.42Å; C568-Y595 WeakPolarHBondContact O-CA 3.15Å; C568-E596 PolarHBondContact O-N 3.02Å; C568-K597 HydrophobicContact CB-CB 4.15Å; C568-K597 PolarHBondContact O-N 3.2Å; C568-K597 VanDerWaalsContact O-N 3.15Å; C568-V599 HydrophobicContact CB-CG1 3.59Å
569	F	94.3	Very high	92.6	Very high	18 Å²	18	33.9 Å²	33.9	8%	0.079	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	158.2	-173.5	74.5	-87	0	0	0	113.1	L565 V593 I594 Y595 I607	L565-F569 HydrophobicContact CB-CE1 4.4Å; L565-F569 WeakPolarHBondContact O-CD1 3.49Å; L565-F569 WeakPolarHBondContact O-CE1 3.18Å; F569-V593 HydrophobicContact CB-CG1 4.2Å; F569-V593 HydrophobicContact CD2-CG1 3.86Å; F569-V593 HydrophobicContact CG-CG1 4.32Å; F569-I594 CarbonylContact C-O 3.28Å; F569-I594 WeakPolarHBondContact CA-O 3.49Å; F569-I594 WeakPolarHBondContact CB-O 3.44Å; F569-Y595 HydrophobicContact CB-CD1 3.78Å; F569-Y595 HydrophobicContact CB-CE1 3.88Å; F569-Y595 HydrophobicContact CB-CG 4.32Å; F569-Y595 HydrophobicContact CG-CE1 4.46Å; F569-I607 HydrophobicContact CD1-CD1 3.93Å; F569-I607 HydrophobicContact CD1-CG1 4.42Å; F569-I607 HydrophobicContact CD1-CG2 3.8Å; F569-I607 HydrophobicContact CD2-CG2 3.82Å; F569-I607 HydrophobicContact CE1-CD1 4.02Å; F569-I607 HydrophobicContact CE1-CG1 4.09Å; F569-I607 HydrophobicContact CE1-CG2 3.68Å; F569-I607 HydrophobicContact CE2-CG2 3.7Å; F569-I607 HydrophobicContact CG-CG2 3.88Å; F569-I607 HydrophobicContact CZ-CG2 3.63Å
570	Y	95.1	Very high	92.6	Very high	42 Å²	42	33.3 Å²	33.3	17%	0.165	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	168.2	169.2	65.3	-89.3	0	0	0	110.3	K557 V572 I594 E596	K557-Y570 HydrophobicContact CD-CD2 3.65Å; K557-Y570 HydrophobicContact CD-CE2 3.56Å; K557-Y570 HydrophobicContact CD-CG 4.23Å; K557-Y570 VanDerWaalsContact CE-CD2 3.45Å; K557-Y570 VanDerWaalsContact CE-CG 3.49Å; K557-Y570 HydrophobicContact CG-CD2 3.61Å; K557-Y570 HydrophobicContact CG-CE2 3.92Å; K557-Y570 HydrophobicContact CG-CG 4.33Å; K557-Y570 VanDerWaalsContact NZ-CE1 3.31Å; Y570-V572 HydrophobicContact CD2-CG2 3.81Å; Y570-V572 HydrophobicContact CE2-CG2 3.38Å; Y570-I594 HydrophobicContact CD1-CB 4.27Å; Y570-I594 HydrophobicContact CD1-CG2 4.46Å; Y570-I594 HydrophobicContact CD2-CB 4.32Å; Y570-I594 HydrophobicContact CE1-CB 3.87Å; Y570-I594 HydrophobicContact CE1-CG2 3.68Å; Y570-I594 HydrophobicContact CE2-CB 3.97Å; Y570-I594 HydrophobicContact CE2-CD1 3.9Å; Y570-I594 HydrophobicContact CE2-CG1 4.31Å; Y570-I594 HydrophobicContact CE2-CG2 4.38Å; Y570-I594 HydrophobicContact CG-CB 4.49Å; Y570-I594 PolarHBondContact N-O 3.32Å; Y570-I594 PolarHBondContact O-N 3.37Å; Y570-E596 HydrophobicContact CD1-CG 3.71Å; Y570-E596 WeakPolarHBondContact CD1-OE1 3.08Å; Y570-E596 HydrophobicContact CE1-CG 3.5Å; Y570-E596 WeakPolarHBondContact CE1-OE1 3.37Å
571	V	96.4	Very high	92.6	Very high	8 Å²	8	34.6 Å²	34.6	5%	0.048	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.8	175.3	-177.8	0	0	0	0	109.1	K557 V558 Q592 L615	K557-V571 CarbonylContact C-O 3.43Å; K557-V571 WeakPolarHBondContact CA-O 3.42Å; V558-V571 PolarHBondContact N-O 2.77Å; V558-V571 PolarHBondContact O-N 2.9Å; V571-Q592 WeakPolarHBondContact CA-O 3.17Å; V571-L615 HydrophobicContact CG1-CD1 3.97Å; V571-L615 HydrophobicContact CG1-CD2 4.14Å
572	V	97	Very high	92.5	Very high	22 Å²	22	38.7 Å²	38.7	13%	0.133	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.6	166.2	-178.9	0	0	0	0	108.6	A556 Y570 S591 Q592 I594	A556-V572 CarbonylContact O-C 3.48Å; A556-V572 VanDerWaalsContact O-CA 3.32Å; A556-V572 WeakPolarHBondContact O-CA 3.26Å; Y570-V572 HydrophobicContact CD2-CG2 3.81Å; Y570-V572 HydrophobicContact CE2-CG2 3.38Å; V572-S591 CarbonylContact O-C 3.19Å; V572-S591 WeakPolarHBondContact O-CA 3.38Å; V572-S591 VanDerWaalsContact O-CB 3.31Å; V572-S591 WeakPolarHBondContact O-CB 3.12Å; V572-Q592 PolarHBondContact N-O 3.39Å; V572-Q592 PolarHBondContact O-N 3.29Å; V572-I594 HydrophobicContact CB-CD1 4.37Å; V572-I594 HydrophobicContact CG2-CD1 3.58Å; V572-I594 HydrophobicContact CG2-CG1 4.32Å
573	S	97.7	Very high	92.7	Very high	4 Å²	4	37 Å²	37	3%	0.028	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	117.9	171.6	-64.8	0	0	0	0	109.6	A556 S590 S591	A556-S573 PolarHBondContact N-O 2.8Å; A556-S573 PolarHBondContact O-N 3.45Å; S573-S590 WeakPolarHBondContact CA-O 3.41Å; S573-S591 WeakPolarHBondContact CB-OG 3.31Å; S573-S591 WeakPolarHBondContact OG-CB 3.41Å; S573-S591 PolarHBondContact OG-OG 2.88Å
574	R	97.4	Very high	93.3	Very high	32 Å²	32	37.4 Å²	37.4	12%	0.121	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	118.3	173	176.9	165.1	-71.4	-173.8	-9	109.6	D447 P449 I553 D555 V589 S590	D447-R574 WeakPolarHBondContact O-CD 3.45Å; D447-R574 PolarHBondContact O-NH1 3.23Å; P449-R574 HydrophobicContact CG-CB 3.79Å; I553-R574 HydrophobicContact CG2-CG 4.46Å; D555-R574 VanDerWaalsContact OD1-CB 3.25Å; D555-R574 WeakPolarHBondContact OD1-CB 3.31Å; D555-R574 VanDerWaalsContact OD1-CG 3.32Å; D555-R574 WeakPolarHBondContact OD1-CG 3.27Å; D555-R574 IonicContact OD1-CZ 3.52Å; D555-R574 IonicContact OD1-NE 3.92Å; D555-R574 PolarHBondContact OD1-NE 3.43Å; D555-R574 IonicContact OD1-NH2 3.73Å; D555-R574 PolarHBondContact OD1-NH2 3.13Å; D555-R574 IonicContact OD2-CZ 2.61Å; D555-R574 IonicContact OD2-NE 2.65Å; D555-R574 IonicContact OD2-NH2 2.68Å; D555-R574 PolarHBondContact OD2-NH2 3.47Å; R574-V589 WeakPolarHBondContact O-CA 3.44Å; R574-S590 PolarHBondContact N-O 3.47Å; R574-S590 PolarHBondContact O-N 3.15Å
575	Y	97.8	Very high	93.8	Very high	14 Å²	14	33 Å²	33	6%	0.055	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.2	176.7	-63.4	-103	0	0	0	110.1	F470 I553 I554 A556 V589 F619	F470-Y575 HydrophobicContact CE1-CD2 4.38Å; F470-Y575 HydrophobicContact CE1-CG 4.45Å; F470-Y575 AromaticContact CZ-CD1 3.79Å; F470-Y575 HydrophobicContact CZ-CD1 3.79Å; F470-Y575 HydrophobicContact CZ-CD2 4.04Å; F470-Y575 HydrophobicContact CZ-CE1 4.24Å; F470-Y575 HydrophobicContact CZ-CE2 4.47Å; F470-Y575 AromaticContact CZ-CG 3.67Å; F470-Y575 HydrophobicContact CZ-CG 3.67Å; I553-Y575 WeakPolarHBondContact CA-O 3.39Å; I554-Y575 PolarHBondContact N-O 2.93Å; I554-Y575 PolarHBondContact O-N 3.05Å; A556-Y575 HydrophobicContact CB-CD2 4.46Å; A556-Y575 HydrophobicContact CB-CE2 3.88Å; Y575-V589 HydrophobicContact CD1-CB 4.43Å; Y575-V589 HydrophobicContact CD1-CG1 3.97Å; Y575-V589 HydrophobicContact CD1-CG2 3.53Å; Y575-V589 HydrophobicContact CE1-CG1 4.12Å; Y575-V589 HydrophobicContact CE1-CG2 4.06Å; Y575-V589 HydrophobicContact CG-CG1 4.22Å; Y575-V589 HydrophobicContact CG-CG2 4.24Å; Y575-F619 AromaticContact CE1-CE1 3.69Å; Y575-F619 HydrophobicContact CE1-CE1 3.69Å; Y575-F619 HydrophobicContact CE1-CZ 4.32Å; Y575-F619 AromaticContact CZ-CE1 3.86Å
576	C	97.2	Very high	94.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	105.9	178	-46.9	0	0	0	0	108.5	H446 Y552 I553 L578 H588	H446-C576 PolarHBondContact NE2-SG 3.29Å; Y552-C576 WeakPolarHBondContact O-CA 3.35Å; I553-C576 HydrophobicContact CD1-CB 3.7Å; C576-L578 HydrophobicContact CB-CD2 4.11Å; C576-H588 HydrophobicContact CB-CB 4.23Å; C576-H588 PolarHBondContact N-O 2.94Å; C576-H588 PolarHBondContact O-N 3.19Å
577	L	96.9	Very high	94.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	111.2	-179.6	-64.6	69.3	0	0	0	107	V462 L465 F466 F470 R551 Y552 L587	V462-L577 HydrophobicContact CG2-CB 3.97Å; V462-L577 WeakPolarHBondContact CG2-O 3.34Å; L465-L577 HydrophobicContact CB-CD2 4.43Å; L465-L577 HydrophobicContact CD2-CB 4.26Å; L465-L577 HydrophobicContact CD2-CD2 4.15Å; L465-L577 HydrophobicContact CD2-CG 4.04Å; L465-L577 HydrophobicContact CG-CD2 3.93Å; L465-L577 HydrophobicContact CG-CG 4.34Å; F466-L577 HydrophobicContact CB-CD2 3.98Å; F470-L577 HydrophobicContact CD2-CD2 4.21Å; F470-L577 HydrophobicContact CE2-CD1 3.84Å; F470-L577 HydrophobicContact CE2-CD2 4.01Å; F470-L577 HydrophobicContact CZ-CD1 4.46Å; R551-L577 CarbonylContact C-O 3.58Å; R551-L577 VanDerWaalsContact CA-O 3.28Å; R551-L577 WeakPolarHBondContact CA-O 3.42Å; Y552-L577 HydrophobicContact CD2-CB 4.46Å; Y552-L577 PolarHBondContact N-O 3.06Å; Y552-L577 PolarHBondContact O-N 2.81Å; L577-L587 HydrophobicContact CG-CD1 4.44Å
578	L	96.5	Very high	95.2	Very high	9 Å²	9	29.3 Å²	29.3	5%	0.047	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	134.3	-170.3	-40.2	175.1	0	0	0	110.8	I440 R551 C576 V580 S585 R586	I440-L578 WeakPolarHBondContact O-CB 3.01Å; R551-L578 HydrophobicContact CG-CD2 3.73Å; C576-L578 HydrophobicContact CB-CD2 4.11Å; L578-V580 PolarHBondContact O-N 2.72Å; L578-S585 CarbonylContact O-C 3.56Å; L578-S585 WeakPolarHBondContact O-CA 3.46Å; L578-S585 WeakPolarHBondContact O-CB 3.43Å; L578-R586 HydrophobicContact CB-CB 4.18Å; L578-R586 HydrophobicContact CD1-CB 4.4Å; L578-R586 HydrophobicContact CG-CB 4.5Å; L578-R586 PolarHBondContact N-O 3.3Å; L578-R586 PolarHBondContact O-N 3.47Å
579	Y	95.4	Very high	95.4	Very high	20 Å²	20	28.8 Å²	28.8	8%	0.078	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	130.9	170.6	176.2	-88.4	0	0	0	110.9	E437 I440 K550 N581 R582	E437-Y579 HydrophobicContact CB-CE1 4.16Å; E437-Y579 HydrophobicContact CG-CE1 4.19Å; I440-Y579 HydrophobicContact CD1-CD1 4.35Å; I440-Y579 HydrophobicContact CG1-CD1 4.33Å; I440-Y579 PolarHBondContact N-O 2.87Å; K550-Y579 VanDerWaalsContact O-CB 3.27Å; K550-Y579 WeakPolarHBondContact O-CB 3.44Å; K550-Y579 PolarHBondContact O-N 2.75Å; Y579-N581 VanDerWaalsContact CE2-O 3.24Å; Y579-N581 WeakPolarHBondContact CE2-O 3.48Å; Y579-R582 PolarHBondContact OH-N 3.12Å
580	V	94.5	Very high	95.6	Very high	23 Å²	23	27.9 Å²	27.9	14%	0.139	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-47	173	174.6	0	0	0	0	110.2	P439 L578 T584 R586	P439-V580 HydrophobicContact CB-CG1 4.46Å; P439-V580 HydrophobicContact CG-CG1 4.46Å; L578-V580 PolarHBondContact O-N 2.72Å; V580-T584 PolarHBondContact N-O 2.95Å; V580-R586 HydrophobicContact CG2-CB 3.84Å
581	N	91.7	Very high	95.7	Very high	59 Å²	59	26 Å²	26	32%	0.316	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	-171.2	163.8	64.3	56.5	0	0	0	109.2	Y579 T583 T584	Y579-N581 VanDerWaalsContact CE2-O 3.24Å; Y579-N581 WeakPolarHBondContact CE2-O 3.48Å; N581-T583 VanDerWaalsContact C-N 3.26Å; N581-T583 PolarHBondContact O-N 2.82Å; N581-T583 PolarHBondContact OD1-N 3.36Å; N581-T583 PolarHBondContact OD1-OG1 3.13Å; N581-T584 PolarHBondContact N-O 3.12Å; N581-T584 VanDerWaalsContact N-O 3.09Å; N581-T584 PolarHBondContact ND2-OG1 2.96Å; N581-T584 PolarHBondContact OD1-N 3.4Å; N581-T584 PolarHBondContact OD1-OG1 2.85Å
582	R	88.6	Confident	95.6	Very high	175 Å²	175	30 Å²	30	66%	0.66	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-35.6	-178.6	-70.8	-174.5	173.2	-173.4	-2.5	113.9	N461 Y579 L639	N461-R582 WeakPolarHBondContact CB-O 3.17Å; N461-R582 PolarHBondContact ND2-O 3.44Å; Y579-R582 PolarHBondContact OH-N 3.12Å; R582-L639 HydrophobicContact CB-CD2 4.05Å; R582-L639 VanDerWaalsContact O-CD2 3.25Å; R582-L639 WeakPolarHBondContact O-CD2 3.22Å
583	T	88.6	Confident	95.6	Very high	40 Å²	40	30 Å²	30	25%	0.245	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	1.7	-171.9	63.1	0	0	0	0	114.3	P459 L460 N581 L635 R638 L639	P459-T583 CarbonylContact C-O 3.44Å; P459-T583 VanDerWaalsContact O-O 3.14Å; L460-T583 PolarHBondContact N-O 2.81Å; N581-T583 VanDerWaalsContact C-N 3.26Å; N581-T583 PolarHBondContact O-N 2.82Å; N581-T583 PolarHBondContact OD1-N 3.36Å; N581-T583 PolarHBondContact OD1-OG1 3.13Å; T583-L635 HydrophobicContact CG2-CD1 3.52Å; T583-R638 PolarHBondContact O-NH2 2.88Å; T583-L639 HydrophobicContact CG2-CD2 4.09Å
584	T	93.7	Very high	95.4	Very high	31 Å²	31	32.2 Å²	32.2	19%	0.19	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	147.4	174.6	75.2	0	0	0	0	112.6	I458 L460 V580 N581	I458-T584 VanDerWaalsContact O-CA 3.31Å; I458-T584 WeakPolarHBondContact O-CA 3.45Å; L460-T584 CarbonylContact O-C 3.57Å; L460-T584 WeakPolarHBondContact O-CA 3.28Å; V580-T584 PolarHBondContact N-O 2.95Å; N581-T584 PolarHBondContact N-O 3.12Å; N581-T584 VanDerWaalsContact N-O 3.09Å; N581-T584 PolarHBondContact ND2-OG1 2.96Å; N581-T584 PolarHBondContact OD1-N 3.4Å; N581-T584 PolarHBondContact OD1-OG1 2.85Å
585	S	95.7	Very high	95.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	148.4	176.8	48.7	0	0	0	0	110.5	I458 L460 L465 L578	I458-S585 PolarHBondContact N-O 2.88Å; I458-S585 PolarHBondContact O-N 2.83Å; L460-S585 WeakPolarHBondContact O-CB 3.22Å; L460-S585 PolarHBondContact O-N 3.34Å; L460-S585 PolarHBondContact O-OG 3.34Å; L465-S585 WeakPolarHBondContact CD2-OG 3.39Å; L578-S585 CarbonylContact O-C 3.56Å; L578-S585 WeakPolarHBondContact O-CA 3.46Å; L578-S585 WeakPolarHBondContact O-CB 3.43Å
586	R	96.9	Very high	94.9	Very high	92 Å²	92	38.3 Å²	38.3	35%	0.347	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.6	178.8	-173.4	159.5	-67.1	169.2	1.7	109.6	D457 L578 V580	D457-R586 VanDerWaalsContact CG-NH2 3.35Å; D457-R586 WeakPolarHBondContact OD1-CB 3.4Å; D457-R586 IonicContact OD1-CZ 2.75Å; D457-R586 VanDerWaalsContact OD1-CZ 3.32Å; D457-R586 IonicContact OD1-NE 2.73Å; D457-R586 PolarHBondContact OD1-NE 2.89Å; D457-R586 IonicContact OD1-NH2 3.59Å; D457-R586 PolarHBondContact OD1-NH2 3.42Å; D457-R586 VanDerWaalsContact OD1-NH2 3.08Å; D457-R586 IonicContact OD2-CZ 3.53Å; D457-R586 IonicContact OD2-NE 2.73Å; D457-R586 IonicContact OD2-NH2 3.46Å; D457-R586 PolarHBondContact OD2-NH2 3.04Å; L578-R586 HydrophobicContact CB-CB 4.18Å; L578-R586 HydrophobicContact CD1-CB 4.4Å; L578-R586 HydrophobicContact CG-CB 4.5Å; L578-R586 PolarHBondContact N-O 3.3Å; L578-R586 PolarHBondContact O-N 3.47Å; V580-R586 HydrophobicContact CG2-CB 3.84Å
587	L	97.5	Very high	94.6	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	107.9	166.4	179.9	60.5	0	0	0	108.1	N455 T456 I458 L465 I469 L577 V589 L626	N455-L587 WeakPolarHBondContact CA-O 3.36Å; T456-L587 PolarHBondContact N-O 2.72Å; T456-L587 PolarHBondContact O-N 2.86Å; I458-L587 HydrophobicContact CD1-CB 4.43Å; I458-L587 HydrophobicContact CG1-CB 3.82Å; L465-L587 HydrophobicContact CD2-CB 4.23Å; I469-L587 HydrophobicContact CD1-CD1 4Å; I469-L587 HydrophobicContact CD1-CD2 4.11Å; L577-L587 HydrophobicContact CG-CD1 4.44Å; L587-V589 HydrophobicContact CD1-CG2 3.73Å; L587-V589 HydrophobicContact CG-CG2 3.98Å; L587-L626 HydrophobicContact CD2-CD1 3.79Å
588	H	97.3	Very high	94.2	Very high	13 Å²	13	49.5 Å²	49.5	6%	0.06	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.2	169.7	-174.6	-116.2	0	0	0	109.6	H448 V452 A454 N455 C576	H448-H588 AromaticContact CD2-CE1 3.52Å; H448-H588 AromaticContact CD2-ND1 3.97Å; H448-H588 AromaticContact CE1-CE1 3.45Å; H448-H588 PolarHBondContact CE1-CE1 2.88Å; H448-H588 VanDerWaalsContact CE1-CE1 3.45Å; H448-H588 AromaticContact CE1-ND1 3.13Å; H448-H588 PolarHBondContact CE1-ND1 3Å; H448-H588 AromaticContact CG-CE1 3.58Å; H448-H588 AromaticContact ND1-CE1 3.53Å; H448-H588 AromaticContact ND1-ND1 3.51Å; H448-H588 AromaticContact NE2-CE1 3.43Å; H448-H588 PolarHBondContact NE2-CE1 2.83Å; H448-H588 AromaticContact NE2-ND1 3.42Å; H448-H588 PolarHBondContact NE2-ND1 3.37Å; V452-H588 WeakPolarHBondContact CG1-NE2 3.23Å; V452-H588 WeakPolarHBondContact CG2-NE2 3.21Å; A454-H588 CarbonylContact O-C 3.56Å; A454-H588 VanDerWaalsContact O-CA 3.3Å; A454-H588 WeakPolarHBondContact O-CA 3.2Å; A454-H588 PolarHBondContact O-CD2 3.34Å; N455-H588 VanDerWaalsContact CG-CD2 3.45Å; C576-H588 HydrophobicContact CB-CB 4.23Å; C576-H588 PolarHBondContact N-O 2.94Å; C576-H588 PolarHBondContact O-N 3.19Å
589	V	97.8	Very high	93.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	128	-179.2	-169	0	0	0	0	110.6	V452 Y453 A454 R574 Y575 L587 F619	V452-V589 WeakPolarHBondContact CA-O 3.44Å; Y453-V589 PolarHBondContact N-O 3.25Å; A454-V589 HydrophobicContact CB-CB 4.17Å; A454-V589 HydrophobicContact CB-CG2 4.15Å; A454-V589 PolarHBondContact N-O 2.92Å; A454-V589 PolarHBondContact O-N 2.91Å; R574-V589 WeakPolarHBondContact O-CA 3.44Å; Y575-V589 HydrophobicContact CD1-CB 4.43Å; Y575-V589 HydrophobicContact CD1-CG1 3.97Å; Y575-V589 HydrophobicContact CD1-CG2 3.53Å; Y575-V589 HydrophobicContact CE1-CG1 4.12Å; Y575-V589 HydrophobicContact CE1-CG2 4.06Å; Y575-V589 HydrophobicContact CG-CG1 4.22Å; Y575-V589 HydrophobicContact CG-CG2 4.24Å; L587-V589 HydrophobicContact CD1-CG2 3.73Å; L587-V589 HydrophobicContact CG-CG2 3.98Å; V589-F619 HydrophobicContact CB-CE1 4.36Å; V589-F619 HydrophobicContact CG1-CD1 4.3Å; V589-F619 HydrophobicContact CG1-CE1 3.7Å; V589-F619 HydrophobicContact CG1-CE2 4.13Å; V589-F619 HydrophobicContact CG1-CZ 3.6Å; V589-F619 HydrophobicContact CG2-CE1 4.42Å
590	S	97.3	Very high	93.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	137.3	177	51.5	0	0	0	0	110.6	H448 P449 R451 S573 R574	H448-S590 WeakPolarHBondContact CA-OG 3.49Å; P449-S590 CarbonylContact O-C 3.57Å; R451-S590 CarbonylContact O-C 3.42Å; R451-S590 VanDerWaalsContact O-CA 3.3Å; R451-S590 WeakPolarHBondContact O-CA 3.4Å; S573-S590 WeakPolarHBondContact CA-O 3.41Å; R574-S590 PolarHBondContact N-O 3.47Å; R574-S590 PolarHBondContact O-N 3.15Å
591	S	97.5	Very high	92.3	Very high	3 Å²	3	63.8 Å²	63.8	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	146.2	-177	-46.5	0	0	0	0	114.2	P449 R451 V572 S573	P449-S591 CarbonylContact O-C 3.57Å; P449-S591 VanDerWaalsContact O-C 3.28Å; P449-S591 PolarHBondContact O-N 2.97Å; R451-S591 PolarHBondContact N-O 2.68Å; R451-S591 PolarHBondContact O-N 3.37Å; V572-S591 CarbonylContact O-C 3.19Å; V572-S591 WeakPolarHBondContact O-CA 3.38Å; V572-S591 VanDerWaalsContact O-CB 3.31Å; V572-S591 WeakPolarHBondContact O-CB 3.12Å; S573-S591 WeakPolarHBondContact CB-OG 3.31Å; S573-S591 WeakPolarHBondContact OG-CB 3.41Å; S573-S591 PolarHBondContact OG-OG 2.88Å
592	Q	95.5	Very high	91.7	Very high	90 Å²	90	62.4 Å²	62.4	42%	0.421	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	144.8	-179	-162.1	176.9	35.4	0	0	111.6	P449 V571 V572	P449-Q592 HydrophobicContact CB-CB 4.48Å; V571-Q592 WeakPolarHBondContact CA-O 3.17Å; V572-Q592 PolarHBondContact N-O 3.39Å; V572-Q592 PolarHBondContact O-N 3.29Å
593	V	95.6	Very high	91.7	Very high	22 Å²	22	54.2 Å²	54.2	13%	0.133	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123.7	167.7	-175.3	0	0	0	0	108.6	F569 Y595 I607 E608 C611	F569-V593 HydrophobicContact CB-CG1 4.2Å; F569-V593 HydrophobicContact CD2-CG1 3.86Å; F569-V593 HydrophobicContact CG-CG1 4.32Å; V593-Y595 HydrophobicContact CB-CE2 4.36Å; V593-Y595 HydrophobicContact CG1-CD2 4.4Å; V593-Y595 HydrophobicContact CG1-CE2 3.72Å; V593-I607 HydrophobicContact CG1-CG2 4.21Å; V593-E608 HydrophobicContact CB-CG 4.29Å; V593-E608 HydrophobicContact CG2-CG 4.33Å; V593-C611 HydrophobicContact CG2-CB 3.67Å
594	I	94.5	Very high	91.7	Very high	52 Å²	52	57.3 Å²	57.3	27%	0.267	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.5	-179.3	-56.1	-173.7	0	0	0	109.2	F569 Y570 V572	F569-I594 CarbonylContact C-O 3.28Å; F569-I594 WeakPolarHBondContact CA-O 3.49Å; F569-I594 WeakPolarHBondContact CB-O 3.44Å; Y570-I594 HydrophobicContact CD1-CB 4.27Å; Y570-I594 HydrophobicContact CD1-CG2 4.46Å; Y570-I594 HydrophobicContact CD2-CB 4.32Å; Y570-I594 HydrophobicContact CE1-CB 3.87Å; Y570-I594 HydrophobicContact CE1-CG2 3.68Å; Y570-I594 HydrophobicContact CE2-CB 3.97Å; Y570-I594 HydrophobicContact CE2-CD1 3.9Å; Y570-I594 HydrophobicContact CE2-CG1 4.31Å; Y570-I594 HydrophobicContact CE2-CG2 4.38Å; Y570-I594 HydrophobicContact CG-CB 4.49Å; Y570-I594 PolarHBondContact N-O 3.32Å; Y570-I594 PolarHBondContact O-N 3.37Å; V572-I594 HydrophobicContact CB-CD1 4.37Å; V572-I594 HydrophobicContact CG2-CD1 3.58Å; V572-I594 HydrophobicContact CG2-CG1 4.32Å
595	Y	94.2	Very high	91.4	Very high	55 Å²	55	58.7 Å²	58.7	22%	0.216	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	114.2	-177.4	-69.5	-91.3	0	0	0	110.6	C568 F569 V593 V599 K604 I607 E608	C568-Y595 CarbonylContact O-C 3.42Å; C568-Y595 WeakPolarHBondContact O-CA 3.15Å; F569-Y595 HydrophobicContact CB-CD1 3.78Å; F569-Y595 HydrophobicContact CB-CE1 3.88Å; F569-Y595 HydrophobicContact CB-CG 4.32Å; F569-Y595 HydrophobicContact CG-CE1 4.46Å; V593-Y595 HydrophobicContact CB-CE2 4.36Å; V593-Y595 HydrophobicContact CG1-CD2 4.4Å; V593-Y595 HydrophobicContact CG1-CE2 3.72Å; Y595-V599 HydrophobicContact CD1-CG1 3.9Å; Y595-V599 HydrophobicContact CD1-CG2 4.08Å; Y595-V599 HydrophobicContact CE1-CG1 3.94Å; Y595-V599 HydrophobicContact CE1-CG2 3.84Å; Y595-K604 HydrophobicContact CE2-CD 4.21Å; Y595-K604 HydrophobicContact CE2-CG 4.06Å; Y595-K604 PolarHBondContact OH-O 2.81Å; Y595-I607 HydrophobicContact CE1-CD1 3.96Å; Y595-I607 HydrophobicContact CE1-CG2 4.4Å; Y595-I607 WeakPolarHBondContact OH-CB 3.44Å; Y595-I607 WeakPolarHBondContact OH-CG2 3.31Å; Y595-E608 HydrophobicContact CE2-CG 4.39Å
596	E	91	Very high	91	Very high	118 Å²	118	64 Å²	64	55%	0.551	32%	0.32	S	S	*	.	S	Bend	trans	-82.8	-24.3	173.3	-65.9	-177.9	177.4	0	0	111.9	K557 C568 Y570	K557-E596 IonicContact NZ-OE1 3.6Å; K557-E596 PolarHBondContact NZ-OE1 2.69Å; C568-E596 PolarHBondContact O-N 3.02Å; Y570-E596 HydrophobicContact CD1-CG 3.71Å; Y570-E596 WeakPolarHBondContact CD1-OE1 3.08Å; Y570-E596 HydrophobicContact CE1-CG 3.5Å; Y570-E596 WeakPolarHBondContact CE1-OE1 3.37Å
597	K	90.6	Very high	90.7	Very high	104 Å²	104	60.3 Å²	60.3	45%	0.452	31%	0.307	S	S	.	.	S	Bend	trans	-132.3	148.9	-179.9	-51.9	-173.1	-170.4	170.2	0	111.4	N567 C568 V599	N567-K597 WeakPolarHBondContact O-CD 3.14Å; N567-K597 WeakPolarHBondContact O-CE 3.46Å; N567-K597 PolarHBondContact O-NZ 3.35Å; C568-K597 HydrophobicContact CB-CB 4.15Å; C568-K597 PolarHBondContact O-N 3.2Å; C568-K597 VanDerWaalsContact O-N 3.15Å; K597-V599 PolarHBondContact O-N 3.01Å
598	P	87.5	Confident	90.4	Very high	131 Å²	131	63.3 Å²	63.3	85%	0.851	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-63.7	130.4	176.8	27.1	-34.8	0	0	0	111
599	V	87.9	Confident	90.1	Very high	35 Å²	35	67 Å²	67	21%	0.212	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-101.7	155.7	172	-63	0	0	0	0	110.6	L565 C568 Y595 K597 A603 K604 I607	L565-V599 HydrophobicContact CD1-CG1 4.49Å; C568-V599 HydrophobicContact CB-CG1 3.59Å; Y595-V599 HydrophobicContact CD1-CG1 3.9Å; Y595-V599 HydrophobicContact CD1-CG2 4.08Å; Y595-V599 HydrophobicContact CE1-CG1 3.94Å; Y595-V599 HydrophobicContact CE1-CG2 3.84Å; K597-V599 PolarHBondContact O-N 3.01Å; V599-A603 HydrophobicContact CB-CB 4.01Å; V599-A603 HydrophobicContact CG2-CB 4.24Å; V599-K604 HydrophobicContact CG2-CB 3.83Å; V599-I607 HydrophobicContact CG1-CD1 4.1Å
600	F	82.1	Confident	89.8	Confident	103 Å²	103	71.7 Å²	71.7	45%	0.452	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-71.3	162.5	-176.3	63.3	-99.1	0	0	0	113.2	L565 G602 A603 W747	L565-F600 HydrophobicContact CD1-CD1 4.44Å; L565-F600 HydrophobicContact CD1-CE1 3.87Å; L565-F600 HydrophobicContact CD1-CZ 4.5Å; L565-F600 HydrophobicContact CD2-CE1 4.44Å; F600-G602 PolarHBondContact O-N 3.29Å; F600-A603 HydrophobicContact CD1-CB 4.01Å; F600-A603 HydrophobicContact CD2-CB 3.8Å; F600-A603 HydrophobicContact CE1-CB 3.96Å; F600-A603 HydrophobicContact CE2-CB 3.74Å; F600-A603 HydrophobicContact CG-CB 3.92Å; F600-A603 HydrophobicContact CZ-CB 3.83Å; F600-A603 VanDerWaalsContact O-CB 3.26Å; F600-A603 WeakPolarHBondContact O-CB 3.47Å; F600-A603 PolarHBondContact O-N 3.23Å; F600-W747 HydrophobicContact CB-CH2 3.57Å; F600-W747 HydrophobicContact CB-CZ2 4.41Å; F600-W747 HydrophobicContact CB-CZ3 4.2Å; F600-W747 HydrophobicContact CG-CH2 4.33Å
601	F	76.8	Confident	89.5	Confident	214 Å²	214	72.6 Å²	72.6	94%	0.939	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	124.3	-177.1	-175.5	-96.4	0	0	0	111.4	A603	F601-A603 VanDerWaalsContact C-N 3.34Å; F601-A603 PolarHBondContact O-N 2.85Å
602	G	80.1	Confident	89.3	Confident	30 Å²	30	74.3 Å²	74.3	31%	0.309	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	-19	-174.7	0	0	0	0	0	115.6	F600 K604 S605 I606	F600-G602 PolarHBondContact O-N 3.29Å; G602-K604 PolarHBondContact O-N 2.65Å; G602-S605 PolarHBondContact O-OG 3.06Å; G602-I606 WeakPolarHBondContact O-CG1 3.43Å
603	A	86.9	Confident	89.2	Confident	3 Å²	3	74 Å²	74	3%	0.025	39%	0.391	C	S	.	.	H	α-helix	trans	-64.9	-40.5	177	0	0	0	0	0	112.2	L565 V599 F600 F601 S605 I606 I607	L565-A603 HydrophobicContact CD1-CB 3.86Å; V599-A603 HydrophobicContact CB-CB 4.01Å; V599-A603 HydrophobicContact CG2-CB 4.24Å; F600-A603 HydrophobicContact CD1-CB 4.01Å; F600-A603 HydrophobicContact CD2-CB 3.8Å; F600-A603 HydrophobicContact CE1-CB 3.96Å; F600-A603 HydrophobicContact CE2-CB 3.74Å; F600-A603 HydrophobicContact CG-CB 3.92Å; F600-A603 HydrophobicContact CZ-CB 3.83Å; F600-A603 VanDerWaalsContact O-CB 3.26Å; F600-A603 WeakPolarHBondContact O-CB 3.47Å; F600-A603 PolarHBondContact O-N 3.23Å; F601-A603 VanDerWaalsContact C-N 3.34Å; F601-A603 PolarHBondContact O-N 2.85Å; A603-S605 PolarHBondContact O-N 2.84Å; A603-I606 PolarHBondContact O-N 3.43Å; A603-I606 VanDerWaalsContact O-N 3.14Å; A603-I607 WeakPolarHBondContact O-CG1 3.35Å; A603-I607 PolarHBondContact O-N 3.23Å
604	K	88.5	Confident	89	Confident	105 Å²	105	74.8 Å²	74.8	46%	0.457	40%	0.403	S	S	.	.	H	α-helix	trans	-54	-49.4	-178.3	176	167	-178.2	179.9	0	112.6	Y595 V599 G602 I606 I607 E608	Y595-K604 HydrophobicContact CE2-CD 4.21Å; Y595-K604 HydrophobicContact CE2-CG 4.06Å; Y595-K604 PolarHBondContact OH-O 2.81Å; V599-K604 HydrophobicContact CG2-CB 3.83Å; G602-K604 PolarHBondContact O-N 2.65Å; K604-I606 VanDerWaalsContact C-N 3.35Å; K604-I606 PolarHBondContact O-N 3.43Å; K604-I607 PolarHBondContact O-N 3.3Å; K604-E608 WeakPolarHBondContact CE-OE1 3.35Å; K604-E608 WeakPolarHBondContact CE-OE2 3.49Å; K604-E608 HydrophobicContact CG-CG 4.5Å; K604-E608 WeakPolarHBondContact CG-OE2 3.06Å; K604-E608 IonicContact NZ-OE1 3.76Å; K604-E608 PolarHBondContact NZ-OE1 2.84Å; K604-E608 WeakPolarHBondContact O-CB 3.48Å; K604-E608 WeakPolarHBondContact O-CG 3.33Å; K604-E608 PolarHBondContact O-N 3.36Å
605	S	87.4	Confident	89.1	Confident	60 Å²	60	73.5 Å²	73.5	42%	0.42	40%	0.397	S	S	.	.	H	α-helix	trans	-70.4	-28.5	180	45.2	0	0	0	0	113.3	G602 A603 N609	G602-S605 PolarHBondContact O-OG 3.06Å; A603-S605 PolarHBondContact O-N 2.84Å; S605-N609 VanDerWaalsContact O-CB 3.26Å; S605-N609 WeakPolarHBondContact O-CB 3.48Å; S605-N609 PolarHBondContact O-N 2.96Å; S605-N609 VanDerWaalsContact O-N 3.08Å; S605-N609 PolarHBondContact O-ND2 3.05Å; S605-N609 PolarHBondContact O-OD1 3.37Å
606	I	88.6	Confident	89.1	Confident	112 Å²	112	72.2 Å²	72.2	57%	0.574	40%	0.396	S	S	*	.	H	α-helix	trans	-68.1	-49	172.5	-63.8	167.3	0	0	0	109.8	G602 A603 K604 N609 T610	G602-I606 WeakPolarHBondContact O-CG1 3.43Å; A603-I606 PolarHBondContact O-N 3.43Å; A603-I606 VanDerWaalsContact O-N 3.14Å; K604-I606 VanDerWaalsContact C-N 3.35Å; K604-I606 PolarHBondContact O-N 3.43Å; I606-N609 PolarHBondContact O-N 3.49Å; I606-T610 WeakPolarHBondContact O-CB 3.3Å; I606-T610 PolarHBondContact O-N 3.5Å; I606-T610 PolarHBondContact O-OG1 3.37Å; I606-T610 VanDerWaalsContact O-OG1 3.14Å
607	I	90.3	Very high	89.3	Confident	15 Å²	15	69 Å²	69	8%	0.077	38%	0.383	C	S	.	.	H	α-helix	trans	-59.4	-51.2	177.3	-66.7	162.5	0	0	0	110.5	L565 F569 V593 Y595 V599 A603 K604 N609 T610 C611	L565-I607 HydrophobicContact CB-CD1 4.18Å; L565-I607 HydrophobicContact CD1-CD1 3.87Å; F569-I607 HydrophobicContact CD1-CD1 3.93Å; F569-I607 HydrophobicContact CD1-CG1 4.42Å; F569-I607 HydrophobicContact CD1-CG2 3.8Å; F569-I607 HydrophobicContact CD2-CG2 3.82Å; F569-I607 HydrophobicContact CE1-CD1 4.02Å; F569-I607 HydrophobicContact CE1-CG1 4.09Å; F569-I607 HydrophobicContact CE1-CG2 3.68Å; F569-I607 HydrophobicContact CE2-CG2 3.7Å; F569-I607 HydrophobicContact CG-CG2 3.88Å; F569-I607 HydrophobicContact CZ-CG2 3.63Å; V593-I607 HydrophobicContact CG1-CG2 4.21Å; Y595-I607 HydrophobicContact CE1-CD1 3.96Å; Y595-I607 HydrophobicContact CE1-CG2 4.4Å; Y595-I607 WeakPolarHBondContact OH-CB 3.44Å; Y595-I607 WeakPolarHBondContact OH-CG2 3.31Å; V599-I607 HydrophobicContact CG1-CD1 4.1Å; A603-I607 WeakPolarHBondContact O-CG1 3.35Å; A603-I607 PolarHBondContact O-N 3.23Å; K604-I607 PolarHBondContact O-N 3.3Å; I607-N609 VanDerWaalsContact C-N 3.35Å; I607-N609 PolarHBondContact O-N 3Å; I607-T610 PolarHBondContact O-N 2.93Å; I607-C611 WeakPolarHBondContact O-CB 3.24Å; I607-C611 PolarHBondContact O-N 3.23Å; I607-C611 PolarHBondContact O-SG 2.88Å; I607-C611 VanDerWaalsContact O-SG 3.38Å
608	E	91.5	Very high	89.5	Confident	65 Å²	65	66.6 Å²	66.6	30%	0.304	37%	0.372	S	S	.	.	H	α-helix	trans	-60.5	-41.7	-179.1	-77.2	171.8	158.5	0	0	112.1	V593 Y595 K604 H612	V593-E608 HydrophobicContact CB-CG 4.29Å; V593-E608 HydrophobicContact CG2-CG 4.33Å; Y595-E608 HydrophobicContact CE2-CG 4.39Å; K604-E608 WeakPolarHBondContact CE-OE1 3.35Å; K604-E608 WeakPolarHBondContact CE-OE2 3.49Å; K604-E608 HydrophobicContact CG-CG 4.5Å; K604-E608 WeakPolarHBondContact CG-OE2 3.06Å; K604-E608 IonicContact NZ-OE1 3.76Å; K604-E608 PolarHBondContact NZ-OE1 2.84Å; K604-E608 WeakPolarHBondContact O-CB 3.48Å; K604-E608 WeakPolarHBondContact O-CG 3.33Å; K604-E608 PolarHBondContact O-N 3.36Å; E608-H612 WeakPolarHBondContact O-CB 3.4Å; E608-H612 PolarHBondContact O-N 2.65Å
609	N	90.3	Very high	89.9	Confident	91 Å²	91	60.5 Å²	60.5	49%	0.487	33%	0.332	S	S	.	.	H	α-helix	trans	-68.7	-39.2	176.9	-71.5	-1.6	0	0	0	112.7	S605 I606 I607 S613	S605-N609 VanDerWaalsContact O-CB 3.26Å; S605-N609 WeakPolarHBondContact O-CB 3.48Å; S605-N609 PolarHBondContact O-N 2.96Å; S605-N609 VanDerWaalsContact O-N 3.08Å; S605-N609 PolarHBondContact O-ND2 3.05Å; S605-N609 PolarHBondContact O-OD1 3.37Å; I606-N609 PolarHBondContact O-N 3.49Å; I607-N609 VanDerWaalsContact C-N 3.35Å; I607-N609 PolarHBondContact O-N 3Å; N609-S613 WeakPolarHBondContact O-CB 3.49Å; N609-S613 PolarHBondContact O-N 3.15Å
610	T	90.9	Very high	90.3	Very high	98 Å²	98	63 Å²	63	60%	0.601	35%	0.345	S	S	*	.	H	α-helix	trans	-68.1	-44.1	176	-64.8	0	0	0	0	111.7	I606 I607 S613 G614	I606-T610 WeakPolarHBondContact O-CB 3.3Å; I606-T610 PolarHBondContact O-N 3.5Å; I606-T610 PolarHBondContact O-OG1 3.37Å; I606-T610 VanDerWaalsContact O-OG1 3.14Å; I607-T610 PolarHBondContact O-N 2.93Å; T610-S613 PolarHBondContact O-N 2.91Å; T610-G614 PolarHBondContact O-N 3.17Å; T610-G614 VanDerWaalsContact O-N 3.08Å
611	C	92.8	Very high	90.9	Very high	18 Å²	18	59.3 Å²	59.3	12%	0.122	33%	0.33	C	S	.	.	H	α-helix	trans	-60.4	-47	172.8	-73.3	0	0	0	0	111.1	V593 I607 S613 G614 L615	V593-C611 HydrophobicContact CG2-CB 3.67Å; I607-C611 WeakPolarHBondContact O-CB 3.24Å; I607-C611 PolarHBondContact O-N 3.23Å; I607-C611 PolarHBondContact O-SG 2.88Å; I607-C611 VanDerWaalsContact O-SG 3.38Å; C611-S613 PolarHBondContact O-N 3.38Å; C611-G614 PolarHBondContact O-N 3.46Å; C611-L615 WeakPolarHBondContact O-CB 3.15Å; C611-L615 WeakPolarHBondContact O-CD1 3.45Å; C611-L615 WeakPolarHBondContact O-CG 3.34Å; C611-L615 PolarHBondContact O-N 3.01Å
612	H	92.8	Very high	91.8	Very high	40 Å²	40	49.2 Å²	49.2	19%	0.185	29%	0.286	C	S	.	.	H	α-helix	trans	-58	-49.7	178.4	177.9	50.8	0	0	0	112	R451 Y453 E608 G614 L615 S616	R451-H612 PolarHBondContact NH1-CE1 2.88Å; R451-H612 PolarHBondContact NH1-NE2 3.13Å; Y453-H612 AromaticContact CE1-CE1 3.66Å; Y453-H612 AromaticContact CE1-ND1 3.21Å; Y453-H612 WeakPolarHBondContact CE1-ND1 3.35Å; Y453-H612 AromaticContact CZ-ND1 3.42Å; Y453-H612 WeakPolarHBondContact OH-CA 3.15Å; Y453-H612 PolarHBondContact OH-ND1 2.85Å; E608-H612 WeakPolarHBondContact O-CB 3.4Å; E608-H612 PolarHBondContact O-N 2.65Å; H612-G614 VanDerWaalsContact C-N 3.3Å; H612-G614 PolarHBondContact O-N 3Å; H612-L615 PolarHBondContact O-N 2.78Å; H612-S616 PolarHBondContact CE1-OG 3.43Å; H612-S616 PolarHBondContact O-N 3.25Å; H612-S616 PolarHBondContact O-OG 3.01Å
613	S	92.3	Very high	92.6	Very high	83 Å²	83	48.4 Å²	48.4	58%	0.58	28%	0.276	S	S	*	.	H	α-helix	trans	-61.5	-36.3	178.5	-179.3	0	0	0	0	113.1	N609 T610 C611 D617	N609-S613 WeakPolarHBondContact O-CB 3.49Å; N609-S613 PolarHBondContact O-N 3.15Å; T610-S613 PolarHBondContact O-N 2.91Å; C611-S613 PolarHBondContact O-N 3.38Å; S613-D617 WeakPolarHBondContact O-CB 3.39Å; S613-D617 PolarHBondContact O-N 2.91Å
614	G	92.8	Very high	93.1	Very high	38 Å²	38	53.2 Å²	53.2	39%	0.392	30%	0.3	S	S	.	.	H	α-helix	trans	-73.3	-37.1	176.8	0	0	0	0	0	113.6	T610 C611 H612 F618	T610-G614 PolarHBondContact O-N 3.17Å; T610-G614 VanDerWaalsContact O-N 3.08Å; C611-G614 PolarHBondContact O-N 3.46Å; H612-G614 VanDerWaalsContact C-N 3.3Å; H612-G614 PolarHBondContact O-N 3Å; G614-F618 WeakPolarHBondContact O-CB 3.14Å; G614-F618 PolarHBondContact O-N 3.32Å
615	L	95.2	Very high	93.4	Very high	25 Å²	25	50.7 Å²	50.7	13%	0.131	29%	0.289	C	S	.	.	H	α-helix	trans	-70.5	-42.1	178.2	-70.6	164.3	0	0	0	111.5	Y453 V571 C611 H612 F618 F619	Y453-L615 HydrophobicContact CD1-CB 3.77Å; Y453-L615 HydrophobicContact CE1-CB 3.36Å; Y453-L615 HydrophobicContact CE1-CD1 4.4Å; Y453-L615 HydrophobicContact CE2-CB 4.29Å; Y453-L615 HydrophobicContact CE2-CD1 4.13Å; Y453-L615 HydrophobicContact CG-CB 4.36Å; V571-L615 HydrophobicContact CG1-CD1 3.97Å; V571-L615 HydrophobicContact CG1-CD2 4.14Å; C611-L615 WeakPolarHBondContact O-CB 3.15Å; C611-L615 WeakPolarHBondContact O-CD1 3.45Å; C611-L615 WeakPolarHBondContact O-CG 3.34Å; C611-L615 PolarHBondContact O-N 3.01Å; H612-L615 PolarHBondContact O-N 2.78Å; L615-F618 PolarHBondContact O-N 3.31Å; L615-F619 HydrophobicContact CB-CD2 4.31Å; L615-F619 HydrophobicContact CB-CE2 4.37Å; L615-F619 HydrophobicContact CD2-CE2 3.86Å; L615-F619 WeakPolarHBondContact O-CB 3.46Å; L615-F619 WeakPolarHBondContact O-CD2 3.43Å; L615-F619 PolarHBondContact O-N 2.91Å
616	S	94.8	Very high	93.7	Very high	28 Å²	28	47.8 Å²	47.8	20%	0.196	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-52.4	173.6	-55.4	0	0	0	0	111.2	H612 F618 F619 D620	H612-S616 PolarHBondContact CE1-OG 3.43Å; H612-S616 PolarHBondContact O-N 3.25Å; H612-S616 PolarHBondContact O-OG 3.01Å; S616-F618 PolarHBondContact O-N 3.44Å; S616-F618 VanDerWaalsContact O-N 3.16Å; S616-F619 PolarHBondContact O-N 2.85Å; S616-F619 VanDerWaalsContact O-N 3.13Å; S616-D620 WeakPolarHBondContact O-CB 3.26Å; S616-D620 PolarHBondContact O-N 2.86Å
617	D	94.4	Very high	94	Very high	51 Å²	51	46.1 Å²	46.1	27%	0.273	26%	0.257	S	S	.	.	H	α-helix	trans	-51.9	-41.5	175.9	175.9	23.9	0	0	0	111.7	R483 K525 S613 T621	R483-D617 IonicContact CZ-OD1 3.54Å; R483-D617 IonicContact CZ-OD2 2.69Å; R483-D617 VanDerWaalsContact NH1-CG 3.32Å; R483-D617 PolarHBondContact NH1-O 3.47Å; R483-D617 IonicContact NH1-OD1 3.51Å; R483-D617 PolarHBondContact NH1-OD1 2.88Å; R483-D617 IonicContact NH1-OD2 3.59Å; R483-D617 IonicContact NH2-OD1 3.82Å; R483-D617 PolarHBondContact NH2-OD1 2.99Å; R483-D617 IonicContact NH2-OD2 2.71Å; R483-D617 PolarHBondContact NH2-OD2 3.15Å; K525-D617 IonicContact NZ-OD1 2.68Å; K525-D617 IonicContact NZ-OD2 3.47Å; K525-D617 PolarHBondContact NZ-OD2 3.29Å; S613-D617 WeakPolarHBondContact O-CB 3.39Å; S613-D617 PolarHBondContact O-N 2.91Å; D617-T621 VanDerWaalsContact O-CB 3.29Å; D617-T621 WeakPolarHBondContact O-CB 3.47Å; D617-T621 PolarHBondContact O-N 3.35Å; D617-T621 PolarHBondContact O-OG1 2.95Å
618	F	95.3	Very high	94.1	Very high	54 Å²	54	49.7 Å²	49.7	24%	0.237	27%	0.273	C	S	.	.	H	α-helix	trans	-67.5	-52.3	175.4	-178.2	-93.5	0	0	0	113.5	F479 G614 L615 S616 T621 I622	F479-F618 HydrophobicContact CE1-CD2 4.34Å; F479-F618 AromaticContact CE1-CE2 3.55Å; F479-F618 HydrophobicContact CE1-CE2 3.55Å; F479-F618 AromaticContact CE1-CZ 3.8Å; F479-F618 HydrophobicContact CE1-CZ 3.8Å; F479-F618 AromaticContact CZ-CD2 3.98Å; F479-F618 HydrophobicContact CZ-CD2 3.98Å; F479-F618 AromaticContact CZ-CE2 3.64Å; F479-F618 HydrophobicContact CZ-CE2 3.64Å; F479-F618 HydrophobicContact CZ-CZ 4.02Å; G614-F618 WeakPolarHBondContact O-CB 3.14Å; G614-F618 PolarHBondContact O-N 3.32Å; L615-F618 PolarHBondContact O-N 3.31Å; S616-F618 PolarHBondContact O-N 3.44Å; S616-F618 VanDerWaalsContact O-N 3.16Å; F618-T621 PolarHBondContact O-N 3.4Å; F618-I622 PolarHBondContact O-N 2.84Å
619	F	96.6	Very high	94	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.009	26%	0.264	C	S	.	.	H	α-helix	trans	-75.5	-30.5	-172.8	-72.2	-57	0	0	0	113.9	Y453 Y575 V589 L615 S616 I622 T623	Y453-F619 HydrophobicContact CD1-CD2 4.16Å; Y453-F619 HydrophobicContact CD2-CD2 4.41Å; Y453-F619 AromaticContact CG-CD2 3.74Å; Y453-F619 HydrophobicContact CG-CD2 3.74Å; Y453-F619 HydrophobicContact CG-CE2 4.29Å; Y575-F619 AromaticContact CE1-CE1 3.69Å; Y575-F619 HydrophobicContact CE1-CE1 3.69Å; Y575-F619 HydrophobicContact CE1-CZ 4.32Å; Y575-F619 AromaticContact CZ-CE1 3.86Å; V589-F619 HydrophobicContact CB-CE1 4.36Å; V589-F619 HydrophobicContact CG1-CD1 4.3Å; V589-F619 HydrophobicContact CG1-CE1 3.7Å; V589-F619 HydrophobicContact CG1-CE2 4.13Å; V589-F619 HydrophobicContact CG1-CZ 3.6Å; V589-F619 HydrophobicContact CG2-CE1 4.42Å; L615-F619 HydrophobicContact CB-CD2 4.31Å; L615-F619 HydrophobicContact CB-CE2 4.37Å; L615-F619 HydrophobicContact CD2-CE2 3.86Å; L615-F619 WeakPolarHBondContact O-CB 3.46Å; L615-F619 WeakPolarHBondContact O-CD2 3.43Å; L615-F619 PolarHBondContact O-N 2.91Å; S616-F619 PolarHBondContact O-N 2.85Å; S616-F619 VanDerWaalsContact O-N 3.13Å; F619-I622 HydrophobicContact CD1-CG2 4.19Å; F619-T623 VanDerWaalsContact O-CB 3.22Å; F619-T623 WeakPolarHBondContact O-CB 3.26Å; F619-T623 PolarHBondContact O-N 2.93Å; F619-T623 VanDerWaalsContact O-N 3.11Å; F619-T623 PolarHBondContact O-OG1 3.01Å
620	D	95.9	Very high	94	Very high	89 Å²	89	43.5 Å²	43.5	48%	0.476	24%	0.241	S	C	.	.	H	α-helix	trans	-64.5	-48.8	168.2	-68.6	-38.5	0	0	0	110	S616 I622 T623 I624	S616-D620 WeakPolarHBondContact O-CB 3.26Å; S616-D620 PolarHBondContact O-N 2.86Å; D620-I622 PolarHBondContact O-N 3.33Å; D620-T623 PolarHBondContact O-N 3.25Å; D620-I624 WeakPolarHBondContact O-CD1 3.26Å; D620-I624 VanDerWaalsContact O-CG1 3.31Å; D620-I624 WeakPolarHBondContact O-CG1 3.39Å; D620-I624 PolarHBondContact O-N 3.02Å
621	T	95.6	Very high	93.9	Very high	24 Å²	24	43.9 Å²	43.9	15%	0.147	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-46.5	179.9	-55.4	0	0	0	0	111.9	F479 R483 D617 F618 T623 I624 K625	F479-T621 HydrophobicContact CD2-CG2 4.46Å; F479-T621 HydrophobicContact CE2-CG2 3.89Å; R483-T621 HydrophobicContact CG-CG2 4.19Å; R483-T621 PolarHBondContact NH1-OG1 3.11Å; D617-T621 VanDerWaalsContact O-CB 3.29Å; D617-T621 WeakPolarHBondContact O-CB 3.47Å; D617-T621 PolarHBondContact O-N 3.35Å; D617-T621 PolarHBondContact O-OG1 2.95Å; F618-T621 PolarHBondContact O-N 3.4Å; T621-T623 VanDerWaalsContact C-N 3.33Å; T621-T623 PolarHBondContact O-N 3.43Å; T621-I624 PolarHBondContact O-N 3.08Å; T621-K625 HydrophobicContact CG2-CG 4.38Å; T621-K625 WeakPolarHBondContact O-CB 3.32Å; T621-K625 WeakPolarHBondContact O-CG 3.37Å; T621-K625 PolarHBondContact O-N 3.22Å
622	I	96	Very high	93.6	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.015	27%	0.27	C	S	.	.	H	α-helix	trans	-66.6	-37.3	-179.3	-155.3	175.3	0	0	0	111	I469 F475 F479 F618 F619 D620 K625 L626	I469-I622 HydrophobicContact CG1-CD1 4.5Å; I469-I622 HydrophobicContact CG2-CD1 4.49Å; F475-I622 HydrophobicContact CE1-CG1 4.17Å; F475-I622 HydrophobicContact CZ-CG1 4.24Å; F479-I622 HydrophobicContact CD1-CD1 4.26Å; F479-I622 HydrophobicContact CD1-CG1 4.29Å; F479-I622 HydrophobicContact CD2-CB 4.37Å; F479-I622 HydrophobicContact CD2-CG1 4.17Å; F479-I622 HydrophobicContact CE1-CB 4.26Å; F479-I622 HydrophobicContact CE1-CD1 3.81Å; F479-I622 HydrophobicContact CE1-CG1 3.95Å; F479-I622 HydrophobicContact CE2-CB 3.6Å; F479-I622 HydrophobicContact CE2-CG1 3.83Å; F479-I622 HydrophobicContact CG-CG1 4.39Å; F479-I622 HydrophobicContact CZ-CB 3.54Å; F479-I622 HydrophobicContact CZ-CD1 4Å; F479-I622 HydrophobicContact CZ-CG1 3.72Å; F618-I622 PolarHBondContact O-N 2.84Å; F619-I622 HydrophobicContact CD1-CG2 4.19Å; D620-I622 PolarHBondContact O-N 3.33Å; I622-K625 PolarHBondContact O-N 3.43Å; I622-L626 HydrophobicContact CG1-CD1 4.19Å; I622-L626 HydrophobicContact CG1-CG 4.37Å; I622-L626 VanDerWaalsContact O-CB 3.27Å; I622-L626 WeakPolarHBondContact O-CB 3.48Å; I622-L626 WeakPolarHBondContact O-CD1 3.27Å; I622-L626 WeakPolarHBondContact O-CG 3.02Å; I622-L626 PolarHBondContact O-N 2.81Å
623	T	96.5	Very high	93.2	Very high	13 Å²	13	48.1 Å²	48.1	8%	0.08	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-43.1	177.6	-63.4	0	0	0	0	111.9	T456 I458 F619 D620 T621 K627	T456-T623 HydrophobicContact CG2-CG2 4.04Å; T456-T623 WeakPolarHBondContact OG1-CG2 3.23Å; I458-T623 HydrophobicContact CD1-CG2 4.28Å; F619-T623 VanDerWaalsContact O-CB 3.22Å; F619-T623 WeakPolarHBondContact O-CB 3.26Å; F619-T623 PolarHBondContact O-N 2.93Å; F619-T623 VanDerWaalsContact O-N 3.11Å; F619-T623 PolarHBondContact O-OG1 3.01Å; D620-T623 PolarHBondContact O-N 3.25Å; T621-T623 VanDerWaalsContact C-N 3.33Å; T621-T623 PolarHBondContact O-N 3.43Å; T623-K627 HydrophobicContact CG2-CD 4.47Å; T623-K627 WeakPolarHBondContact O-CG 3.32Å; T623-K627 PolarHBondContact O-N 2.68Å
624	I	95.8	Very high	92.9	Very high	103 Å²	103	47 Å²	47	53%	0.528	26%	0.258	S	S	.	.	H	α-helix	trans	-63.4	-50.7	174.9	-69.4	162.1	0	0	0	109.9	D620 T621 L626 K627 E628	D620-I624 WeakPolarHBondContact O-CD1 3.26Å; D620-I624 VanDerWaalsContact O-CG1 3.31Å; D620-I624 WeakPolarHBondContact O-CG1 3.39Å; D620-I624 PolarHBondContact O-N 3.02Å; T621-I624 PolarHBondContact O-N 3.08Å; I624-L626 PolarHBondContact O-N 3.49Å; I624-K627 PolarHBondContact O-N 3.02Å; I624-K627 VanDerWaalsContact O-N 3.15Å; I624-E628 PolarHBondContact O-N 2.78Å
625	K	94.9	Very high	92.4	Very high	52 Å²	52	50.1 Å²	50.1	23%	0.226	27%	0.265	C	S	.	.	H	α-helix	trans	-67	-34.6	-177.2	-72.8	-67.4	175.6	-157.5	0	113.3	F475 F479 T621 I622 K627 E628 F629	F475-K625 HydrophobicContact CE2-CB 3.96Å; F475-K625 WeakPolarHBondContact CE2-O 3.37Å; F475-K625 HydrophobicContact CZ-CB 4.09Å; F479-K625 HydrophobicContact CD2-CB 4.48Å; T621-K625 HydrophobicContact CG2-CG 4.38Å; T621-K625 WeakPolarHBondContact O-CB 3.32Å; T621-K625 WeakPolarHBondContact O-CG 3.37Å; T621-K625 PolarHBondContact O-N 3.22Å; I622-K625 PolarHBondContact O-N 3.43Å; K625-K627 VanDerWaalsContact C-N 3.31Å; K625-K627 PolarHBondContact O-N 2.86Å; K625-E628 WeakPolarHBondContact CD-OE2 3.15Å; K625-E628 IonicContact NZ-OE1 3.2Å; K625-E628 PolarHBondContact NZ-OE1 3.49Å; K625-E628 IonicContact NZ-OE2 3.68Å; K625-E628 PolarHBondContact NZ-OE2 3.31Å; K625-F629 WeakPolarHBondContact O-CB 3.45Å; K625-F629 PolarHBondContact O-N 3.39Å
626	L	94.7	Very high	91.8	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-38.4	172.3	-79.5	166.9	0	0	0	112.1	I458 L460 L465 C468 I469 F475 L587 I622 I624 A630	I458-L626 HydrophobicContact CD1-CB 4.27Å; I458-L626 HydrophobicContact CD1-CD1 4.49Å; I458-L626 HydrophobicContact CG2-CB 4.01Å; L460-L626 HydrophobicContact CD1-CD2 4.31Å; L465-L626 HydrophobicContact CD1-CD1 3.97Å; L465-L626 HydrophobicContact CD1-CD2 4.1Å; C468-L626 HydrophobicContact CB-CD2 3.76Å; I469-L626 HydrophobicContact CD1-CD1 3.91Å; I469-L626 HydrophobicContact CG1-CD1 4.23Å; I469-L626 HydrophobicContact CG1-CD2 4.36Å; F475-L626 HydrophobicContact CD1-CD2 4.02Å; F475-L626 HydrophobicContact CE1-CD2 3.5Å; F475-L626 VanDerWaalsContact CE1-CD2 3.5Å; F475-L626 HydrophobicContact CE1-CG 3.87Å; F475-L626 HydrophobicContact CE2-CD2 4.18Å; F475-L626 HydrophobicContact CE2-CG 4.34Å; F475-L626 HydrophobicContact CZ-CB 4.36Å; F475-L626 HydrophobicContact CZ-CD2 3.6Å; F475-L626 HydrophobicContact CZ-CG 3.59Å; L587-L626 HydrophobicContact CD2-CD1 3.79Å; I622-L626 HydrophobicContact CG1-CD1 4.19Å; I622-L626 HydrophobicContact CG1-CG 4.37Å; I622-L626 VanDerWaalsContact O-CB 3.27Å; I622-L626 WeakPolarHBondContact O-CB 3.48Å; I622-L626 WeakPolarHBondContact O-CD1 3.27Å; I622-L626 WeakPolarHBondContact O-CG 3.02Å; I622-L626 PolarHBondContact O-N 2.81Å; I624-L626 PolarHBondContact O-N 3.49Å; L626-A630 WeakPolarHBondContact O-CB 3.15Å; L626-A630 PolarHBondContact O-N 3.47Å
627	K	94.3	Very high	91.2	Very high	77 Å²	77	56.7 Å²	56.7	34%	0.335	29%	0.292	S	S	.	.	H	α-helix	trans	-71.6	-46.8	178.1	-70.4	172.4	-179.5	-179.4	0	111.8	D457 I458 T623 I624 K625 F629 A630 T631	D457-K627 WeakPolarHBondContact O-CE 3.24Å; I458-K627 HydrophobicContact CD1-CG 4.15Å; T623-K627 HydrophobicContact CG2-CD 4.47Å; T623-K627 WeakPolarHBondContact O-CG 3.32Å; T623-K627 PolarHBondContact O-N 2.68Å; I624-K627 PolarHBondContact O-N 3.02Å; I624-K627 VanDerWaalsContact O-N 3.15Å; K625-K627 VanDerWaalsContact C-N 3.31Å; K625-K627 PolarHBondContact O-N 2.86Å; K627-F629 VanDerWaalsContact C-N 3.32Å; K627-F629 PolarHBondContact O-N 2.93Å; K627-A630 PolarHBondContact O-N 3.16Å; K627-T631 PolarHBondContact O-N 3.47Å; K627-T631 PolarHBondContact O-OG1 3.2Å
628	E	93	Very high	90.7	Very high	89 Å²	89	57 Å²	57	42%	0.416	29%	0.29	S	S	.	.	H	α-helix	trans	-59.1	-40.8	174.8	-177.4	-172.9	134.2	0	0	112.2	I624 K625 T631 N632	I624-E628 PolarHBondContact O-N 2.78Å; K625-E628 WeakPolarHBondContact CD-OE2 3.15Å; K625-E628 IonicContact NZ-OE1 3.2Å; K625-E628 PolarHBondContact NZ-OE1 3.49Å; K625-E628 IonicContact NZ-OE2 3.68Å; K625-E628 PolarHBondContact NZ-OE2 3.31Å; E628-T631 WeakPolarHBondContact CA-OG1 3.19Å; E628-T631 PolarHBondContact O-OG1 3.21Å; E628-N632 PolarHBondContact O-ND2 3.02Å
629	F	90.1	Very high	90.1	Very high	27 Å²	27	57.4 Å²	57.4	12%	0.118	29%	0.294	C	S	.	.	H	α-helix	trans	-67.9	-45.6	175	-177.7	-112.9	0	0	0	111.6	F475 K625 K627 T631 N632 L633 L644	F475-F629 HydrophobicContact CB-CD1 4.09Å; F475-F629 HydrophobicContact CB-CE1 3.81Å; F475-F629 HydrophobicContact CB-CE2 4.44Å; F475-F629 HydrophobicContact CB-CZ 4.01Å; F475-F629 HydrophobicContact CD2-CB 3.73Å; F475-F629 AromaticContact CD2-CD1 3.64Å; F475-F629 HydrophobicContact CD2-CD1 3.64Å; F475-F629 HydrophobicContact CD2-CD2 4.1Å; F475-F629 HydrophobicContact CD2-CE1 4.25Å; F475-F629 AromaticContact CD2-CG 3.56Å; F475-F629 HydrophobicContact CD2-CG 3.56Å; F475-F629 HydrophobicContact CE2-CB 3.94Å; F475-F629 HydrophobicContact CE2-CD1 4.49Å; F475-F629 HydrophobicContact CE2-CG 4.28Å; F475-F629 HydrophobicContact CG-CD1 4.08Å; F475-F629 HydrophobicContact CG-CE1 4.3Å; F475-F629 HydrophobicContact CG-CG 4.38Å; K625-F629 WeakPolarHBondContact O-CB 3.45Å; K625-F629 PolarHBondContact O-N 3.39Å; K627-F629 VanDerWaalsContact C-N 3.32Å; K627-F629 PolarHBondContact O-N 2.93Å; F629-T631 VanDerWaalsContact C-N 3.26Å; F629-T631 PolarHBondContact O-N 2.94Å; F629-N632 PolarHBondContact O-N 2.81Å; F629-L633 HydrophobicContact CD1-CD1 4.14Å; F629-L633 HydrophobicContact CE1-CD1 3.73Å; F629-L633 HydrophobicContact CE1-CG 4.39Å; F629-L633 HydrophobicContact CZ-CD1 4.17Å; F629-L633 HydrophobicContact CZ-CD2 4.19Å; F629-L633 HydrophobicContact CZ-CG 4.44Å; F629-L644 HydrophobicContact CE1-CD2 3.48Å; F629-L644 VanDerWaalsContact CE1-CD2 3.48Å; F629-L644 HydrophobicContact CZ-CD2 3.45Å; F629-L644 VanDerWaalsContact CZ-CD2 3.45Å
630	A	90.3	Very high	88.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-65.4	-22.8	179.1	0	0	0	0	0	114.3	P459 L460 L626 K627 N632 R638	P459-A630 HydrophobicContact CB-CB 4.06Å; P459-A630 HydrophobicContact CG-CB 3.85Å; L460-A630 HydrophobicContact CD2-CB 3.69Å; L460-A630 HydrophobicContact CG-CB 3.81Å; L626-A630 WeakPolarHBondContact O-CB 3.15Å; L626-A630 PolarHBondContact O-N 3.47Å; K627-A630 PolarHBondContact O-N 3.16Å; A630-N632 VanDerWaalsContact C-N 3.32Å; A630-R638 WeakPolarHBondContact O-CD 3.3Å
631	T	88.6	Confident	87.4	Confident	105 Å²	105	54.9 Å²	54.9	64%	0.644	28%	0.282	S	S	*	.	H	α-helix	trans	-75	-18.9	170.9	41	0	0	0	0	113.9	K627 E628 F629	K627-T631 PolarHBondContact O-N 3.47Å; K627-T631 PolarHBondContact O-OG1 3.2Å; E628-T631 WeakPolarHBondContact CA-OG1 3.19Å; E628-T631 PolarHBondContact O-OG1 3.21Å; F629-T631 VanDerWaalsContact C-N 3.26Å; F629-T631 PolarHBondContact O-N 2.94Å
632	N	85.9	Confident	85.4	Confident	128 Å²	128	55.8 Å²	55.8	68%	0.684	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-0.7	-178.9	-62.4	-21.3	0	0	0	113.4	E628 F629 A630	E628-N632 PolarHBondContact O-ND2 3.02Å; F629-N632 PolarHBondContact O-N 2.81Å; A630-N632 VanDerWaalsContact C-N 3.32Å
633	L	85	Confident	83.4	Confident	20 Å²	20	62.4 Å²	62.4	11%	0.105	32%	0.321	C	S	.	.	S	Bend	trans	-101.3	143.4	-179.2	-69	-178.7	0	0	0	111.8	L460 F629 E637 R638	L460-L633 HydrophobicContact CD2-CD1 4.05Å; F629-L633 HydrophobicContact CD1-CD1 4.14Å; F629-L633 HydrophobicContact CE1-CD1 3.73Å; F629-L633 HydrophobicContact CE1-CG 4.39Å; F629-L633 HydrophobicContact CZ-CD1 4.17Å; F629-L633 HydrophobicContact CZ-CD2 4.19Å; F629-L633 HydrophobicContact CZ-CG 4.44Å; L633-E637 HydrophobicContact CB-CB 4.03Å; L633-E637 HydrophobicContact CD1-CB 4.39Å; L633-E637 HydrophobicContact CD2-CB 4.07Å; L633-E637 HydrophobicContact CG-CB 4.39Å; L633-R638 HydrophobicContact CB-CG 3.65Å; L633-R638 HydrophobicContact CD1-CG 4.45Å; L633-R638 WeakPolarHBondContact O-CD 3.08Å
634	S	84.9	Confident	81.3	Confident	58 Å²	58	61.9 Å²	61.9	41%	0.406	32%	0.318	S	S	.	.			trans	-63.2	164	170.1	69.6	0	0	0	0	112.1	E636 E637 R638	S634-E636 VanDerWaalsContact C-N 3.26Å; S634-E636 PolarHBondContact O-N 2.8Å; S634-E637 WeakPolarHBondContact CB-OE2 3.13Å; S634-E637 PolarHBondContact N-OE2 3.34Å; S634-E637 PolarHBondContact O-N 3.4Å; S634-E637 WeakPolarHBondContact OG-CG 3.36Å; S634-E637 PolarHBondContact OG-N 3.28Å; S634-E637 PolarHBondContact OG-OE2 3.44Å; S634-R638 WeakPolarHBondContact O-CB 3.4Å; S634-R638 VanDerWaalsContact O-CG 3.26Å; S634-R638 WeakPolarHBondContact O-CG 3.2Å; S634-R638 PolarHBondContact O-N 3.37Å
635	L	83.6	Confident	79.1	Confident	105 Å²	105	60.8 Å²	60.8	55%	0.55	32%	0.316	S	S	.	.	H	α-helix	trans	-57.7	-39	177.3	179.8	59.7	0	0	0	112.2	T583 R638 L639	T583-L635 HydrophobicContact CG2-CD1 3.52Å; L635-R638 PolarHBondContact O-N 2.91Å; L635-L639 HydrophobicContact CD1-CD1 4.17Å; L635-L639 HydrophobicContact CD1-CG 4.42Å; L635-L639 HydrophobicContact CG-CD1 4.04Å; L635-L639 WeakPolarHBondContact O-CB 3.18Å; L635-L639 WeakPolarHBondContact O-CD1 3.25Å; L635-L639 WeakPolarHBondContact O-CG 3.38Å; L635-L639 PolarHBondContact O-N 2.87Å; L635-L639 VanDerWaalsContact O-N 3.12Å
636	E	81.6	Confident	76.8	Confident	142 Å²	142	62.6 Å²	62.6	66%	0.664	33%	0.325	S	S	*	.	H	α-helix	trans	-67.3	-43.1	178.3	-175	174	-179.1	0	0	111.9	S634 L639 T640	S634-E636 VanDerWaalsContact C-N 3.26Å; S634-E636 PolarHBondContact O-N 2.8Å; E636-L639 PolarHBondContact O-N 2.88Å; E636-T640 HydrophobicContact CG-CG2 4.12Å; E636-T640 WeakPolarHBondContact O-CB 3.41Å; E636-T640 WeakPolarHBondContact O-CG2 3.46Å; E636-T640 PolarHBondContact O-N 3.06Å; E636-T640 PolarHBondContact O-OG1 2.92Å
637	E	82	Confident	74	Confident	49 Å²	49	72 Å²	72	23%	0.229	37%	0.369	C	S	.	.	H	α-helix	trans	-66.6	-37.5	176.9	-68.6	163.4	117.4	0	0	112	L633 S634 L639 G641 W643	L633-E637 HydrophobicContact CB-CB 4.03Å; L633-E637 HydrophobicContact CD1-CB 4.39Å; L633-E637 HydrophobicContact CD2-CB 4.07Å; L633-E637 HydrophobicContact CG-CB 4.39Å; S634-E637 WeakPolarHBondContact CB-OE2 3.13Å; S634-E637 PolarHBondContact N-OE2 3.34Å; S634-E637 PolarHBondContact O-N 3.4Å; S634-E637 WeakPolarHBondContact OG-CG 3.36Å; S634-E637 PolarHBondContact OG-N 3.28Å; S634-E637 PolarHBondContact OG-OE2 3.44Å; E637-L639 PolarHBondContact O-N 3.23Å; E637-G641 VanDerWaalsContact O-CA 3.27Å; E637-G641 WeakPolarHBondContact O-CA 3.26Å; E637-G641 PolarHBondContact O-N 3.1Å; E637-W643 HydrophobicContact CG-CB 4.17Å; E637-W643 WeakPolarHBondContact OE1-CB 3.38Å
638	R	84.8	Confident	71.4	Confident	58 Å²	58	78.4 Å²	78.4	22%	0.219	39%	0.391	C	S	.	.	H	α-helix	trans	-66.1	-25.7	174.3	-68.6	173.5	60.3	-163.6	-11	113.1	P459 L460 N461 T583 A630 L633 S634 L635	P459-R638 VanDerWaalsContact O-CZ 3.28Å; P459-R638 PolarHBondContact O-NE 3.34Å; P459-R638 PolarHBondContact O-NH2 3.32Å; L460-R638 HydrophobicContact CD2-CB 4.42Å; L460-R638 HydrophobicContact CD2-CG 4.2Å; N461-R638 VanDerWaalsContact CB-O 3.29Å; N461-R638 WeakPolarHBondContact CB-O 2.76Å; N461-R638 PolarHBondContact N-O 3.31Å; T583-R638 PolarHBondContact O-NH2 2.88Å; A630-R638 WeakPolarHBondContact O-CD 3.3Å; L633-R638 HydrophobicContact CB-CG 3.65Å; L633-R638 HydrophobicContact CD1-CG 4.45Å; L633-R638 WeakPolarHBondContact O-CD 3.08Å; S634-R638 WeakPolarHBondContact O-CB 3.4Å; S634-R638 VanDerWaalsContact O-CG 3.26Å; S634-R638 WeakPolarHBondContact O-CG 3.2Å; S634-R638 PolarHBondContact O-N 3.37Å; L635-R638 PolarHBondContact O-N 2.91Å
639	L	81.6	Confident	68.3	Low	61 Å²	61	77.8 Å²	77.8	32%	0.319	41%	0.408	S	S	.	.	H	α-helix	trans	-85.2	-49.1	176.2	-74.2	166.8	0	0	0	112.4	N461 R582 T583 L635 E636 E637	N461-L639 WeakPolarHBondContact CB-O 3.39Å; R582-L639 HydrophobicContact CB-CD2 4.05Å; R582-L639 VanDerWaalsContact O-CD2 3.25Å; R582-L639 WeakPolarHBondContact O-CD2 3.22Å; T583-L639 HydrophobicContact CG2-CD2 4.09Å; L635-L639 HydrophobicContact CD1-CD1 4.17Å; L635-L639 HydrophobicContact CD1-CG 4.42Å; L635-L639 HydrophobicContact CG-CD1 4.04Å; L635-L639 WeakPolarHBondContact O-CB 3.18Å; L635-L639 WeakPolarHBondContact O-CD1 3.25Å; L635-L639 WeakPolarHBondContact O-CG 3.38Å; L635-L639 PolarHBondContact O-N 2.87Å; L635-L639 VanDerWaalsContact O-N 3.12Å; E636-L639 PolarHBondContact O-N 2.88Å; E637-L639 PolarHBondContact O-N 3.23Å
640	T	70.8	Confident	65.5	Low	39 Å²	39	87 Å²	87	24%	0.239	44%	0.444	C	S	.	.	H	α-helix	trans	-89.1	-31.9	-171.6	59	0	0	0	0	113.3	R467 E636 G642	R467-T640 PolarHBondContact NH1-O 2.91Å; E636-T640 HydrophobicContact CG-CG2 4.12Å; E636-T640 WeakPolarHBondContact O-CB 3.41Å; E636-T640 WeakPolarHBondContact O-CG2 3.46Å; E636-T640 PolarHBondContact O-N 3.06Å; E636-T640 PolarHBondContact O-OG1 2.92Å; T640-G642 PolarHBondContact O-N 3.03Å; T640-G642 PolarHBondContact OG1-N 3.44Å
641	G	65	Low	62.6	Low	0 Å²	0	94.3 Å²	94.3	0%	0	48%	0.482	C	S	.	.			trans	59.5	24.6	-160.1	0	0	0	0	0	113	E637 W643 L644	E637-G641 VanDerWaalsContact O-CA 3.27Å; E637-G641 WeakPolarHBondContact O-CA 3.26Å; E637-G641 PolarHBondContact O-N 3.1Å; G641-W643 PolarHBondContact O-N 2.91Å; G641-L644 VanDerWaalsContact O-CB 3.25Å; G641-L644 WeakPolarHBondContact O-CB 3.44Å; G641-L644 VanDerWaalsContact O-CG 3.29Å; G641-L644 WeakPolarHBondContact O-CG 3.28Å; G641-L644 PolarHBondContact O-N 2.7Å; G641-L644 VanDerWaalsContact O-N 3.11Å
642	G	54.2	Low	60	Low	43 Å²	43	93.9 Å²	93.9	44%	0.443	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-64.3	-34.4	-169.4	0	0	0	0	0	114.5	T640 L644	T640-G642 PolarHBondContact O-N 3.03Å; T640-G642 PolarHBondContact OG1-N 3.44Å; G642-L644 VanDerWaalsContact C-N 3.25Å; G642-L644 PolarHBondContact O-N 3.38Å
643	W	53	Low	57.3	Low	142 Å²	142	93.4 Å²	93.4	54%	0.538	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-77.7	-7.2	176.7	-158.1	79	0	0	0	113.5	E637 G641	E637-W643 HydrophobicContact CG-CB 4.17Å; E637-W643 WeakPolarHBondContact OE1-CB 3.38Å; G641-W643 PolarHBondContact O-N 2.91Å
644	L	53.3	Low	55.1	Low	2 Å²	2	94.9 Å²	94.9	1%	0.01	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-81.9	-24.5	-170.7	-54	179.7	0	0	0	114.2	R467 C468 S473 F629 G641 G642 Q646	R467-L644 HydrophobicContact CB-CD1 3.93Å; C468-L644 VanDerWaalsContact SG-CD1 3.55Å; S473-L644 VanDerWaalsContact CA-O 3.31Å; S473-L644 WeakPolarHBondContact CA-O 3.37Å; F629-L644 HydrophobicContact CE1-CD2 3.48Å; F629-L644 VanDerWaalsContact CE1-CD2 3.48Å; F629-L644 HydrophobicContact CZ-CD2 3.45Å; F629-L644 VanDerWaalsContact CZ-CD2 3.45Å; G641-L644 VanDerWaalsContact O-CB 3.25Å; G641-L644 WeakPolarHBondContact O-CB 3.44Å; G641-L644 VanDerWaalsContact O-CG 3.29Å; G641-L644 WeakPolarHBondContact O-CG 3.28Å; G641-L644 PolarHBondContact O-N 2.7Å; G641-L644 VanDerWaalsContact O-N 3.11Å; G642-L644 VanDerWaalsContact C-N 3.25Å; G642-L644 PolarHBondContact O-N 3.38Å; L644-Q646 PolarHBondContact O-N 3.2Å
645	T	49.5	Very low	53	Low	80 Å²	80	96.4 Å²	96.4	49%	0.491	49%	0.488	S	S	.	.	S	Bend	trans	-83	94.9	178.5	44.9	0	0	0	0	110.2	Q647	T645-Q647 PolarHBondContact O-N 3.2Å
646	Q	45.6	Very low	50.8	Low	90 Å²	90	93.3 Å²	93.3	42%	0.421	47%	0.474	S	S	.	.			trans	-60.6	131	179.5	-175	170.8	87	0	0	111	L644 R648	L644-Q646 PolarHBondContact O-N 3.2Å; Q646-R648 VanDerWaalsContact C-N 3.33Å; Q646-R648 PolarHBondContact O-N 2.89Å
647	Q	37.5	Very low	48.3	Very low	196 Å²	196	92.4 Å²	92.4	92%	0.916	48%	0.48	S	S	*	.			trans	-72.7	80.7	-178.4	-71.6	-175.1	-46.4	0	0	112.6	T645	T645-Q647 PolarHBondContact O-N 3.2Å
648	R	38.3	Very low	45.9	Very low	213 Å²	213	96.4 Å²	96.4	80%	0.804	50%	0.503	S	S	*	.			trans	-121	110.8	156.3	-76.2	-175	170.2	-179.4	-1.4	108.3	Q646 Y650	Q646-R648 VanDerWaalsContact C-N 3.33Å; Q646-R648 PolarHBondContact O-N 2.89Å; R648-Y650 PolarHBondContact O-N 3.36Å
649	G	28.9	Very low	43.3	Very low	75 Å²	75	99.6 Å²	99.6	77%	0.773	52%	0.524	S	S	*	.	S	Bend	trans	-73.4	109	-162	0	0	0	0	0	114.6
650	Y	30.2	Very low	40.8	Very low	221 Å²	221	102 Å²	102	87%	0.867	54%	0.543	S	S	*	.			trans	-147.1	127.2	131.5	-92.4	-74.1	0	0	0	108.9	R648 N652	R648-Y650 PolarHBondContact O-N 3.36Å; Y650-N652 PolarHBondContact O-N 3.4Å
651	L	30.7	Very low	38.8	Very low	154 Å²	154	103.9 Å²	103.9	81%	0.806	56%	0.558	S	S	*	*			trans	-70.9	109.7	-172.7	-84.5	163.2	0	0	0	112.4
652	N	34.5	Very low	37.2	Very low	95 Å²	95	111.7 Å²	111.7	51%	0.508	60%	0.6	S	S	.	*			trans	-105.1	97.3	164.9	-75.5	-61	0	0	0	110.1	Y650 I654	Y650-N652 PolarHBondContact O-N 3.4Å; N652-I654 VanDerWaalsContact C-N 3.31Å; N652-I654 PolarHBondContact O-N 2.96Å
653	N	29.3	Very low	36.2	Very low	119 Å²	119	117.3 Å²	117.3	64%	0.636	62%	0.618	S	S	*	*			trans	-75.7	74.9	-176.4	-74.9	-22.1	0	0	0	112.6
654	I	38.8	Very low	35	Very low	51 Å²	51	119.5 Å²	119.5	26%	0.262	63%	0.634	S	S	.	*			trans	-120	51.5	162.5	-43.2	-174.1	0	0	0	109.6	W493 N652	W493-I654 HydrophobicContact CB-CD1 3.66Å; N652-I654 VanDerWaalsContact C-N 3.31Å; N652-I654 PolarHBondContact O-N 2.96Å
655	T	40.1	Very low	33.9	Very low	90 Å²	90	126.5 Å²	126.5	55%	0.552	67%	0.672	S	S	*	*			trans	-95.3	117.3	164.2	-69.9	0	0	0	0	107.7	R467	R467-T655 PolarHBondContact NH2-OG1 3.21Å
656	P	38.1	Very low	33.1	Very low	39 Å²	39	131 Å²	131	25%	0.253	69%	0.693	S	S	.	*			trans	-61.7	130.9	168.8	27.2	-32.4	0	0	0	107.9	L658	P656-L658 PolarHBondContact O-N 2.78Å
657	P	29.1	Very low	32.4	Very low	123 Å²	123	132.6 Å²	132.6	80%	0.799	71%	0.714	S	S	*	*			trans	-65.3	109.8	-176.5	25.3	-33.2	0	0	0	109.9	N659	P657-N659 VanDerWaalsContact C-N 3.34Å; P657-N659 PolarHBondContact O-N 3.34Å
658	L	31.1	Very low	32.2	Very low	134 Å²	134	131 Å²	131	70%	0.702	71%	0.711	S	S	*	*			trans	-65.9	95.7	166.4	-75.2	169.2	0	0	0	107.6	P656 P660	P656-L658 PolarHBondContact O-N 2.78Å; L658-P660 WeakPolarHBondContact O-CD 3.45Å
659	N	29.2	Very low	31.8	Very low	124 Å²	124	129 Å²	129	66%	0.663	72%	0.715	S	S	*	*			trans	-71.5	109.8	175.1	-179.4	18.5	0	0	0	109.4	P657 S661	P657-N659 VanDerWaalsContact C-N 3.34Å; P657-N659 PolarHBondContact O-N 3.34Å; N659-S661 PolarHBondContact ND2-OG 3.03Å; N659-S661 VanDerWaalsContact ND2-OG 3.11Å; N659-S661 PolarHBondContact O-N 3.16Å; N659-S661 WeakPolarHBondContact OD1-CB 3.18Å; N659-S661 PolarHBondContact OD1-OG 3.46Å
660	P	30.1	Very low	31.9	Very low	112 Å²	112	133.3 Å²	133.3	73%	0.727	72%	0.719	S	S	*	*			trans	-92.9	35.1	-173.1	37.2	-28.1	0	0	0	111.4	L658 N662	L658-P660 WeakPolarHBondContact O-CD 3.45Å; P660-N662 PolarHBondContact O-N 2.99Å
661	S	28.8	Very low	32	Very low	79 Å²	79	131.5 Å²	131.5	55%	0.552	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	68.2	-177.7	63.7	0	0	0	0	112	N659	N659-S661 PolarHBondContact ND2-OG 3.03Å; N659-S661 VanDerWaalsContact ND2-OG 3.11Å; N659-S661 PolarHBondContact O-N 3.16Å; N659-S661 WeakPolarHBondContact OD1-CB 3.18Å; N659-S661 PolarHBondContact OD1-OG 3.46Å
662	N	31	Very low	31.9	Very low	164 Å²	164	129.7 Å²	129.7	88%	0.877	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-178.5	39.5	152.4	-93.8	-10.4	0	0	0	114.1	P660	P660-N662 PolarHBondContact O-N 2.99Å
663	I	32.9	Very low	32.1	Very low	161 Å²	161	131.6 Å²	131.6	83%	0.826	73%	0.734	S	S	*	*			trans	-131.2	63.1	161.4	-45.5	-179.8	0	0	0	110.3
664	Q	28.9	Very low	32	Very low	187 Å²	187	133.8 Å²	133.8	87%	0.874	75%	0.745	S	S	*	*			trans	-102.7	94.9	155.8	-81.1	-173.2	-27.5	0	0	108
665	N	29.9	Very low	31.6	Very low	150 Å²	150	134.8 Å²	134.8	80%	0.802	77%	0.768	S	S	*	*			trans	171.2	89.8	153.9	-90.3	-20.9	0	0	0	109.6
666	N	32.6	Very low	31.2	Very low	173 Å²	173	137.3 Å²	137.3	93%	0.925	78%	0.779	S	S	*	*			trans	178.9	76.6	148.2	-93.9	-17.9	0	0	0	109.5	L668	N666-L668 PolarHBondContact O-N 3.16Å
667	S	30	Very low	31	Very low	125 Å²	125	142.9 Å²	142.9	87%	0.874	80%	0.801	S	S	*	*			trans	-86.1	94.1	170.9	178	0	0	0	0	109.6
668	L	33.2	Very low	31.3	Very low	163 Å²	163	144.5 Å²	144.5	85%	0.853	80%	0.803	S	S	*	*			trans	-170.1	98.1	162	-108.7	171.3	0	0	0	110.9	N666	N666-L668 PolarHBondContact O-N 3.16Å
669	L	31.5	Very low	31.2	Very low	170 Å²	170	144.8 Å²	144.8	89%	0.89	81%	0.805	S	S	*	*			trans	167.6	69.7	145.3	-93.7	167.8	0	0	0	111.8
670	I	29.9	Very low	31.5	Very low	165 Å²	165	150.7 Å²	150.7	85%	0.846	82%	0.818	S	S	*	*			trans	-137.8	93.6	160.8	-58.2	177.4	0	0	0	108.1
671	Q	32.6	Very low	31.4	Very low	183 Å²	183	154.5 Å²	154.5	86%	0.855	82%	0.823	S	S	*	*			trans	-172.5	144.6	159.4	-110.7	165.4	30.7	0	0	112
672	S	29.3	Very low	31.5	Very low	117 Å²	117	159.1 Å²	159.1	82%	0.818	84%	0.841	S	S	*	*			trans	63.9	149.1	-173.8	79.1	0	0	0	0	114.3
673	V	37.2	Very low	31.4	Very low	135 Å²	135	157.9 Å²	157.9	82%	0.818	83%	0.834	S	S	*	*			cis	-123.7	140.7	18	171.9	0	0	0	0	112.2
674	N	28.6	Very low	31.3	Very low	164 Å²	164	159.4 Å²	159.4	88%	0.877	84%	0.835	S	S	*	*			trans	-82.9	153	170	-76.8	-38.3	0	0	0	111.5
675	G	29.6	Very low	31.5	Very low	73 Å²	73	154.5 Å²	154.5	75%	0.753	83%	0.826	S	S	*	*			trans	174	104.9	162.5	0	0	0	0	0	118.5
676	N	32.3	Very low	31.4	Very low	143 Å²	143	154.1 Å²	154.1	77%	0.765	83%	0.825	S	S	*	*			trans	49.1	103	148.1	-67	-10.5	0	0	0	122
677	Q	33.1	Very low	31.3	Very low	156 Å²	156	149.9 Å²	149.9	73%	0.729	81%	0.813	S	S	*	*				41.6	124.7	109.8	-59	177.5	20.2	0	0	119.3
678	N	35.5	Very low	31.2	Very low	157 Å²	157	152.5 Å²	152.5	84%	0.84	81%	0.809	S	S	*	*				-157.1	156.6	105.4	-112.5	-56	0	0	0	114.2
679	N	29.8	Very low	31.1	Very low	139 Å²	139	154.2 Å²	154.2	74%	0.743	81%	0.81	S	S	*	*			trans	-88.3	144.3	-172.6	-70.4	-77.1	0	0	0	113.2
680	R	34.2	Very low	30.9	Very low	249 Å²	249	152.5 Å²	152.5	94%	0.94	81%	0.807	S	S	*	*			trans	-161.8	111.1	134.5	-109	161	-165.9	-170.9	3.4	112
681	K	27.8	Very low	30.9	Very low	191 Å²	191	148.2 Å²	148.2	83%	0.83	80%	0.803	S	S	*	*			trans	-73.8	145.5	159.2	-69.9	176.1	176	175	0	108.7
682	L	31.7	Very low	30.6	Very low	176 Å²	176	146.8 Å²	146.8	92%	0.921	80%	0.801	S	S	*	*			trans	-141.8	137.7	150.7	-157.5	70.5	0	0	0	108.8
683	N	29.4	Very low	30.6	Very low	139 Å²	139	146.3 Å²	146.3	74%	0.743	79%	0.793	S	S	*	*			trans	-108.7	141.1	-172.6	-73.5	-21.4	0	0	0	111.4
684	K	29.7	Very low	30.4	Very low	192 Å²	192	147 Å²	147	84%	0.835	79%	0.793	S	S	*	*			trans	38.7	108.9	130.6	-166.6	-176.8	-179.9	-175	0	119.2
685	A	32.9	Very low	30.5	Very low	84 Å²	84	143.7 Å²	143.7	69%	0.694	78%	0.782	S	S	*	*			trans	-144.1	133.4	143.1	0	0	0	0	0	105.2
686	D	28.1	Very low	30.7	Very low	143 Å²	143	147.4 Å²	147.4	77%	0.765	79%	0.785	S	S	*	*				57	126.4	77.5	-50.4	-47.4	0	0	0	111.1
687	A	31.3	Very low	30.6	Very low	83 Å²	83	149.4 Å²	149.4	69%	0.686	79%	0.787	S	S	*	*				-168.5	151.7	57.3	0	0	0	0	0	114.2
688	F	28.4	Very low	30.6	Very low	181 Å²	181	148.6 Å²	148.6	79%	0.794	79%	0.792	S	S	*	*			trans	41.7	127.2	144.4	-68.8	-108	0	0	0	120.4
689	F	30.1	Very low	30.4	Very low	199 Å²	199	146.7 Å²	146.7	87%	0.873	79%	0.788	S	S	*	*				-157.2	151.1	77	-114.5	-84	0	0	0	114.5
690	T	27	Very low	30.2	Very low	134 Å²	134	144.6 Å²	144.6	82%	0.822	79%	0.79	S	S	*	*			trans	-137.3	147.7	176.6	50.6	0	0	0	0	111.4
691	G	30.3	Very low	30.2	Very low	74 Å²	74	138.5 Å²	138.5	76%	0.763	79%	0.786	S	S	*	*			trans	131.1	107	-177.9	0	0	0	0	0	111.3
692	N	26.1	Very low	30.3	Very low	153 Å²	153	140.1 Å²	140.1	82%	0.818	79%	0.786	S	S	*	*			cis	108.3	140.4	25.9	-169	25.4	0	0	0	111.6
693	V	30.2	Very low	30.2	Very low	107 Å²	107	143.5 Å²	143.5	65%	0.648	79%	0.789	S	S	*	*			trans	61.3	109.5	176.2	-162.2	0	0	0	0	114.7
694	N	32.9	Very low	30.4	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	78%	0.783	S	S	*	*				-165	167.6	76	-133.8	-30.8	0	0	0	114.3
695	S	29.2	Very low	30.4	Very low	94 Å²	94	140.1 Å²	140.1	66%	0.657	79%	0.787	S	S	*	*			trans	-103.6	136	-175.9	54.5	0	0	0	0	114.1
696	N	35.5	Very low	30.2	Very low	150 Å²	150	145.1 Å²	145.1	80%	0.802	80%	0.796	S	S	*	*			trans	-179.8	114.2	147.8	-91.7	-43.4	0	0	0	107.5
697	K	30	Very low	30.4	Very low	186 Å²	186	143.4 Å²	143.4	81%	0.809	80%	0.802	S	S	*	*				85.6	146	63.7	-167.3	179	-174.6	-178.1	0	112
698	V	32.3	Very low	30.3	Very low	138 Å²	138	149.4 Å²	149.4	84%	0.836	81%	0.812	S	S	*	*			trans	86.6	135.4	-176.4	-172.9	0	0	0	0	112.9
699	P	30.4	Very low	30.5	Very low	117 Å²	117	146 Å²	146	76%	0.76	81%	0.811	S	S	*	*				-128.1	-179.8	-129	44.7	-32.9	0	0	0	116.8
700	A	27.2	Very low	30.5	Very low	96 Å²	96	140.9 Å²	140.9	79%	0.793	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-63.8	132.3	169.7	0	0	0	0	0	112.8
701	S	33.8	Very low	30.6	Very low	120 Å²	120	141.8 Å²	141.8	84%	0.839	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-80.5	125.1	167.3	44.4	0	0	0	0	110.5
702	R	28.9	Very low	30.5	Very low	225 Å²	225	147.6 Å²	147.6	85%	0.849	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-80.2	140.9	166.9	-58.9	172.3	-176.1	161.5	-0.5	108.5
703	Y	31.2	Very low	30.5	Very low	248 Å²	248	148.1 Å²	148.1	97%	0.973	81%	0.806	S	S	*	*			trans	-111.8	123.2	140.1	-110.5	-88.8	0	0	0	106.8
704	S	32.1	Very low	30.5	Very low	89 Å²	89	147.4 Å²	147.4	62%	0.622	81%	0.805	S	S	*	*			trans	-106	136.2	-168.2	48.1	0	0	0	0	111.7	Q706	S704-Q706 PolarHBondContact O-N 3.19Å; S704-Q706 VanDerWaalsContact O-N 3.14Å
705	D	29.5	Very low	30.2	Very low	171 Å²	171	145.3 Å²	145.3	91%	0.914	80%	0.802	S	S	*	*			trans	-57	113.4	165.5	-68.6	-66.9	0	0	0	111.1
706	Q	29.6	Very low	30.3	Very low	188 Å²	188	147.9 Å²	147.9	88%	0.879	81%	0.806	S	S	*	*			trans	-151.9	81.8	164.3	-120.9	177.5	24.1	0	0	112.2	S704	S704-Q706 PolarHBondContact O-N 3.19Å; S704-Q706 VanDerWaalsContact O-N 3.14Å
707	A	32.5	Very low	29.9	Very low	108 Å²	108	148.2 Å²	148.2	89%	0.893	81%	0.808	S	S	*	*			trans	-140.4	55.4	167.4	0	0	0	0	0	110.6
708	K	28.7	Very low	29.9	Very low	208 Å²	208	146.5 Å²	146.5	90%	0.904	81%	0.808	S	S	*	*			trans	-99.9	101.8	169.7	-82.9	-173	176.9	178.8	0	110.4
709	S	32	Very low	29.7	Very low	110 Å²	110	146.5 Å²	146.5	77%	0.769	80%	0.803	S	S	*	*			trans	-126.9	100.3	145.7	47.9	0	0	0	0	107
710	S	30.9	Very low	29.8	Very low	92 Å²	92	147.9 Å²	147.9	64%	0.643	81%	0.81	S	S	*	*				75.4	102.6	63	78.8	0	0	0	0	113.3
711	I	29.1	Very low	29.8	Very low	153 Å²	153	150.7 Å²	150.7	79%	0.785	81%	0.811	S	S	*	*			trans	65.1	98.1	148.2	-48.6	160.2	0	0	0	115.7
712	F	28.5	Very low	29.8	Very low	195 Å²	195	151 Å²	151	86%	0.855	81%	0.808	S	S	*	*				-151.1	105.1	115.6	-135	-88.2	0	0	0	110.9
713	N	26.2	Very low	29.9	Very low	165 Å²	165	149.2 Å²	149.2	88%	0.882	81%	0.806	S	S	*	*			trans	-157	76.2	174.8	-152.3	13.2	0	0	0	109.5
714	S	29.8	Very low	29.8	Very low	91 Å²	91	146.7 Å²	146.7	64%	0.636	80%	0.8	S	S	*	*			trans	-164.2	146.9	171.3	-160.4	0	0	0	0	111.2
715	C	27.3	Very low	29.8	Very low	108 Å²	108	151.6 Å²	151.6	73%	0.73	81%	0.813	S	S	*	*			trans	63.8	140.9	167.5	-64.7	0	0	0	0	117.5
716	I	31.5	Very low	29.8	Very low	147 Å²	147	150.3 Å²	150.3	75%	0.754	81%	0.806	S	S	*	*			cis	-151.8	150.5	-9.1	-126.5	163.2	0	0	0	109	D718	I716-D718 PolarHBondContact O-N 3.2Å
717	N	26	Very low	29.9	Very low	158 Å²	158	150.3 Å²	150.3	85%	0.845	80%	0.804	S	S	*	*			trans	-70.1	124.8	163.5	-100.8	-14.6	0	0	0	108
718	D	30.7	Very low	29.7	Very low	150 Å²	150	151.9 Å²	151.9	80%	0.802	80%	0.802	S	S	*	*			trans	-151.6	150.6	138.2	-127.9	-32.2	0	0	0	114.8	I716	I716-D718 PolarHBondContact O-N 3.2Å
719	N	27	Very low	30	Very low	138 Å²	138	147.2 Å²	147.2	74%	0.738	79%	0.791	S	S	*	*			trans	-98.5	137.9	174	-67.7	-91.3	0	0	0	109.1
720	T	33.6	Very low	30	Very low	146 Å²	146	150 Å²	150	90%	0.896	80%	0.796	S	S	*	*			trans	-164.2	153.4	130.4	11.2	0	0	0	0	112.3
721	N	27.8	Very low	30.1	Very low	154 Å²	154	154.7 Å²	154.7	82%	0.824	81%	0.806	S	S	*	*			trans	-69.8	151.9	169.4	-69.8	-90.5	0	0	0	110.9
722	V	32.5	Very low	30.2	Very low	128 Å²	128	149.7 Å²	149.7	78%	0.776	79%	0.792	S	S	*	*				-167.1	127	120.7	137.2	0	0	0	0	113.7
723	K	32.3	Very low	31	Very low	187 Å²	187	146 Å²	146	81%	0.813	79%	0.791	S	S	*	*			trans	31.2	89.9	150.9	-54.4	173.9	-177.4	172.2	0	120.2
724	K	28.9	Very low	31.8	Very low	194 Å²	194	140.1 Å²	140.1	84%	0.843	77%	0.768	S	S	*	*				16.2	111.4	109.3	-173.9	-174.9	-171.6	178.8	0	116.8
725	Q	32.1	Very low	32.7	Very low	193 Å²	193	140 Å²	140	90%	0.902	76%	0.761	S	S	*	*			trans	-145.5	156.7	149.3	-113.1	-177.3	12.3	0	0	111.1
726	N	29	Very low	33.8	Very low	143 Å²	143	140.4 Å²	140.4	77%	0.765	75%	0.753	S	S	*	*			trans	-90.8	143.2	-166.3	-51.4	-29	0	0	0	112.1
727	K	31	Very low	34.9	Very low	189 Å²	189	137.6 Å²	137.6	82%	0.822	74%	0.743	S	S	*	*			trans	-151	102.2	148.5	-136.1	172.6	-172.8	178.5	0	113.5
728	T	28.8	Very low	36.3	Very low	140 Å²	140	138.8 Å²	138.8	86%	0.859	74%	0.737	S	S	*	*			trans	-83.8	106.9	167.8	-40.5	0	0	0	0	108.4
729	T	34.1	Very low	37.5	Very low	110 Å²	110	135.5 Å²	135.5	68%	0.675	72%	0.719	S	S	*	*			trans	-157.6	125.6	170.9	26.4	0	0	0	0	111.8
730	L	33.5	Very low	38.7	Very low	168 Å²	168	131.5 Å²	131.5	88%	0.88	70%	0.695	S	S	*	*			trans	51.5	102.6	147.8	-132.5	72	0	0	0	118.8	G732	L730-G732 PolarHBondContact O-N 3.39Å
731	F	31.8	Very low	39.8	Very low	192 Å²	192	129.3 Å²	129.3	84%	0.842	68%	0.676	S	S	*	*			trans	-67.7	115.1	155.3	-91.8	-80.2	0	0	0	109.2
732	G	32.5	Very low	41.3	Very low	48 Å²	48	129.8 Å²	129.8	50%	0.495	67%	0.666	S	S	.	*			trans	-87.2	159.4	174.5	0	0	0	0	0	112.5	L730 G734	L730-G732 PolarHBondContact O-N 3.39Å; G732-G734 PolarHBondContact O-N 2.77Å
733	S	43.7	Very low	42.8	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-12.3	-173.9	-152.9	0	0	0	0	115.6
734	G	44.6	Very low	44.4	Very low	40 Å²	40	127.3 Å²	127.3	41%	0.412	66%	0.664	S	S	.	*	H	α-helix	trans	-74.6	-24.9	-174.9	0	0	0	0	0	116.2	G732 M736 T737 Y738	G732-G734 PolarHBondContact O-N 2.77Å; G734-M736 VanDerWaalsContact C-N 3.29Å; G734-M736 PolarHBondContact O-N 2.69Å; G734-T737 PolarHBondContact O-N 3.42Å; G734-T737 PolarHBondContact O-OG1 2.81Å; G734-Y738 PolarHBondContact O-N 3.44Å
735	D	48	Very low	46.4	Very low	90 Å²	90	122.7 Å²	122.7	48%	0.481	64%	0.641	S	S	.	*	H	α-helix	trans	-70.4	-28.6	-177.1	-74	-23.5	0	0	0	112.4	L739	D735-L739 WeakPolarHBondContact O-CG 3.32Å; D735-L739 PolarHBondContact O-N 3.01Å; D735-L739 VanDerWaalsContact O-N 3.12Å
736	M	50.6	Low	48.5	Very low	116 Å²	116	115.9 Å²	115.9	57%	0.571	62%	0.618	S	S	*	*	H	α-helix	trans	-70	-38.2	178.1	-81.1	-70.5	-76.9	0	0	112.5	G734 L739 F740	G734-M736 VanDerWaalsContact C-N 3.29Å; G734-M736 PolarHBondContact O-N 2.69Å; M736-L739 PolarHBondContact O-N 3.35Å; M736-L739 HydrophobicContact SD-CD1 4.15Å; M736-F740 HydrophobicContact CE-CE2 4.03Å; M736-F740 WeakPolarHBondContact O-CD2 3.5Å; M736-F740 PolarHBondContact O-N 2.97Å
737	T	55	Low	50.9	Low	87 Å²	87	114.5 Å²	114.5	53%	0.534	60%	0.602	S	S	.	*	H	α-helix	trans	-66.3	-42.3	174.6	38.7	0	0	0	0	111.2	G734 L739 F740 M741	G734-T737 PolarHBondContact O-N 3.42Å; G734-T737 PolarHBondContact O-OG1 2.81Å; T737-L739 PolarHBondContact O-N 3.15Å; T737-F740 PolarHBondContact O-N 3.47Å; T737-F740 VanDerWaalsContact O-N 3.09Å; T737-M741 VanDerWaalsContact O-CG 3.3Å; T737-M741 WeakPolarHBondContact O-CG 3.46Å; T737-M741 PolarHBondContact O-N 2.92Å
738	Y	55.1	Low	53.1	Low	183 Å²	183	108.3 Å²	108.3	72%	0.718	58%	0.578	S	S	*	*	H	α-helix	trans	-61.5	-27.6	173.5	-87.9	-75.3	0	0	0	114.1	G734	G734-Y738 PolarHBondContact O-N 3.44Å
739	L	54.7	Low	55.3	Low	82 Å²	82	104.7 Å²	104.7	43%	0.429	55%	0.553	S	S	.	*	H	α-helix	trans	-71.8	-25.4	174.8	-79.7	165	0	0	0	113.9	D735 M736 T737 R745	D735-L739 WeakPolarHBondContact O-CG 3.32Å; D735-L739 PolarHBondContact O-N 3.01Å; D735-L739 VanDerWaalsContact O-N 3.12Å; M736-L739 PolarHBondContact O-N 3.35Å; M736-L739 HydrophobicContact SD-CD1 4.15Å; T737-L739 PolarHBondContact O-N 3.15Å; L739-R745 VanDerWaalsContact CD2-NH1 3.31Å; L739-R745 WeakPolarHBondContact O-CD 3.29Å
740	F	53.6	Low	57.5	Low	54 Å²	54	105.4 Å²	105.4	24%	0.237	55%	0.552	C	S	.	*	H	α-helix	trans	-94.1	-28.1	175.2	-69.2	-66.6	0	0	0	113.6	M736 T737 R742 L748 L749 I752	M736-F740 HydrophobicContact CE-CE2 4.03Å; M736-F740 WeakPolarHBondContact O-CD2 3.5Å; M736-F740 PolarHBondContact O-N 2.97Å; T737-F740 PolarHBondContact O-N 3.47Å; T737-F740 VanDerWaalsContact O-N 3.09Å; F740-R742 PolarHBondContact O-N 2.84Å; F740-L748 HydrophobicContact CE1-CB 4.35Å; F740-L749 HydrophobicContact CB-CD1 4.21Å; F740-L749 HydrophobicContact CD1-CD1 4.3Å; F740-L749 HydrophobicContact CG-CD1 4.15Å; F740-I752 HydrophobicContact CE1-CD1 3.56Å; F740-I752 HydrophobicContact CZ-CD1 3.63Å
741	M	55.4	Low	59.6	Low	100 Å²	100	100.8 Å²	100.8	49%	0.493	53%	0.531	S	S	.	.			trans	-67.8	0.1	-179.8	-76.4	-65.9	107.8	0	0	115.7	T737 L854	T737-M741 VanDerWaalsContact O-CG 3.3Å; T737-M741 WeakPolarHBondContact O-CG 3.46Å; T737-M741 PolarHBondContact O-N 2.92Å; M741-L854 HydrophobicContact CE-CD1 3.77Å; M741-L854 HydrophobicContact CE-CD2 3.79Å; M741-L854 HydrophobicContact CE-CG 4.3Å; M741-L854 HydrophobicContact SD-CD2 3.77Å
742	R	60	Low	61.9	Low	163 Å²	163	95 Å²	95	62%	0.615	51%	0.508	S	S	*	.	S	Bend	trans	-82.3	129.5	172.2	-70.3	-173.7	176.7	176.7	0.4	110.1	F740 D744 R745 A746	F740-R742 PolarHBondContact O-N 2.84Å; R742-D744 VanDerWaalsContact C-N 3.28Å; R742-D744 PolarHBondContact O-N 2.83Å; R742-R745 WeakPolarHBondContact O-CA 2.83Å; R742-R745 WeakPolarHBondContact O-CB 3.45Å; R742-R745 PolarHBondContact O-N 2.87Å; R742-A746 PolarHBondContact O-N 3.11Å
743	P	64.3	Low	64.2	Low	119 Å²	119	95.4 Å²	95.4	77%	0.773	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-58.2	-36	-175.5	19.6	-31.4	0	0	0	113.5	R745 A746	P743-R745 PolarHBondContact O-N 2.84Å; P743-A746 PolarHBondContact O-N 3.02Å
744	D	66.5	Low	66.2	Low	144 Å²	144	91.6 Å²	91.6	77%	0.77	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-57.2	-9.6	171.7	-77.8	-26.4	0	0	0	114.9	R742 W747	R742-D744 VanDerWaalsContact C-N 3.28Å; R742-D744 PolarHBondContact O-N 2.83Å; D744-W747 VanDerWaalsContact O-CD1 3.31Å; D744-W747 PolarHBondContact O-NE1 3.48Å
745	R	70.7	Confident	68	Low	97 Å²	97	94.6 Å²	94.6	37%	0.366	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-124.6	-1.4	-175.1	-65.8	-175.7	175.5	-171.4	-2.3	114.5	L739 R742 P743 W747 L748	L739-R745 VanDerWaalsContact CD2-NH1 3.31Å; L739-R745 WeakPolarHBondContact O-CD 3.29Å; R742-R745 WeakPolarHBondContact O-CA 2.83Å; R742-R745 WeakPolarHBondContact O-CB 3.45Å; R742-R745 PolarHBondContact O-N 2.87Å; P743-R745 PolarHBondContact O-N 2.84Å; R745-W747 PolarHBondContact O-N 3.26Å; R745-W747 VanDerWaalsContact O-N 3.13Å; R745-L748 HydrophobicContact CB-CD1 4.18Å; R745-L748 HydrophobicContact CG-CD1 4.18Å; R745-L748 WeakPolarHBondContact O-CB 3.4Å; R745-L748 PolarHBondContact O-N 2.93Å
746	A	75	Confident	69.6	Low	51 Å²	51	94.2 Å²	94.2	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-56.2	-32.9	177.9	0	0	0	0	0	112.6	R742 P743 L748 L749 L750	R742-A746 PolarHBondContact O-N 3.11Å; P743-A746 PolarHBondContact O-N 3.02Å; A746-L748 VanDerWaalsContact C-N 3.28Å; A746-L748 PolarHBondContact O-N 3Å; A746-L749 VanDerWaalsContact O-CB 3.3Å; A746-L749 WeakPolarHBondContact O-CB 3.27Å; A746-L749 PolarHBondContact O-N 2.85Å; A746-L749 VanDerWaalsContact O-N 3.11Å; A746-L750 PolarHBondContact O-N 2.95Å
747	W	80.2	Confident	71.2	Confident	113 Å²	113	92.6 Å²	92.6	43%	0.428	47%	0.474	S	S	.	.	H	α-helix	trans	-63.7	-26.6	174.8	70.4	-89.7	0	0	0	113.8	F600 D744 R745 L749 L750 V751	F600-W747 HydrophobicContact CB-CH2 3.57Å; F600-W747 HydrophobicContact CB-CZ2 4.41Å; F600-W747 HydrophobicContact CB-CZ3 4.2Å; F600-W747 HydrophobicContact CG-CH2 4.33Å; D744-W747 VanDerWaalsContact O-CD1 3.31Å; D744-W747 PolarHBondContact O-NE1 3.48Å; R745-W747 PolarHBondContact O-N 3.26Å; R745-W747 VanDerWaalsContact O-N 3.13Å; W747-L749 VanDerWaalsContact C-N 3.34Å; W747-L750 PolarHBondContact O-N 3.18Å; W747-V751 HydrophobicContact CE3-CG2 4.02Å; W747-V751 HydrophobicContact CZ3-CG2 4.28Å; W747-V751 WeakPolarHBondContact O-CG2 3.36Å; W747-V751 PolarHBondContact O-N 2.93Å
748	L	76.8	Confident	72.6	Confident	59 Å²	59	92.4 Å²	92.4	31%	0.309	48%	0.476	S	S	.	.	H	α-helix	trans	-67.2	-37.3	172.8	-74.8	165.5	0	0	0	111	F740 R745 A746 V751 I752	F740-L748 HydrophobicContact CE1-CB 4.35Å; R745-L748 HydrophobicContact CB-CD1 4.18Å; R745-L748 HydrophobicContact CG-CD1 4.18Å; R745-L748 WeakPolarHBondContact O-CB 3.4Å; R745-L748 PolarHBondContact O-N 2.93Å; A746-L748 VanDerWaalsContact C-N 3.28Å; A746-L748 PolarHBondContact O-N 3Å; L748-V751 PolarHBondContact O-N 2.92Å; L748-I752 WeakPolarHBondContact O-CB 3.32Å; L748-I752 WeakPolarHBondContact O-CD1 3.42Å; L748-I752 VanDerWaalsContact O-CG1 3.25Å; L748-I752 WeakPolarHBondContact O-CG1 3.37Å; L748-I752 PolarHBondContact O-N 3.01Å
749	L	76.4	Confident	73.8	Confident	65 Å²	65	89 Å²	89	34%	0.34	47%	0.469	S	S	.	.	H	α-helix	trans	-62.3	-45.8	174.9	-162.7	97.5	0	0	0	110.2	F740 A746 W747 V751 I752 I753	F740-L749 HydrophobicContact CB-CD1 4.21Å; F740-L749 HydrophobicContact CD1-CD1 4.3Å; F740-L749 HydrophobicContact CG-CD1 4.15Å; A746-L749 VanDerWaalsContact O-CB 3.3Å; A746-L749 WeakPolarHBondContact O-CB 3.27Å; A746-L749 PolarHBondContact O-N 2.85Å; A746-L749 VanDerWaalsContact O-N 3.11Å; W747-L749 VanDerWaalsContact C-N 3.34Å; L749-V751 PolarHBondContact O-N 2.73Å; L749-I752 PolarHBondContact O-N 3Å; L749-I753 HydrophobicContact CD2-CD1 3.9Å; L749-I753 HydrophobicContact CG-CD1 4.05Å; L749-I753 VanDerWaalsContact O-CG1 3.3Å; L749-I753 WeakPolarHBondContact O-CG1 3.46Å; L749-I753 PolarHBondContact O-N 2.87Å
750	L	78.9	Confident	75	Confident	124 Å²	124	89 Å²	89	65%	0.649	47%	0.466	S	S	*	.	H	α-helix	trans	-62.2	-39.1	175.6	-64.7	177.1	0	0	0	112.6	A746 W747 G754	A746-L750 PolarHBondContact O-N 2.95Å; W747-L750 PolarHBondContact O-N 3.18Å; L750-G754 PolarHBondContact O-N 2.78Å
751	V	77.6	Confident	76.4	Confident	72 Å²	72	92.2 Å²	92.2	44%	0.436	49%	0.485	S	S	.	.	H	α-helix	trans	-65.7	-41.1	174.1	167.8	0	0	0	0	111.4	W747 L748 L749 G754 L755	W747-V751 HydrophobicContact CE3-CG2 4.02Å; W747-V751 HydrophobicContact CZ3-CG2 4.28Å; W747-V751 WeakPolarHBondContact O-CG2 3.36Å; W747-V751 PolarHBondContact O-N 2.93Å; L748-V751 PolarHBondContact O-N 2.92Å; L749-V751 PolarHBondContact O-N 2.73Å; V751-G754 PolarHBondContact O-N 2.65Å; V751-L755 HydrophobicContact CG1-CD1 3.93Å; V751-L755 HydrophobicContact CG1-CG 4.43Å; V751-L755 WeakPolarHBondContact O-CB 3.39Å; V751-L755 VanDerWaalsContact O-CG 3.27Å; V751-L755 WeakPolarHBondContact O-CG 3.44Å; V751-L755 PolarHBondContact O-N 2.87Å
752	I	80	Confident	77.6	Confident	71 Å²	71	89.8 Å²	89.8	36%	0.364	48%	0.477	S	S	.	.	H	α-helix	trans	-64.3	-46.8	176.2	-70.7	163	0	0	0	110.7	F740 L748 L749 G754 L755 L756	F740-I752 HydrophobicContact CE1-CD1 3.56Å; F740-I752 HydrophobicContact CZ-CD1 3.63Å; L748-I752 WeakPolarHBondContact O-CB 3.32Å; L748-I752 WeakPolarHBondContact O-CD1 3.42Å; L748-I752 VanDerWaalsContact O-CG1 3.25Å; L748-I752 WeakPolarHBondContact O-CG1 3.37Å; L748-I752 PolarHBondContact O-N 3.01Å; L749-I752 PolarHBondContact O-N 3Å; I752-G754 PolarHBondContact O-N 2.84Å; I752-L755 PolarHBondContact O-N 3.36Å; I752-L756 HydrophobicContact CG2-CD1 3.93Å; I752-L756 HydrophobicContact CG2-CG 4.47Å; I752-L756 WeakPolarHBondContact O-CB 3.45Å; I752-L756 VanDerWaalsContact O-CG 3.31Å; I752-L756 WeakPolarHBondContact O-CG 3.36Å; I752-L756 PolarHBondContact O-N 2.87Å
753	I	82	Confident	78.4	Confident	55 Å²	55	86.9 Å²	86.9	28%	0.282	47%	0.472	S	S	.	.	H	α-helix	trans	-60.7	-44.2	176	-68.1	164.6	0	0	0	110.6	L749 L756 L757	L749-I753 HydrophobicContact CD2-CD1 3.9Å; L749-I753 HydrophobicContact CG-CD1 4.05Å; L749-I753 VanDerWaalsContact O-CG1 3.3Å; L749-I753 WeakPolarHBondContact O-CG1 3.46Å; L749-I753 PolarHBondContact O-N 2.87Å; I753-L756 PolarHBondContact O-N 3.09Å; I753-L757 HydrophobicContact CG2-CD1 3.94Å; I753-L757 HydrophobicContact CG2-CG 4.45Å; I753-L757 WeakPolarHBondContact O-CB 3.32Å; I753-L757 WeakPolarHBondContact O-CG 3.33Å; I753-L757 PolarHBondContact O-N 2.76Å
754	G	84.2	Confident	79.1	Confident	38 Å²	38	83 Å²	83	39%	0.392	45%	0.446	S	S	.	.	H	α-helix	trans	-63.4	-39.6	176.6	0	0	0	0	0	113.6	L750 V751 I752 C758	L750-G754 PolarHBondContact O-N 2.78Å; V751-G754 PolarHBondContact O-N 2.65Å; I752-G754 PolarHBondContact O-N 2.84Å; G754-C758 VanDerWaalsContact O-CB 3.3Å; G754-C758 WeakPolarHBondContact O-CB 3.3Å; G754-C758 PolarHBondContact O-N 2.82Å
755	L	82.8	Confident	79.7	Confident	103 Å²	103	83.3 Å²	83.3	54%	0.539	44%	0.438	S	S	.	.	H	α-helix	trans	-67.6	-42.2	174.2	-74.5	170.3	0	0	0	111.8	V751 I752 C758 L759	V751-L755 HydrophobicContact CG1-CD1 3.93Å; V751-L755 HydrophobicContact CG1-CG 4.43Å; V751-L755 WeakPolarHBondContact O-CB 3.39Å; V751-L755 VanDerWaalsContact O-CG 3.27Å; V751-L755 WeakPolarHBondContact O-CG 3.44Å; V751-L755 PolarHBondContact O-N 2.87Å; I752-L755 PolarHBondContact O-N 3.36Å; L755-C758 WeakPolarHBondContact O-CB 3.33Å; L755-C758 PolarHBondContact O-N 3.39Å; L755-L759 WeakPolarHBondContact O-CG 3.37Å; L755-L759 PolarHBondContact O-N 3.08Å
756	L	82.3	Confident	79.9	Confident	82 Å²	82	83.3 Å²	83.3	43%	0.429	45%	0.445	S	S	.	.	H	α-helix	trans	-61.4	-48.9	174.5	-73.6	169.3	0	0	0	111.2	I752 I753 C758 L759 F760	I752-L756 HydrophobicContact CG2-CD1 3.93Å; I752-L756 HydrophobicContact CG2-CG 4.47Å; I752-L756 WeakPolarHBondContact O-CB 3.45Å; I752-L756 VanDerWaalsContact O-CG 3.31Å; I752-L756 WeakPolarHBondContact O-CG 3.36Å; I752-L756 PolarHBondContact O-N 2.87Å; I753-L756 PolarHBondContact O-N 3.09Å; L756-C758 VanDerWaalsContact C-N 3.31Å; L756-C758 PolarHBondContact O-N 2.9Å; L756-L759 PolarHBondContact O-N 3.37Å; L756-L759 VanDerWaalsContact O-N 3.15Å; L756-F760 HydrophobicContact CB-CD2 4.38Å; L756-F760 HydrophobicContact CB-CE2 4.18Å; L756-F760 WeakPolarHBondContact O-CD2 3.47Å; L756-F760 PolarHBondContact O-N 3.24Å
757	L	84.3	Confident	79.9	Confident	83 Å²	83	85.4 Å²	85.4	44%	0.435	44%	0.442	S	S	.	.	H	α-helix	trans	-58.2	-41.6	174.8	-74.7	169.9	0	0	0	111.9	I753 F760 L761	I753-L757 HydrophobicContact CG2-CD1 3.94Å; I753-L757 HydrophobicContact CG2-CG 4.45Å; I753-L757 WeakPolarHBondContact O-CB 3.32Å; I753-L757 WeakPolarHBondContact O-CG 3.33Å; I753-L757 PolarHBondContact O-N 2.76Å; L757-F760 PolarHBondContact O-N 2.9Å; L757-L761 VanDerWaalsContact O-CB 3.31Å; L757-L761 WeakPolarHBondContact O-CB 3.47Å; L757-L761 VanDerWaalsContact O-CG 3.24Å; L757-L761 WeakPolarHBondContact O-CG 3.13Å; L757-L761 PolarHBondContact O-N 3.44Å
758	C	83.9	Confident	79.7	Confident	83 Å²	83	84.2 Å²	84.2	56%	0.561	44%	0.444	S	S	*	.	H	α-helix	trans	-61.9	-43.4	175.2	-171.3	0	0	0	0	112	G754 L755 L756 S762	G754-C758 VanDerWaalsContact O-CB 3.3Å; G754-C758 WeakPolarHBondContact O-CB 3.3Å; G754-C758 PolarHBondContact O-N 2.82Å; L755-C758 WeakPolarHBondContact O-CB 3.33Å; L755-C758 PolarHBondContact O-N 3.39Å; L756-C758 VanDerWaalsContact C-N 3.31Å; L756-C758 PolarHBondContact O-N 2.9Å; C758-S762 WeakPolarHBondContact O-CB 3.3Å; C758-S762 PolarHBondContact O-N 2.81Å
759	L	80.9	Confident	79.6	Confident	110 Å²	110	82.5 Å²	82.5	58%	0.576	44%	0.436	S	S	*	.	H	α-helix	trans	-64.4	-46.9	175.9	-71.9	168.7	0	0	0	111.7	L755 L756 S762 M763	L755-L759 WeakPolarHBondContact O-CG 3.37Å; L755-L759 PolarHBondContact O-N 3.08Å; L756-L759 PolarHBondContact O-N 3.37Å; L756-L759 VanDerWaalsContact O-N 3.15Å; L759-S762 PolarHBondContact O-N 2.88Å; L759-S762 PolarHBondContact O-OG 2.85Å; L759-M763 PolarHBondContact O-N 2.89Å
760	F	79.5	Confident	79.5	Confident	83 Å²	83	83.4 Å²	83.4	36%	0.364	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-47.7	176.6	-73.4	-58.6	0	0	0	112.1	L756 L757 S762 M763 V764 M840	L756-F760 HydrophobicContact CB-CD2 4.38Å; L756-F760 HydrophobicContact CB-CE2 4.18Å; L756-F760 WeakPolarHBondContact O-CD2 3.47Å; L756-F760 PolarHBondContact O-N 3.24Å; L757-F760 PolarHBondContact O-N 2.9Å; F760-S762 VanDerWaalsContact C-N 3.29Å; F760-S762 PolarHBondContact O-N 3.18Å; F760-M763 WeakPolarHBondContact O-CB 3.08Å; F760-M763 PolarHBondContact O-N 3.36Å; F760-M763 VanDerWaalsContact O-N 3.1Å; F760-V764 WeakPolarHBondContact O-CG2 3.25Å; F760-V764 PolarHBondContact O-N 2.97Å; F760-M840 HydrophobicContact CB-SD 4.21Å; F760-M840 HydrophobicContact CD1-CG 4.43Å; F760-M840 HydrophobicContact CD1-SD 4.07Å; F760-M840 HydrophobicContact CG-SD 4.31Å
761	L	82.8	Confident	78.9	Confident	121 Å²	121	79.7 Å²	79.7	63%	0.634	42%	0.424	S	S	*	.	H	α-helix	trans	-60.1	-38.9	174.8	-72.3	170.1	0	0	0	111.6	L757 V764 Y765	L757-L761 VanDerWaalsContact O-CB 3.31Å; L757-L761 WeakPolarHBondContact O-CB 3.47Å; L757-L761 VanDerWaalsContact O-CG 3.24Å; L757-L761 WeakPolarHBondContact O-CG 3.13Å; L757-L761 PolarHBondContact O-N 3.44Å; L761-V764 PolarHBondContact O-N 3.43Å; L761-Y765 WeakPolarHBondContact O-CB 3.46Å; L761-Y765 PolarHBondContact O-N 3.38Å
762	S	81.1	Confident	78.7	Confident	49 Å²	49	81.6 Å²	81.6	34%	0.343	43%	0.428	S	S	.	.	H	α-helix	trans	-65.4	-37	174.5	84.7	0	0	0	0	112.3	C758 L759 F760 N766	C758-S762 WeakPolarHBondContact O-CB 3.3Å; C758-S762 PolarHBondContact O-N 2.81Å; L759-S762 PolarHBondContact O-N 2.88Å; L759-S762 PolarHBondContact O-OG 2.85Å; F760-S762 VanDerWaalsContact C-N 3.29Å; F760-S762 PolarHBondContact O-N 3.18Å; S762-N766 VanDerWaalsContact O-CB 3.28Å; S762-N766 WeakPolarHBondContact O-CB 3.26Å; S762-N766 VanDerWaalsContact O-CG 3.24Å; S762-N766 PolarHBondContact O-N 3.36Å; S762-N766 PolarHBondContact O-ND2 2.92Å
763	M	75.9	Confident	78.1	Confident	102 Å²	102	81.6 Å²	81.6	50%	0.502	43%	0.425	S	S	.	.	H	α-helix	trans	-66.2	-45.6	175.3	-107.5	-179.1	58.8	0	0	111.8	L759 F760 R767	L759-M763 PolarHBondContact O-N 2.89Å; F760-M763 WeakPolarHBondContact O-CB 3.08Å; F760-M763 PolarHBondContact O-N 3.36Å; F760-M763 VanDerWaalsContact O-N 3.1Å; M763-R767 WeakPolarHBondContact O-CG 3.32Å; M763-R767 PolarHBondContact O-N 3.09Å; M763-R767 VanDerWaalsContact O-N 3.08Å
764	V	78.6	Confident	77.3	Confident	38 Å²	38	82.2 Å²	82.2	23%	0.23	43%	0.429	C	S	.	.	H	α-helix	trans	-64.7	-45.7	176.9	174.9	0	0	0	0	110.4	F760 L761 R767 L768 M840	F760-V764 WeakPolarHBondContact O-CG2 3.25Å; F760-V764 PolarHBondContact O-N 2.97Å; L761-V764 PolarHBondContact O-N 3.43Å; V764-R767 PolarHBondContact O-N 3Å; V764-L768 HydrophobicContact CG1-CD1 3.93Å; V764-L768 HydrophobicContact CG1-CG 4.47Å; V764-L768 WeakPolarHBondContact O-CG 3.41Å; V764-L768 PolarHBondContact O-N 3.37Å; V764-M840 HydrophobicContact CG2-CE 3.68Å; V764-M840 HydrophobicContact CG2-SD 4.33Å
765	Y	79.3	Confident	76.3	Confident	151 Å²	151	82.8 Å²	82.8	59%	0.592	43%	0.43	S	S	*	.	H	α-helix	trans	-60.5	-46.3	176.8	-178.7	-104.2	0	0	0	112.3	L761 R767 L768 V769	L761-Y765 WeakPolarHBondContact O-CB 3.46Å; L761-Y765 PolarHBondContact O-N 3.38Å; Y765-R767 VanDerWaalsContact C-N 3.31Å; Y765-R767 PolarHBondContact O-N 2.7Å; Y765-L768 PolarHBondContact O-N 3.44Å; Y765-V769 HydrophobicContact CD1-CG2 4.2Å; Y765-V769 HydrophobicContact CD2-CG2 4.36Å; Y765-V769 HydrophobicContact CE1-CG2 3.74Å; Y765-V769 HydrophobicContact CE2-CG2 3.91Å; Y765-V769 HydrophobicContact CG-CG2 4.5Å; Y765-V769 WeakPolarHBondContact O-CG2 3.28Å; Y765-V769 PolarHBondContact O-N 2.92Å
766	N	76	Confident	75.3	Confident	97 Å²	97	85 Å²	85	52%	0.519	44%	0.437	S	S	.	.	H	α-helix	trans	-60.9	-38.6	176.5	-78.8	-44.9	0	0	0	112.2	S762 V770	S762-N766 VanDerWaalsContact O-CB 3.28Å; S762-N766 WeakPolarHBondContact O-CB 3.26Å; S762-N766 VanDerWaalsContact O-CG 3.24Å; S762-N766 PolarHBondContact O-N 3.36Å; S762-N766 PolarHBondContact O-ND2 2.92Å; N766-V770 WeakPolarHBondContact O-CG2 3.42Å; N766-V770 PolarHBondContact O-N 2.85Å; N766-V770 VanDerWaalsContact O-N 3.12Å
767	R	75.5	Confident	74.1	Confident	95 Å²	95	87.1 Å²	87.1	36%	0.358	45%	0.445	S	S	.	.	H	α-helix	trans	-69	-38.6	174.4	-72.2	178.3	177.4	-111.7	1.5	112.6	M763 V764 Y765 V770 L771 L833	M763-R767 WeakPolarHBondContact O-CG 3.32Å; M763-R767 PolarHBondContact O-N 3.09Å; M763-R767 VanDerWaalsContact O-N 3.08Å; V764-R767 PolarHBondContact O-N 3Å; Y765-R767 VanDerWaalsContact C-N 3.31Å; Y765-R767 PolarHBondContact O-N 2.7Å; R767-V770 PolarHBondContact O-N 2.91Å; R767-L771 PolarHBondContact O-N 3.12Å; R767-L833 HydrophobicContact CB-CD2 3.98Å
768	L	74.1	Confident	72.5	Confident	88 Å²	88	87.7 Å²	87.7	46%	0.461	44%	0.444	S	S	.	.	H	α-helix	trans	-63	-44.2	173.8	-76.2	166.5	0	0	0	111.9	V764 Y765 V770 L771 E772	V764-L768 HydrophobicContact CG1-CD1 3.93Å; V764-L768 HydrophobicContact CG1-CG 4.47Å; V764-L768 WeakPolarHBondContact O-CG 3.41Å; V764-L768 PolarHBondContact O-N 3.37Å; Y765-L768 PolarHBondContact O-N 3.44Å; L768-V770 VanDerWaalsContact C-N 3.29Å; L768-V770 PolarHBondContact O-N 2.9Å; L768-L771 CarbonylContact O-C 3.52Å; L768-L771 WeakPolarHBondContact O-CA 3.43Å; L768-L771 WeakPolarHBondContact O-CB 3.4Å; L768-L771 PolarHBondContact O-N 3.42Å; L768-E772 WeakPolarHBondContact O-CB 3.2Å; L768-E772 PolarHBondContact O-N 3.41Å
769	V	74.7	Confident	70.8	Confident	23 Å²	23	88.5 Å²	88.5	14%	0.139	45%	0.449	C	S	.	.	H	α-helix	trans	-65.1	-30.9	176.8	169.9	0	0	0	0	112.2	Y765 K773	Y765-V769 HydrophobicContact CD1-CG2 4.2Å; Y765-V769 HydrophobicContact CD2-CG2 4.36Å; Y765-V769 HydrophobicContact CE1-CG2 3.74Å; Y765-V769 HydrophobicContact CE2-CG2 3.91Å; Y765-V769 HydrophobicContact CG-CG2 4.5Å; Y765-V769 WeakPolarHBondContact O-CG2 3.28Å; Y765-V769 PolarHBondContact O-N 2.92Å; V769-K773 HydrophobicContact CG1-CD 4.03Å; V769-K773 WeakPolarHBondContact O-CB 3.47Å; V769-K773 VanDerWaalsContact O-CG 3.32Å; V769-K773 WeakPolarHBondContact O-CG 3.44Å; V769-K773 PolarHBondContact O-N 3.49Å
770	V	74.5	Confident	69.1	Low	83 Å²	83	89.3 Å²	89.3	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-69	-40.1	170	169	0	0	0	0	111.2	N766 R767 L768 K773 L774	N766-V770 WeakPolarHBondContact O-CG2 3.42Å; N766-V770 PolarHBondContact O-N 2.85Å; N766-V770 VanDerWaalsContact O-N 3.12Å; R767-V770 PolarHBondContact O-N 2.91Å; L768-V770 VanDerWaalsContact C-N 3.29Å; L768-V770 PolarHBondContact O-N 2.9Å; V770-K773 PolarHBondContact O-N 2.93Å; V770-L774 HydrophobicContact CG1-CD1 4.29Å; V770-L774 WeakPolarHBondContact O-CG 3.45Å; V770-L774 PolarHBondContact O-N 3.21Å; V770-L774 VanDerWaalsContact O-N 3.09Å
771	L	67.8	Low	67.2	Low	46 Å²	46	91.6 Å²	91.6	24%	0.241	48%	0.476	C	S	.	.	H	α-helix	trans	-64.9	-43.2	175.9	-153.4	87.6	0	0	0	111.8	R767 L768 L774 A775 L829 L833	R767-L771 PolarHBondContact O-N 3.12Å; L768-L771 CarbonylContact O-C 3.52Å; L768-L771 WeakPolarHBondContact O-CA 3.43Å; L768-L771 WeakPolarHBondContact O-CB 3.4Å; L768-L771 PolarHBondContact O-N 3.42Å; L771-L774 PolarHBondContact O-N 3.37Å; L771-A775 PolarHBondContact O-N 3.26Å; L771-L829 HydrophobicContact CD1-CB 4.08Å; L771-L829 HydrophobicContact CD1-CD1 4.25Å; L771-L833 HydrophobicContact CD1-CD1 4.43Å
772	E	72.2	Confident	65.1	Low	112 Å²	112	88.8 Å²	88.8	52%	0.523	47%	0.466	S	S	.	.	H	α-helix	trans	-61.1	-46.5	176	-173.3	176.7	-145	0	0	111.1	L768 L774 A775 E776	L768-E772 WeakPolarHBondContact O-CB 3.2Å; L768-E772 PolarHBondContact O-N 3.41Å; E772-L774 VanDerWaalsContact C-N 3.26Å; E772-L774 PolarHBondContact O-N 2.86Å; E772-A775 CarbonylContact O-C 3.54Å; E772-A775 WeakPolarHBondContact O-CA 3.45Å; E772-A775 WeakPolarHBondContact O-CB 3.22Å; E772-A775 PolarHBondContact O-N 3.5Å; E772-E776 PolarHBondContact O-N 3.48Å
773	K	68.5	Low	63.2	Low	71 Å²	71	90.8 Å²	90.8	31%	0.309	49%	0.486	S	S	.	.	H	α-helix	trans	-67.6	-21.4	176.3	-74.5	169.4	-179.7	164	0	114.1	N139 V769 V770 Q777	N139-K773 PolarHBondContact O-NZ 2.92Å; V769-K773 HydrophobicContact CG1-CD 4.03Å; V769-K773 WeakPolarHBondContact O-CB 3.47Å; V769-K773 VanDerWaalsContact O-CG 3.32Å; V769-K773 WeakPolarHBondContact O-CG 3.44Å; V769-K773 PolarHBondContact O-N 3.49Å; V770-K773 PolarHBondContact O-N 2.93Å; K773-Q777 WeakPolarHBondContact O-CG 3.44Å
774	L	64.9	Low	61.6	Low	68 Å²	68	96.7 Å²	96.7	36%	0.356	50%	0.502	S	S	.	.	H	α-helix	trans	-79.7	-26.9	168.2	-72.9	168.9	0	0	0	112.1	V770 L771 E772 L829	V770-L774 HydrophobicContact CG1-CD1 4.29Å; V770-L774 WeakPolarHBondContact O-CG 3.45Å; V770-L774 PolarHBondContact O-N 3.21Å; V770-L774 VanDerWaalsContact O-N 3.09Å; L771-L774 PolarHBondContact O-N 3.37Å; E772-L774 VanDerWaalsContact C-N 3.26Å; E772-L774 PolarHBondContact O-N 2.86Å; L774-L829 HydrophobicContact CD1-CD1 3.83Å
775	A	62.8	Low	60	Low	50 Å²	50	98.7 Å²	98.7	41%	0.413	51%	0.512	S	S	.	.	H	α-helix	trans	-79	-37.8	175.4	0	0	0	0	0	112.9	L771 E772 Q777 F778	L771-A775 PolarHBondContact O-N 3.26Å; E772-A775 CarbonylContact O-C 3.54Å; E772-A775 WeakPolarHBondContact O-CA 3.45Å; E772-A775 WeakPolarHBondContact O-CB 3.22Å; E772-A775 PolarHBondContact O-N 3.5Å; A775-Q777 PolarHBondContact O-N 3.26Å; A775-Q777 VanDerWaalsContact O-N 3.14Å; A775-F778 HydrophobicContact CB-CD2 4.4Å; A775-F778 WeakPolarHBondContact O-CB 3.34Å; A775-F778 VanDerWaalsContact O-CD2 3.28Å; A775-F778 WeakPolarHBondContact O-CD2 3.43Å; A775-F778 PolarHBondContact O-N 2.85Å
776	E	62.6	Low	58.3	Low	149 Å²	149	100 Å²	100	70%	0.696	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.4	171.5	-69	-174.6	138.3	0	0	112.7	E772 F778	E772-E776 PolarHBondContact O-N 3.48Å; E776-F778 VanDerWaalsContact C-N 3.28Å; E776-F778 PolarHBondContact O-N 3.46Å
777	Q	57	Low	56.6	Low	127 Å²	127	100.9 Å²	100.9	59%	0.593	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	16.7	171.6	-66.7	179.1	23.1	0	0	113.7	K773 A775 R822	K773-Q777 WeakPolarHBondContact O-CG 3.44Å; A775-Q777 PolarHBondContact O-N 3.26Å; A775-Q777 VanDerWaalsContact O-N 3.14Å; Q777-R822 PolarHBondContact O-NH2 2.89Å
778	F	50.6	Low	55.1	Low	95 Å²	95	102.6 Å²	102.6	42%	0.417	53%	0.532	S	S	.	.	S	Bend	trans	-95.1	120.7	162.1	-67.5	-61.9	0	0	0	109.8	A775 E776 M826	A775-F778 HydrophobicContact CB-CD2 4.4Å; A775-F778 WeakPolarHBondContact O-CB 3.34Å; A775-F778 VanDerWaalsContact O-CD2 3.28Å; A775-F778 WeakPolarHBondContact O-CD2 3.43Å; A775-F778 PolarHBondContact O-N 2.85Å; E776-F778 VanDerWaalsContact C-N 3.28Å; E776-F778 PolarHBondContact O-N 3.46Å; F778-M826 HydrophobicContact CE2-SD 3.93Å; F778-M826 HydrophobicContact CZ-SD 3.69Å
779	P	46.6	Very low	53.3	Low	100 Å²	100	104.9 Å²	104.9	65%	0.649	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-62.1	145.5	165.5	29	-33.6	0	0	0	108.9	L781	P779-L781 PolarHBondContact O-N 2.94Å; P779-L781 VanDerWaalsContact O-N 3.08Å
780	P	45.8	Very low	51.9	Low	127 Å²	127	110.9 Å²	110.9	83%	0.825	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-61.7	117.3	178.9	25.3	-33.4	0	0	0	109.8	S782	P780-S782 PolarHBondContact O-N 3Å
781	L	39.3	Very low	50.6	Low	132 Å²	132	113.4 Å²	113.4	69%	0.691	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-53.6	125.3	173.7	-83.3	144.9	0	0	0	109.5	P779 D785	P779-L781 PolarHBondContact O-N 2.94Å; P779-L781 VanDerWaalsContact O-N 3.08Å; L781-D785 HydrophobicContact CD2-CB 3.74Å
782	S	38.9	Very low	49.5	Very low	62 Å²	62	116.7 Å²	116.7	43%	0.434	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-62.2	153.2	178.9	84.3	0	0	0	0	109.9	P780 R784 D785	P780-S782 PolarHBondContact O-N 3Å; S782-R784 PolarHBondContact O-N 3.32Å; S782-D785 PolarHBondContact O-N 3.49Å; S782-D785 PolarHBondContact OG-OD2 3.18Å
783	A	41.8	Very low	47.9	Very low	90 Å²	90	118.8 Å²	118.8	74%	0.744	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-15.7	-178.8	0	0	0	0	0	113.8
784	R	42.2	Very low	46.3	Very low	226 Å²	226	118.3 Å²	118.3	85%	0.853	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-29.5	175	-92.1	-179.7	163.1	141.5	-2.6	114.1	S782	S782-R784 PolarHBondContact O-N 3.32Å
785	D	44.8	Very low	44.8	Very low	80 Å²	80	121.9 Å²	121.9	43%	0.428	64%	0.641	S	S	.	*	H	α-helix	trans	-82.6	-19.5	-173.7	-63	-65.1	0	0	0	113.5	L781 S782 N787 F789	L781-D785 HydrophobicContact CD2-CB 3.74Å; S782-D785 PolarHBondContact O-N 3.49Å; S782-D785 PolarHBondContact OG-OD2 3.18Å; D785-N787 PolarHBondContact O-N 3.43Å; D785-F789 PolarHBondContact O-N 2.83Å
786	R	42.8	Very low	43.4	Very low	180 Å²	180	124.9 Å²	124.9	68%	0.679	66%	0.659	S	S	*	*	H	α-helix	trans	-60.9	-44.1	-178	-76.1	-172.1	172.7	-171.2	-2.9	112.6	F789 Q790	R786-F789 PolarHBondContact O-N 2.95Å; R786-Q790 PolarHBondContact O-N 2.92Å
787	N	42.1	Very low	42.1	Very low	115 Å²	115	123.4 Å²	123.4	62%	0.615	66%	0.662	S	S	*	*	H	α-helix	trans	-65.5	-48.1	-175.5	-60.3	14.6	0	0	0	110.8	D785 F789 Q790 D791	D785-N787 PolarHBondContact O-N 3.43Å; N787-F789 VanDerWaalsContact C-N 3.25Å; N787-F789 PolarHBondContact O-N 2.92Å; N787-Q790 PolarHBondContact O-N 3.26Å; N787-D791 PolarHBondContact O-N 3.29Å
788	H	43.2	Very low	41	Very low	131 Å²	131	125.1 Å²	125.1	61%	0.606	67%	0.67	S	S	*	*	H	α-helix	trans	-64.2	-27.8	-178.1	-164.3	-18.8	0	0	0	113.1
789	F	36.5	Very low	40.3	Very low	135 Å²	135	128.6 Å²	128.6	59%	0.592	69%	0.688	S	S	*	*	H	α-helix	trans	-78.1	-22.4	176.2	-156.6	-91	0	0	0	113.1	D785 R786 N787 F793	D785-F789 PolarHBondContact O-N 2.83Å; R786-F789 PolarHBondContact O-N 2.95Å; N787-F789 VanDerWaalsContact C-N 3.25Å; N787-F789 PolarHBondContact O-N 2.92Å; F789-F793 HydrophobicContact CD1-CD2 4.41Å; F789-F793 AromaticContact CE1-CD2 4Å; F789-F793 HydrophobicContact CE1-CD2 4Å; F789-F793 AromaticContact CE1-CE2 3.82Å; F789-F793 HydrophobicContact CE1-CE2 3.82Å; F789-F793 HydrophobicContact CZ-CD2 4.45Å; F789-F793 AromaticContact CZ-CE2 3.83Å; F789-F793 HydrophobicContact CZ-CE2 3.83Å
790	Q	45.6	Very low	39.8	Very low	149 Å²	149	129.9 Å²	129.9	70%	0.696	69%	0.689	S	S	*	*	H	α-helix	trans	-80.7	-35.9	-176.1	-154.7	151	-1.8	0	0	111.6	R786 N787 L792 F793	R786-Q790 PolarHBondContact O-N 2.92Å; N787-Q790 PolarHBondContact O-N 3.26Å; Q790-L792 PolarHBondContact O-N 3.46Å; Q790-F793 PolarHBondContact O-N 2.9Å
791	D	46.7	Very low	39.3	Very low	136 Å²	136	134.7 Å²	134.7	73%	0.727	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-19.9	173.9	-60.4	-32.4	0	0	0	113.7	N787	N787-D791 PolarHBondContact O-N 3.29Å
792	L	44.8	Very low	39	Very low	115 Å²	115	131.9 Å²	131.9	60%	0.602	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-6.2	-177.3	-83.4	166.1	0	0	0	114.9	Q790	Q790-L792 PolarHBondContact O-N 3.46Å
793	F	38.8	Very low	39	Very low	156 Å²	156	134.2 Å²	134.2	68%	0.684	71%	0.71	S	S	*	*	S	Bend	trans	-133	8.5	-178.6	-72.8	-79.7	0	0	0	114.1	F789 Q790 T795	F789-F793 HydrophobicContact CD1-CD2 4.41Å; F789-F793 AromaticContact CE1-CD2 4Å; F789-F793 HydrophobicContact CE1-CD2 4Å; F789-F793 AromaticContact CE1-CE2 3.82Å; F789-F793 HydrophobicContact CE1-CE2 3.82Å; F789-F793 HydrophobicContact CZ-CD2 4.45Å; F789-F793 AromaticContact CZ-CE2 3.83Å; F789-F793 HydrophobicContact CZ-CE2 3.83Å; Q790-F793 PolarHBondContact O-N 2.9Å; F793-T795 PolarHBondContact O-N 3.45Å
794	G	33.9	Very low	38.7	Very low	61 Å²	61	137.4 Å²	137.4	63%	0.629	71%	0.713	S	S	*	*			trans	-79.3	108.3	174.2	0	0	0	0	0	112.6	S796	G794-S796 PolarHBondContact O-N 2.58Å
795	T	34.7	Very low	38.6	Very low	144 Å²	144	131.7 Å²	131.7	88%	0.883	71%	0.705	S	S	*	*			trans	-77.6	110.2	169.6	49.8	0	0	0	0	110.6	F793	F793-T795 PolarHBondContact O-N 3.45Å
796	S	33.3	Very low	38	Very low	113 Å²	113	134.6 Å²	134.6	79%	0.79	72%	0.719	S	S	*	*			trans	-102.3	131.5	174.2	-178.1	0	0	0	0	111.7	G794	G794-S796 PolarHBondContact O-N 2.58Å
797	P	35.7	Very low	37.7	Very low	118 Å²	118	137.3 Å²	137.3	77%	0.766	73%	0.731	S	S	*	*			trans	-98.7	114.3	168.7	34.1	-26.7	0	0	0	112.9
798	Q	32.2	Very low	37.2	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.762	74%	0.735	S	S	*	*			trans	70.1	155.1	146.5	-139.4	176.4	-86.4	0	0	120.3
799	E	36.8	Very low	36.6	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	74%	0.74	S	S	*	*			trans	72.8	134.4	164	-52.3	-174.1	-173.7	0	0	117.4
800	D	36.2	Very low	36.3	Very low	127 Å²	127	141.4 Å²	141.4	68%	0.679	75%	0.75	S	S	*	*			cis	-150.3	170.7	-16.8	-168.1	23.3	0	0	0	111
801	R	34.6	Very low	35.8	Very low	227 Å²	227	142 Å²	142	86%	0.857	76%	0.758	S	S	*	*			trans	-7.9	133.5	173.1	-66.1	150	-166.4	-160.4	-4	120.4
802	G	34	Very low	35.1	Very low	74 Å²	74	140.8 Å²	140.8	76%	0.763	77%	0.766	S	S	*	*			trans	175.3	89.1	158.5	0	0	0	0	0	118.2
803	S	37.5	Very low	34.8	Very low	110 Å²	110	140 Å²	140	77%	0.769	77%	0.77	S	S	*	*			trans	3.1	113.1	159.2	52.6	0	0	0	0	122.1
804	I	36.7	Very low	34.8	Very low	158 Å²	158	142.1 Å²	142.1	81%	0.81	78%	0.779	S	S	*	*				35.7	138.8	105.6	-58.9	173.2	0	0	0	117.9
805	P	39.4	Very low	35.3	Very low	106 Å²	106	142.2 Å²	142.2	69%	0.688	77%	0.77	S	S	*	*			cis	-132.3	153.1	11.8	29	-7.3	0	0	0	118.4
806	I	32	Very low	36.4	Very low	141 Å²	141	138.2 Å²	138.2	72%	0.723	75%	0.747	S	S	*	*			trans	23.3	114.8	130.2	-45.5	172	0	0	0	118.4	K808	I806-K808 HydrophobicContact CG2-CG 4.18Å
807	Y	36.2	Very low	37.5	Very low	236 Å²	236	140.5 Å²	140.5	93%	0.925	75%	0.745	S	S	*	*			trans	-121.3	151.1	130.5	-133.5	-93	0	0	0	108.9
808	K	31.6	Very low	38.7	Very low	160 Å²	160	142.5 Å²	142.5	70%	0.696	74%	0.737	S	S	*	*			trans	-104.7	161.6	-169.8	-95.4	-170.9	176.5	-177.9	0	113.7	I806	I806-K808 HydrophobicContact CG2-CG 4.18Å
809	D	31	Very low	39.8	Very low	133 Å²	133	136.3 Å²	136.3	71%	0.711	71%	0.714	S	S	*	*			trans	86	146.9	154.4	-57.4	-39.8	0	0	0	120.5
810	H	31.4	Very low	41.3	Very low	175 Å²	175	135.4 Å²	135.4	81%	0.81	70%	0.703	S	S	*	*			trans	59.1	79.1	170.6	-55.7	-70.8	0	0	0	119.8
811	L	35.1	Very low	42.8	Very low	162 Å²	162	133.6 Å²	133.6	85%	0.848	70%	0.697	S	S	*	*				-162.1	52.2	128.6	-133.4	85.2	0	0	0	115.8	S813	L811-S813 VanDerWaalsContact C-N 3.29Å; L811-S813 PolarHBondContact O-N 3.44Å
812	A	30.6	Very low	43.8	Very low	109 Å²	109	126.9 Å²	126.9	90%	0.901	67%	0.672	S	S	*	*			trans	-74.1	72.8	175.5	0	0	0	0	0	112.8
813	S	38.2	Very low	45.5	Very low	99 Å²	99	127.8 Å²	127.8	69%	0.692	66%	0.659	S	S	*	*			trans	-79.5	125.3	-176	65.9	0	0	0	0	112.8	L811 S815	L811-S813 VanDerWaalsContact C-N 3.29Å; L811-S813 PolarHBondContact O-N 3.44Å; S813-S815 PolarHBondContact O-N 3.25Å
814	K	39.1	Very low	47.3	Very low	200 Å²	200	129.1 Å²	129.1	87%	0.87	65%	0.651	S	S	*	*			trans	-74.9	108.1	177.4	-70.8	180	177.5	179.7	0	110.4
815	S	45.4	Very low	49.1	Very low	63 Å²	63	125.2 Å²	125.2	44%	0.441	63%	0.634	S	S	.	*			trans	-51.2	128.7	161.4	170.6	0	0	0	0	109.5	S813 R820	S813-S815 PolarHBondContact O-N 3.25Å; S815-R820 PolarHBondContact O-NH1 3.06Å
816	P	57.8	Low	50.3	Low	61 Å²	61	123.3 Å²	123.3	40%	0.396	62%	0.616	S	S	.	*			trans	-65	138.9	-169.6	-23.7	33.8	0	0	0	114	W818 A819	P816-W818 VanDerWaalsContact C-N 3.27Å; P816-W818 VanDerWaalsContact CB-CD1 3.46Å; P816-W818 HydrophobicContact CB-CD2 4.39Å; P816-W818 HydrophobicContact CB-CG 4.13Å; P816-W818 VanDerWaalsContact CB-NE1 3.29Å; P816-W818 PolarHBondContact O-N 3Å; P816-A819 WeakPolarHBondContact O-CB 3.46Å; P816-A819 PolarHBondContact O-N 3.38Å; P816-A819 VanDerWaalsContact O-N 3.1Å
817	E	56.8	Low	52.3	Low	161 Å²	161	123.2 Å²	123.2	75%	0.752	61%	0.611	S	S	*	*	H	α-helix	trans	-60.8	-36.5	178.7	-63.3	-172.2	150.5	0	0	112.5	A819 R820 T821	E817-A819 PolarHBondContact O-N 3.29Å; E817-R820 PolarHBondContact O-N 3.49Å; E817-R820 VanDerWaalsContact O-N 3.13Å; E817-T821 PolarHBondContact O-N 3.34Å; E817-T821 PolarHBondContact O-OG1 3.38Å; E817-T821 VanDerWaalsContact O-OG1 3.14Å
818	W	59.1	Low	54.1	Low	160 Å²	160	116.1 Å²	116.1	61%	0.606	59%	0.589	S	S	*	*	H	α-helix	trans	-58.2	-31.7	177	69.9	-106	0	0	0	112.9	P816 R822	P816-W818 VanDerWaalsContact C-N 3.27Å; P816-W818 VanDerWaalsContact CB-CD1 3.46Å; P816-W818 HydrophobicContact CB-CD2 4.39Å; P816-W818 HydrophobicContact CB-CG 4.13Å; P816-W818 VanDerWaalsContact CB-NE1 3.29Å; P816-W818 PolarHBondContact O-N 3Å; W818-R822 WeakPolarHBondContact O-CB 3.36Å; W818-R822 WeakPolarHBondContact O-CG 3.24Å; W818-R822 PolarHBondContact O-N 3.12Å
819	A	56.8	Low	56.1	Low	33 Å²	33	110.8 Å²	110.8	27%	0.273	57%	0.568	S	S	.	*	H	α-helix	trans	-72.7	-42.9	178.1	0	0	0	0	0	111.2	P816 E817 R822 L823	P816-A819 WeakPolarHBondContact O-CB 3.46Å; P816-A819 PolarHBondContact O-N 3.38Å; P816-A819 VanDerWaalsContact O-N 3.1Å; E817-A819 PolarHBondContact O-N 3.29Å; A819-R822 PolarHBondContact O-N 2.82Å; A819-L823 WeakPolarHBondContact O-CB 3.31Å; A819-L823 PolarHBondContact O-N 3.36Å
820	R	67.2	Low	58.2	Low	148 Å²	148	108.8 Å²	108.8	56%	0.558	56%	0.556	S	S	*	*	H	α-helix	trans	-61.7	-43.8	174.1	-67.2	-169.3	-177.5	83	-3.8	111.5	S815 E817 L823 K824	S815-R820 PolarHBondContact O-NH1 3.06Å; E817-R820 PolarHBondContact O-N 3.49Å; E817-R820 VanDerWaalsContact O-N 3.13Å; R820-L823 PolarHBondContact O-N 2.92Å; R820-K824 PolarHBondContact O-N 3.01Å
821	T	67.8	Low	60.2	Low	90 Å²	90	105.5 Å²	105.5	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-65.7	-43.5	179.3	-53.4	0	0	0	0	111.9	E817 K824 V825	E817-T821 PolarHBondContact O-N 3.34Å; E817-T821 PolarHBondContact O-OG1 3.38Å; E817-T821 VanDerWaalsContact O-OG1 3.14Å; T821-K824 PolarHBondContact O-N 2.94Å; T821-V825 WeakPolarHBondContact O-CG2 3.45Å; T821-V825 PolarHBondContact O-N 3.25Å
822	R	57	Low	62.1	Low	86 Å²	86	101.8 Å²	101.8	33%	0.325	52%	0.521	S	S	.	.	H	α-helix	trans	-64	-40.3	174.4	-75.4	179.9	75.8	168.5	0.1	112.4	Q777 W818 A819 K824 V825 M826	Q777-R822 PolarHBondContact O-NH2 2.89Å; W818-R822 WeakPolarHBondContact O-CB 3.36Å; W818-R822 WeakPolarHBondContact O-CG 3.24Å; W818-R822 PolarHBondContact O-N 3.12Å; A819-R822 PolarHBondContact O-N 2.82Å; R822-K824 VanDerWaalsContact C-N 3.33Å; R822-K824 PolarHBondContact O-N 3.14Å; R822-V825 PolarHBondContact O-N 3.48Å; R822-M826 PolarHBondContact O-N 2.93Å
823	L	69.6	Low	64.1	Low	93 Å²	93	97.9 Å²	97.9	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-65.3	-36.7	176.7	-170.4	68.4	0	0	0	112	A819 R820 M826 K827	A819-L823 WeakPolarHBondContact O-CB 3.31Å; A819-L823 PolarHBondContact O-N 3.36Å; R820-L823 PolarHBondContact O-N 2.92Å; L823-M826 PolarHBondContact O-N 2.85Å; L823-K827 PolarHBondContact O-N 2.88Å
824	K	74.2	Confident	66	Low	138 Å²	138	95.6 Å²	95.6	60%	0.6	47%	0.469	S	S	*	.	H	α-helix	trans	-62	-50.4	172.9	-171	179.1	176.3	-177.5	0	111.1	R820 T821 R822 M826 K827 D828	R820-K824 PolarHBondContact O-N 3.01Å; T821-K824 PolarHBondContact O-N 2.94Å; R822-K824 VanDerWaalsContact C-N 3.33Å; R822-K824 PolarHBondContact O-N 3.14Å; K824-M826 VanDerWaalsContact C-N 3.28Å; K824-M826 PolarHBondContact O-N 2.82Å; K824-K827 PolarHBondContact O-N 2.59Å; K824-D828 WeakPolarHBondContact CG-OD2 3.43Å; K824-D828 VanDerWaalsContact O-CG 3.24Å; K824-D828 PolarHBondContact O-N 2.94Å
825	V	74.2	Confident	67.9	Low	75 Å²	75	91.7 Å²	91.7	46%	0.455	45%	0.452	S	S	.	.	H	α-helix	trans	-57.3	-38.4	177.2	172	0	0	0	0	112.4	T821 R822 L829	T821-V825 WeakPolarHBondContact O-CG2 3.45Å; T821-V825 PolarHBondContact O-N 3.25Å; R822-V825 PolarHBondContact O-N 3.48Å; V825-L829 HydrophobicContact CG1-CD1 4.18Å; V825-L829 WeakPolarHBondContact O-CB 3.28Å; V825-L829 PolarHBondContact O-N 3.44Å
826	M	65.3	Low	69.2	Low	66 Å²	66	90 Å²	90	33%	0.325	44%	0.439	S	S	.	.	H	α-helix	trans	-64.8	-44.5	172.6	-80.2	-171.7	71.5	0	0	112.9	F778 R822 L823 K824 D828 L829 I830	F778-M826 HydrophobicContact CE2-SD 3.93Å; F778-M826 HydrophobicContact CZ-SD 3.69Å; R822-M826 PolarHBondContact O-N 2.93Å; L823-M826 PolarHBondContact O-N 2.85Å; K824-M826 VanDerWaalsContact C-N 3.28Å; K824-M826 PolarHBondContact O-N 2.82Å; M826-D828 VanDerWaalsContact C-N 3.35Å; M826-L829 PolarHBondContact O-N 3.34Å; M826-I830 WeakPolarHBondContact O-CB 3.37Å; M826-I830 WeakPolarHBondContact O-CD1 3.36Å; M826-I830 VanDerWaalsContact O-CG1 3.27Å; M826-I830 WeakPolarHBondContact O-CG1 3.47Å; M826-I830 PolarHBondContact O-N 3.06Å
827	K	73.6	Confident	70.1	Confident	140 Å²	140	91.7 Å²	91.7	61%	0.609	45%	0.445	S	S	*	.	H	α-helix	trans	-62.2	-42.7	176.8	-74.9	-174.2	175.5	-170.7	0	111.7	L823 K824 I830 H831	L823-K827 PolarHBondContact O-N 2.88Å; K824-K827 PolarHBondContact O-N 2.59Å; K827-I830 PolarHBondContact O-N 2.85Å; K827-H831 WeakPolarHBondContact O-CB 3.35Å; K827-H831 PolarHBondContact O-N 2.87Å
828	D	75.2	Confident	71.2	Confident	87 Å²	87	88.1 Å²	88.1	47%	0.465	43%	0.43	S	S	.	.	H	α-helix	trans	-64	-41.6	178.4	-62.7	-20.4	0	0	0	111	K824 M826 H831 L832	K824-D828 WeakPolarHBondContact CG-OD2 3.43Å; K824-D828 VanDerWaalsContact O-CG 3.24Å; K824-D828 PolarHBondContact O-N 2.94Å; M826-D828 VanDerWaalsContact C-N 3.35Å; D828-H831 PolarHBondContact O-N 3.27Å; D828-L832 VanDerWaalsContact O-CB 3.32Å; D828-L832 WeakPolarHBondContact O-CB 3.47Å; D828-L832 PolarHBondContact O-N 3.03Å
829	L	72.9	Confident	72	Confident	47 Å²	47	86.3 Å²	86.3	25%	0.246	43%	0.428	C	S	.	.	H	α-helix	trans	-64.4	-43.7	173.6	-91.2	163.7	0	0	0	113.4	L771 L774 V825 M826 L832 L833	L771-L829 HydrophobicContact CD1-CB 4.08Å; L771-L829 HydrophobicContact CD1-CD1 4.25Å; L774-L829 HydrophobicContact CD1-CD1 3.83Å; V825-L829 HydrophobicContact CG1-CD1 4.18Å; V825-L829 WeakPolarHBondContact O-CB 3.28Å; V825-L829 PolarHBondContact O-N 3.44Å; M826-L829 PolarHBondContact O-N 3.34Å; L829-L832 PolarHBondContact O-N 3.23Å; L829-L833 WeakPolarHBondContact O-CG 3.27Å; L829-L833 PolarHBondContact O-N 3.09Å
830	I	74.2	Confident	72.6	Confident	92 Å²	92	86.8 Å²	86.8	47%	0.472	43%	0.425	S	S	.	.	H	α-helix	trans	-65	-41.8	177.6	-70.7	162.9	0	0	0	110.5	M826 K827 L833 S834	M826-I830 WeakPolarHBondContact O-CB 3.37Å; M826-I830 WeakPolarHBondContact O-CD1 3.36Å; M826-I830 VanDerWaalsContact O-CG1 3.27Å; M826-I830 WeakPolarHBondContact O-CG1 3.47Å; M826-I830 PolarHBondContact O-N 3.06Å; K827-I830 PolarHBondContact O-N 2.85Å; I830-L833 PolarHBondContact O-N 3.29Å; I830-S834 WeakPolarHBondContact O-CB 3.4Å; I830-S834 PolarHBondContact O-N 3Å
831	H	75.1	Confident	73.1	Confident	106 Å²	106	85.9 Å²	85.9	49%	0.491	43%	0.427	S	S	.	.	H	α-helix	trans	-67.7	-36.5	177	-171	53.6	0	0	0	112.1	K827 D828 S834 K835	K827-H831 WeakPolarHBondContact O-CB 3.35Å; K827-H831 PolarHBondContact O-N 2.87Å; D828-H831 PolarHBondContact O-N 3.27Å; H831-S834 PolarHBondContact O-N 3.02Å; H831-K835 WeakPolarHBondContact NE2-CE 3.48Å; H831-K835 PolarHBondContact NE2-NZ 3.02Å; H831-K835 WeakPolarHBondContact O-CG 3.45Å; H831-K835 PolarHBondContact O-N 3.5Å
832	L	73.6	Confident	73.7	Confident	83 Å²	83	87.3 Å²	87.3	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-66	-41.5	173	-172.9	64.6	0	0	0	112.1	D828 L829 K835 T836	D828-L832 VanDerWaalsContact O-CB 3.32Å; D828-L832 WeakPolarHBondContact O-CB 3.47Å; D828-L832 PolarHBondContact O-N 3.03Å; L829-L832 PolarHBondContact O-N 3.23Å; L832-K835 PolarHBondContact O-N 3.05Å; L832-T836 PolarHBondContact O-N 3.46Å; L832-T836 PolarHBondContact O-OG1 3.13Å
833	L	74.1	Confident	74.5	Confident	27 Å²	27	86.3 Å²	86.3	14%	0.141	43%	0.431	C	S	.	.	H	α-helix	trans	-61	-46.7	173.2	-79.4	168.7	0	0	0	111.5	R767 L771 L829 I830 K835 T836 L837	R767-L833 HydrophobicContact CB-CD2 3.98Å; L771-L833 HydrophobicContact CD1-CD1 4.43Å; L829-L833 WeakPolarHBondContact O-CG 3.27Å; L829-L833 PolarHBondContact O-N 3.09Å; I830-L833 PolarHBondContact O-N 3.29Å; L833-K835 PolarHBondContact O-N 3.05Å; L833-T836 WeakPolarHBondContact CA-OG1 3.41Å; L833-T836 PolarHBondContact O-N 3.16Å; L833-T836 VanDerWaalsContact O-N 3.16Å; L833-T836 PolarHBondContact O-OG1 3.47Å; L833-L837 WeakPolarHBondContact O-CG 3.33Å; L833-L837 PolarHBondContact O-N 2.99Å
834	S	76.8	Confident	74.7	Confident	51 Å²	51	87 Å²	87	36%	0.357	44%	0.435	S	S	.	.	H	α-helix	trans	-55.6	-46.7	174.6	172.4	0	0	0	0	112	I830 H831 T836 L837 I838	I830-S834 WeakPolarHBondContact O-CB 3.4Å; I830-S834 PolarHBondContact O-N 3Å; H831-S834 PolarHBondContact O-N 3.02Å; S834-T836 PolarHBondContact O-N 2.76Å; S834-L837 PolarHBondContact O-N 3.19Å; S834-I838 WeakPolarHBondContact O-CG1 3.16Å; S834-I838 PolarHBondContact O-N 3.36Å
835	K	78.9	Confident	74.9	Confident	118 Å²	118	83.3 Å²	83.3	51%	0.513	42%	0.424	S	S	.	.	H	α-helix	trans	-58.8	-45.2	174.4	-76.3	178.5	176.4	173.1	0	112.5	H831 L832 L833 L837 I838 Q839	H831-K835 WeakPolarHBondContact NE2-CE 3.48Å; H831-K835 PolarHBondContact NE2-NZ 3.02Å; H831-K835 WeakPolarHBondContact O-CG 3.45Å; H831-K835 PolarHBondContact O-N 3.5Å; L832-K835 PolarHBondContact O-N 3.05Å; L833-K835 PolarHBondContact O-N 3.05Å; K835-L837 VanDerWaalsContact C-N 3.31Å; K835-L837 PolarHBondContact O-N 3.1Å; K835-I838 PolarHBondContact O-N 3.31Å; K835-Q839 WeakPolarHBondContact O-CB 3.49Å; K835-Q839 PolarHBondContact O-N 3.16Å
836	T	73.7	Confident	74.9	Confident	27 Å²	27	86 Å²	86	17%	0.166	43%	0.432	C	S	.	.	H	α-helix	trans	-65.9	-30.7	177.7	52.6	0	0	0	0	113.5	L832 L833 S834 M840	L832-T836 PolarHBondContact O-N 3.46Å; L832-T836 PolarHBondContact O-OG1 3.13Å; L833-T836 WeakPolarHBondContact CA-OG1 3.41Å; L833-T836 PolarHBondContact O-N 3.16Å; L833-T836 VanDerWaalsContact O-N 3.16Å; L833-T836 PolarHBondContact O-OG1 3.47Å; S834-T836 PolarHBondContact O-N 2.76Å; T836-M840 VanDerWaalsContact O-CE 3.28Å; T836-M840 WeakPolarHBondContact O-CE 3.11Å; T836-M840 WeakPolarHBondContact O-CG 3.47Å; T836-M840 PolarHBondContact O-N 3.38Å
837	L	75.4	Confident	75.4	Confident	98 Å²	98	86.1 Å²	86.1	51%	0.513	44%	0.436	S	S	.	.	H	α-helix	trans	-71.2	-44	174.5	-71.8	166.5	0	0	0	111.9	L833 S834 K835 Q839 M840 Q841	L833-L837 WeakPolarHBondContact O-CG 3.33Å; L833-L837 PolarHBondContact O-N 2.99Å; S834-L837 PolarHBondContact O-N 3.19Å; K835-L837 VanDerWaalsContact C-N 3.31Å; K835-L837 PolarHBondContact O-N 3.1Å; L837-Q839 VanDerWaalsContact C-N 3.32Å; L837-Q839 PolarHBondContact O-N 3.16Å; L837-M840 HydrophobicContact CD2-CE 3.97Å; L837-M840 PolarHBondContact O-N 3.48Å; L837-Q841 PolarHBondContact O-N 3.33Å
838	I	80.8	Confident	75.5	Confident	85 Å²	85	84.7 Å²	84.7	44%	0.436	43%	0.431	S	S	.	.	H	α-helix	trans	-61.6	-42.3	174.9	-65.9	163.4	0	0	0	110.5	S834 K835 Q841 Q842	S834-I838 WeakPolarHBondContact O-CG1 3.16Å; S834-I838 PolarHBondContact O-N 3.36Å; K835-I838 PolarHBondContact O-N 3.31Å; I838-Q841 WeakPolarHBondContact O-CB 3.45Å; I838-Q841 PolarHBondContact O-N 2.95Å; I838-Q842 WeakPolarHBondContact O-CG 3.35Å; I838-Q842 PolarHBondContact O-N 3.01Å
839	Q	75.9	Confident	75.5	Confident	122 Å²	122	85.6 Å²	85.6	57%	0.57	43%	0.433	S	S	*	.	H	α-helix	trans	-63.4	-44.8	176.5	-169.5	177.8	10.7	0	0	111.8	K835 L837 Q841 Q842 T843	K835-Q839 WeakPolarHBondContact O-CB 3.49Å; K835-Q839 PolarHBondContact O-N 3.16Å; L837-Q839 VanDerWaalsContact C-N 3.32Å; L837-Q839 PolarHBondContact O-N 3.16Å; Q839-Q841 VanDerWaalsContact C-N 3.33Å; Q839-Q841 PolarHBondContact O-N 3.14Å; Q839-Q842 PolarHBondContact O-N 2.97Å; Q839-T843 PolarHBondContact O-N 2.95Å; Q839-T843 PolarHBondContact O-OG1 2.93Å
840	M	69	Low	75.6	Confident	44 Å²	44	84.9 Å²	84.9	22%	0.217	44%	0.437	C	S	.	.	H	α-helix	trans	-62	-38.4	174.4	-80	-176.2	-78	0	0	112.5	F760 V764 T836 L837 T843 L844	F760-M840 HydrophobicContact CB-SD 4.21Å; F760-M840 HydrophobicContact CD1-CG 4.43Å; F760-M840 HydrophobicContact CD1-SD 4.07Å; F760-M840 HydrophobicContact CG-SD 4.31Å; V764-M840 HydrophobicContact CG2-CE 3.68Å; V764-M840 HydrophobicContact CG2-SD 4.33Å; T836-M840 VanDerWaalsContact O-CE 3.28Å; T836-M840 WeakPolarHBondContact O-CE 3.11Å; T836-M840 WeakPolarHBondContact O-CG 3.47Å; T836-M840 PolarHBondContact O-N 3.38Å; L837-M840 HydrophobicContact CD2-CE 3.97Å; L837-M840 PolarHBondContact O-N 3.48Å; M840-T843 PolarHBondContact O-N 3.14Å; M840-L844 WeakPolarHBondContact O-CB 3.45Å; M840-L844 PolarHBondContact O-N 2.85Å
841	Q	77	Confident	75.4	Confident	129 Å²	129	84.1 Å²	84.1	60%	0.603	43%	0.433	S	S	*	.	H	α-helix	trans	-60.9	-45.9	174.4	-176.2	-179.5	-4.9	0	0	111.1	L837 I838 Q839 T843 L844 T845	L837-Q841 PolarHBondContact O-N 3.33Å; I838-Q841 WeakPolarHBondContact O-CB 3.45Å; I838-Q841 PolarHBondContact O-N 2.95Å; Q839-Q841 VanDerWaalsContact C-N 3.33Å; Q839-Q841 PolarHBondContact O-N 3.14Å; Q841-T843 PolarHBondContact O-N 2.99Å; Q841-L844 PolarHBondContact O-N 3.49Å; Q841-T845 PolarHBondContact O-N 3.31Å; Q841-T845 PolarHBondContact O-OG1 3.46Å
842	Q	80.6	Confident	75.2	Confident	119 Å²	119	83.3 Å²	83.3	56%	0.556	43%	0.429	S	S	*	.	H	α-helix	trans	-60.5	-43.7	176.4	-71.6	172.5	-19.5	0	0	112.2	I838 Q839 T845 Q846	I838-Q842 WeakPolarHBondContact O-CG 3.35Å; I838-Q842 PolarHBondContact O-N 3.01Å; Q839-Q842 PolarHBondContact O-N 2.97Å; Q842-T845 PolarHBondContact O-N 3.47Å; Q842-Q846 WeakPolarHBondContact O-CG 3.39Å; Q842-Q846 PolarHBondContact O-N 3.13Å
843	T	74.6	Confident	75	Confident	66 Å²	66	84.6 Å²	84.6	41%	0.405	44%	0.436	S	S	.	.	H	α-helix	trans	-65.3	-38.7	176.2	-43.8	0	0	0	0	111.9	Q839 M840 Q841 Q846 V847	Q839-T843 PolarHBondContact O-N 2.95Å; Q839-T843 PolarHBondContact O-OG1 2.93Å; M840-T843 PolarHBondContact O-N 3.14Å; Q841-T843 PolarHBondContact O-N 2.99Å; T843-Q846 PolarHBondContact O-N 3.18Å; T843-V847 WeakPolarHBondContact O-CG2 3.36Å; T843-V847 PolarHBondContact O-N 3.1Å
844	L	73.1	Confident	74.3	Confident	107 Å²	107	88.1 Å²	88.1	56%	0.56	46%	0.455	S	S	*	.	H	α-helix	trans	-63.9	-42.3	174.6	-96.8	156.4	0	0	0	112.2	M840 Q841 V847 Q848	M840-L844 WeakPolarHBondContact O-CB 3.45Å; M840-L844 PolarHBondContact O-N 2.85Å; Q841-L844 PolarHBondContact O-N 3.49Å; L844-V847 PolarHBondContact O-N 2.87Å; L844-Q848 WeakPolarHBondContact O-CB 3.32Å; L844-Q848 PolarHBondContact O-N 3.49Å
845	T	78.4	Confident	73.6	Confident	60 Å²	60	92.2 Å²	92.2	37%	0.368	47%	0.468	S	S	.	.	H	α-helix	trans	-63.5	-39.6	174.3	-57.5	0	0	0	0	111.9	Q841 Q842 Q848 Q849	Q841-T845 PolarHBondContact O-N 3.31Å; Q841-T845 PolarHBondContact O-OG1 3.46Å; Q842-T845 PolarHBondContact O-N 3.47Å; T845-Q848 PolarHBondContact O-N 3.42Å; T845-Q849 WeakPolarHBondContact O-CB 3.19Å; T845-Q849 VanDerWaalsContact O-CG 3.31Å; T845-Q849 WeakPolarHBondContact O-CG 3.42Å; T845-Q849 PolarHBondContact O-N 3.41Å
846	Q	75.5	Confident	72.5	Confident	132 Å²	132	94 Å²	94	62%	0.617	48%	0.476	S	S	*	.	H	α-helix	trans	-64.8	-39.6	174.1	-73.9	178	-7.5	0	0	112.5	Q842 T843 G850	Q842-Q846 WeakPolarHBondContact O-CG 3.39Å; Q842-Q846 PolarHBondContact O-N 3.13Å; T843-Q846 PolarHBondContact O-N 3.18Å; Q846-G850 PolarHBondContact O-N 3.22Å
847	V	74.8	Confident	71.3	Confident	68 Å²	68	97 Å²	97	41%	0.412	50%	0.496	S	S	.	.	H	α-helix	trans	-66.9	-39.9	174.6	170.3	0	0	0	0	111.1	T843 L844 G850 I851	T843-V847 WeakPolarHBondContact O-CG2 3.36Å; T843-V847 PolarHBondContact O-N 3.1Å; L844-V847 PolarHBondContact O-N 2.87Å; V847-G850 PolarHBondContact O-N 3.08Å; V847-I851 HydrophobicContact CG1-CD1 3.96Å; V847-I851 WeakPolarHBondContact O-CG1 3.5Å; V847-I851 PolarHBondContact O-N 3.42Å
848	Q	75.3	Confident	69.8	Low	110 Å²	110	96.9 Å²	96.9	51%	0.514	50%	0.501	S	S	.	.	H	α-helix	trans	-62.5	-49.1	174.8	-177.4	-178	-25.2	0	0	111.5	L844 T845 G850 I851 E852	L844-Q848 WeakPolarHBondContact O-CB 3.32Å; L844-Q848 PolarHBondContact O-N 3.49Å; T845-Q848 PolarHBondContact O-N 3.42Å; Q848-G850 PolarHBondContact O-N 3.25Å; Q848-I851 WeakPolarHBondContact O-CA 3.39Å; Q848-I851 PolarHBondContact O-N 3.34Å; Q848-E852 WeakPolarHBondContact CG-OE1 3.45Å; Q848-E852 PolarHBondContact NE2-OE1 3.24Å; Q848-E852 WeakPolarHBondContact O-CG 3.45Å; Q848-E852 PolarHBondContact O-N 3.45Å
849	Q	76.8	Confident	67.9	Low	106 Å²	106	98.3 Å²	98.3	50%	0.495	52%	0.519	S	S	.	.	H	α-helix	trans	-59.2	-37.1	174.8	-72.8	171.3	-17.2	0	0	111.8	T845 I851 E852 L853	T845-Q849 WeakPolarHBondContact O-CB 3.19Å; T845-Q849 VanDerWaalsContact O-CG 3.31Å; T845-Q849 WeakPolarHBondContact O-CG 3.42Å; T845-Q849 PolarHBondContact O-N 3.41Å; Q849-I851 VanDerWaalsContact C-N 3.34Å; Q849-E852 PolarHBondContact O-N 3.39Å; Q849-L853 WeakPolarHBondContact O-CB 3.46Å; Q849-L853 VanDerWaalsContact O-CG 3.3Å; Q849-L853 WeakPolarHBondContact O-CG 3.28Å; Q849-L853 PolarHBondContact O-N 2.76Å
850	G	73.1	Confident	66.1	Low	32 Å²	32	99.5 Å²	99.5	33%	0.33	53%	0.529	S	S	.	.	H	α-helix	trans	-64.9	-33.8	172.7	0	0	0	0	0	113.7	Q846 V847 Q848 L854	Q846-G850 PolarHBondContact O-N 3.22Å; V847-G850 PolarHBondContact O-N 3.08Å; Q848-G850 PolarHBondContact O-N 3.25Å; G850-L854 VanDerWaalsContact O-CD1 3.3Å; G850-L854 WeakPolarHBondContact O-CD1 3.44Å; G850-L854 WeakPolarHBondContact O-CG 3.38Å; G850-L854 PolarHBondContact O-N 3.23Å
851	I	71.5	Confident	64.6	Low	76 Å²	76	104.9 Å²	104.9	39%	0.39	56%	0.558	S	S	.	*	H	α-helix	trans	-75	-44.3	174.7	-69	163.6	0	0	0	110.5	V847 Q848 Q849 L853 L854 E855	V847-I851 HydrophobicContact CG1-CD1 3.96Å; V847-I851 WeakPolarHBondContact O-CG1 3.5Å; V847-I851 PolarHBondContact O-N 3.42Å; Q848-I851 WeakPolarHBondContact O-CA 3.39Å; Q848-I851 PolarHBondContact O-N 3.34Å; Q849-I851 VanDerWaalsContact C-N 3.34Å; I851-L853 VanDerWaalsContact C-N 3.29Å; I851-L853 PolarHBondContact O-N 3.44Å; I851-L854 CarbonylContact O-C 3.52Å; I851-L854 WeakPolarHBondContact O-CA 3.39Å; I851-L854 WeakPolarHBondContact O-CB 3.37Å; I851-L854 PolarHBondContact O-N 3.03Å; I851-E855 PolarHBondContact O-N 2.85Å
852	E	71.2	Confident	62.7	Low	89 Å²	89	106 Å²	106	42%	0.416	56%	0.563	S	S	.	*	H	α-helix	trans	-58.8	-39.3	177.1	-72.4	169.4	-170.7	0	0	111.7	Q848 Q849 L854 F856	Q848-E852 WeakPolarHBondContact CG-OE1 3.45Å; Q848-E852 PolarHBondContact NE2-OE1 3.24Å; Q848-E852 WeakPolarHBondContact O-CG 3.45Å; Q848-E852 PolarHBondContact O-N 3.45Å; Q849-E852 PolarHBondContact O-N 3.39Å; E852-L854 VanDerWaalsContact C-N 3.26Å; E852-L854 PolarHBondContact O-N 3.39Å; E852-F856 PolarHBondContact O-N 2.83Å
853	L	68.6	Low	60.7	Low	110 Å²	110	107.2 Å²	107.2	58%	0.576	57%	0.573	S	S	*	*	H	α-helix	trans	-69.5	-16.3	173.5	-74	170.1	0	0	0	114.8	Q849 I851	Q849-L853 WeakPolarHBondContact O-CB 3.46Å; Q849-L853 VanDerWaalsContact O-CG 3.3Å; Q849-L853 WeakPolarHBondContact O-CG 3.28Å; Q849-L853 PolarHBondContact O-N 2.76Å; I851-L853 VanDerWaalsContact C-N 3.29Å; I851-L853 PolarHBondContact O-N 3.44Å
854	L	58.8	Low	58.9	Low	102 Å²	102	111.3 Å²	111.3	53%	0.534	59%	0.593	S	S	.	*	H	α-helix	trans	-98	-30.1	177.4	-70.4	170.4	0	0	0	112.3	M741 G850 I851 E852	M741-L854 HydrophobicContact CE-CD1 3.77Å; M741-L854 HydrophobicContact CE-CD2 3.79Å; M741-L854 HydrophobicContact CE-CG 4.3Å; M741-L854 HydrophobicContact SD-CD2 3.77Å; G850-L854 VanDerWaalsContact O-CD1 3.3Å; G850-L854 WeakPolarHBondContact O-CD1 3.44Å; G850-L854 WeakPolarHBondContact O-CG 3.38Å; G850-L854 PolarHBondContact O-N 3.23Å; I851-L854 CarbonylContact O-C 3.52Å; I851-L854 WeakPolarHBondContact O-CA 3.39Å; I851-L854 WeakPolarHBondContact O-CB 3.37Å; I851-L854 PolarHBondContact O-N 3.03Å; E852-L854 VanDerWaalsContact C-N 3.26Å; E852-L854 PolarHBondContact O-N 3.39Å
855	E	61.5	Low	57.3	Low	136 Å²	136	113 Å²	113	64%	0.636	60%	0.601	S	S	*	*	H	α-helix	trans	-81.2	-33.6	174.7	-165	160.8	-140.2	0	0	111.3	I851	I851-E855 PolarHBondContact O-N 2.85Å
856	F	56.9	Low	55.4	Low	155 Å²	155	118.4 Å²	118.4	68%	0.68	62%	0.619	S	S	*	*	S	Bend	trans	-126.8	76.2	174.1	-57.5	-80.5	0	0	0	110.8	E852	E852-F856 PolarHBondContact O-N 2.83Å
857	P	48.1	Very low	53.5	Low	92 Å²	92	118.1 Å²	118.1	60%	0.597	63%	0.627	S	S	*	*			trans	-58.8	132.9	171.9	25.7	-34.2	0	0	0	109.7	S859	P857-S859 PolarHBondContact O-N 2.96Å; P857-S859 VanDerWaalsContact O-N 3.09Å
858	P	44.5	Very low	51.4	Low	95 Å²	95	119.1 Å²	119.1	62%	0.617	64%	0.637	S	S	*	*			trans	-64.1	115.6	-173.6	24	-33.5	0	0	0	110.9	N860	P858-N860 PolarHBondContact O-N 3.03Å
859	S	39.9	Very low	49.5	Very low	114 Å²	114	122.9 Å²	122.9	80%	0.797	66%	0.657	S	S	*	*	S	Bend	trans	-75.2	56.5	-176	63	0	0	0	0	112.9	P857	P857-S859 PolarHBondContact O-N 2.96Å; P857-S859 VanDerWaalsContact O-N 3.09Å
860	N	38.9	Very low	47.5	Very low	148 Å²	148	125.6 Å²	125.6	79%	0.791	68%	0.675	S	S	*	*			trans	-154.2	48.7	-179.2	-88.1	-60	0	0	0	111.5	P858	P858-N860 PolarHBondContact O-N 3.03Å
861	L	38	Very low	45.9	Very low	157 Å²	157	130.5 Å²	130.5	82%	0.822	70%	0.698	S	S	*	*			trans	-144.7	33.9	177.3	-150.6	76.8	0	0	0	115.4
862	E	37.3	Very low	44.1	Very low	152 Å²	152	136.3 Å²	136.3	71%	0.71	72%	0.72	S	S	*	*	S	Bend	trans	-122.5	-13.5	177.2	-128.3	176.5	140.1	0	0	115.7
863	D	37.4	Very low	42.3	Very low	144 Å²	144	138.7 Å²	138.7	77%	0.77	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-10.8	-176.2	-75.2	-41.1	0	0	0	115.7
864	N	38	Very low	40.9	Very low	153 Å²	153	138.8 Å²	138.8	82%	0.818	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	9.3	-172.2	-83.1	-57.8	0	0	0	115.7
865	I	39.7	Very low	39.9	Very low	141 Å²	141	140 Å²	140	72%	0.723	76%	0.76	S	S	*	*	S	Bend	trans	-113.7	-11	-177.4	-63.2	-178.7	0	0	0	113.2
866	K	36.8	Very low	38.8	Very low	174 Å²	174	140.7 Å²	140.7	76%	0.757	77%	0.768	S	S	*	*	S	Bend	trans	-93.9	0.5	-179.6	-76.6	170.9	-179.2	155.6	0	115.4
867	T	36	Very low	38	Very low	127 Å²	127	139 Å²	139	78%	0.779	77%	0.771	S	S	*	*	S	Bend	trans	-93.9	7.9	-172.4	-23.7	0	0	0	0	114.4
868	S	31.8	Very low	37.7	Very low	89 Å²	89	141.1 Å²	141.1	62%	0.622	78%	0.777	S	S	*	*	S	Bend	trans	-124.1	139.9	170.6	66.8	0	0	0	0	110.3
869	M	34.4	Very low	37.6	Very low	188 Å²	188	142.2 Å²	142.2	93%	0.926	78%	0.782	S	S	*	*			trans	67.9	70.6	-177.6	-50.9	-172.2	-173.1	0	0	116.6
870	N	35.5	Very low	37.6	Very low	164 Å²	164	143.5 Å²	143.5	88%	0.877	78%	0.78	S	S	*	*				-145.5	145.3	124.3	-148.1	-11.2	0	0	0	111.7
871	V	38.6	Very low	37.6	Very low	135 Å²	135	141.9 Å²	141.9	82%	0.818	78%	0.779	S	S	*	*			trans	-107.3	140.3	-174.6	175.5	0	0	0	0	110
872	K	33.6	Very low	38.1	Very low	197 Å²	197	139.2 Å²	139.2	86%	0.857	77%	0.771	S	S	*	*			trans	-70.5	133.6	-177.2	-60.1	174.4	179.2	178.1	0	112.4
873	T	35.2	Very low	38.2	Very low	140 Å²	140	137.8 Å²	137.8	86%	0.859	77%	0.769	S	S	*	*			trans	-147.3	124.4	138.7	-40.6	0	0	0	0	109.1
874	P	37.7	Very low	38.4	Very low	112 Å²	112	138 Å²	138	73%	0.727	78%	0.775	S	S	*	*			trans	-119.5	158.5	-171.6	40.8	-31.9	0	0	0	115.4
875	T	38	Very low	38.4	Very low	128 Å²	128	137.2 Å²	137.2	79%	0.785	77%	0.767	S	S	*	*			trans	-157.1	124.9	151.4	44.8	0	0	0	0	111.4
876	N	39	Very low	38.6	Very low	149 Å²	149	137.2 Å²	137.2	80%	0.797	77%	0.773	S	S	*	*			trans	45.6	143	132.6	-56	6	0	0	0	120.6
877	T	40	Very low	38.8	Very low	120 Å²	120	136.6 Å²	136.6	74%	0.736	77%	0.771	S	S	*	*			cis	-155.2	167.7	12.8	-10.2	0	0	0	0	112.1
878	D	41.6	Very low	39.3	Very low	137 Å²	137	139.7 Å²	139.7	73%	0.733	78%	0.776	S	S	*	*			trans	-47.9	163.5	179.1	-43.6	-63.4	0	0	0	115.5
879	T	42.2	Very low	39.6	Very low	118 Å²	118	140.9 Å²	140.9	72%	0.724	78%	0.779	S	S	*	*			cis	-160.1	145.8	45.7	50.2	0	0	0	0	116
880	N	40.1	Very low	40.6	Very low	141 Å²	141	141.4 Å²	141.4	75%	0.754	80%	0.796	S	S	*	*			trans	34	150.2	130.2	-57.1	-8.9	0	0	0	122.4
881	C	39.5	Very low	40.8	Very low	113 Å²	113	140.3 Å²	140.3	76%	0.764	79%	0.792	S	S	*	*			cis	-168.4	175.3	-15.4	-105.4	0	0	0	0	109.3
882	P	47.7	Very low	40.9	Very low	102 Å²	102	140.5 Å²	140.5	66%	0.662	79%	0.791	S	S	*	*			trans	-126.8	-143	-151.7	44.4	-28.9	0	0	0	115.6
883	D	40.5	Very low	41.3	Very low	122 Å²	122	137.4 Å²	137.4	65%	0.652	79%	0.787	S	S	*	*			trans	82.9	121.3	166.7	-59.7	-44.6	0	0	0	119.1
884	T	40.3	Very low	41.7	Very low	147 Å²	147	137.2 Å²	137.2	90%	0.902	78%	0.783	S	S	*	*				-154.3	163.9	82.3	11.8	0	0	0	0	114.6
885	Q	39	Very low	42	Very low	138 Å²	138	138.8 Å²	138.8	65%	0.645	79%	0.786	S	S	*	*			trans	-122.7	150.5	-173.7	-54.4	175	15	0	0	113.6
886	T	44	Very low	42.2	Very low	140 Å²	140	139.5 Å²	139.5	86%	0.859	79%	0.786	S	S	*	*			trans	-165.4	117.4	142.5	17	0	0	0	0	107.3
887	K	39.7	Very low	42.5	Very low	162 Å²	162	138.9 Å²	138.9	70%	0.704	79%	0.786	S	S	*	*				61.4	106.2	52.5	-75.5	-172.4	173.8	176.3	0	115.2
888	H	46.2	Very low	42.6	Very low	192 Å²	192	140.3 Å²	140.3	89%	0.889	79%	0.79	S	S	*	*				-151.5	165.6	113.8	-116.4	-83.6	0	0	0	111.2
889	V	39.8	Very low	42.7	Very low	114 Å²	114	140.6 Å²	140.6	69%	0.691	79%	0.794	S	S	*	*			trans	-147.8	139.1	-157.2	156.3	0	0	0	0	107.4
890	P	53.8	Low	42.8	Very low	198 Å²	198	142.6 Å²	142.6	100%	1.286	80%	0.801	S	S	*	*				-101.1	0	87.3	-16.3	33.1	0	0	0	115.4

Retrieved 890 of 890 residues in 126.3 ms (Link to these results)

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