A0A3Q0KMS9_SCHMA Loading...

L-serine ammonia-lyase

AlphaFold DB , UniProt , Accession A0A3Q0KMS9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 970 aa.

						>A0A3Q0KMS9_SCHMA|A0A3Q0KMS9
MHVNGCMGSNLSDVFPSLPFQDSINNSATGPVLNVNGPNVNSIDTMSRLKFLGLNLTSNNQNGNSNTLCNEDRSRTNLIINYLPQSYDQNDLQRLFERVGPIRQCKLIRDKNTGASLCYGFVDFVNPQHAALAIQTYHGYETEQKRLRVAYASSGGRRFTPGHRLQTFSNGTNFSGSLSSEVTNENIIGWEIIVTGIPVEWTEPDLLRLFSNFGAVVVIRLLAPQFPDSPPGQKPRLSPALNGASSDMSSESADNKFTSSASVIFQEKNNAELSVLRLNGYQAPEWASPLRLRLIGSVTRETYGLFYFSSRQSPLPLNRTTNNNSNADPLTESNILTNVLNRRTLNTLGCAVHGNSQNQYVTETKNSEVALNVAVESSGSLQLPSNPLFGIPPRPIMRNKVTDHNLTSIFNRDVLSQTSSLDVLDFLDGHHNLNSPGLVAGVDRCSSRELSIINTLNSQRTVDNDQPKLEHSLRNLANSTSHSPWLFSQQRSAINPLSETGRSGEINPSALTAGLFRRLSVKSPLIPSPVLSSLLTQRGCQMNIWLKLENIQPTGSFKIRGVENVVRKWAAAGVSHIVCPTTGNAGVAASFAAHTYRINCTLVVPEAFEQTVRRRLSLEAQEAKIVIGGTSFLEAHHRAEQLVNDLQSGHNDPTVRLLHPYDQPELWEGYETIVDEITPEIGQPDAIVVAVGGGGLLAGVIQGLWNKGWSSTHIVTVETEGADCLNRSLKSGQLAVIPRSSTIATSLSAPVLAQRAWSLAQCHSISAVTCTDGEAVDGVKRFLDDHGMLVDPACGAALSTVYSGYLSRLQLEGRLPRPSNILIVIGGGRNVSFRQLIDWENQMSSFAPEQIAASVLPPLSSSYMSHLSPRSTCQEIPKSSTMTHHTSGAEHEEGRVRTPTPNTPRSVCAILSRTAVSRSDAADHQMSVCNGLEVENSSECAGSLNPHDLMNFSKLLASSEAEGEEGGLRE
					

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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	30.9	Very low	30.5	Very low	245 Å²	245	147.8 Å²	147.8	100%	1.207	87%	0.869	S	S	*	*				0	177.3	0	-70	178	179.3	0	0	108.6
2	H	30.8	Very low	30.1	Very low	181 Å²	181	142.3 Å²	142.3	84%	0.838	84%	0.844	S	S	*	*			trans	-46.2	166.8	-178.6	-66.9	-68.3	0	0	0	117.7
3	V	31.7	Very low	30	Very low	105 Å²	105	142.4 Å²	142.4	64%	0.636	84%	0.838	S	S	*	*			cis	-176.9	149.8	-32.8	85.5	0	0	0	0	107.6
4	N	33.5	Very low	30.2	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	84%	0.836	S	S	*	*			trans	58.3	147.8	173.4	-57.5	-10.4	0	0	0	116.1
5	G	28.6	Very low	29.9	Very low	71 Å²	71	146.3 Å²	146.3	73%	0.732	84%	0.842	S	S	*	*			cis	125.6	114.4	7.5	0	0	0	0	0	110.8
6	C	32.4	Very low	30.1	Very low	139 Å²	139	144.4 Å²	144.4	94%	0.939	84%	0.836	S	S	*	*			trans	-159.1	151.5	160.9	-105.1	0	0	0	0	110.5
7	M	30.1	Very low	30	Very low	194 Å²	194	142.5 Å²	142.5	96%	0.956	83%	0.833	S	S	*	*			trans	-108.4	149.9	178.3	-80.9	-174.8	162	0	0	111.5
8	G	27.8	Very low	30.1	Very low	75 Å²	75	144.1 Å²	144.1	77%	0.773	84%	0.837	S	S	*	*			trans	89.2	112.5	143.6	0	0	0	0	0	117.8
9	S	31.5	Very low	29.9	Very low	125 Å²	125	141.8 Å²	141.8	87%	0.874	83%	0.827	S	S	*	*				-168.1	153.2	127.6	18.7	0	0	0	0	109.8
10	N	27.6	Very low	30	Very low	163 Å²	163	145.7 Å²	145.7	87%	0.872	83%	0.834	S	S	*	*			trans	-74.3	147.6	174.1	-59	-32.2	0	0	0	110.1
11	L	30.5	Very low	30	Very low	173 Å²	173	146.1 Å²	146.1	91%	0.906	83%	0.828	S	S	*	*			trans	-143.6	115.3	148.1	-108	168.2	0	0	0	108.9
12	S	26.4	Very low	29.9	Very low	81 Å²	81	140.5 Å²	140.5	57%	0.566	80%	0.803	S	S	*	*			trans	-79.5	178.4	162.7	48	0	0	0	0	110
13	D	28.5	Very low	29.8	Very low	144 Å²	144	137.9 Å²	137.9	77%	0.77	81%	0.806	S	S	*	*			trans	70.1	109.6	161	-44.8	-55.6	0	0	0	117.1
14	V	32.8	Very low	29.6	Very low	133 Å²	133	140.5 Å²	140.5	81%	0.806	81%	0.814	S	S	*	*				-166.7	112.2	114.3	150.6	0	0	0	0	108.2
15	F	25.9	Very low	29.4	Very low	211 Å²	211	141.1 Å²	141.1	93%	0.925	82%	0.818	S	S	*	*			trans	-134.3	116.9	160	-98.6	-71.6	0	0	0	106.8
16	P	33.4	Very low	29.3	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	82%	0.82	S	S	*	*			trans	-95.6	106.4	169.7	32.4	-26.2	0	0	0	110
17	S	28.5	Very low	29.3	Very low	112 Å²	112	143.3 Å²	143.3	78%	0.783	81%	0.812	S	S	*	*			trans	-79	141.5	167.8	49.9	0	0	0	0	110.8
18	L	30.3	Very low	29.3	Very low	171 Å²	171	137.8 Å²	137.8	90%	0.895	80%	0.797	S	S	*	*			trans	-116.1	124.6	170.2	-80.8	171.2	0	0	0	109.9
19	P	27.9	Very low	29.6	Very low	100 Å²	100	140.9 Å²	140.9	65%	0.649	80%	0.801	S	S	*	*			trans	-93.6	160.7	175.8	37.1	-33.9	0	0	0	111.8
20	F	32	Very low	29.5	Very low	220 Å²	220	138.5 Å²	138.5	97%	0.965	80%	0.796	S	S	*	*			trans	-144.1	152.1	147.8	-110.8	-78.1	0	0	0	110.4
21	Q	30.1	Very low	29.7	Very low	154 Å²	154	137.1 Å²	137.1	72%	0.72	80%	0.796	S	S	*	*			trans	-111.6	156.6	-161	-92.3	178.1	-102.9	0	0	114.3
22	D	26.8	Very low	29.4	Very low	128 Å²	128	134.7 Å²	134.7	68%	0.684	79%	0.788	S	S	*	*			trans	42.1	118.8	140.8	-51.1	-29.1	0	0	0	120.4
23	S	29.4	Very low	29.5	Very low	126 Å²	126	139.3 Å²	139.3	88%	0.881	81%	0.805	S	S	*	*				-161.5	114.2	120.9	-84.3	0	0	0	0	111.5
24	I	27.9	Very low	29.3	Very low	160 Å²	160	138.6 Å²	138.6	82%	0.821	80%	0.802	S	S	*	*			trans	-91.6	131.4	166.7	-66.2	166.5	0	0	0	107.9
25	N	30	Very low	29.3	Very low	168 Å²	168	138.3 Å²	138.3	90%	0.898	80%	0.8	S	S	*	*			trans	-155.3	153.9	140.6	-110.3	-40.1	0	0	0	112.9
26	N	26.6	Very low	29.4	Very low	145 Å²	145	134.8 Å²	134.8	78%	0.775	79%	0.791	S	S	*	*			trans	-118.4	-175.1	-169.7	-151.1	-20.3	0	0	0	109.9
27	S	30.4	Very low	29.1	Very low	111 Å²	111	132.8 Å²	132.8	78%	0.776	79%	0.791	S	S	*	*			trans	79	148.1	179.5	87.7	0	0	0	0	115.3
28	A	31.9	Very low	29.4	Very low	77 Å²	77	132.8 Å²	132.8	64%	0.636	79%	0.788	S	S	*	*			cis	-160.4	166.3	-7.5	0	0	0	0	0	111.3
29	T	33.1	Very low	29.2	Very low	141 Å²	141	131.8 Å²	131.8	87%	0.865	78%	0.784	S	S	*	*			trans	44	121.6	155.2	52.7	0	0	0	0	118.8
30	G	28.7	Very low	29.2	Very low	74 Å²	74	133 Å²	133	76%	0.763	79%	0.789	S	S	*	*				91.4	160.4	51	0	0	0	0	0	111.1
31	P	32.6	Very low	29.1	Very low	134 Å²	134	129.4 Å²	129.4	87%	0.87	78%	0.78	S	S	*	*			cis	-129.5	-170	4.3	43.7	-27.6	0	0	0	114.6
32	V	25	Very low	29	Very low	122 Å²	122	127.2 Å²	127.2	74%	0.739	78%	0.782	S	S	*	*			trans	-79	149.6	173.7	173.3	0	0	0	0	112.1	N34	V32-N34 HydrophobicContact CG1-CB 4.26Å
33	L	28.6	Very low	29.2	Very low	178 Å²	178	127.8 Å²	127.8	93%	0.932	78%	0.783	S	S	*	*			trans	-123.9	141	152.4	-81.4	176.8	0	0	0	111.1
34	N	23.9	Very low	29.4	Very low	130 Å²	130	127.1 Å²	127.1	70%	0.695	77%	0.77	S	S	*	*			trans	-148.3	113.7	-170.4	162	41.6	0	0	0	109.4	V32	V32-N34 HydrophobicContact CG1-CB 4.26Å
35	V	31.4	Very low	29.6	Very low	126 Å²	126	125 Å²	125	76%	0.764	76%	0.764	S	S	*	*			trans	-145.3	105.8	170	-174.5	0	0	0	0	110.9
36	N	29.5	Very low	29.6	Very low	138 Å²	138	124.3 Å²	124.3	74%	0.738	76%	0.758	S	S	*	*			trans	28.6	138.2	136.4	-50.8	-30.1	0	0	0	121.3
37	G	25.8	Very low	30	Very low	73 Å²	73	120.4 Å²	120.4	75%	0.753	74%	0.742	S	S	*	*			trans	-78	-140	161.4	0	0	0	0	0	113
38	P	35.5	Very low	30.1	Very low	113 Å²	113	124.6 Å²	124.6	73%	0.734	74%	0.74	S	S	*	*			cis	-135.5	-170.8	18	44	-27.3	0	0	0	115
39	N	26	Very low	30.3	Very low	150 Å²	150	126.7 Å²	126.7	80%	0.802	74%	0.74	S	S	*	*			trans	59	129.6	159.5	-68.9	-21.9	0	0	0	119.5
40	V	28.8	Very low	30.4	Very low	125 Å²	125	129 Å²	129	76%	0.758	74%	0.738	S	S	*	*				-173.4	128.3	108.4	145.9	0	0	0	0	111.1
41	N	30	Very low	30.8	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	74%	0.742	S	S	*	*			trans	22.2	120.5	153.7	-51.5	-19.3	0	0	0	121.4
42	S	26.9	Very low	30.8	Very low	109 Å²	109	134 Å²	134	76%	0.762	73%	0.731	S	S	*	*			trans	-0.1	118.3	131.7	-173.8	0	0	0	0	117.4
43	I	31.8	Very low	30.8	Very low	139 Å²	139	131.4 Å²	131.4	71%	0.713	73%	0.729	S	S	*	*			trans	-166.3	-40.2	147.7	-106	153.8	0	0	0	110.5	T45 M46	I43-T45 PolarHBondContact O-N 3.38Å; I43-M46 PolarHBondContact O-N 3.34Å
44	D	33.1	Very low	30.9	Very low	112 Å²	112	129.8 Å²	129.8	60%	0.599	72%	0.72	S	S	*	*	H	α-helix	trans	-80.1	-16.3	-156.6	-155.7	29.9	0	0	0	116.4	M46 S47	D44-M46 VanDerWaalsContact C-N 3.33Å; D44-M46 PolarHBondContact O-N 3.4Å; D44-S47 VanDerWaalsContact O-CB 3.27Å; D44-S47 WeakPolarHBondContact O-CB 3.17Å; D44-S47 PolarHBondContact O-N 2.62Å; D44-S47 PolarHBondContact O-OG 2.85Å; D44-S47 WeakPolarHBondContact OD1-CB 3.32Å; D44-S47 PolarHBondContact OD1-OG 2.77Å
45	T	32.3	Very low	31	Very low	115 Å²	115	130.5 Å²	130.5	71%	0.706	72%	0.724	S	S	*	*	H	α-helix	trans	-70.9	-25.4	175.1	37.4	0	0	0	0	113.4	I43 S47	I43-T45 PolarHBondContact O-N 3.38Å; T45-S47 VanDerWaalsContact C-N 3.35Å
46	M	30.4	Very low	30.8	Very low	155 Å²	155	132.1 Å²	132.1	76%	0.764	73%	0.728	S	S	*	*	H	α-helix	trans	-72.3	-28.4	171.8	-85.7	-166.1	169.2	0	0	112.7	I43 D44 R48 L49	I43-M46 PolarHBondContact O-N 3.34Å; D44-M46 VanDerWaalsContact C-N 3.33Å; D44-M46 PolarHBondContact O-N 3.4Å; M46-R48 PolarHBondContact O-N 2.81Å; M46-L49 PolarHBondContact O-N 3.11Å
47	S	34.4	Very low	30.8	Very low	62 Å²	62	131.8 Å²	131.8	43%	0.434	73%	0.73	S	S	.	*	H	α-helix	trans	-58.3	-48.3	178.3	-46.5	0	0	0	0	111.4	D44 T45	D44-S47 VanDerWaalsContact O-CB 3.27Å; D44-S47 WeakPolarHBondContact O-CB 3.17Å; D44-S47 PolarHBondContact O-N 2.62Å; D44-S47 PolarHBondContact O-OG 2.85Å; D44-S47 WeakPolarHBondContact OD1-CB 3.32Å; D44-S47 PolarHBondContact OD1-OG 2.77Å; T45-S47 VanDerWaalsContact C-N 3.35Å
48	R	33.4	Very low	30.7	Very low	200 Å²	200	133.4 Å²	133.4	76%	0.755	73%	0.731	S	S	*	*	H	α-helix	trans	-70.7	-30.8	-177.2	-71.1	-173.6	170.8	-156	-4.7	113.6	M46 K50 F51	M46-R48 PolarHBondContact O-N 2.81Å; R48-K50 PolarHBondContact O-N 3.06Å; R48-F51 WeakPolarHBondContact O-CB 3.3Å; R48-F51 PolarHBondContact O-N 2.99Å
49	L	35.1	Very low	30.4	Very low	121 Å²	121	135.2 Å²	135.2	63%	0.634	73%	0.734	S	S	*	*	H	α-helix	trans	-67.1	-32.2	179.4	-82.8	163.4	0	0	0	113.3	M46 F51	M46-L49 PolarHBondContact O-N 3.11Å; L49-F51 VanDerWaalsContact C-N 3.29Å; L49-F51 PolarHBondContact O-N 2.6Å
50	K	35.9	Very low	30.5	Very low	190 Å²	190	133.8 Å²	133.8	83%	0.826	73%	0.726	S	S	*	*	H	α-helix	trans	-70.3	-23.3	174.2	-79.4	-172.4	174.6	179.9	0	113.8	R48 L52	R48-K50 PolarHBondContact O-N 3.06Å; K50-L52 PolarHBondContact O-N 3.38Å
51	F	36.2	Very low	30.6	Very low	192 Å²	192	135.6 Å²	135.6	84%	0.842	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-12.7	-178.3	-154.7	-95.7	0	0	0	113.4	R48 L49	R48-F51 WeakPolarHBondContact O-CB 3.3Å; R48-F51 PolarHBondContact O-N 2.99Å; L49-F51 VanDerWaalsContact C-N 3.29Å; L49-F51 PolarHBondContact O-N 2.6Å
52	L	32.9	Very low	30.6	Very low	121 Å²	121	135.5 Å²	135.5	63%	0.634	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	11.5	-177.3	-67.7	172.3	0	0	0	114.3	K50 L54	K50-L52 PolarHBondContact O-N 3.38Å; L52-L54 PolarHBondContact O-N 3.29Å
53	G	24.3	Very low	30.7	Very low	67 Å²	67	134 Å²	134	69%	0.691	73%	0.727	S	S	*	*			trans	69.6	2.1	167.3	0	0	0	0	0	117.3	N55	G53-N55 PolarHBondContact O-N 3.39Å
54	L	31.2	Very low	30.6	Very low	144 Å²	144	134.4 Å²	134.4	75%	0.754	73%	0.731	S	S	*	*			trans	-79.4	101.6	-179.5	-67.2	177.4	0	0	0	111.4	L52	L52-L54 PolarHBondContact O-N 3.29Å
55	N	27.2	Very low	30.4	Very low	144 Å²	144	133.3 Å²	133.3	77%	0.77	73%	0.732	S	S	*	*			trans	-91.1	104.8	-177.2	-161.4	8.2	0	0	0	110.7	G53	G53-N55 PolarHBondContact O-N 3.39Å
56	L	26.3	Very low	30.2	Very low	161 Å²	161	135.8 Å²	135.8	84%	0.843	74%	0.741	S	S	*	*			trans	-100.4	115.1	170.2	-78.7	91.6	0	0	0	110.4
57	T	29.2	Very low	30.2	Very low	130 Å²	130	134.7 Å²	134.7	80%	0.798	74%	0.743	S	S	*	*			trans	-115.5	147.7	166	47.7	0	0	0	0	110.2
58	S	24.9	Very low	29.8	Very low	108 Å²	108	139.1 Å²	139.1	76%	0.755	76%	0.761	S	S	*	*			trans	-117.1	129	-169.4	-177.6	0	0	0	0	111.9
59	N	28.4	Very low	29.5	Very low	150 Å²	150	134.2 Å²	134.2	80%	0.802	76%	0.756	S	S	*	*			trans	-159.9	124.6	145.3	-93.5	-36.4	0	0	0	107.1
60	N	27.1	Very low	29.3	Very low	121 Å²	121	134.4 Å²	134.4	65%	0.647	76%	0.758	S	S	*	*			cis	81.4	89	41.4	-171.8	23.8	0	0	0	113.7
61	Q	32	Very low	29.3	Very low	162 Å²	162	133.1 Å²	133.1	76%	0.757	76%	0.755	S	S	*	*				-173.6	136.7	128.9	-104.5	169.4	75	0	0	114.6
62	N	30	Very low	29.7	Very low	143 Å²	143	128.2 Å²	128.2	77%	0.765	74%	0.738	S	S	*	*			trans	49.7	89.7	142.6	-57.6	-16.3	0	0	0	121.5
63	G	29.1	Very low	30.6	Very low	76 Å²	76	130.5 Å²	130.5	78%	0.784	74%	0.738	S	S	*	*				80.9	106.3	98.5	0	0	0	0	0	121
64	N	29.4	Very low	32.3	Very low	148 Å²	148	130 Å²	130	79%	0.791	72%	0.724	S	S	*	*				-158.1	125.8	121.5	-132.8	-31.8	0	0	0	114.4
65	S	29.3	Very low	34.6	Very low	90 Å²	90	130.8 Å²	130.8	63%	0.629	72%	0.717	S	S	*	*			trans	28.9	107	145	-50.3	0	0	0	0	122
66	N	26.8	Very low	37.6	Very low	166 Å²	166	124.3 Å²	124.3	89%	0.888	68%	0.682	S	S	*	*	S	Bend	trans	62.2	53.2	139.8	-63.4	-4.1	0	0	0	120.9
67	T	30.3	Very low	40.8	Very low	133 Å²	133	119 Å²	119	82%	0.816	66%	0.655	S	S	*	*			trans	-131.4	-8.2	161.5	48.5	0	0	0	0	115.5
68	L	27.6	Very low	43.9	Very low	155 Å²	155	112.9 Å²	112.9	81%	0.812	62%	0.617	S	S	*	*			trans	-107.1	82.5	-162.1	-156.8	80.1	0	0	0	113.8
69	C	25.9	Very low	47.3	Very low	96 Å²	96	109.5 Å²	109.5	65%	0.649	59%	0.59	S	S	*	*	S	Bend	trans	-156.2	7	174.2	73.5	0	0	0	0	118
70	N	31.9	Very low	50.5	Low	126 Å²	126	102.3 Å²	102.3	67%	0.674	55%	0.552	S	S	*	*	S	Bend	trans	-121	-25.7	-174	-100.9	-32.4	0	0	0	115.7
71	E	36.3	Very low	53.7	Low	163 Å²	163	98.4 Å²	98.4	76%	0.762	53%	0.531	S	S	*	.	S	Bend	trans	-76.7	-36.5	-176.7	-60.8	-165	137.1	0	0	112.6	R73 S74	E71-R73 PolarHBondContact O-N 3.38Å; E71-R73 VanDerWaalsContact O-N 3.1Å; E71-S74 WeakPolarHBondContact O-CB 3.42Å; E71-S74 PolarHBondContact O-N 3.21Å; E71-S74 PolarHBondContact O-OG 3.29Å
72	D	44.2	Very low	56.5	Low	88 Å²	88	96.8 Å²	96.8	47%	0.471	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-58.1	-27.6	-178.3	-68.1	-64.2	0	0	0	114.5	S74 R75 T76	D72-S74 PolarHBondContact O-N 3.3Å; D72-S74 VanDerWaalsContact O-N 3.16Å; D72-R75 PolarHBondContact O-N 3.41Å; D72-T76 PolarHBondContact O-N 3.19Å
73	R	51.3	Low	59.4	Low	170 Å²	170	90 Å²	90	64%	0.642	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-62.6	-20.6	177.6	-68.4	-170.7	179.9	-152.6	1.7	113.2	E71 R75 T76	E71-R73 PolarHBondContact O-N 3.38Å; E71-R73 VanDerWaalsContact O-N 3.1Å; R73-R75 PolarHBondContact O-N 3.14Å; R73-T76 PolarHBondContact O-OG1 3.27Å
74	S	60	Low	62.2	Low	56 Å²	56	86.3 Å²	86.3	39%	0.392	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-67.6	-18.8	171.8	65.7	0	0	0	0	113.2	E71 D72	E71-S74 WeakPolarHBondContact O-CB 3.42Å; E71-S74 PolarHBondContact O-N 3.21Å; E71-S74 PolarHBondContact O-OG 3.29Å; D72-S74 PolarHBondContact O-N 3.3Å; D72-S74 VanDerWaalsContact O-N 3.16Å
75	R	79.7	Confident	65	Low	160 Å²	160	85.3 Å²	85.3	60%	0.604	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-117	9.9	-175.3	-64	-177.1	179.4	-176.4	-0.2	114	D72 R73 P127 A130 Y151	D72-R75 PolarHBondContact O-N 3.41Å; R73-R75 PolarHBondContact O-N 3.14Å; R75-P127 HydrophobicContact CB-CB 4.02Å; R75-P127 WeakPolarHBondContact O-CA 3.36Å; R75-P127 VanDerWaalsContact O-CB 3.32Å; R75-P127 WeakPolarHBondContact O-CB 3.5Å; R75-A130 VanDerWaalsContact O-CB 3.29Å; R75-A130 WeakPolarHBondContact O-CB 3.47Å; R75-Y151 HydrophobicContact CB-CE1 4.11Å; R75-Y151 WeakPolarHBondContact O-CE1 3.47Å
76	T	90.1	Very high	68	Low	8 Å²	8	84.3 Å²	84.3	5%	0.049	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-31.6	171.8	55.8	0	0	0	0	113.2	D72 R73 D123 F124 P127	D72-T76 PolarHBondContact O-N 3.19Å; R73-T76 PolarHBondContact O-OG1 3.27Å; T76-D123 WeakPolarHBondContact CB-OD1 3.44Å; T76-D123 PolarHBondContact OG1-OD1 3.1Å; T76-F124 WeakPolarHBondContact CB-O 3.41Å; T76-F124 PolarHBondContact O-N 3.25Å; T76-P127 HydrophobicContact CG2-CB 4.12Å
77	N	93.4	Very high	71	Confident	51 Å²	51	77.9 Å²	77.9	27%	0.273	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.4	-174.8	-166.8	0.8	0	0	0	112.3	D123 Y151 A152	N77-D123 HydrophobicContact CB-CB 4.27Å; N77-D123 PolarHBondContact N-OD1 3.47Å; N77-Y151 WeakPolarHBondContact O-CA 3.35Å; N77-A152 HydrophobicContact CB-CB 4.22Å; N77-A152 PolarHBondContact O-N 3.42Å
78	L	94.9	Very high	74	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145.9	176.8	-57.1	-173.9	0	0	0	111.4	I80 F96 F121 V122 F124 A130 A133 I134 V149 A150 Y151	L78-I80 HydrophobicContact CB-CD1 3.95Å; L78-F96 HydrophobicContact CD1-CE1 4.42Å; L78-F121 CarbonylContact O-C 3.48Å; L78-F121 WeakPolarHBondContact O-CA 3.12Å; L78-V122 PolarHBondContact N-O 3.31Å; L78-V122 PolarHBondContact O-N 3.21Å; L78-F124 HydrophobicContact CD1-CD2 4.21Å; L78-F124 HydrophobicContact CD1-CE2 3.78Å; L78-F124 HydrophobicContact CG-CD2 4.48Å; L78-F124 HydrophobicContact CG-CE2 4.48Å; L78-A130 HydrophobicContact CD1-CB 4.38Å; L78-A130 HydrophobicContact CD2-CB 3.97Å; L78-A130 HydrophobicContact CG-CB 4.13Å; L78-A133 HydrophobicContact CD1-CB 3.79Å; L78-I134 HydrophobicContact CD1-CG1 4.22Å; L78-I134 HydrophobicContact CD2-CD1 3.67Å; L78-I134 HydrophobicContact CD2-CG1 3.74Å; L78-V149 HydrophobicContact CB-CG1 4.4Å; L78-V149 HydrophobicContact CD1-CG1 3.72Å; L78-A150 CarbonylContact C-O 3.41Å; L78-A150 WeakPolarHBondContact CA-O 3.34Å; L78-Y151 HydrophobicContact CD2-CD1 3.59Å; L78-Y151 HydrophobicContact CD2-CE1 3.93Å; L78-Y151 HydrophobicContact CD2-CG 4.28Å
79	I	95.3	Very high	77.1	Confident	37 Å²	37	70.3 Å²	70.3	19%	0.19	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.6	161.7	-169.8	175.7	0	0	0	109.3	Y119 F121 V149 A150 A152	I79-Y119 HydrophobicContact CD1-CD2 4.14Å; I79-Y119 HydrophobicContact CG1-CD2 4.38Å; I79-F121 HydrophobicContact CB-CD1 3.98Å; I79-F121 HydrophobicContact CB-CE1 3.78Å; I79-F121 HydrophobicContact CD1-CE1 3.84Å; I79-F121 HydrophobicContact CD1-CZ 3.88Å; I79-F121 HydrophobicContact CG1-CD1 4.16Å; I79-F121 HydrophobicContact CG1-CE1 3.75Å; I79-F121 HydrophobicContact CG1-CZ 4.12Å; I79-V149 WeakPolarHBondContact O-CA 3.23Å; I79-A150 HydrophobicContact CG2-CB 4.43Å; I79-A150 PolarHBondContact N-O 3.34Å; I79-A150 PolarHBondContact O-N 3.41Å; I79-A152 HydrophobicContact CB-CB 4.25Å
80	I	95.1	Very high	80.4	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	116.3	179.6	-58.1	70.7	0	0	0	106.8	L78 L83 L92 F96 Y119 G120 V122 L147 V149	L78-I80 HydrophobicContact CB-CD1 3.95Å; I80-L83 HydrophobicContact CG2-CD1 4.33Å; I80-L83 HydrophobicContact CG2-CD2 3.85Å; I80-L83 HydrophobicContact CG2-CG 4.01Å; I80-L92 HydrophobicContact CB-CD1 4.3Å; I80-L92 HydrophobicContact CG1-CD1 4.22Å; I80-L92 HydrophobicContact CG2-CD1 4.28Å; I80-F96 HydrophobicContact CB-CZ 4.45Å; I80-F96 HydrophobicContact CD1-CE1 4.37Å; I80-F96 HydrophobicContact CD1-CZ 4.31Å; I80-F96 HydrophobicContact CG1-CE1 3.88Å; I80-F96 HydrophobicContact CG1-CE2 3.75Å; I80-F96 HydrophobicContact CG1-CZ 3.39Å; I80-F96 HydrophobicContact CG2-CE2 4.2Å; I80-F96 HydrophobicContact CG2-CZ 4.13Å; I80-Y119 CarbonylContact O-C 3.58Å; I80-Y119 WeakPolarHBondContact O-CA 3.47Å; I80-Y119 VanDerWaalsContact O-CB 3.31Å; I80-Y119 WeakPolarHBondContact O-CB 3.28Å; I80-G120 PolarHBondContact N-O 2.83Å; I80-G120 PolarHBondContact O-N 3.47Å; I80-V122 HydrophobicContact CD1-CB 3.9Å; I80-V122 HydrophobicContact CD1-CG2 3.7Å; I80-L147 HydrophobicContact CG2-CB 4.49Å; I80-L147 HydrophobicContact CG2-CD1 4.49Å; I80-V149 HydrophobicContact CG1-CG1 4.39Å; I80-V149 HydrophobicContact CG1-CG2 4.34Å; I80-V149 HydrophobicContact CG2-CG2 4.33Å
81	N	94.3	Very high	83.3	Confident	39 Å²	39	66 Å²	66	21%	0.209	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	161.2	-178.4	-54.6	-92.5	0	0	0	111.1	L83 L147 R148	N81-L83 VanDerWaalsContact C-N 3.34Å; N81-L147 WeakPolarHBondContact O-CA 3.12Å; N81-R148 HydrophobicContact CB-CB 4.3Å; N81-R148 PolarHBondContact N-O 3.46Å; N81-R148 PolarHBondContact ND2-O 3.31Å; N81-R148 PolarHBondContact O-N 2.97Å
82	Y	91	Very high	86.1	Confident	127 Å²	127	58.2 Å²	58.2	50%	0.498	28%	0.279	S	S	.	.	S	Bend	trans	64.3	31.9	-178	-42.4	-63.5	0	0	0	114.3	C118 K145 R146 R148	Y82-C118 PolarHBondContact N-O 3.42Å; Y82-K145 VanDerWaalsContact O-CB 3.28Å; Y82-K145 WeakPolarHBondContact O-CB 3.48Å; Y82-K145 VanDerWaalsContact O-CD 3.27Å; Y82-K145 WeakPolarHBondContact O-CD 3.48Å; Y82-R146 WeakPolarHBondContact CB-O 3.2Å; Y82-R146 WeakPolarHBondContact CD2-O 3.37Å; Y82-R148 HydrophobicContact CD2-CB 3.59Å; Y82-R148 HydrophobicContact CE2-CB 3.53Å; Y82-R148 HydrophobicContact CE2-CG 4.33Å
83	L	90.9	Very high	88.5	Confident	0 Å²	0	57 Å²	57	0%	0	27%	0.27	C	S	.	.			trans	-59.6	146.7	170.8	-70.5	164	0	0	0	110.8	I80 N81 Y87 L92 L107 C118 K145 L147	I80-L83 HydrophobicContact CG2-CD1 4.33Å; I80-L83 HydrophobicContact CG2-CD2 3.85Å; I80-L83 HydrophobicContact CG2-CG 4.01Å; N81-L83 VanDerWaalsContact C-N 3.34Å; L83-Y87 HydrophobicContact CD2-CD1 4.01Å; L83-Y87 HydrophobicContact CD2-CE1 4.44Å; L83-L92 HydrophobicContact CD1-CD1 4.04Å; L83-L92 HydrophobicContact CD1-CD2 4.12Å; L83-L92 HydrophobicContact CD2-CD1 3.95Å; L83-L107 HydrophobicContact CD1-CD1 3.61Å; L83-C118 PolarHBondContact N-O 2.98Å; L83-C118 VanDerWaalsContact O-CB 3.27Å; L83-C118 WeakPolarHBondContact O-CB 3.41Å; L83-C118 PolarHBondContact O-SG 2.96Å; L83-K145 WeakPolarHBondContact O-CD 3.25Å; L83-K145 PolarHBondContact O-NZ 2.83Å; L83-L147 HydrophobicContact CD2-CD1 4.36Å; L83-L147 HydrophobicContact CD2-CD2 3.78Å; L83-L147 HydrophobicContact CG-CD2 4.33Å
84	P	89.1	Confident	90.6	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.264	C	S	.	.			trans	-55.9	154.5	166	-26.4	37.7	0	0	0	111.5	S86 Y87 T142 E143	P84-S86 VanDerWaalsContact C-N 3.31Å; P84-S86 WeakPolarHBondContact CB-OG 3.35Å; P84-Y87 HydrophobicContact CB-CD2 3.65Å; P84-Y87 HydrophobicContact CB-CE2 4.05Å; P84-Y87 HydrophobicContact CB-CG 4.35Å; P84-Y87 HydrophobicContact CG-CD2 3.68Å; P84-Y87 HydrophobicContact CG-CE2 3.62Å; P84-Y87 HydrophobicContact CG-CG 4.36Å; P84-T142 HydrophobicContact CG-CG2 3.76Å; P84-E143 HydrophobicContact CB-CB 3.92Å; P84-E143 HydrophobicContact CB-CG 4.2Å; P84-E143 WeakPolarHBondContact CB-OE2 3.49Å; P84-E143 HydrophobicContact CG-CB 3.86Å; P84-E143 HydrophobicContact CG-CG 4.27Å
85	Q	88.3	Confident	92.2	Very high	127 Å²	127	53.2 Å²	53.2	59%	0.593	25%	0.248	S	C	*	.	S	Bend	trans	-84.5	-13.5	-176	-158.1	155.9	-10.3	0	0	112.5
86	S	91	Very high	92.9	Very high	68 Å²	68	45.6 Å²	45.6	48%	0.476	22%	0.219	S	C	.	.	S	Bend	trans	-67.2	-40.6	166.2	53.3	0	0	0	0	113.4	P84 D88 E143	P84-S86 VanDerWaalsContact C-N 3.31Å; P84-S86 WeakPolarHBondContact CB-OG 3.35Å; S86-D88 PolarHBondContact O-N 2.92Å; S86-E143 WeakPolarHBondContact CB-OE1 3.41Å; S86-E143 PolarHBondContact OG-OE1 3.44Å; S86-E143 PolarHBondContact OG-OE2 3.05Å
87	Y	90.4	Very high	93.2	Very high	32 Å²	32	49.5 Å²	49.5	13%	0.125	24%	0.237	C	C	.	.			trans	-58.2	126.3	-171	-91.2	-134.4	0	0	0	111.7	L83 P84 D91 L95 L107 T142	L83-Y87 HydrophobicContact CD2-CD1 4.01Å; L83-Y87 HydrophobicContact CD2-CE1 4.44Å; P84-Y87 HydrophobicContact CB-CD2 3.65Å; P84-Y87 HydrophobicContact CB-CE2 4.05Å; P84-Y87 HydrophobicContact CB-CG 4.35Å; P84-Y87 HydrophobicContact CG-CD2 3.68Å; P84-Y87 HydrophobicContact CG-CE2 3.62Å; P84-Y87 HydrophobicContact CG-CG 4.36Å; Y87-D91 HydrophobicContact CD1-CB 3.92Å; Y87-D91 HydrophobicContact CE1-CB 4.42Å; Y87-D91 HydrophobicContact CG-CB 4.09Å; Y87-L95 HydrophobicContact CE1-CD2 4.29Å; Y87-L107 WeakPolarHBondContact O-CD2 3.48Å; Y87-T142 PolarHBondContact OH-OG1 2.95Å
88	D	92.7	Very high	93.2	Very high	48 Å²	48	56.2 Å²	56.2	26%	0.257	26%	0.258	S	S	.	.			trans	-90.6	-172.6	168.9	89.1	-4.3	0	0	0	112.1	S86 N90 D91 L92	S86-D88 PolarHBondContact O-N 2.92Å; D88-N90 VanDerWaalsContact OD1-CA 3.23Å; D88-N90 WeakPolarHBondContact OD1-CA 3.36Å; D88-N90 WeakPolarHBondContact OD1-CB 3.15Å; D88-N90 PolarHBondContact OD1-N 3.46Å; D88-N90 PolarHBondContact OD2-ND2 3.4Å; D88-D91 PolarHBondContact N-OD2 2.83Å; D88-D91 PolarHBondContact OD1-N 3.38Å; D88-L92 PolarHBondContact O-N 3.21Å
89	Q	93	Very high	93.1	Very high	80 Å²	80	57.1 Å²	57.1	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-75	-26.7	178.9	-171.3	173	-70.4	0	0	112.9	Q93 C105 L107	Q89-Q93 WeakPolarHBondContact O-CB 3.29Å; Q89-Q93 PolarHBondContact O-N 2.91Å; Q89-C105 PolarHBondContact NE2-O 3.1Å; Q89-L107 HydrophobicContact CB-CB 4.05Å; Q89-L107 HydrophobicContact CG-CB 4.39Å
90	N	94.8	Very high	92.9	Very high	85 Å²	85	56 Å²	56	46%	0.455	26%	0.262	S	S	.	.	H	α-helix	trans	-73.6	-36.5	175.9	-52.5	-69.5	0	0	0	110.8	D88 Q93 R94	D88-N90 VanDerWaalsContact OD1-CA 3.23Å; D88-N90 WeakPolarHBondContact OD1-CA 3.36Å; D88-N90 WeakPolarHBondContact OD1-CB 3.15Å; D88-N90 PolarHBondContact OD1-N 3.46Å; D88-N90 PolarHBondContact OD2-ND2 3.4Å; N90-Q93 PolarHBondContact O-N 3.3Å; N90-R94 VanDerWaalsContact O-CB 3.26Å; N90-R94 WeakPolarHBondContact O-CB 3.15Å; N90-R94 VanDerWaalsContact O-CG 3.29Å; N90-R94 WeakPolarHBondContact O-CG 3.46Å; N90-R94 PolarHBondContact O-N 3.46Å
91	D	93.8	Very high	92.8	Very high	46 Å²	46	59.3 Å²	59.3	25%	0.246	28%	0.283	C	S	.	.	H	α-helix	trans	-66.2	-45.6	174.8	-56.4	-39.4	0	0	0	110.8	Y87 D88 Q93 R94 L95	Y87-D91 HydrophobicContact CD1-CB 3.92Å; Y87-D91 HydrophobicContact CE1-CB 4.42Å; Y87-D91 HydrophobicContact CG-CB 4.09Å; D88-D91 PolarHBondContact N-OD2 2.83Å; D88-D91 PolarHBondContact OD1-N 3.38Å; D91-Q93 VanDerWaalsContact C-N 3.33Å; D91-Q93 PolarHBondContact O-N 2.85Å; D91-R94 PolarHBondContact O-N 3.46Å; D91-R94 IonicContact OD1-CZ 3.67Å; D91-R94 VanDerWaalsContact OD1-CZ 3.24Å; D91-R94 IonicContact OD1-NH1 3.44Å; D91-R94 PolarHBondContact OD1-NH1 2.87Å; D91-R94 IonicContact OD1-NH2 2.73Å; D91-R94 PolarHBondContact OD1-NH2 2.8Å; D91-L95 WeakPolarHBondContact O-CB 3.45Å; D91-L95 PolarHBondContact O-N 2.98Å
92	L	93.8	Very high	92.8	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.9	-42.5	171.9	179.9	61.6	0	0	0	111.8	I80 L83 D88 F96 L107 V122	I80-L92 HydrophobicContact CB-CD1 4.3Å; I80-L92 HydrophobicContact CG1-CD1 4.22Å; I80-L92 HydrophobicContact CG2-CD1 4.28Å; L83-L92 HydrophobicContact CD1-CD1 4.04Å; L83-L92 HydrophobicContact CD1-CD2 4.12Å; L83-L92 HydrophobicContact CD2-CD1 3.95Å; D88-L92 PolarHBondContact O-N 3.21Å; L92-F96 HydrophobicContact CD1-CD2 3.85Å; L92-F96 HydrophobicContact CD1-CE2 3.84Å; L92-F96 WeakPolarHBondContact O-CD2 3.39Å; L92-F96 PolarHBondContact O-N 2.9Å; L92-L107 HydrophobicContact CD2-CD1 4.3Å; L92-V122 HydrophobicContact CD1-CG2 4.32Å; L92-V122 HydrophobicContact CD2-CG2 4.41Å; L92-V122 HydrophobicContact CG-CG2 4.14Å
93	Q	95.7	Very high	92.8	Very high	62 Å²	62	59.5 Å²	59.5	29%	0.29	28%	0.282	S	S	.	.	H	α-helix	trans	-65.3	-53.2	175.7	-175.4	170.6	-25.2	0	0	111.5	Q89 N90 D91 L95 F96 E97 I102 C105	Q89-Q93 WeakPolarHBondContact O-CB 3.29Å; Q89-Q93 PolarHBondContact O-N 2.91Å; N90-Q93 PolarHBondContact O-N 3.3Å; D91-Q93 VanDerWaalsContact C-N 3.33Å; D91-Q93 PolarHBondContact O-N 2.85Å; Q93-L95 PolarHBondContact O-N 3.4Å; Q93-L95 VanDerWaalsContact O-N 3.11Å; Q93-F96 PolarHBondContact O-N 3.15Å; Q93-F96 VanDerWaalsContact O-N 3.1Å; Q93-E97 PolarHBondContact NE2-OE1 2.83Å; Q93-E97 VanDerWaalsContact NE2-OE1 3.08Å; Q93-E97 PolarHBondContact NE2-OE2 3.15Å; Q93-E97 WeakPolarHBondContact O-CB 3.15Å; Q93-E97 PolarHBondContact O-N 3.1Å; Q93-I102 HydrophobicContact CG-CD1 4.13Å; Q93-C105 HydrophobicContact CB-CB 4.08Å; Q93-C105 HydrophobicContact CG-CB 4.37Å
94	R	94.7	Very high	92.9	Very high	136 Å²	136	65.4 Å²	65.4	51%	0.513	31%	0.309	S	S	.	.	H	α-helix	trans	-59.4	-23.2	-179.6	-77.6	-172.7	-103.3	102.7	1.2	113.9	N90 D91 R98	N90-R94 VanDerWaalsContact O-CB 3.26Å; N90-R94 WeakPolarHBondContact O-CB 3.15Å; N90-R94 VanDerWaalsContact O-CG 3.29Å; N90-R94 WeakPolarHBondContact O-CG 3.46Å; N90-R94 PolarHBondContact O-N 3.46Å; D91-R94 PolarHBondContact O-N 3.46Å; D91-R94 IonicContact OD1-CZ 3.67Å; D91-R94 VanDerWaalsContact OD1-CZ 3.24Å; D91-R94 IonicContact OD1-NH1 3.44Å; D91-R94 PolarHBondContact OD1-NH1 2.87Å; D91-R94 IonicContact OD1-NH2 2.73Å; D91-R94 PolarHBondContact OD1-NH2 2.8Å; R94-R98 WeakPolarHBondContact O-CG 3.35Å; R94-R98 PolarHBondContact O-NE 3.12Å
95	L	93.9	Very high	93.2	Very high	11 Å²	11	66 Å²	66	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-75.8	-52.7	172.3	-174.3	62.4	0	0	0	111.3	Y87 D91 Q93 Y137 Y140 L147	Y87-L95 HydrophobicContact CE1-CD2 4.29Å; D91-L95 WeakPolarHBondContact O-CB 3.45Å; D91-L95 PolarHBondContact O-N 2.98Å; Q93-L95 PolarHBondContact O-N 3.4Å; Q93-L95 VanDerWaalsContact O-N 3.11Å; L95-Y137 HydrophobicContact CD1-CD1 4.27Å; L95-Y137 HydrophobicContact CD1-CE1 3.55Å; L95-Y137 HydrophobicContact CD1-CE2 4.38Å; L95-Y137 HydrophobicContact CG-CD1 4.4Å; L95-Y137 HydrophobicContact CG-CE1 4.03Å; L95-Y137 HydrophobicContact CG-CE2 4.2Å; L95-Y137 WeakPolarHBondContact O-CE2 3.35Å; L95-Y137 PolarHBondContact O-OH 2.85Å; L95-Y140 HydrophobicContact CD1-CE1 4.37Å; L95-L147 HydrophobicContact CD2-CD1 3.73Å
96	F	95.7	Very high	93.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-80.9	-26.4	-173.2	-79.1	-98.3	0	0	0	114.2	L78 I80 L92 Q93 R98 V99 I102 V122 F124 A133 Y137 V149	L78-F96 HydrophobicContact CD1-CE1 4.42Å; I80-F96 HydrophobicContact CB-CZ 4.45Å; I80-F96 HydrophobicContact CD1-CE1 4.37Å; I80-F96 HydrophobicContact CD1-CZ 4.31Å; I80-F96 HydrophobicContact CG1-CE1 3.88Å; I80-F96 HydrophobicContact CG1-CE2 3.75Å; I80-F96 HydrophobicContact CG1-CZ 3.39Å; I80-F96 HydrophobicContact CG2-CE2 4.2Å; I80-F96 HydrophobicContact CG2-CZ 4.13Å; L92-F96 HydrophobicContact CD1-CD2 3.85Å; L92-F96 HydrophobicContact CD1-CE2 3.84Å; L92-F96 WeakPolarHBondContact O-CD2 3.39Å; L92-F96 PolarHBondContact O-N 2.9Å; Q93-F96 PolarHBondContact O-N 3.15Å; Q93-F96 VanDerWaalsContact O-N 3.1Å; F96-R98 PolarHBondContact O-N 3.1Å; F96-R98 VanDerWaalsContact O-N 3.17Å; F96-V99 WeakPolarHBondContact O-CB 3.17Å; F96-V99 PolarHBondContact O-N 3.2Å; F96-I102 HydrophobicContact CB-CD1 3.82Å; F96-V122 HydrophobicContact CB-CG1 4.06Å; F96-V122 HydrophobicContact CB-CG2 4.31Å; F96-V122 HydrophobicContact CD2-CG2 4.45Å; F96-V122 HydrophobicContact CG-CG1 4.48Å; F96-V122 HydrophobicContact CG-CG2 4.2Å; F96-F124 HydrophobicContact CB-CZ 4.01Å; F96-F124 HydrophobicContact CD1-CE2 4.16Å; F96-F124 HydrophobicContact CD1-CZ 4.08Å; F96-F124 WeakPolarHBondContact O-CE1 3.44Å; F96-F124 WeakPolarHBondContact O-CZ 3.47Å; F96-A133 HydrophobicContact CD1-CB 3.91Å; F96-A133 HydrophobicContact CE1-CB 4.1Å; F96-Y137 HydrophobicContact CD1-CD2 4.11Å; F96-Y137 AromaticContact CE1-CD2 3.86Å; F96-Y137 HydrophobicContact CE1-CD2 3.86Å; F96-Y137 HydrophobicContact CE1-CG 4.39Å; F96-Y137 HydrophobicContact CE2-CD2 4.4Å; F96-Y137 HydrophobicContact CG-CD2 4.47Å; F96-Y137 HydrophobicContact CZ-CD2 4Å; F96-Y137 HydrophobicContact CZ-CG 4.18Å; F96-V149 HydrophobicContact CE1-CG1 3.94Å; F96-V149 HydrophobicContact CE1-CG2 4.11Å; F96-V149 HydrophobicContact CZ-CG1 4.32Å; F96-V149 HydrophobicContact CZ-CG2 3.71Å
97	E	95.2	Very high	93.6	Very high	90 Å²	90	62.3 Å²	62.3	42%	0.421	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-64.3	-20	178.9	-165.7	157.9	-125.4	0	0	112.4	Q93 V99 G100 I102	Q93-E97 PolarHBondContact NE2-OE1 2.83Å; Q93-E97 VanDerWaalsContact NE2-OE1 3.08Å; Q93-E97 PolarHBondContact NE2-OE2 3.15Å; Q93-E97 WeakPolarHBondContact O-CB 3.15Å; Q93-E97 PolarHBondContact O-N 3.1Å; E97-V99 PolarHBondContact O-N 2.97Å; E97-G100 PolarHBondContact O-N 2.92Å; E97-I102 HydrophobicContact CB-CD1 3.98Å
98	R	92.9	Very high	93.8	Very high	192 Å²	192	62.3 Å²	62.3	73%	0.725	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-62.4	-22.1	170.4	-62.1	175.4	-177.6	-154.5	-3.2	113.7	R94 F96	R94-R98 WeakPolarHBondContact O-CG 3.35Å; R94-R98 PolarHBondContact O-NE 3.12Å; F96-R98 PolarHBondContact O-N 3.1Å; F96-R98 VanDerWaalsContact O-N 3.17Å
99	V	93.8	Very high	93.8	Very high	20 Å²	20	65.6 Å²	65.6	12%	0.121	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-89.3	-23.3	178.8	-167.5	0	0	0	0	111.6	F96 E97 F124 H129 L132 A133 Y137	F96-V99 WeakPolarHBondContact O-CB 3.17Å; F96-V99 PolarHBondContact O-N 3.2Å; E97-V99 PolarHBondContact O-N 2.97Å; V99-F124 HydrophobicContact CB-CE1 4.18Å; V99-F124 HydrophobicContact CB-CZ 4.2Å; V99-H129 HydrophobicContact CG1-CB 4.44Å; V99-H129 WeakPolarHBondContact CG1-O 3.27Å; V99-L132 HydrophobicContact CG1-CB 3.75Å; V99-L132 HydrophobicContact CG1-CD2 3.75Å; V99-L132 HydrophobicContact CG1-CG 3.66Å; V99-A133 HydrophobicContact CB-CB 4.25Å; V99-A133 HydrophobicContact CG1-CB 4.02Å; V99-A133 HydrophobicContact CG2-CB 4.04Å; V99-Y137 HydrophobicContact CG2-CD2 4.13Å; V99-Y137 HydrophobicContact CG2-CE2 3.63Å
100	G	90.7	Very high	93.4	Very high	13 Å²	13	64.2 Å²	64.2	13%	0.134	29%	0.293	C	S	.	.	S	Bend	trans	153.6	174.1	178.2	0	0	0	0	0	112.8	E97 I102 F124	E97-G100 PolarHBondContact O-N 2.92Å; G100-I102 PolarHBondContact O-N 3.29Å; G100-F124 WeakPolarHBondContact O-CE1 3.49Å
101	P	93.4	Very high	92.8	Very high	70 Å²	70	69.6 Å²	69.6	46%	0.455	31%	0.312	S	S	.	.			trans	-59	128.8	-176.9	21.7	-34.7	0	0	0	113.3	V125	P101-V125 HydrophobicContact CB-CB 4.4Å; P101-V125 HydrophobicContact CB-CG2 4Å; P101-V125 HydrophobicContact CG-CB 4.29Å; P101-V125 HydrophobicContact CG-CG2 4.43Å; P101-V125 WeakPolarHBondContact O-CG2 3.5Å; P101-V125 PolarHBondContact O-N 2.91Å
102	I	94	Very high	92.1	Very high	25 Å²	25	74.6 Å²	74.6	13%	0.128	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	135.5	175.9	-67.7	172	0	0	0	109.3	Q93 F96 E97 G100 Q104 C105 V122 F124	Q93-I102 HydrophobicContact CG-CD1 4.13Å; F96-I102 HydrophobicContact CB-CD1 3.82Å; E97-I102 HydrophobicContact CB-CD1 3.98Å; G100-I102 PolarHBondContact O-N 3.29Å; I102-Q104 WeakPolarHBondContact CG2-O 3.47Å; I102-C105 HydrophobicContact CG2-CB 4.25Å; I102-V122 HydrophobicContact CB-CG1 4.49Å; I102-V122 HydrophobicContact CD1-CG1 3.64Å; I102-V122 HydrophobicContact CG1-CG1 3.71Å; I102-V122 HydrophobicContact CG2-CG1 4.01Å; I102-F124 HydrophobicContact CG1-CD1 4.15Å; I102-F124 HydrophobicContact CG1-CE1 3.95Å; I102-F124 HydrophobicContact CG1-CZ 4.43Å
103	R	92	Very high	91.8	Very high	145 Å²	145	79.5 Å²	79.5	55%	0.547	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-38.8	171	-166.5	-165.9	-52	-94.4	-7.2	111.6	D123 V125	R103-D123 WeakPolarHBondContact CA-O 3.32Å; R103-D123 WeakPolarHBondContact CB-O 3.37Å; R103-D123 WeakPolarHBondContact CD-OD2 3.41Å; R103-D123 PolarHBondContact N-O 3.04Å; R103-D123 IonicContact NE-OD2 3.82Å; R103-D123 PolarHBondContact NE-OD2 3.3Å; R103-D123 VanDerWaalsContact NE-OD2 3.15Å; R103-V125 HydrophobicContact CB-CG2 4.17Å; R103-V125 PolarHBondContact NH2-O 2.86Å
104	Q	92	Very high	91.2	Very high	124 Å²	124	78.3 Å²	78.3	58%	0.579	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152	129.1	175.2	-174.4	171.7	18	0	0	111.5	I102 V122 D123	I102-Q104 WeakPolarHBondContact CG2-O 3.47Å; Q104-V122 CarbonylContact O-C 3.48Å; Q104-V122 WeakPolarHBondContact O-CA 3.48Å; Q104-D123 HydrophobicContact CB-CB 4.32Å; Q104-D123 PolarHBondContact N-O 2.89Å; Q104-D123 VanDerWaalsContact N-O 3.15Å; Q104-D123 PolarHBondContact O-N 3.24Å
105	C	94.5	Very high	90.6	Very high	12 Å²	12	73.5 Å²	73.5	8%	0.081	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	139.9	164.1	-178.4	0	0	0	0	109.2	Q89 Q93 I102 F121	Q89-C105 PolarHBondContact NE2-O 3.1Å; Q93-C105 HydrophobicContact CB-CB 4.08Å; Q93-C105 HydrophobicContact CG-CB 4.37Å; I102-C105 HydrophobicContact CG2-CB 4.25Å; C105-F121 CarbonylContact C-O 3.58Å; C105-F121 WeakPolarHBondContact CA-O 3.45Å
106	K	94.5	Very high	90.3	Very high	110 Å²	110	73.3 Å²	73.3	48%	0.478	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	115.2	171.6	-169.6	176.2	-179	175	0	112.7	I108 G120 F121	K106-I108 HydrophobicContact CD-CD1 4.04Å; K106-I108 HydrophobicContact CG-CD1 4.08Å; K106-G120 CarbonylContact O-C 3.6Å; K106-G120 WeakPolarHBondContact O-CA 3.35Å; K106-F121 PolarHBondContact N-O 3.45Å; K106-F121 PolarHBondContact O-N 3.45Å
107	L	94	Very high	90	Very high	8 Å²	8	77.4 Å²	77.4	4%	0.042	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	137.4	166.5	-170.1	76.7	0	0	0	109.1	L83 Y87 Q89 L92 R109	L83-L107 HydrophobicContact CD1-CD1 3.61Å; Y87-L107 WeakPolarHBondContact O-CD2 3.48Å; Q89-L107 HydrophobicContact CB-CB 4.05Å; Q89-L107 HydrophobicContact CG-CB 4.39Å; L92-L107 HydrophobicContact CD2-CD1 4.3Å; L107-R109 HydrophobicContact CD2-CG 4.4Å
108	I	93.9	Very high	89.8	Confident	31 Å²	31	74.1 Å²	74.1	16%	0.159	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.5	174.7	-51.3	-56.9	0	0	0	109.9	K106 L117 Y119 F121	K106-I108 HydrophobicContact CD-CD1 4.04Å; K106-I108 HydrophobicContact CG-CD1 4.08Å; I108-L117 HydrophobicContact CG2-CD1 4.18Å; I108-L117 PolarHBondContact O-N 3.34Å; I108-Y119 HydrophobicContact CB-CD1 4.48Å; I108-Y119 HydrophobicContact CB-CD2 4.26Å; I108-Y119 HydrophobicContact CB-CE1 4.11Å; I108-Y119 HydrophobicContact CB-CE2 3.88Å; I108-Y119 HydrophobicContact CG1-CD2 3.97Å; I108-Y119 HydrophobicContact CG1-CE2 3.56Å; I108-Y119 HydrophobicContact CG2-CE1 4.15Å; I108-Y119 HydrophobicContact CG2-CE2 4.25Å; I108-Y119 PolarHBondContact N-O 2.8Å; I108-F121 HydrophobicContact CD1-CD2 3.96Å; I108-F121 HydrophobicContact CD1-CE2 4.06Å; I108-F121 HydrophobicContact CG1-CD2 3.95Å; I108-F121 HydrophobicContact CG1-CE2 3.83Å
109	R	92.9	Very high	89.9	Confident	118 Å²	118	68.6 Å²	68.6	45%	0.445	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.3	179	-70.2	172.6	176.1	-84.2	-4.5	110	L107 G114 A115	L107-R109 HydrophobicContact CD2-CG 4.4Å; R109-G114 VanDerWaalsContact CD-O 3.31Å; R109-G114 WeakPolarHBondContact CD-O 3.3Å; R109-G114 WeakPolarHBondContact CG-O 3.48Å; R109-G114 PolarHBondContact NH1-O 3.48Å; R109-A115 CarbonylContact C-O 3.45Å; R109-A115 WeakPolarHBondContact CA-O 3.49Å; R109-A115 WeakPolarHBondContact CB-O 3.46Å
110	D	85.3	Confident	89.9	Confident	50 Å²	50	67.6 Å²	67.6	27%	0.267	34%	0.344	S	S	.	.			trans	-64.3	141.9	168.3	172	35.9	0	0	0	109.7	N112 T113 G114 A115 L117	D110-N112 VanDerWaalsContact C-N 3.34Å; D110-N112 PolarHBondContact OD1-N 2.79Å; D110-N112 PolarHBondContact OD2-N 2.87Å; D110-T113 WeakPolarHBondContact CB-OG1 3.48Å; D110-T113 WeakPolarHBondContact OD2-CB 3.42Å; D110-T113 WeakPolarHBondContact OD2-CG2 3.44Å; D110-T113 PolarHBondContact OD2-N 2.78Å; D110-T113 PolarHBondContact OD2-OG1 3.41Å; D110-G114 VanDerWaalsContact O-CA 3.29Å; D110-G114 WeakPolarHBondContact O-CA 3.24Å; D110-G114 PolarHBondContact O-N 3.04Å; D110-G114 VanDerWaalsContact O-N 3.09Å; D110-A115 PolarHBondContact N-O 3.19Å; D110-L117 HydrophobicContact CB-CD2 4.11Å; D110-L117 HydrophobicContact CB-CG 4.3Å
111	K	83.1	Confident	90.2	Very high	198 Å²	198	70 Å²	70	86%	0.861	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-27.7	-179.4	-65.6	-178.4	-179.3	177.6	0	112.6
112	N	79.1	Confident	90.3	Very high	151 Å²	151	66.7 Å²	66.7	81%	0.807	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-45.3	-172.5	-62.8	1.9	0	0	0	111.1	D110	D110-N112 VanDerWaalsContact C-N 3.34Å; D110-N112 PolarHBondContact OD1-N 2.79Å; D110-N112 PolarHBondContact OD2-N 2.87Å
113	T	86.2	Confident	90.3	Very high	104 Å²	104	66.6 Å²	66.6	64%	0.638	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-15.4	-177.5	60.9	0	0	0	0	114.5	D110 A115	D110-T113 WeakPolarHBondContact CB-OG1 3.48Å; D110-T113 WeakPolarHBondContact OD2-CB 3.42Å; D110-T113 WeakPolarHBondContact OD2-CG2 3.44Å; D110-T113 PolarHBondContact OD2-N 2.78Å; D110-T113 PolarHBondContact OD2-OG1 3.41Å; T113-A115 PolarHBondContact O-N 3.25Å; T113-A115 VanDerWaalsContact O-N 3.1Å; T113-A115 WeakPolarHBondContact OG1-CB 3.44Å; T113-A115 PolarHBondContact OG1-N 3.34Å
114	G	82.7	Confident	90.5	Very high	36 Å²	36	59.7 Å²	59.7	37%	0.371	30%	0.303	S	S	.	.			trans	68.7	-1.6	-172.5	0	0	0	0	0	114.9	R109 D110	R109-G114 VanDerWaalsContact CD-O 3.31Å; R109-G114 WeakPolarHBondContact CD-O 3.3Å; R109-G114 WeakPolarHBondContact CG-O 3.48Å; R109-G114 PolarHBondContact NH1-O 3.48Å; D110-G114 VanDerWaalsContact O-CA 3.29Å; D110-G114 WeakPolarHBondContact O-CA 3.24Å; D110-G114 PolarHBondContact O-N 3.04Å; D110-G114 VanDerWaalsContact O-N 3.09Å
115	A	82.9	Confident	90.4	Very high	36 Å²	36	56.6 Å²	56.6	30%	0.298	29%	0.292	S	S	.	.			trans	-65	147.2	179.5	0	0	0	0	0	111.7	R109 D110 T113 L117	R109-A115 CarbonylContact C-O 3.45Å; R109-A115 WeakPolarHBondContact CA-O 3.49Å; R109-A115 WeakPolarHBondContact CB-O 3.46Å; D110-A115 PolarHBondContact N-O 3.19Å; T113-A115 PolarHBondContact O-N 3.25Å; T113-A115 VanDerWaalsContact O-N 3.1Å; T113-A115 WeakPolarHBondContact OG1-CB 3.44Å; T113-A115 PolarHBondContact OG1-N 3.34Å; A115-L117 PolarHBondContact O-N 3.29Å
116	S	88.1	Confident	90.2	Very high	6 Å²	6	58.9 Å²	58.9	4%	0.042	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	125.6	172.5	179.6	0	0	0	0	110.1	C118	S116-C118 PolarHBondContact O-N 2.76Å; S116-C118 VanDerWaalsContact O-N 3.16Å; S116-C118 PolarHBondContact OG-N 3.09Å; S116-C118 VanDerWaalsContact OG-N 3.17Å
117	L	88.7	Confident	90	Very high	87 Å²	87	55.7 Å²	55.7	46%	0.455	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	11.8	170.8	-70.6	178	0	0	0	112.2	I108 D110 A115 Y119	I108-L117 HydrophobicContact CG2-CD1 4.18Å; I108-L117 PolarHBondContact O-N 3.34Å; D110-L117 HydrophobicContact CB-CD2 4.11Å; D110-L117 HydrophobicContact CB-CG 4.3Å; A115-L117 PolarHBondContact O-N 3.29Å; L117-Y119 HydrophobicContact CB-CD1 3.85Å; L117-Y119 HydrophobicContact CB-CE1 3.71Å; L117-Y119 HydrophobicContact CD1-CE1 4.2Å; L117-Y119 WeakPolarHBondContact O-CD1 3.49Å; L117-Y119 PolarHBondContact O-N 3.27Å
118	C	90.3	Very high	89.8	Confident	21 Å²	21	62.3 Å²	62.3	14%	0.142	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	60.9	25	177.5	-60.1	0	0	0	0	114.1	Y82 L83 S116 K145	Y82-C118 PolarHBondContact N-O 3.42Å; L83-C118 PolarHBondContact N-O 2.98Å; L83-C118 VanDerWaalsContact O-CB 3.27Å; L83-C118 WeakPolarHBondContact O-CB 3.41Å; L83-C118 PolarHBondContact O-SG 2.96Å; S116-C118 PolarHBondContact O-N 2.76Å; S116-C118 VanDerWaalsContact O-N 3.16Å; S116-C118 PolarHBondContact OG-N 3.09Å; S116-C118 VanDerWaalsContact OG-N 3.17Å; C118-K145 PolarHBondContact SG-NZ 2.85Å
119	Y	95.2	Very high	89.9	Confident	75 Å²	75	62.8 Å²	62.8	29%	0.294	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	159.6	167.9	77.1	-83.2	0	0	0	112.3	I79 I80 I108 L117 F121	I79-Y119 HydrophobicContact CD1-CD2 4.14Å; I79-Y119 HydrophobicContact CG1-CD2 4.38Å; I80-Y119 CarbonylContact O-C 3.58Å; I80-Y119 WeakPolarHBondContact O-CA 3.47Å; I80-Y119 VanDerWaalsContact O-CB 3.31Å; I80-Y119 WeakPolarHBondContact O-CB 3.28Å; I108-Y119 HydrophobicContact CB-CD1 4.48Å; I108-Y119 HydrophobicContact CB-CD2 4.26Å; I108-Y119 HydrophobicContact CB-CE1 4.11Å; I108-Y119 HydrophobicContact CB-CE2 3.88Å; I108-Y119 HydrophobicContact CG1-CD2 3.97Å; I108-Y119 HydrophobicContact CG1-CE2 3.56Å; I108-Y119 HydrophobicContact CG2-CE1 4.15Å; I108-Y119 HydrophobicContact CG2-CE2 4.25Å; I108-Y119 PolarHBondContact N-O 2.8Å; L117-Y119 HydrophobicContact CB-CD1 3.85Å; L117-Y119 HydrophobicContact CB-CE1 3.71Å; L117-Y119 HydrophobicContact CD1-CE1 4.2Å; L117-Y119 WeakPolarHBondContact O-CD1 3.49Å; L117-Y119 PolarHBondContact O-N 3.27Å; Y119-F121 HydrophobicContact CD2-CE2 4.24Å; Y119-F121 AromaticContact CE2-CE2 3.86Å; Y119-F121 HydrophobicContact CE2-CE2 3.86Å; Y119-F121 HydrophobicContact CE2-CZ 4.23Å
120	G	94.5	Very high	90	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	174.7	179	0	0	0	0	0	112.6	I80 K106	I80-G120 PolarHBondContact N-O 2.83Å; I80-G120 PolarHBondContact O-N 3.47Å; K106-G120 CarbonylContact O-C 3.6Å; K106-G120 WeakPolarHBondContact O-CA 3.35Å
121	F	96.4	Very high	90.3	Very high	63 Å²	63	56.7 Å²	56.7	28%	0.276	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	142	177.5	-63.8	-87.7	0	0	0	111.1	L78 I79 C105 K106 I108 Y119 A152	L78-F121 CarbonylContact O-C 3.48Å; L78-F121 WeakPolarHBondContact O-CA 3.12Å; I79-F121 HydrophobicContact CB-CD1 3.98Å; I79-F121 HydrophobicContact CB-CE1 3.78Å; I79-F121 HydrophobicContact CD1-CE1 3.84Å; I79-F121 HydrophobicContact CD1-CZ 3.88Å; I79-F121 HydrophobicContact CG1-CD1 4.16Å; I79-F121 HydrophobicContact CG1-CE1 3.75Å; I79-F121 HydrophobicContact CG1-CZ 4.12Å; C105-F121 CarbonylContact C-O 3.58Å; C105-F121 WeakPolarHBondContact CA-O 3.45Å; K106-F121 PolarHBondContact N-O 3.45Å; K106-F121 PolarHBondContact O-N 3.45Å; I108-F121 HydrophobicContact CD1-CD2 3.96Å; I108-F121 HydrophobicContact CD1-CE2 4.06Å; I108-F121 HydrophobicContact CG1-CD2 3.95Å; I108-F121 HydrophobicContact CG1-CE2 3.83Å; Y119-F121 HydrophobicContact CD2-CE2 4.24Å; Y119-F121 AromaticContact CE2-CE2 3.86Å; Y119-F121 HydrophobicContact CE2-CE2 3.86Å; Y119-F121 HydrophobicContact CE2-CZ 4.23Å; F121-A152 HydrophobicContact CD1-CB 3.82Å; F121-A152 HydrophobicContact CE1-CB 3.89Å
122	V	95.8	Very high	90.9	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	110.2	174.2	178.3	0	0	0	0	109	L78 I80 L92 F96 I102 Q104 F124	L78-V122 PolarHBondContact N-O 3.31Å; L78-V122 PolarHBondContact O-N 3.21Å; I80-V122 HydrophobicContact CD1-CB 3.9Å; I80-V122 HydrophobicContact CD1-CG2 3.7Å; L92-V122 HydrophobicContact CD1-CG2 4.32Å; L92-V122 HydrophobicContact CD2-CG2 4.41Å; L92-V122 HydrophobicContact CG-CG2 4.14Å; F96-V122 HydrophobicContact CB-CG1 4.06Å; F96-V122 HydrophobicContact CB-CG2 4.31Å; F96-V122 HydrophobicContact CD2-CG2 4.45Å; F96-V122 HydrophobicContact CG-CG1 4.48Å; F96-V122 HydrophobicContact CG-CG2 4.2Å; I102-V122 HydrophobicContact CB-CG1 4.49Å; I102-V122 HydrophobicContact CD1-CG1 3.64Å; I102-V122 HydrophobicContact CG1-CG1 3.71Å; I102-V122 HydrophobicContact CG2-CG1 4.01Å; Q104-V122 CarbonylContact O-C 3.48Å; Q104-V122 WeakPolarHBondContact O-CA 3.48Å; V122-F124 HydrophobicContact CG1-CD2 4.07Å; V122-F124 HydrophobicContact CG1-CE2 3.74Å; V122-F124 HydrophobicContact CG1-CZ 4.15Å
123	D	95.4	Very high	91.6	Very high	23 Å²	23	43.8 Å²	43.8	12%	0.123	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	117	171.1	-174.1	52.6	0	0	0	109.6	T76 N77 R103 Q104	T76-D123 WeakPolarHBondContact CB-OD1 3.44Å; T76-D123 PolarHBondContact OG1-OD1 3.1Å; N77-D123 HydrophobicContact CB-CB 4.27Å; N77-D123 PolarHBondContact N-OD1 3.47Å; R103-D123 WeakPolarHBondContact CA-O 3.32Å; R103-D123 WeakPolarHBondContact CB-O 3.37Å; R103-D123 WeakPolarHBondContact CD-OD2 3.41Å; R103-D123 PolarHBondContact N-O 3.04Å; R103-D123 IonicContact NE-OD2 3.82Å; R103-D123 PolarHBondContact NE-OD2 3.3Å; R103-D123 VanDerWaalsContact NE-OD2 3.15Å; Q104-D123 HydrophobicContact CB-CB 4.32Å; Q104-D123 PolarHBondContact N-O 2.89Å; Q104-D123 VanDerWaalsContact N-O 3.15Å; Q104-D123 PolarHBondContact O-N 3.24Å
124	F	95.6	Very high	92	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	157.1	176.5	-78.9	-87.1	0	0	0	112.1	T76 L78 F96 V99 G100 I102 V122 N126 H129 A130 A133	T76-F124 WeakPolarHBondContact CB-O 3.41Å; T76-F124 PolarHBondContact O-N 3.25Å; L78-F124 HydrophobicContact CD1-CD2 4.21Å; L78-F124 HydrophobicContact CD1-CE2 3.78Å; L78-F124 HydrophobicContact CG-CD2 4.48Å; L78-F124 HydrophobicContact CG-CE2 4.48Å; F96-F124 HydrophobicContact CB-CZ 4.01Å; F96-F124 HydrophobicContact CD1-CE2 4.16Å; F96-F124 HydrophobicContact CD1-CZ 4.08Å; F96-F124 WeakPolarHBondContact O-CE1 3.44Å; F96-F124 WeakPolarHBondContact O-CZ 3.47Å; V99-F124 HydrophobicContact CB-CE1 4.18Å; V99-F124 HydrophobicContact CB-CZ 4.2Å; G100-F124 WeakPolarHBondContact O-CE1 3.49Å; I102-F124 HydrophobicContact CG1-CD1 4.15Å; I102-F124 HydrophobicContact CG1-CE1 3.95Å; I102-F124 HydrophobicContact CG1-CZ 4.43Å; V122-F124 HydrophobicContact CG1-CD2 4.07Å; V122-F124 HydrophobicContact CG1-CE2 3.74Å; V122-F124 HydrophobicContact CG1-CZ 4.15Å; F124-N126 VanDerWaalsContact C-N 3.33Å; F124-N126 WeakPolarHBondContact CB-O 3.29Å; F124-H129 HydrophobicContact CB-CB 4.24Å; F124-H129 HydrophobicContact CD1-CB 3.47Å; F124-H129 VanDerWaalsContact CD1-CB 3.47Å; F124-H129 HydrophobicContact CE1-CB 3.93Å; F124-H129 HydrophobicContact CG-CB 3.91Å; F124-A130 HydrophobicContact CB-CB 4.31Å; F124-A130 HydrophobicContact CD2-CB 3.86Å; F124-A130 HydrophobicContact CG-CB 4.39Å; F124-A133 HydrophobicContact CE2-CB 3.64Å; F124-A133 HydrophobicContact CZ-CB 3.69Å
125	V	90.5	Very high	92.5	Very high	59 Å²	59	46 Å²	46	36%	0.358	24%	0.242	S	C	.	.	S	Bend	trans	-67.2	-37.6	171.9	179.2	0	0	0	0	111.1	P101 R103	P101-V125 HydrophobicContact CB-CB 4.4Å; P101-V125 HydrophobicContact CB-CG2 4Å; P101-V125 HydrophobicContact CG-CB 4.29Å; P101-V125 HydrophobicContact CG-CG2 4.43Å; P101-V125 WeakPolarHBondContact O-CG2 3.5Å; P101-V125 PolarHBondContact O-N 2.91Å; R103-V125 HydrophobicContact CB-CG2 4.17Å; R103-V125 PolarHBondContact NH2-O 2.86Å
126	N	88.6	Confident	93	Very high	61 Å²	61	47.6 Å²	47.6	33%	0.326	25%	0.249	S	C	.	.	S	Bend	trans	-118.7	137.7	-179.2	-59.6	-10.7	0	0	0	111.2	F124 Q128 H129	F124-N126 VanDerWaalsContact C-N 3.33Å; F124-N126 WeakPolarHBondContact CB-O 3.29Å; N126-Q128 PolarHBondContact O-N 3.36Å; N126-H129 PolarHBondContact ND2-CE1 2.76Å; N126-H129 VanDerWaalsContact ND2-CE1 3.29Å; N126-H129 PolarHBondContact O-N 3.03Å
127	P	91.1	Very high	93.3	Very high	43 Å²	43	48.2 Å²	48.2	28%	0.279	25%	0.25	S	S	.	.	H	α-helix	trans	-67	-22.4	178.7	27.7	-35	0	0	0	113.2	R75 T76 H129 A130 A131	R75-P127 HydrophobicContact CB-CB 4.02Å; R75-P127 WeakPolarHBondContact O-CA 3.36Å; R75-P127 VanDerWaalsContact O-CB 3.32Å; R75-P127 WeakPolarHBondContact O-CB 3.5Å; T76-P127 HydrophobicContact CG2-CB 4.12Å; P127-H129 VanDerWaalsContact C-N 3.33Å; P127-H129 PolarHBondContact O-N 2.9Å; P127-A130 WeakPolarHBondContact O-CB 3.16Å; P127-A130 PolarHBondContact O-N 2.88Å; P127-A131 PolarHBondContact O-N 3.16Å
128	Q	90.3	Very high	93.4	Very high	146 Å²	146	49 Å²	49	68%	0.682	25%	0.252	S	S	*	.	H	α-helix	trans	-62.2	-38.8	173.9	-67.4	164.2	-12.4	0	0	112.2	N126 L132	N126-Q128 PolarHBondContact O-N 3.36Å; Q128-L132 WeakPolarHBondContact O-CB 3.12Å; Q128-L132 PolarHBondContact O-N 2.66Å
129	H	95.3	Very high	93.3	Very high	41 Å²	41	49.8 Å²	49.8	19%	0.19	26%	0.263	C	S	.	.	H	α-helix	trans	-72.1	-34.5	176.3	-53.9	151.9	0	0	0	111.2	V99 F124 N126 P127 L132 A133	V99-H129 HydrophobicContact CG1-CB 4.44Å; V99-H129 WeakPolarHBondContact CG1-O 3.27Å; F124-H129 HydrophobicContact CB-CB 4.24Å; F124-H129 HydrophobicContact CD1-CB 3.47Å; F124-H129 VanDerWaalsContact CD1-CB 3.47Å; F124-H129 HydrophobicContact CE1-CB 3.93Å; F124-H129 HydrophobicContact CG-CB 3.91Å; N126-H129 PolarHBondContact ND2-CE1 2.76Å; N126-H129 VanDerWaalsContact ND2-CE1 3.29Å; N126-H129 PolarHBondContact O-N 3.03Å; P127-H129 VanDerWaalsContact C-N 3.33Å; P127-H129 PolarHBondContact O-N 2.9Å; H129-L132 PolarHBondContact O-N 3.12Å; H129-A133 WeakPolarHBondContact O-CB 3.48Å; H129-A133 PolarHBondContact O-N 3.08Å
130	A	94.7	Very high	93.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-43.6	174.2	0	0	0	0	0	112	R75 L78 F124 P127 A133 I134 Y151	R75-A130 VanDerWaalsContact O-CB 3.29Å; R75-A130 WeakPolarHBondContact O-CB 3.47Å; L78-A130 HydrophobicContact CD1-CB 4.38Å; L78-A130 HydrophobicContact CD2-CB 3.97Å; L78-A130 HydrophobicContact CG-CB 4.13Å; F124-A130 HydrophobicContact CB-CB 4.31Å; F124-A130 HydrophobicContact CD2-CB 3.86Å; F124-A130 HydrophobicContact CG-CB 4.39Å; P127-A130 WeakPolarHBondContact O-CB 3.16Å; P127-A130 PolarHBondContact O-N 2.88Å; A130-A133 PolarHBondContact O-N 3.24Å; A130-I134 WeakPolarHBondContact O-CG1 3.43Å; A130-I134 PolarHBondContact O-N 2.97Å; A130-Y151 HydrophobicContact CB-CE1 4.11Å
131	A	92.7	Very high	92.9	Very high	40 Å²	40	55.7 Å²	55.7	33%	0.331	29%	0.29	S	S	.	.	H	α-helix	trans	-61	-47.4	173.5	0	0	0	0	0	112.2	P127 A133 I134 Q135 Y151	P127-A131 PolarHBondContact O-N 3.16Å; A131-A133 VanDerWaalsContact C-N 3.3Å; A131-A133 PolarHBondContact O-N 2.88Å; A131-I134 PolarHBondContact O-N 2.74Å; A131-Q135 PolarHBondContact O-N 2.55Å; A131-Y151 WeakPolarHBondContact CA-OH 3.47Å; A131-Y151 WeakPolarHBondContact CB-OH 3.42Å
132	L	94	Very high	92.2	Very high	78 Å²	78	53.9 Å²	53.9	41%	0.408	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-33.7	177.5	-176.2	60.4	0	0	0	112.3	V99 Q128 H129 Q135 T136	V99-L132 HydrophobicContact CG1-CB 3.75Å; V99-L132 HydrophobicContact CG1-CD2 3.75Å; V99-L132 HydrophobicContact CG1-CG 3.66Å; Q128-L132 WeakPolarHBondContact O-CB 3.12Å; Q128-L132 PolarHBondContact O-N 2.66Å; H129-L132 PolarHBondContact O-N 3.12Å; L132-Q135 PolarHBondContact O-N 3.04Å; L132-T136 VanDerWaalsContact O-CB 3.26Å; L132-T136 WeakPolarHBondContact O-CB 3.36Å; L132-T136 PolarHBondContact O-N 3.47Å; L132-T136 PolarHBondContact O-OG1 2.72Å
133	A	95.9	Very high	91.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-72.4	-34.7	177.5	0	0	0	0	0	112.4	L78 F96 V99 F124 H129 A130 A131 Y137	L78-A133 HydrophobicContact CD1-CB 3.79Å; F96-A133 HydrophobicContact CD1-CB 3.91Å; F96-A133 HydrophobicContact CE1-CB 4.1Å; V99-A133 HydrophobicContact CB-CB 4.25Å; V99-A133 HydrophobicContact CG1-CB 4.02Å; V99-A133 HydrophobicContact CG2-CB 4.04Å; F124-A133 HydrophobicContact CE2-CB 3.64Å; F124-A133 HydrophobicContact CZ-CB 3.69Å; H129-A133 WeakPolarHBondContact O-CB 3.48Å; H129-A133 PolarHBondContact O-N 3.08Å; A130-A133 PolarHBondContact O-N 3.24Å; A131-A133 VanDerWaalsContact C-N 3.3Å; A131-A133 PolarHBondContact O-N 2.88Å; A133-Y137 WeakPolarHBondContact O-CB 3.5Å; A133-Y137 PolarHBondContact O-N 2.86Å
134	I	94.3	Very high	90.8	Very high	36 Å²	36	67.3 Å²	67.3	19%	0.185	35%	0.346	C	S	.	.	H	α-helix	trans	-61	-51	166.4	-65.2	166.4	0	0	0	109.2	L78 A130 A131 T136 H138 V149 Y151	L78-I134 HydrophobicContact CD1-CG1 4.22Å; L78-I134 HydrophobicContact CD2-CD1 3.67Å; L78-I134 HydrophobicContact CD2-CG1 3.74Å; A130-I134 WeakPolarHBondContact O-CG1 3.43Å; A130-I134 PolarHBondContact O-N 2.97Å; A131-I134 PolarHBondContact O-N 2.74Å; I134-T136 VanDerWaalsContact C-N 3.25Å; I134-T136 PolarHBondContact O-N 3.05Å; I134-H138 HydrophobicContact CG2-CB 4.31Å; I134-H138 WeakPolarHBondContact O-CB 3.29Å; I134-H138 PolarHBondContact O-N 2.85Å; I134-V149 HydrophobicContact CG1-CG1 3.92Å; I134-Y151 HydrophobicContact CD1-CD1 4.01Å; I134-Y151 HydrophobicContact CD1-CD2 3.64Å; I134-Y151 HydrophobicContact CD1-CE1 3.81Å; I134-Y151 HydrophobicContact CD1-CE2 3.43Å; I134-Y151 VanDerWaalsContact CD1-CE2 3.43Å; I134-Y151 HydrophobicContact CD1-CG 3.92Å
135	Q	93.2	Very high	90.2	Very high	150 Å²	150	70.3 Å²	70.3	70%	0.701	36%	0.359	S	S	*	.	H	α-helix	trans	-62.8	-29.6	-177.7	-170.7	176.4	5.8	0	0	113.6	A131 L132	A131-Q135 PolarHBondContact O-N 2.55Å; L132-Q135 PolarHBondContact O-N 3.04Å
136	T	92.2	Very high	90.2	Very high	70 Å²	70	75.2 Å²	75.2	43%	0.429	37%	0.371	S	S	.	.	H	α-helix	trans	-91.3	-37.2	-177	-54	0	0	0	0	113	L132 I134	L132-T136 VanDerWaalsContact O-CB 3.26Å; L132-T136 WeakPolarHBondContact O-CB 3.36Å; L132-T136 PolarHBondContact O-N 3.47Å; L132-T136 PolarHBondContact O-OG1 2.72Å; I134-T136 VanDerWaalsContact C-N 3.25Å; I134-T136 PolarHBondContact O-N 3.05Å
137	Y	94.6	Very high	90.4	Very high	19 Å²	19	72.4 Å²	72.4	8%	0.075	36%	0.356	C	S	.	.	H	α-helix	trans	-112.9	-6.6	-171.6	-68.5	-54.5	0	0	0	115.3	L95 F96 V99 A133 G139 Y140 V149	L95-Y137 HydrophobicContact CD1-CD1 4.27Å; L95-Y137 HydrophobicContact CD1-CE1 3.55Å; L95-Y137 HydrophobicContact CD1-CE2 4.38Å; L95-Y137 HydrophobicContact CG-CD1 4.4Å; L95-Y137 HydrophobicContact CG-CE1 4.03Å; L95-Y137 HydrophobicContact CG-CE2 4.2Å; L95-Y137 WeakPolarHBondContact O-CE2 3.35Å; L95-Y137 PolarHBondContact O-OH 2.85Å; F96-Y137 HydrophobicContact CD1-CD2 4.11Å; F96-Y137 AromaticContact CE1-CD2 3.86Å; F96-Y137 HydrophobicContact CE1-CD2 3.86Å; F96-Y137 HydrophobicContact CE1-CG 4.39Å; F96-Y137 HydrophobicContact CE2-CD2 4.4Å; F96-Y137 HydrophobicContact CG-CD2 4.47Å; F96-Y137 HydrophobicContact CZ-CD2 4Å; F96-Y137 HydrophobicContact CZ-CG 4.18Å; V99-Y137 HydrophobicContact CG2-CD2 4.13Å; V99-Y137 HydrophobicContact CG2-CE2 3.63Å; A133-Y137 WeakPolarHBondContact O-CB 3.5Å; A133-Y137 PolarHBondContact O-N 2.86Å; Y137-G139 PolarHBondContact O-N 2.9Å; Y137-Y140 HydrophobicContact CD1-CD1 4.21Å; Y137-Y140 AromaticContact CD1-CD2 3.96Å; Y137-Y140 HydrophobicContact CD1-CD2 3.96Å; Y137-Y140 AromaticContact CD1-CG 3.77Å; Y137-Y140 HydrophobicContact CD1-CG 3.77Å; Y137-Y140 HydrophobicContact CE1-CD2 4.16Å; Y137-Y140 HydrophobicContact CE1-CE2 4.32Å; Y137-Y140 HydrophobicContact CE1-CG 4.32Å; Y137-Y140 WeakPolarHBondContact O-CB 3.41Å; Y137-Y140 PolarHBondContact O-N 3.17Å; Y137-V149 WeakPolarHBondContact O-CG2 3.36Å
138	H	91.2	Very high	90.4	Very high	105 Å²	105	75.6 Å²	75.6	49%	0.486	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	114	169.9	-170.8	107.6	0	0	0	110.4	I134 V149	I134-H138 HydrophobicContact CG2-CB 4.31Å; I134-H138 WeakPolarHBondContact O-CB 3.29Å; I134-H138 PolarHBondContact O-N 2.85Å; H138-V149 HydrophobicContact CB-CB 4.35Å; H138-V149 PolarHBondContact ND1-O 2.84Å
139	G	88.8	Confident	90.7	Very high	36 Å²	36	68.6 Å²	68.6	37%	0.371	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	-2.1	-174.7	0	0	0	0	0	114.6	Y137 E141 L147	Y137-G139 PolarHBondContact O-N 2.9Å; G139-E141 PolarHBondContact O-N 2.97Å; G139-L147 PolarHBondContact N-O 3.15Å
140	Y	91	Very high	90.5	Very high	97 Å²	97	68.3 Å²	68.3	38%	0.38	33%	0.334	S	S	.	.			trans	-61.5	131.7	178.7	179.1	-96	0	0	0	111.4	L95 Y137 T142 R146 L147	L95-Y140 HydrophobicContact CD1-CE1 4.37Å; Y137-Y140 HydrophobicContact CD1-CD1 4.21Å; Y137-Y140 AromaticContact CD1-CD2 3.96Å; Y137-Y140 HydrophobicContact CD1-CD2 3.96Å; Y137-Y140 AromaticContact CD1-CG 3.77Å; Y137-Y140 HydrophobicContact CD1-CG 3.77Å; Y137-Y140 HydrophobicContact CE1-CD2 4.16Å; Y137-Y140 HydrophobicContact CE1-CE2 4.32Å; Y137-Y140 HydrophobicContact CE1-CG 4.32Å; Y137-Y140 WeakPolarHBondContact O-CB 3.41Å; Y137-Y140 PolarHBondContact O-N 3.17Å; Y140-T142 HydrophobicContact CD1-CG2 4.28Å; Y140-T142 HydrophobicContact CE1-CG2 4.24Å; Y140-R146 CarbonylContact O-C 3.59Å; Y140-R146 WeakPolarHBondContact O-CA 3.39Å; Y140-L147 HydrophobicContact CD1-CD1 3.99Å; Y140-L147 HydrophobicContact CD1-CG 4.43Å; Y140-L147 PolarHBondContact O-N 2.79Å
141	E	88.7	Confident	90.5	Very high	103 Å²	103	72.5 Å²	72.5	48%	0.481	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.3	-171.2	-161.2	165.6	159.2	0	0	112	G139 K145 R146	G139-E141 PolarHBondContact O-N 2.97Å; E141-K145 CarbonylContact C-O 3.44Å; E141-K145 WeakPolarHBondContact CA-O 3.44Å; E141-R146 HydrophobicContact CB-CG 4.05Å; E141-R146 HydrophobicContact CG-CG 3.88Å; E141-R146 IonicContact OE2-CZ 2.72Å; E141-R146 IonicContact OE2-NE 3.15Å; E141-R146 PolarHBondContact OE2-NE 3.46Å; E141-R146 IonicContact OE2-NH2 2.63Å; E141-R146 PolarHBondContact OE2-NH2 2.94Å
142	T	82.2	Confident	90.2	Very high	24 Å²	24	70.9 Å²	70.9	15%	0.147	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	133.6	-179	180	0	0	0	0	109.7	P84 Y87 Y140 Q144 K145 L147	P84-T142 HydrophobicContact CG-CG2 3.76Å; Y87-T142 PolarHBondContact OH-OG1 2.95Å; Y140-T142 HydrophobicContact CD1-CG2 4.28Å; Y140-T142 HydrophobicContact CE1-CG2 4.24Å; T142-Q144 VanDerWaalsContact C-N 3.3Å; T142-Q144 PolarHBondContact O-N 3.16Å; T142-K145 PolarHBondContact N-O 3.46Å; T142-K145 PolarHBondContact O-N 3.31Å; T142-K145 VanDerWaalsContact O-O 3.11Å; T142-L147 HydrophobicContact CG2-CD1 4.31Å; T142-L147 HydrophobicContact CG2-CD2 4.04Å; T142-L147 HydrophobicContact CG2-CG 4.13Å
143	E	83.8	Confident	89	Confident	114 Å²	114	71.9 Å²	71.9	53%	0.533	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.3	51.8	-173.6	-63.2	-177.6	-149.7	0	0	113.5	P84 S86 K145	P84-E143 HydrophobicContact CB-CB 3.92Å; P84-E143 HydrophobicContact CB-CG 4.2Å; P84-E143 WeakPolarHBondContact CB-OE2 3.49Å; P84-E143 HydrophobicContact CG-CB 3.86Å; P84-E143 HydrophobicContact CG-CG 4.27Å; S86-E143 WeakPolarHBondContact CB-OE1 3.41Å; S86-E143 PolarHBondContact OG-OE1 3.44Å; S86-E143 PolarHBondContact OG-OE2 3.05Å; E143-K145 PolarHBondContact O-N 3.24Å
144	Q	79.2	Confident	87.1	Confident	192 Å²	192	76.5 Å²	76.5	90%	0.897	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	12.4	179.7	-56	176	-18.5	0	0	115.3	T142	T142-Q144 VanDerWaalsContact C-N 3.3Å; T142-Q144 PolarHBondContact O-N 3.16Å
145	K	82.7	Confident	84.3	Confident	63 Å²	63	78.7 Å²	78.7	27%	0.274	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	144.7	172.5	-57.8	-172.1	-168.1	-178.4	0	111.3	Y82 L83 C118 E141 T142 E143	Y82-K145 VanDerWaalsContact O-CB 3.28Å; Y82-K145 WeakPolarHBondContact O-CB 3.48Å; Y82-K145 VanDerWaalsContact O-CD 3.27Å; Y82-K145 WeakPolarHBondContact O-CD 3.48Å; L83-K145 WeakPolarHBondContact O-CD 3.25Å; L83-K145 PolarHBondContact O-NZ 2.83Å; C118-K145 PolarHBondContact SG-NZ 2.85Å; E141-K145 CarbonylContact C-O 3.44Å; E141-K145 WeakPolarHBondContact CA-O 3.44Å; T142-K145 PolarHBondContact N-O 3.46Å; T142-K145 PolarHBondContact O-N 3.31Å; T142-K145 VanDerWaalsContact O-O 3.11Å; E143-K145 PolarHBondContact O-N 3.24Å
146	R	89.9	Confident	81.2	Confident	162 Å²	162	74.9 Å²	74.9	61%	0.611	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.7	172.1	-70.8	-176	177.1	-176.5	-3.6	110.9	Y82 Y140 E141 R148	Y82-R146 WeakPolarHBondContact CB-O 3.2Å; Y82-R146 WeakPolarHBondContact CD2-O 3.37Å; Y140-R146 CarbonylContact O-C 3.59Å; Y140-R146 WeakPolarHBondContact O-CA 3.39Å; E141-R146 HydrophobicContact CB-CG 4.05Å; E141-R146 HydrophobicContact CG-CG 3.88Å; E141-R146 IonicContact OE2-CZ 2.72Å; E141-R146 IonicContact OE2-NE 3.15Å; E141-R146 PolarHBondContact OE2-NE 3.46Å; E141-R146 IonicContact OE2-NH2 2.63Å; E141-R146 PolarHBondContact OE2-NH2 2.94Å; R146-R148 PolarHBondContact O-N 3.19Å
147	L	92.7	Very high	78.1	Confident	1 Å²	1	82.4 Å²	82.4	1%	0.005	44%	0.436	C	S	.	.			trans	-68.2	128.1	-177.6	-56.7	-172.7	0	0	0	111.3	I80 N81 L83 L95 G139 Y140 T142 V149	I80-L147 HydrophobicContact CG2-CB 4.49Å; I80-L147 HydrophobicContact CG2-CD1 4.49Å; N81-L147 WeakPolarHBondContact O-CA 3.12Å; L83-L147 HydrophobicContact CD2-CD1 4.36Å; L83-L147 HydrophobicContact CD2-CD2 3.78Å; L83-L147 HydrophobicContact CG-CD2 4.33Å; L95-L147 HydrophobicContact CD2-CD1 3.73Å; G139-L147 PolarHBondContact N-O 3.15Å; Y140-L147 HydrophobicContact CD1-CD1 3.99Å; Y140-L147 HydrophobicContact CD1-CG 4.43Å; Y140-L147 PolarHBondContact O-N 2.79Å; T142-L147 HydrophobicContact CG2-CD1 4.31Å; T142-L147 HydrophobicContact CG2-CD2 4.04Å; T142-L147 HydrophobicContact CG2-CG 4.13Å; L147-V149 HydrophobicContact CB-CG2 4.49Å
148	R	92.2	Very high	74.8	Confident	110 Å²	110	93 Å²	93	42%	0.415	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	99.1	172	-178.7	-177.6	179.2	-159.1	0.4	109.6	N81 Y82 R146	N81-R148 HydrophobicContact CB-CB 4.3Å; N81-R148 PolarHBondContact N-O 3.46Å; N81-R148 PolarHBondContact ND2-O 3.31Å; N81-R148 PolarHBondContact O-N 2.97Å; Y82-R148 HydrophobicContact CD2-CB 3.59Å; Y82-R148 HydrophobicContact CE2-CB 3.53Å; Y82-R148 HydrophobicContact CE2-CG 4.33Å; R146-R148 PolarHBondContact O-N 3.19Å
149	V	94.6	Very high	71.7	Confident	0 Å²	0	97 Å²	97	0%	0	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130	177.9	-170.6	0	0	0	0	109.7	L78 I79 I80 F96 I134 Y137 H138 L147	L78-V149 HydrophobicContact CB-CG1 4.4Å; L78-V149 HydrophobicContact CD1-CG1 3.72Å; I79-V149 WeakPolarHBondContact O-CA 3.23Å; I80-V149 HydrophobicContact CG1-CG1 4.39Å; I80-V149 HydrophobicContact CG1-CG2 4.34Å; I80-V149 HydrophobicContact CG2-CG2 4.33Å; F96-V149 HydrophobicContact CE1-CG1 3.94Å; F96-V149 HydrophobicContact CE1-CG2 4.11Å; F96-V149 HydrophobicContact CZ-CG1 4.32Å; F96-V149 HydrophobicContact CZ-CG2 3.71Å; I134-V149 HydrophobicContact CG1-CG1 3.92Å; Y137-V149 WeakPolarHBondContact O-CG2 3.36Å; H138-V149 HydrophobicContact CB-CB 4.35Å; H138-V149 PolarHBondContact ND1-O 2.84Å; L147-V149 HydrophobicContact CB-CG2 4.49Å
150	A	92.9	Very high	68.7	Low	34 Å²	34	100.9 Å²	100.9	28%	0.281	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	165.7	175.4	0	0	0	0	0	110.4	L78 I79	L78-A150 CarbonylContact C-O 3.41Å; L78-A150 WeakPolarHBondContact CA-O 3.34Å; I79-A150 HydrophobicContact CG2-CB 4.43Å; I79-A150 PolarHBondContact N-O 3.34Å; I79-A150 PolarHBondContact O-N 3.41Å
151	Y	94	Very high	65.5	Low	89 Å²	89	102.8 Å²	102.8	35%	0.349	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	137.8	169.9	-64	-69.3	0	0	0	111.1	R75 N77 L78 A130 A131 I134	R75-Y151 HydrophobicContact CB-CE1 4.11Å; R75-Y151 WeakPolarHBondContact O-CE1 3.47Å; N77-Y151 WeakPolarHBondContact O-CA 3.35Å; L78-Y151 HydrophobicContact CD2-CD1 3.59Å; L78-Y151 HydrophobicContact CD2-CE1 3.93Å; L78-Y151 HydrophobicContact CD2-CG 4.28Å; A130-Y151 HydrophobicContact CB-CE1 4.11Å; A131-Y151 WeakPolarHBondContact CA-OH 3.47Å; A131-Y151 WeakPolarHBondContact CB-OH 3.42Å; I134-Y151 HydrophobicContact CD1-CD1 4.01Å; I134-Y151 HydrophobicContact CD1-CD2 3.64Å; I134-Y151 HydrophobicContact CD1-CE1 3.81Å; I134-Y151 HydrophobicContact CD1-CE2 3.43Å; I134-Y151 VanDerWaalsContact CD1-CE2 3.43Å; I134-Y151 HydrophobicContact CD1-CG 3.92Å
152	A	86.7	Confident	62.4	Low	6 Å²	6	101 Å²	101	5%	0.05	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-80.4	119.3	177.4	0	0	0	0	0	110.5	N77 I79 F121 S154	N77-A152 HydrophobicContact CB-CB 4.22Å; N77-A152 PolarHBondContact O-N 3.42Å; I79-A152 HydrophobicContact CB-CB 4.25Å; F121-A152 HydrophobicContact CD1-CB 3.82Å; F121-A152 HydrophobicContact CE1-CB 3.89Å; A152-S154 PolarHBondContact O-N 3.26Å
153	S	69	Low	59.9	Low	98 Å²	98	109 Å²	109	69%	0.685	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-54	131.2	171.2	-61.7	0	0	0	0	110.5	G155	S153-G155 PolarHBondContact O-N 3.43Å
154	S	54.5	Low	56.9	Low	98 Å²	98	114.8 Å²	114.8	69%	0.685	60%	0.595	S	S	*	*			trans	-74.7	62.5	-176.3	-69.5	0	0	0	0	113	A152 G156	A152-S154 PolarHBondContact O-N 3.26Å; S154-G156 PolarHBondContact O-N 3.48Å
155	G	36.3	Very low	54.5	Low	82 Å²	82	113.6 Å²	113.6	85%	0.845	59%	0.593	S	S	*	*			trans	-73.7	92.4	-178.2	0	0	0	0	0	112.7	S153	S153-G155 PolarHBondContact O-N 3.43Å
156	G	29	Very low	51.8	Low	69 Å²	69	118 Å²	118	71%	0.711	62%	0.615	S	S	*	*			trans	161.8	54.5	169.9	0	0	0	0	0	119	S154	S154-G156 PolarHBondContact O-N 3.48Å
157	R	25.5	Very low	48.6	Very low	229 Å²	229	116.9 Å²	116.9	86%	0.864	63%	0.626	S	S	*	*			trans	-86.1	109.4	149.1	-71.8	-160.9	-172.8	-147.2	6.1	108.7	F159	R157-F159 PolarHBondContact O-N 2.94Å; R157-F159 VanDerWaalsContact O-N 3.09Å
158	R	25.5	Very low	45.4	Very low	242 Å²	242	125.6 Å²	125.6	91%	0.913	66%	0.664	S	S	*	*			trans	-66.6	102.8	169.5	-72.2	179	175.7	170.9	-2.4	108.9	T160	R158-T160 PolarHBondContact O-N 3.46Å
159	F	26	Very low	42.1	Very low	187 Å²	187	124.9 Å²	124.9	82%	0.82	68%	0.676	S	S	*	*			trans	-83.3	99.6	165.4	-96	-81.2	0	0	0	109.8	R157 P161	R157-F159 PolarHBondContact O-N 2.94Å; R157-F159 VanDerWaalsContact O-N 3.09Å; F159-P161 WeakPolarHBondContact O-CD 3.47Å
160	T	26.3	Very low	39	Very low	119 Å²	119	132.5 Å²	132.5	73%	0.73	72%	0.717	S	S	*	*			trans	-69.7	119.3	160.8	45.4	0	0	0	0	108.6	R158 G162	R158-T160 PolarHBondContact O-N 3.46Å; T160-G162 PolarHBondContact O-N 3.28Å; T160-G162 VanDerWaalsContact O-N 3.12Å
161	P	24.2	Very low	35.8	Very low	136 Å²	136	134.4 Å²	134.4	88%	0.883	74%	0.74	S	S	*	*	S	Bend	trans	-71.2	108.4	-179.7	28.4	-33.2	0	0	0	109.8	F159	F159-P161 WeakPolarHBondContact O-CD 3.47Å
162	G	23.9	Very low	32.7	Very low	67 Å²	67	136.8 Å²	136.8	69%	0.691	76%	0.764	S	S	*	*			trans	-177.5	-2	-174.3	0	0	0	0	0	119.3	T160	T160-G162 PolarHBondContact O-N 3.28Å; T160-G162 VanDerWaalsContact O-N 3.12Å
163	H	29.5	Very low	29.9	Very low	192 Å²	192	144.1 Å²	144.1	89%	0.889	80%	0.802	S	S	*	*			trans	-121.3	111.3	176.5	-98.2	-85.2	0	0	0	113.5
164	R	20.9	Very low	27.8	Very low	235 Å²	235	149.1 Å²	149.1	89%	0.887	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.6	118.5	170.8	-178.8	-168.3	-62.7	169.4	-0.9	109
165	L	28.2	Very low	26.4	Very low	166 Å²	166	150.5 Å²	150.5	87%	0.869	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-103.1	152.5	163.5	-84.5	169.3	0	0	0	110.3
166	Q	26.5	Very low	25.9	Very low	157 Å²	157	149.4 Å²	149.4	73%	0.734	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-91.3	141.9	-158	-69.4	165	-34.1	0	0	112.8	F168	Q166-F168 HydrophobicContact CB-CD2 4.43Å; Q166-F168 HydrophobicContact CB-CE2 4.22Å
167	T	21.7	Very low	25.6	Very low	138 Å²	138	151.2 Å²	151.2	85%	0.847	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-67.1	125.6	163.6	48.3	0	0	0	0	110.2
168	F	26.1	Very low	25.7	Very low	183 Å²	183	147.8 Å²	147.8	80%	0.803	81%	0.81	S	S	*	*			trans	-120.3	125.9	157.8	-85.2	-82.4	0	0	0	109.2	Q166	Q166-F168 HydrophobicContact CB-CD2 4.43Å; Q166-F168 HydrophobicContact CB-CE2 4.22Å
169	S	23.7	Very low	25.6	Very low	95 Å²	95	141.3 Å²	141.3	66%	0.664	80%	0.802	S	S	*	*			trans	-92.6	169.6	177.1	59.5	0	0	0	0	110.9
170	N	28.8	Very low	25.7	Very low	161 Å²	161	136.4 Å²	136.4	86%	0.861	79%	0.791	S	S	*	*			trans	76.4	136.2	178.9	-40.8	-9.5	0	0	0	113
171	G	25.8	Very low	25.8	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	80%	0.796	S	S	*	*			cis	141.3	62.9	-5.5	0	0	0	0	0	113.8
172	T	29.8	Very low	26.3	Very low	139 Å²	139	137.5 Å²	137.5	85%	0.853	78%	0.783	S	S	*	*			trans	-147.8	145.6	170.7	44.3	0	0	0	0	110.8
173	N	26.5	Very low	26.9	Very low	159 Å²	159	138.6 Å²	138.6	85%	0.85	78%	0.776	S	S	*	*			trans	-60.4	141.4	-177.5	-56.8	-29.5	0	0	0	112.8
174	F	25.5	Very low	27.7	Very low	204 Å²	204	134.2 Å²	134.2	90%	0.895	76%	0.759	S	S	*	*			trans	-141.4	117.5	152.5	-121.3	-85.4	0	0	0	110.1
175	S	24.6	Very low	29.1	Very low	126 Å²	126	128.3 Å²	128.3	88%	0.881	74%	0.742	S	S	*	*			trans	-79	125.7	163.2	-178.9	0	0	0	0	107.7
176	G	25.4	Very low	30.5	Very low	60 Å²	60	126.8 Å²	126.8	62%	0.619	74%	0.735	S	S	*	*			trans	-165.6	133.4	-176.5	0	0	0	0	0	111.6	L178	G176-L178 PolarHBondContact O-N 3.29Å
177	S	23.4	Very low	32.5	Very low	106 Å²	106	119.6 Å²	119.6	74%	0.741	70%	0.701	S	S	*	*			trans	-62.7	128.6	178.3	-177.7	0	0	0	0	110.9
178	L	27.3	Very low	35.1	Very low	158 Å²	158	118.8 Å²	118.8	83%	0.827	69%	0.69	S	S	*	*			trans	-119	56	168.9	-90.5	169	0	0	0	111.2	G176 S180	G176-L178 PolarHBondContact O-N 3.29Å; L178-S180 PolarHBondContact O-N 3.19Å
179	S	23.8	Very low	38	Very low	106 Å²	106	110.2 Å²	110.2	74%	0.741	65%	0.654	S	S	*	*			trans	-67.4	65.2	152.9	59	0	0	0	0	110.3
180	S	28.1	Very low	41.3	Very low	84 Å²	84	109.1 Å²	109.1	59%	0.587	64%	0.635	S	S	*	*			trans	-87.3	115.6	168.7	-175.5	0	0	0	0	108.1	L178 V182	L178-S180 PolarHBondContact O-N 3.19Å; S180-V182 PolarHBondContact O-N 3.15Å
181	E	28.3	Very low	44.4	Very low	178 Å²	178	102 Å²	102	83%	0.832	60%	0.596	S	S	*	*			trans	-63.9	104.4	171.1	-65.9	-171.5	127.9	0	0	109.2	T183	E181-T183 VanDerWaalsContact C-N 3.3Å; E181-T183 PolarHBondContact O-N 3.18Å
182	V	34.6	Very low	47.6	Very low	100 Å²	100	98.4 Å²	98.4	61%	0.606	56%	0.56	S	S	*	*			trans	-68.5	95.4	167.9	179.8	0	0	0	0	106.8	S180 N184	S180-V182 PolarHBondContact O-N 3.15Å; V182-N184 PolarHBondContact O-N 2.94Å
183	T	36.6	Very low	50.7	Low	89 Å²	89	94.5 Å²	94.5	55%	0.546	53%	0.533	S	S	.	.			trans	-59.4	126.5	176.8	53.4	0	0	0	0	108.9	E181 E185	E181-T183 VanDerWaalsContact C-N 3.3Å; E181-T183 PolarHBondContact O-N 3.18Å; T183-E185 PolarHBondContact O-N 3.47Å
184	N	45.5	Very low	53.8	Low	100 Å²	100	87 Å²	87	54%	0.535	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	13.4	-170.3	-66.4	-50.3	0	0	0	114.8	V182	V182-N184 PolarHBondContact O-N 2.94Å
185	E	50.3	Low	56.9	Low	111 Å²	111	79.2 Å²	79.2	52%	0.519	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-22.1	-164.5	-54.4	-146	106.8	0	0	114.1	T183 R300	T183-E185 PolarHBondContact O-N 3.47Å; E185-R300 IonicContact OE1-CZ 3.99Å; E185-R300 IonicContact OE1-NH2 3.99Å; E185-R300 PolarHBondContact OE1-NH2 3.04Å
186	N	57.7	Low	59.9	Low	135 Å²	135	73.5 Å²	73.5	72%	0.722	42%	0.423	S	S	*	.	S	Bend	trans	-120	12.6	-170.7	-67.6	-55.1	0	0	0	114.9	I188	N186-I188 PolarHBondContact O-N 3.22Å; N186-I188 VanDerWaalsContact O-N 3.08Å
187	I	68.1	Low	62.9	Low	6 Å²	6	70.6 Å²	70.6	3%	0.031	39%	0.394	C	S	.	.			trans	-76.5	101.7	-178.9	-60.2	172.2	0	0	0	109.5	V218 I264 V298 T299 R300 Y303	I187-V218 HydrophobicContact CD1-CG2 3.92Å; I187-V218 HydrophobicContact CG1-CG2 4.06Å; I187-I264 HydrophobicContact CG2-CD1 3.81Å; I187-V298 HydrophobicContact CG2-CG1 4.03Å; I187-T299 CarbonylContact O-C 3.6Å; I187-R300 PolarHBondContact O-N 2.95Å; I187-Y303 HydrophobicContact CB-CD1 4.47Å; I187-Y303 HydrophobicContact CD1-CD1 3.51Å; I187-Y303 HydrophobicContact CD1-CE1 3.3Å; I187-Y303 HydrophobicContact CD1-CG 4.3Å; I187-Y303 HydrophobicContact CG2-CD1 4.32Å; I187-Y303 HydrophobicContact CG2-CD2 4.22Å; I187-Y303 HydrophobicContact CG2-CG 4.06Å
188	I	76.5	Confident	65.9	Low	120 Å²	120	66.1 Å²	66.1	62%	0.615	36%	0.362	S	S	*	.			trans	-133	128.9	171.3	-57.3	177.4	0	0	0	107.2	N186 V298	N186-I188 PolarHBondContact O-N 3.22Å; N186-I188 VanDerWaalsContact O-N 3.08Å; I188-V298 WeakPolarHBondContact CA-O 3.25Å
189	G	88.6	Confident	68.5	Low	4 Å²	4	61.9 Å²	61.9	4%	0.041	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.2	-154.7	-177.4	0	0	0	0	0	113.4	F265 S297 V298	G189-F265 CarbonylContact C-O 3.58Å; G189-F265 WeakPolarHBondContact CA-O 3.25Å; G189-S297 CarbonylContact O-C 3.5Å; G189-S297 WeakPolarHBondContact O-CA 3.47Å; G189-V298 PolarHBondContact N-O 2.62Å; G189-V298 PolarHBondContact O-N 3.35Å
190	W	92.1	Very high	71.4	Confident	71 Å²	71	63.5 Å²	63.5	27%	0.269	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	112.7	-178.3	-69.5	81.5	0	0	0	109.5	I264 F265 K268 A271 L294 G296	W190-I264 WeakPolarHBondContact O-CA 3.42Å; W190-F265 PolarHBondContact N-O 3.36Å; W190-F265 PolarHBondContact O-N 2.63Å; W190-K268 VanDerWaalsContact CD1-N 3.27Å; W190-K268 HydrophobicContact CD2-CB 3.71Å; W190-K268 HydrophobicContact CD2-CD 4.36Å; W190-K268 HydrophobicContact CD2-CG 3.8Å; W190-K268 HydrophobicContact CE3-CB 4.25Å; W190-K268 HydrophobicContact CE3-CD 4.18Å; W190-K268 HydrophobicContact CE3-CG 3.81Å; W190-K268 HydrophobicContact CG-CB 3.97Å; W190-K268 HydrophobicContact CG-CG 4.43Å; W190-K268 HydrophobicContact CH2-CD 3.67Å; W190-K268 HydrophobicContact CH2-CG 4.18Å; W190-K268 HydrophobicContact CZ2-CB 4.1Å; W190-K268 HydrophobicContact CZ2-CD 3.84Å; W190-K268 HydrophobicContact CZ2-CG 4.17Å; W190-K268 HydrophobicContact CZ3-CD 3.84Å; W190-K268 HydrophobicContact CZ3-CG 4Å; W190-A271 HydrophobicContact CB-CB 3.97Å; W190-L294 HydrophobicContact CB-CD1 4.42Å; W190-L294 HydrophobicContact CE3-CD1 4.48Å; W190-G296 CarbonylContact C-O 3.4Å; W190-G296 WeakPolarHBondContact CA-O 3.17Å
191	E	93.7	Very high	74.2	Confident	11 Å²	11	61.6 Å²	61.6	5%	0.051	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	132.3	-175	-179	169.2	-149.5	0	0	111.7	S262 V263 I264 I295 G296 V298	E191-S262 VanDerWaalsContact OE1-CB 3.3Å; E191-S262 WeakPolarHBondContact OE1-CB 3.14Å; E191-S262 PolarHBondContact OE1-OG 3.5Å; E191-V263 WeakPolarHBondContact CA-O 3.17Å; E191-I264 HydrophobicContact CB-CG1 4.01Å; E191-I264 HydrophobicContact CG-CG1 4.17Å; E191-I295 HydrophobicContact CB-CB 4.42Å; E191-I295 HydrophobicContact CG-CB 4.41Å; E191-I295 HydrophobicContact CG-CG1 4.3Å; E191-I295 PolarHBondContact O-N 3.26Å; E191-G296 PolarHBondContact N-O 2.93Å; E191-V298 HydrophobicContact CB-CG2 3.49Å; E191-V298 VanDerWaalsContact CB-CG2 3.49Å; E191-V298 HydrophobicContact CG-CG2 4.43Å; E191-V298 WeakPolarHBondContact OE2-CG2 3.43Å
192	I	94	Very high	77.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	144.4	159.2	66.9	170.1	0	0	0	108.9	V194 F210 V263 F265 A271 V275 L292 R293 L294	I192-V194 HydrophobicContact CD1-CG2 3.69Å; I192-V194 HydrophobicContact CG1-CG2 3.94Å; I192-F210 HydrophobicContact CD1-CD1 4.04Å; I192-F210 HydrophobicContact CD1-CE1 3.45Å; I192-F210 VanDerWaalsContact CD1-CE1 3.45Å; I192-F210 HydrophobicContact CD1-CZ 3.93Å; I192-V263 HydrophobicContact CD1-CB 4.09Å; I192-V263 HydrophobicContact CD1-CG1 4.41Å; I192-V263 HydrophobicContact CG1-CB 3.7Å; I192-V263 HydrophobicContact CG1-CG1 4.33Å; I192-V263 WeakPolarHBondContact CG1-O 3.32Å; I192-V263 PolarHBondContact N-O 2.95Å; I192-V263 PolarHBondContact O-N 3.32Å; I192-F265 HydrophobicContact CD1-CE2 4.15Å; I192-A271 HydrophobicContact CG2-CB 3.96Å; I192-V275 HydrophobicContact CG2-CG2 3.73Å; I192-L292 HydrophobicContact CD1-CD2 3.96Å; I192-L292 HydrophobicContact CD1-CG 4.39Å; I192-R293 CarbonylContact C-O 3.59Å; I192-R293 VanDerWaalsContact CA-O 3.25Å; I192-R293 WeakPolarHBondContact CA-O 3.26Å; I192-L294 HydrophobicContact CG2-CB 4.46Å; I192-L294 HydrophobicContact CG2-CD1 3.92Å
193	I	93.3	Very high	79.6	Confident	57 Å²	57	55.6 Å²	55.6	29%	0.292	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	137.2	158.5	-71.8	175.7	0	0	0	108.1	T195 A261 L292 R293 I295	I193-T195 HydrophobicContact CG2-CG2 3.89Å; I193-A261 WeakPolarHBondContact CA-O 3.49Å; I193-L292 WeakPolarHBondContact O-CA 3.44Å; I193-R293 PolarHBondContact N-O 2.98Å; I193-R293 PolarHBondContact O-N 3.31Å; I193-I295 HydrophobicContact CB-CD1 4.13Å; I193-I295 HydrophobicContact CB-CG1 4.26Å; I193-I295 HydrophobicContact CD1-CD1 3.85Å; I193-I295 HydrophobicContact CD1-CG1 3.94Å; I193-I295 HydrophobicContact CG1-CD1 3.97Å; I193-I295 HydrophobicContact CG1-CG1 3.76Å
194	V	92.4	Very high	82.1	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.7	-179.2	-170.7	0	0	0	0	107.1	I192 I197 F210 S260 A261 V263 L290 R291 L292	I192-V194 HydrophobicContact CD1-CG2 3.69Å; I192-V194 HydrophobicContact CG1-CG2 3.94Å; V194-I197 HydrophobicContact CB-CD1 4.02Å; V194-I197 HydrophobicContact CB-CG1 4.45Å; V194-I197 HydrophobicContact CG1-CD1 3.83Å; V194-I197 HydrophobicContact CG1-CG1 3.77Å; V194-F210 HydrophobicContact CB-CZ 4.48Å; V194-F210 HydrophobicContact CG1-CE2 4.32Å; V194-F210 HydrophobicContact CG1-CZ 4.05Å; V194-F210 HydrophobicContact CG2-CE1 4.44Å; V194-F210 HydrophobicContact CG2-CE2 3.92Å; V194-F210 HydrophobicContact CG2-CZ 3.59Å; V194-S260 CarbonylContact O-C 3.57Å; V194-S260 WeakPolarHBondContact O-CA 3.48Å; V194-S260 WeakPolarHBondContact O-CB 3.03Å; V194-A261 HydrophobicContact CB-CB 4.48Å; V194-A261 PolarHBondContact N-O 3.08Å; V194-A261 PolarHBondContact O-N 3.24Å; V194-V263 HydrophobicContact CG2-CG2 4Å; V194-L290 HydrophobicContact CG1-CD2 3.78Å; V194-R291 CarbonylContact C-O 3.51Å; V194-R291 WeakPolarHBondContact CA-O 3.26Å; V194-L292 HydrophobicContact CG1-CD1 3.98Å; V194-L292 HydrophobicContact CG1-CG 4.18Å; V194-L292 HydrophobicContact CG2-CG 4.25Å
195	T	91.6	Very high	84.2	Confident	42 Å²	42	52 Å²	52	26%	0.258	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	164.6	174.8	76.8	0	0	0	0	110.7	I193 I197 S260 L290 R291	I193-T195 HydrophobicContact CG2-CG2 3.89Å; T195-I197 VanDerWaalsContact C-N 3.33Å; T195-S260 WeakPolarHBondContact CG2-OG 3.4Å; T195-L290 CarbonylContact O-C 3.58Å; T195-L290 WeakPolarHBondContact O-CA 3.29Å; T195-R291 PolarHBondContact N-O 3.41Å; T195-R291 PolarHBondContact O-N 3.2Å
196	G	87	Confident	86.2	Confident	5 Å²	5	46.8 Å²	46.8	5%	0.052	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.9	20.7	-173.2	0	0	0	0	0	113.4	S259 S288	G196-S259 PolarHBondContact N-O 2.84Å; G196-S288 WeakPolarHBondContact CA-OG 3.39Å; G196-S288 PolarHBondContact O-OG 3.04Å
197	I	88.9	Confident	87.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	138.9	174.4	-53.1	168.3	0	0	0	107.7	V194 T195 W201 L206 T258 S259 A261 L290	V194-I197 HydrophobicContact CB-CD1 4.02Å; V194-I197 HydrophobicContact CB-CG1 4.45Å; V194-I197 HydrophobicContact CG1-CD1 3.83Å; V194-I197 HydrophobicContact CG1-CG1 3.77Å; T195-I197 VanDerWaalsContact C-N 3.33Å; I197-W201 HydrophobicContact CG2-CB 3.68Å; I197-W201 HydrophobicContact CG2-CD2 4.45Å; I197-W201 HydrophobicContact CG2-CE3 4.46Å; I197-W201 HydrophobicContact CG2-CG 4.16Å; I197-L206 HydrophobicContact CD1-CD1 4.06Å; I197-L206 HydrophobicContact CD1-CD2 3.94Å; I197-L206 HydrophobicContact CG1-CD2 4.32Å; I197-L206 HydrophobicContact CG2-CD2 4.02Å; I197-T258 CarbonylContact O-C 3.54Å; I197-T258 WeakPolarHBondContact O-CA 3.44Å; I197-T258 WeakPolarHBondContact O-CB 3.44Å; I197-S259 PolarHBondContact N-O 2.8Å; I197-S259 PolarHBondContact O-N 2.96Å; I197-A261 HydrophobicContact CD1-CB 3.46Å; I197-A261 VanDerWaalsContact CD1-CB 3.46Å; I197-L290 HydrophobicContact CB-CD2 4.33Å; I197-L290 HydrophobicContact CG1-CD2 3.68Å
198	P	85.4	Confident	88.9	Confident	11 Å²	11	50.1 Å²	50.1	7%	0.071	25%	0.253	C	S	.	.			trans	-61.3	150.5	171.9	-18.9	31.7	0	0	0	111.7	E200 W201 W286	P198-E200 VanDerWaalsContact C-N 3.27Å; P198-E200 HydrophobicContact CB-CG 4.37Å; P198-E200 WeakPolarHBondContact CB-OE1 3.5Å; P198-E200 VanDerWaalsContact CB-OE2 3.23Å; P198-E200 WeakPolarHBondContact CB-OE2 3.5Å; P198-E200 PolarHBondContact O-N 3.07Å; P198-W201 HydrophobicContact CB-CG 4.38Å; P198-W201 HydrophobicContact CG-CG 4.29Å; P198-W201 PolarHBondContact O-N 2.77Å; P198-W286 HydrophobicContact CG-CD2 3.99Å; P198-W286 HydrophobicContact CG-CG 3.87Å; P198-W286 HydrophobicContact CG-CZ2 4.5Å
199	V	82.7	Confident	89.6	Confident	70 Å²	70	44.6 Å²	44.6	42%	0.424	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-23.5	-173.1	174.3	0	0	0	0	112.2	W201 F257	V199-W201 VanDerWaalsContact C-N 3.31Å; V199-F257 HydrophobicContact CG2-CB 3.69Å
200	E	83.5	Confident	89.9	Confident	140 Å²	140	44.4 Å²	44.4	65%	0.654	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-8.6	175.6	69.4	-80.2	-170.4	0	0	114.3	P198	P198-E200 VanDerWaalsContact C-N 3.27Å; P198-E200 HydrophobicContact CB-CG 4.37Å; P198-E200 WeakPolarHBondContact CB-OE1 3.5Å; P198-E200 VanDerWaalsContact CB-OE2 3.23Å; P198-E200 WeakPolarHBondContact CB-OE2 3.5Å; P198-E200 PolarHBondContact O-N 3.07Å
201	W	87.7	Confident	89.9	Confident	44 Å²	44	44 Å²	44	17%	0.167	23%	0.231	C	C	.	.			trans	-79.4	133.3	178.4	-85.6	46.6	0	0	0	112.6	I197 P198 V199 D205 L206 L209 W286	I197-W201 HydrophobicContact CG2-CB 3.68Å; I197-W201 HydrophobicContact CG2-CD2 4.45Å; I197-W201 HydrophobicContact CG2-CE3 4.46Å; I197-W201 HydrophobicContact CG2-CG 4.16Å; P198-W201 HydrophobicContact CB-CG 4.38Å; P198-W201 HydrophobicContact CG-CG 4.29Å; P198-W201 PolarHBondContact O-N 2.77Å; V199-W201 VanDerWaalsContact C-N 3.31Å; W201-D205 HydrophobicContact CD2-CB 4.27Å; W201-D205 HydrophobicContact CE3-CB 3.98Å; W201-D205 HydrophobicContact CZ3-CB 4.42Å; W201-L206 HydrophobicContact CE3-CD2 3.8Å; W201-L206 HydrophobicContact CE3-CG 4.31Å; W201-L206 HydrophobicContact CZ3-CD2 4.23Å; W201-L209 HydrophobicContact CH2-CD2 4.1Å; W201-L209 HydrophobicContact CZ3-CB 4.17Å; W201-L209 HydrophobicContact CZ3-CD2 3.75Å; W201-W286 HydrophobicContact CH2-CH2 4.48Å; W201-W286 HydrophobicContact CH2-CZ2 4.11Å; W201-W286 HydrophobicContact CZ2-CH2 4.36Å; W201-W286 AromaticContact CZ2-CZ2 3.58Å; W201-W286 HydrophobicContact CZ2-CZ2 3.58Å
202	T	88	Confident	89.7	Confident	66 Å²	66	47.2 Å²	47.2	41%	0.405	25%	0.249	S	C	.	.			trans	-100.7	167.1	-179.4	73.6	0	0	0	0	112.7	P204 D205 L206	T202-P204 VanDerWaalsContact C-N 3.34Å; T202-P204 WeakPolarHBondContact OG1-CD 3.19Å; T202-D205 WeakPolarHBondContact CB-OD2 3.42Å; T202-D205 PolarHBondContact N-OD2 3.01Å; T202-D205 PolarHBondContact O-N 3.34Å; T202-D205 PolarHBondContact OG1-OD2 3.46Å; T202-L206 PolarHBondContact O-N 3.18Å; T202-L206 VanDerWaalsContact O-N 3.12Å
203	E	88.3	Confident	89.6	Confident	85 Å²	85	48.8 Å²	48.8	40%	0.397	26%	0.256	S	S	.	.	H	α-helix	trans	-56.5	-40.5	173.7	-63.8	-179.5	170.5	0	0	112.7	D205 L206 L207 I219 R220 L221	E203-D205 VanDerWaalsContact C-N 3.33Å; E203-D205 PolarHBondContact O-N 3.2Å; E203-L206 PolarHBondContact O-N 2.92Å; E203-L207 WeakPolarHBondContact O-CB 3.48Å; E203-L207 PolarHBondContact O-N 3.13Å; E203-I219 HydrophobicContact CB-CG2 4.28Å; E203-I219 HydrophobicContact CG-CG2 4.29Å; E203-R220 VanDerWaalsContact OE1-CA 3.28Å; E203-R220 WeakPolarHBondContact OE1-CA 3.39Å; E203-L221 HydrophobicContact CG-CB 4.27Å; E203-L221 HydrophobicContact CG-CD1 3.65Å; E203-L221 PolarHBondContact OE1-N 3.32Å
204	P	89.3	Confident	89.4	Confident	77 Å²	77	47.3 Å²	47.3	50%	0.5	25%	0.254	S	S	.	.	H	α-helix	trans	-53.3	-37	166.5	-31.9	35.1	0	0	0	116.3	T202 L207 R208	T202-P204 VanDerWaalsContact C-N 3.34Å; T202-P204 WeakPolarHBondContact OG1-CD 3.19Å; P204-L207 WeakPolarHBondContact O-CB 3.03Å; P204-L207 PolarHBondContact O-N 3.09Å; P204-R208 VanDerWaalsContact O-CG 3.3Å; P204-R208 WeakPolarHBondContact O-CG 3.21Å; P204-R208 PolarHBondContact O-N 2.76Å
205	D	90	Very high	89.3	Confident	37 Å²	37	49.5 Å²	49.5	20%	0.198	27%	0.273	C	S	.	.	H	α-helix	trans	-76.5	-39.5	-178	-57.1	-54.6	0	0	0	111.7	W201 T202 E203 L207 R208 L209	W201-D205 HydrophobicContact CD2-CB 4.27Å; W201-D205 HydrophobicContact CE3-CB 3.98Å; W201-D205 HydrophobicContact CZ3-CB 4.42Å; T202-D205 WeakPolarHBondContact CB-OD2 3.42Å; T202-D205 PolarHBondContact N-OD2 3.01Å; T202-D205 PolarHBondContact O-N 3.34Å; T202-D205 PolarHBondContact OG1-OD2 3.46Å; E203-D205 VanDerWaalsContact C-N 3.33Å; E203-D205 PolarHBondContact O-N 3.2Å; D205-L207 VanDerWaalsContact C-N 3.28Å; D205-L207 PolarHBondContact O-N 3.33Å; D205-R208 PolarHBondContact O-N 2.82Å; D205-R208 IonicContact OD1-CZ 3.8Å; D205-R208 IonicContact OD1-NH1 2.77Å; D205-R208 PolarHBondContact OD1-NH1 2.94Å; D205-L209 PolarHBondContact O-N 3.28Å
206	L	91.3	Very high	89.3	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-60.7	-39.2	166.5	-63.5	172.8	0	0	0	111	I197 W201 T202 E203 L209 F210 I219 L221 A261	I197-L206 HydrophobicContact CD1-CD1 4.06Å; I197-L206 HydrophobicContact CD1-CD2 3.94Å; I197-L206 HydrophobicContact CG1-CD2 4.32Å; I197-L206 HydrophobicContact CG2-CD2 4.02Å; W201-L206 HydrophobicContact CE3-CD2 3.8Å; W201-L206 HydrophobicContact CE3-CG 4.31Å; W201-L206 HydrophobicContact CZ3-CD2 4.23Å; T202-L206 PolarHBondContact O-N 3.18Å; T202-L206 VanDerWaalsContact O-N 3.12Å; E203-L206 PolarHBondContact O-N 2.92Å; L206-L209 PolarHBondContact O-N 3.27Å; L206-F210 HydrophobicContact CB-CD2 4.3Å; L206-F210 HydrophobicContact CD2-CE2 4.13Å; L206-F210 WeakPolarHBondContact O-CB 3.26Å; L206-F210 VanDerWaalsContact O-CD2 3.25Å; L206-F210 WeakPolarHBondContact O-CD2 3.45Å; L206-F210 PolarHBondContact O-N 3.3Å; L206-I219 HydrophobicContact CB-CD1 3.91Å; L206-I219 HydrophobicContact CB-CG2 4.08Å; L206-I219 HydrophobicContact CD1-CG2 4.04Å; L206-L221 HydrophobicContact CD1-CD1 3.5Å; L206-L221 VanDerWaalsContact CD1-CD1 3.5Å; L206-A261 HydrophobicContact CD1-CB 3.54Å
207	L	92.5	Very high	89.3	Confident	84 Å²	84	51.7 Å²	51.7	44%	0.44	28%	0.284	S	S	.	.	H	α-helix	trans	-64.2	-44.8	178	-170.5	63.9	0	0	0	111.3	E203 P204 D205 L209 F210 S211 V216 I219	E203-L207 WeakPolarHBondContact O-CB 3.48Å; E203-L207 PolarHBondContact O-N 3.13Å; P204-L207 WeakPolarHBondContact O-CB 3.03Å; P204-L207 PolarHBondContact O-N 3.09Å; D205-L207 VanDerWaalsContact C-N 3.28Å; D205-L207 PolarHBondContact O-N 3.33Å; L207-L209 VanDerWaalsContact C-N 3.29Å; L207-L209 PolarHBondContact O-N 3.13Å; L207-F210 PolarHBondContact O-N 2.81Å; L207-S211 WeakPolarHBondContact O-CB 3.26Å; L207-S211 PolarHBondContact O-N 3.46Å; L207-S211 PolarHBondContact O-OG 3.29Å; L207-S211 VanDerWaalsContact O-OG 3.05Å; L207-V216 HydrophobicContact CD1-CB 4.06Å; L207-V216 HydrophobicContact CD1-CG1 4.2Å; L207-I219 VanDerWaalsContact CA-CD1 3.47Å; L207-I219 HydrophobicContact CB-CD1 3.93Å; L207-I219 HydrophobicContact CD1-CD1 3.95Å; L207-I219 HydrophobicContact CD1-CG1 4.36Å
208	R	89.6	Confident	89.3	Confident	128 Å²	128	52.6 Å²	52.6	48%	0.483	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-37.2	172.4	-71.5	162.7	173	173.3	-10.8	112.6	P204 D205 S211 N212	P204-R208 VanDerWaalsContact O-CG 3.3Å; P204-R208 WeakPolarHBondContact O-CG 3.21Å; P204-R208 PolarHBondContact O-N 2.76Å; D205-R208 PolarHBondContact O-N 2.82Å; D205-R208 IonicContact OD1-CZ 3.8Å; D205-R208 IonicContact OD1-NH1 2.77Å; D205-R208 PolarHBondContact OD1-NH1 2.94Å; R208-S211 PolarHBondContact O-OG 3.37Å; R208-N212 PolarHBondContact O-ND2 2.88Å
209	L	91.5	Very high	89.6	Confident	3 Å²	3	53 Å²	53	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-72.9	-50.3	178	178.2	60.9	0	0	0	111.7	W201 D205 L206 L207 N212 L278 L290 V339	W201-L209 HydrophobicContact CH2-CD2 4.1Å; W201-L209 HydrophobicContact CZ3-CB 4.17Å; W201-L209 HydrophobicContact CZ3-CD2 3.75Å; D205-L209 PolarHBondContact O-N 3.28Å; L206-L209 PolarHBondContact O-N 3.27Å; L207-L209 VanDerWaalsContact C-N 3.29Å; L207-L209 PolarHBondContact O-N 3.13Å; L209-N212 PolarHBondContact O-ND2 2.85Å; L209-L278 HydrophobicContact CD1-CD1 4.04Å; L209-L278 HydrophobicContact CD1-CD2 4.09Å; L209-L278 HydrophobicContact CD2-CD1 3.97Å; L209-L278 HydrophobicContact CG-CD1 3.86Å; L209-L290 HydrophobicContact CD2-CD1 4.28Å; L209-V339 HydrophobicContact CD1-CG1 4.01Å
210	F	94.3	Very high	89.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-81	-25.1	-171.7	-76.3	-70.6	0	0	0	114	I192 V194 L206 L207 N212 F213 V216 V263 F265 L278 L292	I192-F210 HydrophobicContact CD1-CD1 4.04Å; I192-F210 HydrophobicContact CD1-CE1 3.45Å; I192-F210 VanDerWaalsContact CD1-CE1 3.45Å; I192-F210 HydrophobicContact CD1-CZ 3.93Å; V194-F210 HydrophobicContact CB-CZ 4.48Å; V194-F210 HydrophobicContact CG1-CE2 4.32Å; V194-F210 HydrophobicContact CG1-CZ 4.05Å; V194-F210 HydrophobicContact CG2-CE1 4.44Å; V194-F210 HydrophobicContact CG2-CE2 3.92Å; V194-F210 HydrophobicContact CG2-CZ 3.59Å; L206-F210 HydrophobicContact CB-CD2 4.3Å; L206-F210 HydrophobicContact CD2-CE2 4.13Å; L206-F210 WeakPolarHBondContact O-CB 3.26Å; L206-F210 VanDerWaalsContact O-CD2 3.25Å; L206-F210 WeakPolarHBondContact O-CD2 3.45Å; L206-F210 PolarHBondContact O-N 3.3Å; L207-F210 PolarHBondContact O-N 2.81Å; F210-N212 PolarHBondContact O-N 2.82Å; F210-N212 VanDerWaalsContact O-N 3.1Å; F210-F213 PolarHBondContact O-N 3.15Å; F210-V216 HydrophobicContact CB-CG2 4.03Å; F210-V263 HydrophobicContact CB-CG1 4.08Å; F210-V263 HydrophobicContact CD1-CG1 4.36Å; F210-V263 HydrophobicContact CD2-CG1 4.27Å; F210-V263 HydrophobicContact CD2-CG2 3.86Å; F210-V263 HydrophobicContact CE2-CG2 4Å; F210-V263 HydrophobicContact CG-CG1 3.97Å; F210-V263 HydrophobicContact CG-CG2 4.39Å; F210-F265 HydrophobicContact CB-CZ 3.87Å; F210-F265 AromaticContact CD1-CE2 3.98Å; F210-F265 HydrophobicContact CD1-CE2 3.98Å; F210-F265 AromaticContact CD1-CZ 3.84Å; F210-F265 HydrophobicContact CD1-CZ 3.84Å; F210-F265 HydrophobicContact CG-CZ 4.3Å; F210-F265 WeakPolarHBondContact O-CE1 3.46Å; F210-F265 WeakPolarHBondContact O-CZ 3.21Å; F210-L278 HydrophobicContact CD1-CD1 4.18Å; F210-L278 HydrophobicContact CE1-CD1 3.64Å; F210-L278 HydrophobicContact CZ-CD1 4Å; F210-L292 HydrophobicContact CE1-CD2 3.67Å; F210-L292 HydrophobicContact CZ-CD2 3.9Å; F210-L292 HydrophobicContact CZ-CG 4.42Å
211	S	92.1	Very high	89.9	Confident	64 Å²	64	50.3 Å²	50.3	45%	0.448	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-60.5	-21.2	174.5	63.8	0	0	0	0	113.7	L207 R208 F213 G214	L207-S211 WeakPolarHBondContact O-CB 3.26Å; L207-S211 PolarHBondContact O-N 3.46Å; L207-S211 PolarHBondContact O-OG 3.29Å; L207-S211 VanDerWaalsContact O-OG 3.05Å; R208-S211 PolarHBondContact O-OG 3.37Å; S211-F213 PolarHBondContact O-N 3.31Å; S211-G214 PolarHBondContact O-N 2.91Å
212	N	89.9	Confident	89.6	Confident	78 Å²	78	51.1 Å²	51.1	42%	0.417	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-65.6	-13.9	175.2	-60.8	-64.5	0	0	0	113.8	R208 L209 F210 L340	R208-N212 PolarHBondContact O-ND2 2.88Å; L209-N212 PolarHBondContact O-ND2 2.85Å; F210-N212 PolarHBondContact O-N 2.82Å; F210-N212 VanDerWaalsContact O-N 3.1Å; N212-L340 HydrophobicContact CB-CD2 4.42Å
213	F	92.8	Very high	88.6	Confident	33 Å²	33	51.9 Å²	51.9	15%	0.145	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-100.8	-18.3	-179.4	-64.3	-86.7	0	0	0	113.3	F210 S211 F265 N270 L273 S274 R277 L278	F210-F213 PolarHBondContact O-N 3.15Å; S211-F213 PolarHBondContact O-N 3.31Å; F213-F265 HydrophobicContact CB-CE1 3.8Å; F213-F265 HydrophobicContact CB-CZ 3.85Å; F213-N270 VanDerWaalsContact O-CB 3.24Å; F213-N270 WeakPolarHBondContact O-CB 3.31Å; F213-N270 PolarHBondContact O-OD1 2.98Å; F213-L273 HydrophobicContact CD1-CB 4.04Å; F213-L273 WeakPolarHBondContact CE1-O 3.45Å; F213-S274 VanDerWaalsContact CD1-CA 3.41Å; F213-R277 HydrophobicContact CE1-CB 3.74Å; F213-R277 HydrophobicContact CE1-CG 3.97Å; F213-R277 HydrophobicContact CZ-CB 3.91Å; F213-L278 HydrophobicContact CE2-CD1 3.62Å; F213-L278 HydrophobicContact CE2-CG 4.06Å; F213-L278 HydrophobicContact CZ-CD1 3.94Å; F213-L278 HydrophobicContact CZ-CD2 4.4Å; F213-L278 HydrophobicContact CZ-CG 3.85Å
214	G	88.7	Confident	87.2	Confident	25 Å²	25	50.3 Å²	50.3	26%	0.258	29%	0.289	S	S	.	.	S	Bend	trans	145.9	-169.8	-179.9	0	0	0	0	0	112.3	S211 V216	S211-G214 PolarHBondContact O-N 2.91Å; G214-V216 PolarHBondContact O-N 3.47Å
215	A	90.4	Very high	85.1	Confident	47 Å²	47	52.2 Å²	52.2	39%	0.388	29%	0.291	S	S	.	.			trans	-66.4	121.1	-179.2	0	0	0	0	0	111.9	F265 Q266	A215-F265 WeakPolarHBondContact O-CA 3.16Å; A215-F265 WeakPolarHBondContact O-CD1 3.26Å; A215-Q266 HydrophobicContact CB-CB 4.02Å; A215-Q266 PolarHBondContact O-N 3.44Å
216	V	91.2	Very high	82.7	Confident	34 Å²	34	57 Å²	57	21%	0.206	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130	172.3	-178	0	0	0	0	108.5	L207 F210 G214 V218 I219 V263 I264 F265	L207-V216 HydrophobicContact CD1-CB 4.06Å; L207-V216 HydrophobicContact CD1-CG1 4.2Å; F210-V216 HydrophobicContact CB-CG2 4.03Å; G214-V216 PolarHBondContact O-N 3.47Å; V216-V218 WeakPolarHBondContact CG1-O 3.49Å; V216-I219 HydrophobicContact CG1-CD1 4.1Å; V216-I219 HydrophobicContact CG1-CG1 3.59Å; V216-V263 HydrophobicContact CG1-CG1 3.92Å; V216-V263 HydrophobicContact CG2-CG1 4.4Å; V216-I264 CarbonylContact C-O 3.56Å; V216-F265 HydrophobicContact CG2-CD1 3.93Å; V216-F265 HydrophobicContact CG2-CE1 3.58Å; V216-F265 HydrophobicContact CG2-CZ 4Å
217	V	88.2	Confident	80.2	Confident	58 Å²	58	61.4 Å²	61.4	35%	0.352	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-43.8	-177.8	-171.9	0	0	0	0	110.9	I264 Q266	V217-I264 HydrophobicContact CB-CG2 4.22Å; V217-I264 HydrophobicContact CG2-CG2 4.47Å; V217-I264 PolarHBondContact N-O 2.72Å; V217-Q266 HydrophobicContact CG2-CB 3.85Å; V217-Q266 HydrophobicContact CG2-CG 4.47Å
218	V	88.5	Confident	77.4	Confident	20 Å²	20	65.5 Å²	65.5	12%	0.121	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	143	178.6	175.5	0	0	0	0	109.1	I187 V216 I264	I187-V218 HydrophobicContact CD1-CG2 3.92Å; I187-V218 HydrophobicContact CG1-CG2 4.06Å; V216-V218 WeakPolarHBondContact CG1-O 3.49Å; V218-I264 HydrophobicContact CB-CB 4.44Å; V218-I264 HydrophobicContact CB-CD1 4.5Å; V218-I264 PolarHBondContact O-N 2.9Å
219	I	91.3	Very high	74.6	Confident	19 Å²	19	64.1 Å²	64.1	10%	0.097	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	146.6	157	-61.2	-165.9	0	0	0	107.4	E203 L206 L207 V216 S262 V263	E203-I219 HydrophobicContact CB-CG2 4.28Å; E203-I219 HydrophobicContact CG-CG2 4.29Å; L206-I219 HydrophobicContact CB-CD1 3.91Å; L206-I219 HydrophobicContact CB-CG2 4.08Å; L206-I219 HydrophobicContact CD1-CG2 4.04Å; L207-I219 VanDerWaalsContact CA-CD1 3.47Å; L207-I219 HydrophobicContact CB-CD1 3.93Å; L207-I219 HydrophobicContact CD1-CD1 3.95Å; L207-I219 HydrophobicContact CD1-CG1 4.36Å; V216-I219 HydrophobicContact CG1-CD1 4.1Å; V216-I219 HydrophobicContact CG1-CG1 3.59Å; I219-S262 CarbonylContact C-O 3.49Å; I219-S262 WeakPolarHBondContact CA-O 3.47Å; I219-V263 HydrophobicContact CD1-CG1 4.27Å; I219-V263 HydrophobicContact CD1-CG2 4.06Å; I219-V263 HydrophobicContact CG1-CB 4.43Å; I219-V263 HydrophobicContact CG1-CG1 4.13Å; I219-V263 HydrophobicContact CG1-CG2 4.01Å; I219-V263 HydrophobicContact CG2-CG2 4.17Å
220	R	85.5	Confident	71.8	Confident	99 Å²	99	69.4 Å²	69.4	37%	0.374	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	130.7	163.7	-99.5	-174.4	174.4	171	1.1	111.1	E203 A261 S262 Y307	E203-R220 VanDerWaalsContact OE1-CA 3.28Å; E203-R220 WeakPolarHBondContact OE1-CA 3.39Å; R220-A261 CarbonylContact O-C 3.58Å; R220-A261 WeakPolarHBondContact O-CA 3.48Å; R220-A261 VanDerWaalsContact O-CB 3.29Å; R220-A261 WeakPolarHBondContact O-CB 3.47Å; R220-S262 PolarHBondContact N-O 3.47Å; R220-S262 PolarHBondContact O-N 3.36Å; R220-Y307 WeakPolarHBondContact CD-OH 3.41Å; R220-Y307 VanDerWaalsContact NH1-CE1 3.28Å
221	L	86.4	Confident	68.9	Low	55 Å²	55	76.2 Å²	76.2	29%	0.288	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	136.8	159.3	-107.2	82.6	0	0	0	109.3	E203 L206 S259	E203-L221 HydrophobicContact CG-CB 4.27Å; E203-L221 HydrophobicContact CG-CD1 3.65Å; E203-L221 PolarHBondContact OE1-N 3.32Å; L206-L221 HydrophobicContact CD1-CD1 3.5Å; L206-L221 VanDerWaalsContact CD1-CD1 3.5Å; L221-S259 WeakPolarHBondContact CD2-OG 3.4Å
222	L	82.9	Confident	66	Low	60 Å²	60	76.5 Å²	76.5	31%	0.314	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	159.8	164.6	-53.3	176.7	0	0	0	107.6	S259 S260	L222-S259 PolarHBondContact O-OG 3.21Å; L222-S260 WeakPolarHBondContact CB-O 3.38Å; L222-S260 PolarHBondContact N-O 3.02Å
223	A	65.8	Low	63.4	Low	82 Å²	82	82 Å²	82	68%	0.678	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	144.7	179.9	0	0	0	0	0	111.4	Q225	A223-Q225 PolarHBondContact O-N 3.15Å
224	P	58.2	Low	60.4	Low	52 Å²	52	90.1 Å²	90.1	34%	0.338	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	138.1	179.3	25.3	-34.5	0	0	0	110.9	F226	P224-F226 HydrophobicContact CG-CE2 4.22Å; P224-F226 HydrophobicContact CG-CZ 4.43Å; P224-F226 PolarHBondContact O-N 2.71Å
225	Q	46.6	Very low	57.8	Low	117 Å²	117	94.5 Å²	94.5	55%	0.547	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	104.5	-179	-63.7	-164.8	41.6	0	0	109.4	A223 T258 S260	A223-Q225 PolarHBondContact O-N 3.15Å; Q225-T258 PolarHBondContact N-O 3.31Å; Q225-T258 VanDerWaalsContact N-O 3.09Å; Q225-S260 PolarHBondContact NE2-OG 2.78Å
226	F	38.8	Very low	54.9	Low	138 Å²	138	103.8 Å²	103.8	61%	0.605	57%	0.57	S	S	*	*			trans	-72.9	137.2	167.7	-64.3	-81.2	0	0	0	109.4	P224 D228 F257	P224-F226 HydrophobicContact CG-CE2 4.22Å; P224-F226 HydrophobicContact CG-CZ 4.43Å; P224-F226 PolarHBondContact O-N 2.71Å; F226-D228 PolarHBondContact O-N 2.83Å; F226-F257 HydrophobicContact CD1-CD1 4.17Å; F226-F257 AromaticContact CD1-CE1 3.74Å; F226-F257 HydrophobicContact CD1-CE1 3.74Å; F226-F257 HydrophobicContact CD1-CZ 4.25Å; F226-F257 HydrophobicContact CE1-CE1 4.19Å; F226-F257 HydrophobicContact CE1-CZ 4.36Å
227	P	39.4	Very low	52.1	Low	94 Å²	94	110.3 Å²	110.3	61%	0.61	60%	0.603	S	S	*	*			trans	-63.2	121.4	167.6	-19.6	32.3	0	0	0	109.9	S229	P227-S229 PolarHBondContact O-N 3.41Å
228	D	33.5	Very low	49.4	Very low	169 Å²	169	112.4 Å²	112.4	90%	0.904	62%	0.621	S	S	*	*			trans	-62.6	96.4	-179.9	-87.2	-44.2	0	0	0	111.2	F226	F226-D228 PolarHBondContact O-N 2.83Å
229	S	29.7	Very low	46.7	Very low	99 Å²	99	118 Å²	118	69%	0.692	66%	0.657	S	S	*	*			trans	-77.9	131.4	169	-60.5	0	0	0	0	108.8	P227	P227-S229 PolarHBondContact O-N 3.41Å
230	P	34.1	Very low	44	Very low	115 Å²	115	121.3 Å²	121.3	75%	0.747	69%	0.688	S	S	*	*			trans	-61.6	132.5	-175.7	23.7	-33.4	0	0	0	111	G232	P230-G232 VanDerWaalsContact C-N 3.31Å; P230-G232 PolarHBondContact O-N 2.72Å
231	P	32.3	Very low	41.6	Very low	142 Å²	142	123.7 Å²	123.7	92%	0.922	71%	0.707	S	S	*	*	S	Bend	trans	-74.7	78.8	-173.1	30.1	-36.2	0	0	0	111.5
232	G	32.7	Very low	39.2	Very low	70 Å²	70	128.6 Å²	128.6	72%	0.722	73%	0.733	S	S	*	*			trans	-147.5	-6.5	-167.8	0	0	0	0	0	118.3	P230	P230-G232 VanDerWaalsContact C-N 3.31Å; P230-G232 PolarHBondContact O-N 2.72Å
233	Q	35	Very low	36.7	Very low	193 Å²	193	129.3 Å²	129.3	90%	0.902	76%	0.756	S	S	*	*			trans	-131.5	107.5	-179.4	-66.4	-168.1	2.6	0	0	113.3
234	K	29.9	Very low	35.2	Very low	205 Å²	205	129.7 Å²	129.7	89%	0.891	76%	0.759	S	S	*	*			trans	-83.3	123.2	158.1	-74.6	-177.2	176.6	179.5	0	108.3	R236	K234-R236 PolarHBondContact O-N 2.83Å
235	P	32.7	Very low	34.1	Very low	116 Å²	116	132.2 Å²	132.2	75%	0.753	78%	0.778	S	S	*	*			trans	-65.5	123.9	172.1	26.5	-32.7	0	0	0	110	L237	P235-L237 PolarHBondContact O-N 2.83Å
236	R	31.3	Very low	33.5	Very low	243 Å²	243	131.6 Å²	131.6	92%	0.917	79%	0.786	S	S	*	*			trans	-74.9	102.2	169.5	-86.8	-175.4	169.2	-177.6	-2.4	109.1	K234	K234-R236 PolarHBondContact O-N 2.83Å
237	L	32.1	Very low	33.2	Very low	171 Å²	171	133.3 Å²	133.3	90%	0.895	80%	0.802	S	S	*	*			trans	-83.5	112.3	163.2	-76.3	167.8	0	0	0	109.4	P235	P235-L237 PolarHBondContact O-N 2.83Å
238	S	31.4	Very low	32.9	Very low	102 Å²	102	137.4 Å²	137.4	71%	0.713	82%	0.815	S	S	*	*			trans	-128.5	120.9	170.3	52.7	0	0	0	0	109
239	P	31.6	Very low	32.9	Very low	136 Å²	136	135.3 Å²	135.3	88%	0.883	81%	0.813	S	S	*	*			trans	-87.6	123.7	-168.2	32.1	-34.1	0	0	0	113.9
240	A	33.5	Very low	32.9	Very low	90 Å²	90	136.1 Å²	136.1	74%	0.744	82%	0.819	S	S	*	*			trans	-149.8	110.8	156.7	0	0	0	0	0	106.9
241	L	36.3	Very low	32.7	Very low	149 Å²	149	140.1 Å²	140.1	78%	0.78	83%	0.828	S	S	*	*				74.4	103.7	79.7	-85	162.7	0	0	0	114.4
242	N	35	Very low	32.8	Very low	157 Å²	157	137.7 Å²	137.7	84%	0.84	81%	0.814	S	S	*	*			trans	70.6	124.8	153.6	-55.1	-17.3	0	0	0	120
243	G	31.9	Very low	32.7	Very low	76 Å²	76	139 Å²	139	78%	0.784	82%	0.818	S	S	*	*			trans	155.8	115.2	156.6	0	0	0	0	0	115.5
244	A	32.8	Very low	32.9	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	81%	0.807	S	S	*	*			trans	-1.3	120.9	157.4	0	0	0	0	0	117.8
245	S	35.4	Very low	33.5	Very low	105 Å²	105	131.9 Å²	131.9	73%	0.734	80%	0.796	S	S	*	*				54.1	132.2	77.7	75.6	0	0	0	0	114.9
246	S	34	Very low	34.7	Very low	104 Å²	104	134.6 Å²	134.6	73%	0.727	80%	0.796	S	S	*	*			cis	-177.8	136.9	-7.2	44.4	0	0	0	0	108.7
247	D	33	Very low	36.4	Very low	174 Å²	174	126.8 Å²	126.8	93%	0.93	77%	0.769	S	S	*	*			trans	-158.9	161.9	156.8	-112.6	-36.6	0	0	0	112.1
248	M	33.7	Very low	38.8	Very low	179 Å²	179	120.2 Å²	120.2	88%	0.882	74%	0.736	S	S	*	*			trans	-111.6	120	-163.2	-82.5	-84	-178.6	0	0	114.7
249	S	32.1	Very low	41.3	Very low	125 Å²	125	115.5 Å²	115.5	87%	0.874	70%	0.703	S	S	*	*			trans	-156.7	128.8	147.3	50.1	0	0	0	0	110
250	S	29.7	Very low	44	Very low	116 Å²	116	109.1 Å²	109.1	81%	0.811	66%	0.661	S	S	*	*			trans	-123.9	104.1	-174.7	59	0	0	0	0	111.5
251	E	31.2	Very low	46.8	Very low	199 Å²	199	104.8 Å²	104.8	93%	0.93	63%	0.626	S	S	*	*			trans	-105.8	131	161.2	-67.6	-168.7	131.3	0	0	108.8
252	S	34.4	Very low	49.5	Very low	92 Å²	92	97.8 Å²	97.8	64%	0.643	59%	0.589	S	S	*	*			trans	-81.8	129.8	-174.7	49.4	0	0	0	0	111.9	D254	S252-D254 WeakPolarHBondContact CB-OD2 3.17Å; S252-D254 PolarHBondContact O-N 3.04Å; S252-D254 PolarHBondContact OG-OD2 3.34Å
253	A	30.9	Very low	52.3	Low	96 Å²	96	90.3 Å²	90.3	79%	0.793	55%	0.549	S	S	*	.			trans	-80.4	63.9	172.4	0	0	0	0	0	110.8	N255	A253-N255 PolarHBondContact O-N 3.25Å
254	D	38.3	Very low	55.2	Low	125 Å²	125	86.7 Å²	86.7	67%	0.668	51%	0.512	S	S	*	.			trans	-69.7	128	-179.1	-72.8	-58.7	0	0	0	111.8	S252 K256	S252-D254 WeakPolarHBondContact CB-OD2 3.17Å; S252-D254 PolarHBondContact O-N 3.04Å; S252-D254 PolarHBondContact OG-OD2 3.34Å; D254-K256 PolarHBondContact O-N 2.92Å
255	N	42.4	Very low	58.2	Low	125 Å²	125	82.4 Å²	82.4	67%	0.668	48%	0.476	S	S	*	.			trans	-75.5	114.9	-162.7	-77.6	-71.7	0	0	0	113	A253 F257	A253-N255 PolarHBondContact O-N 3.25Å; N255-F257 HydrophobicContact CB-CD2 3.62Å; N255-F257 HydrophobicContact CB-CE2 3.58Å; N255-F257 HydrophobicContact CB-CZ 4.47Å; N255-F257 PolarHBondContact O-N 2.85Å
256	K	57.6	Low	60.8	Low	173 Å²	173	83.3 Å²	83.3	75%	0.752	47%	0.469	S	S	*	.			trans	-76.8	54.6	176.4	-61.8	-177.3	-179.5	177.2	0	113.5	D254 A287	D254-K256 PolarHBondContact O-N 2.92Å; K256-A287 HydrophobicContact CB-CB 4.13Å; K256-A287 HydrophobicContact CG-CB 4.12Å
257	F	67.6	Low	63.4	Low	78 Å²	78	83.6 Å²	83.6	34%	0.342	46%	0.459	S	S	.	.			trans	-82.8	150.7	170.6	-63.7	-56	0	0	0	111.3	V199 F226 N255	V199-F257 HydrophobicContact CG2-CB 3.69Å; F226-F257 HydrophobicContact CD1-CD1 4.17Å; F226-F257 AromaticContact CD1-CE1 3.74Å; F226-F257 HydrophobicContact CD1-CE1 3.74Å; F226-F257 HydrophobicContact CD1-CZ 4.25Å; F226-F257 HydrophobicContact CE1-CE1 4.19Å; F226-F257 HydrophobicContact CE1-CZ 4.36Å; N255-F257 HydrophobicContact CB-CD2 3.62Å; N255-F257 HydrophobicContact CB-CE2 3.58Å; N255-F257 HydrophobicContact CB-CZ 4.47Å; N255-F257 PolarHBondContact O-N 2.85Å
258	T	81.8	Confident	66.2	Low	33 Å²	33	79 Å²	79	20%	0.202	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.9	173.3	62	0	0	0	0	111.1	I197 Q225 S288	I197-T258 CarbonylContact O-C 3.54Å; I197-T258 WeakPolarHBondContact O-CA 3.44Å; I197-T258 WeakPolarHBondContact O-CB 3.44Å; Q225-T258 PolarHBondContact N-O 3.31Å; Q225-T258 VanDerWaalsContact N-O 3.09Å; T258-S288 WeakPolarHBondContact CG2-OG 3.48Å
259	S	83.5	Confident	69	Low	3 Å²	3	75.4 Å²	75.4	2%	0.021	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	171.3	175.4	-164.6	0	0	0	0	111.7	G196 I197 L221 L222	G196-S259 PolarHBondContact N-O 2.84Å; I197-S259 PolarHBondContact N-O 2.8Å; I197-S259 PolarHBondContact O-N 2.96Å; L221-S259 WeakPolarHBondContact CD2-OG 3.4Å; L222-S259 PolarHBondContact O-OG 3.21Å
260	S	89.1	Confident	72	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.014	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	158.1	173.1	-60.1	0	0	0	0	109.4	V194 T195 L222 Q225	V194-S260 CarbonylContact O-C 3.57Å; V194-S260 WeakPolarHBondContact O-CA 3.48Å; V194-S260 WeakPolarHBondContact O-CB 3.03Å; T195-S260 WeakPolarHBondContact CG2-OG 3.4Å; L222-S260 WeakPolarHBondContact CB-O 3.38Å; L222-S260 PolarHBondContact N-O 3.02Å; Q225-S260 PolarHBondContact NE2-OG 2.78Å
261	A	92.1	Very high	75	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.6	178.8	0	0	0	0	0	112.2	I193 V194 I197 L206 R220	I193-A261 WeakPolarHBondContact CA-O 3.49Å; V194-A261 HydrophobicContact CB-CB 4.48Å; V194-A261 PolarHBondContact N-O 3.08Å; V194-A261 PolarHBondContact O-N 3.24Å; I197-A261 HydrophobicContact CD1-CB 3.46Å; I197-A261 VanDerWaalsContact CD1-CB 3.46Å; L206-A261 HydrophobicContact CD1-CB 3.54Å; R220-A261 CarbonylContact O-C 3.58Å; R220-A261 WeakPolarHBondContact O-CA 3.48Å; R220-A261 VanDerWaalsContact O-CB 3.29Å; R220-A261 WeakPolarHBondContact O-CB 3.47Å
262	S	92.4	Very high	78	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	135	161	166.9	0	0	0	0	108.6	E191 I219 R220	E191-S262 VanDerWaalsContact OE1-CB 3.3Å; E191-S262 WeakPolarHBondContact OE1-CB 3.14Å; E191-S262 PolarHBondContact OE1-OG 3.5Å; I219-S262 CarbonylContact C-O 3.49Å; I219-S262 WeakPolarHBondContact CA-O 3.47Å; R220-S262 PolarHBondContact N-O 3.47Å; R220-S262 PolarHBondContact O-N 3.36Å
263	V	93.9	Very high	80.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	119.7	173.6	176.6	0	0	0	0	108.2	E191 I192 V194 F210 V216 I219 F265	E191-V263 WeakPolarHBondContact CA-O 3.17Å; I192-V263 HydrophobicContact CD1-CB 4.09Å; I192-V263 HydrophobicContact CD1-CG1 4.41Å; I192-V263 HydrophobicContact CG1-CB 3.7Å; I192-V263 HydrophobicContact CG1-CG1 4.33Å; I192-V263 WeakPolarHBondContact CG1-O 3.32Å; I192-V263 PolarHBondContact N-O 2.95Å; I192-V263 PolarHBondContact O-N 3.32Å; V194-V263 HydrophobicContact CG2-CG2 4Å; F210-V263 HydrophobicContact CB-CG1 4.08Å; F210-V263 HydrophobicContact CD1-CG1 4.36Å; F210-V263 HydrophobicContact CD2-CG1 4.27Å; F210-V263 HydrophobicContact CD2-CG2 3.86Å; F210-V263 HydrophobicContact CE2-CG2 4Å; F210-V263 HydrophobicContact CG-CG1 3.97Å; F210-V263 HydrophobicContact CG-CG2 4.39Å; V216-V263 HydrophobicContact CG1-CG1 3.92Å; V216-V263 HydrophobicContact CG2-CG1 4.4Å; I219-V263 HydrophobicContact CD1-CG1 4.27Å; I219-V263 HydrophobicContact CD1-CG2 4.06Å; I219-V263 HydrophobicContact CG1-CB 4.43Å; I219-V263 HydrophobicContact CG1-CG1 4.13Å; I219-V263 HydrophobicContact CG1-CG2 4.01Å; I219-V263 HydrophobicContact CG2-CG2 4.17Å; V263-F265 HydrophobicContact CG1-CD2 4.2Å; V263-F265 HydrophobicContact CG1-CE2 3.83Å; V263-F265 HydrophobicContact CG1-CZ 4.43Å
264	I	93.8	Very high	83.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.4	-178.8	-57.4	-174.3	0	0	0	109.1	I187 W190 E191 V216 V217 V218 V298 Y303	I187-I264 HydrophobicContact CG2-CD1 3.81Å; W190-I264 WeakPolarHBondContact O-CA 3.42Å; E191-I264 HydrophobicContact CB-CG1 4.01Å; E191-I264 HydrophobicContact CG-CG1 4.17Å; V216-I264 CarbonylContact C-O 3.56Å; V217-I264 HydrophobicContact CB-CG2 4.22Å; V217-I264 HydrophobicContact CG2-CG2 4.47Å; V217-I264 PolarHBondContact N-O 2.72Å; V218-I264 HydrophobicContact CB-CB 4.44Å; V218-I264 HydrophobicContact CB-CD1 4.5Å; V218-I264 PolarHBondContact O-N 2.9Å; I264-V298 HydrophobicContact CD1-CB 4.3Å; I264-V298 HydrophobicContact CD1-CG1 4.07Å; I264-V298 HydrophobicContact CD1-CG2 4.3Å; I264-Y303 HydrophobicContact CD1-CD2 3.69Å; I264-Y303 HydrophobicContact CD1-CE2 3.56Å
265	F	94.7	Very high	86.3	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	151.4	171.6	-77.8	-86.6	0	0	0	111.8	G189 W190 I192 F210 F213 A215 V216 V263 E267 N270 A271 S274	G189-F265 CarbonylContact C-O 3.58Å; G189-F265 WeakPolarHBondContact CA-O 3.25Å; W190-F265 PolarHBondContact N-O 3.36Å; W190-F265 PolarHBondContact O-N 2.63Å; I192-F265 HydrophobicContact CD1-CE2 4.15Å; F210-F265 HydrophobicContact CB-CZ 3.87Å; F210-F265 AromaticContact CD1-CE2 3.98Å; F210-F265 HydrophobicContact CD1-CE2 3.98Å; F210-F265 AromaticContact CD1-CZ 3.84Å; F210-F265 HydrophobicContact CD1-CZ 3.84Å; F210-F265 HydrophobicContact CG-CZ 4.3Å; F210-F265 WeakPolarHBondContact O-CE1 3.46Å; F210-F265 WeakPolarHBondContact O-CZ 3.21Å; F213-F265 HydrophobicContact CB-CE1 3.8Å; F213-F265 HydrophobicContact CB-CZ 3.85Å; A215-F265 WeakPolarHBondContact O-CA 3.16Å; A215-F265 WeakPolarHBondContact O-CD1 3.26Å; V216-F265 HydrophobicContact CG2-CD1 3.93Å; V216-F265 HydrophobicContact CG2-CE1 3.58Å; V216-F265 HydrophobicContact CG2-CZ 4Å; V263-F265 HydrophobicContact CG1-CD2 4.2Å; V263-F265 HydrophobicContact CG1-CE2 3.83Å; V263-F265 HydrophobicContact CG1-CZ 4.43Å; F265-E267 VanDerWaalsContact C-N 3.29Å; F265-E267 PolarHBondContact O-N 3.19Å; F265-N270 HydrophobicContact CB-CB 4.31Å; F265-N270 HydrophobicContact CD1-CB 3.57Å; F265-N270 HydrophobicContact CE1-CB 4.12Å; F265-N270 HydrophobicContact CG-CB 4.1Å; F265-A271 HydrophobicContact CB-CB 4.07Å; F265-A271 HydrophobicContact CD2-CB 3.83Å; F265-A271 HydrophobicContact CG-CB 4.22Å; F265-S274 WeakPolarHBondContact CE2-OG 3.45Å
266	Q	90.2	Very high	88.6	Confident	125 Å²	125	50.1 Å²	50.1	58%	0.584	24%	0.244	S	C	*	.	S	Bend	trans	-69.2	-29.5	175.7	-170	175.7	-3	0	0	112.2	A215 V217	A215-Q266 HydrophobicContact CB-CB 4.02Å; A215-Q266 PolarHBondContact O-N 3.44Å; V217-Q266 HydrophobicContact CG2-CB 3.85Å; V217-Q266 HydrophobicContact CG2-CG 4.47Å
267	E	89	Confident	90.2	Very high	110 Å²	110	48.9 Å²	48.9	51%	0.514	24%	0.235	S	C	.	.	S	Bend	trans	-127.9	142.2	-175.9	-52.6	179.5	130.5	0	0	111.8	F265 N269 N270 A271	F265-E267 VanDerWaalsContact C-N 3.29Å; F265-E267 PolarHBondContact O-N 3.19Å; E267-N269 VanDerWaalsContact C-N 3.3Å; E267-N269 PolarHBondContact O-N 2.87Å; E267-N270 PolarHBondContact O-N 2.96Å; E267-N270 VanDerWaalsContact O-N 3.15Å; E267-N270 PolarHBondContact OE2-ND2 2.85Å; E267-A271 PolarHBondContact O-N 3.46Å
268	K	92.3	Very high	91.3	Very high	76 Å²	76	45.4 Å²	45.4	33%	0.33	22%	0.22	S	C	.	.	H	α-helix	trans	-54	-44.8	179.3	-170.7	176.2	178.3	-78.3	0	112.8	W190 N270 A271 E272	W190-K268 VanDerWaalsContact CD1-N 3.27Å; W190-K268 HydrophobicContact CD2-CB 3.71Å; W190-K268 HydrophobicContact CD2-CD 4.36Å; W190-K268 HydrophobicContact CD2-CG 3.8Å; W190-K268 HydrophobicContact CE3-CB 4.25Å; W190-K268 HydrophobicContact CE3-CD 4.18Å; W190-K268 HydrophobicContact CE3-CG 3.81Å; W190-K268 HydrophobicContact CG-CB 3.97Å; W190-K268 HydrophobicContact CG-CG 4.43Å; W190-K268 HydrophobicContact CH2-CD 3.67Å; W190-K268 HydrophobicContact CH2-CG 4.18Å; W190-K268 HydrophobicContact CZ2-CB 4.1Å; W190-K268 HydrophobicContact CZ2-CD 3.84Å; W190-K268 HydrophobicContact CZ2-CG 4.17Å; W190-K268 HydrophobicContact CZ3-CD 3.84Å; W190-K268 HydrophobicContact CZ3-CG 4Å; K268-N270 PolarHBondContact O-N 3.11Å; K268-A271 PolarHBondContact O-N 3.44Å; K268-E272 HydrophobicContact CG-CG 4.42Å; K268-E272 IonicContact NZ-OE1 3.15Å; K268-E272 PolarHBondContact NZ-OE1 3.32Å; K268-E272 IonicContact NZ-OE2 2.9Å; K268-E272 PolarHBondContact NZ-OE2 3.16Å; K268-E272 WeakPolarHBondContact O-CG 3.44Å; K268-E272 PolarHBondContact O-N 3.21Å
269	N	92.8	Very high	91.7	Very high	104 Å²	104	48 Å²	48	56%	0.556	23%	0.232	S	C	*	.	H	α-helix	trans	-59.5	-36.8	-177.7	-62	-4.3	0	0	0	112	E267 E272 L273	E267-N269 VanDerWaalsContact C-N 3.3Å; E267-N269 PolarHBondContact O-N 2.87Å; N269-E272 PolarHBondContact O-N 3.15Å; N269-L273 VanDerWaalsContact O-CB 3.26Å; N269-L273 WeakPolarHBondContact O-CB 3.45Å; N269-L273 WeakPolarHBondContact O-CD1 3.4Å; N269-L273 WeakPolarHBondContact O-CG 3.28Å; N269-L273 PolarHBondContact O-N 2.96Å
270	N	94.9	Very high	91.8	Very high	20 Å²	20	50.3 Å²	50.3	11%	0.107	26%	0.257	C	S	.	.	H	α-helix	trans	-75	-40	-175.9	-57.5	-17.3	0	0	0	110.2	F213 F265 E267 K268 S274	F213-N270 VanDerWaalsContact O-CB 3.24Å; F213-N270 WeakPolarHBondContact O-CB 3.31Å; F213-N270 PolarHBondContact O-OD1 2.98Å; F265-N270 HydrophobicContact CB-CB 4.31Å; F265-N270 HydrophobicContact CD1-CB 3.57Å; F265-N270 HydrophobicContact CE1-CB 4.12Å; F265-N270 HydrophobicContact CG-CB 4.1Å; E267-N270 PolarHBondContact O-N 2.96Å; E267-N270 VanDerWaalsContact O-N 3.15Å; E267-N270 PolarHBondContact OE2-ND2 2.85Å; K268-N270 PolarHBondContact O-N 3.11Å; N270-S274 WeakPolarHBondContact O-CB 3.38Å; N270-S274 PolarHBondContact O-N 3.08Å
271	A	93.1	Very high	91.6	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.5	-51	168.8	0	0	0	0	0	111.6	W190 I192 F265 E267 K268 L273 S274 V275 L294	W190-A271 HydrophobicContact CB-CB 3.97Å; I192-A271 HydrophobicContact CG2-CB 3.96Å; F265-A271 HydrophobicContact CB-CB 4.07Å; F265-A271 HydrophobicContact CD2-CB 3.83Å; F265-A271 HydrophobicContact CG-CB 4.22Å; E267-A271 PolarHBondContact O-N 3.46Å; K268-A271 PolarHBondContact O-N 3.44Å; A271-L273 PolarHBondContact O-N 2.94Å; A271-S274 PolarHBondContact O-N 3.49Å; A271-S274 VanDerWaalsContact O-N 3.17Å; A271-S274 PolarHBondContact O-OG 3.28Å; A271-V275 WeakPolarHBondContact O-CG2 3.37Å; A271-V275 PolarHBondContact O-N 2.98Å; A271-L294 HydrophobicContact CB-CD1 3.62Å
272	E	92.6	Very high	91.3	Very high	78 Å²	78	58 Å²	58	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-38.8	-179.3	-72.8	-178.9	139.6	0	0	112.9	K268 N269 S274 V275 L276 L294	K268-E272 HydrophobicContact CG-CG 4.42Å; K268-E272 IonicContact NZ-OE1 3.15Å; K268-E272 PolarHBondContact NZ-OE1 3.32Å; K268-E272 IonicContact NZ-OE2 2.9Å; K268-E272 PolarHBondContact NZ-OE2 3.16Å; K268-E272 WeakPolarHBondContact O-CG 3.44Å; K268-E272 PolarHBondContact O-N 3.21Å; N269-E272 PolarHBondContact O-N 3.15Å; E272-S274 VanDerWaalsContact C-N 3.35Å; E272-V275 PolarHBondContact O-N 3.17Å; E272-L276 VanDerWaalsContact O-CB 3.26Å; E272-L276 WeakPolarHBondContact O-CB 3.39Å; E272-L276 PolarHBondContact O-N 2.8Å; E272-L294 HydrophobicContact CG-CD2 3.97Å
273	L	92.2	Very high	90.5	Very high	79 Å²	79	58 Å²	58	41%	0.414	29%	0.29	S	S	.	.	H	α-helix	trans	-64.8	-36.2	173.7	-76.4	168	0	0	0	112.6	F213 N269 A271 L276 R277	F213-L273 HydrophobicContact CD1-CB 4.04Å; F213-L273 WeakPolarHBondContact CE1-O 3.45Å; N269-L273 VanDerWaalsContact O-CB 3.26Å; N269-L273 WeakPolarHBondContact O-CB 3.45Å; N269-L273 WeakPolarHBondContact O-CD1 3.4Å; N269-L273 WeakPolarHBondContact O-CG 3.28Å; N269-L273 PolarHBondContact O-N 2.96Å; A271-L273 PolarHBondContact O-N 2.94Å; L273-L276 PolarHBondContact O-N 3.04Å; L273-R277 PolarHBondContact O-N 3.07Å; L273-R277 VanDerWaalsContact O-N 3.16Å
274	S	93.7	Very high	89.4	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.5	-45.4	176.5	76.8	0	0	0	0	111.9	F213 F265 N270 A271 E272 L276 R277 L278 L292	F213-S274 VanDerWaalsContact CD1-CA 3.41Å; F265-S274 WeakPolarHBondContact CE2-OG 3.45Å; N270-S274 WeakPolarHBondContact O-CB 3.38Å; N270-S274 PolarHBondContact O-N 3.08Å; A271-S274 PolarHBondContact O-N 3.49Å; A271-S274 VanDerWaalsContact O-N 3.17Å; A271-S274 PolarHBondContact O-OG 3.28Å; E272-S274 VanDerWaalsContact C-N 3.35Å; S274-L276 VanDerWaalsContact C-N 3.34Å; S274-L276 PolarHBondContact O-N 3.08Å; S274-R277 PolarHBondContact O-N 2.84Å; S274-L278 WeakPolarHBondContact O-CB 3.36Å; S274-L278 PolarHBondContact O-N 3.32Å; S274-L292 WeakPolarHBondContact O-CD2 3.42Å
275	V	92.8	Very high	88.6	Confident	30 Å²	30	69.4 Å²	69.4	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-58.1	-47.5	172.1	177.2	0	0	0	0	110.2	I192 A271 E272 R277 N279 L292 L294	I192-V275 HydrophobicContact CG2-CG2 3.73Å; A271-V275 WeakPolarHBondContact O-CG2 3.37Å; A271-V275 PolarHBondContact O-N 2.98Å; E272-V275 PolarHBondContact O-N 3.17Å; V275-R277 VanDerWaalsContact C-N 3.26Å; V275-R277 PolarHBondContact O-N 3.1Å; V275-N279 HydrophobicContact CG1-CB 4.38Å; V275-N279 WeakPolarHBondContact O-CB 3.35Å; V275-N279 PolarHBondContact O-N 2.94Å; V275-N279 VanDerWaalsContact O-N 3.15Å; V275-L292 HydrophobicContact CB-CB 4.43Å; V275-L292 HydrophobicContact CG1-CB 4.45Å; V275-L292 HydrophobicContact CG2-CB 4.11Å; V275-L294 HydrophobicContact CG2-CB 4.42Å
276	L	91.2	Very high	87.9	Confident	141 Å²	141	70.1 Å²	70.1	74%	0.738	36%	0.358	S	S	*	.	H	α-helix	trans	-62	-29	-177.4	-170.7	71	0	0	0	113.7	E272 L273 S274	E272-L276 VanDerWaalsContact O-CB 3.26Å; E272-L276 WeakPolarHBondContact O-CB 3.39Å; E272-L276 PolarHBondContact O-N 2.8Å; L273-L276 PolarHBondContact O-N 3.04Å; S274-L276 VanDerWaalsContact C-N 3.34Å; S274-L276 PolarHBondContact O-N 3.08Å
277	R	89.7	Confident	87.1	Confident	147 Å²	147	67.1 Å²	67.1	56%	0.555	35%	0.354	S	S	*	.	H	α-helix	trans	-101.9	-31.5	-177	-68.9	-158.6	178.2	-152.1	-8.1	115.6	F213 L273 S274 V275	F213-R277 HydrophobicContact CE1-CB 3.74Å; F213-R277 HydrophobicContact CE1-CG 3.97Å; F213-R277 HydrophobicContact CZ-CB 3.91Å; L273-R277 PolarHBondContact O-N 3.07Å; L273-R277 VanDerWaalsContact O-N 3.16Å; S274-R277 PolarHBondContact O-N 2.84Å; V275-R277 VanDerWaalsContact C-N 3.26Å; V275-R277 PolarHBondContact O-N 3.1Å
278	L	92	Very high	86.7	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-105.5	-15.9	-173.5	-62.3	175.2	0	0	0	113.5	L209 F210 F213 S274 G280 Y281 L292 V339	L209-L278 HydrophobicContact CD1-CD1 4.04Å; L209-L278 HydrophobicContact CD1-CD2 4.09Å; L209-L278 HydrophobicContact CD2-CD1 3.97Å; L209-L278 HydrophobicContact CG-CD1 3.86Å; F210-L278 HydrophobicContact CD1-CD1 4.18Å; F210-L278 HydrophobicContact CE1-CD1 3.64Å; F210-L278 HydrophobicContact CZ-CD1 4Å; F213-L278 HydrophobicContact CE2-CD1 3.62Å; F213-L278 HydrophobicContact CE2-CG 4.06Å; F213-L278 HydrophobicContact CZ-CD1 3.94Å; F213-L278 HydrophobicContact CZ-CD2 4.4Å; F213-L278 HydrophobicContact CZ-CG 3.85Å; S274-L278 WeakPolarHBondContact O-CB 3.36Å; S274-L278 PolarHBondContact O-N 3.32Å; L278-G280 PolarHBondContact O-N 3.21Å; L278-Y281 VanDerWaalsContact O-CB 3.29Å; L278-Y281 WeakPolarHBondContact O-CB 3.37Å; L278-Y281 PolarHBondContact O-N 3.44Å; L278-L292 HydrophobicContact CB-CD1 3.99Å; L278-L292 HydrophobicContact CB-CD2 3.67Å; L278-L292 HydrophobicContact CD1-CD2 4.33Å; L278-V339 HydrophobicContact CD2-CG1 4.43Å
279	N	89.5	Confident	86.5	Confident	87 Å²	87	61.3 Å²	61.3	47%	0.465	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	117	175.8	-171.1	42	0	0	0	110.4	V275 R291 L292	V275-N279 HydrophobicContact CG1-CB 4.38Å; V275-N279 WeakPolarHBondContact O-CB 3.35Å; V275-N279 PolarHBondContact O-N 2.94Å; V275-N279 VanDerWaalsContact O-N 3.15Å; N279-R291 WeakPolarHBondContact OD1-CA 3.38Å; N279-L292 HydrophobicContact CB-CB 4.17Å; N279-L292 PolarHBondContact OD1-N 3.26Å; N279-L292 PolarHBondContact OD1-O 2.94Å
280	G	85.8	Confident	86.4	Confident	52 Å²	52	56.5 Å²	56.5	54%	0.536	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	1.6	-171.7	0	0	0	0	0	114.8	L278 Q282 L290	L278-G280 PolarHBondContact O-N 3.21Å; G280-Q282 PolarHBondContact O-N 2.82Å; G280-L290 WeakPolarHBondContact CA-O 3.26Å; G280-L290 PolarHBondContact N-O 2.81Å
281	Y	85.8	Confident	86.2	Confident	65 Å²	65	63.5 Å²	63.5	26%	0.255	33%	0.334	S	S	.	.			trans	-73.4	125.2	176.2	-179.8	-102.7	0	0	0	111	L278 A283 W286 P289 L290 V339	L278-Y281 VanDerWaalsContact O-CB 3.29Å; L278-Y281 WeakPolarHBondContact O-CB 3.37Å; L278-Y281 PolarHBondContact O-N 3.44Å; Y281-A283 HydrophobicContact CE1-CB 4.48Å; Y281-W286 AromaticContact CD1-CH2 3.67Å; Y281-W286 HydrophobicContact CD1-CH2 3.67Å; Y281-W286 AromaticContact CD1-CZ3 3.51Å; Y281-W286 HydrophobicContact CD1-CZ3 3.51Å; Y281-W286 AromaticContact CE1-CH2 3.55Å; Y281-W286 HydrophobicContact CE1-CH2 3.55Å; Y281-W286 HydrophobicContact CE1-CZ2 4.32Å; Y281-W286 AromaticContact CE1-CZ3 3.74Å; Y281-W286 HydrophobicContact CE1-CZ3 3.74Å; Y281-P289 WeakPolarHBondContact O-CA 3.35Å; Y281-L290 HydrophobicContact CD1-CD1 4.39Å; Y281-L290 PolarHBondContact O-N 2.85Å; Y281-V339 HydrophobicContact CE1-CG2 4.19Å
282	Q	85.1	Confident	86.3	Confident	97 Å²	97	63.8 Å²	63.8	45%	0.453	34%	0.335	S	S	.	.			trans	-128.9	123.9	174.1	-167.2	168.2	-1.7	0	0	108.6	G280 W286 P289	G280-Q282 PolarHBondContact O-N 2.82Å; Q282-W286 HydrophobicContact CG-CB 4.2Å; Q282-W286 PolarHBondContact NE2-O 2.94Å; Q282-P289 HydrophobicContact CB-CB 3.98Å
283	A	75.5	Confident	86.2	Confident	2 Å²	2	68.5 Å²	68.5	2%	0.017	35%	0.35	C	S	.	.			trans	-76.4	151.1	165.4	0	0	0	0	0	109.7	Y281 E285 W286	Y281-A283 HydrophobicContact CE1-CB 4.48Å; A283-E285 HydrophobicContact CB-CG 4.2Å; A283-E285 WeakPolarHBondContact CB-OE1 3.25Å; A283-E285 PolarHBondContact O-N 2.86Å; A283-E285 VanDerWaalsContact O-N 3.1Å; A283-W286 HydrophobicContact CB-CD2 3.71Å; A283-W286 HydrophobicContact CB-CE3 4.26Å; A283-W286 HydrophobicContact CB-CG 3.91Å; A283-W286 HydrophobicContact CB-CZ2 4.12Å; A283-W286 PolarHBondContact O-N 2.94Å
284	P	71.4	Confident	86.1	Confident	133 Å²	133	67.1 Å²	67.1	86%	0.864	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-34	179.5	-28.4	35.1	0	0	0	114.4
285	E	75.7	Confident	85.8	Confident	106 Å²	106	70.3 Å²	70.3	50%	0.495	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-7	179.9	60.1	-87.5	-161.1	0	0	114.9	A283	A283-E285 HydrophobicContact CB-CG 4.2Å; A283-E285 WeakPolarHBondContact CB-OE1 3.25Å; A283-E285 PolarHBondContact O-N 2.86Å; A283-E285 VanDerWaalsContact O-N 3.1Å
286	W	80.2	Confident	85.3	Confident	16 Å²	16	69.9 Å²	69.9	6%	0.061	36%	0.36	C	S	.	.			trans	-94.2	133.8	-174.9	-64.8	-5.7	0	0	0	113.7	P198 W201 Y281 Q282 A283 S288 L290	P198-W286 HydrophobicContact CG-CD2 3.99Å; P198-W286 HydrophobicContact CG-CG 3.87Å; P198-W286 HydrophobicContact CG-CZ2 4.5Å; W201-W286 HydrophobicContact CH2-CH2 4.48Å; W201-W286 HydrophobicContact CH2-CZ2 4.11Å; W201-W286 HydrophobicContact CZ2-CH2 4.36Å; W201-W286 AromaticContact CZ2-CZ2 3.58Å; W201-W286 HydrophobicContact CZ2-CZ2 3.58Å; Y281-W286 AromaticContact CD1-CH2 3.67Å; Y281-W286 HydrophobicContact CD1-CH2 3.67Å; Y281-W286 AromaticContact CD1-CZ3 3.51Å; Y281-W286 HydrophobicContact CD1-CZ3 3.51Å; Y281-W286 AromaticContact CE1-CH2 3.55Å; Y281-W286 HydrophobicContact CE1-CH2 3.55Å; Y281-W286 HydrophobicContact CE1-CZ2 4.32Å; Y281-W286 AromaticContact CE1-CZ3 3.74Å; Y281-W286 HydrophobicContact CE1-CZ3 3.74Å; Q282-W286 HydrophobicContact CG-CB 4.2Å; Q282-W286 PolarHBondContact NE2-O 2.94Å; A283-W286 HydrophobicContact CB-CD2 3.71Å; A283-W286 HydrophobicContact CB-CE3 4.26Å; A283-W286 HydrophobicContact CB-CG 3.91Å; A283-W286 HydrophobicContact CB-CZ2 4.12Å; A283-W286 PolarHBondContact O-N 2.94Å; W286-S288 PolarHBondContact O-N 3.48Å; W286-S288 VanDerWaalsContact O-N 3.15Å; W286-L290 HydrophobicContact CE3-CG 4.3Å; W286-L290 HydrophobicContact CH2-CD1 3.71Å; W286-L290 HydrophobicContact CH2-CG 4.16Å; W286-L290 HydrophobicContact CZ3-CB 4.49Å; W286-L290 HydrophobicContact CZ3-CD1 3.52Å; W286-L290 HydrophobicContact CZ3-CG 3.53Å
287	A	75.1	Confident	85.1	Confident	61 Å²	61	66.4 Å²	66.4	50%	0.504	35%	0.348	S	S	.	.	S	Bend	trans	-63.6	-17.4	176.5	0	0	0	0	0	114.7	K256	K256-A287 HydrophobicContact CB-CB 4.13Å; K256-A287 HydrophobicContact CG-CB 4.12Å
288	S	78.8	Confident	84.6	Confident	28 Å²	28	59.6 Å²	59.6	20%	0.196	32%	0.322	C	S	.	.	S	Bend	trans	-152.8	156.3	177.3	73.5	0	0	0	0	112.5	G196 T258 W286	G196-S288 WeakPolarHBondContact CA-OG 3.39Å; G196-S288 PolarHBondContact O-OG 3.04Å; T258-S288 WeakPolarHBondContact CG2-OG 3.48Å; W286-S288 PolarHBondContact O-N 3.48Å; W286-S288 VanDerWaalsContact O-N 3.15Å
289	P	88.7	Confident	83.9	Confident	36 Å²	36	61.9 Å²	61.9	23%	0.234	34%	0.337	C	S	.	.			trans	-69.6	141.8	167.1	29.3	-33.5	0	0	0	111.4	Y281 Q282 R291	Y281-P289 WeakPolarHBondContact O-CA 3.35Å; Q282-P289 HydrophobicContact CB-CB 3.98Å; P289-R291 PolarHBondContact O-N 3.17Å
290	L	91.5	Very high	82.9	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.016	34%	0.337	C	S	.	.			trans	-57.2	132.5	166.3	-78.7	173	0	0	0	110.2	V194 T195 I197 L209 G280 Y281 W286 L292	V194-L290 HydrophobicContact CG1-CD2 3.78Å; T195-L290 CarbonylContact O-C 3.58Å; T195-L290 WeakPolarHBondContact O-CA 3.29Å; I197-L290 HydrophobicContact CB-CD2 4.33Å; I197-L290 HydrophobicContact CG1-CD2 3.68Å; L209-L290 HydrophobicContact CD2-CD1 4.28Å; G280-L290 WeakPolarHBondContact CA-O 3.26Å; G280-L290 PolarHBondContact N-O 2.81Å; Y281-L290 HydrophobicContact CD1-CD1 4.39Å; Y281-L290 PolarHBondContact O-N 2.85Å; W286-L290 HydrophobicContact CE3-CG 4.3Å; W286-L290 HydrophobicContact CH2-CD1 3.71Å; W286-L290 HydrophobicContact CH2-CG 4.16Å; W286-L290 HydrophobicContact CZ3-CB 4.49Å; W286-L290 HydrophobicContact CZ3-CD1 3.52Å; W286-L290 HydrophobicContact CZ3-CG 3.53Å; L290-L292 HydrophobicContact CB-CD1 3.81Å
291	R	90.1	Very high	81.4	Confident	167 Å²	167	67.4 Å²	67.4	63%	0.63	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.4	170.7	-61.6	-172.8	-178.2	-165.6	1.5	109.1	V194 T195 N279 P289	V194-R291 CarbonylContact C-O 3.51Å; V194-R291 WeakPolarHBondContact CA-O 3.26Å; T195-R291 PolarHBondContact N-O 3.41Å; T195-R291 PolarHBondContact O-N 3.2Å; N279-R291 WeakPolarHBondContact OD1-CA 3.38Å; P289-R291 PolarHBondContact O-N 3.17Å
292	L	94.9	Very high	80.3	Confident	7 Å²	7	66.2 Å²	66.2	4%	0.037	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.8	-178.1	-76.5	68.5	0	0	0	109.5	I192 I193 V194 F210 S274 V275 L278 N279 L290	I192-L292 HydrophobicContact CD1-CD2 3.96Å; I192-L292 HydrophobicContact CD1-CG 4.39Å; I193-L292 WeakPolarHBondContact O-CA 3.44Å; V194-L292 HydrophobicContact CG1-CD1 3.98Å; V194-L292 HydrophobicContact CG1-CG 4.18Å; V194-L292 HydrophobicContact CG2-CG 4.25Å; F210-L292 HydrophobicContact CE1-CD2 3.67Å; F210-L292 HydrophobicContact CZ-CD2 3.9Å; F210-L292 HydrophobicContact CZ-CG 4.42Å; S274-L292 WeakPolarHBondContact O-CD2 3.42Å; V275-L292 HydrophobicContact CB-CB 4.43Å; V275-L292 HydrophobicContact CG1-CB 4.45Å; V275-L292 HydrophobicContact CG2-CB 4.11Å; L278-L292 HydrophobicContact CB-CD1 3.99Å; L278-L292 HydrophobicContact CB-CD2 3.67Å; L278-L292 HydrophobicContact CD1-CD2 4.33Å; N279-L292 HydrophobicContact CB-CB 4.17Å; N279-L292 PolarHBondContact OD1-N 3.26Å; N279-L292 PolarHBondContact OD1-O 2.94Å; L290-L292 HydrophobicContact CB-CD1 3.81Å
293	R	90.3	Very high	79.1	Confident	176 Å²	176	62.2 Å²	62.2	66%	0.664	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	121	176.9	-177.6	176.8	178.3	176.1	-1.7	110.1	I192 I193 I295	I192-R293 CarbonylContact C-O 3.59Å; I192-R293 VanDerWaalsContact CA-O 3.25Å; I192-R293 WeakPolarHBondContact CA-O 3.26Å; I193-R293 PolarHBondContact N-O 2.98Å; I193-R293 PolarHBondContact O-N 3.31Å; R293-I295 HydrophobicContact CG-CD1 4.26Å; R293-I295 PolarHBondContact O-N 2.78Å
294	L	90.6	Very high	77.9	Confident	50 Å²	50	63.9 Å²	63.9	26%	0.262	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	124.2	165.5	-172.5	74.1	0	0	0	109	W190 I192 A271 E272 V275	W190-L294 HydrophobicContact CB-CD1 4.42Å; W190-L294 HydrophobicContact CE3-CD1 4.48Å; I192-L294 HydrophobicContact CG2-CB 4.46Å; I192-L294 HydrophobicContact CG2-CD1 3.92Å; A271-L294 HydrophobicContact CB-CD1 3.62Å; E272-L294 HydrophobicContact CG-CD2 3.97Å; V275-L294 HydrophobicContact CG2-CB 4.42Å
295	I	88	Confident	76.6	Confident	68 Å²	68	64 Å²	64	35%	0.349	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-47.2	176.3	-55.6	-52.4	0	0	0	109.5	E191 I193 R293	E191-I295 HydrophobicContact CB-CB 4.42Å; E191-I295 HydrophobicContact CG-CB 4.41Å; E191-I295 HydrophobicContact CG-CG1 4.3Å; E191-I295 PolarHBondContact O-N 3.26Å; I193-I295 HydrophobicContact CB-CD1 4.13Å; I193-I295 HydrophobicContact CB-CG1 4.26Å; I193-I295 HydrophobicContact CD1-CD1 3.85Å; I193-I295 HydrophobicContact CD1-CG1 3.94Å; I193-I295 HydrophobicContact CG1-CD1 3.97Å; I193-I295 HydrophobicContact CG1-CG1 3.76Å; R293-I295 HydrophobicContact CG-CD1 4.26Å; R293-I295 PolarHBondContact O-N 2.78Å
296	G	82.3	Confident	75	Confident	20 Å²	20	65.1 Å²	65.1	21%	0.206	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.5	-163.2	175.4	0	0	0	0	0	112.9	W190 E191	W190-G296 CarbonylContact C-O 3.4Å; W190-G296 WeakPolarHBondContact CA-O 3.17Å; E191-G296 PolarHBondContact N-O 2.93Å
297	S	85.6	Confident	73.1	Confident	69 Å²	69	67.6 Å²	67.6	48%	0.483	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.1	171.6	54.7	0	0	0	0	110.5	G189	G189-S297 CarbonylContact O-C 3.5Å; G189-S297 WeakPolarHBondContact O-CA 3.47Å
298	V	80.8	Confident	71	Confident	3 Å²	3	73.7 Å²	73.7	2%	0.018	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133.1	170.8	171.1	0	0	0	0	109.8	I187 I188 G189 E191 I264 Y303	I187-V298 HydrophobicContact CG2-CG1 4.03Å; I188-V298 WeakPolarHBondContact CA-O 3.25Å; G189-V298 PolarHBondContact N-O 2.62Å; G189-V298 PolarHBondContact O-N 3.35Å; E191-V298 HydrophobicContact CB-CG2 3.49Å; E191-V298 VanDerWaalsContact CB-CG2 3.49Å; E191-V298 HydrophobicContact CG-CG2 4.43Å; E191-V298 WeakPolarHBondContact OE2-CG2 3.43Å; I264-V298 HydrophobicContact CD1-CB 4.3Å; I264-V298 HydrophobicContact CD1-CG1 4.07Å; I264-V298 HydrophobicContact CD1-CG2 4.3Å; V298-Y303 HydrophobicContact CG1-CD2 3.93Å; V298-Y303 HydrophobicContact CG1-CG 4.13Å
299	T	75.8	Confident	68.5	Low	53 Å²	53	78.5 Å²	78.5	33%	0.325	39%	0.393	S	S	.	.			trans	-115.9	170.1	166.7	71.8	0	0	0	0	108.9	I187 E301 T302 Y303	I187-T299 CarbonylContact O-C 3.6Å; T299-E301 PolarHBondContact O-N 3.46Å; T299-E301 VanDerWaalsContact O-N 3.08Å; T299-E301 PolarHBondContact OG1-N 3.41Å; T299-T302 PolarHBondContact N-OG1 3.37Å; T299-T302 PolarHBondContact O-N 3.05Å; T299-T302 PolarHBondContact O-OG1 3.33Å; T299-T302 PolarHBondContact OG1-N 3.06Å; T299-T302 PolarHBondContact OG1-OG1 2.65Å; T299-Y303 PolarHBondContact O-N 3.4Å
300	R	68.2	Low	65.6	Low	127 Å²	127	81.6 Å²	81.6	48%	0.479	42%	0.416	S	S	.	.	H	α-helix	trans	-48.6	-34.3	169.8	-178	-176.6	-179.2	171.2	12.8	113	E185 I187	E185-R300 IonicContact OE1-CZ 3.99Å; E185-R300 IonicContact OE1-NH2 3.99Å; E185-R300 PolarHBondContact OE1-NH2 3.04Å; I187-R300 PolarHBondContact O-N 2.95Å
301	E	55.6	Low	62.5	Low	128 Å²	128	93 Å²	93	60%	0.598	46%	0.459	S	S	*	.	H	α-helix	trans	-79.9	-42.2	-177	-62	178.8	135.8	0	0	111.4	T299 L305	T299-E301 PolarHBondContact O-N 3.46Å; T299-E301 VanDerWaalsContact O-N 3.08Å; T299-E301 PolarHBondContact OG1-N 3.41Å; E301-L305 WeakPolarHBondContact O-CG 3.38Å
302	T	63.3	Low	59.4	Low	41 Å²	41	94.5 Å²	94.5	25%	0.252	47%	0.473	S	S	.	.	H	α-helix	trans	-78	-30.3	178.8	53.1	0	0	0	0	113.9	T299 G304 L305 F306	T299-T302 PolarHBondContact N-OG1 3.37Å; T299-T302 PolarHBondContact O-N 3.05Å; T299-T302 PolarHBondContact O-OG1 3.33Å; T299-T302 PolarHBondContact OG1-N 3.06Å; T299-T302 PolarHBondContact OG1-OG1 2.65Å; T302-G304 PolarHBondContact O-N 3.35Å; T302-L305 PolarHBondContact O-N 3.01Å; T302-L305 VanDerWaalsContact O-N 3.13Å; T302-F306 VanDerWaalsContact O-CD2 3.26Å; T302-F306 WeakPolarHBondContact O-CD2 3.16Å; T302-F306 PolarHBondContact O-N 3.22Å
303	Y	58.7	Low	56.1	Low	13 Å²	13	99.8 Å²	99.8	5%	0.051	51%	0.51	C	S	.	.	H	α-helix	trans	-61.5	-32.3	176.8	-166.1	-117	0	0	0	112.7	I187 I264 V298 T299 Y307	I187-Y303 HydrophobicContact CB-CD1 4.47Å; I187-Y303 HydrophobicContact CD1-CD1 3.51Å; I187-Y303 HydrophobicContact CD1-CE1 3.3Å; I187-Y303 HydrophobicContact CD1-CG 4.3Å; I187-Y303 HydrophobicContact CG2-CD1 4.32Å; I187-Y303 HydrophobicContact CG2-CD2 4.22Å; I187-Y303 HydrophobicContact CG2-CG 4.06Å; I264-Y303 HydrophobicContact CD1-CD2 3.69Å; I264-Y303 HydrophobicContact CD1-CE2 3.56Å; V298-Y303 HydrophobicContact CG1-CD2 3.93Å; V298-Y303 HydrophobicContact CG1-CG 4.13Å; T299-Y303 PolarHBondContact O-N 3.4Å; Y303-Y307 HydrophobicContact CD2-CE2 4.5Å; Y303-Y307 HydrophobicContact CE2-CD2 4.33Å; Y303-Y307 AromaticContact CE2-CE2 3.83Å; Y303-Y307 HydrophobicContact CE2-CE2 3.83Å; Y303-Y307 AromaticContact CZ-CE2 3.91Å; Y303-Y307 WeakPolarHBondContact O-CD2 3.31Å
304	G	49.7	Very low	53.1	Low	37 Å²	37	97 Å²	97	38%	0.381	52%	0.515	S	S	.	.	H	α-helix	trans	-73.4	-37	174.4	0	0	0	0	0	113.4	T302 Y307	T302-G304 PolarHBondContact O-N 3.35Å; G304-Y307 PolarHBondContact O-N 3.36Å
305	L	44.3	Very low	50	Low	135 Å²	135	102.6 Å²	102.6	71%	0.707	54%	0.544	S	S	*	.	H	α-helix	trans	-68.5	-39.9	-174.1	-72.6	168.4	0	0	0	112.7	E301 T302 Y307	E301-L305 WeakPolarHBondContact O-CG 3.38Å; T302-L305 PolarHBondContact O-N 3.01Å; T302-L305 VanDerWaalsContact O-N 3.13Å; L305-Y307 PolarHBondContact O-N 3.3Å; L305-Y307 VanDerWaalsContact O-N 3.13Å
306	F	43.2	Very low	47.1	Very low	130 Å²	130	105.4 Å²	105.4	57%	0.57	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-2.4	177.7	-64.7	-61	0	0	0	114.5	T302	T302-F306 VanDerWaalsContact O-CD2 3.26Å; T302-F306 WeakPolarHBondContact O-CD2 3.16Å; T302-F306 PolarHBondContact O-N 3.22Å
307	Y	40.6	Very low	44.5	Very low	67 Å²	67	112 Å²	112	26%	0.263	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.4	1.8	-169.7	-103.2	-76.7	0	0	0	116.6	R220 Y303 G304 L305	R220-Y307 WeakPolarHBondContact CD-OH 3.41Å; R220-Y307 VanDerWaalsContact NH1-CE1 3.28Å; Y303-Y307 HydrophobicContact CD2-CE2 4.5Å; Y303-Y307 HydrophobicContact CE2-CD2 4.33Å; Y303-Y307 AromaticContact CE2-CE2 3.83Å; Y303-Y307 HydrophobicContact CE2-CE2 3.83Å; Y303-Y307 AromaticContact CZ-CE2 3.91Å; Y303-Y307 WeakPolarHBondContact O-CD2 3.31Å; G304-Y307 PolarHBondContact O-N 3.36Å; L305-Y307 PolarHBondContact O-N 3.3Å; L305-Y307 VanDerWaalsContact O-N 3.13Å
308	F	30.5	Very low	41.5	Very low	190 Å²	190	116.4 Å²	116.4	83%	0.833	62%	0.615	S	S	*	*	S	Bend	trans	-104.9	56.4	-175.2	-95.1	-83.3	0	0	0	115.3
309	S	26.8	Very low	38.9	Very low	128 Å²	128	127.3 Å²	127.3	90%	0.895	66%	0.656	S	S	*	*	S	Bend	trans	-141.1	-0.3	171.8	-77.9	0	0	0	0	116.9
310	S	27.1	Very low	36.3	Very low	102 Å²	102	131 Å²	131	71%	0.713	68%	0.678	S	S	*	*	S	Bend	trans	-132.3	21.6	-166.6	56.6	0	0	0	0	116.7
311	R	26.3	Very low	34.4	Very low	243 Å²	243	131.5 Å²	131.5	92%	0.917	70%	0.695	S	S	*	*			trans	-129.2	62	-179.7	-81.2	-166.5	166.9	-145.9	-1.4	115.3
312	Q	25.7	Very low	33	Very low	198 Å²	198	132.4 Å²	132.4	93%	0.925	70%	0.704	S	S	*	*			trans	-147.2	79	160.5	-75.2	-158	1.8	0	0	114.3
313	S	25.3	Very low	31.4	Very low	118 Å²	118	138.3 Å²	138.3	83%	0.825	73%	0.734	S	S	*	*			trans	-166	120.8	147.9	50.7	0	0	0	0	111.3
314	P	26.3	Very low	29.9	Very low	117 Å²	117	145 Å²	145	76%	0.76	77%	0.771	S	S	*	*			trans	-105.7	122.9	176	34.8	-27.6	0	0	0	112.5
315	L	26.9	Very low	29	Very low	168 Å²	168	148.9 Å²	148.9	88%	0.88	79%	0.792	S	S	*	*			trans	-142	110.7	163.4	-77.6	179.2	0	0	0	110.3
316	P	25.4	Very low	28.1	Very low	126 Å²	126	150.4 Å²	150.4	82%	0.818	80%	0.801	S	S	*	*			trans	-85.7	137.7	171.3	33.5	-31.5	0	0	0	110.7
317	L	27.7	Very low	27.5	Very low	158 Å²	158	148.8 Å²	148.8	83%	0.827	81%	0.812	S	S	*	*			trans	-138.7	83.5	176.7	-122.4	160.6	0	0	0	111	R319	L317-R319 PolarHBondContact O-N 2.86Å
318	N	22.8	Very low	26.8	Very low	162 Å²	162	152.8 Å²	152.8	87%	0.866	84%	0.838	S	S	*	*			trans	-64.3	119.8	170.2	-90.5	-16.2	0	0	0	110.5
319	R	26	Very low	26.6	Very low	233 Å²	233	149.5 Å²	149.5	88%	0.879	84%	0.836	S	S	*	*			trans	-139.5	107.2	152.1	-90.2	-167.2	174.8	-178.4	-1.3	111.3	L317	L317-R319 PolarHBondContact O-N 2.86Å
320	T	22.7	Very low	26.6	Very low	131 Å²	131	151.1 Å²	151.1	80%	0.804	83%	0.833	S	S	*	*			trans	-83.1	128.9	168.9	48.5	0	0	0	0	110.8
321	T	28.3	Very low	26.7	Very low	137 Å²	137	152.9 Å²	152.9	84%	0.84	84%	0.84	S	S	*	*			trans	-146.2	125.6	154.8	40.7	0	0	0	0	109.2
322	N	25.6	Very low	26.8	Very low	147 Å²	147	150.2 Å²	150.2	79%	0.786	84%	0.838	S	S	*	*			trans	-67.9	152.1	171.6	-61.7	-23.4	0	0	0	110.6
323	N	29.9	Very low	27.1	Very low	164 Å²	164	144.6 Å²	144.6	88%	0.877	82%	0.821	S	S	*	*				-162.1	146.8	119.2	-100.2	-20.5	0	0	0	111.6
324	N	26.5	Very low	27.4	Very low	155 Å²	155	144.7 Å²	144.7	83%	0.829	81%	0.812	S	S	*	*			trans	-91	139.2	178.1	-64.1	-23.8	0	0	0	110.7
325	S	30.6	Very low	28.1	Very low	118 Å²	118	143.3 Å²	143.3	83%	0.825	80%	0.797	S	S	*	*			trans	-151.8	119.5	153.2	56.3	0	0	0	0	109.4
326	N	26.5	Very low	28.4	Very low	166 Å²	166	138.5 Å²	138.5	89%	0.888	77%	0.772	S	S	*	*			trans	-75.1	143.5	-179.5	-59.8	-22.8	0	0	0	111.4
327	A	29.4	Very low	28.9	Very low	97 Å²	97	135.6 Å²	135.6	80%	0.802	75%	0.752	S	S	*	*			trans	-150.3	144.8	160	0	0	0	0	0	108.9
328	D	26.6	Very low	29.3	Very low	151 Å²	151	134 Å²	134	81%	0.807	74%	0.744	S	S	*	*			trans	-82	150.9	-165.6	-65.9	-72.2	0	0	0	115.2	L330	D328-L330 PolarHBondContact O-N 3.17Å
329	P	26.1	Very low	30.3	Very low	121 Å²	121	128.2 Å²	128.2	79%	0.786	72%	0.715	S	S	*	*			trans	-87.1	98.6	-178.2	33.7	-33.9	0	0	0	112.9
330	L	27	Very low	30.9	Very low	161 Å²	161	121.2 Å²	121.2	84%	0.843	69%	0.694	S	S	*	*			trans	-140.3	48	179.2	-77.4	178.8	0	0	0	115.1	D328	D328-L330 PolarHBondContact O-N 3.17Å
331	T	29.3	Very low	31.5	Very low	139 Å²	139	120.8 Å²	120.8	85%	0.853	69%	0.687	S	S	*	*			trans	-144.2	-0.7	175.9	2.2	0	0	0	0	117.8	S333	T331-S333 PolarHBondContact O-N 3.2Å; T331-S333 VanDerWaalsContact O-N 3.11Å
332	E	28.5	Very low	31.8	Very low	187 Å²	187	125.4 Å²	125.4	87%	0.874	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	88.3	178.4	-69.1	-162.7	132.5	0	0	113.1
333	S	31.4	Very low	32	Very low	81 Å²	81	128.2 Å²	128.2	57%	0.566	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-160.6	-33.2	165	-166.6	0	0	0	0	116	T331 T337	T331-S333 PolarHBondContact O-N 3.2Å; T331-S333 VanDerWaalsContact O-N 3.11Å; S333-T337 PolarHBondContact O-OG1 2.88Å
334	N	32.1	Very low	31.9	Very low	119 Å²	119	126.6 Å²	126.6	64%	0.636	69%	0.685	S	S	*	*	H	α-helix	trans	-87.9	-32.3	-160	-70	-17.1	0	0	0	115.4	T337 N338	N334-T337 PolarHBondContact O-N 3.41Å; N334-N338 PolarHBondContact O-N 2.98Å
335	I	40	Very low	32	Very low	88 Å²	88	127.2 Å²	127.2	45%	0.451	69%	0.688	S	S	.	*	H	α-helix	trans	-64.9	-55.8	-172.2	-56.8	176.2	0	0	0	111.1	T337 N338	I335-T337 VanDerWaalsContact C-N 3.28Å; I335-T337 PolarHBondContact O-N 3.02Å; I335-N338 PolarHBondContact O-N 3.04Å
336	L	34.3	Very low	31.8	Very low	68 Å²	68	128.8 Å²	128.8	36%	0.356	69%	0.686	S	S	.	*	H	α-helix	trans	-59.7	-36	177.5	-95.6	160.8	0	0	0	113	N338 V339	L336-N338 VanDerWaalsContact C-N 3.3Å; L336-N338 PolarHBondContact O-N 3.3Å; L336-V339 WeakPolarHBondContact O-CB 3.14Å; L336-V339 PolarHBondContact O-N 3.07Å
337	T	35.4	Very low	31.9	Very low	64 Å²	64	127.1 Å²	127.1	39%	0.393	68%	0.683	S	S	.	*	H	α-helix	trans	-65.3	-33.1	-178.8	-57.4	0	0	0	0	112.3	S333 N334 I335 N341	S333-T337 PolarHBondContact O-OG1 2.88Å; N334-T337 PolarHBondContact O-N 3.41Å; I335-T337 VanDerWaalsContact C-N 3.28Å; I335-T337 PolarHBondContact O-N 3.02Å; T337-N341 PolarHBondContact O-ND2 2.9Å; T337-N341 VanDerWaalsContact O-ND2 3.14Å
338	N	37.3	Very low	31.9	Very low	124 Å²	124	131.2 Å²	131.2	66%	0.663	69%	0.69	S	S	*	*	H	α-helix	trans	-71.5	-26.6	176.1	-75.3	-26.9	0	0	0	113.5	N334 I335 L336	N334-N338 PolarHBondContact O-N 2.98Å; I335-N338 PolarHBondContact O-N 3.04Å; L336-N338 VanDerWaalsContact C-N 3.3Å; L336-N338 PolarHBondContact O-N 3.3Å
339	V	44	Very low	31.9	Very low	42 Å²	42	127.4 Å²	127.4	26%	0.255	69%	0.686	S	S	.	*	H	α-helix	trans	-69	-33.5	177.6	-178.4	0	0	0	0	111.8	L209 L278 Y281 L336	L209-V339 HydrophobicContact CD1-CG1 4.01Å; L278-V339 HydrophobicContact CD2-CG1 4.43Å; Y281-V339 HydrophobicContact CE1-CG2 4.19Å; L336-V339 WeakPolarHBondContact O-CB 3.14Å; L336-V339 PolarHBondContact O-N 3.07Å
340	L	36.9	Very low	31.9	Very low	85 Å²	85	128 Å²	128	45%	0.445	69%	0.692	S	S	.	*	H	α-helix	trans	-89.5	-23	-164.3	-65.4	170.8	0	0	0	115	N212 R342	N212-L340 HydrophobicContact CB-CD2 4.42Å; L340-R342 PolarHBondContact O-N 2.78Å
341	N	36.5	Very low	31.7	Very low	122 Å²	122	124.9 Å²	124.9	65%	0.652	69%	0.689	S	S	*	*			trans	-85.3	0.1	-162.1	-81.5	-37.2	0	0	0	117.4	T337 R343	T337-N341 PolarHBondContact O-ND2 2.9Å; T337-N341 VanDerWaalsContact O-ND2 3.14Å; N341-R343 PolarHBondContact O-N 2.85Å; N341-R343 VanDerWaalsContact O-N 3.15Å
342	R	33.1	Very low	31.7	Very low	235 Å²	235	125.1 Å²	125.1	89%	0.887	69%	0.691	S	S	*	*			trans	-87.9	59.4	178.2	-77	-168.1	172.1	-164.2	-0.4	113.9	L340	L340-R342 PolarHBondContact O-N 2.78Å
343	R	30.8	Very low	31.5	Very low	205 Å²	205	125.1 Å²	125.1	77%	0.774	69%	0.69	S	S	*	*			trans	-105.4	31.6	-178.3	-116.1	-173.1	-172.1	-177.6	5.4	115.7	N341	N341-R343 PolarHBondContact O-N 2.85Å; N341-R343 VanDerWaalsContact O-N 3.15Å
344	T	27.8	Very low	31.4	Very low	130 Å²	130	124.8 Å²	124.8	80%	0.798	70%	0.699	S	S	*	*			trans	-148.6	162.2	170.7	31.5	0	0	0	0	112.1
345	L	28.6	Very low	31.1	Very low	169 Å²	169	127 Å²	127	89%	0.885	71%	0.711	S	S	*	*			trans	83.4	78.7	179.9	-58.5	170.7	0	0	0	117.1
346	N	26.7	Very low	30.7	Very low	150 Å²	150	128.2 Å²	128.2	80%	0.802	73%	0.728	S	S	*	*			trans	-89.5	165.1	138.4	-99.9	-20.2	0	0	0	109.1
347	T	27.5	Very low	30.5	Very low	132 Å²	132	132.7 Å²	132.7	81%	0.81	75%	0.747	S	S	*	*	S	Bend	trans	52	86.9	169.9	50.2	0	0	0	0	117
348	L	30.4	Very low	30.2	Very low	182 Å²	182	135.4 Å²	135.4	95%	0.953	76%	0.759	S	S	*	*				-172.6	139.6	120.7	-100.4	158.4	0	0	0	109.2
349	G	25.5	Very low	29.8	Very low	71 Å²	71	136.1 Å²	136.1	73%	0.732	76%	0.758	S	S	*	*			trans	-104.7	127.9	175.9	0	0	0	0	0	110.8
350	C	26.9	Very low	29.1	Very low	134 Å²	134	143.4 Å²	143.4	91%	0.905	78%	0.783	S	S	*	*			trans	-153	135	162.7	-115.6	0	0	0	0	108.6
351	A	23.2	Very low	28.8	Very low	95 Å²	95	144.7 Å²	144.7	79%	0.785	79%	0.794	S	S	*	*			trans	-90.7	156	166.2	0	0	0	0	0	109.9
352	V	28.2	Very low	28.5	Very low	145 Å²	145	145 Å²	145	88%	0.879	80%	0.8	S	S	*	*			trans	177	148.5	142.1	143.2	0	0	0	0	109.4
353	H	24.8	Very low	28.4	Very low	187 Å²	187	140.5 Å²	140.5	87%	0.866	79%	0.789	S	S	*	*			trans	-75.6	158.7	176.2	-73.9	-83.8	0	0	0	113.3
354	G	28.5	Very low	28.4	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	79%	0.786	S	S	*	*			trans	-159.1	113.8	163.5	0	0	0	0	0	111.6
355	N	26.1	Very low	28.6	Very low	164 Å²	164	137.1 Å²	137.1	88%	0.877	78%	0.779	S	S	*	*			trans	-99.4	144.3	-178.3	-90.3	-5.4	0	0	0	112.5
356	S	31.5	Very low	28.7	Very low	115 Å²	115	136.4 Å²	136.4	80%	0.804	78%	0.776	S	S	*	*			trans	-175.2	140.9	159.6	46.8	0	0	0	0	110.1
357	Q	29.8	Very low	29	Very low	162 Å²	162	134.7 Å²	134.7	76%	0.757	78%	0.776	S	S	*	*			cis	-167.8	160.7	-17.8	-144.9	-177.8	20.7	0	0	109
358	N	30.3	Very low	28.9	Very low	121 Å²	121	137.3 Å²	137.3	65%	0.647	78%	0.779	S	S	*	*			trans	71.8	147.7	163.3	-53.4	-33.1	0	0	0	116.4
359	Q	29.3	Very low	28.9	Very low	138 Å²	138	135.6 Å²	135.6	65%	0.645	78%	0.775	S	S	*	*			cis	-161.8	159.9	1	-132.5	168.4	4	0	0	112.7
360	Y	29.2	Very low	29	Very low	196 Å²	196	136 Å²	136	77%	0.769	77%	0.772	S	S	*	*			trans	67.8	140.4	168.6	-59.5	-70.1	0	0	0	118.9
361	V	29.4	Very low	29.1	Very low	112 Å²	112	136.8 Å²	136.8	68%	0.679	77%	0.766	S	S	*	*			cis	-162.1	148.5	-23.4	88.4	0	0	0	0	111.3
362	T	30.5	Very low	29.2	Very low	128 Å²	128	138.6 Å²	138.6	79%	0.785	76%	0.763	S	S	*	*			trans	50.5	137.2	168.4	54.7	0	0	0	0	120.2
363	E	30.5	Very low	29.2	Very low	141 Å²	141	138.2 Å²	138.2	66%	0.659	76%	0.761	S	S	*	*			cis	-146.5	-154.1	-25.7	-142	-145.4	110.9	0	0	105.2	K365	E363-K365 PolarHBondContact OE1-N 2.86Å; E363-K365 VanDerWaalsContact OE1-N 3.1Å
364	T	31.9	Very low	29.3	Very low	115 Å²	115	133.3 Å²	133.3	71%	0.706	75%	0.752	S	S	*	*			cis	-148.8	143.7	15.9	-31.9	0	0	0	0	112.4
365	K	31.6	Very low	29.2	Very low	148 Å²	148	136.1 Å²	136.1	64%	0.643	75%	0.754	S	S	*	*			trans	14	120.6	157.8	-70.3	162.4	-167	168.3	0	121.6	E363	E363-K365 PolarHBondContact OE1-N 2.86Å; E363-K365 VanDerWaalsContact OE1-N 3.1Å
366	N	31.2	Very low	29.3	Very low	155 Å²	155	136.4 Å²	136.4	83%	0.829	75%	0.75	S	S	*	*				67	139	125.5	-56.5	4	0	0	0	119.9
367	S	32.8	Very low	29.2	Very low	114 Å²	114	135.8 Å²	135.8	80%	0.797	75%	0.746	S	S	*	*			cis	-154.8	143.9	0.4	48.2	0	0	0	0	112.1
368	E	25.7	Very low	29.2	Very low	187 Å²	187	133.6 Å²	133.6	87%	0.874	75%	0.749	S	S	*	*			trans	-74.9	161.5	167.1	-54.9	173.9	115.6	0	0	112.2
369	V	30.3	Very low	29.2	Very low	145 Å²	145	131.2 Å²	131.2	88%	0.879	75%	0.753	S	S	*	*				-159.2	142.1	120.6	154.1	0	0	0	0	107.1
370	A	26.8	Very low	29.2	Very low	80 Å²	80	129.9 Å²	129.9	66%	0.661	76%	0.759	S	S	*	*			trans	-113.1	168.6	173.6	0	0	0	0	0	111.3
371	L	29	Very low	29.4	Very low	151 Å²	151	127.5 Å²	127.5	79%	0.791	76%	0.758	S	S	*	*			trans	156.2	121.4	131.8	-82.5	160.9	0	0	0	114.8
372	N	25.9	Very low	29.5	Very low	133 Å²	133	129.7 Å²	129.7	71%	0.711	76%	0.761	S	S	*	*				43.1	122.9	126.2	-65.9	-0.2	0	0	0	124.2
373	V	27	Very low	29.6	Very low	137 Å²	137	131.2 Å²	131.2	83%	0.83	76%	0.764	S	S	*	*				83.1	146.7	123.2	174.3	0	0	0	0	120.4
374	A	28.6	Very low	29.8	Very low	84 Å²	84	129.9 Å²	129.9	69%	0.694	77%	0.767	S	S	*	*			trans	70	133.2	178	0	0	0	0	0	115.7
375	V	25.7	Very low	30	Very low	133 Å²	133	129.1 Å²	129.1	81%	0.806	77%	0.766	S	S	*	*			cis	89.2	135.6	30.3	-179.5	0	0	0	0	113.6
376	E	28.3	Very low	30.1	Very low	170 Å²	170	129.5 Å²	129.5	79%	0.794	78%	0.776	S	S	*	*			trans	80.6	79.2	171.4	-83.2	168.8	-142.4	0	0	121.9
377	S	28.3	Very low	30.6	Very low	102 Å²	102	126.8 Å²	126.8	71%	0.713	77%	0.766	S	S	*	*				72.4	148.4	115.9	86.6	0	0	0	0	124.3
378	S	30.5	Very low	30.7	Very low	116 Å²	116	127.8 Å²	127.8	81%	0.811	76%	0.762	S	S	*	*			trans	89.5	127.1	144.9	-52.3	0	0	0	0	121.4
379	G	30.9	Very low	31.2	Very low	71 Å²	71	127.2 Å²	127.2	73%	0.732	76%	0.757	S	S	*	*			trans	89.2	107.2	162.7	0	0	0	0	0	115.9
380	S	29.3	Very low	31.2	Very low	110 Å²	110	123.2 Å²	123.2	77%	0.769	75%	0.746	S	S	*	*			cis	99.5	113.4	37.3	73	0	0	0	0	114.2
381	L	32.8	Very low	31.5	Very low	145 Å²	145	126.8 Å²	126.8	76%	0.759	75%	0.752	S	S	*	*				170	126.9	128.2	-89.8	159.9	0	0	0	114.2
382	Q	32.5	Very low	31.5	Very low	159 Å²	159	125 Å²	125	74%	0.743	75%	0.75	S	S	*	*			trans	45	118.2	148	-66.3	161.6	-7.2	0	0	120.8
383	L	32	Very low	32	Very low	159 Å²	159	124.6 Å²	124.6	83%	0.832	75%	0.754	S	S	*	*				72.5	149.4	63.1	-74.2	168.6	0	0	0	115
384	P	35.5	Very low	32.2	Very low	113 Å²	113	129.6 Å²	129.6	73%	0.734	76%	0.758	S	S	*	*			cis	-113.5	-149.4	4.6	45.3	-33.2	0	0	0	111.8
385	S	36.2	Very low	32.4	Very low	99 Å²	99	131 Å²	131	69%	0.692	76%	0.76	S	S	*	*			cis	-158.6	128.2	0.5	48.1	0	0	0	0	114
386	N	33.6	Very low	32.6	Very low	156 Å²	156	132.1 Å²	132.1	83%	0.834	76%	0.76	S	S	*	*				38.8	154.2	124.9	-77.8	10.9	0	0	0	125.2
387	P	40	Very low	32.7	Very low	98 Å²	98	132.7 Å²	132.7	64%	0.636	77%	0.765	S	S	*	*			cis	-147.9	-177.4	-25.6	41.2	-22.5	0	0	0	117.9
388	L	35.5	Very low	32.7	Very low	135 Å²	135	138.7 Å²	138.7	71%	0.707	77%	0.772	S	S	*	*			trans	71.6	142.1	170.8	-86.5	52.9	0	0	0	114.8
389	F	35.8	Very low	32.8	Very low	175 Å²	175	140 Å²	140	77%	0.768	77%	0.77	S	S	*	*			cis	-132.7	178.2	-8.4	-95.5	-61.7	0	0	0	108
390	G	30.8	Very low	32.8	Very low	62 Å²	62	145.6 Å²	145.6	64%	0.639	77%	0.774	S	S	*	*			cis	114	136.4	7.8	0	0	0	0	0	112.2
391	I	32.8	Very low	32.9	Very low	155 Å²	155	146 Å²	146	80%	0.795	77%	0.771	S	S	*	*			cis	-146.9	115.3	-3.4	-49.6	176.3	0	0	0	109.9
392	P	30.6	Very low	32.9	Very low	114 Å²	114	144.6 Å²	144.6	74%	0.74	77%	0.769	S	S	*	*			trans	-98.1	-177.1	175.9	39.7	-35	0	0	0	112.9
393	P	36.2	Very low	32.9	Very low	123 Å²	123	142.8 Å²	142.8	80%	0.799	77%	0.765	S	S	*	*			trans	-95.7	168.7	-149.4	38.2	-38.7	0	0	0	117.3
394	R	30.4	Very low	33.2	Very low	242 Å²	242	142 Å²	142	91%	0.913	76%	0.756	S	S	*	*			trans	-150.4	150	167.5	-72.4	-164.8	175.9	-161.6	-1.4	114.6
395	P	33.9	Very low	33.1	Very low	115 Å²	115	142.8 Å²	142.8	75%	0.747	75%	0.754	S	S	*	*			trans	-112.6	-175	169.8	40.4	-31.9	0	0	0	114.5
396	I	28.1	Very low	32.9	Very low	155 Å²	155	144.5 Å²	144.5	80%	0.795	76%	0.755	S	S	*	*			trans	83.1	123	164.8	-55.7	162.5	0	0	0	118
397	M	32	Very low	32.6	Very low	183 Å²	183	142.3 Å²	142.3	90%	0.901	75%	0.748	S	S	*	*				-170.4	171.5	122.3	-99.1	-162.2	80.8	0	0	113
398	R	27.5	Very low	32.1	Very low	228 Å²	228	142.8 Å²	142.8	86%	0.86	75%	0.753	S	S	*	*			trans	-119.7	155	-166.3	-73.5	172.4	160.7	150.1	-9.4	114.2
399	N	33.3	Very low	31.8	Very low	144 Å²	144	143.6 Å²	143.6	77%	0.77	76%	0.756	S	S	*	*			trans	-161.1	132.6	134.2	-94.7	-34	0	0	0	108.3
400	K	29.2	Very low	31.3	Very low	187 Å²	187	143.7 Å²	143.7	81%	0.813	76%	0.757	S	S	*	*				57.1	126.8	80.7	-71	-168.2	168.5	-172.4	0	112.2
401	V	33.4	Very low	31.2	Very low	119 Å²	119	147.1 Å²	147.1	72%	0.721	76%	0.76	S	S	*	*				-167.5	131.1	67.3	151.1	0	0	0	0	111.6
402	T	32.7	Very low	30.9	Very low	116 Å²	116	149.4 Å²	149.4	71%	0.712	76%	0.759	S	S	*	*			trans	46.9	151.4	149.1	67.5	0	0	0	0	122.6
403	D	32.4	Very low	30.7	Very low	121 Å²	121	150 Å²	150	65%	0.647	76%	0.756	S	S	*	*			cis	-163.6	173.5	-2	-128.4	-50.9	0	0	0	116.1
404	H	37.5	Very low	30.3	Very low	142 Å²	142	151 Å²	151	66%	0.657	76%	0.76	S	S	*	*			trans	79.3	117.4	145.3	-71.9	2.7	0	0	0	123.9
405	N	32.7	Very low	30	Very low	129 Å²	129	147.1 Å²	147.1	69%	0.69	76%	0.756	S	S	*	*			trans	76.4	142.1	131	-60.1	-11.8	0	0	0	121
406	L	32.7	Very low	29.8	Very low	135 Å²	135	146.7 Å²	146.7	71%	0.707	76%	0.756	S	S	*	*			cis	-155.9	132.7	-8.6	-111.2	168	0	0	0	112
407	T	27	Very low	29.7	Very low	111 Å²	111	147.2 Å²	147.2	68%	0.681	76%	0.755	S	S	*	*			trans	16.7	149.5	151.1	56.5	0	0	0	0	125
408	S	30.2	Very low	29.6	Very low	107 Å²	107	144.9 Å²	144.9	75%	0.748	75%	0.751	S	S	*	*			trans	89.4	151.6	142.4	86.5	0	0	0	0	118.4
409	I	29.6	Very low	29.7	Very low	152 Å²	152	138.7 Å²	138.7	78%	0.779	74%	0.743	S	S	*	*			cis	-155.5	166	-16.3	-117.7	168	0	0	0	109.8
410	F	25	Very low	29.4	Very low	178 Å²	178	135.9 Å²	135.9	78%	0.781	74%	0.735	S	S	*	*			trans	-40.5	139.4	171	-62.3	-106.2	0	0	0	115.8
411	N	28.5	Very low	29.4	Very low	133 Å²	133	134.8 Å²	134.8	71%	0.711	74%	0.737	S	S	*	*				176	147.1	97.6	-97.1	-67.9	0	0	0	115.5
412	R	27.1	Very low	29.3	Very low	204 Å²	204	135 Å²	135	77%	0.77	73%	0.734	S	S	*	*			trans	39.6	134.3	140.9	-70.1	-173.5	128.4	132.7	3.8	123.8
413	D	24.7	Very low	29.1	Very low	125 Å²	125	135 Å²	135	67%	0.668	73%	0.733	S	S	*	*				41.9	118.8	122	-37.2	-30.2	0	0	0	119.8
414	V	29.1	Very low	28.9	Very low	146 Å²	146	136.5 Å²	136.5	89%	0.885	74%	0.741	S	S	*	*				-164	150.4	117.3	135.7	0	0	0	0	111.2
415	L	24.6	Very low	28.5	Very low	160 Å²	160	136.2 Å²	136.2	84%	0.838	74%	0.744	S	S	*	*			trans	-82.9	179.2	-179.8	-76.1	150.9	0	0	0	112.8
416	S	28.1	Very low	28.4	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	75%	0.752	S	S	*	*			trans	88.7	146.1	167.4	86.5	0	0	0	0	115.9
417	Q	26.8	Very low	28.2	Very low	167 Å²	167	140.3 Å²	140.3	78%	0.78	76%	0.757	S	S	*	*			cis	-163.7	174.9	-11.9	-119.3	170.5	18.8	0	0	109.4
418	T	28.8	Very low	28.3	Very low	133 Å²	133	142.5 Å²	142.5	82%	0.816	76%	0.764	S	S	*	*			trans	67.3	147.2	171.3	68.1	0	0	0	0	116.9
419	S	30.3	Very low	28.4	Very low	99 Å²	99	141 Å²	141	69%	0.692	77%	0.765	S	S	*	*			cis	-164.4	157.6	-15.4	43.1	0	0	0	0	111.2
420	S	27.2	Very low	28.6	Very low	85 Å²	85	142.1 Å²	142.1	59%	0.594	77%	0.767	S	S	*	*			trans	-1.9	136.8	154.8	57.9	0	0	0	0	118.2
421	L	30.1	Very low	28.9	Very low	164 Å²	164	140.7 Å²	140.7	86%	0.859	76%	0.762	S	S	*	*				-163.7	166.6	60.2	-76.2	166.4	0	0	0	111.2
422	D	30.1	Very low	29	Very low	123 Å²	123	140.7 Å²	140.7	66%	0.658	76%	0.762	S	S	*	*			cis	-171.4	-165	-41.1	-125.3	100.3	0	0	0	111.2
423	V	29.9	Very low	29.1	Very low	115 Å²	115	137.8 Å²	137.8	70%	0.697	76%	0.761	S	S	*	*			trans	0.5	120.7	159.6	179.9	0	0	0	0	118.4
424	L	27.7	Very low	29.4	Very low	154 Å²	154	139.3 Å²	139.3	81%	0.806	77%	0.769	S	S	*	*				73.2	153.4	68.8	-96.1	170.9	0	0	0	116.9
425	D	28.1	Very low	29.5	Very low	136 Å²	136	137.9 Å²	137.9	73%	0.727	77%	0.766	S	S	*	*			trans	59.8	120.2	176	-61.9	-18.5	0	0	0	119.9
426	F	30.5	Very low	29.8	Very low	197 Å²	197	136.7 Å²	136.7	86%	0.864	77%	0.767	S	S	*	*				-160.8	117.8	125.5	-117.9	-73.6	0	0	0	111.6
427	L	28.9	Very low	29.9	Very low	153 Å²	153	135 Å²	135	80%	0.801	77%	0.767	S	S	*	*			trans	-132.2	139.8	162.1	-88.1	173.1	0	0	0	107.5
428	D	29.5	Very low	30.1	Very low	157 Å²	157	134.8 Å²	134.8	84%	0.84	77%	0.77	S	S	*	*			trans	49.7	116.8	168.1	-56.1	-22.3	0	0	0	118.4
429	G	31.8	Very low	30.2	Very low	74 Å²	74	135.1 Å²	135.1	76%	0.763	77%	0.772	S	S	*	*			trans	-171.1	67.5	-179.7	0	0	0	0	0	114.5
430	H	33.5	Very low	30	Very low	176 Å²	176	135 Å²	135	82%	0.815	78%	0.777	S	S	*	*			trans	-79.5	142.9	171.2	-106.3	-5.2	0	0	0	112
431	H	32.3	Very low	30.1	Very low	149 Å²	149	134.7 Å²	134.7	69%	0.69	79%	0.787	S	S	*	*			trans	65.8	104.6	162.9	-66.4	-61.2	0	0	0	120.9
432	N	30.1	Very low	29.8	Very low	133 Å²	133	133.4 Å²	133.4	71%	0.711	79%	0.786	S	S	*	*				67.3	130.1	118.3	-71	-3.4	0	0	0	122.5
433	L	29.8	Very low	29.7	Very low	143 Å²	143	134.6 Å²	134.6	75%	0.749	79%	0.792	S	S	*	*			trans	66.5	104.1	144.7	-62.3	165.6	0	0	0	118.2
434	N	30.7	Very low	29.5	Very low	157 Å²	157	139.4 Å²	139.4	84%	0.84	80%	0.797	S	S	*	*				-170.6	157.4	89.7	-95	-50.9	0	0	0	113.8
435	S	30.1	Very low	29.6	Very low	115 Å²	115	137.9 Å²	137.9	80%	0.804	80%	0.798	S	S	*	*			trans	-80.5	156.9	176.9	-57.3	0	0	0	0	112.2
436	P	31.9	Very low	29.7	Very low	135 Å²	135	135.9 Å²	135.9	88%	0.877	80%	0.795	S	S	*	*			trans	-91.3	160.8	-158.3	35.5	-37.6	0	0	0	115.8
437	G	30.8	Very low	29.9	Very low	70 Å²	70	131.1 Å²	131.1	72%	0.722	79%	0.786	S	S	*	*			trans	-153.4	89.4	177.6	0	0	0	0	0	115.6
438	L	31	Very low	30	Very low	163 Å²	163	134 Å²	134	85%	0.853	79%	0.787	S	S	*	*			trans	56.1	122.5	143.7	-69.8	160.9	0	0	0	122.6
439	V	31	Very low	30.1	Very low	139 Å²	139	134.6 Å²	134.6	84%	0.842	78%	0.784	S	S	*	*			trans	80.5	139.7	138	177.3	0	0	0	0	118.8
440	A	24.9	Very low	30.2	Very low	98 Å²	98	138 Å²	138	81%	0.81	78%	0.784	S	S	*	*			trans	-89.9	150.1	-177.8	0	0	0	0	0	113.2
441	G	28.5	Very low	29.9	Very low	77 Å²	77	134 Å²	134	79%	0.794	78%	0.776	S	S	*	*			trans	-153.3	124.7	169.1	0	0	0	0	0	110
442	V	24.5	Very low	29.9	Very low	138 Å²	138	134.5 Å²	134.5	84%	0.836	78%	0.782	S	S	*	*			trans	-96.8	129.6	179.1	176.8	0	0	0	0	108.7
443	D	29.1	Very low	30	Very low	147 Å²	147	135.2 Å²	135.2	79%	0.786	78%	0.784	S	S	*	*			trans	-160.3	177.2	139.2	-127.9	-39.6	0	0	0	115.6
444	R	25.7	Very low	30	Very low	216 Å²	216	135.2 Å²	135.2	82%	0.815	79%	0.785	S	S	*	*			trans	-109.9	152	-160.2	-53.9	151.2	171.2	179	-1.5	113.4
445	C	28.8	Very low	29.9	Very low	122 Å²	122	133.6 Å²	133.6	82%	0.824	78%	0.781	S	S	*	*			trans	174.7	158.6	132	-94.2	0	0	0	0	110.5
446	S	29.6	Very low	30.1	Very low	95 Å²	95	135.9 Å²	135.9	66%	0.664	78%	0.783	S	S	*	*			cis	167.4	145.5	-44.2	59.4	0	0	0	0	107.8
447	S	34.5	Very low	29.8	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	78%	0.78	S	S	*	*			trans	93.1	146	177.1	-50.5	0	0	0	0	116
448	R	32	Very low	29.7	Very low	214 Å²	214	137.9 Å²	137.9	81%	0.808	78%	0.778	S	S	*	*			cis	-165	157.5	-14.1	-108.6	170.6	172.6	144	-7.2	103.8
449	E	31.7	Very low	29.8	Very low	168 Å²	168	138.1 Å²	138.1	79%	0.785	78%	0.775	S	S	*	*			cis	-147.9	135.8	33.9	-65.2	179.5	135.3	0	0	107.8
450	L	32.8	Very low	29.7	Very low	147 Å²	147	141.8 Å²	141.8	77%	0.77	77%	0.773	S	S	*	*				54.5	139.2	90.4	-59.7	172	0	0	0	116.2
451	S	29	Very low	29.9	Very low	91 Å²	91	142.9 Å²	142.9	64%	0.636	77%	0.77	S	S	*	*			cis	173.2	146.7	-27.5	47.7	0	0	0	0	108.9
452	I	31.1	Very low	30	Very low	160 Å²	160	145 Å²	145	82%	0.821	77%	0.767	S	S	*	*			trans	158.8	136.5	153.3	-90	155	0	0	0	109.1
453	I	32.8	Very low	30.3	Very low	147 Å²	147	144.7 Å²	144.7	75%	0.754	76%	0.761	S	S	*	*			cis	-151.4	152.3	-18.4	-108.6	169	0	0	0	107.1
454	N	28.9	Very low	30.4	Very low	143 Å²	143	144.3 Å²	144.3	77%	0.765	76%	0.759	S	S	*	*			trans	-83.3	-176.7	175.4	-78	-31.8	0	0	0	111.2
455	T	30.1	Very low	30.7	Very low	123 Å²	123	141.7 Å²	141.7	76%	0.755	76%	0.761	S	S	*	*			cis	-179.5	170.6	43.6	-32.4	0	0	0	0	112.1
456	L	32.5	Very low	30.7	Very low	164 Å²	164	144.6 Å²	144.6	86%	0.859	76%	0.762	S	S	*	*			trans	90.3	159.6	157.1	-63.8	178.5	0	0	0	119.5
457	N	27.1	Very low	31	Very low	149 Å²	149	144.5 Å²	144.5	80%	0.797	76%	0.76	S	S	*	*			trans	-141.2	158.3	-145.8	-98.6	-29.7	0	0	0	112.9
458	S	28.1	Very low	30.9	Very low	97 Å²	97	149 Å²	149	68%	0.678	77%	0.767	S	S	*	*			trans	55	118.7	148.2	65.6	0	0	0	0	120.4
459	Q	33.4	Very low	30.6	Very low	169 Å²	169	146.4 Å²	146.4	79%	0.79	77%	0.768	S	S	*	*				-179.7	137.1	97.4	-92.6	178.8	40.6	0	0	113.9
460	R	29.3	Very low	30.4	Very low	216 Å²	216	146 Å²	146	82%	0.815	77%	0.767	S	S	*	*			trans	43.3	122.5	143.7	-68.2	-174.3	174.6	174.9	-0.9	123.4
461	T	29.1	Very low	30.3	Very low	120 Å²	120	147 Å²	147	74%	0.736	77%	0.767	S	S	*	*				74.5	118.5	128.1	57.6	0	0	0	0	123.6
462	V	30.9	Very low	30.2	Very low	122 Å²	122	147.7 Å²	147.7	74%	0.739	77%	0.771	S	S	*	*				94.2	126.8	125.3	169.2	0	0	0	0	120
463	D	30.3	Very low	30.1	Very low	131 Å²	131	147.1 Å²	147.1	70%	0.701	77%	0.769	S	S	*	*			trans	63.6	124.8	156.9	-64.7	0.1	0	0	0	125.3
464	N	30.6	Very low	29.9	Very low	140 Å²	140	151.9 Å²	151.9	75%	0.749	78%	0.778	S	S	*	*			trans	84	152.1	138.4	-68.6	-19	0	0	0	123.6
465	D	32.7	Very low	29.8	Very low	160 Å²	160	153 Å²	153	86%	0.856	78%	0.784	S	S	*	*			trans	73.8	120	165.6	-59.1	-24.6	0	0	0	122.2
466	Q	27.5	Very low	29.7	Very low	183 Å²	183	154.9 Å²	154.9	86%	0.855	79%	0.789	S	S	*	*			trans	-85.3	-179.5	171.6	-103.3	-171.6	13.6	0	0	111.2
467	P	37.7	Very low	29.5	Very low	94 Å²	94	151.1 Å²	151.1	61%	0.61	78%	0.781	S	S	*	*			cis	-135.5	-175.4	-16.6	26.7	-3.9	0	0	0	114.2
468	K	31.2	Very low	29.6	Very low	190 Å²	190	151.9 Å²	151.9	83%	0.826	79%	0.785	S	S	*	*			trans	103.6	117.8	153.4	-59.2	177.3	-178.6	173.9	0	118.2
469	L	25.5	Very low	29.5	Very low	161 Å²	161	152.4 Å²	152.4	84%	0.843	79%	0.789	S	S	*	*			trans	72.6	145.8	149.8	-117.8	71.9	0	0	0	119.8
470	E	26.9	Very low	29.3	Very low	160 Å²	160	150.4 Å²	150.4	75%	0.748	79%	0.788	S	S	*	*			trans	71.6	156.1	169.2	-51.9	-159.2	164.2	0	0	119.2
471	H	31.3	Very low	29.3	Very low	168 Å²	168	145.1 Å²	145.1	78%	0.778	78%	0.784	S	S	*	*			trans	58.8	120	-174.1	-53.6	-46.4	0	0	0	116.4
472	S	28	Very low	29.5	Very low	104 Å²	104	147.7 Å²	147.7	73%	0.727	79%	0.788	S	S	*	*			cis	74.3	121.7	34.5	-44.4	0	0	0	0	115.3
473	L	28	Very low	29.5	Very low	149 Å²	149	145.8 Å²	145.8	78%	0.78	78%	0.78	S	S	*	*			trans	63.2	75.7	157.5	-58.7	174.3	0	0	0	118.6
474	R	28	Very low	29.5	Very low	246 Å²	246	144.6 Å²	144.6	93%	0.928	78%	0.779	S	S	*	*			trans	-168.3	84.1	134.3	-107	162.8	-173.5	179.4	2.5	112.6
475	N	27	Very low	29.6	Very low	167 Å²	167	146 Å²	146	89%	0.893	77%	0.774	S	S	*	*			trans	-167.9	71.5	156.7	-98.5	-19.8	0	0	0	107.3
476	L	28	Very low	29.4	Very low	163 Å²	163	146.3 Å²	146.3	85%	0.853	78%	0.775	S	S	*	*			trans	-143.6	49	-172.8	-111.2	163.1	0	0	0	111.1
477	A	29.2	Very low	29.6	Very low	85 Å²	85	147 Å²	147	70%	0.702	78%	0.775	S	S	*	*	S	Bend	trans	-145.8	149.7	161.9	0	0	0	0	0	106.8
478	N	28.2	Very low	29.2	Very low	165 Å²	165	147.9 Å²	147.9	88%	0.882	78%	0.784	S	S	*	*	S	Bend	trans	72	46.8	178.8	-53.5	-5.8	0	0	0	117.7
479	S	27.4	Very low	29.2	Very low	108 Å²	108	146.8 Å²	146.8	76%	0.755	78%	0.782	S	S	*	*			trans	-171.2	77.8	146.9	48.7	0	0	0	0	113.8
480	T	28	Very low	29.4	Very low	127 Å²	127	146.3 Å²	146.3	78%	0.779	78%	0.775	S	S	*	*			trans	-115.4	60.7	176.3	51.6	0	0	0	0	112.8
481	S	30.4	Very low	29.4	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	78%	0.782	S	S	*	*			trans	-103.6	90.9	164.9	55.4	0	0	0	0	109.2	S483	S481-S483 PolarHBondContact O-N 2.87Å
482	H	32.1	Very low	29.4	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.806	78%	0.779	S	S	*	*			trans	-82.3	97.8	-175.9	-79.6	-73.5	0	0	0	112.4	P484	H482-P484 WeakPolarHBondContact O-CD 3.44Å
483	S	30.6	Very low	29.4	Very low	83 Å²	83	146 Å²	146	58%	0.58	78%	0.78	S	S	*	*			trans	-93.3	112.9	168.1	-57.1	0	0	0	0	110.8	S481 W485	S481-S483 PolarHBondContact O-N 2.87Å; S483-W485 PolarHBondContact O-N 2.96Å
484	P	31.8	Very low	29.6	Very low	106 Å²	106	147 Å²	147	69%	0.688	78%	0.784	S	S	*	*			trans	-93	50.4	-170.6	37.9	-37.1	0	0	0	114.1	H482	H482-P484 WeakPolarHBondContact O-CD 3.44Å
485	W	31.2	Very low	29.5	Very low	168 Å²	168	141.7 Å²	141.7	64%	0.636	77%	0.774	S	S	*	*			trans	-138.1	91.7	170.5	-74.9	114.7	0	0	0	111.4	S483	S483-W485 PolarHBondContact O-N 2.96Å
486	L	28.4	Very low	29.8	Very low	167 Å²	167	139.8 Å²	139.8	87%	0.874	77%	0.771	S	S	*	*			trans	-133	101.1	172.1	-100.6	168	0	0	0	110.6	S488	L486-S488 PolarHBondContact O-N 2.85Å
487	F	31.8	Very low	30	Very low	197 Å²	197	140 Å²	140	86%	0.864	77%	0.772	S	S	*	*			trans	-66.3	120	165.7	-100.8	-89.3	0	0	0	109.5	Q489	F487-Q489 PolarHBondContact O-N 2.94Å
488	S	31.1	Very low	30.2	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	77%	0.773	S	S	*	*			trans	-75.7	96.9	-178.5	55.2	0	0	0	0	112.4	L486	L486-S488 PolarHBondContact O-N 2.85Å
489	Q	31.2	Very low	30.2	Very low	167 Å²	167	142.3 Å²	142.3	78%	0.78	77%	0.774	S	S	*	*			trans	48.2	97	148.9	-55.9	-174.6	12.6	0	0	118.1	F487	F487-Q489 PolarHBondContact O-N 2.94Å
490	Q	28.5	Very low	30.6	Very low	150 Å²	150	143.5 Å²	143.5	70%	0.701	78%	0.777	S	S	*	*			trans	-98.6	77.6	135.4	-74.7	-163.3	-64.5	0	0	109.5	S492	Q490-S492 PolarHBondContact O-N 3.18Å
491	R	26.3	Very low	30.7	Very low	234 Å²	234	141 Å²	141	88%	0.883	78%	0.777	S	S	*	*			trans	-85.2	79.9	163.6	-94.8	-164.7	173.9	-142.4	1.8	109.5
492	S	32.3	Very low	30.8	Very low	103 Å²	103	147.5 Å²	147.5	72%	0.72	79%	0.785	S	S	*	*			trans	-93.2	99	171.2	52.6	0	0	0	0	110.7	Q490	Q490-S492 PolarHBondContact O-N 3.18Å
493	A	27	Very low	30.7	Very low	90 Å²	90	145.3 Å²	145.3	74%	0.744	79%	0.789	S	S	*	*			trans	38	96.9	160.3	0	0	0	0	0	118.9
494	I	32.1	Very low	30.9	Very low	168 Å²	168	144.4 Å²	144.4	86%	0.862	79%	0.793	S	S	*	*			trans	-122.8	120.7	139.3	-60.3	-179.9	0	0	0	105.9
495	N	27.4	Very low	31	Very low	136 Å²	136	149 Å²	149	73%	0.727	81%	0.805	S	S	*	*			trans	-73.2	141.6	178.8	-74.9	-11.7	0	0	0	110.4	L497	N495-L497 PolarHBondContact O-N 3.29Å
496	P	33	Very low	31.2	Very low	126 Å²	126	147.8 Å²	147.8	82%	0.818	81%	0.81	S	S	*	*			trans	-68.9	113.3	157.9	30.1	-30.3	0	0	0	108.2
497	L	31.2	Very low	31.4	Very low	168 Å²	168	145.4 Å²	145.4	88%	0.88	80%	0.798	S	S	*	*			trans	-71.4	133.4	167.9	-91.7	162.8	0	0	0	109.1	N495	N495-L497 PolarHBondContact O-N 3.29Å
498	S	33.8	Very low	31.7	Very low	103 Å²	103	140.9 Å²	140.9	72%	0.72	79%	0.789	S	S	*	*			trans	-70.1	142.8	-175.5	50.2	0	0	0	0	112.9	T500	S498-T500 PolarHBondContact O-N 2.88Å
499	E	29.4	Very low	32	Very low	195 Å²	195	139.4 Å²	139.4	91%	0.911	78%	0.779	S	S	*	*			trans	-68.3	106.7	178.6	-59.9	176.1	118.3	0	0	112.7
500	T	35.4	Very low	32.2	Very low	134 Å²	134	134.9 Å²	134.9	82%	0.822	77%	0.769	S	S	*	*			trans	-149.2	103.5	155.3	52.2	0	0	0	0	112.9	S498	S498-T500 PolarHBondContact O-N 2.88Å
501	G	30.8	Very low	32.5	Very low	75 Å²	75	134.4 Å²	134.4	77%	0.773	77%	0.771	S	S	*	*			trans	92.2	134.3	143.6	0	0	0	0	0	119.9
502	R	32	Very low	33.3	Very low	239 Å²	239	127 Å²	127	90%	0.902	75%	0.752	S	S	*	*			trans	67.5	88.6	156.4	-61.2	-175.5	177.1	-175.8	-1.1	118.4	G504	R502-G504 PolarHBondContact O-N 3.47Å
503	S	29.7	Very low	33.7	Very low	128 Å²	128	126 Å²	126	90%	0.895	75%	0.75	S	S	*	*				19.1	100.5	128.6	58.4	0	0	0	0	117.7
504	G	35.6	Very low	34.3	Very low	64 Å²	64	124 Å²	124	66%	0.66	74%	0.738	S	S	*	*			trans	-154.9	140.8	162.2	0	0	0	0	0	109	R502 I506	R502-G504 PolarHBondContact O-N 3.47Å; G504-I506 PolarHBondContact O-N 2.72Å
505	E	32.7	Very low	35.2	Very low	202 Å²	202	124.4 Å²	124.4	94%	0.944	74%	0.741	S	S	*	*			trans	-73.3	112.7	-175.5	-63.9	178.5	131.9	0	0	110.8
506	I	34.8	Very low	36.7	Very low	144 Å²	144	123.1 Å²	123.1	74%	0.738	73%	0.729	S	S	*	*			trans	-89	111.8	177.8	-59.6	-179.8	0	0	0	109.2	G504	G504-I506 PolarHBondContact O-N 2.72Å
507	N	33	Very low	38.6	Very low	116 Å²	116	126 Å²	126	62%	0.62	72%	0.724	S	S	*	*			trans	-61.8	121.7	176.5	-109.8	-52.7	0	0	0	111.1	S509 A510	N507-S509 PolarHBondContact O-N 3.27Å; N507-A510 PolarHBondContact O-N 3.37Å
508	P	37.7	Very low	41.3	Very low	102 Å²	102	123.4 Å²	123.4	66%	0.662	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-66.2	-21.6	-177.4	26.1	-34.2	0	0	0	113.2	A510 L511	P508-A510 PolarHBondContact O-N 3.23Å; P508-L511 PolarHBondContact O-N 2.97Å
509	S	38.9	Very low	44.1	Very low	84 Å²	84	119.7 Å²	119.7	59%	0.587	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-64.9	-19.7	177.5	49.2	0	0	0	0	114.7	N507	N507-S509 PolarHBondContact O-N 3.27Å
510	A	34	Very low	47.2	Very low	71 Å²	71	111 Å²	111	59%	0.587	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-78.2	-25.2	179.3	0	0	0	0	0	113.4	N507 P508	N507-A510 PolarHBondContact O-N 3.37Å; P508-A510 PolarHBondContact O-N 3.23Å
511	L	36	Very low	50.1	Low	141 Å²	141	107.4 Å²	107.4	74%	0.738	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-81.9	-23.1	-175.8	-77.1	163.1	0	0	0	113.2	P508 A513	P508-L511 PolarHBondContact O-N 2.97Å; L511-A513 VanDerWaalsContact C-N 3.26Å; L511-A513 PolarHBondContact O-N 3.11Å
512	T	42.9	Very low	53.2	Low	79 Å²	79	110.4 Å²	110.4	49%	0.485	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-75.7	-11.8	-179.7	-18.2	0	0	0	0	113.8
513	A	39.4	Very low	56.3	Low	81 Å²	81	99.2 Å²	99.2	67%	0.669	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-87.3	-4	-178.4	0	0	0	0	0	114.3	L511 L515	L511-A513 VanDerWaalsContact C-N 3.26Å; L511-A513 PolarHBondContact O-N 3.11Å; A513-L515 PolarHBondContact O-N 3Å
514	G	40.8	Very low	59.4	Low	49 Å²	49	95.8 Å²	95.8	51%	0.505	54%	0.538	S	S	.	.	S	Bend	trans	-59.3	131.3	172.2	0	0	0	0	0	110.6	F516	G514-F516 WeakPolarHBondContact O-CD2 3.38Å; G514-F516 PolarHBondContact O-N 3.41Å
515	L	50.6	Low	62.4	Low	175 Å²	175	93.9 Å²	93.9	92%	0.916	51%	0.512	S	S	*	.			trans	-57	96.7	-172.9	-97.9	70.7	0	0	0	112.2	A513 R517	A513-L515 PolarHBondContact O-N 3Å; L515-R517 PolarHBondContact O-N 2.79Å
516	F	59.2	Low	65.4	Low	110 Å²	110	86.7 Å²	86.7	48%	0.482	48%	0.48	S	S	.	.			trans	-62.3	109.5	163	-73.2	-86.3	0	0	0	108.3	G514 R518 Y596	G514-F516 WeakPolarHBondContact O-CD2 3.38Å; G514-F516 PolarHBondContact O-N 3.41Å; F516-R518 PolarHBondContact O-N 3.45Å; F516-Y596 HydrophobicContact CB-CE1 3.7Å; F516-Y596 AromaticContact CD1-CD1 4Å; F516-Y596 HydrophobicContact CD1-CD1 4Å; F516-Y596 AromaticContact CD1-CE1 3.82Å; F516-Y596 HydrophobicContact CD1-CE1 3.82Å; F516-Y596 HydrophobicContact CD2-CE1 4.46Å; F516-Y596 HydrophobicContact CE1-CD1 4.31Å; F516-Y596 HydrophobicContact CG-CD1 4.23Å; F516-Y596 AromaticContact CG-CE1 3.76Å; F516-Y596 HydrophobicContact CG-CE1 3.76Å
517	R	71.9	Confident	68.4	Low	185 Å²	185	83.2 Å²	83.2	70%	0.698	47%	0.466	S	S	*	.			trans	-53.7	136.5	175.4	-173.8	180	-179.5	168.2	0.1	109.7	L515 L519	L515-R517 PolarHBondContact O-N 2.79Å; R517-L519 PolarHBondContact O-N 3.29Å
518	R	87.8	Confident	71.4	Confident	114 Å²	114	77.7 Å²	77.7	43%	0.43	44%	0.437	S	S	.	.			trans	-47.3	133.4	169.5	-72.5	-72.2	-154.6	179.2	4.8	109.5	F516 E563 N564	F516-R518 PolarHBondContact O-N 3.45Å; R518-E563 WeakPolarHBondContact CD-OE1 3.36Å; R518-E563 IonicContact NE-OE1 2.66Å; R518-E563 IonicContact NH1-OE1 3.8Å; R518-E563 PolarHBondContact NH1-OE1 2.96Å; R518-N564 PolarHBondContact NH1-OD1 3.37Å
519	L	93.5	Very high	74.3	Confident	25 Å²	25	77.4 Å²	77.4	13%	0.131	44%	0.435	C	S	.	.	S	Bend	trans	-82.2	-40.1	175.3	-53.9	-173.6	0	0	0	110	R517 P553 I559 E563 F591 A592 T595 Y596	R517-L519 PolarHBondContact O-N 3.29Å; L519-P553 WeakPolarHBondContact O-CG 3.39Å; L519-I559 HydrophobicContact CB-CD1 4.45Å; L519-I559 HydrophobicContact CB-CG1 4.37Å; L519-E563 HydrophobicContact CB-CG 4Å; L519-E563 HydrophobicContact CD1-CG 4.12Å; L519-E563 HydrophobicContact CG-CG 3.9Å; L519-E563 PolarHBondContact N-OE2 3.46Å; L519-F591 HydrophobicContact CB-CE1 4.22Å; L519-F591 HydrophobicContact CD1-CD1 4.47Å; L519-F591 HydrophobicContact CD1-CE1 4.43Å; L519-A592 HydrophobicContact CD1-CB 4.18Å; L519-T595 HydrophobicContact CD1-CG2 4.28Å; L519-T595 HydrophobicContact CD2-CG2 3.58Å; L519-Y596 HydrophobicContact CD1-CD2 4.32Å; L519-Y596 HydrophobicContact CD1-CE2 3.68Å; L519-Y596 HydrophobicContact CG-CE2 4.2Å
520	S	95.4	Very high	77.1	Confident	12 Å²	12	76.6 Å²	76.6	8%	0.084	43%	0.427	C	S	.	.	S	Bend	trans	-60.1	139.5	165.5	50.4	0	0	0	0	111.4	E563	S520-E563 WeakPolarHBondContact CB-OE2 3.19Å; S520-E563 PolarHBondContact N-OE2 3.33Å; S520-E563 PolarHBondContact OG-OE2 2.85Å
521	V	95.5	Very high	80.1	Confident	59 Å²	59	73.2 Å²	73.2	36%	0.358	40%	0.399	S	S	.	.			trans	-105.3	150.9	177.3	-60.9	0	0	0	0	110.5	S523 I551 Q552 P553 R560	V521-S523 PolarHBondContact O-N 2.94Å; V521-S523 VanDerWaalsContact O-N 3.08Å; V521-I551 HydrophobicContact CG2-CD1 3.86Å; V521-Q552 PolarHBondContact O-NE2 2.92Å; V521-P553 HydrophobicContact CG1-CG 4.43Å; V521-R560 PolarHBondContact O-NH2 3.49Å
522	K	96.3	Very high	83.1	Confident	139 Å²	139	67.4 Å²	67.4	60%	0.604	37%	0.37	S	S	*	.			trans	-64.7	110.2	167.5	173.3	158	-171.7	165.6	0	108.6	E676	K522-E676 WeakPolarHBondContact CA-OE1 3.35Å; K522-E676 WeakPolarHBondContact CA-OE2 3.04Å; K522-E676 HydrophobicContact CB-CG 4.46Å; K522-E676 HydrophobicContact CD-CB 4.46Å; K522-E676 HydrophobicContact CD-CG 3.93Å; K522-E676 HydrophobicContact CG-CB 4.44Å; K522-E676 HydrophobicContact CG-CG 3.89Å
523	S	96	Very high	85.6	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.021	37%	0.365	C	S	.	.			trans	-80.5	144.8	-176.7	66.6	0	0	0	0	110.8	V521 K547 L548 E549 R560 E676	V521-S523 PolarHBondContact O-N 2.94Å; V521-S523 VanDerWaalsContact O-N 3.08Å; S523-K547 PolarHBondContact O-NZ 2.91Å; S523-K547 WeakPolarHBondContact OG-CD 3.41Å; S523-K547 WeakPolarHBondContact OG-CE 3.31Å; S523-K547 PolarHBondContact OG-NZ 3.23Å; S523-L548 WeakPolarHBondContact CB-O 3.47Å; S523-E549 WeakPolarHBondContact CB-OE1 3.46Å; S523-E549 PolarHBondContact OG-OE1 2.84Å; S523-R560 PolarHBondContact OG-NH2 3.42Å; S523-E676 PolarHBondContact N-OE2 2.95Å; S523-E676 VanDerWaalsContact N-OE2 3.07Å
524	P	96.2	Very high	88.4	Confident	57 Å²	57	64 Å²	64	37%	0.37	34%	0.341	S	S	.	.			trans	-56.5	142.8	171.3	-24.1	34.2	0	0	0	111.9	I526 L548 I551	P524-I526 HydrophobicContact CB-CG2 4.06Å; P524-L548 HydrophobicContact CB-CD1 4.29Å; P524-L548 PolarHBondContact O-N 2.73Å; P524-I551 HydrophobicContact CG-CD1 4.45Å
525	L	97.1	Very high	91	Very high	23 Å²	23	61.6 Å²	61.6	12%	0.12	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	114	164.3	-179.7	49.6	0	0	0	105.7	W545 L546 K547 I677 I681 L822	L525-W545 HydrophobicContact CD1-CB 4.01Å; L525-L546 WeakPolarHBondContact CA-O 3.47Å; L525-K547 HydrophobicContact CB-CD 4.26Å; L525-K547 HydrophobicContact CD1-CB 4.06Å; L525-K547 HydrophobicContact CD1-CD 4.4Å; L525-I677 HydrophobicContact CD2-CB 4.25Å; L525-I677 HydrophobicContact CD2-CG1 4.22Å; L525-I677 HydrophobicContact CD2-CG2 4.16Å; L525-I681 HydrophobicContact CD1-CD1 4.26Å; L525-I681 HydrophobicContact CD2-CD1 3.55Å; L525-I681 HydrophobicContact CG-CD1 3.85Å; L525-L822 HydrophobicContact CD1-CD1 3.74Å; L525-L822 HydrophobicContact CD1-CG 4.14Å; L525-L822 HydrophobicContact CD2-CD1 3.87Å; L525-L822 HydrophobicContact CG-CD1 4.48Å
526	I	96.2	Very high	93.1	Very high	52 Å²	52	57.4 Å²	57.4	27%	0.267	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.5	-173.2	63.3	168.1	0	0	0	110.9	P524 W545 L546 L548	P524-I526 HydrophobicContact CB-CG2 4.06Å; I526-W545 CarbonylContact O-C 3.54Å; I526-W545 WeakPolarHBondContact O-CA 3.46Å; I526-L546 HydrophobicContact CD1-CD1 4.45Å; I526-L546 HydrophobicContact CG1-CB 3.95Å; I526-L546 HydrophobicContact CG1-CD1 4.47Å; I526-L546 PolarHBondContact N-O 2.81Å; I526-L546 PolarHBondContact O-N 2.81Å; I526-L548 HydrophobicContact CD1-CD1 3.92Å; I526-L548 HydrophobicContact CD1-CG 4.49Å; I526-L548 HydrophobicContact CG1-CD1 4.23Å; I526-L548 HydrophobicContact CG1-CG 4.38Å
527	P	97.2	Very high	94.8	Very high	70 Å²	70	57.1 Å²	57.1	46%	0.455	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	153.4	166.2	31	-33.8	0	0	0	109.7	P529 W545	P527-P529 WeakPolarHBondContact O-CD 3.45Å; P527-W545 HydrophobicContact CB-CD2 4.35Å; P527-W545 HydrophobicContact CB-CE3 3.95Å; P527-W545 HydrophobicContact CB-CH2 4.22Å; P527-W545 HydrophobicContact CB-CZ3 3.89Å; P527-W545 HydrophobicContact CG-CZ3 4.13Å
528	S	97.8	Very high	95.8	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.007	28%	0.282	C	S	.	.			trans	-121.6	84.6	176.3	-174	0	0	0	0	110.9	V530 L531 S532 I544 H786	S528-V530 PolarHBondContact O-N 3.48Å; S528-V530 VanDerWaalsContact O-N 3.16Å; S528-L531 PolarHBondContact O-N 2.86Å; S528-L531 VanDerWaalsContact O-N 3.15Å; S528-L531 VanDerWaalsContact OG-CG 3.31Å; S528-L531 WeakPolarHBondContact OG-CG 3.35Å; S528-S532 PolarHBondContact O-N 3.24Å; S528-S532 PolarHBondContact O-OG 3.23Å; S528-S532 VanDerWaalsContact O-OG 3.11Å; S528-I544 PolarHBondContact N-O 2.71Å; S528-H786 PolarHBondContact OG-CE1 2.99Å; S528-H786 PolarHBondContact OG-NE2 2.86Å
529	P	97.4	Very high	96.1	Very high	96 Å²	96	49.7 Å²	49.7	62%	0.623	29%	0.286	S	S	*	.	H	α-helix	trans	-55.8	-33	-179.8	-27	35.6	0	0	0	113.4	P527 S533	P527-P529 WeakPolarHBondContact O-CD 3.45Å; P529-S533 WeakPolarHBondContact O-CB 3.04Å; P529-S533 PolarHBondContact O-N 3Å
530	V	97.4	Very high	96.2	Very high	67 Å²	67	48.6 Å²	48.6	41%	0.406	28%	0.281	S	S	.	.	H	α-helix	trans	-63.1	-50.3	177.3	-176.2	0	0	0	0	111.3	S528 S533 L534 D785	S528-V530 PolarHBondContact O-N 3.48Å; S528-V530 VanDerWaalsContact O-N 3.16Å; V530-S533 PolarHBondContact O-N 3.14Å; V530-L534 PolarHBondContact O-N 3.29Å; V530-D785 HydrophobicContact CG1-CB 4.1Å
531	L	97.8	Very high	96.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-74	-37	-178.4	-61.6	-179.6	0	0	0	112.2	S528 S533 L534 L535 I544 L546 V801 Y802	S528-L531 PolarHBondContact O-N 2.86Å; S528-L531 VanDerWaalsContact O-N 3.15Å; S528-L531 VanDerWaalsContact OG-CG 3.31Å; S528-L531 WeakPolarHBondContact OG-CG 3.35Å; L531-S533 VanDerWaalsContact C-N 3.34Å; L531-L534 PolarHBondContact O-N 3.27Å; L531-L535 WeakPolarHBondContact O-CG 3.27Å; L531-L535 PolarHBondContact O-N 2.86Å; L531-I544 HydrophobicContact CB-CB 3.97Å; L531-I544 HydrophobicContact CB-CG1 3.98Å; L531-I544 HydrophobicContact CB-CG2 3.92Å; L531-I544 HydrophobicContact CD1-CG2 3.99Å; L531-L546 HydrophobicContact CD1-CD2 4.14Å; L531-V801 HydrophobicContact CB-CG1 4.16Å; L531-V801 HydrophobicContact CD2-CG1 3.98Å; L531-V801 HydrophobicContact CG-CG1 4.48Å; L531-Y802 HydrophobicContact CD2-CD1 4.31Å; L531-Y802 HydrophobicContact CD2-CE1 3.47Å; L531-Y802 VanDerWaalsContact CD2-CE1 3.47Å
532	S	97.8	Very high	96.3	Very high	19 Å²	19	50.8 Å²	50.8	13%	0.133	29%	0.286	C	S	.	.	H	α-helix	trans	-58.1	-47.4	169.2	-56.5	0	0	0	0	110.8	S528 L534 L535 T536 M542 I544	S528-S532 PolarHBondContact O-N 3.24Å; S528-S532 PolarHBondContact O-OG 3.23Å; S528-S532 VanDerWaalsContact O-OG 3.11Å; S532-L534 PolarHBondContact O-N 3.32Å; S532-L535 PolarHBondContact O-N 3.47Å; S532-T536 PolarHBondContact O-N 3.36Å; S532-T536 PolarHBondContact O-OG1 3.16Å; S532-T536 VanDerWaalsContact O-OG1 3.08Å; S532-M542 WeakPolarHBondContact CB-O 3.2Å; S532-I544 PolarHBondContact OG-N 3.15Å
533	S	97.1	Very high	96.3	Very high	56 Å²	56	47.8 Å²	47.8	39%	0.392	28%	0.276	S	S	.	.	H	α-helix	trans	-63.2	-40.6	178.8	-171.2	0	0	0	0	112.7	P529 V530 L531 L535 T536 Q537	P529-S533 WeakPolarHBondContact O-CB 3.04Å; P529-S533 PolarHBondContact O-N 3Å; V530-S533 PolarHBondContact O-N 3.14Å; L531-S533 VanDerWaalsContact C-N 3.34Å; S533-L535 PolarHBondContact O-N 3.05Å; S533-T536 PolarHBondContact O-N 3.39Å; S533-Q537 WeakPolarHBondContact O-CB 3.37Å; S533-Q537 VanDerWaalsContact O-CG 3.26Å; S533-Q537 WeakPolarHBondContact O-CG 3.35Å; S533-Q537 PolarHBondContact O-N 2.73Å; S533-Q537 PolarHBondContact O-NE2 3.24Å; S533-Q537 PolarHBondContact OG-NE2 3.49Å
534	L	96.6	Very high	96.4	Very high	31 Å²	31	47.7 Å²	47.7	16%	0.162	28%	0.276	C	S	.	.	H	α-helix	trans	-58.7	-36.5	175.2	178.7	62.7	0	0	0	112.1	V530 L531 S532 V801 Y802	V530-L534 PolarHBondContact O-N 3.29Å; L531-L534 PolarHBondContact O-N 3.27Å; S532-L534 PolarHBondContact O-N 3.32Å; L534-V801 HydrophobicContact CD2-CG1 4.22Å; L534-Y802 HydrophobicContact CD2-CD1 3.77Å; L534-Y802 HydrophobicContact CD2-CE1 4.18Å
535	L	96.3	Very high	96.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-78.8	-36.7	176.6	-63.9	166.6	0	0	0	111.7	L531 S532 S533 Q537 R538 G539 C540 M542 I544 V801 S807	L531-L535 WeakPolarHBondContact O-CG 3.27Å; L531-L535 PolarHBondContact O-N 2.86Å; S532-L535 PolarHBondContact O-N 3.47Å; S533-L535 PolarHBondContact O-N 3.05Å; L535-Q537 VanDerWaalsContact C-N 3.31Å; L535-Q537 PolarHBondContact O-N 3.33Å; L535-R538 CarbonylContact O-C 3.55Å; L535-R538 WeakPolarHBondContact O-CA 3.22Å; L535-R538 WeakPolarHBondContact O-CB 3.46Å; L535-R538 PolarHBondContact O-N 3.47Å; L535-G539 PolarHBondContact O-N 2.79Å; L535-C540 HydrophobicContact CB-CB 4.18Å; L535-C540 VanDerWaalsContact O-CB 3.28Å; L535-C540 WeakPolarHBondContact O-CB 3.38Å; L535-C540 PolarHBondContact O-N 3.03Å; L535-M542 HydrophobicContact CB-CB 4.49Å; L535-M542 HydrophobicContact CD1-CB 4.03Å; L535-M542 HydrophobicContact CD1-SD 3.85Å; L535-I544 HydrophobicContact CD1-CD1 3.5Å; L535-I544 VanDerWaalsContact CD1-CD1 3.5Å; L535-I544 HydrophobicContact CD1-CG1 3.55Å; L535-V801 HydrophobicContact CD1-CG1 4.17Å; L535-V801 HydrophobicContact CD2-CG1 4.29Å; L535-V801 HydrophobicContact CG-CG1 4.2Å; L535-S807 WeakPolarHBondContact CD2-OG 3.45Å
536	T	95.4	Very high	96.6	Very high	86 Å²	86	45 Å²	45	53%	0.528	26%	0.256	S	S	.	.	H	α-helix	trans	-61	-38.4	171.2	-56.7	0	0	0	0	112.3	S532 S533 R538 G539 C540	S532-T536 PolarHBondContact O-N 3.36Å; S532-T536 PolarHBondContact O-OG1 3.16Å; S532-T536 VanDerWaalsContact O-OG1 3.08Å; S533-T536 PolarHBondContact O-N 3.39Å; T536-R538 PolarHBondContact O-N 3.02Å; T536-G539 PolarHBondContact O-N 3.21Å; T536-C540 WeakPolarHBondContact CA-O 3.33Å
537	Q	93.8	Very high	96.7	Very high	104 Å²	104	42.5 Å²	42.5	49%	0.486	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-20.4	173.2	-71.7	169.2	48.8	0	0	113	S533 L535	S533-Q537 WeakPolarHBondContact O-CB 3.37Å; S533-Q537 VanDerWaalsContact O-CG 3.26Å; S533-Q537 WeakPolarHBondContact O-CG 3.35Å; S533-Q537 PolarHBondContact O-N 2.73Å; S533-Q537 PolarHBondContact O-NE2 3.24Å; S533-Q537 PolarHBondContact OG-NE2 3.49Å; L535-Q537 VanDerWaalsContact C-N 3.31Å; L535-Q537 PolarHBondContact O-N 3.33Å
538	R	93.9	Very high	96.7	Very high	94 Å²	94	39.6 Å²	39.6	36%	0.355	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	9.8	173	-67.3	172.4	171.2	159.1	-7.9	113.7	L535 T536 V801 Y802 G804 S807	L535-R538 CarbonylContact O-C 3.55Å; L535-R538 WeakPolarHBondContact O-CA 3.22Å; L535-R538 WeakPolarHBondContact O-CB 3.46Å; L535-R538 PolarHBondContact O-N 3.47Å; T536-R538 PolarHBondContact O-N 3.02Å; R538-V801 PolarHBondContact NH1-O 3.38Å; R538-Y802 PolarHBondContact NH2-O 3.5Å; R538-G804 VanDerWaalsContact NH1-CA 3.33Å; R538-S807 WeakPolarHBondContact CD-OG 3.35Å
539	G	93.5	Very high	96.7	Very high	49 Å²	49	39.6 Å²	39.6	51%	0.505	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	15.6	179	0	0	0	0	0	114.9	L535 T536	L535-G539 PolarHBondContact O-N 2.79Å; T536-G539 PolarHBondContact O-N 3.21Å
540	C	95.8	Very high	96.7	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.02	20%	0.201	C	C	.	.			trans	-94.6	159.2	178.3	-53	0	0	0	0	111.9	L535 T536 M542 S807 Q810	L535-C540 HydrophobicContact CB-CB 4.18Å; L535-C540 VanDerWaalsContact O-CB 3.28Å; L535-C540 WeakPolarHBondContact O-CB 3.38Å; L535-C540 PolarHBondContact O-N 3.03Å; T536-C540 WeakPolarHBondContact CA-O 3.33Å; C540-M542 HydrophobicContact CB-CG 4.44Å; C540-S807 WeakPolarHBondContact SG-CA 3.46Å; C540-S807 WeakPolarHBondContact SG-CB 3.44Å; C540-S807 PolarHBondContact SG-OG 3.07Å; C540-Q810 VanDerWaalsContact CA-OE1 3.28Å; C540-Q810 VanDerWaalsContact CB-OE1 3.25Å
541	Q	95.9	Very high	96.6	Very high	113 Å²	113	36.9 Å²	36.9	53%	0.528	20%	0.201	S	C	.	.			trans	-119.3	87.3	171.1	-68	-176.9	4.2	0	0	108.3	Q810 P818 S819	Q541-Q810 PolarHBondContact O-NE2 2.83Å; Q541-P818 HydrophobicContact CB-CB 4.19Å; Q541-P818 CarbonylContact O-C 3.57Å; Q541-P818 WeakPolarHBondContact O-CA 3.5Å; Q541-S819 PolarHBondContact O-N 3.42Å
542	M	96.9	Very high	96.6	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.015	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	130.7	-177.4	-68.8	-170.4	178.2	0	0	111.5	S532 L535 C540 I544 L806 Q810 L815 S819 I821	S532-M542 WeakPolarHBondContact CB-O 3.2Å; L535-M542 HydrophobicContact CB-CB 4.49Å; L535-M542 HydrophobicContact CD1-CB 4.03Å; L535-M542 HydrophobicContact CD1-SD 3.85Å; C540-M542 HydrophobicContact CB-CG 4.44Å; M542-I544 HydrophobicContact CB-CD1 4.35Å; M542-L806 HydrophobicContact CE-CB 4.15Å; M542-L806 WeakPolarHBondContact CE-O 3.44Å; M542-L806 HydrophobicContact SD-CB 4.06Å; M542-Q810 HydrophobicContact CE-CB 3.45Å; M542-Q810 VanDerWaalsContact CE-CB 3.45Å; M542-Q810 HydrophobicContact CE-CG 4.1Å; M542-L815 HydrophobicContact CE-CD1 3.62Å; M542-S819 CarbonylContact C-O 3.59Å; M542-S819 WeakPolarHBondContact CA-O 3.2Å; M542-I821 HydrophobicContact CB-CG1 4.45Å; M542-I821 HydrophobicContact CG-CG1 4.29Å; M542-I821 HydrophobicContact SD-CD1 4.47Å; M542-I821 HydrophobicContact SD-CG1 3.92Å
543	N	97	Very high	96.4	Very high	77 Å²	77	38.2 Å²	38.2	41%	0.412	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	113.3	165.8	-58.9	-35	0	0	0	108.2	S819 N820 I821	N543-S819 PolarHBondContact N-O 3.34Å; N543-N820 WeakPolarHBondContact CB-OD1 3.27Å; N543-N820 PolarHBondContact ND2-OD1 3.06Å; N543-I821 PolarHBondContact O-N 2.98Å
544	I	98.1	Very high	96.3	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	127	175.6	-58.9	-51.5	0	0	0	110.2	S528 L531 S532 L535 M542 L546 I821 I823	S528-I544 PolarHBondContact N-O 2.71Å; L531-I544 HydrophobicContact CB-CB 3.97Å; L531-I544 HydrophobicContact CB-CG1 3.98Å; L531-I544 HydrophobicContact CB-CG2 3.92Å; L531-I544 HydrophobicContact CD1-CG2 3.99Å; S532-I544 PolarHBondContact OG-N 3.15Å; L535-I544 HydrophobicContact CD1-CD1 3.5Å; L535-I544 VanDerWaalsContact CD1-CD1 3.5Å; L535-I544 HydrophobicContact CD1-CG1 3.55Å; M542-I544 HydrophobicContact CB-CD1 4.35Å; I544-L546 HydrophobicContact CG2-CD2 3.97Å; I544-I821 HydrophobicContact CD1-CB 3.74Å; I544-I821 HydrophobicContact CD1-CG1 4.07Å; I544-I821 HydrophobicContact CD1-CG2 4.33Å; I544-I823 HydrophobicContact CG2-CD1 3.69Å; I544-I823 HydrophobicContact CG2-CG1 4.23Å
545	W	98.3	Very high	96.3	Very high	23 Å²	23	34.2 Å²	34.2	9%	0.087	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138.2	176	-61.6	87.2	0	0	0	110.3	L525 I526 P527 E680 I681 N820 I821 L822 I823	L525-W545 HydrophobicContact CD1-CB 4.01Å; I526-W545 CarbonylContact O-C 3.54Å; I526-W545 WeakPolarHBondContact O-CA 3.46Å; P527-W545 HydrophobicContact CB-CD2 4.35Å; P527-W545 HydrophobicContact CB-CE3 3.95Å; P527-W545 HydrophobicContact CB-CH2 4.22Å; P527-W545 HydrophobicContact CB-CZ3 3.89Å; P527-W545 HydrophobicContact CG-CZ3 4.13Å; W545-E680 HydrophobicContact CH2-CG 4.13Å; W545-I681 HydrophobicContact CB-CD1 3.9Å; W545-I681 HydrophobicContact CD2-CD1 3.38Å; W545-I681 HydrophobicContact CD2-CG1 3.68Å; W545-I681 HydrophobicContact CE3-CD1 3.57Å; W545-I681 HydrophobicContact CE3-CG1 3.87Å; W545-I681 HydrophobicContact CG-CD1 3.53Å; W545-I681 HydrophobicContact CG-CG1 4.2Å; W545-I681 HydrophobicContact CH2-CG1 4.07Å; W545-I681 HydrophobicContact CZ2-CG1 3.89Å; W545-I681 HydrophobicContact CZ3-CD1 4.21Å; W545-I681 HydrophobicContact CZ3-CG1 4.05Å; W545-N820 PolarHBondContact NE1-OD1 3.24Å; W545-I821 PolarHBondContact N-O 2.94Å; W545-L822 CarbonylContact O-C 3.34Å; W545-L822 WeakPolarHBondContact O-CA 3.29Å; W545-I823 PolarHBondContact O-N 2.93Å
546	L	98.3	Very high	96.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	117.3	-174.2	-54.6	178.4	0	0	0	110.3	L525 I526 L531 I544 L548 F782 I823 I825	L525-L546 WeakPolarHBondContact CA-O 3.47Å; I526-L546 HydrophobicContact CD1-CD1 4.45Å; I526-L546 HydrophobicContact CG1-CB 3.95Å; I526-L546 HydrophobicContact CG1-CD1 4.47Å; I526-L546 PolarHBondContact N-O 2.81Å; I526-L546 PolarHBondContact O-N 2.81Å; L531-L546 HydrophobicContact CD1-CD2 4.14Å; I544-L546 HydrophobicContact CG2-CD2 3.97Å; L546-L548 HydrophobicContact CB-CD2 3.91Å; L546-F782 HydrophobicContact CD1-CE2 3.86Å; L546-F782 HydrophobicContact CD1-CZ 4.34Å; L546-I823 HydrophobicContact CD2-CB 4.08Å; L546-I823 HydrophobicContact CD2-CD1 4.26Å; L546-I823 HydrophobicContact CD2-CG1 4.49Å; L546-I825 HydrophobicContact CB-CG1 4.09Å; L546-I825 HydrophobicContact CD2-CD1 4.15Å; L546-I825 HydrophobicContact CD2-CG1 4.2Å
547	K	98.3	Very high	96.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	103.2	175.7	-175.4	56.7	174.1	163.5	0	109.2	S523 L525 E549 I673 E676 L822 I823 I825	S523-K547 PolarHBondContact O-NZ 2.91Å; S523-K547 WeakPolarHBondContact OG-CD 3.41Å; S523-K547 WeakPolarHBondContact OG-CE 3.31Å; S523-K547 PolarHBondContact OG-NZ 3.23Å; L525-K547 HydrophobicContact CB-CD 4.26Å; L525-K547 HydrophobicContact CD1-CB 4.06Å; L525-K547 HydrophobicContact CD1-CD 4.4Å; K547-E549 PolarHBondContact O-N 2.78Å; K547-I673 HydrophobicContact CG-CG2 3.84Å; K547-E676 IonicContact NZ-OE2 3.16Å; K547-E676 PolarHBondContact NZ-OE2 3.26Å; K547-L822 HydrophobicContact CB-CD2 3.91Å; K547-L822 HydrophobicContact CB-CG 4.37Å; K547-I823 PolarHBondContact N-O 3.26Å; K547-I825 WeakPolarHBondContact O-CB 3.18Å; K547-I825 PolarHBondContact O-N 3.26Å
548	L	97.9	Very high	96.5	Very high	9 Å²	9	27.6 Å²	27.6	5%	0.047	15%	0.147	C	C	.	.			trans	-82.7	67.5	-163.4	-61.7	-170.5	0	0	0	113.9	S523 P524 I526 L546 N550 I551 M788 I825	S523-L548 WeakPolarHBondContact CB-O 3.47Å; P524-L548 HydrophobicContact CB-CD1 4.29Å; P524-L548 PolarHBondContact O-N 2.73Å; I526-L548 HydrophobicContact CD1-CD1 3.92Å; I526-L548 HydrophobicContact CD1-CG 4.49Å; I526-L548 HydrophobicContact CG1-CD1 4.23Å; I526-L548 HydrophobicContact CG1-CG 4.38Å; L546-L548 HydrophobicContact CB-CD2 3.91Å; L548-N550 WeakPolarHBondContact CA-OD1 3.09Å; L548-N550 WeakPolarHBondContact CB-OD1 3.37Å; L548-N550 PolarHBondContact O-N 3.24Å; L548-N550 PolarHBondContact O-OD1 2.74Å; L548-I551 HydrophobicContact CB-CG2 4.22Å; L548-I551 WeakPolarHBondContact O-CG1 3.41Å; L548-I551 PolarHBondContact O-N 3.07Å; L548-M788 HydrophobicContact CD1-CE 4.31Å; L548-M788 HydrophobicContact CD1-SD 4.37Å; L548-M788 HydrophobicContact CD2-CE 4.02Å; L548-M788 HydrophobicContact CD2-SD 4.46Å; L548-I825 HydrophobicContact CD2-CB 4.15Å; L548-I825 HydrophobicContact CD2-CG1 4.11Å; L548-I825 HydrophobicContact CD2-CG2 4.27Å
549	E	98.1	Very high	96.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-71	-10.2	176.4	-64.8	-57.9	130.7	0	0	114.1	S523 K547 I551 Q552 S556 F557 R560 I673 V824 I825	S523-E549 WeakPolarHBondContact CB-OE1 3.46Å; S523-E549 PolarHBondContact OG-OE1 2.84Å; K547-E549 PolarHBondContact O-N 2.78Å; E549-I551 PolarHBondContact O-N 2.73Å; E549-Q552 WeakPolarHBondContact O-CB 3.26Å; E549-Q552 VanDerWaalsContact O-CG 3.31Å; E549-Q552 WeakPolarHBondContact O-CG 3.2Å; E549-Q552 PolarHBondContact O-N 3.48Å; E549-Q552 WeakPolarHBondContact OE2-CG 3.47Å; E549-Q552 PolarHBondContact OE2-NE2 3.22Å; E549-S556 CarbonylContact O-C 3.56Å; E549-S556 WeakPolarHBondContact O-CA 3.07Å; E549-F557 HydrophobicContact CB-CB 3.71Å; E549-F557 HydrophobicContact CG-CB 3.88Å; E549-R560 VanDerWaalsContact CD-NE 3.32Å; E549-R560 IonicContact OE1-CZ 2.65Å; E549-R560 IonicContact OE1-NE 2.67Å; E549-R560 PolarHBondContact OE1-NE 2.69Å; E549-R560 IonicContact OE1-NH2 2.74Å; E549-R560 PolarHBondContact OE1-NH2 2.72Å; E549-R560 IonicContact OE2-CZ 3.22Å; E549-R560 IonicContact OE2-NE 2.95Å; E549-R560 PolarHBondContact OE2-NE 3.14Å; E549-R560 IonicContact OE2-NH2 2.71Å; E549-R560 PolarHBondContact OE2-NH2 3.26Å; E549-I673 HydrophobicContact CG-CD1 4.37Å; E549-V824 HydrophobicContact CG-CG1 4.24Å; E549-I825 CarbonylContact C-O 3.54Å; E549-I825 WeakPolarHBondContact CA-O 3.4Å; E549-I825 WeakPolarHBondContact CB-O 3.2Å; E549-I825 PolarHBondContact N-O 2.99Å
550	N	96.4	Very high	96.9	Very high	27 Å²	27	20.9 Å²	20.9	14%	0.144	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-62.8	-22.1	168.1	67.4	-35.8	0	0	0	113.7	L548 Q552 M788 V790 I825 G827	L548-N550 WeakPolarHBondContact CA-OD1 3.09Å; L548-N550 WeakPolarHBondContact CB-OD1 3.37Å; L548-N550 PolarHBondContact O-N 3.24Å; L548-N550 PolarHBondContact O-OD1 2.74Å; N550-Q552 VanDerWaalsContact C-N 3.35Å; N550-M788 PolarHBondContact ND2-SD 3.28Å; N550-V790 HydrophobicContact CB-CG1 4.43Å; N550-I825 HydrophobicContact CB-CG2 4.28Å; N550-I825 PolarHBondContact N-O 3.3Å; N550-G827 VanDerWaalsContact CB-CA 3.46Å
551	I	96.1	Very high	97	Very high	79 Å²	79	20.8 Å²	20.8	41%	0.405	11%	0.105	S	C	.	.	G	3₁₀ helix	trans	-85.7	-1.2	178.9	76.6	115	0	0	0	114.3	V521 P524 L548 E549	V521-I551 HydrophobicContact CG2-CD1 3.86Å; P524-I551 HydrophobicContact CG-CD1 4.45Å; L548-I551 HydrophobicContact CB-CG2 4.22Å; L548-I551 WeakPolarHBondContact O-CG1 3.41Å; L548-I551 PolarHBondContact O-N 3.07Å; E549-I551 PolarHBondContact O-N 2.73Å
552	Q	97.3	Very high	97.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	S	Bend	trans	-57	152.7	172.5	-70.1	-62.8	-12	0	0	110.8	V521 E549 N550 T554 G555 S556 I559	V521-Q552 PolarHBondContact O-NE2 2.92Å; E549-Q552 WeakPolarHBondContact O-CB 3.26Å; E549-Q552 VanDerWaalsContact O-CG 3.31Å; E549-Q552 WeakPolarHBondContact O-CG 3.2Å; E549-Q552 PolarHBondContact O-N 3.48Å; E549-Q552 WeakPolarHBondContact OE2-CG 3.47Å; E549-Q552 PolarHBondContact OE2-NE2 3.22Å; N550-Q552 VanDerWaalsContact C-N 3.35Å; Q552-T554 VanDerWaalsContact C-N 3.26Å; Q552-T554 PolarHBondContact O-N 3.44Å; Q552-T554 VanDerWaalsContact O-N 3.12Å; Q552-G555 WeakPolarHBondContact O-CA 3.34Å; Q552-G555 PolarHBondContact O-N 2.77Å; Q552-S556 WeakPolarHBondContact CB-O 3.45Å; Q552-I559 HydrophobicContact CB-CG2 3.72Å; Q552-I559 HydrophobicContact CG-CG2 3.86Å
553	P	94.6	Very high	97	Very high	47 Å²	47	15.3 Å²	15.3	31%	0.305	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-38.1	-174.9	-29.5	36.7	0	0	0	114.5	L519 V521 G555 F591 R829	L519-P553 WeakPolarHBondContact O-CG 3.39Å; V521-P553 HydrophobicContact CG1-CG 4.43Å; P553-G555 VanDerWaalsContact C-N 3.3Å; P553-F591 HydrophobicContact CB-CE1 4.02Å; P553-F591 HydrophobicContact CB-CZ 4.02Å; P553-R829 PolarHBondContact O-NH1 2.86Å; P553-R829 PolarHBondContact O-NH2 3.29Å
554	T	94.8	Very high	97	Very high	3 Å²	3	11.9 Å²	11.9	2%	0.018	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	7.3	177.1	64.4	0	0	0	0	113.8	Q552 S556 I559 V587 F591 R615	Q552-T554 VanDerWaalsContact C-N 3.26Å; Q552-T554 PolarHBondContact O-N 3.44Å; Q552-T554 VanDerWaalsContact O-N 3.12Å; T554-S556 PolarHBondContact O-N 3.47Å; T554-I559 HydrophobicContact CG2-CB 4.47Å; T554-I559 HydrophobicContact CG2-CD1 4.34Å; T554-V587 HydrophobicContact CG2-CG1 4.06Å; T554-F591 HydrophobicContact CG2-CB 3.75Å; T554-F591 HydrophobicContact CG2-CD1 3.65Å; T554-F591 HydrophobicContact CG2-CE1 4.4Å; T554-F591 HydrophobicContact CG2-CG 3.75Å; T554-R615 PolarHBondContact O-NH2 2.84Å
555	G	95	Very high	97	Very high	1 Å²	1	11.9 Å²	11.9	1%	0.01	6%	0.061	C	C	.	.	S	Bend	trans	76.9	10.9	174.9	0	0	0	0	0	115.8	Q552 P553 G828	Q552-G555 WeakPolarHBondContact O-CA 3.34Å; Q552-G555 PolarHBondContact O-N 2.77Å; P553-G555 VanDerWaalsContact C-N 3.3Å; G555-G828 WeakPolarHBondContact O-CA 3.43Å; G555-G828 PolarHBondContact O-N 2.86Å
556	S	96.7	Very high	96.9	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.007	6%	0.057	C	C	.	.	B	Isolated β-bridge	trans	-154.7	162.4	173.8	68.8	0	0	0	0	112.8	E549 Q552 T554 K558 G826	E549-S556 CarbonylContact O-C 3.56Å; E549-S556 WeakPolarHBondContact O-CA 3.07Å; Q552-S556 WeakPolarHBondContact CB-O 3.45Å; T554-S556 PolarHBondContact O-N 3.47Å; S556-K558 PolarHBondContact O-N 3.08Å; S556-G826 VanDerWaalsContact CA-O 3.26Å; S556-G826 WeakPolarHBondContact CA-O 3.46Å; S556-G826 VanDerWaalsContact CB-O 3.27Å; S556-G826 WeakPolarHBondContact CB-O 3.44Å
557	F	97.6	Very high	96.8	Very high	25 Å²	25	14.5 Å²	14.5	11%	0.11	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-25.5	175.6	71.9	-90.3	0	0	0	114.4	E549 I559 R560 Y670 I673 L696 G826	E549-F557 HydrophobicContact CB-CB 3.71Å; E549-F557 HydrophobicContact CG-CB 3.88Å; F557-I559 PolarHBondContact O-N 2.82Å; F557-R560 PolarHBondContact O-N 2.95Å; F557-Y670 AromaticContact CD2-CD1 3.94Å; F557-Y670 HydrophobicContact CD2-CD1 3.94Å; F557-Y670 AromaticContact CD2-CE1 3.51Å; F557-Y670 HydrophobicContact CD2-CE1 3.51Å; F557-Y670 HydrophobicContact CD2-CE2 4.36Å; F557-Y670 AromaticContact CD2-CZ 3.75Å; F557-Y670 AromaticContact CE2-CE1 3.92Å; F557-Y670 HydrophobicContact CE2-CE1 3.92Å; F557-Y670 HydrophobicContact CE2-CE2 4.03Å; F557-Y670 AromaticContact CE2-CZ 3.64Å; F557-Y670 WeakPolarHBondContact O-CE1 3.37Å; F557-I673 HydrophobicContact CB-CD1 4.39Å; F557-L696 HydrophobicContact CD1-CD2 4.22Å; F557-L696 HydrophobicContact CD2-CB 4.37Å; F557-L696 HydrophobicContact CD2-CD1 3.9Å; F557-L696 HydrophobicContact CD2-CD2 4.18Å; F557-L696 HydrophobicContact CD2-CG 4.38Å; F557-L696 HydrophobicContact CE1-CD2 4.02Å; F557-L696 HydrophobicContact CE2-CB 3.76Å; F557-L696 HydrophobicContact CE2-CD1 4.17Å; F557-L696 HydrophobicContact CE2-CD2 4.01Å; F557-L696 HydrophobicContact CE2-CG 4.19Å; F557-L696 HydrophobicContact CG-CD1 4.41Å; F557-L696 HydrophobicContact CG-CD2 4.29Å; F557-L696 HydrophobicContact CZ-CB 4.09Å; F557-L696 HydrophobicContact CZ-CD2 3.91Å; F557-G826 PolarHBondContact N-O 2.65Å
558	K	97	Very high	96.6	Very high	25 Å²	25	17.6 Å²	17.6	11%	0.109	9%	0.085	C	C	.	.	H	α-helix	trans	-58.8	-24.7	-170.1	-66.6	-169.6	174.7	65.2	0	113.9	S556 R560 V562 N584 A585 A588	S556-K558 PolarHBondContact O-N 3.08Å; K558-R560 VanDerWaalsContact C-N 3.28Å; K558-R560 PolarHBondContact O-N 2.99Å; K558-V562 WeakPolarHBondContact O-CB 3.33Å; K558-V562 WeakPolarHBondContact O-CG2 3.49Å; K558-V562 PolarHBondContact O-N 2.96Å; K558-V562 VanDerWaalsContact O-N 3.13Å; K558-N584 HydrophobicContact CD-CB 3.87Å; K558-A585 HydrophobicContact CD-CB 4.05Å; K558-A588 HydrophobicContact CB-CB 4.28Å
559	I	97.1	Very high	96.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.3	-33.5	175	-171.9	56.6	0	0	0	113	L519 Q552 T554 F557 G561 E563 A588 F591 A592	L519-I559 HydrophobicContact CB-CD1 4.45Å; L519-I559 HydrophobicContact CB-CG1 4.37Å; Q552-I559 HydrophobicContact CB-CG2 3.72Å; Q552-I559 HydrophobicContact CG-CG2 3.86Å; T554-I559 HydrophobicContact CG2-CB 4.47Å; T554-I559 HydrophobicContact CG2-CD1 4.34Å; F557-I559 PolarHBondContact O-N 2.82Å; I559-G561 PolarHBondContact O-N 2.54Å; I559-E563 HydrophobicContact CD1-CB 4.26Å; I559-E563 HydrophobicContact CG1-CB 4.5Å; I559-E563 WeakPolarHBondContact O-CA 3.46Å; I559-E563 WeakPolarHBondContact O-CB 3.09Å; I559-E563 PolarHBondContact O-N 2.74Å; I559-A588 HydrophobicContact CD1-CB 4.48Å; I559-F591 HydrophobicContact CD1-CD1 3.89Å; I559-A592 HydrophobicContact CD1-CB 4.3Å
560	R	97.7	Very high	96.3	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.008	10%	0.095	C	C	.	.	H	α-helix	trans	-61.6	-50	-177.3	-64.2	177.4	175.2	-87.7	0.3	112.4	V521 S523 E549 F557 K558 N564 G669 Y670 T672 I673 E676	V521-R560 PolarHBondContact O-NH2 3.49Å; S523-R560 PolarHBondContact OG-NH2 3.42Å; E549-R560 VanDerWaalsContact CD-NE 3.32Å; E549-R560 IonicContact OE1-CZ 2.65Å; E549-R560 IonicContact OE1-NE 2.67Å; E549-R560 PolarHBondContact OE1-NE 2.69Å; E549-R560 IonicContact OE1-NH2 2.74Å; E549-R560 PolarHBondContact OE1-NH2 2.72Å; E549-R560 IonicContact OE2-CZ 3.22Å; E549-R560 IonicContact OE2-NE 2.95Å; E549-R560 PolarHBondContact OE2-NE 3.14Å; E549-R560 IonicContact OE2-NH2 2.71Å; E549-R560 PolarHBondContact OE2-NH2 3.26Å; F557-R560 PolarHBondContact O-N 2.95Å; K558-R560 VanDerWaalsContact C-N 3.28Å; K558-R560 PolarHBondContact O-N 2.99Å; R560-N564 WeakPolarHBondContact O-CB 3.23Å; R560-N564 PolarHBondContact O-N 2.88Å; R560-G669 WeakPolarHBondContact CB-O 3.42Å; R560-G669 WeakPolarHBondContact O-CA 3.29Å; R560-Y670 HydrophobicContact CB-CD1 4.05Å; R560-Y670 HydrophobicContact CB-CE1 4.46Å; R560-T672 PolarHBondContact NH1-OG1 3.26Å; R560-I673 VanDerWaalsContact CD-CG1 3.49Å; R560-E676 IonicContact CZ-OE1 2.77Å; R560-E676 IonicContact CZ-OE2 2.71Å; R560-E676 IonicContact NH1-OE1 3.24Å; R560-E676 PolarHBondContact NH1-OE1 3.18Å; R560-E676 IonicContact NH1-OE2 2.79Å; R560-E676 VanDerWaalsContact NH2-CD 3.27Å; R560-E676 IonicContact NH2-OE1 3.47Å; R560-E676 PolarHBondContact NH2-OE1 2.65Å; R560-E676 IonicContact NH2-OE2 3.2Å; R560-E676 PolarHBondContact NH2-OE2 3.16Å
561	G	97.5	Very high	96.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.6	-51	177	0	0	0	0	0	111.9	I559 E563 N564 V565 L666 Y670	I559-G561 PolarHBondContact O-N 2.54Å; G561-E563 PolarHBondContact O-N 2.71Å; G561-N564 PolarHBondContact O-N 3.27Å; G561-N564 VanDerWaalsContact O-N 3.14Å; G561-V565 WeakPolarHBondContact O-CG2 3.27Å; G561-V565 PolarHBondContact O-N 2.94Å; G561-V565 VanDerWaalsContact O-N 3.14Å; G561-L666 VanDerWaalsContact CA-O 3.23Å; G561-L666 WeakPolarHBondContact CA-O 3.3Å; G561-Y670 VanDerWaalsContact N-CE1 3.32Å
562	V	97.5	Very high	96.1	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-64.5	-41.5	-177.4	171.9	0	0	0	0	112.4	K558 N564 V565 V566 A588 A589 A592 L658 L666	K558-V562 WeakPolarHBondContact O-CB 3.33Å; K558-V562 WeakPolarHBondContact O-CG2 3.49Å; K558-V562 PolarHBondContact O-N 2.96Å; K558-V562 VanDerWaalsContact O-N 3.13Å; V562-N564 VanDerWaalsContact C-N 3.33Å; V562-N564 PolarHBondContact O-N 2.9Å; V562-V565 PolarHBondContact O-N 3.47Å; V562-V566 HydrophobicContact CG1-CG2 4.1Å; V562-V566 WeakPolarHBondContact O-CB 3.38Å; V562-V566 VanDerWaalsContact O-CG2 3.26Å; V562-V566 WeakPolarHBondContact O-CG2 3.28Å; V562-V566 PolarHBondContact O-N 3.2Å; V562-A588 HydrophobicContact CB-CB 4Å; V562-A588 HydrophobicContact CG1-CB 4.13Å; V562-A588 HydrophobicContact CG2-CB 4.05Å; V562-A589 HydrophobicContact CG1-CB 4.35Å; V562-A592 HydrophobicContact CG1-CB 4.23Å; V562-L658 HydrophobicContact CG1-CD2 3.83Å; V562-L666 HydrophobicContact CG2-CD1 4.42Å
563	E	96.3	Very high	96	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.7	-46.5	171.9	-178.2	-145.2	122.9	0	0	110.8	R518 L519 S520 I559 G561 V565 V566 R567 Y596	R518-E563 WeakPolarHBondContact CD-OE1 3.36Å; R518-E563 IonicContact NE-OE1 2.66Å; R518-E563 IonicContact NH1-OE1 3.8Å; R518-E563 PolarHBondContact NH1-OE1 2.96Å; L519-E563 HydrophobicContact CB-CG 4Å; L519-E563 HydrophobicContact CD1-CG 4.12Å; L519-E563 HydrophobicContact CG-CG 3.9Å; L519-E563 PolarHBondContact N-OE2 3.46Å; S520-E563 WeakPolarHBondContact CB-OE2 3.19Å; S520-E563 PolarHBondContact N-OE2 3.33Å; S520-E563 PolarHBondContact OG-OE2 2.85Å; I559-E563 HydrophobicContact CD1-CB 4.26Å; I559-E563 HydrophobicContact CG1-CB 4.5Å; I559-E563 WeakPolarHBondContact O-CA 3.46Å; I559-E563 WeakPolarHBondContact O-CB 3.09Å; I559-E563 PolarHBondContact O-N 2.74Å; G561-E563 PolarHBondContact O-N 2.71Å; E563-V565 VanDerWaalsContact C-N 3.31Å; E563-V565 PolarHBondContact O-N 2.8Å; E563-V566 PolarHBondContact O-N 2.95Å; E563-R567 WeakPolarHBondContact O-CB 3.45Å; E563-R567 PolarHBondContact O-N 2.67Å; E563-Y596 HydrophobicContact CG-CE2 4.06Å
564	N	97	Very high	96.1	Very high	6 Å²	6	21.8 Å²	21.8	3%	0.032	14%	0.141	C	C	.	.	H	α-helix	trans	-63.5	-37.7	-175.9	-163.7	60.3	0	0	0	112.4	R518 R560 G561 V562 R567 K568 E665 E668	R518-N564 PolarHBondContact NH1-OD1 3.37Å; R560-N564 WeakPolarHBondContact O-CB 3.23Å; R560-N564 PolarHBondContact O-N 2.88Å; G561-N564 PolarHBondContact O-N 3.27Å; G561-N564 VanDerWaalsContact O-N 3.14Å; V562-N564 VanDerWaalsContact C-N 3.33Å; V562-N564 PolarHBondContact O-N 2.9Å; N564-R567 PolarHBondContact OD1-NH2 3.24Å; N564-K568 WeakPolarHBondContact O-CB 3.31Å; N564-K568 WeakPolarHBondContact O-CG 3.5Å; N564-K568 PolarHBondContact O-N 3.14Å; N564-E665 WeakPolarHBondContact CB-O 3.38Å; N564-E665 PolarHBondContact ND2-O 3.17Å; N564-E668 PolarHBondContact ND2-OE2 3.17Å
565	V	97.2	Very high	96	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.7	-60.3	170.1	-177.2	0	0	0	0	110.7	G561 V562 E563 R567 K568 W569 L658 E665 L666	G561-V565 WeakPolarHBondContact O-CG2 3.27Å; G561-V565 PolarHBondContact O-N 2.94Å; G561-V565 VanDerWaalsContact O-N 3.14Å; V562-V565 PolarHBondContact O-N 3.47Å; E563-V565 VanDerWaalsContact C-N 3.31Å; E563-V565 PolarHBondContact O-N 2.8Å; V565-R567 VanDerWaalsContact C-N 3.3Å; V565-R567 PolarHBondContact O-N 3.04Å; V565-K568 PolarHBondContact O-N 3.44Å; V565-K568 VanDerWaalsContact O-N 3.11Å; V565-W569 HydrophobicContact CG1-CD2 3.59Å; V565-W569 HydrophobicContact CG1-CE3 3.91Å; V565-W569 HydrophobicContact CG1-CG 4.17Å; V565-W569 HydrophobicContact CG1-CH2 3.73Å; V565-W569 HydrophobicContact CG1-CZ2 3.41Å; V565-W569 VanDerWaalsContact CG1-CZ2 3.41Å; V565-W569 HydrophobicContact CG1-CZ3 3.98Å; V565-W569 WeakPolarHBondContact O-CB 3.39Å; V565-W569 PolarHBondContact O-N 2.82Å; V565-L658 HydrophobicContact CB-CD1 3.94Å; V565-L658 HydrophobicContact CG1-CD1 3.65Å; V565-L658 HydrophobicContact CG2-CD1 4.21Å; V565-E665 HydrophobicContact CG2-CB 4.08Å; V565-L666 HydrophobicContact CG2-CB 3.68Å
566	V	96.7	Very high	96.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.5	-36.7	-171.2	177.5	0	0	0	0	111.7	V562 E563 W569 A570 I577 A592 Y596 I598 L658	V562-V566 HydrophobicContact CG1-CG2 4.1Å; V562-V566 WeakPolarHBondContact O-CB 3.38Å; V562-V566 VanDerWaalsContact O-CG2 3.26Å; V562-V566 WeakPolarHBondContact O-CG2 3.28Å; V562-V566 PolarHBondContact O-N 3.2Å; E563-V566 PolarHBondContact O-N 2.95Å; V566-W569 PolarHBondContact O-N 2.96Å; V566-A570 WeakPolarHBondContact O-CB 3.16Å; V566-A570 PolarHBondContact O-N 3.34Å; V566-I577 HydrophobicContact CG2-CD1 4.06Å; V566-A592 HydrophobicContact CB-CB 4.02Å; V566-A592 HydrophobicContact CG1-CB 4.06Å; V566-A592 HydrophobicContact CG2-CB 4.16Å; V566-Y596 HydrophobicContact CB-CD2 4.38Å; V566-Y596 HydrophobicContact CG1-CD2 3.77Å; V566-Y596 HydrophobicContact CG1-CG 4.37Å; V566-I598 HydrophobicContact CG1-CD1 3.92Å; V566-L658 HydrophobicContact CG2-CD2 4.21Å
567	R	95.2	Very high	96.2	Very high	78 Å²	78	24.7 Å²	24.7	29%	0.294	16%	0.157	S	C	.	.	H	α-helix	trans	-64.6	-44.3	174.4	-176.7	-171.8	62	71.4	3.7	112.7	E563 N564 V565 W569 A571 Y596	E563-R567 WeakPolarHBondContact O-CB 3.45Å; E563-R567 PolarHBondContact O-N 2.67Å; N564-R567 PolarHBondContact OD1-NH2 3.24Å; V565-R567 VanDerWaalsContact C-N 3.3Å; V565-R567 PolarHBondContact O-N 3.04Å; R567-W569 VanDerWaalsContact C-N 3.32Å; R567-A571 PolarHBondContact O-N 3.34Å; R567-Y596 HydrophobicContact CB-CE1 4.04Å; R567-Y596 HydrophobicContact CB-CE2 3.83Å; R567-Y596 HydrophobicContact CG-CE1 3.84Å; R567-Y596 HydrophobicContact CG-CE2 4.46Å
568	K	94.7	Very high	96.2	Very high	65 Å²	65	23.5 Å²	23.5	28%	0.283	15%	0.152	S	C	.	.	H	α-helix	trans	-64.7	-40.1	174.7	-78.6	-178.6	-179.9	-168.8	0	110.8	N564 V565 A571 A572 E665 E668	N564-K568 WeakPolarHBondContact O-CB 3.31Å; N564-K568 WeakPolarHBondContact O-CG 3.5Å; N564-K568 PolarHBondContact O-N 3.14Å; V565-K568 PolarHBondContact O-N 3.44Å; V565-K568 VanDerWaalsContact O-N 3.11Å; K568-A571 PolarHBondContact O-N 3.4Å; K568-A572 WeakPolarHBondContact O-CB 3.27Å; K568-A572 PolarHBondContact O-N 2.75Å; K568-E665 HydrophobicContact CD-CB 3.95Å; K568-E665 HydrophobicContact CD-CG 3.68Å; K568-E665 VanDerWaalsContact NZ-CG 3.28Å; K568-E668 WeakPolarHBondContact CE-OE2 3.29Å; K568-E668 IonicContact NZ-OE1 3.42Å; K568-E668 PolarHBondContact NZ-OE1 3.09Å; K568-E668 IonicContact NZ-OE2 3.55Å; K568-E668 PolarHBondContact NZ-OE2 2.9Å
569	W	95.9	Very high	96.2	Very high	17 Å²	17	22.3 Å²	22.3	6%	0.064	15%	0.147	C	C	.	.	H	α-helix	trans	-69.8	-37.2	180	-74.9	13.4	0	0	0	112.5	V565 V566 R567 A572 G573 V574 I577 R656 L657 L658	V565-W569 HydrophobicContact CG1-CD2 3.59Å; V565-W569 HydrophobicContact CG1-CE3 3.91Å; V565-W569 HydrophobicContact CG1-CG 4.17Å; V565-W569 HydrophobicContact CG1-CH2 3.73Å; V565-W569 HydrophobicContact CG1-CZ2 3.41Å; V565-W569 VanDerWaalsContact CG1-CZ2 3.41Å; V565-W569 HydrophobicContact CG1-CZ3 3.98Å; V565-W569 WeakPolarHBondContact O-CB 3.39Å; V565-W569 PolarHBondContact O-N 2.82Å; V566-W569 PolarHBondContact O-N 2.96Å; R567-W569 VanDerWaalsContact C-N 3.32Å; W569-A572 CarbonylContact O-C 3.59Å; W569-A572 WeakPolarHBondContact O-CA 3.49Å; W569-A572 PolarHBondContact O-N 2.7Å; W569-A572 VanDerWaalsContact O-N 3.07Å; W569-G573 PolarHBondContact O-N 3.08Å; W569-V574 HydrophobicContact CB-CB 3.87Å; W569-V574 HydrophobicContact CB-CG1 4.23Å; W569-V574 HydrophobicContact CB-CG2 3.67Å; W569-V574 HydrophobicContact CD2-CG2 4.46Å; W569-V574 HydrophobicContact CE3-CG1 4.34Å; W569-V574 HydrophobicContact CG-CG2 4.08Å; W569-V574 WeakPolarHBondContact O-CB 3.34Å; W569-V574 PolarHBondContact O-N 3Å; W569-I577 HydrophobicContact CE3-CG2 3.77Å; W569-I577 HydrophobicContact CZ3-CG2 3.92Å; W569-R656 HydrophobicContact CE3-CB 3.9Å; W569-R656 HydrophobicContact CH2-CB 4.03Å; W569-R656 HydrophobicContact CZ3-CB 3.55Å; W569-L657 WeakPolarHBondContact CH2-O 3.46Å; W569-L658 HydrophobicContact CH2-CB 4.49Å; W569-L658 HydrophobicContact CZ3-CB 4.16Å
570	A	94.5	Very high	96.1	Very high	24 Å²	24	22.3 Å²	22.3	20%	0.198	15%	0.147	C	C	.	.	H	α-helix	trans	-59	-46.4	170.2	0	0	0	0	0	111.9	V566 A572 G573 Y596 I598	V566-A570 WeakPolarHBondContact O-CB 3.16Å; V566-A570 PolarHBondContact O-N 3.34Å; A570-A572 PolarHBondContact O-N 3.13Å; A570-G573 PolarHBondContact O-N 3.16Å; A570-Y596 HydrophobicContact CB-CD1 4.25Å; A570-Y596 HydrophobicContact CB-CG 4.26Å; A570-I598 HydrophobicContact CB-CD1 3.75Å; A570-I598 HydrophobicContact CB-CG1 4.49Å
571	A	93.6	Very high	95.8	Very high	83 Å²	83	22.3 Å²	22.3	69%	0.686	15%	0.148	S	C	*	.	H	α-helix	trans	-65.1	-22.7	174.7	0	0	0	0	0	113.3	R567 K568	R567-A571 PolarHBondContact O-N 3.34Å; K568-A571 PolarHBondContact O-N 3.4Å
572	A	94.2	Very high	95.2	Very high	72 Å²	72	24.6 Å²	24.6	60%	0.595	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	3.7	173.8	0	0	0	0	0	114	K568 W569 A570	K568-A572 WeakPolarHBondContact O-CB 3.27Å; K568-A572 PolarHBondContact O-N 2.75Å; W569-A572 CarbonylContact O-C 3.59Å; W569-A572 WeakPolarHBondContact O-CA 3.49Å; W569-A572 PolarHBondContact O-N 2.7Å; W569-A572 VanDerWaalsContact O-N 3.07Å; A570-A572 PolarHBondContact O-N 3.13Å
573	G	94.7	Very high	94.6	Very high	47 Å²	47	24.6 Å²	24.6	49%	0.485	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	20.5	175.2	0	0	0	0	0	116.4	W569 A570 S575 T654	W569-G573 PolarHBondContact O-N 3.08Å; A570-G573 PolarHBondContact O-N 3.16Å; G573-S575 PolarHBondContact O-N 3.36Å; G573-T654 VanDerWaalsContact O-CB 3.27Å; G573-T654 WeakPolarHBondContact O-CB 3.35Å; G573-T654 WeakPolarHBondContact O-CG2 3.4Å
574	V	96.2	Very high	94.4	Very high	8 Å²	8	24.8 Å²	24.8	5%	0.048	16%	0.163	C	C	.	.			trans	-61.9	117.7	175.8	163.7	0	0	0	0	111.6	W569 I577 I598 T654 R656	W569-V574 HydrophobicContact CB-CB 3.87Å; W569-V574 HydrophobicContact CB-CG1 4.23Å; W569-V574 HydrophobicContact CB-CG2 3.67Å; W569-V574 HydrophobicContact CD2-CG2 4.46Å; W569-V574 HydrophobicContact CE3-CG1 4.34Å; W569-V574 HydrophobicContact CG-CG2 4.08Å; W569-V574 WeakPolarHBondContact O-CB 3.34Å; W569-V574 PolarHBondContact O-N 3Å; V574-I577 HydrophobicContact CG1-CG2 4Å; V574-I598 HydrophobicContact CB-CD1 4.47Å; V574-I598 HydrophobicContact CG1-CD1 4.32Å; V574-I598 HydrophobicContact CG1-CG2 4.22Å; V574-I598 WeakPolarHBondContact O-CG1 3.31Å; V574-T654 VanDerWaalsContact CA-O 3.29Å; V574-T654 WeakPolarHBondContact CA-O 3.46Å; V574-T654 VanDerWaalsContact CG1-O 3.3Å; V574-T654 WeakPolarHBondContact CG1-O 3.46Å; V574-R656 HydrophobicContact CG2-CG 4.09Å
575	S	94.3	Very high	94.3	Very high	37 Å²	37	24.8 Å²	24.8	26%	0.259	16%	0.163	S	C	.	.			trans	-77.2	-35.3	179	71.1	0	0	0	0	113.3	G573 N599 D652 T654	G573-S575 PolarHBondContact O-N 3.36Å; S575-N599 PolarHBondContact O-N 3.39Å; S575-D652 WeakPolarHBondContact CB-OD2 3.48Å; S575-D652 PolarHBondContact OG-OD2 2.83Å; S575-T654 WeakPolarHBondContact CB-OG1 3.39Å; S575-T654 PolarHBondContact N-O 3.42Å; S575-T654 PolarHBondContact N-OG1 2.89Å; S575-T654 PolarHBondContact OG-OG1 3.08Å
576	H	97.1	Very high	94.2	Very high	28 Å²	28	24.8 Å²	24.8	13%	0.13	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	133.2	-166.1	-162.2	114.3	0	0	0	111.6	N599 T601 V655 R656	H576-N599 CarbonylContact C-O 3.59Å; H576-N599 VanDerWaalsContact CA-O 3.32Å; H576-N599 WeakPolarHBondContact CA-O 3.39Å; H576-N599 HydrophobicContact CB-CB 4.12Å; H576-N599 WeakPolarHBondContact ND1-CB 3.49Å; H576-T601 PolarHBondContact NE2-OG1 3.44Å; H576-V655 HydrophobicContact CB-CB 4.39Å; H576-V655 HydrophobicContact CB-CG1 4.13Å; H576-V655 HydrophobicContact CB-CG2 4.06Å; H576-V655 CarbonylContact O-C 3.48Å; H576-V655 WeakPolarHBondContact O-CA 3.45Å; H576-R656 PolarHBondContact O-N 3.26Å
577	I	97.6	Very high	94.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	140.2	168.1	59.8	161.2	0	0	0	112.3	V566 W569 V574 A589 A593 I598 N599 C600 T601 R656 L658	V566-I577 HydrophobicContact CG2-CD1 4.06Å; W569-I577 HydrophobicContact CE3-CG2 3.77Å; W569-I577 HydrophobicContact CZ3-CG2 3.92Å; V574-I577 HydrophobicContact CG1-CG2 4Å; I577-A589 HydrophobicContact CD1-CB 4.12Å; I577-A593 HydrophobicContact CD1-CB 3.81Å; I577-A593 HydrophobicContact CG1-CB 4.03Å; I577-I598 HydrophobicContact CG1-CG2 4.24Å; I577-I598 HydrophobicContact CG2-CG2 4.08Å; I577-N599 PolarHBondContact N-O 2.87Å; I577-C600 HydrophobicContact CG1-CB 4.33Å; I577-T601 PolarHBondContact O-N 3.22Å; I577-R656 CarbonylContact C-O 3.51Å; I577-R656 WeakPolarHBondContact CA-O 3.46Å; I577-L658 HydrophobicContact CD1-CD2 3.8Å
578	V	97.8	Very high	94.2	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.3	167.9	-171.9	0	0	0	0	108	T601 V603 A639 L642 V643 L646 R656 L657 L658	V578-T601 CarbonylContact C-O 3.52Å; V578-T601 WeakPolarHBondContact CA-O 3.48Å; V578-V603 HydrophobicContact CG1-CG2 3.74Å; V578-A639 HydrophobicContact CG1-CB 3.77Å; V578-L642 HydrophobicContact CG1-CD2 4.13Å; V578-L642 HydrophobicContact CG2-CD2 4.38Å; V578-V643 HydrophobicContact CB-CG2 3.71Å; V578-V643 HydrophobicContact CG2-CG2 3.58Å; V578-L646 HydrophobicContact CG2-CD1 4.31Å; V578-R656 PolarHBondContact N-O 3.47Å; V578-L657 CarbonylContact O-C 3.23Å; V578-L657 WeakPolarHBondContact O-CA 3.44Å; V578-L658 PolarHBondContact O-N 3.17Å
579	C	97.3	Very high	94.3	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.007	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	114.3	-177.2	-169.9	0	0	0	0	111.5	A589 T601 L602 V603 L658	C579-A589 HydrophobicContact CB-CB 4.01Å; C579-T601 PolarHBondContact N-O 3.16Å; C579-L602 HydrophobicContact CB-CD2 4.05Å; C579-L602 WeakPolarHBondContact O-CA 3.4Å; C579-V603 PolarHBondContact O-N 2.78Å; C579-L658 HydrophobicContact CB-CB 4.2Å; C579-L658 HydrophobicContact CB-CD2 4.28Å; C579-L658 PolarHBondContact SG-O 2.99Å
580	P	95	Very high	94.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	133.9	171.8	30	-32.1	0	0	0	110.5	V603 F632 H636 A639	P580-V603 CarbonylContact C-O 3.58Å; P580-V603 WeakPolarHBondContact CA-O 3.42Å; P580-F632 HydrophobicContact CB-CE2 4.19Å; P580-H636 HydrophobicContact CB-CB 4.24Å; P580-H636 HydrophobicContact CG-CB 4.32Å; P580-A639 HydrophobicContact CB-CB 4.04Å; P580-A639 HydrophobicContact CG-CB 4.15Å
581	T	92.3	Very high	94.4	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.012	14%	0.141	C	C	.	.			trans	-156.6	154.5	-168.2	-158.6	0	0	0	0	116	G583 G586 L602 V603 V604	T581-G583 PolarHBondContact OG1-N 3.41Å; T581-G586 PolarHBondContact OG1-N 3.25Å; T581-L602 HydrophobicContact CG2-CB 4.28Å; T581-V603 PolarHBondContact N-O 3.42Å; T581-V604 HydrophobicContact CG2-CG1 3.86Å
582	T	83.6	Confident	94.5	Very high	47 Å²	47	15.9 Å²	15.9	29%	0.288	11%	0.109	S	C	.	.	S	Bend	trans	-119.1	19.4	168.7	52.6	0	0	0	0	112.1	P605 V612 F632 N830	T582-P605 HydrophobicContact CG2-CG 4.42Å; T582-V612 WeakPolarHBondContact O-CG1 3.47Å; T582-F632 HydrophobicContact CG2-CD2 4.23Å; T582-N830 PolarHBondContact O-ND2 2.94Å
583	G	85.7	Confident	94.7	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.01	8%	0.08	C	C	.	.	S	Bend	trans	137.3	-90.4	168.2	0	0	0	0	0	114.8	T581 A585 G586 V587	T581-G583 PolarHBondContact OG1-N 3.41Å; G583-A585 PolarHBondContact O-N 3.33Å; G583-G586 PolarHBondContact O-N 3.21Å; G583-V587 PolarHBondContact O-N 3.26Å; G583-V587 VanDerWaalsContact O-N 3.14Å
584	N	93	Very high	94.6	Very high	4 Å²	4	14.6 Å²	14.6	2%	0.021	8%	0.077	C	C	.	.	H	α-helix	trans	-50.7	-35.2	-170.6	-78.3	-50.5	0	0	0	114.3	K558 A588 R615 S746 D791 G828 R829	K558-N584 HydrophobicContact CD-CB 3.87Å; N584-A588 PolarHBondContact O-N 2.94Å; N584-R615 PolarHBondContact OD1-NH1 2.77Å; N584-S746 PolarHBondContact ND2-OG 2.89Å; N584-D791 PolarHBondContact ND2-OD2 2.79Å; N584-G828 WeakPolarHBondContact OD1-CA 3.43Å; N584-R829 PolarHBondContact OD1-N 3.13Å
585	A	94	Very high	94.6	Very high	6 Å²	6	16.7 Å²	16.7	5%	0.05	9%	0.09	C	C	.	.	H	α-helix	trans	-74.1	-37.3	176.5	0	0	0	0	0	113	K558 G583 A588 A589 P660	K558-A585 HydrophobicContact CD-CB 4.05Å; G583-A585 PolarHBondContact O-N 3.33Å; A585-A588 WeakPolarHBondContact O-CB 3.37Å; A585-A588 PolarHBondContact O-N 2.87Å; A585-A589 WeakPolarHBondContact O-CB 3.26Å; A585-A589 PolarHBondContact O-N 3.39Å; A585-P660 HydrophobicContact CB-CB 3.66Å
586	G	94.6	Very high	94.6	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.2	-37.6	179	0	0	0	0	0	113.1	T581 G583 A589 S590	T581-G586 PolarHBondContact OG1-N 3.25Å; G583-G586 PolarHBondContact O-N 3.21Å; G586-A589 PolarHBondContact O-N 2.8Å; G586-S590 WeakPolarHBondContact O-CB 3.27Å; G586-S590 PolarHBondContact O-N 2.92Å
587	V	95	Very high	94.5	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.018	12%	0.117	C	C	.	.	H	α-helix	trans	-62.1	-44.5	170.5	178.7	0	0	0	0	110.7	T554 G583 A589 F591 R615 L616 E619	T554-V587 HydrophobicContact CG2-CG1 4.06Å; G583-V587 PolarHBondContact O-N 3.26Å; G583-V587 VanDerWaalsContact O-N 3.14Å; V587-A589 VanDerWaalsContact C-N 3.34Å; V587-A589 PolarHBondContact O-N 2.99Å; V587-F591 WeakPolarHBondContact O-CB 3.19Å; V587-F591 PolarHBondContact O-N 3.49Å; V587-R615 HydrophobicContact CG2-CG 4.46Å; V587-L616 HydrophobicContact CG2-CD2 3.82Å; V587-E619 HydrophobicContact CG1-CB 3.99Å; V587-E619 VanDerWaalsContact CG1-OE2 3.29Å; V587-E619 WeakPolarHBondContact CG1-OE2 3.46Å; V587-E619 HydrophobicContact CG2-CB 4.33Å
588	A	96.7	Very high	94.3	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.7	-41.4	175.6	0	0	0	0	0	112.4	K558 I559 V562 N584 A585 A592	K558-A588 HydrophobicContact CB-CB 4.28Å; I559-A588 HydrophobicContact CD1-CB 4.48Å; V562-A588 HydrophobicContact CB-CB 4Å; V562-A588 HydrophobicContact CG1-CB 4.13Å; V562-A588 HydrophobicContact CG2-CB 4.05Å; N584-A588 PolarHBondContact O-N 2.94Å; A585-A588 WeakPolarHBondContact O-CB 3.37Å; A585-A588 PolarHBondContact O-N 2.87Å; A588-A592 VanDerWaalsContact O-CB 3.28Å; A588-A592 WeakPolarHBondContact O-CB 3.44Å; A588-A592 PolarHBondContact O-N 3.47Å
589	A	97.4	Very high	94.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.8	-50.1	177.9	0	0	0	0	0	111.9	V562 I577 C579 A585 G586 V587 A593 L602 L658	V562-A589 HydrophobicContact CG1-CB 4.35Å; I577-A589 HydrophobicContact CD1-CB 4.12Å; C579-A589 HydrophobicContact CB-CB 4.01Å; A585-A589 WeakPolarHBondContact O-CB 3.26Å; A585-A589 PolarHBondContact O-N 3.39Å; G586-A589 PolarHBondContact O-N 2.8Å; V587-A589 VanDerWaalsContact C-N 3.34Å; V587-A589 PolarHBondContact O-N 2.99Å; A589-A593 WeakPolarHBondContact O-CB 3.48Å; A589-A593 PolarHBondContact O-N 3.04Å; A589-L602 HydrophobicContact CB-CD2 4.1Å; A589-L658 HydrophobicContact CB-CD2 3.63Å
590	S	96.7	Very high	94.3	Very high	6 Å²	6	31.2 Å²	31.2	4%	0.042	15%	0.148	C	C	.	.	H	α-helix	trans	-62.3	-45.4	178.4	-177.3	0	0	0	0	112.1	G586 A593 H594 A620	G586-S590 WeakPolarHBondContact O-CB 3.27Å; G586-S590 PolarHBondContact O-N 2.92Å; S590-A593 PolarHBondContact O-N 3.14Å; S590-H594 VanDerWaalsContact O-CB 3.27Å; S590-H594 WeakPolarHBondContact O-CB 3.4Å; S590-H594 PolarHBondContact O-N 2.79Å; S590-A620 WeakPolarHBondContact OG-CA 3.48Å; S590-A620 WeakPolarHBondContact OG-CB 3.46Å
591	F	95.7	Very high	94.4	Very high	72 Å²	72	31.3 Å²	31.3	32%	0.316	15%	0.148	S	C	.	.	H	α-helix	trans	-65.1	-42.7	-179.1	-178.4	-104.2	0	0	0	112.3	L519 P553 T554 I559 V587 T595	L519-F591 HydrophobicContact CB-CE1 4.22Å; L519-F591 HydrophobicContact CD1-CD1 4.47Å; L519-F591 HydrophobicContact CD1-CE1 4.43Å; P553-F591 HydrophobicContact CB-CE1 4.02Å; P553-F591 HydrophobicContact CB-CZ 4.02Å; T554-F591 HydrophobicContact CG2-CB 3.75Å; T554-F591 HydrophobicContact CG2-CD1 3.65Å; T554-F591 HydrophobicContact CG2-CE1 4.4Å; T554-F591 HydrophobicContact CG2-CG 3.75Å; I559-F591 HydrophobicContact CD1-CD1 3.89Å; V587-F591 WeakPolarHBondContact O-CB 3.19Å; V587-F591 PolarHBondContact O-N 3.49Å; F591-T595 PolarHBondContact O-N 3.17Å; F591-T595 PolarHBondContact O-OG1 2.97Å
592	A	96.7	Very high	94.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.3	-49.3	174.4	0	0	0	0	0	111.6	L519 I559 V562 V566 A588 H594 T595 Y596	L519-A592 HydrophobicContact CD1-CB 4.18Å; I559-A592 HydrophobicContact CD1-CB 4.3Å; V562-A592 HydrophobicContact CG1-CB 4.23Å; V566-A592 HydrophobicContact CB-CB 4.02Å; V566-A592 HydrophobicContact CG1-CB 4.06Å; V566-A592 HydrophobicContact CG2-CB 4.16Å; A588-A592 VanDerWaalsContact O-CB 3.28Å; A588-A592 WeakPolarHBondContact O-CB 3.44Å; A588-A592 PolarHBondContact O-N 3.47Å; A592-H594 PolarHBondContact O-N 3.19Å; A592-T595 PolarHBondContact O-N 2.8Å; A592-T595 VanDerWaalsContact O-N 3.16Å; A592-Y596 HydrophobicContact CB-CD2 4.5Å; A592-Y596 WeakPolarHBondContact O-CD2 3.1Å; A592-Y596 PolarHBondContact O-N 2.81Å
593	A	96.5	Very high	95.2	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.8	-46.6	-177.2	0	0	0	0	0	112.2	I577 A589 S590 T595 Y596 R597 I598 C600	I577-A593 HydrophobicContact CD1-CB 3.81Å; I577-A593 HydrophobicContact CG1-CB 4.03Å; A589-A593 WeakPolarHBondContact O-CB 3.48Å; A589-A593 PolarHBondContact O-N 3.04Å; S590-A593 PolarHBondContact O-N 3.14Å; A593-T595 VanDerWaalsContact C-N 3.35Å; A593-T595 PolarHBondContact O-N 3.12Å; A593-Y596 CarbonylContact O-C 3.54Å; A593-Y596 PolarHBondContact O-N 3.48Å; A593-R597 PolarHBondContact O-N 3.28Å; A593-I598 CarbonylContact C-O 3.56Å; A593-I598 HydrophobicContact CB-CB 4.22Å; A593-I598 WeakPolarHBondContact CB-O 3.36Å; A593-I598 PolarHBondContact O-N 3.06Å; A593-C600 HydrophobicContact CB-CB 3.85Å
594	H	94.7	Very high	95.6	Very high	92 Å²	92	29 Å²	29	43%	0.426	13%	0.134	S	C	.	.	H	α-helix	trans	-51.8	-51.8	171.6	167.5	76.3	0	0	0	111.8	S590 A592 Y596 R597 E622	S590-H594 VanDerWaalsContact O-CB 3.27Å; S590-H594 WeakPolarHBondContact O-CB 3.4Å; S590-H594 PolarHBondContact O-N 2.79Å; A592-H594 PolarHBondContact O-N 3.19Å; H594-Y596 VanDerWaalsContact C-N 3.3Å; H594-Y596 PolarHBondContact O-N 3.46Å; H594-R597 PolarHBondContact O-N 2.81Å; H594-E622 IonicContact CE1-OE1 2.75Å; H594-E622 PolarHBondContact CE1-OE1 3.02Å; H594-E622 IonicContact CE1-OE2 2.7Å; H594-E622 IonicContact CG-OE2 2.8Å; H594-E622 IonicContact ND1-OE1 3.53Å; H594-E622 PolarHBondContact ND1-OE1 3.04Å; H594-E622 IonicContact ND1-OE2 3.87Å; H594-E622 PolarHBondContact ND1-OE2 3.28Å
595	T	94.3	Very high	95.5	Very high	52 Å²	52	29.1 Å²	29.1	32%	0.319	14%	0.135	S	C	.	.	H	α-helix	trans	-66.6	-32.4	-175.5	-49.9	0	0	0	0	112.6	L519 F591 A592 A593	L519-T595 HydrophobicContact CD1-CG2 4.28Å; L519-T595 HydrophobicContact CD2-CG2 3.58Å; F591-T595 PolarHBondContact O-N 3.17Å; F591-T595 PolarHBondContact O-OG1 2.97Å; A592-T595 PolarHBondContact O-N 2.8Å; A592-T595 VanDerWaalsContact O-N 3.16Å; A593-T595 VanDerWaalsContact C-N 3.35Å; A593-T595 PolarHBondContact O-N 3.12Å
596	Y	94.6	Very high	95.1	Very high	15 Å²	15	34.3 Å²	34.3	6%	0.059	16%	0.158	C	C	.	.	H	α-helix	trans	-89.8	3.9	174.9	-68.9	-64.6	0	0	0	114.3	F516 L519 E563 V566 R567 A570 A592 A593 H594 I598	F516-Y596 HydrophobicContact CB-CE1 3.7Å; F516-Y596 AromaticContact CD1-CD1 4Å; F516-Y596 HydrophobicContact CD1-CD1 4Å; F516-Y596 AromaticContact CD1-CE1 3.82Å; F516-Y596 HydrophobicContact CD1-CE1 3.82Å; F516-Y596 HydrophobicContact CD2-CE1 4.46Å; F516-Y596 HydrophobicContact CE1-CD1 4.31Å; F516-Y596 HydrophobicContact CG-CD1 4.23Å; F516-Y596 AromaticContact CG-CE1 3.76Å; F516-Y596 HydrophobicContact CG-CE1 3.76Å; L519-Y596 HydrophobicContact CD1-CD2 4.32Å; L519-Y596 HydrophobicContact CD1-CE2 3.68Å; L519-Y596 HydrophobicContact CG-CE2 4.2Å; E563-Y596 HydrophobicContact CG-CE2 4.06Å; V566-Y596 HydrophobicContact CB-CD2 4.38Å; V566-Y596 HydrophobicContact CG1-CD2 3.77Å; V566-Y596 HydrophobicContact CG1-CG 4.37Å; R567-Y596 HydrophobicContact CB-CE1 4.04Å; R567-Y596 HydrophobicContact CB-CE2 3.83Å; R567-Y596 HydrophobicContact CG-CE1 3.84Å; R567-Y596 HydrophobicContact CG-CE2 4.46Å; A570-Y596 HydrophobicContact CB-CD1 4.25Å; A570-Y596 HydrophobicContact CB-CG 4.26Å; A592-Y596 HydrophobicContact CB-CD2 4.5Å; A592-Y596 WeakPolarHBondContact O-CD2 3.1Å; A592-Y596 PolarHBondContact O-N 2.81Å; A593-Y596 CarbonylContact O-C 3.54Å; A593-Y596 PolarHBondContact O-N 3.48Å; H594-Y596 VanDerWaalsContact C-N 3.3Å; H594-Y596 PolarHBondContact O-N 3.46Å; Y596-I598 VanDerWaalsContact C-N 3.33Å; Y596-I598 PolarHBondContact O-N 3.09Å
597	R	94.6	Very high	94.2	Very high	235 Å²	235	38.6 Å²	38.6	89%	0.887	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	38	-178.7	-54	-179.2	-178.9	174.9	-0.2	114.5	A593 H594	A593-R597 PolarHBondContact O-N 3.28Å; H594-R597 PolarHBondContact O-N 2.81Å
598	I	95.4	Very high	93.3	Very high	11 Å²	11	39.8 Å²	39.8	6%	0.056	20%	0.198	C	C	.	.			trans	-102.4	135.8	174.6	-63.7	-179.7	0	0	0	108.2	V566 A570 V574 I577 A593 Y596	V566-I598 HydrophobicContact CG1-CD1 3.92Å; A570-I598 HydrophobicContact CB-CD1 3.75Å; A570-I598 HydrophobicContact CB-CG1 4.49Å; V574-I598 HydrophobicContact CB-CD1 4.47Å; V574-I598 HydrophobicContact CG1-CD1 4.32Å; V574-I598 HydrophobicContact CG1-CG2 4.22Å; V574-I598 WeakPolarHBondContact O-CG1 3.31Å; I577-I598 HydrophobicContact CG1-CG2 4.24Å; I577-I598 HydrophobicContact CG2-CG2 4.08Å; A593-I598 CarbonylContact C-O 3.56Å; A593-I598 HydrophobicContact CB-CB 4.22Å; A593-I598 WeakPolarHBondContact CB-O 3.36Å; A593-I598 PolarHBondContact O-N 3.06Å; Y596-I598 VanDerWaalsContact C-N 3.33Å; Y596-I598 PolarHBondContact O-N 3.09Å
599	N	96.6	Very high	92.3	Very high	101 Å²	101	42.2 Å²	42.2	54%	0.54	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	141.3	174.7	-68.4	-31.9	0	0	0	110.5	S575 H576 I577	S575-N599 PolarHBondContact O-N 3.39Å; H576-N599 CarbonylContact C-O 3.59Å; H576-N599 VanDerWaalsContact CA-O 3.32Å; H576-N599 WeakPolarHBondContact CA-O 3.39Å; H576-N599 HydrophobicContact CB-CB 4.12Å; H576-N599 WeakPolarHBondContact ND1-CB 3.49Å; I577-N599 PolarHBondContact N-O 2.87Å
600	C	97.8	Very high	91.4	Very high	9 Å²	9	48.6 Å²	48.6	6%	0.061	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129	-176.6	-167.6	0	0	0	0	111.7	I577 A593 A623 K624	I577-C600 HydrophobicContact CG1-CB 4.33Å; A593-C600 HydrophobicContact CB-CB 3.85Å; C600-A623 HydrophobicContact CB-CB 3.85Å; C600-A623 CarbonylContact O-C 3.58Å; C600-A623 WeakPolarHBondContact O-CA 3.47Å; C600-K624 PolarHBondContact O-N 3.48Å
601	T	97.3	Very high	90.6	Very high	2 Å²	2	50 Å²	50	1%	0.012	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.8	161.1	-54.1	0	0	0	0	109.9	H576 I577 V578 C579 V603 K624 V626 L642	H576-T601 PolarHBondContact NE2-OG1 3.44Å; I577-T601 PolarHBondContact O-N 3.22Å; V578-T601 CarbonylContact C-O 3.52Å; V578-T601 WeakPolarHBondContact CA-O 3.48Å; C579-T601 PolarHBondContact N-O 3.16Å; T601-V603 HydrophobicContact CG2-CG2 4.32Å; T601-K624 CarbonylContact C-O 3.52Å; T601-K624 VanDerWaalsContact CA-O 3.26Å; T601-K624 WeakPolarHBondContact CA-O 3.38Å; T601-K624 HydrophobicContact CG2-CB 4.37Å; T601-K624 WeakPolarHBondContact CG2-O 3.48Å; T601-V626 HydrophobicContact CG2-CB 4.15Å; T601-V626 HydrophobicContact CG2-CG2 3.59Å; T601-L642 HydrophobicContact CG2-CD2 3.65Å
602	L	96.7	Very high	90	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127	167.7	-59	-176.4	0	0	0	109.2	C579 T581 A589 L616 A620 A623 K624 V626	C579-L602 HydrophobicContact CB-CD2 4.05Å; C579-L602 WeakPolarHBondContact O-CA 3.4Å; T581-L602 HydrophobicContact CG2-CB 4.28Å; A589-L602 HydrophobicContact CB-CD2 4.1Å; L602-L616 HydrophobicContact CD1-CD1 4.44Å; L602-L616 HydrophobicContact CD1-CD2 3.83Å; L602-A620 HydrophobicContact CD1-CB 4.01Å; L602-A623 HydrophobicContact CD1-CB 4.14Å; L602-A623 HydrophobicContact CG-CB 3.94Å; L602-K624 PolarHBondContact N-O 2.91Å; L602-V626 PolarHBondContact O-N 2.96Å
603	V	96.2	Very high	89.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	122.3	173.8	-168.9	0	0	0	0	108.9	V578 C579 P580 T581 T601 V626 A635 R638 A639	V578-V603 HydrophobicContact CG1-CG2 3.74Å; C579-V603 PolarHBondContact O-N 2.78Å; P580-V603 CarbonylContact C-O 3.58Å; P580-V603 WeakPolarHBondContact CA-O 3.42Å; T581-V603 PolarHBondContact N-O 3.42Å; T601-V603 HydrophobicContact CG2-CG2 4.32Å; V603-V626 WeakPolarHBondContact CA-O 3.44Å; V603-V626 HydrophobicContact CG2-CB 4.44Å; V603-A635 HydrophobicContact CG1-CB 4.21Å; V603-A635 VanDerWaalsContact CG1-O 3.26Å; V603-A635 WeakPolarHBondContact CG1-O 3.39Å; V603-R638 HydrophobicContact CG1-CB 4.27Å; V603-R638 HydrophobicContact CG1-CG 4.4Å; V603-A639 HydrophobicContact CB-CB 4.11Å; V603-A639 HydrophobicContact CG2-CB 3.77Å
604	V	93.2	Very high	89	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146	-176.4	-62	0	0	0	0	110.1	T581 F608 L616 I625 V626 I627 G628	T581-V604 HydrophobicContact CG2-CG1 3.86Å; V604-F608 HydrophobicContact CB-CD1 4.45Å; V604-F608 HydrophobicContact CB-CE1 4.32Å; V604-F608 HydrophobicContact CB-CE2 4.45Å; V604-F608 HydrophobicContact CB-CZ 4.32Å; V604-F608 HydrophobicContact CG1-CE2 4.4Å; V604-F608 HydrophobicContact CG2-CD1 4.26Å; V604-F608 HydrophobicContact CG2-CE1 3.74Å; V604-F608 HydrophobicContact CG2-CE2 4.44Å; V604-F608 HydrophobicContact CG2-CZ 3.85Å; V604-L616 HydrophobicContact CG1-CD1 3.86Å; V604-I625 HydrophobicContact CG2-CG2 3.85Å; V604-V626 PolarHBondContact N-O 3.3Å; V604-I627 HydrophobicContact CG2-CG1 4.4Å; V604-I627 CarbonylContact O-C 3.53Å; V604-I627 WeakPolarHBondContact O-CA 3.47Å; V604-G628 PolarHBondContact O-N 3.01Å
605	P	90.6	Very high	88.7	Confident	7 Å²	7	56.3 Å²	56.3	5%	0.045	27%	0.266	C	S	.	.			trans	-66.9	156.4	167.6	28.8	-32	0	0	0	110.3	T582 F608 G629	T582-P605 HydrophobicContact CG2-CG 4.42Å; P605-F608 HydrophobicContact CG-CB 4.3Å; P605-F608 WeakPolarHBondContact O-CD1 3.47Å; P605-G629 CarbonylContact C-O 3.48Å; P605-G629 WeakPolarHBondContact CA-O 3.37Å
606	E	86.6	Confident	88.4	Confident	116 Å²	116	53.9 Å²	53.9	54%	0.542	25%	0.251	S	S	.	.	S	Bend	trans	-62.4	-47.8	-179.4	-177.3	173.6	-152.3	0	0	112.1	F608 R613 I627 G629	E606-F608 PolarHBondContact O-N 3.32Å; E606-F608 VanDerWaalsContact O-N 3.15Å; E606-R613 PolarHBondContact O-NH2 2.87Å; E606-I627 HydrophobicContact CB-CG2 3.77Å; E606-I627 HydrophobicContact CG-CG2 4.4Å; E606-G629 PolarHBondContact N-O 3.16Å
607	A	74.5	Confident	88	Confident	89 Å²	89	56.4 Å²	56.4	74%	0.736	27%	0.271	S	S	*	.	S	Bend	trans	-87.5	66.8	179.8	0	0	0	0	0	111.7
608	F	76.3	Confident	87.7	Confident	29 Å²	29	49.3 Å²	49.3	13%	0.127	25%	0.25	C	S	.	.			trans	-111.9	151.5	174.5	77.2	-68.5	0	0	0	112.3	V604 P605 E606 Q610 V612 R613 L616	V604-F608 HydrophobicContact CB-CD1 4.45Å; V604-F608 HydrophobicContact CB-CE1 4.32Å; V604-F608 HydrophobicContact CB-CE2 4.45Å; V604-F608 HydrophobicContact CB-CZ 4.32Å; V604-F608 HydrophobicContact CG1-CE2 4.4Å; V604-F608 HydrophobicContact CG2-CD1 4.26Å; V604-F608 HydrophobicContact CG2-CE1 3.74Å; V604-F608 HydrophobicContact CG2-CE2 4.44Å; V604-F608 HydrophobicContact CG2-CZ 3.85Å; P605-F608 HydrophobicContact CG-CB 4.3Å; P605-F608 WeakPolarHBondContact O-CD1 3.47Å; E606-F608 PolarHBondContact O-N 3.32Å; E606-F608 VanDerWaalsContact O-N 3.15Å; F608-Q610 PolarHBondContact O-N 3.07Å; F608-V612 HydrophobicContact CD2-CB 3.92Å; F608-V612 HydrophobicContact CD2-CG1 3.69Å; F608-V612 HydrophobicContact CE2-CB 4.39Å; F608-V612 HydrophobicContact CE2-CG1 4Å; F608-R613 HydrophobicContact CD2-CB 4.34Å; F608-R613 HydrophobicContact CE1-CB 4.3Å; F608-R613 HydrophobicContact CE1-CG 4.27Å; F608-R613 VanDerWaalsContact CE1-NE 3.29Å; F608-R613 HydrophobicContact CE2-CB 3.64Å; F608-R613 HydrophobicContact CE2-CG 4.23Å; F608-R613 HydrophobicContact CZ-CB 3.62Å; F608-R613 HydrophobicContact CZ-CG 3.7Å; F608-L616 HydrophobicContact CE2-CD1 4.15Å
609	E	75.3	Confident	87.4	Confident	50 Å²	50	50.9 Å²	50.9	23%	0.234	26%	0.258	C	S	.	.			trans	-52	137.3	-173.8	-66.8	-167.6	157.4	0	0	113.1	T611 V612 R613 T745 Q835	E609-T611 PolarHBondContact O-N 3.21Å; E609-V612 HydrophobicContact CB-CB 4.25Å; E609-V612 HydrophobicContact CB-CG2 3.99Å; E609-V612 WeakPolarHBondContact O-CA 3.33Å; E609-V612 WeakPolarHBondContact O-CB 3.41Å; E609-V612 PolarHBondContact O-N 2.96Å; E609-R613 PolarHBondContact O-N 3.14Å; E609-T745 HydrophobicContact CG-CG2 4.41Å; E609-Q835 PolarHBondContact OE2-NE2 3.25Å
610	Q	78.6	Confident	87	Confident	134 Å²	134	46.1 Å²	46.1	63%	0.626	23%	0.232	S	C	*	.	H	α-helix	trans	-60.1	-29.4	176.2	-174.2	65.5	-9.9	0	0	112.6	F608 R614	F608-Q610 PolarHBondContact O-N 3.07Å; Q610-R614 VanDerWaalsContact O-CB 3.26Å; Q610-R614 WeakPolarHBondContact O-CB 3.32Å; Q610-R614 PolarHBondContact O-N 3.32Å
611	T	80.2	Confident	86.5	Confident	37 Å²	37	51.2 Å²	51.2	23%	0.227	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-46.7	170.5	-61.3	0	0	0	0	111.6	E609 R614 R615 Q835	E609-T611 PolarHBondContact O-N 3.21Å; T611-R614 PolarHBondContact O-N 3.38Å; T611-R615 WeakPolarHBondContact O-CB 3.32Å; T611-R615 PolarHBondContact O-N 2.67Å; T611-Q835 VanDerWaalsContact CG2-OE1 3.27Å; T611-Q835 PolarHBondContact OG1-NE2 3.02Å; T611-Q835 PolarHBondContact OG1-OE1 3.42Å
612	V	83.8	Confident	86.2	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-42	177.6	178	0	0	0	0	110.8	T582 F608 E609 R615 L616 N830	T582-V612 WeakPolarHBondContact O-CG1 3.47Å; F608-V612 HydrophobicContact CD2-CB 3.92Å; F608-V612 HydrophobicContact CD2-CG1 3.69Å; F608-V612 HydrophobicContact CE2-CB 4.39Å; F608-V612 HydrophobicContact CE2-CG1 4Å; E609-V612 HydrophobicContact CB-CB 4.25Å; E609-V612 HydrophobicContact CB-CG2 3.99Å; E609-V612 WeakPolarHBondContact O-CA 3.33Å; E609-V612 WeakPolarHBondContact O-CB 3.41Å; E609-V612 PolarHBondContact O-N 2.96Å; V612-R615 PolarHBondContact O-N 2.8Å; V612-L616 HydrophobicContact CG1-CD1 4.22Å; V612-L616 HydrophobicContact CG1-CG 4.32Å; V612-L616 WeakPolarHBondContact O-CG 3.47Å; V612-L616 PolarHBondContact O-N 2.88Å; V612-N830 HydrophobicContact CG2-CB 4.26Å; V612-N830 WeakPolarHBondContact CG2-ND2 3.21Å
613	R	85.6	Confident	86.1	Confident	97 Å²	97	58.2 Å²	58.2	37%	0.366	29%	0.289	S	S	.	.	H	α-helix	trans	-56.8	-55.5	174.4	-171.7	174.3	-66.5	179.9	-4.4	111.3	E606 F608 E609 R615 L616 S617	E606-R613 PolarHBondContact O-NH2 2.87Å; F608-R613 HydrophobicContact CD2-CB 4.34Å; F608-R613 HydrophobicContact CE1-CB 4.3Å; F608-R613 HydrophobicContact CE1-CG 4.27Å; F608-R613 VanDerWaalsContact CE1-NE 3.29Å; F608-R613 HydrophobicContact CE2-CB 3.64Å; F608-R613 HydrophobicContact CE2-CG 4.23Å; F608-R613 HydrophobicContact CZ-CB 3.62Å; F608-R613 HydrophobicContact CZ-CG 3.7Å; E609-R613 PolarHBondContact O-N 3.14Å; R613-R615 VanDerWaalsContact C-N 3.26Å; R613-R615 PolarHBondContact O-N 2.91Å; R613-L616 PolarHBondContact O-N 3.47Å; R613-S617 PolarHBondContact O-N 2.83Å; R613-S617 VanDerWaalsContact O-N 3.1Å; R613-S617 PolarHBondContact O-OG 3.41Å
614	R	86	Confident	86	Confident	179 Å²	179	64.6 Å²	64.6	68%	0.675	32%	0.317	S	S	*	.	H	α-helix	trans	-55.6	-40.5	175.3	177.3	178	179.1	-170.2	0.8	112.2	Q610 T611 L618	Q610-R614 VanDerWaalsContact O-CB 3.26Å; Q610-R614 WeakPolarHBondContact O-CB 3.32Å; Q610-R614 PolarHBondContact O-N 3.32Å; T611-R614 PolarHBondContact O-N 3.38Å; R614-L618 HydrophobicContact CG-CD1 4.07Å; R614-L618 WeakPolarHBondContact O-CG 3.24Å; R614-L618 PolarHBondContact O-N 2.84Å
615	R	87.8	Confident	86.1	Confident	16 Å²	16	67.9 Å²	67.9	6%	0.06	33%	0.334	C	S	.	.	H	α-helix	trans	-68.7	-45.1	-178.7	-176.5	179.7	175	-156	-4.2	112.1	T554 N584 V587 T611 V612 R613 S617 L618 E619 N830	T554-R615 PolarHBondContact O-NH2 2.84Å; N584-R615 PolarHBondContact OD1-NH1 2.77Å; V587-R615 HydrophobicContact CG2-CG 4.46Å; T611-R615 WeakPolarHBondContact O-CB 3.32Å; T611-R615 PolarHBondContact O-N 2.67Å; V612-R615 PolarHBondContact O-N 2.8Å; R613-R615 VanDerWaalsContact C-N 3.26Å; R613-R615 PolarHBondContact O-N 2.91Å; R615-S617 VanDerWaalsContact C-N 3.33Å; R615-S617 PolarHBondContact O-N 2.72Å; R615-L618 PolarHBondContact O-N 3.26Å; R615-L618 VanDerWaalsContact O-N 3.08Å; R615-E619 HydrophobicContact CG-CG 4.31Å; R615-E619 IonicContact CZ-OE2 3.38Å; R615-E619 IonicContact NE-OE2 2.72Å; R615-E619 PolarHBondContact NE-OE2 3.49Å; R615-E619 IonicContact NH2-OE2 3.28Å; R615-E619 PolarHBondContact NH2-OE2 2.68Å; R615-E619 PolarHBondContact O-N 3.48Å; R615-N830 PolarHBondContact NH1-OD1 3.33Å
616	L	89	Confident	86.2	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-62.7	-40.5	176	-67.6	-179.8	0	0	0	111.1	V587 L602 V604 F608 V612 R613 L618 A620 I625	V587-L616 HydrophobicContact CG2-CD2 3.82Å; L602-L616 HydrophobicContact CD1-CD1 4.44Å; L602-L616 HydrophobicContact CD1-CD2 3.83Å; V604-L616 HydrophobicContact CG1-CD1 3.86Å; F608-L616 HydrophobicContact CE2-CD1 4.15Å; V612-L616 HydrophobicContact CG1-CD1 4.22Å; V612-L616 HydrophobicContact CG1-CG 4.32Å; V612-L616 WeakPolarHBondContact O-CG 3.47Å; V612-L616 PolarHBondContact O-N 2.88Å; R613-L616 PolarHBondContact O-N 3.47Å; L616-L618 PolarHBondContact O-N 3.05Å; L616-L618 VanDerWaalsContact O-N 3.1Å; L616-A620 HydrophobicContact CD2-CB 4.18Å; L616-A620 CarbonylContact O-C 3.58Å; L616-A620 WeakPolarHBondContact O-CA 3.13Å; L616-A620 WeakPolarHBondContact O-CB 3Å; L616-A620 PolarHBondContact O-N 2.88Å; L616-I625 HydrophobicContact CB-CD1 3.88Å
617	S	86.8	Confident	86.6	Confident	69 Å²	69	68 Å²	68	48%	0.483	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-12.6	173.7	-56.3	0	0	0	0	115.1	R613 R615 Q621	R613-S617 PolarHBondContact O-N 2.83Å; R613-S617 VanDerWaalsContact O-N 3.1Å; R613-S617 PolarHBondContact O-OG 3.41Å; R615-S617 VanDerWaalsContact C-N 3.33Å; R615-S617 PolarHBondContact O-N 2.72Å; S617-Q621 WeakPolarHBondContact O-CG 3.35Å; S617-Q621 PolarHBondContact O-NE2 3.49Å
618	L	88.2	Confident	87.3	Confident	85 Å²	85	63.9 Å²	63.9	45%	0.445	30%	0.304	S	S	.	.	H	α-helix	trans	-112.8	-36.5	-179.3	-71.6	174	0	0	0	114	R614 R615 L616	R614-L618 HydrophobicContact CG-CD1 4.07Å; R614-L618 WeakPolarHBondContact O-CG 3.24Å; R614-L618 PolarHBondContact O-N 2.84Å; R615-L618 PolarHBondContact O-N 3.26Å; R615-L618 VanDerWaalsContact O-N 3.08Å; L616-L618 PolarHBondContact O-N 3.05Å; L616-L618 VanDerWaalsContact O-N 3.1Å
619	E	88.5	Confident	87.9	Confident	44 Å²	44	64 Å²	64	21%	0.206	31%	0.314	C	S	.	.	H	α-helix	trans	-102.9	-11.7	-177.6	-63.5	-170.7	156.9	0	0	113.5	V587 R615 R829	V587-E619 HydrophobicContact CG1-CB 3.99Å; V587-E619 VanDerWaalsContact CG1-OE2 3.29Å; V587-E619 WeakPolarHBondContact CG1-OE2 3.46Å; V587-E619 HydrophobicContact CG2-CB 4.33Å; R615-E619 HydrophobicContact CG-CG 4.31Å; R615-E619 IonicContact CZ-OE2 3.38Å; R615-E619 IonicContact NE-OE2 2.72Å; R615-E619 PolarHBondContact NE-OE2 3.49Å; R615-E619 IonicContact NH2-OE2 3.28Å; R615-E619 PolarHBondContact NH2-OE2 2.68Å; R615-E619 PolarHBondContact O-N 3.48Å; E619-R829 IonicContact OE1-CZ 3.5Å; E619-R829 IonicContact OE1-NH1 2.72Å; E619-R829 PolarHBondContact OE1-NH1 3.33Å
620	A	89	Confident	88.4	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.008	33%	0.325	C	S	.	.			trans	-127.9	37.1	-176.3	0	0	0	0	0	113.2	S590 L602 L616 E622 A623	S590-A620 WeakPolarHBondContact OG-CA 3.48Å; S590-A620 WeakPolarHBondContact OG-CB 3.46Å; L602-A620 HydrophobicContact CD1-CB 4.01Å; L616-A620 HydrophobicContact CD2-CB 4.18Å; L616-A620 CarbonylContact O-C 3.58Å; L616-A620 WeakPolarHBondContact O-CA 3.13Å; L616-A620 WeakPolarHBondContact O-CB 3Å; L616-A620 PolarHBondContact O-N 2.88Å; A620-E622 VanDerWaalsContact C-N 3.25Å; A620-E622 PolarHBondContact O-N 2.92Å; A620-E622 VanDerWaalsContact O-N 3.15Å; A620-A623 HydrophobicContact CB-CB 4.43Å; A620-A623 PolarHBondContact O-N 3.16Å
621	Q	86.8	Confident	88.6	Confident	117 Å²	117	59.8 Å²	59.8	55%	0.547	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.4	-170.9	-65.6	-172	-28.4	0	0	115.4	S617	S617-Q621 WeakPolarHBondContact O-CG 3.35Å; S617-Q621 PolarHBondContact O-NE2 3.49Å
622	E	89.8	Confident	88.9	Confident	138 Å²	138	59.5 Å²	59.5	65%	0.645	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-5.5	178.3	-66.5	-173.6	-157.4	0	0	113.7	H594 A620	H594-E622 IonicContact CE1-OE1 2.75Å; H594-E622 PolarHBondContact CE1-OE1 3.02Å; H594-E622 IonicContact CE1-OE2 2.7Å; H594-E622 IonicContact CG-OE2 2.8Å; H594-E622 IonicContact ND1-OE1 3.53Å; H594-E622 PolarHBondContact ND1-OE1 3.04Å; H594-E622 IonicContact ND1-OE2 3.87Å; H594-E622 PolarHBondContact ND1-OE2 3.28Å; A620-E622 VanDerWaalsContact C-N 3.25Å; A620-E622 PolarHBondContact O-N 2.92Å; A620-E622 VanDerWaalsContact O-N 3.15Å
623	A	94.4	Very high	89	Confident	10 Å²	10	64.3 Å²	64.3	8%	0.083	32%	0.322	C	S	.	.	S	Bend	trans	-88.5	132.3	175	0	0	0	0	0	111.2	C600 L602 A620 I625	C600-A623 HydrophobicContact CB-CB 3.85Å; C600-A623 CarbonylContact O-C 3.58Å; C600-A623 WeakPolarHBondContact O-CA 3.47Å; L602-A623 HydrophobicContact CD1-CB 4.14Å; L602-A623 HydrophobicContact CG-CB 3.94Å; A620-A623 HydrophobicContact CB-CB 4.43Å; A620-A623 PolarHBondContact O-N 3.16Å; A623-I625 PolarHBondContact O-N 3.46Å
624	K	95.3	Very high	89.2	Confident	135 Å²	135	63.3 Å²	63.3	59%	0.587	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.2	117.6	170.2	-176	179.3	-178.9	175.2	0	108.7	C600 T601 L602 V626	C600-K624 PolarHBondContact O-N 3.48Å; T601-K624 CarbonylContact C-O 3.52Å; T601-K624 VanDerWaalsContact CA-O 3.26Å; T601-K624 WeakPolarHBondContact CA-O 3.38Å; T601-K624 HydrophobicContact CG2-CB 4.37Å; T601-K624 WeakPolarHBondContact CG2-O 3.48Å; L602-K624 PolarHBondContact N-O 2.91Å; K624-V626 HydrophobicContact CD-CG2 4.31Å; K624-V626 HydrophobicContact CG-CG2 4.17Å
625	I	94.2	Very high	89.5	Confident	68 Å²	68	54.8 Å²	54.8	35%	0.349	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.2	172.4	-57.5	176.5	0	0	0	108.5	V604 L616 A623	V604-I625 HydrophobicContact CG2-CG2 3.85Å; L616-I625 HydrophobicContact CB-CD1 3.88Å; A623-I625 PolarHBondContact O-N 3.46Å
626	V	94.4	Very high	89.7	Confident	28 Å²	28	55.4 Å²	55.4	17%	0.17	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.7	176.3	173.1	0	0	0	0	108.5	T601 L602 V603 V604 K624	T601-V626 HydrophobicContact CG2-CB 4.15Å; T601-V626 HydrophobicContact CG2-CG2 3.59Å; L602-V626 PolarHBondContact O-N 2.96Å; V603-V626 WeakPolarHBondContact CA-O 3.44Å; V603-V626 HydrophobicContact CG2-CB 4.44Å; V604-V626 PolarHBondContact N-O 3.3Å; K624-V626 HydrophobicContact CD-CG2 4.31Å; K624-V626 HydrophobicContact CG-CG2 4.17Å
627	I	93.4	Very high	90	Very high	98 Å²	98	60 Å²	60	50%	0.503	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	133.3	172.2	-61	175.6	0	0	0	108.8	V604 E606	V604-I627 HydrophobicContact CG2-CG1 4.4Å; V604-I627 CarbonylContact O-C 3.53Å; V604-I627 WeakPolarHBondContact O-CA 3.47Å; E606-I627 HydrophobicContact CB-CG2 3.77Å; E606-I627 HydrophobicContact CG-CG2 4.4Å
628	G	90	Very high	90.4	Very high	3 Å²	3	60.4 Å²	60.4	3%	0.031	31%	0.305	C	S	.	.			trans	-134.6	92.3	179	0	0	0	0	0	111.2	V604 E634 A635	V604-G628 PolarHBondContact O-N 3.01Å; G628-E634 CarbonylContact O-C 3.58Å; G628-A635 WeakPolarHBondContact O-CA 3.38Å; G628-A635 WeakPolarHBondContact O-CB 3.43Å; G628-A635 PolarHBondContact O-N 3.19Å
629	G	88.2	Confident	90.8	Very high	32 Å²	32	56.4 Å²	56.4	33%	0.33	28%	0.284	S	S	.	.			trans	60.5	-164.1	176.5	0	0	0	0	0	115.3	P605 E606 E634	P605-G629 CarbonylContact C-O 3.48Å; P605-G629 WeakPolarHBondContact CA-O 3.37Å; E606-G629 PolarHBondContact N-O 3.16Å; G629-E634 WeakPolarHBondContact CA-OE2 3.47Å
630	T	85.9	Confident	91.2	Very high	75 Å²	75	58 Å²	58	46%	0.46	29%	0.292	S	S	.	.	S	Bend	trans	-97.2	-21.1	-171.9	66.8	0	0	0	0	113.8	E634	T630-E634 PolarHBondContact N-OE2 3.2Å; T630-E634 PolarHBondContact OG1-OE1 2.79Å; T630-E634 VanDerWaalsContact OG1-OE1 3.13Å; T630-E634 PolarHBondContact OG1-OE2 3.4Å
631	S	83.5	Confident	91.5	Very high	20 Å²	20	61.4 Å²	61.4	14%	0.14	31%	0.308	C	S	.	.	S	Bend	trans	-123.5	163	-176.8	74.2	0	0	0	0	113.1	L633 E634 A635	S631-L633 PolarHBondContact O-N 3.46Å; S631-L633 PolarHBondContact OG-N 3.13Å; S631-E634 WeakPolarHBondContact CB-OE1 3.46Å; S631-E634 PolarHBondContact N-OE1 3.17Å; S631-E634 PolarHBondContact O-N 3.32Å; S631-E634 PolarHBondContact OG-N 3.19Å; S631-E634 PolarHBondContact OG-OE1 3.29Å; S631-A635 PolarHBondContact O-N 3.4Å
632	F	86.1	Confident	91.9	Very high	31 Å²	31	56.7 Å²	56.7	14%	0.136	29%	0.286	C	S	.	.	H	α-helix	trans	-59.7	-30.5	173.5	174.7	-97.5	0	0	0	112.7	P580 T582 A635 H636 P660 P750	P580-F632 HydrophobicContact CB-CE2 4.19Å; T582-F632 HydrophobicContact CG2-CD2 4.23Å; F632-A635 PolarHBondContact O-N 3.18Å; F632-H636 WeakPolarHBondContact O-CB 3.49Å; F632-H636 PolarHBondContact O-N 2.83Å; F632-P660 HydrophobicContact CE2-CG 4.19Å; F632-P660 HydrophobicContact CZ-CG 3.82Å; F632-P750 HydrophobicContact CD1-CG 3.99Å; F632-P750 HydrophobicContact CE1-CG 4.35Å
633	L	85.7	Confident	92.2	Very high	103 Å²	103	50.6 Å²	50.6	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-69.9	-40.8	177.6	-175	62.4	0	0	0	111.6	S631 H636 H637	S631-L633 PolarHBondContact O-N 3.46Å; S631-L633 PolarHBondContact OG-N 3.13Å; L633-H636 PolarHBondContact O-N 2.88Å; L633-H637 PolarHBondContact O-N 3.2Å
634	E	90.5	Very high	92.2	Very high	77 Å²	77	54.8 Å²	54.8	36%	0.36	28%	0.279	S	S	.	.	H	α-helix	trans	-66.9	-38.3	172.4	-68.5	148	-108.2	0	0	111.7	G628 G629 T630 S631 H636 H637 R638	G628-E634 CarbonylContact O-C 3.58Å; G629-E634 WeakPolarHBondContact CA-OE2 3.47Å; T630-E634 PolarHBondContact N-OE2 3.2Å; T630-E634 PolarHBondContact OG1-OE1 2.79Å; T630-E634 VanDerWaalsContact OG1-OE1 3.13Å; T630-E634 PolarHBondContact OG1-OE2 3.4Å; S631-E634 WeakPolarHBondContact CB-OE1 3.46Å; S631-E634 PolarHBondContact N-OE1 3.17Å; S631-E634 PolarHBondContact O-N 3.32Å; S631-E634 PolarHBondContact OG-N 3.19Å; S631-E634 PolarHBondContact OG-OE1 3.29Å; E634-H636 VanDerWaalsContact C-N 3.34Å; E634-H637 PolarHBondContact O-N 3.5Å; E634-R638 WeakPolarHBondContact O-CB 3.23Å; E634-R638 PolarHBondContact O-N 2.86Å
635	A	92.2	Very high	92.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-37.5	174.8	0	0	0	0	0	112	V603 G628 S631 F632 A639	V603-A635 HydrophobicContact CG1-CB 4.21Å; V603-A635 VanDerWaalsContact CG1-O 3.26Å; V603-A635 WeakPolarHBondContact CG1-O 3.39Å; G628-A635 WeakPolarHBondContact O-CA 3.38Å; G628-A635 WeakPolarHBondContact O-CB 3.43Å; G628-A635 PolarHBondContact O-N 3.19Å; S631-A635 PolarHBondContact O-N 3.4Å; F632-A635 PolarHBondContact O-N 3.18Å; A635-A639 WeakPolarHBondContact O-CB 3.24Å; A635-A639 PolarHBondContact O-N 3Å
636	H	92.7	Very high	92	Very high	29 Å²	29	50.9 Å²	50.9	13%	0.134	27%	0.265	C	S	.	.	H	α-helix	trans	-62.9	-51.6	171.2	-172.2	107.7	0	0	0	111	P580 F632 L633 E634 R638 A639 E640 H659	P580-H636 HydrophobicContact CB-CB 4.24Å; P580-H636 HydrophobicContact CG-CB 4.32Å; F632-H636 WeakPolarHBondContact O-CB 3.49Å; F632-H636 PolarHBondContact O-N 2.83Å; L633-H636 PolarHBondContact O-N 2.88Å; E634-H636 VanDerWaalsContact C-N 3.34Å; H636-R638 VanDerWaalsContact C-N 3.32Å; H636-R638 PolarHBondContact O-N 3.39Å; H636-A639 WeakPolarHBondContact O-CA 3.44Å; H636-A639 VanDerWaalsContact O-CB 3.27Å; H636-A639 WeakPolarHBondContact O-CB 3.29Å; H636-A639 PolarHBondContact O-N 3.1Å; H636-E640 PolarHBondContact O-N 2.84Å; H636-H659 AromaticContact CE1-CD2 3.6Å; H636-H659 AromaticContact CE1-NE2 3.44Å; H636-H659 PolarHBondContact CE1-NE2 2.62Å; H636-H659 AromaticContact ND1-NE2 3.95Å
637	H	93.7	Very high	91.9	Very high	97 Å²	97	52.7 Å²	52.7	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-63.5	-37.4	-179	-170.6	51.6	0	0	0	112.5	L633 E634 A639 E640 Q641	L633-H637 PolarHBondContact O-N 3.2Å; E634-H637 PolarHBondContact O-N 3.5Å; H637-A639 VanDerWaalsContact C-N 3.27Å; H637-A639 PolarHBondContact O-N 2.66Å; H637-E640 WeakPolarHBondContact CA-OE2 3.44Å; H637-E640 IonicContact CE1-OE2 3.81Å; H637-E640 IonicContact CG-OE2 3.75Å; H637-E640 IonicContact ND1-OE2 2.83Å; H637-E640 PolarHBondContact ND1-OE2 2.87Å; H637-E640 WeakPolarHBondContact O-CB 3.46Å; H637-E640 PolarHBondContact O-N 3.33Å; H637-Q641 PolarHBondContact CD2-NE2 3.49Å; H637-Q641 PolarHBondContact NE2-NE2 2.93Å; H637-Q641 VanDerWaalsContact O-CG 3.31Å; H637-Q641 WeakPolarHBondContact O-CG 3.5Å; H637-Q641 PolarHBondContact O-N 3.19Å
638	R	96.4	Very high	91.6	Very high	78 Å²	78	52.1 Å²	52.1	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-66.8	-28.4	172.7	-175	58.3	-167.5	130.9	3.9	112.5	V603 E634 H636 Q641 L642 D645	V603-R638 HydrophobicContact CG1-CB 4.27Å; V603-R638 HydrophobicContact CG1-CG 4.4Å; E634-R638 WeakPolarHBondContact O-CB 3.23Å; E634-R638 PolarHBondContact O-N 2.86Å; H636-R638 VanDerWaalsContact C-N 3.32Å; H636-R638 PolarHBondContact O-N 3.39Å; R638-Q641 VanDerWaalsContact CD-OE1 3.23Å; R638-Q641 VanDerWaalsContact NH1-CB 3.33Å; R638-L642 VanDerWaalsContact O-CB 3.3Å; R638-L642 WeakPolarHBondContact O-CB 3.29Å; R638-L642 PolarHBondContact O-N 3.39Å; R638-D645 IonicContact CZ-OD2 2.77Å; R638-D645 IonicContact NH1-OD2 3.33Å; R638-D645 PolarHBondContact NH1-OD2 3.26Å; R638-D645 IonicContact NH2-OD2 3.33Å; R638-D645 PolarHBondContact NH2-OD2 3.4Å
639	A	96.9	Very high	91.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-70	-41.1	171.9	0	0	0	0	0	112.4	V578 P580 V603 A635 H636 H637 L642 V643 L657	V578-A639 HydrophobicContact CG1-CB 3.77Å; P580-A639 HydrophobicContact CB-CB 4.04Å; P580-A639 HydrophobicContact CG-CB 4.15Å; V603-A639 HydrophobicContact CB-CB 4.11Å; V603-A639 HydrophobicContact CG2-CB 3.77Å; A635-A639 WeakPolarHBondContact O-CB 3.24Å; A635-A639 PolarHBondContact O-N 3Å; H636-A639 WeakPolarHBondContact O-CA 3.44Å; H636-A639 VanDerWaalsContact O-CB 3.27Å; H636-A639 WeakPolarHBondContact O-CB 3.29Å; H636-A639 PolarHBondContact O-N 3.1Å; H637-A639 VanDerWaalsContact C-N 3.27Å; H637-A639 PolarHBondContact O-N 2.66Å; A639-L642 PolarHBondContact O-N 2.73Å; A639-V643 WeakPolarHBondContact O-CG2 3.34Å; A639-V643 PolarHBondContact O-N 3.31Å; A639-V643 VanDerWaalsContact O-N 3.09Å; A639-L657 HydrophobicContact CB-CD1 3.59Å
640	E	96	Very high	90.6	Very high	79 Å²	79	60.3 Å²	60.3	37%	0.369	32%	0.321	S	S	.	.	H	α-helix	trans	-59.2	-51	171.9	-61.8	178.1	114.8	0	0	111.2	H636 H637 L642 V643 N644 L657	H636-E640 PolarHBondContact O-N 2.84Å; H637-E640 WeakPolarHBondContact CA-OE2 3.44Å; H637-E640 IonicContact CE1-OE2 3.81Å; H637-E640 IonicContact CG-OE2 3.75Å; H637-E640 IonicContact ND1-OE2 2.83Å; H637-E640 PolarHBondContact ND1-OE2 2.87Å; H637-E640 WeakPolarHBondContact O-CB 3.46Å; H637-E640 PolarHBondContact O-N 3.33Å; E640-L642 VanDerWaalsContact C-N 3.32Å; E640-L642 PolarHBondContact O-N 2.92Å; E640-V643 PolarHBondContact O-N 3.47Å; E640-N644 PolarHBondContact O-N 3.37Å; E640-N644 VanDerWaalsContact O-N 3.12Å; E640-N644 PolarHBondContact O-ND2 3.09Å; E640-L657 HydrophobicContact CG-CD2 4.03Å
641	Q	96	Very high	90	Very high	72 Å²	72	63.8 Å²	63.8	34%	0.336	34%	0.337	S	S	.	.	H	α-helix	trans	-55	-47.7	176.2	-69.3	172.5	2	0	0	111.2	H637 R638 V643 N644 D645	H637-Q641 PolarHBondContact CD2-NE2 3.49Å; H637-Q641 PolarHBondContact NE2-NE2 2.93Å; H637-Q641 VanDerWaalsContact O-CG 3.31Å; H637-Q641 WeakPolarHBondContact O-CG 3.5Å; H637-Q641 PolarHBondContact O-N 3.19Å; R638-Q641 VanDerWaalsContact CD-OE1 3.23Å; R638-Q641 VanDerWaalsContact NH1-CB 3.33Å; Q641-V643 VanDerWaalsContact C-N 3.29Å; Q641-V643 PolarHBondContact O-N 3.47Å; Q641-N644 WeakPolarHBondContact O-CB 3.34Å; Q641-N644 PolarHBondContact O-N 3.28Å; Q641-N644 VanDerWaalsContact O-N 3.09Å; Q641-D645 PolarHBondContact O-N 3.12Å
642	L	95.5	Very high	89.8	Confident	18 Å²	18	64.8 Å²	64.8	9%	0.094	34%	0.341	C	S	.	.	H	α-helix	trans	-64.3	-31.6	-178.8	-174.7	65.2	0	0	0	113.1	V578 T601 R638 A639 E640 L646	V578-L642 HydrophobicContact CG1-CD2 4.13Å; V578-L642 HydrophobicContact CG2-CD2 4.38Å; T601-L642 HydrophobicContact CG2-CD2 3.65Å; R638-L642 VanDerWaalsContact O-CB 3.3Å; R638-L642 WeakPolarHBondContact O-CB 3.29Å; R638-L642 PolarHBondContact O-N 3.39Å; A639-L642 PolarHBondContact O-N 2.73Å; E640-L642 VanDerWaalsContact C-N 3.32Å; E640-L642 PolarHBondContact O-N 2.92Å; L642-L646 HydrophobicContact CD1-CD1 4.29Å; L642-L646 HydrophobicContact CD1-CG 4.25Å; L642-L646 HydrophobicContact CG-CD1 4Å; L642-L646 HydrophobicContact CG-CG 4.39Å; L642-L646 WeakPolarHBondContact O-CB 3.48Å; L642-L646 WeakPolarHBondContact O-CG 3.32Å; L642-L646 PolarHBondContact O-N 3.02Å
643	V	96.2	Very high	89.7	Confident	10 Å²	10	68 Å²	68	6%	0.061	37%	0.365	C	S	.	.	H	α-helix	trans	-65.9	-45.3	171.9	170.8	0	0	0	0	110.3	V578 A639 E640 Q641 L646 Q647 V655 L657	V578-V643 HydrophobicContact CB-CG2 3.71Å; V578-V643 HydrophobicContact CG2-CG2 3.58Å; A639-V643 WeakPolarHBondContact O-CG2 3.34Å; A639-V643 PolarHBondContact O-N 3.31Å; A639-V643 VanDerWaalsContact O-N 3.09Å; E640-V643 PolarHBondContact O-N 3.47Å; Q641-V643 VanDerWaalsContact C-N 3.29Å; Q641-V643 PolarHBondContact O-N 3.47Å; V643-L646 PolarHBondContact O-N 3.26Å; V643-Q647 HydrophobicContact CG1-CG 4.24Å; V643-Q647 WeakPolarHBondContact O-CB 3.22Å; V643-Q647 VanDerWaalsContact O-CG 3.25Å; V643-Q647 WeakPolarHBondContact O-CG 3.47Å; V643-Q647 PolarHBondContact O-N 2.8Å; V643-V655 HydrophobicContact CG1-CG1 4.41Å; V643-V655 HydrophobicContact CG2-CG1 4.44Å; V643-L657 HydrophobicContact CG2-CB 4.11Å; V643-L657 HydrophobicContact CG2-CD1 4.38Å
644	N	94.2	Very high	90.1	Very high	98 Å²	98	65 Å²	65	52%	0.524	35%	0.351	S	S	.	.	H	α-helix	trans	-63	-42.8	176.3	-60.9	-28.7	0	0	0	112	E640 Q641 L646 S648	E640-N644 PolarHBondContact O-N 3.37Å; E640-N644 VanDerWaalsContact O-N 3.12Å; E640-N644 PolarHBondContact O-ND2 3.09Å; Q641-N644 WeakPolarHBondContact O-CB 3.34Å; Q641-N644 PolarHBondContact O-N 3.28Å; Q641-N644 VanDerWaalsContact O-N 3.09Å; N644-L646 PolarHBondContact O-N 2.9Å; N644-S648 WeakPolarHBondContact O-CB 3.46Å; N644-S648 PolarHBondContact O-N 2.82Å; N644-S648 PolarHBondContact O-OG 3.12Å
645	D	93.3	Very high	90.3	Very high	77 Å²	77	61.6 Å²	61.6	41%	0.412	34%	0.335	S	S	.	.	H	α-helix	trans	-57.1	-47.9	175.8	-63.9	-22.4	0	0	0	110.7	R638 Q641 S648 G649	R638-D645 IonicContact CZ-OD2 2.77Å; R638-D645 IonicContact NH1-OD2 3.33Å; R638-D645 PolarHBondContact NH1-OD2 3.26Å; R638-D645 IonicContact NH2-OD2 3.33Å; R638-D645 PolarHBondContact NH2-OD2 3.4Å; Q641-D645 PolarHBondContact O-N 3.12Å; D645-S648 PolarHBondContact O-OG 3.07Å; D645-G649 PolarHBondContact O-N 3.29Å
646	L	91	Very high	90.6	Very high	43 Å²	43	66.7 Å²	66.7	23%	0.225	36%	0.355	C	S	.	.	H	α-helix	trans	-73	-43	-176.9	-72.5	171.1	0	0	0	112.9	V578 L642 V643 N644 H650 V655	V578-L646 HydrophobicContact CG2-CD1 4.31Å; L642-L646 HydrophobicContact CD1-CD1 4.29Å; L642-L646 HydrophobicContact CD1-CG 4.25Å; L642-L646 HydrophobicContact CG-CD1 4Å; L642-L646 HydrophobicContact CG-CG 4.39Å; L642-L646 WeakPolarHBondContact O-CB 3.48Å; L642-L646 WeakPolarHBondContact O-CG 3.32Å; L642-L646 PolarHBondContact O-N 3.02Å; V643-L646 PolarHBondContact O-N 3.26Å; N644-L646 PolarHBondContact O-N 2.9Å; L646-H650 PolarHBondContact O-N 3.32Å; L646-H650 PolarHBondContact O-ND1 3.39Å; L646-V655 HydrophobicContact CB-CG1 4.02Å; L646-V655 HydrophobicContact CB-CG2 4.2Å; L646-V655 HydrophobicContact CD1-CG1 4.09Å
647	Q	91.8	Very high	90.8	Very high	67 Å²	67	67.1 Å²	67.1	31%	0.313	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-47.7	176.8	-73.2	-179.7	-4.5	0	0	111.1	V643 N651 D652 V655	V643-Q647 HydrophobicContact CG1-CG 4.24Å; V643-Q647 WeakPolarHBondContact O-CB 3.22Å; V643-Q647 VanDerWaalsContact O-CG 3.25Å; V643-Q647 WeakPolarHBondContact O-CG 3.47Å; V643-Q647 PolarHBondContact O-N 2.8Å; Q647-N651 VanDerWaalsContact O-CA 3.23Å; Q647-N651 WeakPolarHBondContact O-CA 3.37Å; Q647-N651 PolarHBondContact O-N 3.01Å; Q647-D652 WeakPolarHBondContact CG-O 3.33Å; Q647-D652 PolarHBondContact O-N 3.14Å; Q647-V655 HydrophobicContact CG-CB 3.97Å; Q647-V655 PolarHBondContact NE2-O 3.1Å
648	S	87.9	Confident	90.9	Very high	86 Å²	86	62.5 Å²	62.5	60%	0.601	34%	0.336	S	S	*	.	H	α-helix	trans	-72	-38.6	-178.2	60	0	0	0	0	113.1	N644 D645 H650	N644-S648 WeakPolarHBondContact O-CB 3.46Å; N644-S648 PolarHBondContact O-N 2.82Å; N644-S648 PolarHBondContact O-OG 3.12Å; D645-S648 PolarHBondContact O-OG 3.07Å; S648-H650 VanDerWaalsContact C-N 3.29Å; S648-H650 PolarHBondContact O-N 2.93Å
649	G	81.3	Confident	90.8	Very high	60 Å²	60	60.1 Å²	60.1	62%	0.619	33%	0.328	S	S	*	.	H	α-helix	trans	-66.8	-23.8	-179.4	0	0	0	0	0	115.1	D645	D645-G649 PolarHBondContact O-N 3.29Å
650	H	75.1	Confident	90.6	Very high	146 Å²	146	60.7 Å²	60.7	68%	0.676	33%	0.332	S	S	*	.	H	α-helix	trans	-122.4	-3.5	-176.6	-62.1	85.8	0	0	0	114.4	L646 S648 D652	L646-H650 PolarHBondContact O-N 3.32Å; L646-H650 PolarHBondContact O-ND1 3.39Å; S648-H650 VanDerWaalsContact C-N 3.29Å; S648-H650 PolarHBondContact O-N 2.93Å; H650-D652 HydrophobicContact CB-CB 4.15Å; H650-D652 PolarHBondContact O-N 3.13Å
651	N	74.5	Confident	90.5	Very high	148 Å²	148	58 Å²	58	79%	0.791	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	36.6	-163.9	-73.6	-49.3	0	0	0	112.8	Q647 P653	Q647-N651 VanDerWaalsContact O-CA 3.23Å; Q647-N651 WeakPolarHBondContact O-CA 3.37Å; Q647-N651 PolarHBondContact O-N 3.01Å; N651-P653 WeakPolarHBondContact O-CD 3.1Å
652	D	79.9	Confident	90.3	Very high	42 Å²	42	57.2 Å²	57.2	23%	0.225	32%	0.317	C	S	.	.			trans	-98.7	98	-179.8	-175.5	3.4	0	0	0	111.1	S575 Q647 H650 T654 V655	S575-D652 WeakPolarHBondContact CB-OD2 3.48Å; S575-D652 PolarHBondContact OG-OD2 2.83Å; Q647-D652 WeakPolarHBondContact CG-O 3.33Å; Q647-D652 PolarHBondContact O-N 3.14Å; H650-D652 HydrophobicContact CB-CB 4.15Å; H650-D652 PolarHBondContact O-N 3.13Å; D652-T654 VanDerWaalsContact CG-OG1 3.29Å; D652-T654 PolarHBondContact O-N 2.81Å; D652-T654 VanDerWaalsContact O-N 3.13Å; D652-T654 WeakPolarHBondContact OD1-CA 3.41Å; D652-T654 WeakPolarHBondContact OD1-CB 3.27Å; D652-T654 VanDerWaalsContact OD1-CG2 3.31Å; D652-T654 WeakPolarHBondContact OD1-CG2 3.2Å; D652-T654 PolarHBondContact OD1-N 3.19Å; D652-T654 PolarHBondContact OD1-OG1 2.86Å; D652-T654 PolarHBondContact OD2-OG1 3.45Å; D652-V655 HydrophobicContact CB-CG2 4.25Å
653	P	83.6	Confident	90.2	Very high	98 Å²	98	57.8 Å²	57.8	64%	0.636	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	0.7	177.4	34.3	-38.6	0	0	0	113.1	N651	N651-P653 WeakPolarHBondContact O-CD 3.1Å
654	T	93.2	Very high	90	Very high	40 Å²	40	60.8 Å²	60.8	25%	0.245	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-3.3	-175.8	82.7	0	0	0	0	113	G573 V574 S575 D652	G573-T654 VanDerWaalsContact O-CB 3.27Å; G573-T654 WeakPolarHBondContact O-CB 3.35Å; G573-T654 WeakPolarHBondContact O-CG2 3.4Å; V574-T654 VanDerWaalsContact CA-O 3.29Å; V574-T654 WeakPolarHBondContact CA-O 3.46Å; V574-T654 VanDerWaalsContact CG1-O 3.3Å; V574-T654 WeakPolarHBondContact CG1-O 3.46Å; S575-T654 WeakPolarHBondContact CB-OG1 3.39Å; S575-T654 PolarHBondContact N-O 3.42Å; S575-T654 PolarHBondContact N-OG1 2.89Å; S575-T654 PolarHBondContact OG-OG1 3.08Å; D652-T654 VanDerWaalsContact CG-OG1 3.29Å; D652-T654 PolarHBondContact O-N 2.81Å; D652-T654 VanDerWaalsContact O-N 3.13Å; D652-T654 WeakPolarHBondContact OD1-CA 3.41Å; D652-T654 WeakPolarHBondContact OD1-CB 3.27Å; D652-T654 VanDerWaalsContact OD1-CG2 3.31Å; D652-T654 WeakPolarHBondContact OD1-CG2 3.2Å; D652-T654 PolarHBondContact OD1-N 3.19Å; D652-T654 PolarHBondContact OD1-OG1 2.86Å; D652-T654 PolarHBondContact OD2-OG1 3.45Å
655	V	96.1	Very high	90.1	Very high	6 Å²	6	58.3 Å²	58.3	4%	0.036	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	131.9	168.4	-175.1	0	0	0	0	110.8	H576 V643 L646 Q647 D652	H576-V655 HydrophobicContact CB-CB 4.39Å; H576-V655 HydrophobicContact CB-CG1 4.13Å; H576-V655 HydrophobicContact CB-CG2 4.06Å; H576-V655 CarbonylContact O-C 3.48Å; H576-V655 WeakPolarHBondContact O-CA 3.45Å; V643-V655 HydrophobicContact CG1-CG1 4.41Å; V643-V655 HydrophobicContact CG2-CG1 4.44Å; L646-V655 HydrophobicContact CB-CG1 4.02Å; L646-V655 HydrophobicContact CB-CG2 4.2Å; L646-V655 HydrophobicContact CD1-CG1 4.09Å; Q647-V655 HydrophobicContact CG-CB 3.97Å; Q647-V655 PolarHBondContact NE2-O 3.1Å; D652-V655 HydrophobicContact CB-CG2 4.25Å
656	R	96.6	Very high	90.2	Very high	107 Å²	107	54.7 Å²	54.7	40%	0.404	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	151.9	-177.1	-64.2	-164.7	177.7	-155.8	-4.8	116	W569 V574 H576 I577 V578	W569-R656 HydrophobicContact CE3-CB 3.9Å; W569-R656 HydrophobicContact CH2-CB 4.03Å; W569-R656 HydrophobicContact CZ3-CB 3.55Å; V574-R656 HydrophobicContact CG2-CG 4.09Å; H576-R656 PolarHBondContact O-N 3.26Å; I577-R656 CarbonylContact C-O 3.51Å; I577-R656 WeakPolarHBondContact CA-O 3.46Å; V578-R656 PolarHBondContact N-O 3.47Å
657	L	97.1	Very high	90.5	Very high	37 Å²	37	53.7 Å²	53.7	19%	0.194	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	114	172	-171.9	72	0	0	0	111.1	W569 V578 A639 E640 V643 Q663	W569-L657 WeakPolarHBondContact CH2-O 3.46Å; V578-L657 CarbonylContact O-C 3.23Å; V578-L657 WeakPolarHBondContact O-CA 3.44Å; A639-L657 HydrophobicContact CB-CD1 3.59Å; E640-L657 HydrophobicContact CG-CD2 4.03Å; V643-L657 HydrophobicContact CG2-CB 4.11Å; V643-L657 HydrophobicContact CG2-CD1 4.38Å; L657-Q663 PolarHBondContact O-NE2 2.71Å
658	L	97.2	Very high	90.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.295	C	S	.	.			trans	-88	105.4	171.7	174.7	66.7	0	0	0	109.7	V562 V565 V566 W569 I577 V578 C579 A589	V562-L658 HydrophobicContact CG1-CD2 3.83Å; V565-L658 HydrophobicContact CB-CD1 3.94Å; V565-L658 HydrophobicContact CG1-CD1 3.65Å; V565-L658 HydrophobicContact CG2-CD1 4.21Å; V566-L658 HydrophobicContact CG2-CD2 4.21Å; W569-L658 HydrophobicContact CH2-CB 4.49Å; W569-L658 HydrophobicContact CZ3-CB 4.16Å; I577-L658 HydrophobicContact CD1-CD2 3.8Å; V578-L658 PolarHBondContact O-N 3.17Å; C579-L658 HydrophobicContact CB-CB 4.2Å; C579-L658 HydrophobicContact CB-CD2 4.28Å; C579-L658 PolarHBondContact SG-O 2.99Å; A589-L658 HydrophobicContact CB-CD2 3.63Å
659	H	94.4	Very high	91.1	Very high	28 Å²	28	49 Å²	49	13%	0.13	27%	0.266	C	S	.	.			trans	-71.3	134.3	175.2	-156.6	-61	0	0	0	110.2	H636 Y661 D662 Q663 L666	H636-H659 AromaticContact CE1-CD2 3.6Å; H636-H659 AromaticContact CE1-NE2 3.44Å; H636-H659 PolarHBondContact CE1-NE2 2.62Å; H636-H659 AromaticContact ND1-NE2 3.95Å; H659-Y661 AromaticContact CE1-CD1 3.95Å; H659-Y661 AromaticContact CE1-CD2 3.86Å; H659-Y661 AromaticContact CE1-CE1 3.69Å; H659-Y661 AromaticContact CE1-CE2 3.61Å; H659-Y661 AromaticContact CE1-CZ 3.54Å; H659-Y661 AromaticContact ND1-CD1 3.97Å; H659-Y661 AromaticContact ND1-CG 3.91Å; H659-Y661 PolarHBondContact ND1-N 2.72Å; H659-Y661 PolarHBondContact O-N 2.96Å; H659-D662 PolarHBondContact ND1-N 2.79Å; H659-Q663 HydrophobicContact CB-CG 3.88Å; H659-L666 VanDerWaalsContact O-CD1 3.3Å; H659-L666 WeakPolarHBondContact O-CD1 3.18Å
660	P	92.9	Very high	91.9	Very high	12 Å²	12	46.3 Å²	46.3	8%	0.078	24%	0.237	C	C	.	.	S	Bend	trans	-67.1	-2	179	24.6	-35.9	0	0	0	116	A585 F632	A585-P660 HydrophobicContact CB-CB 3.66Å; F632-P660 HydrophobicContact CE2-CG 4.19Å; F632-P660 HydrophobicContact CZ-CG 3.82Å
661	Y	93.5	Very high	92.9	Very high	23 Å²	23	41 Å²	41	9%	0.09	21%	0.213	C	C	.	.	S	Bend	trans	-164.8	-22.4	-177.8	58.2	-101.9	0	0	0	117.6	H659 W667 G693 G695 A749 V751 A753	H659-Y661 AromaticContact CE1-CD1 3.95Å; H659-Y661 AromaticContact CE1-CD2 3.86Å; H659-Y661 AromaticContact CE1-CE1 3.69Å; H659-Y661 AromaticContact CE1-CE2 3.61Å; H659-Y661 AromaticContact CE1-CZ 3.54Å; H659-Y661 AromaticContact ND1-CD1 3.97Å; H659-Y661 AromaticContact ND1-CG 3.91Å; H659-Y661 PolarHBondContact ND1-N 2.72Å; H659-Y661 PolarHBondContact O-N 2.96Å; Y661-W667 PolarHBondContact O-NE1 3.42Å; Y661-G693 WeakPolarHBondContact CD2-O 3.46Å; Y661-G695 WeakPolarHBondContact O-CA 3.14Å; Y661-A749 HydrophobicContact CE1-CB 3.81Å; Y661-V751 WeakPolarHBondContact CE2-O 3.41Å; Y661-V751 PolarHBondContact OH-O 2.71Å; Y661-A753 HydrophobicContact CD2-CB 4.18Å
662	D	92.1	Very high	94	Very high	55 Å²	55	34.8 Å²	34.8	29%	0.294	18%	0.181	S	C	.	.			trans	-108.7	61.8	-171.1	-161.1	10.8	0	0	0	112.8	H659 W667 A753	H659-D662 PolarHBondContact ND1-N 2.79Å; D662-W667 VanDerWaalsContact OD1-CZ2 3.31Å; D662-W667 WeakPolarHBondContact OD1-CZ2 3.03Å; D662-A753 HydrophobicContact CB-CB 3.88Å; D662-A753 VanDerWaalsContact CG-CA 3.49Å; D662-A753 VanDerWaalsContact CG-CB 3.49Å; D662-A753 WeakPolarHBondContact OD1-CA 3.45Å; D662-A753 WeakPolarHBondContact OD1-CB 3.26Å; D662-A753 WeakPolarHBondContact OD2-CA 3.21Å
663	Q	92.2	Very high	94.8	Very high	30 Å²	30	33 Å²	33	14%	0.14	17%	0.171	C	C	.	.			trans	-141.5	138.2	176.3	-77.2	178.6	-11.1	0	0	111.1	L657 H659 E665 L666 W667	L657-Q663 PolarHBondContact O-NE2 2.71Å; H659-Q663 HydrophobicContact CB-CG 3.88Å; Q663-E665 PolarHBondContact O-N 3.05Å; Q663-L666 HydrophobicContact CB-CB 4.1Å; Q663-L666 VanDerWaalsContact O-CB 3.32Å; Q663-L666 WeakPolarHBondContact O-CB 3.37Å; Q663-L666 PolarHBondContact O-N 3.02Å; Q663-L666 VanDerWaalsContact O-N 3.09Å; Q663-W667 PolarHBondContact O-N 3.11Å
664	P	92.4	Very high	95.5	Very high	73 Å²	73	28.4 Å²	28.4	47%	0.474	14%	0.141	S	C	.	.	H	α-helix	trans	-55.3	-48.2	-177.8	-27.8	36	0	0	0	114.5	L666 W667 E668	P664-L666 PolarHBondContact O-N 2.95Å; P664-W667 HydrophobicContact CB-CE3 4.33Å; P664-W667 HydrophobicContact CB-CZ3 4.15Å; P664-W667 HydrophobicContact CG-CH2 4.34Å; P664-W667 HydrophobicContact CG-CZ3 3.99Å; P664-W667 PolarHBondContact O-N 2.87Å; P664-W667 VanDerWaalsContact O-N 3.1Å; P664-E668 PolarHBondContact O-N 3.44Å; P664-E668 VanDerWaalsContact O-N 3.14Å
665	E	95.3	Very high	95.6	Very high	47 Å²	47	30.4 Å²	30.4	22%	0.22	15%	0.15	C	C	.	.	H	α-helix	trans	-69.5	-16.9	-177.9	-48.4	99.2	117.3	0	0	112.6	N564 V565 K568 Q663 G669	N564-E665 WeakPolarHBondContact CB-O 3.38Å; N564-E665 PolarHBondContact ND2-O 3.17Å; V565-E665 HydrophobicContact CG2-CB 4.08Å; K568-E665 HydrophobicContact CD-CB 3.95Å; K568-E665 HydrophobicContact CD-CG 3.68Å; K568-E665 VanDerWaalsContact NZ-CG 3.28Å; Q663-E665 PolarHBondContact O-N 3.05Å; E665-G669 PolarHBondContact O-N 3.16Å
666	L	96.9	Very high	95.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-78.7	-34.9	173.5	-177.6	150.8	0	0	0	111.2	G561 V562 V565 H659 Q663 P664 G669 Y670	G561-L666 VanDerWaalsContact CA-O 3.23Å; G561-L666 WeakPolarHBondContact CA-O 3.3Å; V562-L666 HydrophobicContact CG2-CD1 4.42Å; V565-L666 HydrophobicContact CG2-CB 3.68Å; H659-L666 VanDerWaalsContact O-CD1 3.3Å; H659-L666 WeakPolarHBondContact O-CD1 3.18Å; Q663-L666 HydrophobicContact CB-CB 4.1Å; Q663-L666 VanDerWaalsContact O-CB 3.32Å; Q663-L666 WeakPolarHBondContact O-CB 3.37Å; Q663-L666 PolarHBondContact O-N 3.02Å; Q663-L666 VanDerWaalsContact O-N 3.09Å; P664-L666 PolarHBondContact O-N 2.95Å; L666-G669 PolarHBondContact O-N 3.18Å; L666-Y670 HydrophobicContact CD2-CD2 3.95Å; L666-Y670 HydrophobicContact CD2-CE2 3.25Å; L666-Y670 HydrophobicContact CG-CE2 4.13Å; L666-Y670 WeakPolarHBondContact O-CD2 3.44Å; L666-Y670 PolarHBondContact O-N 2.86Å
667	W	96.5	Very high	95.5	Very high	22 Å²	22	26.9 Å²	26.9	8%	0.083	14%	0.138	C	C	.	.	H	α-helix	trans	-72.1	-41.7	174.3	-47.8	-36.6	0	0	0	112.1	Y661 D662 Q663 P664 G669 Y670 E671 A698 G699 A753 R755	Y661-W667 PolarHBondContact O-NE1 3.42Å; D662-W667 VanDerWaalsContact OD1-CZ2 3.31Å; D662-W667 WeakPolarHBondContact OD1-CZ2 3.03Å; Q663-W667 PolarHBondContact O-N 3.11Å; P664-W667 HydrophobicContact CB-CE3 4.33Å; P664-W667 HydrophobicContact CB-CZ3 4.15Å; P664-W667 HydrophobicContact CG-CH2 4.34Å; P664-W667 HydrophobicContact CG-CZ3 3.99Å; P664-W667 PolarHBondContact O-N 2.87Å; P664-W667 VanDerWaalsContact O-N 3.1Å; W667-G669 PolarHBondContact O-N 2.85Å; W667-Y670 CarbonylContact O-C 3.36Å; W667-Y670 PolarHBondContact O-N 3.48Å; W667-E671 PolarHBondContact O-N 2.79Å; W667-A698 HydrophobicContact CB-CB 4.44Å; W667-A698 HydrophobicContact CD2-CB 4.18Å; W667-A698 HydrophobicContact CG-CB 3.9Å; W667-G699 WeakPolarHBondContact O-CA 3.16Å; W667-A753 HydrophobicContact CZ2-CB 4.37Å; W667-R755 HydrophobicContact CD2-CB 4.49Å; W667-R755 HydrophobicContact CD2-CG 4.24Å; W667-R755 HydrophobicContact CE3-CB 4.12Å; W667-R755 HydrophobicContact CE3-CG 3.7Å; W667-R755 HydrophobicContact CH2-CB 3.33Å; W667-R755 HydrophobicContact CH2-CG 3.86Å; W667-R755 HydrophobicContact CZ2-CB 3.69Å; W667-R755 HydrophobicContact CZ2-CG 4.32Å; W667-R755 HydrophobicContact CZ3-CB 3.56Å; W667-R755 HydrophobicContact CZ3-CG 3.51Å
668	E	95.9	Very high	94.9	Very high	55 Å²	55	26.8 Å²	26.8	26%	0.257	14%	0.139	S	C	.	.	H	α-helix	trans	-50.4	-45.3	169.5	-69.3	174.3	-159.6	0	0	111.3	N564 K568 P664 Y670 E671	N564-E668 PolarHBondContact ND2-OE2 3.17Å; K568-E668 WeakPolarHBondContact CE-OE2 3.29Å; K568-E668 IonicContact NZ-OE1 3.42Å; K568-E668 PolarHBondContact NZ-OE1 3.09Å; K568-E668 IonicContact NZ-OE2 3.55Å; K568-E668 PolarHBondContact NZ-OE2 2.9Å; P664-E668 PolarHBondContact O-N 3.44Å; P664-E668 VanDerWaalsContact O-N 3.14Å; E668-Y670 VanDerWaalsContact C-N 3.28Å; E668-Y670 PolarHBondContact O-N 2.72Å; E668-E671 VanDerWaalsContact O-CG 3.22Å; E668-E671 WeakPolarHBondContact O-CG 3.48Å; E668-E671 PolarHBondContact O-N 2.9Å
669	G	96.7	Very high	94.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.9	-38.2	178.4	0	0	0	0	0	112.4	R560 E665 L666 W667 T672	R560-G669 WeakPolarHBondContact CB-O 3.42Å; R560-G669 WeakPolarHBondContact O-CA 3.29Å; E665-G669 PolarHBondContact O-N 3.16Å; L666-G669 PolarHBondContact O-N 3.18Å; W667-G669 PolarHBondContact O-N 2.85Å; G669-T672 PolarHBondContact O-OG1 2.97Å
670	Y	98	Very high	94	Very high	3 Å²	3	38.9 Å²	38.9	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-76	-22.9	176.3	-61	-32.2	0	0	0	114.3	F557 R560 G561 L666 W667 E668 T672 I673 G695 L696	F557-Y670 AromaticContact CD2-CD1 3.94Å; F557-Y670 HydrophobicContact CD2-CD1 3.94Å; F557-Y670 AromaticContact CD2-CE1 3.51Å; F557-Y670 HydrophobicContact CD2-CE1 3.51Å; F557-Y670 HydrophobicContact CD2-CE2 4.36Å; F557-Y670 AromaticContact CD2-CZ 3.75Å; F557-Y670 AromaticContact CE2-CE1 3.92Å; F557-Y670 HydrophobicContact CE2-CE1 3.92Å; F557-Y670 HydrophobicContact CE2-CE2 4.03Å; F557-Y670 AromaticContact CE2-CZ 3.64Å; F557-Y670 WeakPolarHBondContact O-CE1 3.37Å; R560-Y670 HydrophobicContact CB-CD1 4.05Å; R560-Y670 HydrophobicContact CB-CE1 4.46Å; G561-Y670 VanDerWaalsContact N-CE1 3.32Å; L666-Y670 HydrophobicContact CD2-CD2 3.95Å; L666-Y670 HydrophobicContact CD2-CE2 3.25Å; L666-Y670 HydrophobicContact CG-CE2 4.13Å; L666-Y670 WeakPolarHBondContact O-CD2 3.44Å; L666-Y670 PolarHBondContact O-N 2.86Å; W667-Y670 CarbonylContact O-C 3.36Å; W667-Y670 PolarHBondContact O-N 3.48Å; E668-Y670 VanDerWaalsContact C-N 3.28Å; E668-Y670 PolarHBondContact O-N 2.72Å; Y670-T672 PolarHBondContact O-N 3.04Å; Y670-T672 VanDerWaalsContact O-N 3.16Å; Y670-I673 WeakPolarHBondContact O-CB 3.37Å; Y670-I673 VanDerWaalsContact O-CG1 3.32Å; Y670-I673 WeakPolarHBondContact O-CG1 3.47Å; Y670-I673 PolarHBondContact O-N 3.48Å; Y670-G695 WeakPolarHBondContact CD2-O 3.23Å; Y670-L696 HydrophobicContact CG-CD1 4.35Å
671	E	96.7	Very high	93.9	Very high	35 Å²	35	39 Å²	39	16%	0.164	21%	0.207	C	C	.	.	H	α-helix	trans	-59.3	-28.6	176.7	99.5	-159.5	138.9	0	0	111.9	W667 E668 I673 V674 D675 G699 Q702 N706	W667-E671 PolarHBondContact O-N 2.79Å; E668-E671 VanDerWaalsContact O-CG 3.22Å; E668-E671 WeakPolarHBondContact O-CG 3.48Å; E668-E671 PolarHBondContact O-N 2.9Å; E671-I673 PolarHBondContact O-N 3.06Å; E671-V674 WeakPolarHBondContact O-CB 3.41Å; E671-V674 PolarHBondContact O-N 2.94Å; E671-D675 PolarHBondContact O-N 2.89Å; E671-G699 WeakPolarHBondContact CA-O 3.36Å; E671-G699 WeakPolarHBondContact CB-O 3.23Å; E671-Q702 WeakPolarHBondContact OE2-CG 3.43Å; E671-Q702 PolarHBondContact OE2-NE2 3.27Å; E671-N706 PolarHBondContact OE2-ND2 3.45Å
672	T	96.6	Very high	93.8	Very high	18 Å²	18	39 Å²	39	11%	0.11	22%	0.215	C	C	.	.	H	α-helix	trans	-58.6	-17.9	174.4	68.6	0	0	0	0	114.6	R560 G669 Y670 V674 D675 E676	R560-T672 PolarHBondContact NH1-OG1 3.26Å; G669-T672 PolarHBondContact O-OG1 2.97Å; Y670-T672 PolarHBondContact O-N 3.04Å; Y670-T672 VanDerWaalsContact O-N 3.16Å; T672-V674 VanDerWaalsContact C-N 3.28Å; T672-V674 PolarHBondContact O-N 2.97Å; T672-D675 PolarHBondContact O-N 3.39Å; T672-E676 WeakPolarHBondContact O-CG 3.27Å; T672-E676 PolarHBondContact O-N 2.84Å
673	I	97.9	Very high	93.9	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-64.5	-37	172.8	-63.5	171.4	0	0	0	110.3	K547 E549 F557 R560 Y670 E671 L696	K547-I673 HydrophobicContact CG-CG2 3.84Å; E549-I673 HydrophobicContact CG-CD1 4.37Å; F557-I673 HydrophobicContact CB-CD1 4.39Å; R560-I673 VanDerWaalsContact CD-CG1 3.49Å; Y670-I673 WeakPolarHBondContact O-CB 3.37Å; Y670-I673 VanDerWaalsContact O-CG1 3.32Å; Y670-I673 WeakPolarHBondContact O-CG1 3.47Å; Y670-I673 PolarHBondContact O-N 3.48Å; E671-I673 PolarHBondContact O-N 3.06Å; I673-L696 HydrophobicContact CD1-CD1 3.57Å
674	V	97.6	Very high	94.2	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-78.4	-36.9	178.7	-170.2	0	0	0	0	110.9	E671 T672 E676 I677 V700 L704 K707 W709	E671-V674 WeakPolarHBondContact O-CB 3.41Å; E671-V674 PolarHBondContact O-N 2.94Å; T672-V674 VanDerWaalsContact C-N 3.28Å; T672-V674 PolarHBondContact O-N 2.97Å; V674-E676 PolarHBondContact O-N 3.33Å; V674-I677 HydrophobicContact CB-CD1 4.48Å; V674-I677 HydrophobicContact CG1-CD1 4.01Å; V674-I677 WeakPolarHBondContact O-CB 3.48Å; V674-I677 WeakPolarHBondContact O-CG1 3.48Å; V674-I677 PolarHBondContact O-N 3.39Å; V674-I677 VanDerWaalsContact O-N 3.14Å; V674-V700 HydrophobicContact CG2-CG1 4.37Å; V674-L704 HydrophobicContact CG1-CD2 4.09Å; V674-L704 HydrophobicContact CG1-CG 4.42Å; V674-K707 HydrophobicContact CG1-CG 4.06Å; V674-W709 HydrophobicContact CG1-CE3 4.17Å; V674-W709 HydrophobicContact CG1-CZ3 4.26Å
675	D	94.9	Very high	94.4	Very high	81 Å²	81	37.4 Å²	37.4	43%	0.433	20%	0.2	S	C	.	.	H	α-helix	trans	-58.8	-26.1	172.2	-78.5	-48	0	0	0	113.9	E671 T672 K707	E671-D675 PolarHBondContact O-N 2.89Å; T672-D675 PolarHBondContact O-N 3.39Å; D675-K707 WeakPolarHBondContact OD1-CE 3.37Å; D675-K707 IonicContact OD1-NZ 3.63Å; D675-K707 PolarHBondContact OD1-NZ 3.38Å
676	E	95.9	Very high	94.5	Very high	24 Å²	24	35.1 Å²	35.1	11%	0.112	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-0.7	-179.6	-72	176.2	-162.6	0	0	114.6	K522 S523 K547 R560 T672 V674	K522-E676 WeakPolarHBondContact CA-OE1 3.35Å; K522-E676 WeakPolarHBondContact CA-OE2 3.04Å; K522-E676 HydrophobicContact CB-CG 4.46Å; K522-E676 HydrophobicContact CD-CB 4.46Å; K522-E676 HydrophobicContact CD-CG 3.93Å; K522-E676 HydrophobicContact CG-CB 4.44Å; K522-E676 HydrophobicContact CG-CG 3.89Å; S523-E676 PolarHBondContact N-OE2 2.95Å; S523-E676 VanDerWaalsContact N-OE2 3.07Å; K547-E676 IonicContact NZ-OE2 3.16Å; K547-E676 PolarHBondContact NZ-OE2 3.26Å; R560-E676 IonicContact CZ-OE1 2.77Å; R560-E676 IonicContact CZ-OE2 2.71Å; R560-E676 IonicContact NH1-OE1 3.24Å; R560-E676 PolarHBondContact NH1-OE1 3.18Å; R560-E676 IonicContact NH1-OE2 2.79Å; R560-E676 VanDerWaalsContact NH2-CD 3.27Å; R560-E676 IonicContact NH2-OE1 3.47Å; R560-E676 PolarHBondContact NH2-OE1 2.65Å; R560-E676 IonicContact NH2-OE2 3.2Å; R560-E676 PolarHBondContact NH2-OE2 3.16Å; T672-E676 WeakPolarHBondContact O-CG 3.27Å; T672-E676 PolarHBondContact O-N 2.84Å; V674-E676 PolarHBondContact O-N 3.33Å
677	I	95.8	Very high	94.6	Very high	16 Å²	16	35.3 Å²	35.3	8%	0.082	19%	0.191	C	C	.	.			trans	-61.9	136.6	172.1	-64.8	176	0	0	0	109.2	L525 V674 I681 P684 I687 W709 L822	L525-I677 HydrophobicContact CD2-CB 4.25Å; L525-I677 HydrophobicContact CD2-CG1 4.22Å; L525-I677 HydrophobicContact CD2-CG2 4.16Å; V674-I677 HydrophobicContact CB-CD1 4.48Å; V674-I677 HydrophobicContact CG1-CD1 4.01Å; V674-I677 WeakPolarHBondContact O-CB 3.48Å; V674-I677 WeakPolarHBondContact O-CG1 3.48Å; V674-I677 PolarHBondContact O-N 3.39Å; V674-I677 VanDerWaalsContact O-N 3.14Å; I677-I681 HydrophobicContact CG2-CB 4.44Å; I677-P684 HydrophobicContact CD1-CG 4.37Å; I677-I687 HydrophobicContact CD1-CD1 4.43Å; I677-W709 HydrophobicContact CB-CH2 4.46Å; I677-W709 HydrophobicContact CB-CZ3 4.18Å; I677-W709 HydrophobicContact CD1-CZ3 4.08Å; I677-W709 HydrophobicContact CG2-CH2 4.18Å; I677-W709 HydrophobicContact CG2-CZ3 4.06Å; I677-L822 HydrophobicContact CD1-CD1 3.8Å; I677-L822 HydrophobicContact CG1-CD1 3.82Å
678	T	84.4	Confident	94.7	Very high	35 Å²	35	34.2 Å²	34.2	22%	0.215	19%	0.187	C	C	.	.			trans	-80.8	143.7	-173.6	46.7	0	0	0	0	111.3	E680 I681 G682	T678-E680 PolarHBondContact O-N 2.79Å; T678-I681 PolarHBondContact O-N 3.47Å; T678-G682 PolarHBondContact O-N 3.05Å
679	P	86.9	Confident	94.8	Very high	132 Å²	132	31.6 Å²	31.6	86%	0.857	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-19.3	172.6	-25.9	35.3	0	0	0	114.3	I681 G682	P679-I681 VanDerWaalsContact C-N 3.34Å; P679-G682 PolarHBondContact O-N 3.5Å
680	E	84.9	Confident	94.9	Very high	150 Å²	150	32.5 Å²	32.5	70%	0.701	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-34.5	174.3	-175.9	-179.8	-178.8	0	0	113.5	W545 T678	W545-E680 HydrophobicContact CH2-CG 4.13Å; T678-E680 PolarHBondContact O-N 2.79Å
681	I	91	Very high	94.9	Very high	14 Å²	14	32.5 Å²	32.5	7%	0.072	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-36.3	172.6	-51.9	178.5	0	0	0	110.2	L525 W545 I677 T678 P679 P684 N820	L525-I681 HydrophobicContact CD1-CD1 4.26Å; L525-I681 HydrophobicContact CD2-CD1 3.55Å; L525-I681 HydrophobicContact CG-CD1 3.85Å; W545-I681 HydrophobicContact CB-CD1 3.9Å; W545-I681 HydrophobicContact CD2-CD1 3.38Å; W545-I681 HydrophobicContact CD2-CG1 3.68Å; W545-I681 HydrophobicContact CE3-CD1 3.57Å; W545-I681 HydrophobicContact CE3-CG1 3.87Å; W545-I681 HydrophobicContact CG-CD1 3.53Å; W545-I681 HydrophobicContact CG-CG1 4.2Å; W545-I681 HydrophobicContact CH2-CG1 4.07Å; W545-I681 HydrophobicContact CZ2-CG1 3.89Å; W545-I681 HydrophobicContact CZ3-CD1 4.21Å; W545-I681 HydrophobicContact CZ3-CG1 4.05Å; I677-I681 HydrophobicContact CG2-CB 4.44Å; T678-I681 PolarHBondContact O-N 3.47Å; P679-I681 VanDerWaalsContact C-N 3.34Å; I681-P684 HydrophobicContact CG2-CB 4.45Å; I681-N820 HydrophobicContact CG2-CB 3.99Å
682	G	90.8	Very high	94.8	Very high	24 Å²	24	31.4 Å²	31.4	25%	0.247	18%	0.181	C	C	.	.			trans	67.6	-139.4	-166	0	0	0	0	0	110.9	T678 P679 W709	T678-G682 PolarHBondContact O-N 3.05Å; P679-G682 PolarHBondContact O-N 3.5Å; G682-W709 VanDerWaalsContact O-CH2 3.25Å; G682-W709 WeakPolarHBondContact O-CH2 3.5Å
683	Q	95.9	Very high	94.6	Very high	67 Å²	67	30.9 Å²	30.9	31%	0.313	18%	0.178	S	C	.	.	S	Bend	trans	-74.5	124.2	171.1	-179.1	174.5	-2.2	0	0	109.7	W709 S711 T712	Q683-W709 HydrophobicContact CB-CD2 3.85Å; Q683-W709 HydrophobicContact CB-CE3 4.45Å; Q683-W709 HydrophobicContact CB-CG 3.92Å; Q683-W709 HydrophobicContact CB-CZ2 4.4Å; Q683-W709 HydrophobicContact CG-CB 3.81Å; Q683-W709 HydrophobicContact CG-CD2 3.89Å; Q683-W709 HydrophobicContact CG-CE3 4.42Å; Q683-W709 HydrophobicContact CG-CG 3.6Å; Q683-W709 PolarHBondContact NE2-O 3.35Å; Q683-S711 PolarHBondContact NE2-OG 3.03Å; Q683-T712 VanDerWaalsContact CG-OG1 3.24Å; Q683-T712 WeakPolarHBondContact CG-OG1 3.4Å; Q683-T712 PolarHBondContact NE2-OG1 2.95Å
684	P	97.1	Very high	94.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.179	C	C	.	.			trans	-73.9	144.2	171.9	31	-33.5	0	0	0	110.8	I677 I681 A686 I687 T712 L822	I677-P684 HydrophobicContact CD1-CG 4.37Å; I681-P684 HydrophobicContact CG2-CB 4.45Å; P684-A686 VanDerWaalsContact C-N 3.34Å; P684-I687 HydrophobicContact CB-CG1 4.45Å; P684-I687 HydrophobicContact CG-CD1 3.98Å; P684-I687 HydrophobicContact CG-CG1 3.83Å; P684-T712 HydrophobicContact CG-CG2 4.22Å; P684-T712 WeakPolarHBondContact O-CB 3.22Å; P684-T712 VanDerWaalsContact O-CG2 3.3Å; P684-T712 WeakPolarHBondContact O-CG2 3.39Å; P684-T712 PolarHBondContact O-OG1 3.13Å; P684-L822 HydrophobicContact CB-CB 4.35Å
685	D	97.3	Very high	94.4	Very high	56 Å²	56	30.9 Å²	30.9	30%	0.299	18%	0.18	S	C	.	.	S	Bend	trans	-68.2	-37.2	176.3	-59.5	-80.2	0	0	0	111.2	H713 P816 S819 N820	D685-H713 PolarHBondContact O-N 2.91Å; D685-P816 HydrophobicContact CB-CG 3.92Å; D685-P816 VanDerWaalsContact OD1-CG 3.29Å; D685-P816 WeakPolarHBondContact OD1-CG 3.32Å; D685-S819 WeakPolarHBondContact OD2-CA 3.14Å; D685-N820 PolarHBondContact N-O 2.88Å; D685-N820 PolarHBondContact OD2-N 2.92Å
686	A	98	Very high	94.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	153.6	170.3	0	0	0	0	0	114.4	P684 H713 L815 I821 L822	P684-A686 VanDerWaalsContact C-N 3.34Å; A686-H713 CarbonylContact C-O 3.56Å; A686-H713 WeakPolarHBondContact CA-O 3.42Å; A686-H713 HydrophobicContact CB-CB 4.06Å; A686-L815 HydrophobicContact CB-CD2 3.82Å; A686-I821 HydrophobicContact CB-CD1 3.89Å; A686-I821 WeakPolarHBondContact O-CA 3.47Å; A686-L822 PolarHBondContact O-N 2.89Å
687	I	98.3	Very high	94.7	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.015	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.8	170.9	-56.8	-175.9	0	0	0	110	I677 P684 V689 V700 L704 T712 H713 I714 V715 L822 V824	I677-I687 HydrophobicContact CD1-CD1 4.43Å; P684-I687 HydrophobicContact CB-CG1 4.45Å; P684-I687 HydrophobicContact CG-CD1 3.98Å; P684-I687 HydrophobicContact CG-CG1 3.83Å; I687-V689 HydrophobicContact CG2-CG2 3.79Å; I687-V700 HydrophobicContact CD1-CG1 4.08Å; I687-V700 HydrophobicContact CG2-CG1 4.36Å; I687-L704 HydrophobicContact CD1-CD1 4.26Å; I687-L704 HydrophobicContact CD1-CD2 4.01Å; I687-L704 HydrophobicContact CD1-CG 4.41Å; I687-T712 HydrophobicContact CD1-CG2 4.27Å; I687-T712 HydrophobicContact CG1-CG2 3.92Å; I687-H713 PolarHBondContact N-O 3.33Å; I687-I714 CarbonylContact O-C 3.52Å; I687-I714 VanDerWaalsContact O-CA 3.32Å; I687-I714 WeakPolarHBondContact O-CA 3.28Å; I687-I714 WeakPolarHBondContact O-CG2 3.43Å; I687-V715 PolarHBondContact O-N 3.48Å; I687-L822 CarbonylContact C-O 3.4Å; I687-L822 VanDerWaalsContact CA-O 3.26Å; I687-L822 WeakPolarHBondContact CA-O 3.49Å; I687-L822 HydrophobicContact CG1-CB 4.35Å; I687-L822 HydrophobicContact CG2-CD2 3.92Å; I687-V824 HydrophobicContact CG2-CG2 3.97Å
688	V	98.6	Very high	94.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.9	173.5	-170.8	0	0	0	0	109.8	V715 V717 A797 T800 L806 I821 L822 I823 V824	V688-V715 WeakPolarHBondContact CA-O 3.49Å; V688-V715 HydrophobicContact CG2-CB 4.29Å; V688-V717 HydrophobicContact CG1-CG2 3.87Å; V688-A797 HydrophobicContact CG1-CB 4.16Å; V688-T800 HydrophobicContact CG1-CG2 4.27Å; V688-L806 HydrophobicContact CG2-CD1 4.36Å; V688-L806 HydrophobicContact CG2-CD2 4.41Å; V688-I821 HydrophobicContact CG2-CG2 3.92Å; V688-L822 PolarHBondContact N-O 3.42Å; V688-I823 HydrophobicContact CB-CB 4.46Å; V688-I823 HydrophobicContact CB-CG1 4.19Å; V688-I823 HydrophobicContact CB-CG2 4.28Å; V688-I823 HydrophobicContact CG2-CG1 4.04Å; V688-V824 PolarHBondContact O-N 2.99Å; V688-V824 VanDerWaalsContact O-N 3.14Å
689	V	98.2	Very high	95.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	124.4	-175.5	-175.9	0	0	0	0	110.7	I687 L696 V700 I714 V715 T716 V717 V824	I687-V689 HydrophobicContact CG2-CG2 3.79Å; V689-L696 HydrophobicContact CG1-CB 4.49Å; V689-L696 HydrophobicContact CG1-CD2 3.8Å; V689-L696 HydrophobicContact CG1-CG 3.86Å; V689-V700 HydrophobicContact CG2-CG1 4.5Å; V689-I714 HydrophobicContact CB-CG2 4.36Å; V689-I714 HydrophobicContact CG2-CG2 3.99Å; V689-V715 PolarHBondContact N-O 3.27Å; V689-T716 WeakPolarHBondContact O-CA 3.33Å; V689-V717 PolarHBondContact O-N 3.36Å; V689-V824 HydrophobicContact CG2-CG2 4.38Å
690	A	98	Very high	95.9	Very high	19 Å²	19	18 Å²	18	16%	0.157	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	131.9	168.9	0	0	0	0	0	110.9	V717 L747 A793 A797	A690-V717 CarbonylContact C-O 3.58Å; A690-V717 WeakPolarHBondContact CA-O 3.41Å; A690-L747 HydrophobicContact CB-CD2 4.07Å; A690-A793 WeakPolarHBondContact CB-O 3.49Å; A690-A797 HydrophobicContact CB-CB 4.2Å
691	V	97.6	Very high	96.5	Very high	2 Å²	2	10.8 Å²	10.8	1%	0.012	7%	0.07	C	C	.	.			trans	-113.1	115	-170.4	174.6	0	0	0	0	111.4	L697 T716 V717 E718 L725 L747 L752	V691-L697 HydrophobicContact CG2-CB 4.41Å; V691-L697 HydrophobicContact CG2-CD2 4.28Å; V691-T716 HydrophobicContact CG2-CG2 3.67Å; V691-V717 PolarHBondContact N-O 3.22Å; V691-E718 HydrophobicContact CB-CG 3.93Å; V691-E718 HydrophobicContact CG1-CG 4.39Å; V691-L725 HydrophobicContact CG1-CB 4.12Å; V691-L725 HydrophobicContact CG1-CD2 4.15Å; V691-L725 HydrophobicContact CG2-CD2 4.24Å; V691-L747 WeakPolarHBondContact O-CD2 3.26Å; V691-L752 HydrophobicContact CG1-CD2 4.03Å
692	G	94.5	Very high	96.6	Very high	13 Å²	13	11.9 Å²	11.9	13%	0.134	8%	0.075	C	C	.	.	S	Bend	trans	-97.3	-120.1	158.3	0	0	0	0	0	109.4	G694 L747 L752	G692-G694 PolarHBondContact O-N 2.95Å; G692-L747 VanDerWaalsContact CA-O 3.3Å; G692-L747 WeakPolarHBondContact CA-O 3.3Å; G692-L752 WeakPolarHBondContact O-CD2 3.04Å
693	G	92.8	Very high	96.9	Very high	6 Å²	6	10.9 Å²	10.9	6%	0.062	6%	0.064	C	C	.	.	S	Bend	trans	-66.6	20.7	176.1	0	0	0	0	0	116.1	Y661 G695 A749 A753	Y661-G693 WeakPolarHBondContact CD2-O 3.46Å; G693-G695 PolarHBondContact O-N 3.45Å; G693-A749 VanDerWaalsContact CA-CB 3.41Å; G693-A753 WeakPolarHBondContact O-CB 3.2Å; G693-A753 PolarHBondContact O-N 3.47Å
694	G	95.6	Very high	97	Very high	3 Å²	3	7.7 Å²	7.7	3%	0.031	5%	0.049	C	C	.	.	S	Bend	trans	72.7	-10	173.2	0	0	0	0	0	117.1	G692 L696 L697 A698 A756	G692-G694 PolarHBondContact O-N 2.95Å; G694-L696 VanDerWaalsContact C-N 3.34Å; G694-L696 PolarHBondContact O-N 2.87Å; G694-L697 WeakPolarHBondContact O-CA 3.39Å; G694-L697 WeakPolarHBondContact O-CB 3.41Å; G694-L697 PolarHBondContact O-N 2.89Å; G694-A698 PolarHBondContact O-N 2.87Å; G694-A756 WeakPolarHBondContact O-CB 3.5Å
695	G	96.4	Very high	96.9	Very high	3 Å²	3	12.5 Å²	12.5	3%	0.031	7%	0.067	C	C	.	.	H	α-helix	trans	-55.4	-41.6	-175.5	0	0	0	0	0	114.9	Y661 Y670 G693 A698 G699	Y661-G695 WeakPolarHBondContact O-CA 3.14Å; Y670-G695 WeakPolarHBondContact CD2-O 3.23Å; G693-G695 PolarHBondContact O-N 3.45Å; G695-A698 PolarHBondContact O-N 3.36Å; G695-G699 PolarHBondContact O-N 3.09Å
696	L	97.7	Very high	96.8	Very high	14 Å²	14	14.7 Å²	14.7	7%	0.073	8%	0.079	C	C	.	.	H	α-helix	trans	-64.9	-43.4	175	178.1	58.2	0	0	0	111.9	F557 Y670 I673 V689 G694 A698 G699 V700 V824	F557-L696 HydrophobicContact CD1-CD2 4.22Å; F557-L696 HydrophobicContact CD2-CB 4.37Å; F557-L696 HydrophobicContact CD2-CD1 3.9Å; F557-L696 HydrophobicContact CD2-CD2 4.18Å; F557-L696 HydrophobicContact CD2-CG 4.38Å; F557-L696 HydrophobicContact CE1-CD2 4.02Å; F557-L696 HydrophobicContact CE2-CB 3.76Å; F557-L696 HydrophobicContact CE2-CD1 4.17Å; F557-L696 HydrophobicContact CE2-CD2 4.01Å; F557-L696 HydrophobicContact CE2-CG 4.19Å; F557-L696 HydrophobicContact CG-CD1 4.41Å; F557-L696 HydrophobicContact CG-CD2 4.29Å; F557-L696 HydrophobicContact CZ-CB 4.09Å; F557-L696 HydrophobicContact CZ-CD2 3.91Å; Y670-L696 HydrophobicContact CG-CD1 4.35Å; I673-L696 HydrophobicContact CD1-CD1 3.57Å; V689-L696 HydrophobicContact CG1-CB 4.49Å; V689-L696 HydrophobicContact CG1-CD2 3.8Å; V689-L696 HydrophobicContact CG1-CG 3.86Å; G694-L696 VanDerWaalsContact C-N 3.34Å; G694-L696 PolarHBondContact O-N 2.87Å; L696-A698 VanDerWaalsContact C-N 3.34Å; L696-A698 PolarHBondContact O-N 2.81Å; L696-G699 PolarHBondContact O-N 2.77Å; L696-V700 HydrophobicContact CD1-CG2 4.11Å; L696-V700 HydrophobicContact CG-CG2 4.48Å; L696-V700 WeakPolarHBondContact O-CG2 3.46Å; L696-V700 PolarHBondContact O-N 3.29Å; L696-V824 HydrophobicContact CD2-CG1 4.27Å
697	L	98.2	Very high	96.6	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-59.7	-45.1	176.9	178.1	63.4	0	0	0	111.1	V691 G694 G699 V700 I701 I714 T716 L725 I765	V691-L697 HydrophobicContact CG2-CB 4.41Å; V691-L697 HydrophobicContact CG2-CD2 4.28Å; G694-L697 WeakPolarHBondContact O-CA 3.39Å; G694-L697 WeakPolarHBondContact O-CB 3.41Å; G694-L697 PolarHBondContact O-N 2.89Å; L697-G699 PolarHBondContact O-N 3.05Å; L697-V700 PolarHBondContact O-N 2.8Å; L697-I701 HydrophobicContact CD1-CD1 3.75Å; L697-I701 HydrophobicContact CD1-CG1 4.13Å; L697-I701 HydrophobicContact CG-CD1 3.83Å; L697-I701 VanDerWaalsContact O-CG1 3.28Å; L697-I701 WeakPolarHBondContact O-CG1 3.26Å; L697-I701 PolarHBondContact O-N 3.01Å; L697-I714 HydrophobicContact CD1-CD1 3.94Å; L697-I714 HydrophobicContact CD1-CG2 3.89Å; L697-T716 HydrophobicContact CD1-CG2 3.61Å; L697-T716 HydrophobicContact CD2-CG2 3.85Å; L697-T716 HydrophobicContact CG-CG2 4.33Å; L697-L725 HydrophobicContact CD2-CD2 3.87Å; L697-I765 HydrophobicContact CD1-CD1 4.16Å; L697-I765 HydrophobicContact CD2-CD1 4.18Å
698	A	96.9	Very high	96.5	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.7	-45.1	177.9	0	0	0	0	0	112.3	W667 G694 G695 L696 Q702 R755 A756 L759	W667-A698 HydrophobicContact CB-CB 4.44Å; W667-A698 HydrophobicContact CD2-CB 4.18Å; W667-A698 HydrophobicContact CG-CB 3.9Å; G694-A698 PolarHBondContact O-N 2.87Å; G695-A698 PolarHBondContact O-N 3.36Å; L696-A698 VanDerWaalsContact C-N 3.34Å; L696-A698 PolarHBondContact O-N 2.81Å; A698-Q702 VanDerWaalsContact O-CB 3.3Å; A698-Q702 WeakPolarHBondContact O-CB 3.48Å; A698-Q702 PolarHBondContact O-N 3.25Å; A698-R755 HydrophobicContact CB-CG 4.24Å; A698-A756 HydrophobicContact CB-CB 4.28Å; A698-L759 HydrophobicContact CB-CD1 3.96Å
699	G	97.3	Very high	96.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67.1	-39	176.6	0	0	0	0	0	113.9	W667 E671 G695 L696 L697 Q702 G703	W667-G699 WeakPolarHBondContact O-CA 3.16Å; E671-G699 WeakPolarHBondContact CA-O 3.36Å; E671-G699 WeakPolarHBondContact CB-O 3.23Å; G695-G699 PolarHBondContact O-N 3.09Å; L696-G699 PolarHBondContact O-N 2.77Å; L697-G699 PolarHBondContact O-N 3.05Å; G699-Q702 PolarHBondContact O-N 3.14Å; G699-G703 PolarHBondContact O-N 3.36Å
700	V	98.1	Very high	96.2	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-64.6	-46.2	175.7	170.2	0	0	0	0	111	V674 I687 V689 L696 L697 Q702 G703 L704 I714	V674-V700 HydrophobicContact CG2-CG1 4.37Å; I687-V700 HydrophobicContact CD1-CG1 4.08Å; I687-V700 HydrophobicContact CG2-CG1 4.36Å; V689-V700 HydrophobicContact CG2-CG1 4.5Å; L696-V700 HydrophobicContact CD1-CG2 4.11Å; L696-V700 HydrophobicContact CG-CG2 4.48Å; L696-V700 WeakPolarHBondContact O-CG2 3.46Å; L696-V700 PolarHBondContact O-N 3.29Å; L697-V700 PolarHBondContact O-N 2.8Å; V700-Q702 VanDerWaalsContact C-N 3.35Å; V700-Q702 PolarHBondContact O-N 3.3Å; V700-G703 PolarHBondContact O-N 3.33Å; V700-L704 HydrophobicContact CG1-CD1 4.21Å; V700-L704 WeakPolarHBondContact O-CG 3.36Å; V700-L704 PolarHBondContact O-N 3.36Å; V700-I714 HydrophobicContact CG1-CD1 4.02Å
701	I	97.7	Very high	96	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.9	-42.9	177.4	-64.4	171.9	0	0	0	110.7	L697 L704 W705 I714 L759 H763 I765	L697-I701 HydrophobicContact CD1-CD1 3.75Å; L697-I701 HydrophobicContact CD1-CG1 4.13Å; L697-I701 HydrophobicContact CG-CD1 3.83Å; L697-I701 VanDerWaalsContact O-CG1 3.28Å; L697-I701 WeakPolarHBondContact O-CG1 3.26Å; L697-I701 PolarHBondContact O-N 3.01Å; I701-L704 PolarHBondContact O-N 2.96Å; I701-W705 HydrophobicContact CG2-CD2 4.18Å; I701-W705 HydrophobicContact CG2-CG 4.45Å; I701-W705 HydrophobicContact CG2-CZ2 3.86Å; I701-W705 PolarHBondContact O-N 3.33Å; I701-I714 HydrophobicContact CD1-CD1 4.2Å; I701-I714 HydrophobicContact CG1-CD1 3.45Å; I701-I714 VanDerWaalsContact CG1-CD1 3.45Å; I701-L759 HydrophobicContact CB-CD1 4.27Å; I701-L759 HydrophobicContact CD1-CB 3.83Å; I701-L759 HydrophobicContact CG2-CB 4.31Å; I701-L759 HydrophobicContact CG2-CD1 4.31Å; I701-L759 HydrophobicContact CG2-CD2 3.97Å; I701-L759 HydrophobicContact CG2-CG 4.43Å; I701-H763 HydrophobicContact CD1-CB 4.31Å; I701-H763 HydrophobicContact CG2-CB 4.27Å; I701-I765 HydrophobicContact CD1-CD1 4.13Å
702	Q	94.4	Very high	96	Very high	37 Å²	37	30.1 Å²	30.1	17%	0.173	18%	0.176	C	C	.	.	H	α-helix	trans	-61.3	-45.5	176.3	-174.1	170.9	-53.8	0	0	111.7	E671 A698 G699 V700 L704 W705 N706	E671-Q702 WeakPolarHBondContact OE2-CG 3.43Å; E671-Q702 PolarHBondContact OE2-NE2 3.27Å; A698-Q702 VanDerWaalsContact O-CB 3.3Å; A698-Q702 WeakPolarHBondContact O-CB 3.48Å; A698-Q702 PolarHBondContact O-N 3.25Å; G699-Q702 PolarHBondContact O-N 3.14Å; V700-Q702 VanDerWaalsContact C-N 3.35Å; V700-Q702 PolarHBondContact O-N 3.3Å; Q702-L704 PolarHBondContact O-N 2.96Å; Q702-W705 PolarHBondContact O-N 2.89Å; Q702-N706 WeakPolarHBondContact O-CB 3.37Å; Q702-N706 PolarHBondContact O-N 3.45Å; Q702-N706 PolarHBondContact O-ND2 3.26Å; Q702-N706 PolarHBondContact O-OD1 3.37Å
703	G	96.5	Very high	96.1	Very high	2 Å²	2	30.3 Å²	30.3	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-41.6	175.5	0	0	0	0	0	112.9	G699 V700 N706 K707	G699-G703 PolarHBondContact O-N 3.36Å; V700-G703 PolarHBondContact O-N 3.33Å; G703-N706 PolarHBondContact O-N 3.3Å; G703-K707 WeakPolarHBondContact O-CG 3.38Å; G703-K707 PolarHBondContact O-N 3.17Å; G703-K707 VanDerWaalsContact O-N 3.13Å
704	L	97.5	Very high	96.4	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61.1	-45.5	174	-73.6	171.7	0	0	0	111.5	V674 I687 V700 I701 Q702 N706 K707 G708 W709 T712 I714	V674-L704 HydrophobicContact CG1-CD2 4.09Å; V674-L704 HydrophobicContact CG1-CG 4.42Å; I687-L704 HydrophobicContact CD1-CD1 4.26Å; I687-L704 HydrophobicContact CD1-CD2 4.01Å; I687-L704 HydrophobicContact CD1-CG 4.41Å; V700-L704 HydrophobicContact CG1-CD1 4.21Å; V700-L704 WeakPolarHBondContact O-CG 3.36Å; V700-L704 PolarHBondContact O-N 3.36Å; I701-L704 PolarHBondContact O-N 2.96Å; Q702-L704 PolarHBondContact O-N 2.96Å; L704-N706 PolarHBondContact O-N 3.32Å; L704-K707 PolarHBondContact O-N 3.47Å; L704-K707 VanDerWaalsContact O-N 3.17Å; L704-G708 PolarHBondContact O-N 2.92Å; L704-W709 HydrophobicContact CB-CB 4.43Å; L704-W709 HydrophobicContact CD2-CB 3.81Å; L704-W709 HydrophobicContact CD2-CE3 4.1Å; L704-W709 PolarHBondContact O-N 2.8Å; L704-T712 HydrophobicContact CD1-CG2 3.95Å; L704-T712 HydrophobicContact CD2-CG2 4.01Å; L704-I714 HydrophobicContact CD1-CD1 4.02Å; L704-I714 HydrophobicContact CD1-CG1 4.32Å
705	W	95.5	Very high	96.5	Very high	101 Å²	101	29.9 Å²	29.9	38%	0.383	17%	0.169	S	C	.	.	H	α-helix	trans	-65.1	-40.1	178.8	-67.8	10.9	0	0	0	111.7	I701 Q702 K707 G708 L759 H763	I701-W705 HydrophobicContact CG2-CD2 4.18Å; I701-W705 HydrophobicContact CG2-CG 4.45Å; I701-W705 HydrophobicContact CG2-CZ2 3.86Å; I701-W705 PolarHBondContact O-N 3.33Å; Q702-W705 PolarHBondContact O-N 2.89Å; W705-K707 PolarHBondContact O-N 3.38Å; W705-G708 PolarHBondContact O-N 3.45Å; W705-L759 HydrophobicContact CE3-CD2 4.49Å; W705-L759 HydrophobicContact CH2-CD2 3.44Å; W705-L759 VanDerWaalsContact CH2-CD2 3.44Å; W705-L759 HydrophobicContact CZ2-CD2 3.93Å; W705-L759 HydrophobicContact CZ3-CD2 3.77Å; W705-H763 HydrophobicContact CZ2-CB 4.49Å; W705-H763 AromaticContact NE1-ND1 3.66Å
706	N	94.9	Very high	96.6	Very high	103 Å²	103	29.8 Å²	29.8	55%	0.551	17%	0.168	S	C	*	.	H	α-helix	trans	-62.1	-27.7	174.3	-66	-12.4	0	0	0	113	E671 Q702 G703 L704	E671-N706 PolarHBondContact OE2-ND2 3.45Å; Q702-N706 WeakPolarHBondContact O-CB 3.37Å; Q702-N706 PolarHBondContact O-N 3.45Å; Q702-N706 PolarHBondContact O-ND2 3.26Å; Q702-N706 PolarHBondContact O-OD1 3.37Å; G703-N706 PolarHBondContact O-N 3.3Å; L704-N706 PolarHBondContact O-N 3.32Å
707	K	94.9	Very high	96.6	Very high	82 Å²	82	29.1 Å²	29.1	36%	0.357	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-9.4	173.2	-65.4	-66.2	176.5	-165.3	0	114.2	V674 D675 G703 L704 W705 W709	V674-K707 HydrophobicContact CG1-CG 4.06Å; D675-K707 WeakPolarHBondContact OD1-CE 3.37Å; D675-K707 IonicContact OD1-NZ 3.63Å; D675-K707 PolarHBondContact OD1-NZ 3.38Å; G703-K707 WeakPolarHBondContact O-CG 3.38Å; G703-K707 PolarHBondContact O-N 3.17Å; G703-K707 VanDerWaalsContact O-N 3.13Å; L704-K707 PolarHBondContact O-N 3.47Å; L704-K707 VanDerWaalsContact O-N 3.17Å; W705-K707 PolarHBondContact O-N 3.38Å; K707-W709 VanDerWaalsContact C-N 3.25Å; K707-W709 HydrophobicContact CB-CB 4.2Å; K707-W709 HydrophobicContact CB-CD2 3.6Å; K707-W709 HydrophobicContact CB-CE3 4.02Å; K707-W709 HydrophobicContact CB-CG 3.68Å; K707-W709 HydrophobicContact CG-CD2 4.18Å; K707-W709 HydrophobicContact CG-CE3 4.13Å; K707-W709 HydrophobicContact CG-CZ3 4.39Å
708	G	95.2	Very high	96.6	Very high	54 Å²	54	29 Å²	29	56%	0.557	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.2	10.8	-167.4	0	0	0	0	0	114.1	L704 W705 S710	L704-G708 PolarHBondContact O-N 2.92Å; W705-G708 PolarHBondContact O-N 3.45Å; G708-S710 PolarHBondContact O-N 2.86Å
709	W	96.6	Very high	96.7	Very high	52 Å²	52	29 Å²	29	20%	0.197	16%	0.164	C	C	.	.			trans	-88.4	38.3	-177.1	-63.8	-9.3	0	0	0	112.5	V674 I677 G682 Q683 L704 K707 S711 T712	V674-W709 HydrophobicContact CG1-CE3 4.17Å; V674-W709 HydrophobicContact CG1-CZ3 4.26Å; I677-W709 HydrophobicContact CB-CH2 4.46Å; I677-W709 HydrophobicContact CB-CZ3 4.18Å; I677-W709 HydrophobicContact CD1-CZ3 4.08Å; I677-W709 HydrophobicContact CG2-CH2 4.18Å; I677-W709 HydrophobicContact CG2-CZ3 4.06Å; G682-W709 VanDerWaalsContact O-CH2 3.25Å; G682-W709 WeakPolarHBondContact O-CH2 3.5Å; Q683-W709 HydrophobicContact CB-CD2 3.85Å; Q683-W709 HydrophobicContact CB-CE3 4.45Å; Q683-W709 HydrophobicContact CB-CG 3.92Å; Q683-W709 HydrophobicContact CB-CZ2 4.4Å; Q683-W709 HydrophobicContact CG-CB 3.81Å; Q683-W709 HydrophobicContact CG-CD2 3.89Å; Q683-W709 HydrophobicContact CG-CE3 4.42Å; Q683-W709 HydrophobicContact CG-CG 3.6Å; Q683-W709 PolarHBondContact NE2-O 3.35Å; L704-W709 HydrophobicContact CB-CB 4.43Å; L704-W709 HydrophobicContact CD2-CB 3.81Å; L704-W709 HydrophobicContact CD2-CE3 4.1Å; L704-W709 PolarHBondContact O-N 2.8Å; K707-W709 VanDerWaalsContact C-N 3.25Å; K707-W709 HydrophobicContact CB-CB 4.2Å; K707-W709 HydrophobicContact CB-CD2 3.6Å; K707-W709 HydrophobicContact CB-CE3 4.02Å; K707-W709 HydrophobicContact CB-CG 3.68Å; K707-W709 HydrophobicContact CG-CD2 4.18Å; K707-W709 HydrophobicContact CG-CE3 4.13Å; K707-W709 HydrophobicContact CG-CZ3 4.39Å; W709-S711 PolarHBondContact O-N 2.88Å; W709-T712 WeakPolarHBondContact O-CB 3.46Å; W709-T712 PolarHBondContact O-N 3.47Å; W709-T712 PolarHBondContact O-OG1 3.33Å
710	S	93.8	Very high	96.6	Very high	69 Å²	69	33.9 Å²	33.9	48%	0.483	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.6	-175.4	55.5	0	0	0	0	114.5	G708 H763	G708-S710 PolarHBondContact O-N 2.86Å; S710-H763 PolarHBondContact O-CE1 3.36Å; S710-H763 VanDerWaalsContact O-CE1 3.26Å; S710-H763 PolarHBondContact O-ND1 3.28Å
711	S	95.1	Very high	96.3	Very high	90 Å²	90	34.2 Å²	34.2	63%	0.629	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.1	175.3	50.4	0	0	0	0	114.7	Q683 W709 H713	Q683-S711 PolarHBondContact NE2-OG 3.03Å; W709-S711 PolarHBondContact O-N 2.88Å; S711-H713 PolarHBondContact O-N 3.38Å
712	T	96.9	Very high	96.2	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	19%	0.191	C	C	.	.			trans	-60.9	132.9	173.5	-69.8	0	0	0	0	110.1	Q683 P684 I687 L704 W709 H763	Q683-T712 VanDerWaalsContact CG-OG1 3.24Å; Q683-T712 WeakPolarHBondContact CG-OG1 3.4Å; Q683-T712 PolarHBondContact NE2-OG1 2.95Å; P684-T712 HydrophobicContact CG-CG2 4.22Å; P684-T712 WeakPolarHBondContact O-CB 3.22Å; P684-T712 VanDerWaalsContact O-CG2 3.3Å; P684-T712 WeakPolarHBondContact O-CG2 3.39Å; P684-T712 PolarHBondContact O-OG1 3.13Å; I687-T712 HydrophobicContact CD1-CG2 4.27Å; I687-T712 HydrophobicContact CG1-CG2 3.92Å; L704-T712 HydrophobicContact CD1-CG2 3.95Å; L704-T712 HydrophobicContact CD2-CG2 4.01Å; W709-T712 WeakPolarHBondContact O-CB 3.46Å; W709-T712 PolarHBondContact O-N 3.47Å; W709-T712 PolarHBondContact O-OG1 3.33Å; T712-H763 PolarHBondContact O-CE1 2.76Å; T712-H763 PolarHBondContact O-NE2 3.24Å
713	H	97.3	Very high	96.2	Very high	16 Å²	16	33.4 Å²	33.4	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	150.1	175.7	-170.4	62.9	0	0	0	111.1	D685 A686 I687 S711 S764 I765 S766	D685-H713 PolarHBondContact O-N 2.91Å; A686-H713 CarbonylContact C-O 3.56Å; A686-H713 WeakPolarHBondContact CA-O 3.42Å; A686-H713 HydrophobicContact CB-CB 4.06Å; I687-H713 PolarHBondContact N-O 3.33Å; S711-H713 PolarHBondContact O-N 3.38Å; H713-S764 PolarHBondContact ND1-O 3.29Å; H713-S764 PolarHBondContact ND1-OG 3.27Å; H713-I765 VanDerWaalsContact CE1-C 3.43Å; H713-S766 PolarHBondContact CE1-N 3.11Å; H713-S766 PolarHBondContact CE1-OG 3.1Å; H713-S766 VanDerWaalsContact CE1-OG 3.29Å; H713-S766 WeakPolarHBondContact NE2-CB 3.41Å; H713-S766 PolarHBondContact NE2-N 3.14Å; H713-S766 PolarHBondContact NE2-OG 3.09Å
714	I	98	Very high	96.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124.7	171	-54.8	-175.1	0	0	0	110.5	I687 V689 L697 V700 I701 L704 T716 S764 I765 S766	I687-I714 CarbonylContact O-C 3.52Å; I687-I714 VanDerWaalsContact O-CA 3.32Å; I687-I714 WeakPolarHBondContact O-CA 3.28Å; I687-I714 WeakPolarHBondContact O-CG2 3.43Å; V689-I714 HydrophobicContact CB-CG2 4.36Å; V689-I714 HydrophobicContact CG2-CG2 3.99Å; L697-I714 HydrophobicContact CD1-CD1 3.94Å; L697-I714 HydrophobicContact CD1-CG2 3.89Å; V700-I714 HydrophobicContact CG1-CD1 4.02Å; I701-I714 HydrophobicContact CD1-CD1 4.2Å; I701-I714 HydrophobicContact CG1-CD1 3.45Å; I701-I714 VanDerWaalsContact CG1-CD1 3.45Å; L704-I714 HydrophobicContact CD1-CD1 4.02Å; L704-I714 HydrophobicContact CD1-CG1 4.32Å; I714-T716 HydrophobicContact CG2-CG2 3.81Å; I714-S764 PolarHBondContact N-O 3.47Å; I714-I765 HydrophobicContact CB-CG1 4.34Å; I714-I765 CarbonylContact O-C 3.53Å; I714-I765 VanDerWaalsContact O-CA 3.27Å; I714-I765 WeakPolarHBondContact O-CA 3.26Å; I714-S766 PolarHBondContact O-N 3.32Å
715	V	98.2	Very high	96.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	103.8	168	-176.3	0	0	0	0	107.4	I687 V688 V689 V717 S766 V768 T800 Y805 L806 L809	I687-V715 PolarHBondContact O-N 3.48Å; V688-V715 WeakPolarHBondContact CA-O 3.49Å; V688-V715 HydrophobicContact CG2-CB 4.29Å; V689-V715 PolarHBondContact N-O 3.27Å; V715-V717 HydrophobicContact CG1-CG2 4.37Å; V715-S766 CarbonylContact C-O 3.59Å; V715-S766 WeakPolarHBondContact CA-O 3.29Å; V715-V768 HydrophobicContact CG1-CG2 3.75Å; V715-T800 HydrophobicContact CG1-CG2 4.21Å; V715-Y805 HydrophobicContact CG1-CD1 4.34Å; V715-Y805 HydrophobicContact CG1-CE1 4.01Å; V715-L806 HydrophobicContact CG2-CD2 4.05Å; V715-L809 HydrophobicContact CG2-CD1 3.87Å
716	T	98.2	Very high	96.1	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	134.2	176.6	49.4	0	0	0	0	110.2	V689 V691 L697 I714 L725 I765 S766 A767 V768	V689-T716 WeakPolarHBondContact O-CA 3.33Å; V691-T716 HydrophobicContact CG2-CG2 3.67Å; L697-T716 HydrophobicContact CD1-CG2 3.61Å; L697-T716 HydrophobicContact CD2-CG2 3.85Å; L697-T716 HydrophobicContact CG-CG2 4.33Å; I714-T716 HydrophobicContact CG2-CG2 3.81Å; T716-L725 HydrophobicContact CG2-CD2 3.88Å; T716-L725 WeakPolarHBondContact OG1-CD2 3.26Å; T716-I765 HydrophobicContact CG2-CD1 4.42Å; T716-I765 HydrophobicContact CG2-CG2 3.92Å; T716-I765 VanDerWaalsContact OG1-CG2 3.26Å; T716-I765 WeakPolarHBondContact OG1-CG2 3.35Å; T716-S766 PolarHBondContact N-O 3.14Å; T716-S766 PolarHBondContact OG1-O 3.3Å; T716-A767 VanDerWaalsContact OG1-CA 3.32Å; T716-A767 WeakPolarHBondContact OG1-CA 3.08Å; T716-V768 PolarHBondContact O-N 2.99Å
717	V	98.3	Very high	96.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.3	-175.3	-155.2	0	0	0	0	111.3	V688 V689 A690 V691 V715 V768 A796 T800	V688-V717 HydrophobicContact CG1-CG2 3.87Å; V689-V717 PolarHBondContact O-N 3.36Å; A690-V717 CarbonylContact C-O 3.58Å; A690-V717 WeakPolarHBondContact CA-O 3.41Å; V691-V717 PolarHBondContact N-O 3.22Å; V715-V717 HydrophobicContact CG1-CG2 4.37Å; V717-V768 WeakPolarHBondContact CA-O 3.29Å; V717-V768 HydrophobicContact CG1-CB 4.36Å; V717-A796 HydrophobicContact CG1-CB 4.37Å; V717-A796 WeakPolarHBondContact CG1-O 3.34Å; V717-T800 HydrophobicContact CB-CG2 4.45Å; V717-T800 HydrophobicContact CG1-CG2 4.18Å; V717-T800 HydrophobicContact CG2-CG2 3.4Å; V717-T800 VanDerWaalsContact CG2-CG2 3.4Å
718	E	98.2	Very high	96.2	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	158.2	176.8	-57.9	179.8	123.8	0	0	109.3	V691 D723 C724 L725 N726 V768 T769 C770	V691-E718 HydrophobicContact CB-CG 3.93Å; V691-E718 HydrophobicContact CG1-CG 4.39Å; E718-D723 HydrophobicContact CB-CB 4.21Å; E718-D723 VanDerWaalsContact OE2-CA 3.29Å; E718-D723 WeakPolarHBondContact OE2-CA 3.41Å; E718-C724 PolarHBondContact OE1-N 3.22Å; E718-C724 PolarHBondContact OE2-N 2.84Å; E718-L725 VanDerWaalsContact OE1-CB 3.28Å; E718-L725 WeakPolarHBondContact OE1-CB 3.28Å; E718-L725 PolarHBondContact OE1-N 3.1Å; E718-L725 PolarHBondContact OE2-N 3.32Å; E718-L725 VanDerWaalsContact OE2-N 3.15Å; E718-N726 WeakPolarHBondContact OE2-CB 3.41Å; E718-N726 PolarHBondContact OE2-N 3.22Å; E718-V768 PolarHBondContact N-O 2.75Å; E718-T769 CarbonylContact O-C 3.54Å; E718-T769 WeakPolarHBondContact O-CA 3.3Å; E718-C770 PolarHBondContact O-N 3.2Å
719	T	97.7	Very high	96.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	149.2	167.2	46.4	0	0	0	0	110.9	G721 A722 D723 T742 A744 L747 C770 D772 A775 A796	T719-G721 PolarHBondContact O-N 3.27Å; T719-A722 CarbonylContact O-C 3.47Å; T719-A722 PolarHBondContact O-N 2.66Å; T719-D723 PolarHBondContact O-N 3.09Å; T719-T742 WeakPolarHBondContact CB-OG1 3.33Å; T719-T742 VanDerWaalsContact OG1-CB 3.3Å; T719-T742 WeakPolarHBondContact OG1-CB 3.48Å; T719-T742 WeakPolarHBondContact OG1-CG2 3.37Å; T719-T742 PolarHBondContact OG1-OG1 2.93Å; T719-A744 HydrophobicContact CG2-CB 3.94Å; T719-L747 HydrophobicContact CG2-CD1 4.02Å; T719-C770 CarbonylContact C-O 3.48Å; T719-C770 VanDerWaalsContact CA-O 3.29Å; T719-C770 WeakPolarHBondContact CA-O 3.39Å; T719-D772 WeakPolarHBondContact CB-OD1 3.37Å; T719-A775 HydrophobicContact CG2-CB 4.06Å; T719-A796 HydrophobicContact CG2-CB 4.12Å
720	E	96.1	Very high	96.1	Very high	102 Å²	102	30.9 Å²	30.9	48%	0.477	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	125	174	-68.3	-179.2	171.9	0	0	110.9	C770	E720-C770 PolarHBondContact N-O 2.8Å
721	G	92.5	Very high	96.1	Very high	8 Å²	8	31 Å²	31	8%	0.082	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.7	-2.7	-172	0	0	0	0	0	114.9	T719 D723 S740 S741	T719-G721 PolarHBondContact O-N 3.27Å; G721-D723 PolarHBondContact N-OD1 3.17Å; G721-S740 WeakPolarHBondContact O-CA 3.42Å; G721-S740 VanDerWaalsContact O-CB 3.26Å; G721-S740 WeakPolarHBondContact O-CB 3.42Å; G721-S741 WeakPolarHBondContact CA-OG 3.5Å
722	A	94.3	Very high	96	Very high	2 Å²	2	29.1 Å²	29.1	2%	0.017	16%	0.155	C	C	.	.			trans	-129.6	18.5	162.1	0	0	0	0	0	112.2	T719 C724 T742 L747	T719-A722 CarbonylContact O-C 3.47Å; T719-A722 PolarHBondContact O-N 2.66Å; A722-C724 PolarHBondContact O-N 3.35Å; A722-T742 HydrophobicContact CB-CG2 3.54Å; A722-L747 HydrophobicContact CB-CB 4.03Å
723	D	95.6	Very high	95.8	Very high	17 Å²	17	36.1 Å²	36.1	9%	0.091	19%	0.188	C	C	.	.			trans	-76.5	53	-173.1	56.1	-62.2	0	0	0	114	E718 T719 G721 N726 R727 T769	E718-D723 HydrophobicContact CB-CB 4.21Å; E718-D723 VanDerWaalsContact OE2-CA 3.29Å; E718-D723 WeakPolarHBondContact OE2-CA 3.41Å; T719-D723 PolarHBondContact O-N 3.09Å; G721-D723 PolarHBondContact N-OD1 3.17Å; D723-N726 HydrophobicContact CB-CB 4.08Å; D723-R727 WeakPolarHBondContact O-CB 3.37Å; D723-R727 VanDerWaalsContact O-CG 3.26Å; D723-R727 WeakPolarHBondContact O-CG 3.34Å; D723-R727 PolarHBondContact O-N 3.28Å; D723-R727 IonicContact OD1-CZ 3.42Å; D723-R727 IonicContact OD1-NE 3.24Å; D723-R727 PolarHBondContact OD1-NE 2.92Å; D723-R727 IonicContact OD1-NH2 3.51Å; D723-R727 PolarHBondContact OD1-NH2 3.16Å; D723-R727 WeakPolarHBondContact OD2-CG 3.14Å; D723-R727 IonicContact OD2-CZ 3.47Å; D723-R727 IonicContact OD2-NE 2.8Å; D723-R727 PolarHBondContact OD2-NE 3.29Å; D723-R727 IonicContact OD2-NH2 2.72Å; D723-R727 PolarHBondContact OD2-NH2 3.39Å; D723-T769 HydrophobicContact CB-CG2 3.5Å
724	C	94.1	Very high	95.4	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	20%	0.199	C	C	.	.	H	α-helix	trans	-66.7	-44.8	-172.7	-173.6	0	0	0	0	112.7	E718 A722 S728 A735 I737 L752	E718-C724 PolarHBondContact OE1-N 3.22Å; E718-C724 PolarHBondContact OE2-N 2.84Å; A722-C724 PolarHBondContact O-N 3.35Å; C724-S728 VanDerWaalsContact O-CB 3.31Å; C724-S728 WeakPolarHBondContact O-CB 3.43Å; C724-S728 PolarHBondContact O-N 3.48Å; C724-S728 PolarHBondContact O-OG 2.92Å; C724-A735 PolarHBondContact SG-O 2.86Å; C724-A735 VanDerWaalsContact SG-O 3.4Å; C724-I737 HydrophobicContact CB-CD1 4.06Å; C724-L752 HydrophobicContact CB-CD2 4.44Å
725	L	96.7	Very high	95.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.4	-42.2	175.6	178.4	63.2	0	0	0	111.4	V691 L697 T716 E718 S728 L729 L752 A760	V691-L725 HydrophobicContact CG1-CB 4.12Å; V691-L725 HydrophobicContact CG1-CD2 4.15Å; V691-L725 HydrophobicContact CG2-CD2 4.24Å; L697-L725 HydrophobicContact CD2-CD2 3.87Å; T716-L725 HydrophobicContact CG2-CD2 3.88Å; T716-L725 WeakPolarHBondContact OG1-CD2 3.26Å; E718-L725 VanDerWaalsContact OE1-CB 3.28Å; E718-L725 WeakPolarHBondContact OE1-CB 3.28Å; E718-L725 PolarHBondContact OE1-N 3.1Å; E718-L725 PolarHBondContact OE2-N 3.32Å; E718-L725 VanDerWaalsContact OE2-N 3.15Å; L725-S728 PolarHBondContact O-N 2.89Å; L725-L729 HydrophobicContact CD1-CD1 3.8Å; L725-L729 HydrophobicContact CD1-CG 3.95Å; L725-L729 HydrophobicContact CG-CD1 3.87Å; L725-L729 HydrophobicContact CG-CG 4.4Å; L725-L729 WeakPolarHBondContact O-CB 3.43Å; L725-L729 WeakPolarHBondContact O-CG 3.32Å; L725-L729 PolarHBondContact O-N 2.95Å; L725-L752 HydrophobicContact CB-CD1 4.01Å; L725-L752 HydrophobicContact CB-CD2 4.23Å; L725-L752 HydrophobicContact CD1-CD1 3.67Å; L725-L752 HydrophobicContact CG-CD1 4.44Å; L725-A760 HydrophobicContact CD1-CB 3.73Å
726	N	96.4	Very high	94.6	Very high	8 Å²	8	43.6 Å²	43.6	4%	0.043	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-47.1	179.6	-155.3	-83.2	0	0	0	111.2	E718 D723 K730 A767 V768 T769	E718-N726 WeakPolarHBondContact OE2-CB 3.41Å; E718-N726 PolarHBondContact OE2-N 3.22Å; D723-N726 HydrophobicContact CB-CB 4.08Å; N726-K730 WeakPolarHBondContact O-CB 3.26Å; N726-K730 WeakPolarHBondContact O-CG 3.43Å; N726-K730 PolarHBondContact O-N 2.94Å; N726-K730 WeakPolarHBondContact OD1-CD 3.3Å; N726-K730 WeakPolarHBondContact OD1-CE 3.41Å; N726-K730 PolarHBondContact OD1-NZ 2.86Å; N726-A767 PolarHBondContact ND2-O 3.18Å; N726-A767 VanDerWaalsContact ND2-O 3.09Å; N726-V768 PolarHBondContact ND2-N 3.17Å; N726-T769 HydrophobicContact CB-CG2 3.89Å
727	R	95.1	Very high	94	Very high	107 Å²	107	44.1 Å²	44.1	40%	0.404	24%	0.237	S	C	.	.	H	α-helix	trans	-62.4	-43.9	173.5	-70.2	176.6	-160.3	-161.9	7.5	112	D723 L729 K730 S731 A735	D723-R727 WeakPolarHBondContact O-CB 3.37Å; D723-R727 VanDerWaalsContact O-CG 3.26Å; D723-R727 WeakPolarHBondContact O-CG 3.34Å; D723-R727 PolarHBondContact O-N 3.28Å; D723-R727 IonicContact OD1-CZ 3.42Å; D723-R727 IonicContact OD1-NE 3.24Å; D723-R727 PolarHBondContact OD1-NE 2.92Å; D723-R727 IonicContact OD1-NH2 3.51Å; D723-R727 PolarHBondContact OD1-NH2 3.16Å; D723-R727 WeakPolarHBondContact OD2-CG 3.14Å; D723-R727 IonicContact OD2-CZ 3.47Å; D723-R727 IonicContact OD2-NE 2.8Å; D723-R727 PolarHBondContact OD2-NE 3.29Å; D723-R727 IonicContact OD2-NH2 2.72Å; D723-R727 PolarHBondContact OD2-NH2 3.39Å; R727-L729 PolarHBondContact O-N 2.87Å; R727-K730 PolarHBondContact O-N 3.24Å; R727-S731 WeakPolarHBondContact O-CB 3.4Å; R727-S731 PolarHBondContact O-N 2.82Å; R727-S731 PolarHBondContact O-OG 2.91Å; R727-S731 VanDerWaalsContact O-OG 3.06Å; R727-A735 HydrophobicContact CB-CB 3.85Å
728	S	95.8	Very high	92.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-41.4	-178.4	-57.6	0	0	0	0	112.5	C724 L725 S731 G732 Q733 A735 W757	C724-S728 VanDerWaalsContact O-CB 3.31Å; C724-S728 WeakPolarHBondContact O-CB 3.43Å; C724-S728 PolarHBondContact O-N 3.48Å; C724-S728 PolarHBondContact O-OG 2.92Å; L725-S728 PolarHBondContact O-N 2.89Å; S728-S731 PolarHBondContact O-OG 2.77Å; S728-G732 WeakPolarHBondContact O-CA 3.49Å; S728-G732 PolarHBondContact O-N 2.56Å; S728-Q733 VanDerWaalsContact CA-O 3.28Å; S728-Q733 WeakPolarHBondContact CA-O 3.34Å; S728-Q733 PolarHBondContact O-N 2.97Å; S728-A735 WeakPolarHBondContact OG-CB 3.41Å; S728-A735 PolarHBondContact OG-N 3.02Å; S728-W757 VanDerWaalsContact CB-CZ3 3.46Å; S728-W757 WeakPolarHBondContact O-CH2 3.36Å
729	L	95.4	Very high	92	Very high	64 Å²	64	58 Å²	58	34%	0.335	30%	0.3	S	S	.	.	H	α-helix	trans	-69.4	-38.3	176.4	-70.2	170.1	0	0	0	111.8	L725 R727 W757 A760 A767	L725-L729 HydrophobicContact CD1-CD1 3.8Å; L725-L729 HydrophobicContact CD1-CG 3.95Å; L725-L729 HydrophobicContact CG-CD1 3.87Å; L725-L729 HydrophobicContact CG-CG 4.4Å; L725-L729 WeakPolarHBondContact O-CB 3.43Å; L725-L729 WeakPolarHBondContact O-CG 3.32Å; L725-L729 PolarHBondContact O-N 2.95Å; R727-L729 PolarHBondContact O-N 2.87Å; L729-W757 HydrophobicContact CD2-CH2 4.5Å; L729-W757 HydrophobicContact CD2-CZ3 3.82Å; L729-W757 HydrophobicContact CG-CZ3 4.15Å; L729-A760 HydrophobicContact CD2-CB 4.49Å; L729-A767 HydrophobicContact CD1-CB 3.67Å
730	K	94.3	Very high	91.3	Very high	162 Å²	162	60.2 Å²	60.2	70%	0.704	32%	0.316	S	S	*	.	H	α-helix	trans	-67.1	-35.7	175.9	-78.8	171.1	171.6	163.7	0	113.6	N726 R727	N726-K730 WeakPolarHBondContact O-CB 3.26Å; N726-K730 WeakPolarHBondContact O-CG 3.43Å; N726-K730 PolarHBondContact O-N 2.94Å; N726-K730 WeakPolarHBondContact OD1-CD 3.3Å; N726-K730 WeakPolarHBondContact OD1-CE 3.41Å; N726-K730 PolarHBondContact OD1-NZ 2.86Å; R727-K730 PolarHBondContact O-N 3.24Å
731	S	94.4	Very high	91	Very high	72 Å²	72	60.2 Å²	60.2	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-86.5	-18	178.5	65.8	0	0	0	0	113.8	R727 S728 Q733	R727-S731 WeakPolarHBondContact O-CB 3.4Å; R727-S731 PolarHBondContact O-N 2.82Å; R727-S731 PolarHBondContact O-OG 2.91Å; R727-S731 VanDerWaalsContact O-OG 3.06Å; S728-S731 PolarHBondContact O-OG 2.77Å; S731-Q733 PolarHBondContact O-N 2.99Å; S731-Q733 PolarHBondContact OG-N 2.95Å; S731-Q733 VanDerWaalsContact OG-N 3.08Å; S731-Q733 PolarHBondContact OG-O 2.78Å
732	G	93.5	Very high	90.9	Very high	49 Å²	49	60.4 Å²	60.4	51%	0.505	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	8.5	-168.5	0	0	0	0	0	114.3	S728	S728-G732 WeakPolarHBondContact O-CA 3.49Å; S728-G732 PolarHBondContact O-N 2.56Å
733	Q	92	Very high	90.8	Very high	148 Å²	148	61.6 Å²	61.6	69%	0.692	33%	0.333	S	S	*	.	S	Bend	trans	-138.1	143.2	-175.8	-60.4	-173.8	11	0	0	110.7	S728 S731 A735	S728-Q733 VanDerWaalsContact CA-O 3.28Å; S728-Q733 WeakPolarHBondContact CA-O 3.34Å; S728-Q733 PolarHBondContact O-N 2.97Å; S731-Q733 PolarHBondContact O-N 2.99Å; S731-Q733 PolarHBondContact OG-N 2.95Å; S731-Q733 VanDerWaalsContact OG-N 3.08Å; S731-Q733 PolarHBondContact OG-O 2.78Å; Q733-A735 PolarHBondContact O-N 3.15Å
734	L	89.7	Confident	90.6	Very high	58 Å²	58	60.8 Å²	60.8	30%	0.304	33%	0.329	S	S	.	.			trans	-59	110.2	-179.6	-179.6	57.8	0	0	0	111.3	V751 L752 W757	L734-V751 HydrophobicContact CD1-CG2 3.84Å; L734-V751 HydrophobicContact CD2-CG2 3.76Å; L734-V751 HydrophobicContact CG-CG2 3.72Å; L734-L752 HydrophobicContact CD1-CB 3.89Å; L734-L752 HydrophobicContact CD1-CD1 4.29Å; L734-L752 HydrophobicContact CD1-CG 4.26Å; L734-W757 HydrophobicContact CD1-CB 4.31Å; L734-W757 HydrophobicContact CD1-CG 4.34Å
735	A	90.1	Very high	90.4	Very high	20 Å²	20	62.3 Å²	62.3	17%	0.165	34%	0.338	C	S	.	.			trans	-82.2	152.9	-178	0	0	0	0	0	111.7	C724 R727 S728 Q733	C724-A735 PolarHBondContact SG-O 2.86Å; C724-A735 VanDerWaalsContact SG-O 3.4Å; R727-A735 HydrophobicContact CB-CB 3.85Å; S728-A735 WeakPolarHBondContact OG-CB 3.41Å; S728-A735 PolarHBondContact OG-N 3.02Å; Q733-A735 PolarHBondContact O-N 3.15Å
736	V	87.5	Confident	90.1	Very high	96 Å²	96	63.6 Å²	63.6	58%	0.582	35%	0.347	S	S	*	.			trans	-119.8	135	174.4	-176.3	0	0	0	0	109.3	P738 P750 V751	V736-P738 HydrophobicContact CG1-CG 4.14Å; V736-P750 CarbonylContact C-O 3.52Å; V736-P750 VanDerWaalsContact CA-O 3.28Å; V736-P750 WeakPolarHBondContact CA-O 3.17Å; V736-P750 WeakPolarHBondContact CG1-O 3.49Å; V736-V751 HydrophobicContact CG2-CG2 4.31Å
737	I	86.8	Confident	90	Very high	12 Å²	12	63.4 Å²	63.4	6%	0.062	35%	0.346	C	S	.	.			trans	-119.8	87.3	175.1	-56.3	-179	0	0	0	107.7	C724 R739 P750	C724-I737 HydrophobicContact CB-CD1 4.06Å; I737-R739 WeakPolarHBondContact CG2-O 3.37Å; I737-R739 PolarHBondContact O-N 3.14Å; I737-R739 VanDerWaalsContact O-N 3.16Å; I737-P750 PolarHBondContact N-O 3.32Å; I737-P750 VanDerWaalsContact O-CA 3.31Å; I737-P750 WeakPolarHBondContact O-CA 3.38Å; I737-P750 WeakPolarHBondContact O-CB 3.49Å
738	P	73.6	Confident	89.8	Confident	88 Å²	88	59.6 Å²	59.6	57%	0.571	34%	0.336	S	S	*	.	S	Bend	trans	-63.7	-24.2	-171.7	-24.5	34.8	0	0	0	114.8	V736	V736-P738 HydrophobicContact CG1-CG 4.14Å
739	R	80.4	Confident	89.4	Confident	203 Å²	203	60.2 Å²	60.2	77%	0.766	34%	0.34	S	S	*	.	S	Bend	trans	-141.7	123.9	175.6	-66.2	-178.4	176.2	172.6	-2.9	108.5	I737	I737-R739 WeakPolarHBondContact CG2-O 3.37Å; I737-R739 PolarHBondContact O-N 3.14Å; I737-R739 VanDerWaalsContact O-N 3.16Å
740	S	83.4	Confident	89	Confident	48 Å²	48	57.8 Å²	57.8	34%	0.336	33%	0.329	S	S	.	.			trans	-89.6	142.1	175.8	64.1	0	0	0	0	111.6	G721 S748	G721-S740 WeakPolarHBondContact O-CA 3.42Å; G721-S740 VanDerWaalsContact O-CB 3.26Å; G721-S740 WeakPolarHBondContact O-CB 3.42Å; S740-S748 WeakPolarHBondContact OG-CB 3.45Å; S740-S748 PolarHBondContact OG-OG 2.87Å
741	S	88.7	Confident	88.8	Confident	102 Å²	102	52.2 Å²	52.2	71%	0.713	31%	0.308	S	S	*	.			trans	-95.5	-7.9	176	53.2	0	0	0	0	114.9	G721	G721-S741 WeakPolarHBondContact CA-OG 3.5Å
742	T	91.3	Very high	88.7	Confident	11 Å²	11	49 Å²	49	7%	0.067	29%	0.285	C	S	.	.			trans	-77.3	149.4	-176.2	179.1	0	0	0	0	113.6	T719 A722 A744 D772	T719-T742 WeakPolarHBondContact CB-OG1 3.33Å; T719-T742 VanDerWaalsContact OG1-CB 3.3Å; T719-T742 WeakPolarHBondContact OG1-CB 3.48Å; T719-T742 WeakPolarHBondContact OG1-CG2 3.37Å; T719-T742 PolarHBondContact OG1-OG1 2.93Å; A722-T742 HydrophobicContact CB-CG2 3.54Å; T742-A744 HydrophobicContact CG2-CB 4.29Å; T742-A744 PolarHBondContact O-N 2.88Å; T742-A744 WeakPolarHBondContact OG1-CB 3.49Å; T742-A744 PolarHBondContact OG1-N 3.03Å; T742-D772 VanDerWaalsContact CA-OD2 3.23Å; T742-D772 WeakPolarHBondContact CA-OD2 3.49Å; T742-D772 WeakPolarHBondContact CB-OD1 3.36Å; T742-D772 PolarHBondContact OG1-OD1 2.99Å; T742-D772 PolarHBondContact OG1-OD2 3.12Å
743	I	91.4	Very high	88.6	Confident	28 Å²	28	46.7 Å²	46.7	14%	0.144	26%	0.261	C	S	.	.	S	Bend	trans	-69.2	-16.6	165.2	68.1	169.8	0	0	0	113.2	T745 D772 V776 P792 W839 M843	I743-T745 PolarHBondContact O-N 3.39Å; I743-D772 HydrophobicContact CD1-CB 4.4Å; I743-D772 HydrophobicContact CG1-CB 4.12Å; I743-D772 PolarHBondContact N-OD2 2.97Å; I743-V776 HydrophobicContact CD1-CG2 3.6Å; I743-P792 HydrophobicContact CD1-CB 4.18Å; I743-P792 HydrophobicContact CD1-CG 3.97Å; I743-P792 HydrophobicContact CG1-CB 4.16Å; I743-P792 HydrophobicContact CG1-CG 4.19Å; I743-W839 HydrophobicContact CD1-CB 4.28Å; I743-W839 HydrophobicContact CD1-CD2 3.69Å; I743-W839 HydrophobicContact CD1-CE3 4.11Å; I743-W839 HydrophobicContact CD1-CG 3.76Å; I743-M843 HydrophobicContact CD1-CE 3.75Å
744	A	92	Very high	88.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.251	C	S	.	.			trans	-78.9	66.6	-175.4	0	0	0	0	0	111.6	T719 T742 S746 L747 P792	T719-A744 HydrophobicContact CG2-CB 3.94Å; T742-A744 HydrophobicContact CG2-CB 4.29Å; T742-A744 PolarHBondContact O-N 2.88Å; T742-A744 WeakPolarHBondContact OG1-CB 3.49Å; T742-A744 PolarHBondContact OG1-N 3.03Å; A744-S746 PolarHBondContact O-N 2.97Å; A744-L747 HydrophobicContact CB-CB 4.44Å; A744-L747 HydrophobicContact CB-CD1 3.83Å; A744-L747 HydrophobicContact CB-CG 4.04Å; A744-L747 WeakPolarHBondContact O-CB 3.32Å; A744-L747 PolarHBondContact O-N 3.25Å; A744-P792 HydrophobicContact CB-CB 4Å
745	T	89.3	Confident	88.7	Confident	33 Å²	33	46.3 Å²	46.3	20%	0.202	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-19.1	-174	60.8	0	0	0	0	115.5	E609 I743 L747	E609-T745 HydrophobicContact CG-CG2 4.41Å; I743-T745 PolarHBondContact O-N 3.39Å; T745-L747 VanDerWaalsContact C-N 3.31Å
746	S	91.5	Very high	88.8	Confident	27 Å²	27	45.3 Å²	45.3	19%	0.189	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-17	171	-89.8	0	0	0	0	114.4	N584 A744 D791 A793	N584-S746 PolarHBondContact ND2-OG 2.89Å; A744-S746 PolarHBondContact O-N 2.97Å; S746-D791 WeakPolarHBondContact CB-OD2 3.37Å; S746-D791 PolarHBondContact OG-OD2 2.9Å; S746-A793 VanDerWaalsContact CB-CB 3.45Å
747	L	93.5	Very high	89.2	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-20.6	179.1	-55	-177.8	0	0	0	113.3	A690 V691 G692 T719 A722 A744 T745 A749 A793 A796	A690-L747 HydrophobicContact CB-CD2 4.07Å; V691-L747 WeakPolarHBondContact O-CD2 3.26Å; G692-L747 VanDerWaalsContact CA-O 3.3Å; G692-L747 WeakPolarHBondContact CA-O 3.3Å; T719-L747 HydrophobicContact CG2-CD1 4.02Å; A722-L747 HydrophobicContact CB-CB 4.03Å; A744-L747 HydrophobicContact CB-CB 4.44Å; A744-L747 HydrophobicContact CB-CD1 3.83Å; A744-L747 HydrophobicContact CB-CG 4.04Å; A744-L747 WeakPolarHBondContact O-CB 3.32Å; A744-L747 PolarHBondContact O-N 3.25Å; T745-L747 VanDerWaalsContact C-N 3.31Å; L747-A749 PolarHBondContact O-N 3.47Å; L747-A793 HydrophobicContact CD1-CB 4.17Å; L747-A793 HydrophobicContact CD2-CB 3.57Å; L747-A793 HydrophobicContact CG-CB 3.58Å; L747-A796 HydrophobicContact CD1-CB 4.33Å
748	S	90.6	Very high	89.5	Confident	27 Å²	27	43.1 Å²	43.1	19%	0.189	23%	0.233	C	C	.	.			trans	-64.5	42.8	-173.9	-56.5	0	0	0	0	116.9	S740	S740-S748 WeakPolarHBondContact OG-CB 3.45Å; S740-S748 PolarHBondContact OG-OG 2.87Å
749	A	89	Confident	90.4	Very high	12 Å²	12	39 Å²	39	10%	0.099	21%	0.207	C	C	.	.			trans	-77.2	133.5	170.1	0	0	0	0	0	110.1	Y661 G693 L747 V751	Y661-A749 HydrophobicContact CE1-CB 3.81Å; G693-A749 VanDerWaalsContact CA-CB 3.41Å; L747-A749 PolarHBondContact O-N 3.47Å; A749-V751 VanDerWaalsContact C-N 3.27Å; A749-V751 PolarHBondContact O-N 3.09Å
750	P	86.5	Confident	91	Very high	13 Å²	13	29.7 Å²	29.7	8%	0.084	17%	0.173	C	C	.	.	S	Bend	trans	-74.3	-19	-177.1	30.3	-36	0	0	0	113.2	F632 V736 I737	F632-P750 HydrophobicContact CD1-CG 3.99Å; F632-P750 HydrophobicContact CE1-CG 4.35Å; V736-P750 CarbonylContact C-O 3.52Å; V736-P750 VanDerWaalsContact CA-O 3.28Å; V736-P750 WeakPolarHBondContact CA-O 3.17Å; V736-P750 WeakPolarHBondContact CG1-O 3.49Å; I737-P750 PolarHBondContact N-O 3.32Å; I737-P750 VanDerWaalsContact O-CA 3.31Å; I737-P750 WeakPolarHBondContact O-CA 3.38Å; I737-P750 WeakPolarHBondContact O-CB 3.49Å
751	V	89.1	Confident	91.4	Very high	46 Å²	46	32.7 Å²	32.7	28%	0.279	18%	0.181	S	C	.	.	S	Bend	trans	-155.7	147.8	178	67.6	0	0	0	0	109.6	Y661 L734 V736 A749	Y661-V751 WeakPolarHBondContact CE2-O 3.41Å; Y661-V751 PolarHBondContact OH-O 2.71Å; L734-V751 HydrophobicContact CD1-CG2 3.84Å; L734-V751 HydrophobicContact CD2-CG2 3.76Å; L734-V751 HydrophobicContact CG-CG2 3.72Å; V736-V751 HydrophobicContact CG2-CG2 4.31Å; A749-V751 VanDerWaalsContact C-N 3.27Å; A749-V751 PolarHBondContact O-N 3.09Å
752	L	92.3	Very high	91.5	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	18%	0.179	C	C	.	.			trans	-66.7	152.4	172.6	-61	176.6	0	0	0	112	V691 G692 C724 L725 L734 Q754 W757	V691-L752 HydrophobicContact CG1-CD2 4.03Å; G692-L752 WeakPolarHBondContact O-CD2 3.04Å; C724-L752 HydrophobicContact CB-CD2 4.44Å; L725-L752 HydrophobicContact CB-CD1 4.01Å; L725-L752 HydrophobicContact CB-CD2 4.23Å; L725-L752 HydrophobicContact CD1-CD1 3.67Å; L725-L752 HydrophobicContact CG-CD1 4.44Å; L734-L752 HydrophobicContact CD1-CB 3.89Å; L734-L752 HydrophobicContact CD1-CD1 4.29Å; L734-L752 HydrophobicContact CD1-CG 4.26Å; L752-Q754 PolarHBondContact O-N 2.95Å; L752-W757 HydrophobicContact CD1-CB 4.33Å
753	A	92.7	Very high	91.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.			trans	-53.1	131.8	157.1	0	0	0	0	0	110.7	Y661 D662 W667 G693 R755 A756 W757	Y661-A753 HydrophobicContact CD2-CB 4.18Å; D662-A753 HydrophobicContact CB-CB 3.88Å; D662-A753 VanDerWaalsContact CG-CA 3.49Å; D662-A753 VanDerWaalsContact CG-CB 3.49Å; D662-A753 WeakPolarHBondContact OD1-CA 3.45Å; D662-A753 WeakPolarHBondContact OD1-CB 3.26Å; D662-A753 WeakPolarHBondContact OD2-CA 3.21Å; W667-A753 HydrophobicContact CZ2-CB 4.37Å; G693-A753 WeakPolarHBondContact O-CB 3.2Å; G693-A753 PolarHBondContact O-N 3.47Å; A753-R755 PolarHBondContact O-N 3.47Å; A753-R755 VanDerWaalsContact O-N 3.13Å; A753-A756 HydrophobicContact CB-CB 4.07Å; A753-A756 WeakPolarHBondContact O-CB 3.17Å; A753-A756 PolarHBondContact O-N 2.87Å; A753-W757 PolarHBondContact O-N 2.85Å; A753-W757 VanDerWaalsContact O-N 3.1Å
754	Q	90.1	Very high	91.9	Very high	104 Å²	104	34.4 Å²	34.4	49%	0.486	19%	0.193	S	C	.	.	H	α-helix	trans	-57	-34.6	-179.1	178.7	61.8	21.7	0	0	111.8	L752 W757 S758	L752-Q754 PolarHBondContact O-N 2.95Å; Q754-W757 PolarHBondContact O-N 2.9Å; Q754-S758 PolarHBondContact O-N 3.46Å; Q754-S758 PolarHBondContact O-OG 3.25Å
755	R	92	Very high	92.1	Very high	94 Å²	94	35.9 Å²	35.9	36%	0.355	20%	0.201	S	C	.	.	H	α-helix	trans	-64.5	-40.3	174.2	179.5	61.9	167	165.4	0.3	112.7	W667 A698 A753 S758 L759	W667-R755 HydrophobicContact CD2-CB 4.49Å; W667-R755 HydrophobicContact CD2-CG 4.24Å; W667-R755 HydrophobicContact CE3-CB 4.12Å; W667-R755 HydrophobicContact CE3-CG 3.7Å; W667-R755 HydrophobicContact CH2-CB 3.33Å; W667-R755 HydrophobicContact CH2-CG 3.86Å; W667-R755 HydrophobicContact CZ2-CB 3.69Å; W667-R755 HydrophobicContact CZ2-CG 4.32Å; W667-R755 HydrophobicContact CZ3-CB 3.56Å; W667-R755 HydrophobicContact CZ3-CG 3.51Å; A698-R755 HydrophobicContact CB-CG 4.24Å; A753-R755 PolarHBondContact O-N 3.47Å; A753-R755 VanDerWaalsContact O-N 3.13Å; R755-S758 PolarHBondContact O-N 2.86Å; R755-L759 HydrophobicContact CG-CD1 3.88Å; R755-L759 HydrophobicContact CG-CG 4.37Å; R755-L759 WeakPolarHBondContact O-CB 3.26Å; R755-L759 VanDerWaalsContact O-CG 3.26Å; R755-L759 WeakPolarHBondContact O-CG 3.45Å; R755-L759 PolarHBondContact O-N 3.47Å
756	A	93.8	Very high	92.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.1	-38.6	179.4	0	0	0	0	0	111.3	G694 A698 A753 L759 A760	G694-A756 WeakPolarHBondContact O-CB 3.5Å; A698-A756 HydrophobicContact CB-CB 4.28Å; A753-A756 HydrophobicContact CB-CB 4.07Å; A753-A756 WeakPolarHBondContact O-CB 3.17Å; A753-A756 PolarHBondContact O-N 2.87Å; A756-L759 PolarHBondContact O-N 3.23Å; A756-A760 WeakPolarHBondContact O-CB 3.3Å; A756-A760 PolarHBondContact O-N 2.93Å
757	W	94.4	Very high	92.6	Very high	18 Å²	18	34.7 Å²	34.7	7%	0.068	20%	0.195	C	C	.	.	H	α-helix	trans	-58.8	-54.7	170.9	171.6	-123.8	0	0	0	111.7	S728 L729 L734 L752 A753 Q754 L759 A760 Q761	S728-W757 VanDerWaalsContact CB-CZ3 3.46Å; S728-W757 WeakPolarHBondContact O-CH2 3.36Å; L729-W757 HydrophobicContact CD2-CH2 4.5Å; L729-W757 HydrophobicContact CD2-CZ3 3.82Å; L729-W757 HydrophobicContact CG-CZ3 4.15Å; L734-W757 HydrophobicContact CD1-CB 4.31Å; L734-W757 HydrophobicContact CD1-CG 4.34Å; L752-W757 HydrophobicContact CD1-CB 4.33Å; A753-W757 PolarHBondContact O-N 2.85Å; A753-W757 VanDerWaalsContact O-N 3.1Å; Q754-W757 PolarHBondContact O-N 2.9Å; W757-L759 VanDerWaalsContact C-N 3.32Å; W757-L759 PolarHBondContact O-N 3.2Å; W757-A760 PolarHBondContact O-N 2.82Å; W757-A760 VanDerWaalsContact O-N 3.12Å; W757-Q761 HydrophobicContact CD2-CG 4.42Å; W757-Q761 HydrophobicContact CE3-CG 4.48Å; W757-Q761 HydrophobicContact CH2-CG 4.26Å; W757-Q761 HydrophobicContact CZ2-CG 4.2Å; W757-Q761 VanDerWaalsContact CZ2-NE2 3.29Å; W757-Q761 HydrophobicContact CZ3-CG 4.4Å; W757-Q761 PolarHBondContact O-N 3.42Å
758	S	93.3	Very high	92.8	Very high	44 Å²	44	35.1 Å²	35.1	31%	0.308	20%	0.198	S	C	.	.	H	α-helix	trans	-62.6	-34.2	179.4	-60.1	0	0	0	0	113.8	Q754 R755 Q761	Q754-S758 PolarHBondContact O-N 3.46Å; Q754-S758 PolarHBondContact O-OG 3.25Å; R755-S758 PolarHBondContact O-N 2.86Å; S758-Q761 PolarHBondContact O-N 2.93Å
759	L	92.9	Very high	93.1	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-70.6	-35.4	174.8	-72.6	173.2	0	0	0	112.2	A698 I701 W705 R755 A756 W757 Q761 C762 H763	A698-L759 HydrophobicContact CB-CD1 3.96Å; I701-L759 HydrophobicContact CB-CD1 4.27Å; I701-L759 HydrophobicContact CD1-CB 3.83Å; I701-L759 HydrophobicContact CG2-CB 4.31Å; I701-L759 HydrophobicContact CG2-CD1 4.31Å; I701-L759 HydrophobicContact CG2-CD2 3.97Å; I701-L759 HydrophobicContact CG2-CG 4.43Å; W705-L759 HydrophobicContact CE3-CD2 4.49Å; W705-L759 HydrophobicContact CH2-CD2 3.44Å; W705-L759 VanDerWaalsContact CH2-CD2 3.44Å; W705-L759 HydrophobicContact CZ2-CD2 3.93Å; W705-L759 HydrophobicContact CZ3-CD2 3.77Å; R755-L759 HydrophobicContact CG-CD1 3.88Å; R755-L759 HydrophobicContact CG-CG 4.37Å; R755-L759 WeakPolarHBondContact O-CB 3.26Å; R755-L759 VanDerWaalsContact O-CG 3.26Å; R755-L759 WeakPolarHBondContact O-CG 3.45Å; R755-L759 PolarHBondContact O-N 3.47Å; A756-L759 PolarHBondContact O-N 3.23Å; W757-L759 VanDerWaalsContact C-N 3.32Å; W757-L759 PolarHBondContact O-N 3.2Å; L759-Q761 PolarHBondContact O-N 3.47Å; L759-C762 PolarHBondContact O-N 3.01Å; L759-C762 VanDerWaalsContact O-N 3.13Å; L759-H763 WeakPolarHBondContact O-CB 3.37Å; L759-H763 PolarHBondContact O-N 3.03Å; L759-H763 VanDerWaalsContact O-N 3.15Å
760	A	92.4	Very high	93.5	Very high	7 Å²	7	35.4 Å²	35.4	6%	0.058	20%	0.198	C	C	.	.	H	α-helix	trans	-67.7	-23.4	176.3	0	0	0	0	0	113.6	L725 L729 A756 W757 I765	L725-A760 HydrophobicContact CD1-CB 3.73Å; L729-A760 HydrophobicContact CD2-CB 4.49Å; A756-A760 WeakPolarHBondContact O-CB 3.3Å; A756-A760 PolarHBondContact O-N 2.93Å; W757-A760 PolarHBondContact O-N 2.82Å; W757-A760 VanDerWaalsContact O-N 3.12Å; A760-I765 HydrophobicContact CB-CD1 3.82Å
761	Q	92	Very high	94	Very high	110 Å²	110	37.3 Å²	37.3	51%	0.514	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-16.5	172.4	-64.1	179.3	-61.1	0	0	113.6	W757 S758 L759	W757-Q761 HydrophobicContact CD2-CG 4.42Å; W757-Q761 HydrophobicContact CE3-CG 4.48Å; W757-Q761 HydrophobicContact CH2-CG 4.26Å; W757-Q761 HydrophobicContact CZ2-CG 4.2Å; W757-Q761 VanDerWaalsContact CZ2-NE2 3.29Å; W757-Q761 HydrophobicContact CZ3-CG 4.4Å; W757-Q761 PolarHBondContact O-N 3.42Å; S758-Q761 PolarHBondContact O-N 2.93Å; L759-Q761 PolarHBondContact O-N 3.47Å
762	C	92.3	Very high	94.3	Very high	97 Å²	97	36.6 Å²	36.6	66%	0.655	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.1	3.4	-170.8	-63	0	0	0	0	114.6	L759	L759-C762 PolarHBondContact O-N 3.01Å; L759-C762 VanDerWaalsContact O-N 3.13Å
763	H	95	Very high	94.5	Very high	20 Å²	20	38 Å²	38	9%	0.093	22%	0.219	C	C	.	.	S	Bend	trans	-130.7	160	-178.5	-171.2	55.4	0	0	0	111	I701 W705 S710 T712 L759 I765	I701-H763 HydrophobicContact CD1-CB 4.31Å; I701-H763 HydrophobicContact CG2-CB 4.27Å; W705-H763 HydrophobicContact CZ2-CB 4.49Å; W705-H763 AromaticContact NE1-ND1 3.66Å; S710-H763 PolarHBondContact O-CE1 3.36Å; S710-H763 VanDerWaalsContact O-CE1 3.26Å; S710-H763 PolarHBondContact O-ND1 3.28Å; T712-H763 PolarHBondContact O-CE1 2.76Å; T712-H763 PolarHBondContact O-NE2 3.24Å; L759-H763 WeakPolarHBondContact O-CB 3.37Å; L759-H763 PolarHBondContact O-N 3.03Å; L759-H763 VanDerWaalsContact O-N 3.15Å; H763-I765 PolarHBondContact O-N 2.9Å; H763-I765 VanDerWaalsContact O-N 3.09Å
764	S	95.4	Very high	94.7	Very high	61 Å²	61	41.2 Å²	41.2	43%	0.427	23%	0.234	S	C	.	.			trans	-76.5	99	-173.7	-171.5	0	0	0	0	110.6	H713 I714	H713-S764 PolarHBondContact ND1-O 3.29Å; H713-S764 PolarHBondContact ND1-OG 3.27Å; I714-S764 PolarHBondContact N-O 3.47Å
765	I	95.8	Very high	95	Very high	31 Å²	31	36.2 Å²	36.2	16%	0.159	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.1	-175.2	-59.6	-165.2	0	0	0	112.5	L697 I701 H713 I714 T716 A760 H763	L697-I765 HydrophobicContact CD1-CD1 4.16Å; L697-I765 HydrophobicContact CD2-CD1 4.18Å; I701-I765 HydrophobicContact CD1-CD1 4.13Å; H713-I765 VanDerWaalsContact CE1-C 3.43Å; I714-I765 HydrophobicContact CB-CG1 4.34Å; I714-I765 CarbonylContact O-C 3.53Å; I714-I765 VanDerWaalsContact O-CA 3.27Å; I714-I765 WeakPolarHBondContact O-CA 3.26Å; T716-I765 HydrophobicContact CG2-CD1 4.42Å; T716-I765 HydrophobicContact CG2-CG2 3.92Å; T716-I765 VanDerWaalsContact OG1-CG2 3.26Å; T716-I765 WeakPolarHBondContact OG1-CG2 3.35Å; A760-I765 HydrophobicContact CB-CD1 3.82Å; H763-I765 PolarHBondContact O-N 2.9Å; H763-I765 VanDerWaalsContact O-N 3.09Å
766	S	95.7	Very high	95.2	Very high	5 Å²	5	32 Å²	32	4%	0.035	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	111.7	158.2	-67.8	0	0	0	0	109.3	H713 I714 V715 T716 R814	H713-S766 PolarHBondContact CE1-N 3.11Å; H713-S766 PolarHBondContact CE1-OG 3.1Å; H713-S766 VanDerWaalsContact CE1-OG 3.29Å; H713-S766 WeakPolarHBondContact NE2-CB 3.41Å; H713-S766 PolarHBondContact NE2-N 3.14Å; H713-S766 PolarHBondContact NE2-OG 3.09Å; I714-S766 PolarHBondContact O-N 3.32Å; V715-S766 CarbonylContact C-O 3.59Å; V715-S766 WeakPolarHBondContact CA-O 3.29Å; T716-S766 PolarHBondContact N-O 3.14Å; T716-S766 PolarHBondContact OG1-O 3.3Å; S766-R814 PolarHBondContact OG-NH2 3.06Å
767	A	96.5	Very high	95.4	Very high	29 Å²	29	35.2 Å²	35.2	24%	0.24	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	129.7	174.7	0	0	0	0	0	111.1	T716 N726 L729	T716-A767 VanDerWaalsContact OG1-CA 3.32Å; T716-A767 WeakPolarHBondContact OG1-CA 3.08Å; N726-A767 PolarHBondContact ND2-O 3.18Å; N726-A767 VanDerWaalsContact ND2-O 3.09Å; L729-A767 HydrophobicContact CD1-CB 3.67Å
768	V	96.3	Very high	95.5	Very high	14 Å²	14	34.3 Å²	34.3	9%	0.085	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.2	-170.1	-164.5	0	0	0	0	109.5	V715 T716 V717 E718 N726 Y805	V715-V768 HydrophobicContact CG1-CG2 3.75Å; T716-V768 PolarHBondContact O-N 2.99Å; V717-V768 WeakPolarHBondContact CA-O 3.29Å; V717-V768 HydrophobicContact CG1-CB 4.36Å; E718-V768 PolarHBondContact N-O 2.75Å; N726-V768 PolarHBondContact ND2-N 3.17Å; V768-Y805 HydrophobicContact CB-CE2 4.38Å; V768-Y805 HydrophobicContact CG1-CD1 4.49Å; V768-Y805 HydrophobicContact CG1-CD2 3.69Å; V768-Y805 HydrophobicContact CG1-CE1 4.41Å; V768-Y805 HydrophobicContact CG1-CE2 3.6Å; V768-Y805 HydrophobicContact CG1-CG 4.18Å; V768-Y805 HydrophobicContact CG2-CD1 4.19Å; V768-Y805 HydrophobicContact CG2-CD2 4.47Å; V768-Y805 HydrophobicContact CG2-CE1 3.51Å; V768-Y805 HydrophobicContact CG2-CE2 3.84Å; V768-Y805 WeakPolarHBondContact CG2-OH 3.42Å
769	T	97.6	Very high	95.7	Very high	42 Å²	42	32.2 Å²	32.2	26%	0.258	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	149.7	166.1	53.6	0	0	0	0	109.9	E718 D723 N726	E718-T769 CarbonylContact O-C 3.54Å; E718-T769 WeakPolarHBondContact O-CA 3.3Å; D723-T769 HydrophobicContact CB-CG2 3.5Å; N726-T769 HydrophobicContact CB-CG2 3.89Å
770	C	97.3	Very high	95.8	Very high	3 Å²	3	35 Å²	35	2%	0.02	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.4	166.8	61.7	0	0	0	0	110	E718 T719 E720 E774	E718-C770 PolarHBondContact O-N 3.2Å; T719-C770 CarbonylContact C-O 3.48Å; T719-C770 VanDerWaalsContact CA-O 3.29Å; T719-C770 WeakPolarHBondContact CA-O 3.39Å; E720-C770 PolarHBondContact N-O 2.8Å; C770-E774 HydrophobicContact CB-CB 4.15Å
771	T	97.3	Very high	96	Very high	53 Å²	53	37.9 Å²	37.9	33%	0.325	22%	0.216	S	C	.	.			trans	-71.5	156.2	174.6	59.7	0	0	0	0	111	G773 E774 A775	T771-G773 PolarHBondContact O-N 3.37Å; T771-E774 PolarHBondContact N-OE2 3.28Å; T771-E774 PolarHBondContact O-N 3.15Å; T771-E774 VanDerWaalsContact O-N 3.14Å; T771-E774 WeakPolarHBondContact OG1-CG 3.33Å; T771-E774 PolarHBondContact OG1-N 3.13Å; T771-E774 VanDerWaalsContact OG1-N 3.13Å; T771-E774 PolarHBondContact OG1-OE2 3.07Å; T771-A775 PolarHBondContact O-N 3.05Å
772	D	96.1	Very high	96.3	Very high	30 Å²	30	32.6 Å²	32.6	16%	0.16	19%	0.192	C	C	.	.	H	α-helix	trans	-58.5	-28.7	170.9	-78.6	0.4	0	0	0	112.1	T719 T742 I743 A775 V776 M843	T719-D772 WeakPolarHBondContact CB-OD1 3.37Å; T742-D772 VanDerWaalsContact CA-OD2 3.23Å; T742-D772 WeakPolarHBondContact CA-OD2 3.49Å; T742-D772 WeakPolarHBondContact CB-OD1 3.36Å; T742-D772 PolarHBondContact OG1-OD1 2.99Å; T742-D772 PolarHBondContact OG1-OD2 3.12Å; I743-D772 HydrophobicContact CD1-CB 4.4Å; I743-D772 HydrophobicContact CG1-CB 4.12Å; I743-D772 PolarHBondContact N-OD2 2.97Å; D772-A775 PolarHBondContact O-N 3.38Å; D772-V776 WeakPolarHBondContact O-CG2 3.31Å; D772-V776 PolarHBondContact O-N 3.06Å; D772-M843 HydrophobicContact CB-CE 3.67Å; D772-M843 WeakPolarHBondContact O-CE 3.45Å
773	G	95.9	Very high	96.5	Very high	34 Å²	34	30.3 Å²	30.3	35%	0.351	17%	0.172	S	C	.	.	H	α-helix	trans	-65.7	-44.5	173.9	0	0	0	0	0	113.2	T771 A775 V776 D777	T771-G773 PolarHBondContact O-N 3.37Å; G773-A775 VanDerWaalsContact C-N 3.32Å; G773-V776 PolarHBondContact O-N 2.66Å; G773-D777 PolarHBondContact O-N 3.18Å
774	E	96.9	Very high	96.6	Very high	67 Å²	67	35.6 Å²	35.6	31%	0.313	20%	0.201	S	C	.	.	H	α-helix	trans	-66.1	-34.1	172.8	-73.3	167.5	106.5	0	0	112.3	C770 T771 G778	C770-E774 HydrophobicContact CB-CB 4.15Å; T771-E774 PolarHBondContact N-OE2 3.28Å; T771-E774 PolarHBondContact O-N 3.15Å; T771-E774 VanDerWaalsContact O-N 3.14Å; T771-E774 WeakPolarHBondContact OG1-CG 3.33Å; T771-E774 PolarHBondContact OG1-N 3.13Å; T771-E774 VanDerWaalsContact OG1-N 3.13Å; T771-E774 PolarHBondContact OG1-OE2 3.07Å; E774-G778 PolarHBondContact O-N 3.46Å
775	A	97.1	Very high	96.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-41	173	0	0	0	0	0	111.6	T719 T771 D772 G773 G778 V779 P792 G795 A796	T719-A775 HydrophobicContact CG2-CB 4.06Å; T771-A775 PolarHBondContact O-N 3.05Å; D772-A775 PolarHBondContact O-N 3.38Å; G773-A775 VanDerWaalsContact C-N 3.32Å; A775-G778 PolarHBondContact O-N 3.21Å; A775-V779 WeakPolarHBondContact O-CG2 3.34Å; A775-V779 PolarHBondContact O-N 3.45Å; A775-P792 HydrophobicContact CB-CB 4.48Å; A775-G795 WeakPolarHBondContact O-CA 3.28Å; A775-A796 HydrophobicContact CB-CB 4.39Å
776	V	96.3	Very high	96.7	Very high	6 Å²	6	36 Å²	36	4%	0.036	20%	0.198	C	C	.	.	H	α-helix	trans	-70.3	-40	175.6	166.8	0	0	0	0	112.5	I743 D772 G773 G778 V779 K780 L836 W839 M843	I743-V776 HydrophobicContact CD1-CG2 3.6Å; D772-V776 WeakPolarHBondContact O-CG2 3.31Å; D772-V776 PolarHBondContact O-N 3.06Å; G773-V776 PolarHBondContact O-N 2.66Å; V776-G778 VanDerWaalsContact C-N 3.25Å; V776-G778 PolarHBondContact O-N 2.74Å; V776-V779 PolarHBondContact O-N 2.93Å; V776-K780 HydrophobicContact CG1-CD 4.09Å; V776-K780 HydrophobicContact CG1-CG 4.39Å; V776-K780 WeakPolarHBondContact O-CG 3.4Å; V776-K780 PolarHBondContact O-N 2.72Å; V776-L836 HydrophobicContact CG1-CD1 4.09Å; V776-W839 HydrophobicContact CG2-CB 4.2Å; V776-W839 HydrophobicContact CG2-CE3 4.33Å; V776-M843 HydrophobicContact CB-CE 4.29Å; V776-M843 HydrophobicContact CB-SD 4.03Å; V776-M843 HydrophobicContact CG1-SD 4.35Å; V776-M843 HydrophobicContact CG2-CE 3.64Å; V776-M843 HydrophobicContact CG2-SD 3.96Å
777	D	96.1	Very high	96.7	Very high	66 Å²	66	38.5 Å²	38.5	35%	0.353	22%	0.224	S	C	.	.	H	α-helix	trans	-57.6	-42.8	169.6	-173.7	60.5	0	0	0	110.5	G773 V779 K780 R781	G773-D777 PolarHBondContact O-N 3.18Å; D777-V779 PolarHBondContact O-N 2.85Å; D777-K780 PolarHBondContact O-N 3.28Å; D777-R781 VanDerWaalsContact CG-CD 3.42Å; D777-R781 WeakPolarHBondContact O-CB 3.49Å; D777-R781 WeakPolarHBondContact O-CG 3.36Å; D777-R781 PolarHBondContact O-N 2.93Å; D777-R781 VanDerWaalsContact OD1-CD 3.27Å; D777-R781 WeakPolarHBondContact OD1-CD 3.16Å; D777-R781 WeakPolarHBondContact OD2-CD 3.34Å; D777-R781 IonicContact OD2-NH1 2.73Å; D777-R781 PolarHBondContact OD2-NH1 3.23Å
778	G	97.1	Very high	96.6	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.4	-39.5	174.2	0	0	0	0	0	114.2	E774 A775 V776 F782	E774-G778 PolarHBondContact O-N 3.46Å; A775-G778 PolarHBondContact O-N 3.21Å; V776-G778 VanDerWaalsContact C-N 3.25Å; V776-G778 PolarHBondContact O-N 2.74Å; G778-F782 WeakPolarHBondContact O-CB 3.43Å; G778-F782 PolarHBondContact O-N 3.22Å
779	V	97	Very high	96.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-47.1	173.3	175.7	0	0	0	0	111.3	A775 V776 D777 L783 L789 V790 L836	A775-V779 WeakPolarHBondContact O-CG2 3.34Å; A775-V779 PolarHBondContact O-N 3.45Å; V776-V779 PolarHBondContact O-N 2.93Å; D777-V779 PolarHBondContact O-N 2.85Å; V779-L783 PolarHBondContact O-N 2.85Å; V779-L789 HydrophobicContact CG1-CD1 3.8Å; V779-V790 WeakPolarHBondContact CG1-O 3.4Å; V779-V790 HydrophobicContact CG2-CG2 4.34Å; V779-L836 HydrophobicContact CB-CD1 4.1Å; V779-L836 HydrophobicContact CG1-CD1 3.71Å; V779-L836 HydrophobicContact CG1-CD2 4.23Å
780	K	96.1	Very high	96.5	Very high	59 Å²	59	39.1 Å²	39.1	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-61.5	-51.4	-177.9	-74.7	177.9	58.4	167.4	0	111.5	V776 D777 F782 L783 D784 L836 E840	V776-K780 HydrophobicContact CG1-CD 4.09Å; V776-K780 HydrophobicContact CG1-CG 4.39Å; V776-K780 WeakPolarHBondContact O-CG 3.4Å; V776-K780 PolarHBondContact O-N 2.72Å; D777-K780 PolarHBondContact O-N 3.28Å; K780-F782 VanDerWaalsContact C-N 3.32Å; K780-F782 PolarHBondContact O-N 2.83Å; K780-L783 WeakPolarHBondContact O-CB 3.49Å; K780-L783 PolarHBondContact O-N 2.71Å; K780-L783 VanDerWaalsContact O-N 3.15Å; K780-D784 PolarHBondContact O-N 3.42Å; K780-L836 HydrophobicContact CG-CD1 4.05Å; K780-L836 HydrophobicContact CG-CD2 3.99Å; K780-L836 HydrophobicContact CG-CG 4.1Å; K780-E840 IonicContact NZ-OE1 3.76Å; K780-E840 PolarHBondContact NZ-OE1 3.02Å; K780-E840 IonicContact NZ-OE2 3.18Å; K780-E840 PolarHBondContact NZ-OE2 3.38Å
781	R	97.1	Very high	96.3	Very high	68 Å²	68	39.2 Å²	39.2	26%	0.257	22%	0.221	S	C	.	.	H	α-helix	trans	-68.5	-30.9	-176.8	-66.3	178	65.5	178.2	1.3	112.8	D777 D784 D785 Y802	D777-R781 VanDerWaalsContact CG-CD 3.42Å; D777-R781 WeakPolarHBondContact O-CB 3.49Å; D777-R781 WeakPolarHBondContact O-CG 3.36Å; D777-R781 PolarHBondContact O-N 2.93Å; D777-R781 VanDerWaalsContact OD1-CD 3.27Å; D777-R781 WeakPolarHBondContact OD1-CD 3.16Å; D777-R781 WeakPolarHBondContact OD2-CD 3.34Å; D777-R781 IonicContact OD2-NH1 2.73Å; D777-R781 PolarHBondContact OD2-NH1 3.23Å; R781-D784 PolarHBondContact O-N 3.17Å; R781-D785 WeakPolarHBondContact O-CB 3.32Å; R781-D785 PolarHBondContact O-N 2.98Å; R781-Y802 VanDerWaalsContact C-OH 3.26Å; R781-Y802 HydrophobicContact CB-CD1 4.3Å; R781-Y802 HydrophobicContact CB-CD2 4.33Å; R781-Y802 HydrophobicContact CB-CE1 3.8Å; R781-Y802 HydrophobicContact CB-CE2 3.83Å; R781-Y802 PolarHBondContact O-OH 3.29Å
782	F	97.3	Very high	96.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-74.5	-28.6	173.7	-169.7	-107.8	0	0	0	112.9	L546 G778 K780 H786 M788 V790 L798 Y802 I825	L546-F782 HydrophobicContact CD1-CE2 3.86Å; L546-F782 HydrophobicContact CD1-CZ 4.34Å; G778-F782 WeakPolarHBondContact O-CB 3.43Å; G778-F782 PolarHBondContact O-N 3.22Å; K780-F782 VanDerWaalsContact C-N 3.32Å; K780-F782 PolarHBondContact O-N 2.83Å; F782-H786 HydrophobicContact CD2-CB 4.22Å; F782-H786 AromaticContact CD2-CE1 4Å; F782-H786 AromaticContact CD2-CG 3.9Å; F782-H786 AromaticContact CD2-ND1 3.17Å; F782-H786 WeakPolarHBondContact CD2-ND1 3.3Å; F782-H786 HydrophobicContact CE2-CB 4.02Å; F782-H786 AromaticContact CE2-CG 3.66Å; F782-H786 AromaticContact CE2-ND1 3.32Å; F782-H786 VanDerWaalsContact CE2-ND1 3.32Å; F782-H786 WeakPolarHBondContact CE2-ND1 3.38Å; F782-H786 HydrophobicContact CZ-CB 4.23Å; F782-H786 WeakPolarHBondContact O-CB 3.33Å; F782-H786 PolarHBondContact O-N 2.75Å; F782-M788 HydrophobicContact CD1-CB 4.27Å; F782-M788 WeakPolarHBondContact CD1-O 3.31Å; F782-M788 HydrophobicContact CE1-CB 3.82Å; F782-M788 HydrophobicContact CE1-CE 4.14Å; F782-M788 HydrophobicContact CZ-CE 3.83Å; F782-V790 HydrophobicContact CD1-CG1 4.03Å; F782-V790 HydrophobicContact CD1-CG2 4Å; F782-V790 HydrophobicContact CE1-CG1 3.86Å; F782-L798 HydrophobicContact CB-CD1 3.64Å; F782-L798 HydrophobicContact CB-CD2 4.44Å; F782-L798 HydrophobicContact CD1-CD1 3.87Å; F782-L798 HydrophobicContact CD2-CD1 3.86Å; F782-L798 HydrophobicContact CD2-CD2 3.49Å; F782-L798 VanDerWaalsContact CD2-CD2 3.49Å; F782-L798 HydrophobicContact CD2-CG 4.34Å; F782-L798 HydrophobicContact CE1-CD1 4.49Å; F782-L798 HydrophobicContact CE2-CD1 4.47Å; F782-L798 HydrophobicContact CE2-CD2 3.88Å; F782-L798 HydrophobicContact CG-CD1 3.52Å; F782-L798 HydrophobicContact CG-CD2 4.07Å; F782-L798 HydrophobicContact CG-CG 4.45Å; F782-Y802 WeakPolarHBondContact CA-OH 3.04Å; F782-Y802 HydrophobicContact CB-CE2 4.46Å; F782-Y802 PolarHBondContact N-OH 2.85Å; F782-I825 HydrophobicContact CE1-CG2 3.93Å; F782-I825 HydrophobicContact CE2-CD1 4.08Å; F782-I825 HydrophobicContact CZ-CD1 3.89Å; F782-I825 HydrophobicContact CZ-CG1 4.03Å; F782-I825 HydrophobicContact CZ-CG2 3.93Å
783	L	96.4	Very high	96.2	Very high	48 Å²	48	35.8 Å²	35.8	25%	0.251	20%	0.201	S	C	.	.	H	α-helix	trans	-65.4	-42	168.3	178.8	63.3	0	0	0	111.1	V779 K780 G787 L789 L836	V779-L783 PolarHBondContact O-N 2.85Å; K780-L783 WeakPolarHBondContact O-CB 3.49Å; K780-L783 PolarHBondContact O-N 2.71Å; K780-L783 VanDerWaalsContact O-N 3.15Å; L783-G787 WeakPolarHBondContact O-CA 3.29Å; L783-G787 PolarHBondContact O-N 2.85Å; L783-L789 HydrophobicContact CD1-CB 4.24Å; L783-L789 HydrophobicContact CD2-CD1 4.42Å; L783-L836 HydrophobicContact CD2-CD2 4.37Å
784	D	96.5	Very high	96.3	Very high	131 Å²	131	34.4 Å²	34.4	70%	0.701	19%	0.186	S	C	*	.	H	α-helix	trans	-73.2	-47.1	178.3	-66	-29.7	0	0	0	112.7	K780 R781	K780-D784 PolarHBondContact O-N 3.42Å; R781-D784 PolarHBondContact O-N 3.17Å
785	D	96.8	Very high	96.3	Very high	57 Å²	57	31.2 Å²	31.2	31%	0.305	17%	0.171	S	C	.	.	H	α-helix	trans	-72.1	-31.6	-176.9	-72.2	-27.4	0	0	0	113.2	V530 R781 Y802	V530-D785 HydrophobicContact CG1-CB 4.1Å; R781-D785 WeakPolarHBondContact O-CB 3.32Å; R781-D785 PolarHBondContact O-N 2.98Å; D785-Y802 VanDerWaalsContact OD2-CE1 3.25Å; D785-Y802 WeakPolarHBondContact OD2-CE1 3.47Å; D785-Y802 PolarHBondContact OD2-OH 2.72Å
786	H	96.8	Very high	96.4	Very high	44 Å²	44	31.2 Å²	31.2	20%	0.204	17%	0.171	C	C	.	.	H	α-helix	trans	-130.8	-1.9	-170.6	-59	93.6	0	0	0	115.4	S528 F782 M788	S528-H786 PolarHBondContact OG-CE1 2.99Å; S528-H786 PolarHBondContact OG-NE2 2.86Å; F782-H786 HydrophobicContact CD2-CB 4.22Å; F782-H786 AromaticContact CD2-CE1 4Å; F782-H786 AromaticContact CD2-CG 3.9Å; F782-H786 AromaticContact CD2-ND1 3.17Å; F782-H786 WeakPolarHBondContact CD2-ND1 3.3Å; F782-H786 HydrophobicContact CE2-CB 4.02Å; F782-H786 AromaticContact CE2-CG 3.66Å; F782-H786 AromaticContact CE2-ND1 3.32Å; F782-H786 VanDerWaalsContact CE2-ND1 3.32Å; F782-H786 WeakPolarHBondContact CE2-ND1 3.38Å; F782-H786 HydrophobicContact CZ-CB 4.23Å; F782-H786 WeakPolarHBondContact O-CB 3.33Å; F782-H786 PolarHBondContact O-N 2.75Å; H786-M788 VanDerWaalsContact C-N 3.26Å; H786-M788 HydrophobicContact CB-CE 3.75Å; H786-M788 PolarHBondContact O-N 2.88Å
787	G	95.7	Very high	96.5	Very high	57 Å²	57	30.9 Å²	30.9	59%	0.588	17%	0.169	S	C	*	.	S	Bend	trans	68.5	19.3	178.7	0	0	0	0	0	114.6	L783	L783-G787 WeakPolarHBondContact O-CA 3.29Å; L783-G787 PolarHBondContact O-N 2.85Å
788	M	95.2	Very high	96.6	Very high	39 Å²	39	27.8 Å²	27.8	19%	0.192	15%	0.153	C	C	.	.			trans	-124.2	113.9	-172.2	-73.2	-175	-74.9	0	0	112.3	L548 N550 F782 H786	L548-M788 HydrophobicContact CD1-CE 4.31Å; L548-M788 HydrophobicContact CD1-SD 4.37Å; L548-M788 HydrophobicContact CD2-CE 4.02Å; L548-M788 HydrophobicContact CD2-SD 4.46Å; N550-M788 PolarHBondContact ND2-SD 3.28Å; F782-M788 HydrophobicContact CD1-CB 4.27Å; F782-M788 WeakPolarHBondContact CD1-O 3.31Å; F782-M788 HydrophobicContact CE1-CB 3.82Å; F782-M788 HydrophobicContact CE1-CE 4.14Å; F782-M788 HydrophobicContact CZ-CE 3.83Å; H786-M788 VanDerWaalsContact C-N 3.26Å; H786-M788 HydrophobicContact CB-CE 3.75Å; H786-M788 PolarHBondContact O-N 2.88Å
789	L	95	Very high	96.6	Very high	60 Å²	60	28 Å²	28	31%	0.314	15%	0.154	S	C	.	.			trans	-75	134.9	170.1	-173.1	64.7	0	0	0	110.6	V779 L783 V831 L836	V779-L789 HydrophobicContact CG1-CD1 3.8Å; L783-L789 HydrophobicContact CD1-CB 4.24Å; L783-L789 HydrophobicContact CD2-CD1 4.42Å; L789-V831 HydrophobicContact CD1-CG2 4.02Å; L789-V831 HydrophobicContact CD2-CG1 4.21Å; L789-V831 HydrophobicContact CD2-CG2 4.24Å; L789-V831 HydrophobicContact CG-CG1 4.01Å; L789-V831 HydrophobicContact CG-CG2 4.14Å; L789-L836 HydrophobicContact CD1-CD2 4.13Å
790	V	95.7	Very high	96.6	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.155	C	C	.	.			trans	-139.4	161.9	-179.4	-62.2	0	0	0	0	110.4	N550 V779 F782 C794 L798 I825	N550-V790 HydrophobicContact CB-CG1 4.43Å; V779-V790 WeakPolarHBondContact CG1-O 3.4Å; V779-V790 HydrophobicContact CG2-CG2 4.34Å; F782-V790 HydrophobicContact CD1-CG1 4.03Å; F782-V790 HydrophobicContact CD1-CG2 4Å; F782-V790 HydrophobicContact CE1-CG1 3.86Å; V790-C794 HydrophobicContact CB-CB 3.69Å; V790-C794 HydrophobicContact CG2-CB 3.72Å; V790-L798 HydrophobicContact CG2-CD1 4.14Å; V790-I825 HydrophobicContact CG1-CG2 4.13Å
791	D	94.1	Very high	96.7	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.027	14%	0.142	C	C	.	.			trans	-75.9	162.3	179.7	84	13.7	0	0	0	112.5	N584 S746 A793 C794 G795 G827 V831	N584-D791 PolarHBondContact ND2-OD2 2.79Å; S746-D791 WeakPolarHBondContact CB-OD2 3.37Å; S746-D791 PolarHBondContact OG-OD2 2.9Å; D791-A793 PolarHBondContact O-N 3.15Å; D791-A793 VanDerWaalsContact O-N 3.11Å; D791-A793 WeakPolarHBondContact OD1-CA 3.34Å; D791-A793 WeakPolarHBondContact OD1-CB 3.33Å; D791-A793 PolarHBondContact OD1-N 2.66Å; D791-C794 WeakPolarHBondContact O-CA 3.48Å; D791-C794 WeakPolarHBondContact O-CB 3.44Å; D791-C794 PolarHBondContact O-N 2.8Å; D791-C794 PolarHBondContact OD1-N 2.98Å; D791-C794 VanDerWaalsContact OD1-N 3.17Å; D791-G795 PolarHBondContact O-N 3.3Å; D791-G827 VanDerWaalsContact CG-O 3.27Å; D791-G827 PolarHBondContact N-O 2.75Å; D791-V831 HydrophobicContact CB-CB 4.41Å; D791-V831 HydrophobicContact CB-CG1 4.37Å
792	P	95.3	Very high	96.7	Very high	4 Å²	4	22.2 Å²	22.2	3%	0.026	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-21	-178	-25.9	35.3	0	0	0	114.7	I743 A744 A775 G795 A796 W839	I743-P792 HydrophobicContact CD1-CB 4.18Å; I743-P792 HydrophobicContact CD1-CG 3.97Å; I743-P792 HydrophobicContact CG1-CB 4.16Å; I743-P792 HydrophobicContact CG1-CG 4.19Å; A744-P792 HydrophobicContact CB-CB 4Å; A775-P792 HydrophobicContact CB-CB 4.48Å; P792-G795 CarbonylContact O-C 3.49Å; P792-G795 WeakPolarHBondContact O-CA 3.26Å; P792-G795 PolarHBondContact O-N 3.31Å; P792-A796 PolarHBondContact O-N 3.37Å; P792-W839 HydrophobicContact CG-CE3 4.17Å; P792-W839 HydrophobicContact CG-CH2 3.51Å; P792-W839 HydrophobicContact CG-CZ2 4.16Å; P792-W839 HydrophobicContact CG-CZ3 3.5Å; P792-W839 VanDerWaalsContact CG-CZ3 3.5Å
793	A	96.4	Very high	96.6	Very high	7 Å²	7	25.3 Å²	25.3	6%	0.058	15%	0.152	C	C	.	.	H	α-helix	trans	-70.4	-36.4	173	0	0	0	0	0	111.5	A690 S746 L747 D791 A797	A690-A793 WeakPolarHBondContact CB-O 3.49Å; S746-A793 VanDerWaalsContact CB-CB 3.45Å; L747-A793 HydrophobicContact CD1-CB 4.17Å; L747-A793 HydrophobicContact CD2-CB 3.57Å; L747-A793 HydrophobicContact CG-CB 3.58Å; D791-A793 PolarHBondContact O-N 3.15Å; D791-A793 VanDerWaalsContact O-N 3.11Å; D791-A793 WeakPolarHBondContact OD1-CA 3.34Å; D791-A793 WeakPolarHBondContact OD1-CB 3.33Å; D791-A793 PolarHBondContact OD1-N 2.66Å; A793-A797 PolarHBondContact O-N 3.48Å
794	C	97.2	Very high	96.5	Very high	4 Å²	4	23.5 Å²	23.5	3%	0.027	15%	0.146	C	C	.	.	H	α-helix	trans	-68.9	-37.1	168.6	-163.2	0	0	0	0	111.5	V790 D791 A796 A797 L798	V790-C794 HydrophobicContact CB-CB 3.69Å; V790-C794 HydrophobicContact CG2-CB 3.72Å; D791-C794 WeakPolarHBondContact O-CA 3.48Å; D791-C794 WeakPolarHBondContact O-CB 3.44Å; D791-C794 PolarHBondContact O-N 2.8Å; D791-C794 PolarHBondContact OD1-N 2.98Å; D791-C794 VanDerWaalsContact OD1-N 3.17Å; C794-A796 VanDerWaalsContact C-N 3.32Å; C794-A796 PolarHBondContact O-N 3.01Å; C794-A797 PolarHBondContact O-N 3.05Å; C794-L798 WeakPolarHBondContact O-CD1 3.31Å; C794-L798 WeakPolarHBondContact O-CG 3.49Å; C794-L798 PolarHBondContact O-N 3.24Å; C794-L798 VanDerWaalsContact O-N 3.16Å
795	G	97.4	Very high	96.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56.5	-41.1	171.7	0	0	0	0	0	113.4	A775 D791 P792 A797 L798 S799	A775-G795 WeakPolarHBondContact O-CA 3.28Å; D791-G795 PolarHBondContact O-N 3.3Å; P792-G795 CarbonylContact O-C 3.49Å; P792-G795 WeakPolarHBondContact O-CA 3.26Å; P792-G795 PolarHBondContact O-N 3.31Å; G795-A797 PolarHBondContact O-N 2.82Å; G795-L798 CarbonylContact O-C 3.51Å; G795-L798 WeakPolarHBondContact O-CB 3.35Å; G795-L798 PolarHBondContact O-N 2.92Å; G795-S799 PolarHBondContact O-N 3.1Å
796	A	98.1	Very high	96.5	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-41.8	174.7	0	0	0	0	0	112.7	V717 T719 L747 A775 P792 C794 L798 S799	V717-A796 HydrophobicContact CG1-CB 4.37Å; V717-A796 WeakPolarHBondContact CG1-O 3.34Å; T719-A796 HydrophobicContact CG2-CB 4.12Å; L747-A796 HydrophobicContact CD1-CB 4.33Å; A775-A796 HydrophobicContact CB-CB 4.39Å; P792-A796 PolarHBondContact O-N 3.37Å; C794-A796 VanDerWaalsContact C-N 3.32Å; C794-A796 PolarHBondContact O-N 3.01Å; A796-L798 VanDerWaalsContact C-N 3.32Å; A796-L798 PolarHBondContact O-N 2.87Å; A796-S799 PolarHBondContact O-N 2.96Å; A796-S799 PolarHBondContact O-OG 3.29Å
797	A	98.3	Very high	96.5	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-62.1	-41.5	173.4	0	0	0	0	0	112	V688 A690 A793 C794 G795 T800 I823	V688-A797 HydrophobicContact CG1-CB 4.16Å; A690-A797 HydrophobicContact CB-CB 4.2Å; A793-A797 PolarHBondContact O-N 3.48Å; C794-A797 PolarHBondContact O-N 3.05Å; G795-A797 PolarHBondContact O-N 2.82Å; A797-T800 PolarHBondContact O-OG1 3.33Å; A797-I823 HydrophobicContact CB-CG2 4.28Å
798	L	98.3	Very high	96.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-68.4	-31.5	179.8	-73.5	157.7	0	0	0	113.1	F782 V790 C794 G795 A796 T800 V801 Y802 I825	F782-L798 HydrophobicContact CB-CD1 3.64Å; F782-L798 HydrophobicContact CB-CD2 4.44Å; F782-L798 HydrophobicContact CD1-CD1 3.87Å; F782-L798 HydrophobicContact CD2-CD1 3.86Å; F782-L798 HydrophobicContact CD2-CD2 3.49Å; F782-L798 VanDerWaalsContact CD2-CD2 3.49Å; F782-L798 HydrophobicContact CD2-CG 4.34Å; F782-L798 HydrophobicContact CE1-CD1 4.49Å; F782-L798 HydrophobicContact CE2-CD1 4.47Å; F782-L798 HydrophobicContact CE2-CD2 3.88Å; F782-L798 HydrophobicContact CG-CD1 3.52Å; F782-L798 HydrophobicContact CG-CD2 4.07Å; F782-L798 HydrophobicContact CG-CG 4.45Å; V790-L798 HydrophobicContact CG2-CD1 4.14Å; C794-L798 WeakPolarHBondContact O-CD1 3.31Å; C794-L798 WeakPolarHBondContact O-CG 3.49Å; C794-L798 PolarHBondContact O-N 3.24Å; C794-L798 VanDerWaalsContact O-N 3.16Å; G795-L798 CarbonylContact O-C 3.51Å; G795-L798 WeakPolarHBondContact O-CB 3.35Å; G795-L798 PolarHBondContact O-N 2.92Å; A796-L798 VanDerWaalsContact C-N 3.32Å; A796-L798 PolarHBondContact O-N 2.87Å; L798-T800 PolarHBondContact O-N 2.9Å; L798-T800 VanDerWaalsContact O-N 3.14Å; L798-V801 PolarHBondContact O-N 3.13Å; L798-Y802 HydrophobicContact CB-CD2 4.08Å; L798-Y802 HydrophobicContact CB-CE2 3.97Å; L798-Y802 HydrophobicContact CD2-CE2 4.36Å; L798-Y802 WeakPolarHBondContact O-CD2 3.15Å; L798-Y802 PolarHBondContact O-N 3.47Å; L798-I825 HydrophobicContact CD1-CD1 4.29Å; L798-I825 HydrophobicContact CD2-CD1 3.8Å; L798-I825 HydrophobicContact CG-CD1 4.08Å
799	S	97.8	Very high	96.5	Very high	4 Å²	4	15.9 Å²	15.9	3%	0.028	8%	0.082	C	C	.	.	H	α-helix	trans	-57.5	-30.7	179.7	80.8	0	0	0	0	112.2	G795 A796 V801 Y802 S803	G795-S799 PolarHBondContact O-N 3.1Å; A796-S799 PolarHBondContact O-N 2.96Å; A796-S799 PolarHBondContact O-OG 3.29Å; S799-V801 PolarHBondContact O-N 3.07Å; S799-Y802 PolarHBondContact O-N 3.32Å; S799-S803 WeakPolarHBondContact O-CB 3.27Å; S799-S803 PolarHBondContact O-N 3.48Å; S799-S803 PolarHBondContact O-OG 3.05Å
800	T	97.6	Very high	96.5	Very high	2 Å²	2	13 Å²	13	1%	0.012	7%	0.067	C	C	.	.	H	α-helix	trans	-59.2	-30	176.9	63.8	0	0	0	0	114.1	V688 V715 V717 A797 L798 Y805 L806	V688-T800 HydrophobicContact CG1-CG2 4.27Å; V715-T800 HydrophobicContact CG1-CG2 4.21Å; V717-T800 HydrophobicContact CB-CG2 4.45Å; V717-T800 HydrophobicContact CG1-CG2 4.18Å; V717-T800 HydrophobicContact CG2-CG2 3.4Å; V717-T800 VanDerWaalsContact CG2-CG2 3.4Å; A797-T800 PolarHBondContact O-OG1 3.33Å; L798-T800 PolarHBondContact O-N 2.9Å; L798-T800 VanDerWaalsContact O-N 3.14Å; T800-Y805 PolarHBondContact O-N 3.31Å; T800-Y805 VanDerWaalsContact O-N 3.16Å; T800-L806 PolarHBondContact O-N 2.98Å
801	V	97.8	Very high	96.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-80	-51.2	169.4	178.6	0	0	0	0	109.5	L531 L534 L535 R538 L798 S799 G804 L806 I823	L531-V801 HydrophobicContact CB-CG1 4.16Å; L531-V801 HydrophobicContact CD2-CG1 3.98Å; L531-V801 HydrophobicContact CG-CG1 4.48Å; L534-V801 HydrophobicContact CD2-CG1 4.22Å; L535-V801 HydrophobicContact CD1-CG1 4.17Å; L535-V801 HydrophobicContact CD2-CG1 4.29Å; L535-V801 HydrophobicContact CG-CG1 4.2Å; R538-V801 PolarHBondContact NH1-O 3.38Å; L798-V801 PolarHBondContact O-N 3.13Å; S799-V801 PolarHBondContact O-N 3.07Å; V801-G804 PolarHBondContact O-N 2.94Å; V801-G804 VanDerWaalsContact O-N 3.16Å; V801-L806 HydrophobicContact CG2-CD1 3.78Å; V801-I823 HydrophobicContact CG2-CD1 3.48Å; V801-I823 VanDerWaalsContact CG2-CD1 3.48Å
802	Y	97.5	Very high	96.3	Very high	5 Å²	5	23 Å²	23	2%	0.02	12%	0.117	C	C	.	.	H	α-helix	trans	-68.8	-39.6	-168.3	-69.4	-52.4	0	0	0	114.1	L531 L534 R538 R781 F782 D785 L798 S799 G804	L531-Y802 HydrophobicContact CD2-CD1 4.31Å; L531-Y802 HydrophobicContact CD2-CE1 3.47Å; L531-Y802 VanDerWaalsContact CD2-CE1 3.47Å; L534-Y802 HydrophobicContact CD2-CD1 3.77Å; L534-Y802 HydrophobicContact CD2-CE1 4.18Å; R538-Y802 PolarHBondContact NH2-O 3.5Å; R781-Y802 VanDerWaalsContact C-OH 3.26Å; R781-Y802 HydrophobicContact CB-CD1 4.3Å; R781-Y802 HydrophobicContact CB-CD2 4.33Å; R781-Y802 HydrophobicContact CB-CE1 3.8Å; R781-Y802 HydrophobicContact CB-CE2 3.83Å; R781-Y802 PolarHBondContact O-OH 3.29Å; F782-Y802 WeakPolarHBondContact CA-OH 3.04Å; F782-Y802 HydrophobicContact CB-CE2 4.46Å; F782-Y802 PolarHBondContact N-OH 2.85Å; D785-Y802 VanDerWaalsContact OD2-CE1 3.25Å; D785-Y802 WeakPolarHBondContact OD2-CE1 3.47Å; D785-Y802 PolarHBondContact OD2-OH 2.72Å; L798-Y802 HydrophobicContact CB-CD2 4.08Å; L798-Y802 HydrophobicContact CB-CE2 3.97Å; L798-Y802 HydrophobicContact CD2-CE2 4.36Å; L798-Y802 WeakPolarHBondContact O-CD2 3.15Å; L798-Y802 PolarHBondContact O-N 3.47Å; S799-Y802 PolarHBondContact O-N 3.32Å; Y802-G804 VanDerWaalsContact C-N 3.31Å
803	S	94.7	Very high	96.2	Very high	64 Å²	64	25.7 Å²	25.7	45%	0.448	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-23.3	172.1	71.1	0	0	0	0	113	S799 Y805	S799-S803 WeakPolarHBondContact O-CB 3.27Å; S799-S803 PolarHBondContact O-N 3.48Å; S799-S803 PolarHBondContact O-OG 3.05Å; S803-Y805 PolarHBondContact OG-N 3.21Å
804	G	94.3	Very high	96	Very high	11 Å²	11	31 Å²	31	11%	0.113	16%	0.164	C	C	.	.	S	Bend	trans	91.7	14.3	-176.6	0	0	0	0	0	114.6	R538 V801 Y802 L806 S807 R808	R538-G804 VanDerWaalsContact NH1-CA 3.33Å; V801-G804 PolarHBondContact O-N 2.94Å; V801-G804 VanDerWaalsContact O-N 3.16Å; Y802-G804 VanDerWaalsContact C-N 3.31Å; G804-L806 VanDerWaalsContact C-N 3.29Å; G804-L806 PolarHBondContact O-N 2.94Å; G804-S807 WeakPolarHBondContact O-CA 3.28Å; G804-S807 VanDerWaalsContact O-CB 3.29Å; G804-S807 WeakPolarHBondContact O-CB 3.48Å; G804-S807 PolarHBondContact O-N 2.94Å; G804-R808 PolarHBondContact O-N 3.47Å
805	Y	96.2	Very high	95.9	Very high	31 Å²	31	31.1 Å²	31.1	12%	0.122	17%	0.165	C	C	.	.	H	α-helix	trans	-52.9	-44.3	173.9	-177.3	-85.3	0	0	0	112.6	V715 V768 T800 S803 S807 R808 L809	V715-Y805 HydrophobicContact CG1-CD1 4.34Å; V715-Y805 HydrophobicContact CG1-CE1 4.01Å; V768-Y805 HydrophobicContact CB-CE2 4.38Å; V768-Y805 HydrophobicContact CG1-CD1 4.49Å; V768-Y805 HydrophobicContact CG1-CD2 3.69Å; V768-Y805 HydrophobicContact CG1-CE1 4.41Å; V768-Y805 HydrophobicContact CG1-CE2 3.6Å; V768-Y805 HydrophobicContact CG1-CG 4.18Å; V768-Y805 HydrophobicContact CG2-CD1 4.19Å; V768-Y805 HydrophobicContact CG2-CD2 4.47Å; V768-Y805 HydrophobicContact CG2-CE1 3.51Å; V768-Y805 HydrophobicContact CG2-CE2 3.84Å; V768-Y805 WeakPolarHBondContact CG2-OH 3.42Å; T800-Y805 PolarHBondContact O-N 3.31Å; T800-Y805 VanDerWaalsContact O-N 3.16Å; S803-Y805 PolarHBondContact OG-N 3.21Å; Y805-S807 VanDerWaalsContact C-N 3.34Å; Y805-S807 PolarHBondContact O-N 2.86Å; Y805-R808 VanDerWaalsContact CD2-NH2 3.32Å; Y805-R808 WeakPolarHBondContact O-CB 3.45Å; Y805-R808 PolarHBondContact O-N 3.25Å; Y805-L809 HydrophobicContact CD1-CD1 4.28Å; Y805-L809 HydrophobicContact CD1-CG 4.19Å; Y805-L809 HydrophobicContact CE1-CD1 3.65Å; Y805-L809 HydrophobicContact CE1-CD2 3.97Å; Y805-L809 HydrophobicContact CE1-CG 3.65Å; Y805-L809 PolarHBondContact O-N 3.06Å
806	L	97.2	Very high	95.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-37.2	175.7	-66.4	-179.8	0	0	0	112.4	M542 V688 V715 T800 V801 G804 R808 L809 Q810 I821	M542-L806 HydrophobicContact CE-CB 4.15Å; M542-L806 WeakPolarHBondContact CE-O 3.44Å; M542-L806 HydrophobicContact SD-CB 4.06Å; V688-L806 HydrophobicContact CG2-CD1 4.36Å; V688-L806 HydrophobicContact CG2-CD2 4.41Å; V715-L806 HydrophobicContact CG2-CD2 4.05Å; T800-L806 PolarHBondContact O-N 2.98Å; V801-L806 HydrophobicContact CG2-CD1 3.78Å; G804-L806 VanDerWaalsContact C-N 3.29Å; G804-L806 PolarHBondContact O-N 2.94Å; L806-R808 VanDerWaalsContact C-N 3.29Å; L806-R808 PolarHBondContact O-N 2.96Å; L806-L809 HydrophobicContact CD2-CD1 4.35Å; L806-L809 PolarHBondContact O-N 3.15Å; L806-Q810 PolarHBondContact O-N 2.8Å; L806-I821 HydrophobicContact CD1-CG2 4.18Å
807	S	96.4	Very high	95.4	Very high	6 Å²	6	40.2 Å²	40.2	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-43.1	173.8	-63.7	0	0	0	0	111.3	L535 R538 C540 G804 Y805 Q810 L811	L535-S807 WeakPolarHBondContact CD2-OG 3.45Å; R538-S807 WeakPolarHBondContact CD-OG 3.35Å; C540-S807 WeakPolarHBondContact SG-CA 3.46Å; C540-S807 WeakPolarHBondContact SG-CB 3.44Å; C540-S807 PolarHBondContact SG-OG 3.07Å; G804-S807 WeakPolarHBondContact O-CA 3.28Å; G804-S807 VanDerWaalsContact O-CB 3.29Å; G804-S807 WeakPolarHBondContact O-CB 3.48Å; G804-S807 PolarHBondContact O-N 2.94Å; Y805-S807 VanDerWaalsContact C-N 3.34Å; Y805-S807 PolarHBondContact O-N 2.86Å; S807-Q810 PolarHBondContact O-N 2.82Å; S807-L811 WeakPolarHBondContact O-CD1 3.31Å; S807-L811 VanDerWaalsContact O-CG 3.31Å; S807-L811 WeakPolarHBondContact O-CG 3.49Å; S807-L811 PolarHBondContact O-N 3.42Å; S807-L811 VanDerWaalsContact O-N 3.07Å
808	R	95.6	Very high	95	Very high	130 Å²	130	44.1 Å²	44.1	49%	0.491	23%	0.233	S	C	.	.	H	α-helix	trans	-60.9	-47.7	175	178.5	173.1	63.6	169.2	-3.8	111.7	G804 Y805 L806 Q810 L811 E812	G804-R808 PolarHBondContact O-N 3.47Å; Y805-R808 VanDerWaalsContact CD2-NH2 3.32Å; Y805-R808 WeakPolarHBondContact O-CB 3.45Å; Y805-R808 PolarHBondContact O-N 3.25Å; L806-R808 VanDerWaalsContact C-N 3.29Å; L806-R808 PolarHBondContact O-N 2.96Å; R808-Q810 VanDerWaalsContact C-N 3.29Å; R808-Q810 PolarHBondContact O-N 3.37Å; R808-L811 CarbonylContact O-C 3.57Å; R808-L811 WeakPolarHBondContact O-CA 3.17Å; R808-L811 WeakPolarHBondContact O-CB 3.46Å; R808-L811 PolarHBondContact O-N 3.44Å; R808-E812 WeakPolarHBondContact CD-OE1 3.36Å; R808-E812 HydrophobicContact CG-CG 4.05Å; R808-E812 WeakPolarHBondContact CG-OE1 3.28Å; R808-E812 IonicContact NE-OE1 2.75Å; R808-E812 WeakPolarHBondContact O-CG 3.18Å; R808-E812 PolarHBondContact O-N 3.4Å
809	L	94.8	Very high	94.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-55.3	-40.6	178.5	-72.7	-170.9	0	0	0	113.4	V715 Y805 L806 E812 G813 R814 L815	V715-L809 HydrophobicContact CG2-CD1 3.87Å; Y805-L809 HydrophobicContact CD1-CD1 4.28Å; Y805-L809 HydrophobicContact CD1-CG 4.19Å; Y805-L809 HydrophobicContact CE1-CD1 3.65Å; Y805-L809 HydrophobicContact CE1-CD2 3.97Å; Y805-L809 HydrophobicContact CE1-CG 3.65Å; Y805-L809 PolarHBondContact O-N 3.06Å; L806-L809 HydrophobicContact CD2-CD1 4.35Å; L806-L809 PolarHBondContact O-N 3.15Å; L809-E812 PolarHBondContact O-N 2.92Å; L809-G813 PolarHBondContact O-N 2.83Å; L809-R814 HydrophobicContact CB-CB 4.49Å; L809-R814 HydrophobicContact CD2-CB 4.29Å; L809-R814 WeakPolarHBondContact O-CB 3.36Å; L809-R814 PolarHBondContact O-N 3.42Å; L809-L815 HydrophobicContact CB-CD1 3.72Å; L809-L815 HydrophobicContact CB-CG 4.03Å; L809-L815 HydrophobicContact CD1-CD1 3.99Å; L809-L815 HydrophobicContact CD1-CG 4.36Å
810	Q	95.4	Very high	94.8	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-80.6	-16.3	178.8	-163.8	-173.6	69.6	0	0	113.1	C540 Q541 M542 L806 S807 R808 L815 P816 R817 S819	C540-Q810 VanDerWaalsContact CA-OE1 3.28Å; C540-Q810 VanDerWaalsContact CB-OE1 3.25Å; Q541-Q810 PolarHBondContact O-NE2 2.83Å; M542-Q810 HydrophobicContact CE-CB 3.45Å; M542-Q810 VanDerWaalsContact CE-CB 3.45Å; M542-Q810 HydrophobicContact CE-CG 4.1Å; L806-Q810 PolarHBondContact O-N 2.8Å; S807-Q810 PolarHBondContact O-N 2.82Å; R808-Q810 VanDerWaalsContact C-N 3.29Å; R808-Q810 PolarHBondContact O-N 3.37Å; Q810-L815 HydrophobicContact CB-CB 4.16Å; Q810-L815 HydrophobicContact CG-CB 4.33Å; Q810-P816 PolarHBondContact NE2-O 2.88Å; Q810-R817 HydrophobicContact CG-CG 3.69Å; Q810-R817 PolarHBondContact O-NE 3.08Å; Q810-R817 PolarHBondContact O-NH2 3.15Å; Q810-S819 PolarHBondContact NE2-OG 2.82Å
811	L	93.2	Very high	94.9	Very high	115 Å²	115	45.8 Å²	45.8	60%	0.602	24%	0.241	S	C	*	.	H	α-helix	trans	-80.1	-35	167.6	-73.2	161.8	0	0	0	111.6	S807 R808 G813	S807-L811 WeakPolarHBondContact O-CD1 3.31Å; S807-L811 VanDerWaalsContact O-CG 3.31Å; S807-L811 WeakPolarHBondContact O-CG 3.49Å; S807-L811 PolarHBondContact O-N 3.42Å; S807-L811 VanDerWaalsContact O-N 3.07Å; R808-L811 CarbonylContact O-C 3.57Å; R808-L811 WeakPolarHBondContact O-CA 3.17Å; R808-L811 WeakPolarHBondContact O-CB 3.46Å; R808-L811 PolarHBondContact O-N 3.44Å; L811-G813 PolarHBondContact O-N 2.81Å
812	E	93.6	Very high	94.9	Very high	98 Å²	98	46 Å²	46	46%	0.458	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	0.2	171.4	-67.6	170.5	175.8	0	0	113.5	R808 L809 R814	R808-E812 WeakPolarHBondContact CD-OE1 3.36Å; R808-E812 HydrophobicContact CG-CG 4.05Å; R808-E812 WeakPolarHBondContact CG-OE1 3.28Å; R808-E812 IonicContact NE-OE1 2.75Å; R808-E812 WeakPolarHBondContact O-CG 3.18Å; R808-E812 PolarHBondContact O-N 3.4Å; L809-E812 PolarHBondContact O-N 2.92Å; E812-R814 HydrophobicContact CB-CG 3.9Å; E812-R814 PolarHBondContact O-N 3Å; E812-R814 WeakPolarHBondContact OE2-CD 3.42Å
813	G	92.9	Very high	94.9	Very high	62 Å²	62	45.7 Å²	45.7	64%	0.639	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	7.9	-178	0	0	0	0	0	115	L809 L811 L815	L809-G813 PolarHBondContact O-N 2.83Å; L811-G813 PolarHBondContact O-N 2.81Å; G813-L815 VanDerWaalsContact C-N 3.27Å; G813-L815 PolarHBondContact O-N 2.81Å
814	R	92.6	Very high	95.1	Very high	118 Å²	118	42.9 Å²	42.9	45%	0.445	22%	0.221	S	C	.	.	S	Bend	trans	-80.8	-4.8	-177.3	-56.9	-177.5	66.5	-141.8	-9.9	113.7	S766 L809 E812	S766-R814 PolarHBondContact OG-NH2 3.06Å; L809-R814 HydrophobicContact CB-CB 4.49Å; L809-R814 HydrophobicContact CD2-CB 4.29Å; L809-R814 WeakPolarHBondContact O-CB 3.36Å; L809-R814 PolarHBondContact O-N 3.42Å; E812-R814 HydrophobicContact CB-CG 3.9Å; E812-R814 PolarHBondContact O-N 3Å; E812-R814 WeakPolarHBondContact OE2-CD 3.42Å
815	L	94.5	Very high	95.3	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.037	22%	0.216	C	C	.	.	S	Bend	trans	-134.3	144.6	170.5	-66.9	173	0	0	0	108.9	M542 A686 L809 Q810 G813 I821	M542-L815 HydrophobicContact CE-CD1 3.62Å; A686-L815 HydrophobicContact CB-CD2 3.82Å; L809-L815 HydrophobicContact CB-CD1 3.72Å; L809-L815 HydrophobicContact CB-CG 4.03Å; L809-L815 HydrophobicContact CD1-CD1 3.99Å; L809-L815 HydrophobicContact CD1-CG 4.36Å; Q810-L815 HydrophobicContact CB-CB 4.16Å; Q810-L815 HydrophobicContact CG-CB 4.33Å; G813-L815 VanDerWaalsContact C-N 3.27Å; G813-L815 PolarHBondContact O-N 2.81Å; L815-I821 HydrophobicContact CD1-CD1 4.1Å; L815-I821 HydrophobicContact CD2-CD1 4.49Å
816	P	92.8	Very high	95.3	Very high	63 Å²	63	41.5 Å²	41.5	41%	0.409	22%	0.216	S	C	.	.			trans	-68.2	171.9	-177.7	27.9	-33.8	0	0	0	112.5	D685 Q810 P818 S819	D685-P816 HydrophobicContact CB-CG 3.92Å; D685-P816 VanDerWaalsContact OD1-CG 3.29Å; D685-P816 WeakPolarHBondContact OD1-CG 3.32Å; Q810-P816 PolarHBondContact NE2-O 2.88Å; P816-P818 CarbonylContact C-O 3.56Å; P816-P818 VanDerWaalsContact C-O 3.23Å; P816-P818 CarbonylContact O-C 3.53Å; P816-S819 PolarHBondContact O-OG 2.92Å
817	R	91.1	Very high	95.1	Very high	127 Å²	127	41.5 Å²	41.5	48%	0.479	22%	0.217	S	C	.	.	S	Bend	trans	-127.9	116	173.1	-68.6	-179.1	-178.6	-135.3	-1.9	109.8	Q810	Q810-R817 HydrophobicContact CG-CG 3.69Å; Q810-R817 PolarHBondContact O-NE 3.08Å; Q810-R817 PolarHBondContact O-NH2 3.15Å
818	P	91.5	Very high	94.6	Very high	83 Å²	83	41.5 Å²	41.5	54%	0.539	22%	0.217	S	C	.	.	S	Bend	cis	-67	176.2	-6.6	31.8	-37.6	0	0	0	113.2	Q541 P816	Q541-P818 HydrophobicContact CB-CB 4.19Å; Q541-P818 CarbonylContact O-C 3.57Å; Q541-P818 WeakPolarHBondContact O-CA 3.5Å; P816-P818 CarbonylContact C-O 3.56Å; P816-P818 VanDerWaalsContact C-O 3.23Å; P816-P818 CarbonylContact O-C 3.53Å
819	S	95	Very high	94	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.5	164	-34.6	0	0	0	0	112	Q541 M542 N543 D685 Q810 P816	Q541-S819 PolarHBondContact O-N 3.42Å; M542-S819 CarbonylContact C-O 3.59Å; M542-S819 WeakPolarHBondContact CA-O 3.2Å; N543-S819 PolarHBondContact N-O 3.34Å; D685-S819 WeakPolarHBondContact OD2-CA 3.14Å; Q810-S819 PolarHBondContact NE2-OG 2.82Å; P816-S819 PolarHBondContact O-OG 2.92Å
820	N	97.1	Very high	93.5	Very high	40 Å²	40	39.5 Å²	39.5	21%	0.214	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.8	159.6	-66.3	-58.1	0	0	0	109.3	N543 W545 I681 D685	N543-N820 WeakPolarHBondContact CB-OD1 3.27Å; N543-N820 PolarHBondContact ND2-OD1 3.06Å; W545-N820 PolarHBondContact NE1-OD1 3.24Å; I681-N820 HydrophobicContact CG2-CB 3.99Å; D685-N820 PolarHBondContact N-O 2.88Å; D685-N820 PolarHBondContact OD2-N 2.92Å
821	I	97.9	Very high	93.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.2	-179.8	-45.4	-65.2	0	0	0	109.2	M542 N543 I544 W545 A686 V688 L806 L815	M542-I821 HydrophobicContact CB-CG1 4.45Å; M542-I821 HydrophobicContact CG-CG1 4.29Å; M542-I821 HydrophobicContact SD-CD1 4.47Å; M542-I821 HydrophobicContact SD-CG1 3.92Å; N543-I821 PolarHBondContact O-N 2.98Å; I544-I821 HydrophobicContact CD1-CB 3.74Å; I544-I821 HydrophobicContact CD1-CG1 4.07Å; I544-I821 HydrophobicContact CD1-CG2 4.33Å; W545-I821 PolarHBondContact N-O 2.94Å; A686-I821 HydrophobicContact CB-CD1 3.89Å; A686-I821 WeakPolarHBondContact O-CA 3.47Å; V688-I821 HydrophobicContact CG2-CG2 3.92Å; L806-I821 HydrophobicContact CD1-CG2 4.18Å; L815-I821 HydrophobicContact CD1-CD1 4.1Å; L815-I821 HydrophobicContact CD2-CD1 4.49Å
822	L	98.3	Very high	92.8	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127	176.1	-176	153.9	0	0	0	110.6	L525 W545 K547 I677 P684 A686 I687 V688 V824	L525-L822 HydrophobicContact CD1-CD1 3.74Å; L525-L822 HydrophobicContact CD1-CG 4.14Å; L525-L822 HydrophobicContact CD2-CD1 3.87Å; L525-L822 HydrophobicContact CG-CD1 4.48Å; W545-L822 CarbonylContact O-C 3.34Å; W545-L822 WeakPolarHBondContact O-CA 3.29Å; K547-L822 HydrophobicContact CB-CD2 3.91Å; K547-L822 HydrophobicContact CB-CG 4.37Å; I677-L822 HydrophobicContact CD1-CD1 3.8Å; I677-L822 HydrophobicContact CG1-CD1 3.82Å; P684-L822 HydrophobicContact CB-CB 4.35Å; A686-L822 PolarHBondContact O-N 2.89Å; I687-L822 CarbonylContact C-O 3.4Å; I687-L822 VanDerWaalsContact CA-O 3.26Å; I687-L822 WeakPolarHBondContact CA-O 3.49Å; I687-L822 HydrophobicContact CG1-CB 4.35Å; I687-L822 HydrophobicContact CG2-CD2 3.92Å; V688-L822 PolarHBondContact N-O 3.42Å; L822-V824 HydrophobicContact CD2-CG2 3.9Å
823	I	98.4	Very high	92.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.3	176.1	-52	180	0	0	0	108.7	I544 W545 L546 K547 V688 A797 V801 I825	I544-I823 HydrophobicContact CG2-CD1 3.69Å; I544-I823 HydrophobicContact CG2-CG1 4.23Å; W545-I823 PolarHBondContact O-N 2.93Å; L546-I823 HydrophobicContact CD2-CB 4.08Å; L546-I823 HydrophobicContact CD2-CD1 4.26Å; L546-I823 HydrophobicContact CD2-CG1 4.49Å; K547-I823 PolarHBondContact N-O 3.26Å; V688-I823 HydrophobicContact CB-CB 4.46Å; V688-I823 HydrophobicContact CB-CG1 4.19Å; V688-I823 HydrophobicContact CB-CG2 4.28Å; V688-I823 HydrophobicContact CG2-CG1 4.04Å; A797-I823 HydrophobicContact CB-CG2 4.28Å; V801-I823 HydrophobicContact CG2-CD1 3.48Å; V801-I823 VanDerWaalsContact CG2-CD1 3.48Å; I823-I825 HydrophobicContact CB-CD1 4.49Å; I823-I825 HydrophobicContact CG2-CD1 3.83Å; I823-I825 PolarHBondContact O-N 3.36Å
824	V	98.5	Very high	92.4	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.03	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	101.2	174.7	-175.4	0	0	0	0	109.1	E549 I687 V688 V689 L696 L822 G826	E549-V824 HydrophobicContact CG-CG1 4.24Å; I687-V824 HydrophobicContact CG2-CG2 3.97Å; V688-V824 PolarHBondContact O-N 2.99Å; V688-V824 VanDerWaalsContact O-N 3.14Å; V689-V824 HydrophobicContact CG2-CG2 4.38Å; L696-V824 HydrophobicContact CD2-CG1 4.27Å; L822-V824 HydrophobicContact CD2-CG2 3.9Å; V824-G826 PolarHBondContact O-N 3.23Å
825	I	98.3	Very high	92.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.			trans	-76.9	78	176.3	-58.3	-57.8	0	0	0	108	L546 K547 L548 E549 N550 F782 V790 L798 I823 G827	L546-I825 HydrophobicContact CB-CG1 4.09Å; L546-I825 HydrophobicContact CD2-CD1 4.15Å; L546-I825 HydrophobicContact CD2-CG1 4.2Å; K547-I825 WeakPolarHBondContact O-CB 3.18Å; K547-I825 PolarHBondContact O-N 3.26Å; L548-I825 HydrophobicContact CD2-CB 4.15Å; L548-I825 HydrophobicContact CD2-CG1 4.11Å; L548-I825 HydrophobicContact CD2-CG2 4.27Å; E549-I825 CarbonylContact C-O 3.54Å; E549-I825 WeakPolarHBondContact CA-O 3.4Å; E549-I825 WeakPolarHBondContact CB-O 3.2Å; E549-I825 PolarHBondContact N-O 2.99Å; N550-I825 HydrophobicContact CB-CG2 4.28Å; N550-I825 PolarHBondContact N-O 3.3Å; F782-I825 HydrophobicContact CE1-CG2 3.93Å; F782-I825 HydrophobicContact CE2-CD1 4.08Å; F782-I825 HydrophobicContact CZ-CD1 3.89Å; F782-I825 HydrophobicContact CZ-CG1 4.03Å; F782-I825 HydrophobicContact CZ-CG2 3.93Å; V790-I825 HydrophobicContact CG1-CG2 4.13Å; L798-I825 HydrophobicContact CD1-CD1 4.29Å; L798-I825 HydrophobicContact CD2-CD1 3.8Å; L798-I825 HydrophobicContact CG-CD1 4.08Å; I823-I825 HydrophobicContact CB-CD1 4.49Å; I823-I825 HydrophobicContact CG2-CD1 3.83Å; I823-I825 PolarHBondContact O-N 3.36Å; I825-G827 PolarHBondContact O-N 2.6Å; I825-G827 VanDerWaalsContact O-N 3.09Å
826	G	96.1	Very high	92.1	Very high	12 Å²	12	39.8 Å²	39.8	12%	0.124	19%	0.192	C	C	.	.			trans	-59.8	-19.8	-173.4	0	0	0	0	0	114.6	S556 F557 V824 G828	S556-G826 VanDerWaalsContact CA-O 3.26Å; S556-G826 WeakPolarHBondContact CA-O 3.46Å; S556-G826 VanDerWaalsContact CB-O 3.27Å; S556-G826 WeakPolarHBondContact CB-O 3.44Å; F557-G826 PolarHBondContact N-O 2.65Å; V824-G826 PolarHBondContact O-N 3.23Å; G826-G828 PolarHBondContact O-N 2.99Å
827	G	92.5	Very high	91.9	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.01	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	79.5	-113.8	172.2	0	0	0	0	0	113.3	N550 D791 I825	N550-G827 VanDerWaalsContact CB-CA 3.46Å; D791-G827 VanDerWaalsContact CG-O 3.27Å; D791-G827 PolarHBondContact N-O 2.75Å; I825-G827 PolarHBondContact O-N 2.6Å; I825-G827 VanDerWaalsContact O-N 3.09Å
828	G	86.5	Confident	91.9	Very high	5 Å²	5	36.9 Å²	36.9	5%	0.052	18%	0.182	C	C	.	.			trans	86	137.4	-172.5	0	0	0	0	0	112.6	G555 N584 G826	G555-G828 WeakPolarHBondContact O-CA 3.43Å; G555-G828 PolarHBondContact O-N 2.86Å; N584-G828 WeakPolarHBondContact OD1-CA 3.43Å; G826-G828 PolarHBondContact O-N 2.99Å
829	R	83.1	Confident	91.8	Very high	86 Å²	86	33.6 Å²	33.6	33%	0.325	16%	0.159	S	C	.	.	S	Bend	trans	-111.1	23.2	172	-47.6	178.3	-176.8	143.3	6.5	112.3	P553 N584 E619 V831	P553-R829 PolarHBondContact O-NH1 2.86Å; P553-R829 PolarHBondContact O-NH2 3.29Å; N584-R829 PolarHBondContact OD1-N 3.13Å; E619-R829 IonicContact OE1-CZ 3.5Å; E619-R829 IonicContact OE1-NH1 2.72Å; E619-R829 PolarHBondContact OE1-NH1 3.33Å; R829-V831 PolarHBondContact O-N 3.13Å; R829-V831 VanDerWaalsContact O-N 3.07Å
830	N	83.3	Confident	91.4	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.011	18%	0.175	C	C	.	.	S	Bend	trans	-80.9	41.6	169.8	-72.4	15.2	0	0	0	110.1	T582 V612 R615	T582-N830 PolarHBondContact O-ND2 2.94Å; V612-N830 HydrophobicContact CG2-CB 4.26Å; V612-N830 WeakPolarHBondContact CG2-ND2 3.21Å; R615-N830 PolarHBondContact NH1-OD1 3.33Å
831	V	89	Confident	91	Very high	16 Å²	16	39.9 Å²	39.9	10%	0.097	19%	0.19	C	C	.	.			trans	-153	149.2	-170.7	62.1	0	0	0	0	109.2	L789 D791 R829 W839	L789-V831 HydrophobicContact CD1-CG2 4.02Å; L789-V831 HydrophobicContact CD2-CG1 4.21Å; L789-V831 HydrophobicContact CD2-CG2 4.24Å; L789-V831 HydrophobicContact CG-CG1 4.01Å; L789-V831 HydrophobicContact CG-CG2 4.14Å; D791-V831 HydrophobicContact CB-CB 4.41Å; D791-V831 HydrophobicContact CB-CG1 4.37Å; R829-V831 PolarHBondContact O-N 3.13Å; R829-V831 VanDerWaalsContact O-N 3.07Å; V831-W839 HydrophobicContact CB-CH2 4.39Å; V831-W839 HydrophobicContact CG2-CH2 4.09Å; V831-W839 HydrophobicContact CG2-CZ3 3.81Å
832	S	86.8	Confident	90.3	Very high	40 Å²	40	44.9 Å²	44.9	28%	0.28	21%	0.213	S	C	.	.			trans	-148.3	157.4	174.3	59.9	0	0	0	0	109.4	R834 Q835 L836	S832-R834 PolarHBondContact O-N 2.95Å; S832-R834 VanDerWaalsContact O-N 3.13Å; S832-Q835 PolarHBondContact O-N 3.06Å; S832-Q835 VanDerWaalsContact O-N 3.08Å; S832-Q835 PolarHBondContact OG-N 2.73Å; S832-Q835 PolarHBondContact OG-OE1 2.56Å; S832-L836 PolarHBondContact O-N 3.36Å
833	F	88.8	Confident	89.4	Confident	138 Å²	138	47.4 Å²	47.4	61%	0.605	23%	0.225	S	C	*	.	H	α-helix	trans	-56	-30.7	176.3	-174.7	-105.5	0	0	0	112.6	I837	F833-I837 HydrophobicContact CD1-CD1 3.99Å; F833-I837 HydrophobicContact CE1-CD1 3.58Å; F833-I837 HydrophobicContact CZ-CD1 4.01Å; F833-I837 WeakPolarHBondContact O-CG1 3.3Å; F833-I837 PolarHBondContact O-N 3.44Å
834	R	88.9	Confident	88	Confident	187 Å²	187	50.8 Å²	50.8	71%	0.706	25%	0.249	S	C	*	.	H	α-helix	trans	-69	-49.5	173.8	-172.7	174.3	177	156.7	1.8	112.2	S832 L836 I837 D838	S832-R834 PolarHBondContact O-N 2.95Å; S832-R834 VanDerWaalsContact O-N 3.13Å; R834-L836 PolarHBondContact O-N 3.23Å; R834-I837 PolarHBondContact O-N 3.27Å; R834-I837 VanDerWaalsContact O-N 3.12Å; R834-D838 WeakPolarHBondContact CG-OD2 3.49Å; R834-D838 IonicContact NE-OD2 2.74Å; R834-D838 PolarHBondContact O-N 3.06Å
835	Q	88.9	Confident	85.9	Confident	18 Å²	18	54.6 Å²	54.6	8%	0.084	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-37.3	174.7	-81.7	166.6	-76.9	0	0	112.6	E609 T611 S832 I837 D838 W839	E609-Q835 PolarHBondContact OE2-NE2 3.25Å; T611-Q835 VanDerWaalsContact CG2-OE1 3.27Å; T611-Q835 PolarHBondContact OG1-NE2 3.02Å; T611-Q835 PolarHBondContact OG1-OE1 3.42Å; S832-Q835 PolarHBondContact O-N 3.06Å; S832-Q835 VanDerWaalsContact O-N 3.08Å; S832-Q835 PolarHBondContact OG-N 2.73Å; S832-Q835 PolarHBondContact OG-OE1 2.56Å; Q835-I837 VanDerWaalsContact C-N 3.3Å; Q835-I837 PolarHBondContact O-N 3.16Å; Q835-D838 PolarHBondContact O-N 3.33Å; Q835-W839 HydrophobicContact CB-CD2 4.35Å; Q835-W839 HydrophobicContact CB-CE3 4.34Å; Q835-W839 HydrophobicContact CB-CH2 4.06Å; Q835-W839 HydrophobicContact CB-CZ2 4.08Å; Q835-W839 HydrophobicContact CB-CZ3 4.2Å; Q835-W839 HydrophobicContact CG-CZ2 4.44Å; Q835-W839 WeakPolarHBondContact O-CB 3.35Å; Q835-W839 VanDerWaalsContact O-CD2 3.26Å; Q835-W839 VanDerWaalsContact O-CG 3.24Å; Q835-W839 PolarHBondContact O-N 2.93Å
836	L	90.6	Very high	83.4	Confident	8 Å²	8	63.1 Å²	63.1	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-40.2	178.7	-166.8	61.6	0	0	0	111.8	V776 V779 K780 L783 L789 S832 R834 W839 E840	V776-L836 HydrophobicContact CG1-CD1 4.09Å; V779-L836 HydrophobicContact CB-CD1 4.1Å; V779-L836 HydrophobicContact CG1-CD1 3.71Å; V779-L836 HydrophobicContact CG1-CD2 4.23Å; K780-L836 HydrophobicContact CG-CD1 4.05Å; K780-L836 HydrophobicContact CG-CD2 3.99Å; K780-L836 HydrophobicContact CG-CG 4.1Å; L783-L836 HydrophobicContact CD2-CD2 4.37Å; L789-L836 HydrophobicContact CD1-CD2 4.13Å; S832-L836 PolarHBondContact O-N 3.36Å; R834-L836 PolarHBondContact O-N 3.23Å; L836-W839 HydrophobicContact CD1-CE3 4.32Å; L836-E840 WeakPolarHBondContact O-CB 3.47Å; L836-E840 PolarHBondContact O-N 3.09Å; L836-E840 VanDerWaalsContact O-N 3.12Å
837	I	90	Very high	80.4	Confident	71 Å²	71	66.3 Å²	66.3	36%	0.364	34%	0.339	S	S	.	.	H	α-helix	trans	-70.2	-42.4	172.5	-66.2	167.1	0	0	0	111.2	F833 R834 Q835 W839 E840 N841	F833-I837 HydrophobicContact CD1-CD1 3.99Å; F833-I837 HydrophobicContact CE1-CD1 3.58Å; F833-I837 HydrophobicContact CZ-CD1 4.01Å; F833-I837 WeakPolarHBondContact O-CG1 3.3Å; F833-I837 PolarHBondContact O-N 3.44Å; R834-I837 PolarHBondContact O-N 3.27Å; R834-I837 VanDerWaalsContact O-N 3.12Å; Q835-I837 VanDerWaalsContact C-N 3.3Å; Q835-I837 PolarHBondContact O-N 3.16Å; I837-W839 PolarHBondContact O-N 2.85Å; I837-E840 PolarHBondContact O-N 3.36Å; I837-N841 WeakPolarHBondContact CG2-ND2 3.16Å; I837-N841 WeakPolarHBondContact O-CB 3.39Å; I837-N841 VanDerWaalsContact O-CG 3.27Å; I837-N841 PolarHBondContact O-N 2.97Å; I837-N841 PolarHBondContact O-ND2 2.97Å; I837-N841 VanDerWaalsContact O-ND2 3.09Å
838	D	89.9	Confident	77.4	Confident	59 Å²	59	70.9 Å²	70.9	32%	0.316	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-41.3	180	-62.8	-31.1	0	0	0	111.3	R834 Q835 N841 Q842	R834-D838 WeakPolarHBondContact CG-OD2 3.49Å; R834-D838 IonicContact NE-OD2 2.74Å; R834-D838 PolarHBondContact O-N 3.06Å; Q835-D838 PolarHBondContact O-N 3.33Å; D838-N841 PolarHBondContact O-N 3.38Å; D838-Q842 VanDerWaalsContact O-CG 3.23Å; D838-Q842 WeakPolarHBondContact O-CG 3.46Å; D838-Q842 PolarHBondContact O-N 3.39Å
839	W	89.8	Confident	74.7	Confident	13 Å²	13	79.4 Å²	79.4	5%	0.049	41%	0.407	C	S	.	.	H	α-helix	trans	-66.3	-44	173.2	-65.3	-38.4	0	0	0	112.3	I743 V776 P792 V831 Q835 L836 I837 N841 Q842 M843	I743-W839 HydrophobicContact CD1-CB 4.28Å; I743-W839 HydrophobicContact CD1-CD2 3.69Å; I743-W839 HydrophobicContact CD1-CE3 4.11Å; I743-W839 HydrophobicContact CD1-CG 3.76Å; V776-W839 HydrophobicContact CG2-CB 4.2Å; V776-W839 HydrophobicContact CG2-CE3 4.33Å; P792-W839 HydrophobicContact CG-CE3 4.17Å; P792-W839 HydrophobicContact CG-CH2 3.51Å; P792-W839 HydrophobicContact CG-CZ2 4.16Å; P792-W839 HydrophobicContact CG-CZ3 3.5Å; P792-W839 VanDerWaalsContact CG-CZ3 3.5Å; V831-W839 HydrophobicContact CB-CH2 4.39Å; V831-W839 HydrophobicContact CG2-CH2 4.09Å; V831-W839 HydrophobicContact CG2-CZ3 3.81Å; Q835-W839 HydrophobicContact CB-CD2 4.35Å; Q835-W839 HydrophobicContact CB-CE3 4.34Å; Q835-W839 HydrophobicContact CB-CH2 4.06Å; Q835-W839 HydrophobicContact CB-CZ2 4.08Å; Q835-W839 HydrophobicContact CB-CZ3 4.2Å; Q835-W839 HydrophobicContact CG-CZ2 4.44Å; Q835-W839 WeakPolarHBondContact O-CB 3.35Å; Q835-W839 VanDerWaalsContact O-CD2 3.26Å; Q835-W839 VanDerWaalsContact O-CG 3.24Å; Q835-W839 PolarHBondContact O-N 2.93Å; L836-W839 HydrophobicContact CD1-CE3 4.32Å; I837-W839 PolarHBondContact O-N 2.85Å; W839-N841 VanDerWaalsContact C-N 3.3Å; W839-N841 PolarHBondContact O-N 2.98Å; W839-Q842 PolarHBondContact O-N 3.39Å; W839-M843 HydrophobicContact CB-CE 4.41Å; W839-M843 VanDerWaalsContact O-CG 3.29Å; W839-M843 WeakPolarHBondContact O-CG 3.4Å; W839-M843 PolarHBondContact O-N 3.41Å
840	E	87.9	Confident	72.2	Confident	76 Å²	76	84.2 Å²	84.2	36%	0.355	43%	0.433	S	S	.	.	H	α-helix	trans	-60.9	-38.3	176.2	175.3	162.4	-157.1	0	0	112.2	K780 L836 I837 S844	K780-E840 IonicContact NZ-OE1 3.76Å; K780-E840 PolarHBondContact NZ-OE1 3.02Å; K780-E840 IonicContact NZ-OE2 3.18Å; K780-E840 PolarHBondContact NZ-OE2 3.38Å; L836-E840 WeakPolarHBondContact O-CB 3.47Å; L836-E840 PolarHBondContact O-N 3.09Å; L836-E840 VanDerWaalsContact O-N 3.12Å; I837-E840 PolarHBondContact O-N 3.36Å; E840-S844 VanDerWaalsContact O-CB 3.24Å; E840-S844 WeakPolarHBondContact O-CB 3.25Å; E840-S844 PolarHBondContact O-N 3.33Å; E840-S844 PolarHBondContact O-OG 3.18Å
841	N	87.6	Confident	69.8	Low	97 Å²	97	92.4 Å²	92.4	52%	0.519	48%	0.475	S	S	.	.	H	α-helix	trans	-67.1	-43.7	174.3	-72.6	-37.1	0	0	0	112.1	I837 D838 W839 S844 S845	I837-N841 WeakPolarHBondContact CG2-ND2 3.16Å; I837-N841 WeakPolarHBondContact O-CB 3.39Å; I837-N841 VanDerWaalsContact O-CG 3.27Å; I837-N841 PolarHBondContact O-N 2.97Å; I837-N841 PolarHBondContact O-ND2 2.97Å; I837-N841 VanDerWaalsContact O-ND2 3.09Å; D838-N841 PolarHBondContact O-N 3.38Å; W839-N841 VanDerWaalsContact C-N 3.3Å; W839-N841 PolarHBondContact O-N 2.98Å; N841-S844 PolarHBondContact O-N 2.93Å; N841-S845 PolarHBondContact O-N 3.27Å; N841-S845 VanDerWaalsContact O-N 3.09Å
842	Q	83.1	Confident	66.9	Low	105 Å²	105	96.2 Å²	96.2	49%	0.491	51%	0.508	S	S	.	.	H	α-helix	trans	-58.4	-49.7	175.4	-73.4	163.8	11.1	0	0	110.9	D838 W839 S844 S845 F846	D838-Q842 VanDerWaalsContact O-CG 3.23Å; D838-Q842 WeakPolarHBondContact O-CG 3.46Å; D838-Q842 PolarHBondContact O-N 3.39Å; W839-Q842 PolarHBondContact O-N 3.39Å; Q842-S844 PolarHBondContact O-N 3.42Å; Q842-S845 WeakPolarHBondContact O-CB 3.31Å; Q842-S845 PolarHBondContact O-N 3.49Å; Q842-S845 VanDerWaalsContact O-N 3.17Å; Q842-S845 PolarHBondContact O-OG 3.38Å; Q842-F846 WeakPolarHBondContact O-CD2 3.46Å
843	M	80.6	Confident	64.1	Low	56 Å²	56	98.9 Å²	98.9	28%	0.276	53%	0.532	S	S	.	.	H	α-helix	trans	-63.7	-40.6	178.6	-67.2	165.6	-176.5	0	0	112.1	I743 D772 V776 W839 S845 F846	I743-M843 HydrophobicContact CD1-CE 3.75Å; D772-M843 HydrophobicContact CB-CE 3.67Å; D772-M843 WeakPolarHBondContact O-CE 3.45Å; V776-M843 HydrophobicContact CB-CE 4.29Å; V776-M843 HydrophobicContact CB-SD 4.03Å; V776-M843 HydrophobicContact CG1-SD 4.35Å; V776-M843 HydrophobicContact CG2-CE 3.64Å; V776-M843 HydrophobicContact CG2-SD 3.96Å; W839-M843 HydrophobicContact CB-CE 4.41Å; W839-M843 VanDerWaalsContact O-CG 3.29Å; W839-M843 WeakPolarHBondContact O-CG 3.4Å; W839-M843 PolarHBondContact O-N 3.41Å; M843-S845 PolarHBondContact O-N 3.36Å; M843-F846 PolarHBondContact O-N 3.33Å
844	S	68.8	Low	61.3	Low	72 Å²	72	97.8 Å²	97.8	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-63.5	-25.9	176	-63.9	0	0	0	0	113.5	E840 N841 Q842 F846	E840-S844 VanDerWaalsContact O-CB 3.24Å; E840-S844 WeakPolarHBondContact O-CB 3.25Å; E840-S844 PolarHBondContact O-N 3.33Å; E840-S844 PolarHBondContact O-OG 3.18Å; N841-S844 PolarHBondContact O-N 2.93Å; Q842-S844 PolarHBondContact O-N 3.42Å; S844-F846 VanDerWaalsContact C-N 3.34Å
845	S	53.6	Low	58.4	Low	85 Å²	85	95.4 Å²	95.4	59%	0.594	55%	0.548	S	S	*	.	H	α-helix	trans	-74.4	-21.1	179.2	75.9	0	0	0	0	113.9	N841 Q842 M843 A847	N841-S845 PolarHBondContact O-N 3.27Å; N841-S845 VanDerWaalsContact O-N 3.09Å; Q842-S845 WeakPolarHBondContact O-CB 3.31Å; Q842-S845 PolarHBondContact O-N 3.49Å; Q842-S845 VanDerWaalsContact O-N 3.17Å; Q842-S845 PolarHBondContact O-OG 3.38Å; M843-S845 PolarHBondContact O-N 3.36Å; S845-A847 VanDerWaalsContact C-N 3.27Å; S845-A847 PolarHBondContact O-N 3.12Å
846	F	45.6	Very low	55.6	Low	178 Å²	178	102.5 Å²	102.5	78%	0.781	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	21.6	177.6	-74.5	-75.3	0	0	0	113.9	Q842 M843 S844 P848	Q842-F846 WeakPolarHBondContact O-CD2 3.46Å; M843-F846 PolarHBondContact O-N 3.33Å; S844-F846 VanDerWaalsContact C-N 3.34Å; F846-P848 WeakPolarHBondContact O-CD 3.33Å
847	A	34.3	Very low	52.9	Low	80 Å²	80	106.7 Å²	106.7	66%	0.661	61%	0.613	S	S	*	*			trans	-112.1	66.1	175.5	0	0	0	0	0	113.2	S845 E849	S845-A847 VanDerWaalsContact C-N 3.27Å; S845-A847 PolarHBondContact O-N 3.12Å; A847-E849 PolarHBondContact O-N 3.24Å
848	P	29.3	Very low	50	Low	96 Å²	96	109.1 Å²	109.1	62%	0.623	63%	0.633	S	S	*	*			trans	-73.4	108.3	177.5	30.9	-34.4	0	0	0	112.3	F846 Q850	F846-P848 WeakPolarHBondContact O-CD 3.33Å; P848-Q850 VanDerWaalsContact C-N 3.26Å; P848-Q850 PolarHBondContact O-N 2.8Å
849	E	29.8	Very low	47.3	Very low	184 Å²	184	114.9 Å²	114.9	86%	0.86	66%	0.663	S	S	*	*	S	Bend	trans	58.2	-14.3	145.9	-56.8	-172.5	132.6	0	0	121.3	A847 I851 A852	A847-E849 PolarHBondContact O-N 3.24Å; E849-I851 PolarHBondContact O-N 3.24Å; E849-A852 PolarHBondContact O-N 3.02Å
850	Q	30.6	Very low	44.6	Very low	188 Å²	188	119.6 Å²	119.6	88%	0.879	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	4.4	-172.6	-72.6	-166.8	-18.3	0	0	116.9	P848	P848-Q850 VanDerWaalsContact C-N 3.26Å; P848-Q850 PolarHBondContact O-N 2.8Å
851	I	31.9	Very low	41.8	Very low	174 Å²	174	121.7 Å²	121.7	89%	0.892	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	4.8	177.3	-58.4	179.5	0	0	0	111.8	E849	E849-I851 PolarHBondContact O-N 3.24Å
852	A	28.9	Very low	39	Very low	96 Å²	96	122.1 Å²	122.1	79%	0.793	73%	0.732	S	S	*	*	S	Bend	trans	-103.3	13.5	-177.5	0	0	0	0	0	115.4	E849	E849-A852 PolarHBondContact O-N 3.02Å
853	A	26.6	Very low	36.5	Very low	95 Å²	95	126.8 Å²	126.8	79%	0.785	75%	0.747	S	S	*	*			trans	-150	65.1	-174.7	0	0	0	0	0	115.4
854	S	30.3	Very low	34.1	Very low	115 Å²	115	131.2 Å²	131.2	80%	0.804	77%	0.768	S	S	*	*			trans	-136.5	107.8	159.6	56.8	0	0	0	0	111.5	L856	S854-L856 PolarHBondContact O-N 3.19Å
855	V	29.3	Very low	32.2	Very low	137 Å²	137	131.4 Å²	131.4	83%	0.83	77%	0.769	S	S	*	*			trans	-81.7	112	-175.9	177.7	0	0	0	0	110
856	L	30.2	Very low	31.3	Very low	168 Å²	168	135.1 Å²	135.1	88%	0.88	78%	0.777	S	S	*	*			trans	-87.8	117.3	158	-77.6	172.1	0	0	0	108.6	S854	S854-L856 PolarHBondContact O-N 3.19Å
857	P	33.5	Very low	30.7	Very low	96 Å²	96	133.5 Å²	133.5	62%	0.623	78%	0.776	S	S	*	*			trans	-74.6	151.7	-174.1	29.9	-35.3	0	0	0	112.4	L859	P857-L859 PolarHBondContact O-N 2.8Å
858	P	28.6	Very low	30.5	Very low	121 Å²	121	134.7 Å²	134.7	79%	0.786	78%	0.78	S	S	*	*			trans	-77.9	114.9	-178.6	30.8	-33.9	0	0	0	111.7	S860	P858-S860 PolarHBondContact O-N 3.09Å; P858-S860 VanDerWaalsContact O-N 3.14Å
859	L	32.6	Very low	30.8	Very low	180 Å²	180	135.6 Å²	135.6	94%	0.942	79%	0.785	S	S	*	*			trans	-80.3	91.3	168.8	-79.1	171.5	0	0	0	110.7	P857	P857-L859 PolarHBondContact O-N 2.8Å
860	S	33.7	Very low	30.9	Very low	112 Å²	112	138.6 Å²	138.6	78%	0.783	79%	0.789	S	S	*	*			trans	-75.7	149	170.9	52.1	0	0	0	0	112.1	P858	P858-S860 PolarHBondContact O-N 3.09Å; P858-S860 VanDerWaalsContact O-N 3.14Å
861	S	27.9	Very low	31.1	Very low	121 Å²	121	134.3 Å²	134.3	85%	0.846	78%	0.78	S	S	*	*			trans	-81.4	138.1	-172.5	175.8	0	0	0	0	114.3
862	S	29.6	Very low	30.9	Very low	105 Å²	105	131.9 Å²	131.9	73%	0.734	77%	0.773	S	S	*	*			trans	179.9	153.8	145.5	43.9	0	0	0	0	108.9
863	Y	30	Very low	31	Very low	204 Å²	204	132.7 Å²	132.7	80%	0.8	77%	0.772	S	S	*	*			cis	-159.2	149.3	4.8	-143	-137.2	0	0	0	111
864	M	30.1	Very low	31.2	Very low	148 Å²	148	136.7 Å²	136.7	73%	0.729	77%	0.774	S	S	*	*			trans	61.6	152.7	153.4	-75.4	-174.7	76.8	0	0	120.1
865	S	30.5	Very low	31.3	Very low	76 Å²	76	140.1 Å²	140.1	53%	0.531	78%	0.778	S	S	.	*			cis	-166.8	167.5	-8.4	45.6	0	0	0	0	112.5
866	H	33.6	Very low	31.6	Very low	163 Å²	163	140.5 Å²	140.5	76%	0.755	77%	0.774	S	S	*	*			trans	71.1	142.7	165.2	-59	-60.3	0	0	0	117.2
867	L	32.8	Very low	31.8	Very low	144 Å²	144	138.2 Å²	138.2	75%	0.754	77%	0.769	S	S	*	*			cis	-156.7	130.9	7.2	-125.5	164.9	0	0	0	114.4
868	S	31.6	Very low	31.7	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	78%	0.778	S	S	*	*			trans	71.9	155.3	148.9	64.8	0	0	0	0	123.8
869	P	35.3	Very low	31.9	Very low	115 Å²	115	142.5 Å²	142.5	75%	0.747	78%	0.78	S	S	*	*			trans	-139.7	170.9	-156	43.5	-24.7	0	0	0	118.9
870	R	31.4	Very low	32	Very low	246 Å²	246	138.3 Å²	138.3	93%	0.928	77%	0.765	S	S	*	*			trans	167.2	152.5	150.6	-93.4	154	-175	-168.3	1.5	108.3
871	S	34.5	Very low	31.9	Very low	98 Å²	98	138.5 Å²	138.5	69%	0.685	76%	0.762	S	S	*	*			cis	-155.7	127.3	-0.9	47.9	0	0	0	0	109.1
872	T	27.8	Very low	32	Very low	124 Å²	124	140 Å²	140	76%	0.761	76%	0.757	S	S	*	*				79.2	109.2	94	-46.8	0	0	0	0	116.6
873	C	31.7	Very low	32	Very low	113 Å²	113	139.1 Å²	139.1	76%	0.764	75%	0.748	S	S	*	*			trans	154.5	107.2	152.3	-82.5	0	0	0	0	106.5
874	Q	30.6	Very low	32.2	Very low	179 Å²	179	136.2 Å²	136.2	84%	0.836	74%	0.741	S	S	*	*				58.6	129	74.3	-66.2	-178.9	-49.8	0	0	112.4
875	E	31.7	Very low	32.4	Very low	187 Å²	187	136.7 Å²	136.7	87%	0.874	74%	0.742	S	S	*	*			cis	-135.7	157	28.1	-59	178.3	137.3	0	0	115.5
876	I	35.1	Very low	32.5	Very low	145 Å²	145	139.1 Å²	139.1	74%	0.744	75%	0.753	S	S	*	*			trans	-152.9	143.6	158.4	-29.5	173.1	0	0	0	107.8	K878	I876-K878 HydrophobicContact CG2-CG 4.33Å
877	P	35.5	Very low	32.3	Very low	120 Å²	120	136.9 Å²	136.9	78%	0.779	76%	0.756	S	S	*	*				-142.2	154.5	109.9	36.6	-22.9	0	0	0	112.6
878	K	30.7	Very low	32.3	Very low	190 Å²	190	133.8 Å²	133.8	83%	0.826	76%	0.759	S	S	*	*			cis	78.9	107	30.7	-76.5	-166.9	172.4	-177.7	0	117.1	I876	I876-K878 HydrophobicContact CG2-CG 4.33Å
879	S	33.7	Very low	32.1	Very low	117 Å²	117	133.5 Å²	133.5	82%	0.818	76%	0.763	S	S	*	*			trans	-166.3	141.3	161.2	-172.4	0	0	0	0	107.3
880	S	34.2	Very low	31.9	Very low	91 Å²	91	137.5 Å²	137.5	64%	0.636	77%	0.772	S	S	*	*			cis	-168.8	112.7	-20.8	41.5	0	0	0	0	108.4
881	T	31.3	Very low	31.8	Very low	116 Å²	116	134.8 Å²	134.8	71%	0.712	77%	0.769	S	S	*	*				82.8	146.2	95.3	-22.5	0	0	0	0	116.2
882	M	30.7	Very low	31.6	Very low	152 Å²	152	139.4 Å²	139.4	75%	0.749	78%	0.78	S	S	*	*			trans	78	137.7	161.1	-61.5	-71.3	98.8	0	0	119.1
883	T	30.4	Very low	31.6	Very low	88 Å²	88	142.5 Å²	142.5	54%	0.54	79%	0.786	S	S	.	*			cis	-168.8	163.2	-29.8	0.6	0	0	0	0	114
884	H	34.4	Very low	31.5	Very low	142 Å²	142	140.3 Å²	140.3	66%	0.657	78%	0.783	S	S	*	*			trans	64.1	118	148	-63.2	-48.4	0	0	0	123.7
885	H	32.8	Very low	31.4	Very low	159 Å²	159	142.4 Å²	142.4	74%	0.736	78%	0.783	S	S	*	*				57	155.1	127.1	-52.2	-45.8	0	0	0	121.4
886	T	32.1	Very low	31.3	Very low	127 Å²	127	139.4 Å²	139.4	78%	0.779	78%	0.777	S	S	*	*			cis	-144.6	160.7	13.8	-21	0	0	0	0	112.7
887	S	31.2	Very low	31	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	78%	0.779	S	S	*	*			trans	-27.9	138.3	170.7	54.3	0	0	0	0	120.4
888	G	31.6	Very low	30.8	Very low	80 Å²	80	142.3 Å²	142.3	83%	0.825	78%	0.776	S	S	*	*			trans	-158.7	130	149.3	0	0	0	0	0	107.7
889	A	27.9	Very low	31	Very low	99 Å²	99	138.9 Å²	138.9	82%	0.818	77%	0.774	S	S	*	*			trans	-130.4	129.6	-165.9	0	0	0	0	0	112.9
890	E	31.1	Very low	30.9	Very low	200 Å²	200	140 Å²	140	94%	0.935	78%	0.776	S	S	*	*			trans	-135.8	149.1	160.6	-66.8	-168.7	144.6	0	0	108.3
891	H	28.7	Very low	30.8	Very low	188 Å²	188	140.7 Å²	140.7	87%	0.87	78%	0.778	S	S	*	*			trans	-92.3	136.3	-176.9	-89.5	-117.4	0	0	0	111.3
892	E	30.5	Very low	31	Very low	196 Å²	196	142.1 Å²	142.1	92%	0.916	78%	0.781	S	S	*	*			trans	-147.2	132.5	158.8	-149.9	175.6	-147.2	0	0	110.5	G894	E892-G894 PolarHBondContact O-N 2.83Å
893	E	27.2	Very low	30.8	Very low	188 Å²	188	140.5 Å²	140.5	88%	0.879	78%	0.78	S	S	*	*			trans	-90.6	88.3	-167.1	-66.3	-167.8	129	0	0	113.6	R895	E893-R895 PolarHBondContact O-N 2.98Å; E893-R895 VanDerWaalsContact O-N 3.14Å
894	G	30.8	Very low	31	Very low	68 Å²	68	141.4 Å²	141.4	70%	0.701	79%	0.787	S	S	*	*			trans	-76.3	92	175.7	0	0	0	0	0	114.1	E892 V896	E892-G894 PolarHBondContact O-N 2.83Å; G894-V896 PolarHBondContact O-N 3.02Å
895	R	27.1	Very low	30.7	Very low	222 Å²	222	146.8 Å²	146.8	84%	0.838	80%	0.802	S	S	*	*			trans	-69.8	79.1	178.3	-167.5	-178.3	-172.3	175.3	5.8	113.6	E893 R897	E893-R895 PolarHBondContact O-N 2.98Å; E893-R895 VanDerWaalsContact O-N 3.14Å; R895-R897 PolarHBondContact O-N 3.32Å
896	V	30.3	Very low	30.6	Very low	124 Å²	124	144.5 Å²	144.5	75%	0.752	80%	0.804	S	S	*	*			trans	-72.3	108	173.2	-179.7	0	0	0	0	110.6	G894 T898	G894-V896 PolarHBondContact O-N 3.02Å; V896-T898 PolarHBondContact O-N 3.28Å
897	R	29.5	Very low	30.4	Very low	207 Å²	207	145.4 Å²	145.4	78%	0.781	81%	0.809	S	S	*	*			trans	-77.5	114.6	163.5	-82.7	-175.8	168.6	179.2	-3.8	109.5	R895	R895-R897 PolarHBondContact O-N 3.32Å
898	T	30.8	Very low	30.4	Very low	119 Å²	119	145.4 Å²	145.4	73%	0.73	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-75.8	152.8	167.6	43.9	0	0	0	0	111.3	V896	V896-T898 PolarHBondContact O-N 3.28Å
899	P	34.5	Very low	30.3	Very low	119 Å²	119	145.8 Å²	145.8	77%	0.773	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.3	150.4	169.3	-16.6	31.1	0	0	0	111.8
900	T	32.3	Very low	30.5	Very low	141 Å²	141	148.2 Å²	148.2	87%	0.865	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-67.5	135.6	175.3	33.7	0	0	0	0	111.8
901	P	31.9	Very low	30.3	Very low	104 Å²	104	145.7 Å²	145.7	68%	0.675	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-98.3	154.3	-172.1	37.1	-36.2	0	0	0	115.3
902	N	34.5	Very low	30.3	Very low	146 Å²	146	141.6 Å²	141.6	78%	0.781	79%	0.785	S	S	*	*			trans	73.2	99.6	150.6	-58.1	-17.7	0	0	0	120.6
903	T	27.6	Very low	30.2	Very low	118 Å²	118	143.4 Å²	143.4	72%	0.724	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-71.7	124.7	130.5	46.2	0	0	0	0	110.2
904	P	34.3	Very low	30.3	Very low	107 Å²	107	140.3 Å²	140.3	70%	0.695	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-93.7	129.8	175.7	33.7	-30.5	0	0	0	112.4
905	R	28.7	Very low	30.1	Very low	256 Å²	256	141.6 Å²	141.6	97%	0.966	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-99.5	138.2	164	-108.6	-179.4	174.9	150.1	-1.1	109.7
906	S	29.3	Very low	30.2	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-94.2	145.2	-176.8	49	0	0	0	0	113.4
907	V	29.4	Very low	30.1	Very low	147 Å²	147	136.1 Å²	136.1	89%	0.891	78%	0.777	S	S	*	*			trans	-137.6	139.5	155.7	-178.5	0	0	0	0	106.9
908	C	30	Very low	30	Very low	114 Å²	114	136.9 Å²	136.9	77%	0.77	78%	0.78	S	S	*	*			trans	-96.9	179.5	-165	-57.5	0	0	0	0	114.4
909	A	30.5	Very low	29.8	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	78%	0.775	S	S	*	*			trans	100.6	138.8	154.3	0	0	0	0	0	117.3
910	I	30.7	Very low	29.6	Very low	150 Å²	150	136.6 Å²	136.6	77%	0.769	78%	0.775	S	S	*	*			cis	-154.4	156	-9.2	-119.8	166.1	0	0	0	110.5
911	L	27.3	Very low	29.5	Very low	148 Å²	148	134.4 Å²	134.4	78%	0.775	77%	0.77	S	S	*	*			trans	1.6	141.6	159.5	-45	169.6	0	0	0	118.4
912	S	29.6	Very low	29.5	Very low	102 Å²	102	133.4 Å²	133.4	71%	0.713	77%	0.771	S	S	*	*				-170.7	148.3	54.9	-57.9	0	0	0	0	115.1
913	R	28.8	Very low	29.3	Very low	233 Å²	233	133.3 Å²	133.3	88%	0.879	77%	0.771	S	S	*	*			trans	44.1	106.9	140.8	-65.8	-174.3	179.9	-145.3	-3.5	119.6
914	T	28.5	Very low	29.6	Very low	124 Å²	124	134.8 Å²	134.8	76%	0.761	77%	0.769	S	S	*	*				86.5	97	64.1	62.1	0	0	0	0	117.4
915	A	27.6	Very low	29.5	Very low	95 Å²	95	136.3 Å²	136.3	79%	0.785	77%	0.767	S	S	*	*				85.1	169.4	115.5	0	0	0	0	0	122.8
916	V	28.2	Very low	29.8	Very low	131 Å²	131	131.9 Å²	131.9	79%	0.794	76%	0.759	S	S	*	*			trans	99	80.6	159.5	-164.4	0	0	0	0	119.1
917	S	27.5	Very low	29.9	Very low	99 Å²	99	131.2 Å²	131.2	69%	0.692	75%	0.754	S	S	*	*				108.6	147.4	116.3	79.4	0	0	0	0	123.1
918	R	27.6	Very low	30.1	Very low	224 Å²	224	130.5 Å²	130.5	85%	0.845	75%	0.75	S	S	*	*			trans	71.8	109.1	152.3	-77.3	173	176.9	166.3	-0.7	120.8
919	S	27.2	Very low	30.3	Very low	90 Å²	90	130.1 Å²	130.1	63%	0.629	75%	0.747	S	S	*	*				44	146.9	107.6	79.3	0	0	0	0	119.3
920	D	31.3	Very low	30.5	Very low	142 Å²	142	133.5 Å²	133.5	76%	0.759	75%	0.753	S	S	*	*			cis	-149.4	158	32.1	-88.1	-74.2	0	0	0	115.7
921	A	29.4	Very low	30.6	Very low	94 Å²	94	129 Å²	129	78%	0.777	75%	0.745	S	S	*	*			trans	43.6	145.8	141.5	0	0	0	0	0	126.2
922	A	31.4	Very low	31	Very low	84 Å²	84	130 Å²	130	69%	0.694	75%	0.75	S	S	*	*			trans	87.2	99.2	140.1	0	0	0	0	0	122.4
923	D	29.9	Very low	31	Very low	144 Å²	144	133.3 Å²	133.3	77%	0.77	75%	0.754	S	S	*	*				41.7	135.5	120.6	-45	-17.4	0	0	0	123.7
924	H	35.4	Very low	31.3	Very low	148 Å²	148	128 Å²	128	69%	0.685	75%	0.747	S	S	*	*				-178.2	124.3	95.1	-110.6	17.2	0	0	0	116.8
925	Q	31	Very low	31.5	Very low	139 Å²	139	129.3 Å²	129.3	65%	0.65	75%	0.745	S	S	*	*				70.6	158.4	127.8	-71.2	-170	15	0	0	126.5
926	M	34.4	Very low	31.7	Very low	163 Å²	163	130.4 Å²	130.4	80%	0.803	74%	0.737	S	S	*	*			trans	78.1	140	162.4	-64.2	-71.1	175	0	0	118.6
927	S	31.9	Very low	31.9	Very low	96 Å²	96	129.5 Å²	129.5	67%	0.671	74%	0.737	S	S	*	*			cis	-171.2	157.4	-18.1	-168.3	0	0	0	0	111.7
928	V	33.1	Very low	32.1	Very low	133 Å²	133	129.5 Å²	129.5	81%	0.806	74%	0.737	S	S	*	*			trans	147.6	116.8	136.9	168.5	0	0	0	0	113.7
929	C	34.3	Very low	32.2	Very low	105 Å²	105	127.9 Å²	127.9	71%	0.709	74%	0.739	S	S	*	*			trans	-24.6	158.1	160.5	-62.9	0	0	0	0	119
930	N	35.3	Very low	32.1	Very low	159 Å²	159	129.6 Å²	129.6	85%	0.85	75%	0.749	S	S	*	*			cis	-163.5	-177.8	1	-109.2	15.7	0	0	0	107.6
931	G	32.2	Very low	31.9	Very low	57 Å²	57	127.8 Å²	127.8	59%	0.588	75%	0.754	S	S	*	*			cis	153.5	171.6	3.1	0	0	0	0	0	110.2
932	L	36	Very low	31.8	Very low	169 Å²	169	127.3 Å²	127.3	89%	0.885	76%	0.759	S	S	*	*			trans	66	92.6	-171.4	-55.7	177.6	0	0	0	113.5
933	E	30.9	Very low	31.7	Very low	170 Å²	170	128.5 Å²	128.5	79%	0.794	76%	0.762	S	S	*	*			cis	72.6	134.1	26.7	-145.4	-177.5	-86.2	0	0	113
934	V	33.9	Very low	31.6	Very low	123 Å²	123	129.4 Å²	129.4	75%	0.745	77%	0.766	S	S	*	*			cis	-105.4	-151.8	4.7	-135.7	0	0	0	0	110
935	E	32.9	Very low	31.5	Very low	150 Å²	150	128.6 Å²	128.6	70%	0.701	77%	0.766	S	S	*	*			cis	-151.5	160.1	5.4	-143.7	-176.3	-46.9	0	0	111.8
936	N	32.6	Very low	31.6	Very low	119 Å²	119	127.1 Å²	127.1	64%	0.636	77%	0.769	S	S	*	*			trans	44.9	91.6	159	-61	-23.3	0	0	0	122.1
937	S	31.6	Very low	31.7	Very low	111 Å²	111	126.9 Å²	126.9	78%	0.776	77%	0.765	S	S	*	*			trans	68	137.2	130.1	62.7	0	0	0	0	121.2
938	S	31.3	Very low	32	Very low	99 Å²	99	130 Å²	130	69%	0.692	78%	0.775	S	S	*	*			cis	-167.4	145.8	-11.8	46.5	0	0	0	0	112.1
939	E	29.7	Very low	31.9	Very low	191 Å²	191	131.1 Å²	131.1	89%	0.893	78%	0.775	S	S	*	*			trans	69.5	150.4	156.9	-67.7	-175.9	146.9	0	0	120.3
940	C	25.7	Very low	31.9	Very low	126 Å²	126	133.4 Å²	133.4	85%	0.851	78%	0.777	S	S	*	*			trans	-110	-171.1	-172.6	-66.4	0	0	0	0	111
941	A	27.3	Very low	32	Very low	103 Å²	103	133 Å²	133	85%	0.851	78%	0.775	S	S	*	*			trans	78.2	143.1	164.7	0	0	0	0	0	116.3
942	G	27	Very low	32	Very low	85 Å²	85	141 Å²	141	88%	0.876	79%	0.794	S	S	*	*			trans	-84.3	148.2	-177.7	0	0	0	0	0	112.5
943	S	29	Very low	31.8	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	78%	0.784	S	S	*	*			trans	-128.3	144.1	167.3	54	0	0	0	0	109.8
944	L	27.7	Very low	31.9	Very low	163 Å²	163	138.8 Å²	138.8	85%	0.853	79%	0.787	S	S	*	*			trans	-65.2	133.7	164.6	-80.2	68.3	0	0	0	107.3	P946	L944-P946 WeakPolarHBondContact O-CD 3.23Å
945	N	34	Very low	32	Very low	130 Å²	130	140.8 Å²	140.8	70%	0.695	79%	0.792	S	S	*	*			trans	-69	109.1	179.7	-169.2	-3	0	0	0	110	H947	N945-H947 VanDerWaalsContact C-N 3.32Å; N945-H947 PolarHBondContact O-N 2.71Å
946	P	32.1	Very low	31.9	Very low	108 Å²	108	142.3 Å²	142.3	70%	0.701	80%	0.804	S	S	*	*			trans	-90.5	64.5	-163.7	36.7	-33.4	0	0	0	111.3	L944	L944-P946 WeakPolarHBondContact O-CD 3.23Å
947	H	37	Very low	31.9	Very low	158 Å²	158	141.3 Å²	141.3	73%	0.731	81%	0.813	S	S	*	*			trans	-113.2	-3.8	-178	-123	-70.8	0	0	0	115.4	N945 L949	N945-H947 VanDerWaalsContact C-N 3.32Å; N945-H947 PolarHBondContact O-N 2.71Å; H947-L949 PolarHBondContact O-N 3.03Å
948	D	38.9	Very low	31.9	Very low	162 Å²	162	141.9 Å²	141.9	87%	0.866	82%	0.816	S	S	*	*	S	Bend	trans	-81.5	12.5	175.7	-69.9	-44.5	0	0	0	114.2
949	L	31.4	Very low	32.2	Very low	156 Å²	156	142.9 Å²	142.9	82%	0.817	82%	0.823	S	S	*	*			trans	-123.9	46	-172.2	-79	173.7	0	0	0	114.5	H947	H947-L949 PolarHBondContact O-N 3.03Å
950	M	33.4	Very low	32.5	Very low	153 Å²	153	143 Å²	143	75%	0.754	82%	0.824	S	S	*	*	S	Bend	trans	-149.5	57.9	172.4	-160.4	67.4	75.4	0	0	114.9
951	N	37.5	Very low	33.1	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	82%	0.82	S	S	*	*	S	Bend	trans	-153.6	1.2	162.9	-103.9	-39.5	0	0	0	116.4	S953	N951-S953 VanDerWaalsContact C-N 3.31Å; N951-S953 PolarHBondContact O-N 2.98Å
952	F	33	Very low	33.5	Very low	225 Å²	225	146.2 Å²	146.2	99%	0.987	83%	0.825	S	S	*	*	S	Bend	trans	-90	31.9	-175.4	-111	-81	0	0	0	114.7
953	S	30.2	Very low	34	Very low	95 Å²	95	145.9 Å²	145.9	66%	0.664	82%	0.822	S	S	*	*	S	Bend	trans	-128.5	17.9	-167.8	57.1	0	0	0	0	115.8	N951	N951-S953 VanDerWaalsContact C-N 3.31Å; N951-S953 PolarHBondContact O-N 2.98Å
954	K	34.7	Very low	34.4	Very low	197 Å²	197	149.7 Å²	149.7	86%	0.857	83%	0.827	S	S	*	*	S	Bend	trans	-129.5	20.4	-173.8	-87.7	-172.8	174.4	178.1	0	116.7
955	L	34.6	Very low	35	Very low	165 Å²	165	151.4 Å²	151.4	86%	0.864	83%	0.831	S	S	*	*	S	Bend	trans	-134.2	8	-173.7	-116	163.1	0	0	0	116.4
956	L	31.7	Very low	35.2	Very low	182 Å²	182	149 Å²	149	95%	0.953	84%	0.837	S	S	*	*	S	Bend	trans	-143	56.7	178.4	-71.3	176.3	0	0	0	112.1
957	A	31.6	Very low	35.4	Very low	98 Å²	98	147.8 Å²	147.8	81%	0.81	84%	0.844	S	S	*	*			trans	-144.1	54.3	-176.1	0	0	0	0	0	113.4
958	S	33.1	Very low	35.1	Very low	122 Å²	122	148.3 Å²	148.3	85%	0.853	85%	0.851	S	S	*	*			trans	-159	52	175.1	66.5	0	0	0	0	114.6
959	S	36	Very low	34.9	Very low	120 Å²	120	151.3 Å²	151.3	84%	0.839	85%	0.85	S	S	*	*			trans	-159.3	112.6	161.6	57	0	0	0	0	110.5
960	E	36.7	Very low	35.3	Very low	194 Å²	194	155.8 Å²	155.8	91%	0.907	87%	0.867	S	S	*	*			trans	-89.7	177	171	-62.7	178.8	133.2	0	0	110.8
961	A	38.1	Very low	35.4	Very low	93 Å²	93	156 Å²	156	77%	0.769	87%	0.873	S	S	*	*			trans	79.6	90	173.7	0	0	0	0	0	118.4
962	E	36.8	Very low	35.3	Very low	204 Å²	204	156.2 Å²	156.2	95%	0.953	88%	0.876	S	S	*	*				51.8	130.6	127.7	-60.6	178.8	-173.9	0	0	121.8
963	G	36.8	Very low	35.4	Very low	78 Å²	78	152.3 Å²	152.3	80%	0.804	87%	0.87	S	S	*	*			trans	162	99.9	169.7	0	0	0	0	0	113.6
964	E	37.3	Very low	35.7	Very low	189 Å²	189	155.7 Å²	155.7	88%	0.883	88%	0.882	S	S	*	*			trans	-62	161.5	-168	-62.4	176.3	123.9	0	0	118.3
965	E	39.4	Very low	35.8	Very low	199 Å²	199	153.1 Å²	153.1	93%	0.93	88%	0.884	S	S	*	*			trans	56.3	123.6	159.5	-65	-167.3	152.2	0	0	121
966	G	38.8	Very low	35.9	Very low	80 Å²	80	152.3 Å²	152.3	83%	0.825	89%	0.885	S	S	*	*			trans	-175.5	11.1	177.4	0	0	0	0	0	121.1
967	G	37.3	Very low	36.2	Very low	82 Å²	82	150.2 Å²	150.2	85%	0.845	88%	0.88	S	S	*	*			trans	37.3	95.4	164.1	0	0	0	0	0	120.8
968	L	29.8	Very low	36.6	Very low	168 Å²	168	154.2 Å²	154.2	88%	0.88	89%	0.885	S	S	*	*			trans	-77.8	145.8	166.2	-107.3	164.6	0	0	0	112.8
969	R	35.4	Very low	36.8	Very low	225 Å²	225	156.9 Å²	156.9	85%	0.849	89%	0.888	S	S	*	*			trans	-151.7	128.3	157.8	-109	-170.1	-177	-140	-1.4	112.8
970	E	39.7	Very low	36.9	Very low	251 Å²	251	160.3 Å²	160.3	100%	1.173	89%	0.892	S	S	*	*			trans	52.3	0	169.1	-66.3	176.3	-170.8	0	0	116.6

Retrieved 970 of 970 residues in 448.6 ms (Link to these results)

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