A0A077ZA16_TRITR Loading...

Semaphorin 5B

AlphaFold DB , UniProt , Accession A0A077ZA16, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,160 aa.

						>A0A077ZA16_TRITR|A0A077ZA16
MVAVTALAPSQLDRSVGKPESICQLTYALLVSCVSVMGRYAYWVSVPRLLLLLISVDRRLSLTAYDGSLRVSYDELLRNASRFEMTGVTDFKALMFDSPRNQIIVGARDVVFRIHQDTMVTLERLDLPAPMSKIDRCQMLGRPAEVCHNFIRVLAPEPGGQQVLVCGTDAFKPSCSIRQMNDLRKGTPLSQEGIGFVPYDPEYNFTYVADINGQFFAGIPLDFTGDDFAIVRIRPVDMLLRTRRPGRTLLYGDFPFTLFSLLLVNHFWLLSDPTFVAAYEIGEFIYFFFHETAIEDIAFEQPDRRSRFFARDTYSRVARVCKDEPGPTKSSDDMWFTTFSKARLVCITAGGQLFDNVQSVDFVREEGLFYAVFTASKRHIMGSAICHYKLTDIEAVFKGPALFKGEGSTCWLSRPNPSPDHVVSSRRVFPYRILLRCLRYGNYDRYSNQKYIMEKAVLPLLNRSLRDVQSDQYVKIAVDSVEVRNVGTAYVLFVLEASGTLKKYSHLPEEKELCLLEVIELKKESDNVRIFNMQLHKEKRALFFTMDKRLLRIPLERCSRHASEERCIGAKDPYCGWSRATKRCTATRGPLDPDHEWVQLIDGCPTMRFPVHGQYGPWSEWTVCSWKPTYSENCLCRVRNCDSPAPKFGGRQCEGPKIEVNNCTVHGRWTGWGIWSSCSATCGISSRHRYRYCSNPAPDYGGRPCSGPGVQHEYCDVPPCPTSNIVPAPLRRNGQWSAWTPWKPCSKKCGGGFRKRTRSCDNPSPMNGGDNCLGSSQEFESCGDQQCEEVVRVSEWTQWGKIDETSSGGLLHQRYRFSCSARLPNPDDLVMKPLTVEEKVCAPWITNCADLSISPAASSAHWSVWSEWSVCTRVCGSGTQNRQRLCMSTNVEETGPIRCIGPTKETRLCNVKPCTGTQVDFNTLSRDPTSSWSCWSDFTECSATCGEAVKQRWRVCNGAQECVGESQQTIACRLRECPAGEESTTWSAWSKCNELNLRVRMQVCPNMEVCGDEPDFEIQRCGIGDEDVEGVAGNAMHIRQSRQDNTMLLIVSVIGSIIIVVLLVLLFVCCARVFPGVCGRCCLVRKRGDIPQRPSTPSTKFNIYTPPPSLRNGRSQTPNLIMNPLSRFSAKDELEGLTEEETALTLKRNMLTSLNTKDYM
					

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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	32.2	Very low	36.1	Very low	208 Å²	208	129.2 Å²	129.2	100%	1.025	79%	0.794	S	S	*	*				0	145.3	0	-68.4	-179.3	-177.8	0	0	107.7
2	V	33.7	Very low	36	Very low	147 Å²	147	130 Å²	130	89%	0.891	79%	0.788	S	S	*	*			trans	61	129.6	173	-163.8	0	0	0	0	115.4
3	A	33	Very low	35.9	Very low	78 Å²	78	128.1 Å²	128.1	65%	0.645	77%	0.771	S	S	*	*			cis	164.7	144.9	-31	0	0	0	0	0	106.5
4	V	35.3	Very low	35.5	Very low	133 Å²	133	134.4 Å²	134.4	81%	0.806	77%	0.774	S	S	*	*			trans	69.7	130.3	141	163.2	0	0	0	0	116.6
5	T	36	Very low	35.4	Very low	127 Å²	127	133.6 Å²	133.6	78%	0.779	78%	0.78	S	S	*	*			cis	-170.6	170.7	4.8	21.5	0	0	0	0	107.6
6	A	37.5	Very low	35.1	Very low	82 Å²	82	134.4 Å²	134.4	68%	0.678	79%	0.787	S	S	*	*			cis	-169.3	-168.4	-7.9	0	0	0	0	0	109.5
7	L	36.7	Very low	34.9	Very low	182 Å²	182	131.1 Å²	131.1	95%	0.953	79%	0.788	S	S	*	*			trans	86.3	122	163	-56.6	176.4	0	0	0	118.2
8	A	36.4	Very low	34.6	Very low	94 Å²	94	135.1 Å²	135.1	78%	0.777	79%	0.793	S	S	*	*			trans	-122	-150.9	-174.3	0	0	0	0	0	108.1
9	P	42.3	Very low	34.8	Very low	114 Å²	114	133.9 Å²	133.9	74%	0.74	79%	0.79	S	S	*	*			cis	-121.5	-178.2	-13.9	20.3	6.7	0	0	0	111.9
10	S	37.6	Very low	34.7	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	80%	0.798	S	S	*	*				-166.7	125.9	53.8	57.2	0	0	0	0	112.3
11	Q	36.6	Very low	34.5	Very low	151 Å²	151	135.2 Å²	135.2	71%	0.706	79%	0.79	S	S	*	*				75	129.7	92.3	-63.2	-96.4	-27.9	0	0	113.4
12	L	35.2	Very low	34.4	Very low	139 Å²	139	132.7 Å²	132.7	73%	0.728	78%	0.779	S	S	*	*			cis	-145.8	169.1	2.3	-66	101.1	0	0	0	108.5
13	D	34.2	Very low	34.1	Very low	105 Å²	105	130.1 Å²	130.1	56%	0.561	77%	0.767	S	S	*	*			cis	-154.2	155.7	-20.5	-117.1	20.9	0	0	0	108
14	R	30.4	Very low	34.1	Very low	217 Å²	217	134.6 Å²	134.6	82%	0.819	77%	0.774	S	S	*	*				55.8	128.6	82.6	-51.8	-177.8	170.9	-176.2	-3	114.5
15	S	33.4	Very low	33.9	Very low	122 Å²	122	134.8 Å²	134.8	85%	0.853	77%	0.77	S	S	*	*			cis	-138.5	159	47	54.2	0	0	0	0	116.6
16	V	31.7	Very low	33.7	Very low	147 Å²	147	134.2 Å²	134.2	89%	0.891	77%	0.767	S	S	*	*			trans	-115.9	149.6	-179.9	170.1	0	0	0	0	109.8
17	G	30.8	Very low	33.6	Very low	78 Å²	78	141.3 Å²	141.3	80%	0.804	78%	0.777	S	S	*	*			trans	-155.9	119.7	170.5	0	0	0	0	0	112.5
18	K	29.6	Very low	33.6	Very low	203 Å²	203	136.2 Å²	136.2	88%	0.883	76%	0.762	S	S	*	*			trans	-100.6	176.3	179.2	-114.1	-167.7	176.7	179.4	0	110.6
19	P	39.7	Very low	33.3	Very low	113 Å²	113	139.5 Å²	139.5	73%	0.734	77%	0.765	S	S	*	*			trans	-88.5	158.2	-156.7	36.8	-38.5	0	0	0	114
20	E	32.7	Very low	33	Very low	203 Å²	203	142 Å²	142	95%	0.949	77%	0.772	S	S	*	*			trans	-155.9	168.1	153.3	-120.8	162.2	-141.2	0	0	110.8
21	S	30.1	Very low	33.2	Very low	92 Å²	92	143.5 Å²	143.5	64%	0.643	78%	0.776	S	S	*	*			trans	-126.3	168.4	-162.2	61.8	0	0	0	0	112.9
22	I	28.6	Very low	33	Very low	154 Å²	154	141.1 Å²	141.1	79%	0.79	78%	0.776	S	S	*	*			trans	87.1	144.8	159.3	-62.6	159.8	0	0	0	117.2
23	C	28.5	Very low	32.8	Very low	94 Å²	94	140 Å²	140	64%	0.635	78%	0.779	S	S	*	*			trans	91.3	106.4	162	-88.5	0	0	0	0	120.9
24	Q	33.4	Very low	33	Very low	171 Å²	171	141.7 Å²	141.7	80%	0.799	79%	0.792	S	S	*	*				69.3	153.7	128.3	-64.1	-174.6	3.2	0	0	119.5
25	L	31.5	Very low	33.1	Very low	137 Å²	137	136.1 Å²	136.1	72%	0.717	79%	0.787	S	S	*	*			cis	-180	126.7	-35.1	-125.8	163.8	0	0	0	103.1
26	T	30.6	Very low	33.3	Very low	115 Å²	115	136 Å²	136	71%	0.706	78%	0.781	S	S	*	*			trans	45.2	125.3	154.1	48.9	0	0	0	0	121.4
27	Y	36.1	Very low	33.4	Very low	231 Å²	231	137.8 Å²	137.8	91%	0.906	78%	0.782	S	S	*	*				-148.6	124.8	126.9	-119.3	-84.6	0	0	0	112.2
28	A	35.8	Very low	33.5	Very low	75 Å²	75	137.5 Å²	137.5	62%	0.62	78%	0.779	S	S	*	*			trans	21.6	125.9	155	0	0	0	0	0	120.8
29	L	31.5	Very low	33.8	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	78%	0.777	S	S	*	*				49.7	110.2	71.8	-75.5	171.9	0	0	0	114.9
30	L	36	Very low	33.3	Very low	168 Å²	168	143.3 Å²	143.3	88%	0.88	78%	0.782	S	S	*	*				178.1	157.9	123.2	-96.7	164.9	0	0	0	113.3
31	V	40	Very low	33.5	Very low	136 Å²	136	137.3 Å²	137.3	82%	0.824	77%	0.767	S	S	*	*			trans	78.2	108.3	169	-159.4	0	0	0	0	118.6
32	S	33.4	Very low	33.5	Very low	100 Å²	100	143 Å²	143	70%	0.699	78%	0.776	S	S	*	*			trans	-111.2	175.4	166.8	55.8	0	0	0	0	111.2
33	C	31.7	Very low	33.8	Very low	116 Å²	116	147.6 Å²	147.6	78%	0.784	78%	0.783	S	S	*	*			trans	75.7	143.6	177.5	-50.5	0	0	0	0	113.6
34	V	37.8	Very low	34.1	Very low	140 Å²	140	149 Å²	149	85%	0.848	79%	0.789	S	S	*	*			cis	-136.7	154.9	23.3	174.5	0	0	0	0	111.2
35	S	32.5	Very low	34.3	Very low	101 Å²	101	145.6 Å²	145.6	71%	0.706	78%	0.784	S	S	*	*			trans	-84.5	-170.6	177.5	47.5	0	0	0	0	113.8
36	V	37.5	Very low	34.6	Very low	120 Å²	120	145.7 Å²	145.7	73%	0.727	79%	0.79	S	S	*	*			trans	103.5	102.3	157.3	-171.7	0	0	0	0	118
37	M	34.2	Very low	35	Very low	184 Å²	184	145.7 Å²	145.7	91%	0.906	79%	0.792	S	S	*	*			trans	65.7	144.4	142.1	-58.7	-91.1	-94.5	0	0	121.5
38	G	32.9	Very low	34.9	Very low	72 Å²	72	146.3 Å²	146.3	74%	0.742	79%	0.793	S	S	*	*			trans	135.6	58.8	138.6	0	0	0	0	0	121.5
39	R	34.5	Very low	34.7	Very low	226 Å²	226	150.2 Å²	150.2	85%	0.853	80%	0.803	S	S	*	*			trans	39.1	122.6	132.7	-73.1	-167.3	-178.7	-154.1	1.2	122.2
40	Y	30.9	Very low	34.6	Very low	211 Å²	211	150.4 Å²	150.4	83%	0.827	80%	0.804	S	S	*	*			trans	78.2	134.7	134.9	-83.7	-96.6	0	0	0	123.4
41	A	35.1	Very low	34.6	Very low	78 Å²	78	150.4 Å²	150.4	65%	0.645	80%	0.804	S	S	*	*			trans	89.6	109.4	142	0	0	0	0	0	121.4
42	Y	31	Very low	34.1	Very low	210 Å²	210	152.1 Å²	152.1	82%	0.824	81%	0.807	S	S	*	*			trans	33.8	122.2	134.7	-64.1	-86.4	0	0	0	120.5
43	W	35.8	Very low	34	Very low	251 Å²	251	154.8 Å²	154.8	95%	0.951	81%	0.813	S	S	*	*				-153.1	135.2	116.1	-93.5	98.2	0	0	0	109.8
44	V	33.9	Very low	34	Very low	123 Å²	123	157 Å²	157	75%	0.745	82%	0.815	S	S	*	*			trans	-109.3	124.8	178.7	170.8	0	0	0	0	109.1
45	S	37.8	Very low	33.8	Very low	101 Å²	101	155.9 Å²	155.9	71%	0.706	81%	0.813	S	S	*	*			trans	-166.3	120	146.2	3.6	0	0	0	0	115.3
46	V	37	Very low	33.9	Very low	138 Å²	138	158.4 Å²	158.4	84%	0.836	82%	0.824	S	S	*	*			trans	82	127.7	140.1	-175.6	0	0	0	0	119.4
47	P	39.7	Very low	33.6	Very low	115 Å²	115	158.9 Å²	158.9	75%	0.747	82%	0.822	S	S	*	*			trans	-118.4	167.5	-168.7	43.2	-33	0	0	0	115.7
48	R	34.9	Very low	33.4	Very low	244 Å²	244	160 Å²	160	92%	0.921	82%	0.816	S	S	*	*			trans	-164.1	107.9	152.5	-104	163.4	-174.2	-172.7	1.6	108.6
49	L	30.1	Very low	33.2	Very low	158 Å²	158	168 Å²	168	83%	0.827	82%	0.824	S	S	*	*				81.6	65.1	85.9	-163.7	93.8	0	0	0	114.7
50	L	30.7	Very low	32.9	Very low	167 Å²	167	164.7 Å²	164.7	87%	0.874	82%	0.823	S	S	*	*			trans	-173.4	150.3	145.7	-126.9	70.1	0	0	0	108.2
51	L	35.1	Very low	32.7	Very low	168 Å²	168	160.2 Å²	160.2	88%	0.88	82%	0.823	S	S	*	*			trans	92.7	72.5	-174.1	-61.7	158.1	0	0	0	116.3
52	L	29.9	Very low	32.3	Very low	171 Å²	171	163.4 Å²	163.4	90%	0.895	83%	0.828	S	S	*	*			trans	-147.3	44.5	160.2	-120.3	174.1	0	0	0	112.2
53	L	31	Very low	32.4	Very low	156 Å²	156	158.6 Å²	158.6	82%	0.817	82%	0.82	S	S	*	*	S	Bend	trans	-143.9	139.4	168.6	-72.8	177.6	0	0	0	109.1
54	I	32.4	Very low	32.1	Very low	164 Å²	164	151.2 Å²	151.2	84%	0.841	81%	0.813	S	S	*	*			trans	73.6	99.9	170.4	-47.5	157.1	0	0	0	116.3
55	S	32.4	Very low	32.1	Very low	115 Å²	115	152.1 Å²	152.1	80%	0.804	80%	0.804	S	S	*	*			trans	166.1	55.1	136.3	48.9	0	0	0	0	114.5
56	V	35.4	Very low	32.4	Very low	155 Å²	155	148.7 Å²	148.7	94%	0.939	78%	0.778	S	S	*	*			trans	-129.7	84.9	157.9	-174	0	0	0	0	108.4
57	D	31.1	Very low	32.8	Very low	129 Å²	129	144.7 Å²	144.7	69%	0.69	76%	0.764	S	S	*	*			trans	-124.5	111	173.1	176.1	31.1	0	0	0	109.1
58	R	29.9	Very low	33.7	Very low	207 Å²	207	141.5 Å²	141.5	78%	0.781	74%	0.744	S	S	*	*	S	Bend		166.3	130.5	125.1	-90.2	162	-174.5	-155.3	-4.8	112.6
59	R	27.9	Very low	35.7	Very low	241 Å²	241	131 Å²	131	91%	0.909	71%	0.707	S	S	*	*			trans	70.8	71.7	164.1	-53.6	178.9	-166.5	-128.5	3.8	117.6
60	L	28.6	Very low	38.3	Very low	157 Å²	157	128.2 Å²	128.2	82%	0.822	69%	0.685	S	S	*	*			trans	-116.1	118.5	137.9	-94.7	121.4	0	0	0	108.5	L62	L60-L62 VanDerWaalsContact C-N 3.34Å; L60-L62 PolarHBondContact O-N 3.28Å
61	S	26.9	Very low	41	Very low	117 Å²	117	120.3 Å²	120.3	82%	0.818	64%	0.644	S	S	*	*			trans	-76.6	89.2	172.8	-162.7	0	0	0	0	108.5	T63	S61-T63 VanDerWaalsContact C-N 3.32Å; S61-T63 PolarHBondContact O-N 2.92Å
62	L	27.1	Very low	43.6	Very low	145 Å²	145	114.7 Å²	114.7	76%	0.759	62%	0.618	S	S	*	*			trans	-74.3	82.2	178.9	-98.8	143.4	0	0	0	110.4	L60 A64	L60-L62 VanDerWaalsContact C-N 3.34Å; L60-L62 PolarHBondContact O-N 3.28Å; L62-A64 PolarHBondContact O-N 3.46Å
63	T	33.3	Very low	46.5	Very low	108 Å²	108	107.1 Å²	107.1	66%	0.663	58%	0.578	S	S	*	*			trans	-62.4	131.5	156.8	50.6	0	0	0	0	108.5	S61 Y65	S61-T63 VanDerWaalsContact C-N 3.32Å; S61-T63 PolarHBondContact O-N 2.92Å; T63-Y65 PolarHBondContact O-N 3.5Å
64	A	30	Very low	49.2	Very low	96 Å²	96	103.9 Å²	103.9	79%	0.793	56%	0.561	S	S	*	*			trans	-57.7	124.6	-166	0	0	0	0	0	112.8	L62 D66	L62-A64 PolarHBondContact O-N 3.46Å; A64-D66 PolarHBondContact O-N 2.97Å
65	Y	32.2	Very low	51.8	Low	142 Å²	142	99.3 Å²	99.3	56%	0.557	54%	0.536	S	S	*	.			trans	-75.6	93.2	-174.1	-147.4	-85.2	0	0	0	111.1	T63 K647	T63-Y65 PolarHBondContact O-N 3.5Å; Y65-K647 PolarHBondContact O-NZ 2.62Å
66	D	44.2	Very low	54.6	Low	30 Å²	30	94.1 Å²	94.1	16%	0.16	50%	0.5	C	S	.	.			trans	-88.5	107.6	173.1	-162.7	-23.3	0	0	0	110.7	A64 S68 F648	A64-D66 PolarHBondContact O-N 2.97Å; D66-S68 VanDerWaalsContact CG-OG 3.3Å; D66-S68 PolarHBondContact O-N 3.42Å; D66-S68 WeakPolarHBondContact OD1-CB 3.1Å; D66-S68 PolarHBondContact OD1-N 3.32Å; D66-S68 VanDerWaalsContact OD1-N 3.12Å; D66-S68 PolarHBondContact OD1-OG 3.42Å; D66-F648 HydrophobicContact CB-CZ 4.31Å; D66-F648 WeakPolarHBondContact OD2-CZ 3.3Å
67	G	45.1	Very low	57.1	Low	53 Å²	53	88.8 Å²	88.8	55%	0.546	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-6.4	-176.4	0	0	0	0	0	114.4
68	S	59.5	Low	59.8	Low	48 Å²	48	92.2 Å²	92.2	34%	0.336	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-30.8	179.6	62.9	0	0	0	0	112.8	D66 R560 M607	D66-S68 VanDerWaalsContact CG-OG 3.3Å; D66-S68 PolarHBondContact O-N 3.42Å; D66-S68 WeakPolarHBondContact OD1-CB 3.1Å; D66-S68 PolarHBondContact OD1-N 3.32Å; D66-S68 VanDerWaalsContact OD1-N 3.12Å; D66-S68 PolarHBondContact OD1-OG 3.42Å; S68-R560 PolarHBondContact O-NH1 2.05Å; S68-M607 WeakPolarHBondContact OG-CE 3.42Å
69	L	76.9	Confident	62.3	Low	24 Å²	24	86.8 Å²	86.8	13%	0.126	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-25.8	-165.1	-163.9	167.3	0	0	0	114	L515 L516 V518 M607	L69-L515 HydrophobicContact CD1-CD2 3.8Å; L69-L515 HydrophobicContact CD1-CG 4.18Å; L69-L515 HydrophobicContact CD2-CG 4.48Å; L69-L515 HydrophobicContact CG-CD2 4.48Å; L69-L516 VanDerWaalsContact CD2-C 3.49Å; L69-L516 WeakPolarHBondContact CD2-O 3.37Å; L69-V518 HydrophobicContact CG-CG2 4.34Å; L69-V518 PolarHBondContact O-N 3.12Å; L69-M607 HydrophobicContact CB-CE 3.79Å; L69-M607 HydrophobicContact CD1-CE 4.19Å; L69-M607 HydrophobicContact CD1-CG 4.07Å; L69-M607 HydrophobicContact CD1-SD 4.21Å; L69-M607 HydrophobicContact CD2-CE 3.69Å; L69-M607 HydrophobicContact CD2-SD 3.81Å; L69-M607 HydrophobicContact CG-CE 4.09Å; L69-M607 HydrophobicContact CG-SD 4.48Å
70	R	84.2	Confident	65.3	Low	100 Å²	100	76.1 Å²	76.1	38%	0.377	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.5	-178.6	-70.8	-176.8	-179.4	173.8	0.9	111.8	V518 R560	R70-V518 CarbonylContact C-O 3.55Å; R70-V518 VanDerWaalsContact CA-O 3.22Å; R70-V518 WeakPolarHBondContact CA-O 3.29Å; R70-V518 HydrophobicContact CG-CB 4.12Å; R70-V518 HydrophobicContact CG-CG1 4.31Å; R70-R560 PolarHBondContact O-NH2 3.18Å
71	V	88.1	Confident	68.3	Low	1 Å²	1	70 Å²	70	1%	0.006	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.8	168.9	-179.1	0	0	0	0	107.6	E75 L76 V518 I519 E520	V71-E75 HydrophobicContact CG1-CB 4.08Å; V71-E75 HydrophobicContact CG1-CG 4.07Å; V71-L76 HydrophobicContact CG1-CB 4.16Å; V71-V518 PolarHBondContact N-O 3.02Å; V71-I519 HydrophobicContact CB-CB 4.43Å; V71-I519 HydrophobicContact CB-CG1 4.07Å; V71-I519 HydrophobicContact CB-CG2 4.33Å; V71-I519 HydrophobicContact CG1-CG2 4.48Å; V71-I519 HydrophobicContact CG2-CG1 4.16Å; V71-E520 PolarHBondContact O-N 2.91Å
72	S	89.4	Confident	71.4	Confident	49 Å²	49	70.8 Å²	70.8	34%	0.343	38%	0.375	S	S	.	.			trans	-69.3	157.4	178.3	67.3	0	0	0	0	112	D74 E75 L76 E520	S72-D74 VanDerWaalsContact C-N 3.26Å; S72-D74 PolarHBondContact O-N 3.08Å; S72-E75 WeakPolarHBondContact O-CB 3.48Å; S72-E75 PolarHBondContact O-N 2.67Å; S72-E75 WeakPolarHBondContact OG-CB 3.37Å; S72-E75 PolarHBondContact OG-N 2.79Å; S72-L76 WeakPolarHBondContact O-CB 3.49Å; S72-L76 PolarHBondContact O-N 3.29Å; S72-E520 WeakPolarHBondContact CA-OE2 3.4Å
73	Y	90	Very high	74.5	Confident	12 Å²	12	64.5 Å²	64.5	5%	0.047	34%	0.341	C	S	.	.	H	α-helix	trans	-58	-35.6	178.2	-179.5	-104.1	0	0	0	113.4	L76 L77 E520 L521 K523 R549	Y73-L76 PolarHBondContact O-N 3.33Å; Y73-L77 HydrophobicContact CD1-CD1 3.93Å; Y73-L77 HydrophobicContact CD1-CG 4.42Å; Y73-L77 HydrophobicContact CE1-CD1 3.38Å; Y73-L77 HydrophobicContact CE1-CG 4.1Å; Y73-L77 HydrophobicContact CE2-CD1 4.34Å; Y73-L77 HydrophobicContact CE2-CD2 4.32Å; Y73-L77 HydrophobicContact CE2-CG 4.21Å; Y73-L77 WeakPolarHBondContact O-CG 3.5Å; Y73-L77 PolarHBondContact O-N 3.19Å; Y73-L77 VanDerWaalsContact O-N 3.09Å; Y73-E520 WeakPolarHBondContact CA-O 3.48Å; Y73-E520 PolarHBondContact N-OE2 3.3Å; Y73-L521 VanDerWaalsContact CD2-C 3.42Å; Y73-L521 WeakPolarHBondContact CD2-O 3.46Å; Y73-L521 VanDerWaalsContact CE2-O 3.23Å; Y73-L521 WeakPolarHBondContact CE2-O 3.44Å; Y73-K523 HydrophobicContact CD1-CD 4.26Å; Y73-K523 HydrophobicContact CD1-CG 3.56Å; Y73-K523 HydrophobicContact CE1-CG 4.11Å; Y73-K523 HydrophobicContact CG-CG 4.2Å; Y73-R549 VanDerWaalsContact OH-CZ 3.25Å; Y73-R549 PolarHBondContact OH-NH2 3.4Å
74	D	88.4	Confident	77.3	Confident	88 Å²	88	63.8 Å²	63.8	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-77	-19.3	177.3	-66.7	-43.6	0	0	0	113.4	S72 K523	S72-D74 VanDerWaalsContact C-N 3.26Å; S72-D74 PolarHBondContact O-N 3.08Å; D74-K523 WeakPolarHBondContact OD1-CE 3.11Å; D74-K523 IonicContact OD1-NZ 2.99Å; D74-K523 PolarHBondContact OD1-NZ 3.04Å; D74-K523 IonicContact OD2-NZ 3.35Å; D74-K523 PolarHBondContact OD2-NZ 2.03Å
75	E	87.6	Confident	80.3	Confident	68 Å²	68	62.2 Å²	62.2	32%	0.318	31%	0.307	S	S	.	.	H	α-helix	trans	-78.8	-46.6	168.2	-174	-178.9	-179.7	0	0	110.3	V71 S72 L77 R78 R560	V71-E75 HydrophobicContact CG1-CB 4.08Å; V71-E75 HydrophobicContact CG1-CG 4.07Å; S72-E75 WeakPolarHBondContact O-CB 3.48Å; S72-E75 PolarHBondContact O-N 2.67Å; S72-E75 WeakPolarHBondContact OG-CB 3.37Å; S72-E75 PolarHBondContact OG-N 2.79Å; E75-L77 PolarHBondContact O-N 3.34Å; E75-R78 WeakPolarHBondContact O-CB 3.14Å; E75-R78 WeakPolarHBondContact O-CG 3.44Å; E75-R78 PolarHBondContact O-N 2.98Å; E75-R560 IonicContact OE1-CZ 2.79Å; E75-R560 IonicContact OE1-NE 2.67Å; E75-R560 PolarHBondContact OE1-NE 2.94Å; E75-R560 IonicContact OE1-NH2 3.97Å; E75-R560 PolarHBondContact OE1-NH2 3.06Å; E75-R560 IonicContact OE2-CZ 3.67Å; E75-R560 IonicContact OE2-NE 2.66Å; E75-R560 IonicContact OE2-NH2 3.27Å; E75-R560 PolarHBondContact OE2-NH2 2.67Å
76	L	90	Very high	83.1	Confident	6 Å²	6	62.3 Å²	62.3	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-54.1	-47.9	178.4	179.3	62.6	0	0	0	112.7	V71 S72 Y73 R78 N79 A80 I519 E520 L521 I553	V71-L76 HydrophobicContact CG1-CB 4.16Å; S72-L76 WeakPolarHBondContact O-CB 3.49Å; S72-L76 PolarHBondContact O-N 3.29Å; Y73-L76 PolarHBondContact O-N 3.33Å; L76-R78 PolarHBondContact O-N 3.49Å; L76-N79 PolarHBondContact O-N 3.38Å; L76-N79 VanDerWaalsContact O-N 3.16Å; L76-A80 HydrophobicContact CG-CB 4.38Å; L76-A80 WeakPolarHBondContact O-CB 3.18Å; L76-A80 PolarHBondContact O-N 3.4Å; L76-A80 VanDerWaalsContact O-N 3.14Å; L76-I519 HydrophobicContact CD1-CG2 3.76Å; L76-I519 HydrophobicContact CD2-CG2 3.8Å; L76-I519 HydrophobicContact CG-CG2 4.25Å; L76-E520 WeakPolarHBondContact CD2-O 3.1Å; L76-L521 HydrophobicContact CD2-CD2 4.04Å; L76-I553 HydrophobicContact CD1-CD1 4.08Å; L76-I553 HydrophobicContact CD1-CG1 4.29Å; L76-I553 HydrophobicContact CD1-CG2 3.68Å; L76-I553 HydrophobicContact CD2-CD1 3.92Å; L76-I553 HydrophobicContact CG-CD1 4.41Å
77	L	89.1	Confident	85.3	Confident	43 Å²	43	63.9 Å²	63.9	23%	0.225	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-12	-177.5	-78.6	-178.1	0	0	0	114.6	Y73 E75 N79 L551	Y73-L77 HydrophobicContact CD1-CD1 3.93Å; Y73-L77 HydrophobicContact CD1-CG 4.42Å; Y73-L77 HydrophobicContact CE1-CD1 3.38Å; Y73-L77 HydrophobicContact CE1-CG 4.1Å; Y73-L77 HydrophobicContact CE2-CD1 4.34Å; Y73-L77 HydrophobicContact CE2-CD2 4.32Å; Y73-L77 HydrophobicContact CE2-CG 4.21Å; Y73-L77 WeakPolarHBondContact O-CG 3.5Å; Y73-L77 PolarHBondContact O-N 3.19Å; Y73-L77 VanDerWaalsContact O-N 3.09Å; E75-L77 PolarHBondContact O-N 3.34Å; L77-N79 VanDerWaalsContact C-N 3.31Å; L77-L551 HydrophobicContact CD2-CD1 4.37Å
78	R	86.5	Confident	87.5	Confident	202 Å²	202	61.8 Å²	61.8	76%	0.762	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-31.1	175.4	-61	177.3	-175.8	-121	2.1	112.4	E75 L76	E75-R78 WeakPolarHBondContact O-CB 3.14Å; E75-R78 WeakPolarHBondContact O-CG 3.44Å; E75-R78 PolarHBondContact O-N 2.98Å; L76-R78 PolarHBondContact O-N 3.49Å
79	N	84	Confident	89.2	Confident	92 Å²	92	60.9 Å²	60.9	49%	0.492	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-1.5	-175.3	-64	-2.6	0	0	0	113.4	L76 L77 P554	L76-N79 PolarHBondContact O-N 3.38Å; L76-N79 VanDerWaalsContact O-N 3.16Å; L77-N79 VanDerWaalsContact C-N 3.31Å; N79-P554 WeakPolarHBondContact O-CD 3.35Å
80	A	90.3	Very high	90	Very high	18 Å²	18	60.4 Å²	60.4	15%	0.149	31%	0.313	C	S	.	.			trans	-96.7	145.7	176.2	0	0	0	0	0	111.4	L76 L551 R552 I553	L76-A80 HydrophobicContact CG-CB 4.38Å; L76-A80 WeakPolarHBondContact O-CB 3.18Å; L76-A80 PolarHBondContact O-N 3.4Å; L76-A80 VanDerWaalsContact O-N 3.14Å; A80-L551 HydrophobicContact CB-CD1 4.05Å; A80-R552 WeakPolarHBondContact CA-O 3.14Å; A80-R552 WeakPolarHBondContact CB-O 3.29Å; A80-I553 HydrophobicContact CB-CG1 4.12Å
81	S	91.7	Very high	90.5	Very high	29 Å²	29	55.7 Å²	55.7	20%	0.203	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	143.4	170.8	54.4	0	0	0	0	110.8	M119 R552	S81-M119 VanDerWaalsContact OG-CG 3.29Å; S81-M119 WeakPolarHBondContact OG-CG 3.34Å; S81-R552 PolarHBondContact N-O 2.87Å; S81-R552 PolarHBondContact O-N 3.16Å; S81-R552 PolarHBondContact OG-NH1 3.02Å
82	R	90.8	Very high	90.8	Very high	133 Å²	133	55.7 Å²	55.7	50%	0.502	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.1	-177.6	72.5	-179.4	-174.7	-136.5	-0.3	111.9	L550 L551	R82-L550 CarbonylContact C-O 3.28Å; R82-L550 VanDerWaalsContact CA-O 3.28Å; R82-L550 WeakPolarHBondContact CA-O 3.27Å; R82-L551 HydrophobicContact CB-CD1 3.92Å
83	F	93.4	Very high	91	Very high	13 Å²	13	53.4 Å²	53.4	6%	0.057	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.1	171.5	171.3	-103.8	0	0	0	109.4	M85 F91 F112 I114 M119 T121 R549 L550	F83-M85 HydrophobicContact CE2-CE 4.1Å; F83-M85 HydrophobicContact CZ-CB 4.27Å; F83-M85 HydrophobicContact CZ-CE 4.09Å; F83-F91 HydrophobicContact CD1-CE1 4.26Å; F83-F91 AromaticContact CE1-CE1 3.86Å; F83-F91 HydrophobicContact CE1-CE1 3.86Å; F83-F91 HydrophobicContact CE1-CZ 4.35Å; F83-F112 HydrophobicContact CE1-CD2 4.01Å; F83-F112 HydrophobicContact CE1-CE2 4.17Å; F83-F112 HydrophobicContact CE1-CG 4.21Å; F83-F112 HydrophobicContact CZ-CD1 4.04Å; F83-F112 HydrophobicContact CZ-CD2 4.27Å; F83-F112 HydrophobicContact CZ-CE1 4.08Å; F83-F112 HydrophobicContact CZ-CE2 4.3Å; F83-F112 HydrophobicContact CZ-CG 4.13Å; F83-F112 HydrophobicContact CZ-CZ 4.21Å; F83-I114 HydrophobicContact CB-CD1 4.48Å; F83-I114 HydrophobicContact CD1-CD1 3.44Å; F83-I114 VanDerWaalsContact CD1-CD1 3.44Å; F83-I114 HydrophobicContact CD2-CD1 4.16Å; F83-I114 HydrophobicContact CE1-CD1 3.54Å; F83-I114 HydrophobicContact CE2-CD1 4.27Å; F83-I114 HydrophobicContact CG-CD1 3.76Å; F83-I114 HydrophobicContact CZ-CD1 3.97Å; F83-M119 HydrophobicContact CB-CB 4.43Å; F83-M119 HydrophobicContact CB-CE 4.27Å; F83-T121 VanDerWaalsContact CE2-OG1 3.24Å; F83-T121 WeakPolarHBondContact CE2-OG1 3.37Å; F83-R549 CarbonylContact O-C 3.59Å; F83-R549 WeakPolarHBondContact O-CA 3.31Å; F83-R549 WeakPolarHBondContact O-CB 3.47Å; F83-L550 HydrophobicContact CB-CB 4.34Å; F83-L550 PolarHBondContact N-O 2.99Å; F83-L550 PolarHBondContact O-N 3.18Å
84	E	92.1	Very high	91.2	Very high	92 Å²	92	52.8 Å²	52.8	43%	0.43	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145.9	-178.9	175.9	155.8	-168.4	0	0	107.9	K548 R549	E84-K548 WeakPolarHBondContact CG-O 3.48Å; E84-R549 HydrophobicContact CB-CB 4.09Å
85	M	92.3	Very high	91.5	Very high	64 Å²	64	49.4 Å²	49.4	32%	0.315	26%	0.258	S	S	.	.			trans	-142.9	121.1	-174.9	-177.2	67.8	65.1	0	0	110	F83 G87 V88 F112	F83-M85 HydrophobicContact CE2-CE 4.1Å; F83-M85 HydrophobicContact CZ-CB 4.27Å; F83-M85 HydrophobicContact CZ-CE 4.09Å; M85-G87 PolarHBondContact O-N 2.9Å; M85-V88 HydrophobicContact CB-CB 4.3Å; M85-V88 HydrophobicContact CB-CG2 4.21Å; M85-V88 HydrophobicContact CG-CB 4.5Å; M85-V88 HydrophobicContact CG-CG2 3.87Å; M85-V88 PolarHBondContact O-N 2.97Å; M85-V88 VanDerWaalsContact O-N 3.11Å; M85-F112 HydrophobicContact CB-CZ 4.38Å; M85-F112 HydrophobicContact CE-CE1 4.29Å; M85-F112 HydrophobicContact CG-CZ 4.16Å
86	T	90.7	Very high	91.7	Very high	144 Å²	144	47 Å²	47	88%	0.883	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.8	130.6	-177.8	-49	0	0	0	0	111.7	V88	T86-V88 VanDerWaalsContact C-N 3.29Å; T86-V88 PolarHBondContact O-N 3.26Å
87	G	90.2	Very high	91.8	Very high	63 Å²	63	47.4 Å²	47.4	65%	0.649	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.9	-8.5	179.6	0	0	0	0	0	115.7	M85 R108	M85-G87 PolarHBondContact O-N 2.9Å; G87-R108 PolarHBondContact O-NH2 3.29Å
88	V	93.3	Very high	91.7	Very high	9 Å²	9	46.7 Å²	46.7	6%	0.055	25%	0.247	C	C	.	.			trans	-98.9	133.7	175.8	-176.4	0	0	0	0	110.3	M85 T86 F91 A107 V110 F112	M85-V88 HydrophobicContact CB-CB 4.3Å; M85-V88 HydrophobicContact CB-CG2 4.21Å; M85-V88 HydrophobicContact CG-CB 4.5Å; M85-V88 HydrophobicContact CG-CG2 3.87Å; M85-V88 PolarHBondContact O-N 2.97Å; M85-V88 VanDerWaalsContact O-N 3.11Å; T86-V88 VanDerWaalsContact C-N 3.29Å; T86-V88 PolarHBondContact O-N 3.26Å; V88-F91 HydrophobicContact CB-CZ 4.14Å; V88-F91 HydrophobicContact CG1-CE1 4.1Å; V88-F91 HydrophobicContact CG1-CE2 4.14Å; V88-F91 HydrophobicContact CG1-CZ 3.65Å; V88-A107 HydrophobicContact CG1-CB 3.66Å; V88-V110 HydrophobicContact CG1-CG1 3.62Å; V88-V110 HydrophobicContact CG2-CG1 4.21Å; V88-F112 HydrophobicContact CG1-CE2 4.18Å; V88-F112 HydrophobicContact CG2-CZ 4.24Å
89	T	94.6	Very high	91.8	Very high	29 Å²	29	42.7 Å²	42.7	18%	0.178	25%	0.247	C	C	.	.			trans	-132.1	175.6	175.5	65.1	0	0	0	0	111	R108 D547	T89-R108 WeakPolarHBondContact O-CB 3.48Å; T89-R108 PolarHBondContact O-N 2.86Å; T89-R108 PolarHBondContact OG1-NH1 2.9Å; T89-D547 CarbonylContact C-O 3.6Å; T89-D547 WeakPolarHBondContact CA-O 3.5Å; T89-D547 WeakPolarHBondContact CB-O 3.03Å
90	D	94.2	Very high	92.2	Very high	14 Å²	14	41.9 Å²	41.9	8%	0.075	24%	0.237	C	C	.	.			trans	60.5	52.7	170.7	-60.7	-93	0	0	0	113.4	K92 A107 R108 F150 R529 D547	D90-K92 VanDerWaalsContact C-N 3.26Å; D90-K92 HydrophobicContact CB-CD 4.11Å; D90-K92 HydrophobicContact CB-CG 4.25Å; D90-K92 WeakPolarHBondContact O-CB 3.26Å; D90-K92 WeakPolarHBondContact O-CG 3.43Å; D90-K92 PolarHBondContact O-N 3.15Å; D90-K92 WeakPolarHBondContact OD1-CE 3.37Å; D90-K92 IonicContact OD1-NZ 2.94Å; D90-A107 VanDerWaalsContact O-CA 3.3Å; D90-A107 WeakPolarHBondContact O-CA 3.02Å; D90-R108 HydrophobicContact CB-CB 4.34Å; D90-F150 HydrophobicContact CB-CD1 3.73Å; D90-F150 HydrophobicContact CB-CE1 3.72Å; D90-R529 IonicContact OD1-NH2 4Å; D90-R529 PolarHBondContact OD1-NH2 3.01Å; D90-D547 PolarHBondContact N-O 3.07Å
91	F	94.8	Very high	92.3	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.24	C	C	.	.			trans	-64.4	87.4	170.2	-61	-92.8	0	0	0	109.4	F83 V88 V105 A107 F112 F531 T545 M546 K548	F83-F91 HydrophobicContact CD1-CE1 4.26Å; F83-F91 AromaticContact CE1-CE1 3.86Å; F83-F91 HydrophobicContact CE1-CE1 3.86Å; F83-F91 HydrophobicContact CE1-CZ 4.35Å; V88-F91 HydrophobicContact CB-CZ 4.14Å; V88-F91 HydrophobicContact CG1-CE1 4.1Å; V88-F91 HydrophobicContact CG1-CE2 4.14Å; V88-F91 HydrophobicContact CG1-CZ 3.65Å; F91-V105 HydrophobicContact CD1-CG1 3.86Å; F91-A107 HydrophobicContact CD1-CB 3.73Å; F91-A107 HydrophobicContact CE1-CB 3.97Å; F91-A107 HydrophobicContact CG-CB 4.11Å; F91-F112 HydrophobicContact CE1-CD2 4.26Å; F91-F112 AromaticContact CE1-CE2 3.99Å; F91-F112 HydrophobicContact CE1-CE2 3.99Å; F91-F531 WeakPolarHBondContact O-CD2 3.08Å; F91-T545 WeakPolarHBondContact O-CB 3.32Å; F91-T545 PolarHBondContact O-OG1 2.86Å; F91-M546 WeakPolarHBondContact CB-O 3.4Å; F91-M546 WeakPolarHBondContact CD2-O 3.41Å; F91-M546 PolarHBondContact N-O 2.03Å; F91-K548 VanDerWaalsContact CE2-C 3.42Å; F91-K548 WeakPolarHBondContact CE2-O 3.39Å
92	K	92.9	Very high	92.4	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.009	23%	0.232	C	C	.	.			trans	-108.6	-10.2	-167.6	-80.3	-179.4	175.2	-174.4	0	113.7	D90 G106 F150 P201 E202 F531 F1101	D90-K92 VanDerWaalsContact C-N 3.26Å; D90-K92 HydrophobicContact CB-CD 4.11Å; D90-K92 HydrophobicContact CB-CG 4.25Å; D90-K92 WeakPolarHBondContact O-CB 3.26Å; D90-K92 WeakPolarHBondContact O-CG 3.43Å; D90-K92 PolarHBondContact O-N 3.15Å; D90-K92 WeakPolarHBondContact OD1-CE 3.37Å; D90-K92 IonicContact OD1-NZ 2.94Å; K92-G106 PolarHBondContact N-O 2.81Å; K92-F150 HydrophobicContact CD-CD1 4.45Å; K92-P201 PolarHBondContact NZ-O 2.04Å; K92-E202 IonicContact NZ-OE1 2.85Å; K92-E202 PolarHBondContact NZ-OE1 3.03Å; K92-F531 HydrophobicContact CG-CD1 4.33Å; K92-F531 HydrophobicContact CG-CD2 3.97Å; K92-F531 HydrophobicContact CG-CE1 4.43Å; K92-F531 HydrophobicContact CG-CE2 4.05Å; K92-F531 HydrophobicContact CG-CG 4.09Å; K92-F531 HydrophobicContact CG-CZ 4.28Å; K92-F1101 WeakPolarHBondContact O-CE2 3.03Å; K92-F1101 WeakPolarHBondContact O-CZ 3.42Å
93	A	94	Very high	92.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	141.4	174.2	0	0	0	0	0	113.1	V105 G106 I151 L154 F1101	A93-V105 CarbonylContact O-C 3.51Å; A93-V105 WeakPolarHBondContact O-CA 3.45Å; A93-V105 WeakPolarHBondContact O-CG1 3.13Å; A93-G106 PolarHBondContact N-O 3.49Å; A93-G106 PolarHBondContact O-N 2.78Å; A93-I151 HydrophobicContact CB-CG2 4.45Å; A93-L154 HydrophobicContact CB-CD1 3.9Å; A93-L154 HydrophobicContact CB-CG 4.01Å; A93-F1101 HydrophobicContact CB-CE1 3.68Å; A93-F1101 HydrophobicContact CB-CZ 3.57Å
94	L	94.6	Very high	92.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	130.3	177.9	172.7	66.8	0	0	0	109	F96 I103 I104 V105 F543 T545 L550	L94-F96 HydrophobicContact CD2-CE2 4.12Å; L94-F96 HydrophobicContact CD2-CZ 3.82Å; L94-F96 HydrophobicContact CG-CE2 4.34Å; L94-F96 HydrophobicContact CG-CZ 4.31Å; L94-I103 HydrophobicContact CD1-CB 4.01Å; L94-I103 HydrophobicContact CD1-CD1 4.09Å; L94-I103 HydrophobicContact CD1-CG1 4.38Å; L94-I104 WeakPolarHBondContact CA-O 3.37Å; L94-V105 HydrophobicContact CD1-CG2 3.95Å; L94-F543 HydrophobicContact CD2-CB 3.74Å; L94-F543 HydrophobicContact CD2-CG 4.49Å; L94-T545 HydrophobicContact CB-CG2 3.7Å; L94-T545 HydrophobicContact CD2-CG2 3.94Å; L94-T545 HydrophobicContact CG-CG2 4.43Å; L94-L550 HydrophobicContact CD1-CD1 4.48Å; L94-L550 HydrophobicContact CD2-CD1 4.21Å
95	M	94.1	Very high	92.9	Very high	16 Å²	16	30.4 Å²	30.4	8%	0.079	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.3	174.4	-174.4	-173.3	82	0	0	109.3	I103 I104 L154 V163 M180	M95-I103 CarbonylContact O-C 3.55Å; M95-I103 WeakPolarHBondContact O-CA 3.37Å; M95-I104 HydrophobicContact CE-CB 4.35Å; M95-I104 HydrophobicContact CE-CD1 3.9Å; M95-I104 HydrophobicContact CE-CG1 4.28Å; M95-I104 PolarHBondContact N-O 2.86Å; M95-I104 PolarHBondContact O-N 2.81Å; M95-L154 HydrophobicContact CB-CB 3.74Å; M95-L154 HydrophobicContact CB-CD1 4.27Å; M95-L154 HydrophobicContact SD-CB 4.18Å; M95-V163 HydrophobicContact CE-CB 4.18Å; M95-V163 HydrophobicContact CE-CG2 3.65Å; M95-V163 HydrophobicContact SD-CG2 3.91Å; M95-M180 HydrophobicContact CE-CE 3.79Å; M95-M180 HydrophobicContact CE-SD 3.56Å; M95-M180 VanDerWaalsContact CE-SD 3.56Å
96	F	92.5	Very high	93.1	Very high	19 Å²	19	27.3 Å²	27.3	8%	0.083	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	143.2	176.4	-61.3	-84	0	0	0	111.2	L94 I103 Q534 H536 F543 I1103	L94-F96 HydrophobicContact CD2-CE2 4.12Å; L94-F96 HydrophobicContact CD2-CZ 3.82Å; L94-F96 HydrophobicContact CG-CE2 4.34Å; L94-F96 HydrophobicContact CG-CZ 4.31Å; F96-I103 HydrophobicContact CD1-CG2 3.36Å; F96-I103 HydrophobicContact CE1-CG2 3.8Å; F96-I103 HydrophobicContact CG-CG2 4.29Å; F96-Q534 HydrophobicContact CE2-CB 4.07Å; F96-Q534 VanDerWaalsContact CE2-OE1 3.32Å; F96-Q534 HydrophobicContact CZ-CB 4.44Å; F96-H536 AromaticContact CD1-CD2 3.35Å; F96-H536 WeakPolarHBondContact CD1-CD2 3.25Å; F96-H536 HydrophobicContact CE1-CB 4.37Å; F96-H536 AromaticContact CE1-CD2 3.75Å; F96-H536 AromaticContact CG-CD2 3.49Å; F96-H536 VanDerWaalsContact CG-CD2 3.49Å; F96-H536 WeakPolarHBondContact CG-CD2 3.39Å; F96-H536 HydrophobicContact CZ-CB 4.39Å; F96-F543 HydrophobicContact CE1-CB 4.49Å; F96-F543 HydrophobicContact CE1-CD1 4.04Å; F96-F543 AromaticContact CE1-CD2 3.55Å; F96-F543 HydrophobicContact CE1-CD2 3.55Å; F96-F543 HydrophobicContact CE1-CE1 4.08Å; F96-F543 AromaticContact CE1-CE2 3.6Å; F96-F543 HydrophobicContact CE1-CE2 3.6Å; F96-F543 AromaticContact CE1-CG 3.78Å; F96-F543 HydrophobicContact CE1-CG 3.78Å; F96-F543 AromaticContact CE1-CZ 3.87Å; F96-F543 HydrophobicContact CE1-CZ 3.87Å; F96-F543 HydrophobicContact CZ-CB 3.95Å; F96-F543 HydrophobicContact CZ-CD1 4.35Å; F96-F543 AromaticContact CZ-CD2 3.53Å; F96-F543 HydrophobicContact CZ-CD2 3.53Å; F96-F543 HydrophobicContact CZ-CE2 4.06Å; F96-F543 AromaticContact CZ-CG 3.69Å; F96-F543 HydrophobicContact CZ-CG 3.69Å; F96-I1103 HydrophobicContact CD2-CD1 3.49Å; F96-I1103 VanDerWaalsContact CD2-CD1 3.49Å; F96-I1103 HydrophobicContact CD2-CG1 4.01Å; F96-I1103 HydrophobicContact CE2-CD1 3.63Å; F96-I1103 HydrophobicContact CE2-CG1 4.49Å
97	D	91.9	Very high	93.3	Very high	13 Å²	13	20.5 Å²	20.5	7%	0.07	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	70	174.3	179.1	23.9	0	0	0	108.4	P99 R100 N101 Q102 M180	D97-P99 VanDerWaalsContact C-N 3.31Å; D97-R100 PolarHBondContact O-N 2.72Å; D97-R100 IonicContact OD1-NH1 2.72Å; D97-R100 PolarHBondContact OD1-NH1 2.83Å; D97-R100 WeakPolarHBondContact OD2-CB 3Å; D97-R100 WeakPolarHBondContact OD2-CD 3.27Å; D97-R100 WeakPolarHBondContact OD2-CG 2.97Å; D97-R100 IonicContact OD2-CZ 2.79Å; D97-R100 IonicContact OD2-NE 3.62Å; D97-R100 IonicContact OD2-NH1 3.57Å; D97-R100 PolarHBondContact OD2-NH1 2.77Å; D97-N101 PolarHBondContact O-N 2.71Å; D97-Q102 CarbonylContact C-O 3.37Å; D97-Q102 HydrophobicContact CB-CG 3.84Å; D97-Q102 PolarHBondContact N-O 2.76Å; D97-Q102 PolarHBondContact O-N 2.84Å; D97-Q102 PolarHBondContact OD2-NE2 3.47Å; D97-M180 WeakPolarHBondContact OD2-CG 3.42Å
98	S	86.6	Confident	93.6	Very high	29 Å²	29	20.4 Å²	20.4	20%	0.203	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-49.8	-41.6	-179.3	-42.2	0	0	0	0	113.6	R100 N101 H536 E538	S98-R100 PolarHBondContact O-N 3.42Å; S98-R100 VanDerWaalsContact O-N 3.08Å; S98-N101 PolarHBondContact O-N 3.29Å; S98-H536 PolarHBondContact OG-CE1 3.2Å; S98-H536 PolarHBondContact OG-NE2 2.93Å; S98-H536 VanDerWaalsContact OG-NE2 3.15Å; S98-E538 PolarHBondContact OG-OE2 3.28Å
99	P	88.9	Confident	93.8	Very high	117 Å²	117	21.1 Å²	21.1	76%	0.76	11%	0.111	S	C	*	.	G	3₁₀ helix	trans	-57.3	-23.7	178	-27.6	36.9	0	0	0	115	D97	D97-P99 VanDerWaalsContact C-N 3.31Å
100	R	91.8	Very high	93.9	Very high	75 Å²	75	19.8 Å²	19.8	28%	0.283	10%	0.103	S	C	.	.	G	3₁₀ helix	trans	-113.4	10.2	178	-54.9	-174	-172.2	73.9	0.9	113.2	D97 S98 Q102 G160 N181	D97-R100 PolarHBondContact O-N 2.72Å; D97-R100 IonicContact OD1-NH1 2.72Å; D97-R100 PolarHBondContact OD1-NH1 2.83Å; D97-R100 WeakPolarHBondContact OD2-CB 3Å; D97-R100 WeakPolarHBondContact OD2-CD 3.27Å; D97-R100 WeakPolarHBondContact OD2-CG 2.97Å; D97-R100 IonicContact OD2-CZ 2.79Å; D97-R100 IonicContact OD2-NE 3.62Å; D97-R100 IonicContact OD2-NH1 3.57Å; D97-R100 PolarHBondContact OD2-NH1 2.77Å; S98-R100 PolarHBondContact O-N 3.42Å; S98-R100 VanDerWaalsContact O-N 3.08Å; R100-Q102 HydrophobicContact CB-CG 3.96Å; R100-Q102 PolarHBondContact O-N 2.96Å; R100-G160 PolarHBondContact NH1-O 2.95Å; R100-G160 PolarHBondContact NH2-O 2.03Å; R100-N181 WeakPolarHBondContact CD-OD1 3.45Å; R100-N181 PolarHBondContact NE-OD1 2.84Å
101	N	92.2	Very high	94	Very high	39 Å²	39	19.1 Å²	19.1	21%	0.209	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	38.6	-176.8	-157.4	39.2	0	0	0	114.5	D97 S98 H115 Q116 D117 K539	D97-N101 PolarHBondContact O-N 2.71Å; S98-N101 PolarHBondContact O-N 3.29Å; N101-H115 PolarHBondContact ND2-CE1 2.75Å; N101-H115 PolarHBondContact ND2-NE2 3.46Å; N101-H115 PolarHBondContact O-CD2 3.12Å; N101-Q116 WeakPolarHBondContact O-CB 3.42Å; N101-Q116 PolarHBondContact O-N 2.01Å; N101-D117 PolarHBondContact ND2-OD2 3.05Å; N101-D117 PolarHBondContact OD1-OD2 3.3Å; N101-K539 WeakPolarHBondContact OD1-CE 3.46Å; N101-K539 PolarHBondContact OD1-NZ 3.07Å
102	Q	94	Very high	94.1	Very high	5 Å²	5	19.1 Å²	19.1	2%	0.023	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	161.9	-175.1	71	-176.4	-3.2	0	0	112.2	D97 R100 I114 L122 M180	D97-Q102 CarbonylContact C-O 3.37Å; D97-Q102 HydrophobicContact CB-CG 3.84Å; D97-Q102 PolarHBondContact N-O 2.76Å; D97-Q102 PolarHBondContact O-N 2.84Å; D97-Q102 PolarHBondContact OD2-NE2 3.47Å; R100-Q102 HydrophobicContact CB-CG 3.96Å; R100-Q102 PolarHBondContact O-N 2.96Å; Q102-I114 CarbonylContact C-O 3.46Å; Q102-I114 VanDerWaalsContact CA-O 3.3Å; Q102-I114 WeakPolarHBondContact CA-O 3.42Å; Q102-I114 WeakPolarHBondContact CB-O 3.31Å; Q102-L122 HydrophobicContact CB-CD1 4.02Å; Q102-M180 PolarHBondContact NE2-O 2.79Å; Q102-M180 VanDerWaalsContact NE2-O 3.13Å
103	I	94.6	Very high	94.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144	170.6	63.9	-175.5	0	0	0	109.1	L94 M95 F96 V105 I114 Q116 M119 F543 L550	L94-I103 HydrophobicContact CD1-CB 4.01Å; L94-I103 HydrophobicContact CD1-CD1 4.09Å; L94-I103 HydrophobicContact CD1-CG1 4.38Å; M95-I103 CarbonylContact O-C 3.55Å; M95-I103 WeakPolarHBondContact O-CA 3.37Å; F96-I103 HydrophobicContact CD1-CG2 3.36Å; F96-I103 HydrophobicContact CE1-CG2 3.8Å; F96-I103 HydrophobicContact CG-CG2 4.29Å; I103-V105 HydrophobicContact CD1-CG2 4.2Å; I103-V105 HydrophobicContact CG1-CG2 4.04Å; I103-I114 HydrophobicContact CD1-CB 4.31Å; I103-I114 HydrophobicContact CD1-CG2 4.45Å; I103-I114 HydrophobicContact CG1-CB 3.77Å; I103-I114 HydrophobicContact CG1-CG2 4.37Å; I103-I114 PolarHBondContact N-O 2.97Å; I103-I114 PolarHBondContact O-N 2.91Å; I103-Q116 HydrophobicContact CG2-CB 4.02Å; I103-Q116 HydrophobicContact CG2-CG 3.77Å; I103-M119 HydrophobicContact CD1-SD 4.45Å; I103-F543 HydrophobicContact CD1-CD1 4.36Å; I103-F543 HydrophobicContact CD1-CE1 4.12Å; I103-L550 HydrophobicContact CD1-CD2 3.51Å
104	I	95.9	Very high	94.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131.3	171.7	-57.5	-172.5	0	0	0	107.8	L94 M95 V111 F112 L154 V163 M180 L183	L94-I104 WeakPolarHBondContact CA-O 3.37Å; M95-I104 HydrophobicContact CE-CB 4.35Å; M95-I104 HydrophobicContact CE-CD1 3.9Å; M95-I104 HydrophobicContact CE-CG1 4.28Å; M95-I104 PolarHBondContact N-O 2.86Å; M95-I104 PolarHBondContact O-N 2.81Å; I104-V111 HydrophobicContact CG2-CG1 3.47Å; I104-V111 VanDerWaalsContact CG2-CG1 3.47Å; I104-F112 CarbonylContact C-O 3.55Å; I104-F112 WeakPolarHBondContact CA-O 3.41Å; I104-L154 HydrophobicContact CB-CD1 4.24Å; I104-L154 HydrophobicContact CG2-CD1 3.81Å; I104-L154 HydrophobicContact CG2-CD2 3.93Å; I104-L154 HydrophobicContact CG2-CG 4.48Å; I104-L154 VanDerWaalsContact O-CD1 3.3Å; I104-L154 WeakPolarHBondContact O-CD1 3.45Å; I104-V163 HydrophobicContact CD1-CB 4.49Å; I104-V163 HydrophobicContact CD1-CG1 4.03Å; I104-M180 HydrophobicContact CD1-CG 4.29Å; I104-M180 HydrophobicContact CD1-SD 3.36Å; I104-M180 WeakPolarHBondContact CD1-SD 3.25Å; I104-M180 HydrophobicContact CG1-SD 4.49Å; I104-L183 HydrophobicContact CD1-CD2 4Å
105	V	96.3	Very high	94.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	121.9	-172.2	-167.4	0	0	0	0	109.3	F91 A93 L94 I103 V111 F112 I114 L550	F91-V105 HydrophobicContact CD1-CG1 3.86Å; A93-V105 CarbonylContact O-C 3.51Å; A93-V105 WeakPolarHBondContact O-CA 3.45Å; A93-V105 WeakPolarHBondContact O-CG1 3.13Å; L94-V105 HydrophobicContact CD1-CG2 3.95Å; I103-V105 HydrophobicContact CD1-CG2 4.2Å; I103-V105 HydrophobicContact CG1-CG2 4.04Å; V105-V111 CarbonylContact O-C 3.58Å; V105-V111 WeakPolarHBondContact O-CA 3.36Å; V105-F112 HydrophobicContact CB-CB 4.48Å; V105-F112 PolarHBondContact N-O 2.92Å; V105-F112 PolarHBondContact O-N 3.23Å; V105-I114 HydrophobicContact CB-CD1 4.42Å; V105-I114 HydrophobicContact CG2-CD1 3.78Å; V105-I114 HydrophobicContact CG2-CG1 4.35Å; V105-L550 HydrophobicContact CG2-CD2 4.02Å
106	G	96.3	Very high	94	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.5	175.3	0	0	0	0	0	110.8	K92 A93	K92-G106 PolarHBondContact N-O 2.81Å; A93-G106 PolarHBondContact N-O 3.49Å; A93-G106 PolarHBondContact O-N 2.78Å
107	A	96.7	Very high	93.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	-166.7	176.6	0	0	0	0	0	110.6	V88 D90 F91 D109 V110 I151	V88-A107 HydrophobicContact CG1-CB 3.66Å; D90-A107 VanDerWaalsContact O-CA 3.3Å; D90-A107 WeakPolarHBondContact O-CA 3.02Å; F91-A107 HydrophobicContact CD1-CB 3.73Å; F91-A107 HydrophobicContact CE1-CB 3.97Å; F91-A107 HydrophobicContact CG-CB 4.11Å; A107-D109 PolarHBondContact O-N 3.12Å; A107-V110 HydrophobicContact CB-CG1 3.87Å; A107-V110 PolarHBondContact N-O 3.12Å; A107-I151 PolarHBondContact O-N 2.84Å
108	R	96.2	Very high	93.6	Very high	61 Å²	61	27.8 Å²	27.8	23%	0.23	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-67.3	121.6	171	-170.3	-174.5	68.2	-163.7	-7.5	110.7	G87 T89 D90 V110 H148 F150	G87-R108 PolarHBondContact O-NH2 3.29Å; T89-R108 WeakPolarHBondContact O-CB 3.48Å; T89-R108 PolarHBondContact O-N 2.86Å; T89-R108 PolarHBondContact OG1-NH1 2.9Å; D90-R108 HydrophobicContact CB-CB 4.34Å; R108-V110 PolarHBondContact O-N 3.11Å; R108-V110 VanDerWaalsContact O-N 3.12Å; R108-H148 HydrophobicContact CG-CB 3.65Å; R108-F150 HydrophobicContact CB-CD1 4.04Å; R108-F150 HydrophobicContact CB-CE1 3.95Å; R108-F150 HydrophobicContact CG-CD1 4.09Å; R108-F150 HydrophobicContact CG-CE1 3.74Å; R108-F150 HydrophobicContact CG-CZ 4.05Å
109	D	96.4	Very high	93.9	Very high	25 Å²	25	26.8 Å²	26.8	13%	0.134	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	13.8	177.8	-53.1	-48.4	0	0	0	116	A107 L127 P128 H148 N149	A107-D109 PolarHBondContact O-N 3.12Å; D109-L127 CarbonylContact O-C 3.15Å; D109-L127 PolarHBondContact O-N 3Å; D109-P128 HydrophobicContact CB-CB 4.12Å; D109-H148 IonicContact OD1-ND1 3.03Å; D109-H148 IonicContact OD2-CE1 3.83Å; D109-H148 IonicContact OD2-CG 3.06Å; D109-H148 IonicContact OD2-ND1 3.45Å; D109-H148 PolarHBondContact OD2-ND1 3.38Å; D109-N149 WeakPolarHBondContact CA-O 3.44Å; D109-N149 PolarHBondContact N-O 2.99Å; D109-N149 PolarHBondContact OD1-N 2.83Å
110	V	96.3	Very high	94	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	147	-174.4	69.7	0	0	0	0	113	V88 A107 R108 F112 R124 L125	V88-V110 HydrophobicContact CG1-CG1 3.62Å; V88-V110 HydrophobicContact CG2-CG1 4.21Å; A107-V110 HydrophobicContact CB-CG1 3.87Å; A107-V110 PolarHBondContact N-O 3.12Å; R108-V110 PolarHBondContact O-N 3.11Å; R108-V110 VanDerWaalsContact O-N 3.12Å; V110-F112 HydrophobicContact CB-CE2 4.39Å; V110-F112 HydrophobicContact CG1-CD2 4.23Å; V110-F112 HydrophobicContact CG1-CE2 3.46Å; V110-F112 VanDerWaalsContact CG1-CE2 3.46Å; V110-F112 HydrophobicContact CG1-CZ 3.91Å; V110-F112 HydrophobicContact CG2-CD2 4.43Å; V110-F112 HydrophobicContact CG2-CE1 4.17Å; V110-F112 HydrophobicContact CG2-CE2 3.95Å; V110-F112 HydrophobicContact CG2-CZ 3.8Å; V110-R124 HydrophobicContact CG2-CG 3.64Å; V110-L125 WeakPolarHBondContact CA-O 3.47Å; V110-L125 WeakPolarHBondContact CG2-O 3.34Å
111	V	96.6	Very high	94.1	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.9	165.8	-176.6	0	0	0	0	109.3	I104 V105 L125 L127 I151 V165 L183	I104-V111 HydrophobicContact CG2-CG1 3.47Å; I104-V111 VanDerWaalsContact CG2-CG1 3.47Å; V105-V111 CarbonylContact O-C 3.58Å; V105-V111 WeakPolarHBondContact O-CA 3.36Å; V111-L125 PolarHBondContact N-O 3.03Å; V111-L125 PolarHBondContact O-N 3.38Å; V111-L127 HydrophobicContact CG2-CD1 3.92Å; V111-I151 HydrophobicContact CG2-CD1 4.28Å; V111-I151 HydrophobicContact CG2-CG1 3.85Å; V111-I151 HydrophobicContact CG2-CG2 4.16Å; V111-V165 HydrophobicContact CG2-CG1 3.81Å; V111-L183 HydrophobicContact CG1-CD1 3.85Å
112	F	96.6	Very high	94.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	147.3	172.2	-62.5	-80.1	0	0	0	111.2	F83 M85 V88 F91 I104 V105 V110 I114 T121 E123 R124	F83-F112 HydrophobicContact CE1-CD2 4.01Å; F83-F112 HydrophobicContact CE1-CE2 4.17Å; F83-F112 HydrophobicContact CE1-CG 4.21Å; F83-F112 HydrophobicContact CZ-CD1 4.04Å; F83-F112 HydrophobicContact CZ-CD2 4.27Å; F83-F112 HydrophobicContact CZ-CE1 4.08Å; F83-F112 HydrophobicContact CZ-CE2 4.3Å; F83-F112 HydrophobicContact CZ-CG 4.13Å; F83-F112 HydrophobicContact CZ-CZ 4.21Å; M85-F112 HydrophobicContact CB-CZ 4.38Å; M85-F112 HydrophobicContact CE-CE1 4.29Å; M85-F112 HydrophobicContact CG-CZ 4.16Å; V88-F112 HydrophobicContact CG1-CE2 4.18Å; V88-F112 HydrophobicContact CG2-CZ 4.24Å; F91-F112 HydrophobicContact CE1-CD2 4.26Å; F91-F112 AromaticContact CE1-CE2 3.99Å; F91-F112 HydrophobicContact CE1-CE2 3.99Å; I104-F112 CarbonylContact C-O 3.55Å; I104-F112 WeakPolarHBondContact CA-O 3.41Å; V105-F112 HydrophobicContact CB-CB 4.48Å; V105-F112 PolarHBondContact N-O 2.92Å; V105-F112 PolarHBondContact O-N 3.23Å; V110-F112 HydrophobicContact CB-CE2 4.39Å; V110-F112 HydrophobicContact CG1-CD2 4.23Å; V110-F112 HydrophobicContact CG1-CE2 3.46Å; V110-F112 VanDerWaalsContact CG1-CE2 3.46Å; V110-F112 HydrophobicContact CG1-CZ 3.91Å; V110-F112 HydrophobicContact CG2-CD2 4.43Å; V110-F112 HydrophobicContact CG2-CE1 4.17Å; V110-F112 HydrophobicContact CG2-CE2 3.95Å; V110-F112 HydrophobicContact CG2-CZ 3.8Å; F112-I114 HydrophobicContact CB-CD1 3.98Å; F112-I114 HydrophobicContact CB-CG1 3.79Å; F112-T121 HydrophobicContact CD1-CG2 3.94Å; F112-E123 WeakPolarHBondContact CA-O 3.33Å; F112-R124 HydrophobicContact CD1-CB 4.04Å; F112-R124 HydrophobicContact CD1-CG 4.13Å; F112-R124 HydrophobicContact CE1-CB 3.96Å; F112-R124 HydrophobicContact CE1-CG 3.67Å; F112-R124 HydrophobicContact CZ-CG 4.41Å
113	R	96.1	Very high	94.2	Very high	47 Å²	47	26.8 Å²	26.8	18%	0.177	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.7	160.1	-165.7	175.4	65.4	148.3	-12.9	106.8	L122 E123 N181 L183	R113-L122 HydrophobicContact CB-CB 4.29Å; R113-L122 HydrophobicContact CG-CB 4.18Å; R113-L122 HydrophobicContact CG-CD1 4.39Å; R113-L122 PolarHBondContact NH2-O 2.92Å; R113-L122 WeakPolarHBondContact O-CA 3.49Å; R113-L122 PolarHBondContact O-N 3.3Å; R113-E123 HydrophobicContact CB-CB 3.75Å; R113-E123 IonicContact CZ-OE2 3.57Å; R113-E123 PolarHBondContact N-O 2.92Å; R113-E123 IonicContact NE-OE2 2.6Å; R113-E123 IonicContact NH2-OE2 3.65Å; R113-E123 PolarHBondContact O-N 2.95Å; R113-E123 VanDerWaalsContact O-N 3.08Å; R113-N181 VanDerWaalsContact NH1-C 3.29Å; R113-N181 PolarHBondContact NH1-O 3.46Å; R113-L183 HydrophobicContact CB-CD1 4.04Å
114	I	94.9	Very high	94.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.9	-171.4	-53.8	-177.5	0	0	0	108.7	F83 Q102 I103 V105 F112 Q116 V120	F83-I114 HydrophobicContact CB-CD1 4.48Å; F83-I114 HydrophobicContact CD1-CD1 3.44Å; F83-I114 VanDerWaalsContact CD1-CD1 3.44Å; F83-I114 HydrophobicContact CD2-CD1 4.16Å; F83-I114 HydrophobicContact CE1-CD1 3.54Å; F83-I114 HydrophobicContact CE2-CD1 4.27Å; F83-I114 HydrophobicContact CG-CD1 3.76Å; F83-I114 HydrophobicContact CZ-CD1 3.97Å; Q102-I114 CarbonylContact C-O 3.46Å; Q102-I114 VanDerWaalsContact CA-O 3.3Å; Q102-I114 WeakPolarHBondContact CA-O 3.42Å; Q102-I114 WeakPolarHBondContact CB-O 3.31Å; I103-I114 HydrophobicContact CD1-CB 4.31Å; I103-I114 HydrophobicContact CD1-CG2 4.45Å; I103-I114 HydrophobicContact CG1-CB 3.77Å; I103-I114 HydrophobicContact CG1-CG2 4.37Å; I103-I114 PolarHBondContact N-O 2.97Å; I103-I114 PolarHBondContact O-N 2.91Å; V105-I114 HydrophobicContact CB-CD1 4.42Å; V105-I114 HydrophobicContact CG2-CD1 3.78Å; V105-I114 HydrophobicContact CG2-CG1 4.35Å; F112-I114 HydrophobicContact CB-CD1 3.98Å; F112-I114 HydrophobicContact CB-CG1 3.79Å; I114-Q116 PolarHBondContact O-N 3.35Å; I114-V120 CarbonylContact C-O 3.57Å; I114-V120 WeakPolarHBondContact CA-O 3.27Å; I114-V120 WeakPolarHBondContact CG2-O 3.39Å
115	H	93.8	Very high	94.2	Very high	51 Å²	51	31.3 Å²	31.3	24%	0.236	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	125	175.1	-175.9	-103.1	0	0	0	110.2	N101 D117 T118 M119 V120 L122	N101-H115 PolarHBondContact ND2-CE1 2.75Å; N101-H115 PolarHBondContact ND2-NE2 3.46Å; N101-H115 PolarHBondContact O-CD2 3.12Å; H115-D117 PolarHBondContact O-N 3.11Å; H115-T118 PolarHBondContact ND1-OG1 2.82Å; H115-M119 WeakPolarHBondContact O-CA 3.39Å; H115-M119 PolarHBondContact O-N 2.97Å; H115-V120 PolarHBondContact N-O 2.92Å; H115-L122 HydrophobicContact CB-CD1 4.05Å; H115-L122 HydrophobicContact CB-CD2 4.15Å; H115-L122 HydrophobicContact CB-CG 4.06Å
116	Q	90.4	Very high	94.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-33.8	-161.2	-176.9	171.6	12	0	0	114.3	N101 I103 I114 H536 F543	N101-Q116 WeakPolarHBondContact O-CB 3.42Å; N101-Q116 PolarHBondContact O-N 2.01Å; I103-Q116 HydrophobicContact CG2-CB 4.02Å; I103-Q116 HydrophobicContact CG2-CG 3.77Å; I114-Q116 PolarHBondContact O-N 3.35Å; Q116-H536 PolarHBondContact NE2-CD2 2.94Å; Q116-H536 PolarHBondContact NE2-NE2 2.8Å; Q116-F543 HydrophobicContact CG-CZ 4.04Å
117	D	87.7	Confident	94.1	Very high	51 Å²	51	35.8 Å²	35.8	27%	0.273	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-42.7	-177.7	-60.6	-49.1	0	0	0	112.7	N101 H115 K539	N101-D117 PolarHBondContact ND2-OD2 3.05Å; N101-D117 PolarHBondContact OD1-OD2 3.3Å; H115-D117 PolarHBondContact O-N 3.11Å; D117-K539 WeakPolarHBondContact OD1-CD 3.27Å; D117-K539 WeakPolarHBondContact OD1-CE 3.37Å; D117-K539 IonicContact OD1-NZ 2.73Å; D117-K539 PolarHBondContact OD1-NZ 2.91Å; D117-K539 IonicContact OD2-NZ 3.75Å; D117-K539 PolarHBondContact OD2-NZ 2.87Å
118	T	88.5	Confident	94	Very high	82 Å²	82	39.7 Å²	39.7	50%	0.503	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-12.8	-173.2	61	0	0	0	0	113.5	H115 V120	H115-T118 PolarHBondContact ND1-OG1 2.82Å; T118-V120 PolarHBondContact O-N 2.82Å
119	M	91	Very high	93.9	Very high	9 Å²	9	37.1 Å²	37.1	4%	0.044	20%	0.2	C	C	.	.			trans	60	20.8	-175.8	-51.5	-66.2	-77.7	0	0	114.1	S81 F83 I103 H115 F543 L550 R552	S81-M119 VanDerWaalsContact OG-CG 3.29Å; S81-M119 WeakPolarHBondContact OG-CG 3.34Å; F83-M119 HydrophobicContact CB-CB 4.43Å; F83-M119 HydrophobicContact CB-CE 4.27Å; I103-M119 HydrophobicContact CD1-SD 4.45Å; H115-M119 WeakPolarHBondContact O-CA 3.39Å; H115-M119 PolarHBondContact O-N 2.97Å; M119-F543 HydrophobicContact SD-CE1 4.08Å; M119-L550 HydrophobicContact CE-CB 4.37Å; M119-L550 HydrophobicContact CE-CD2 3.48Å; M119-L550 VanDerWaalsContact CE-CD2 3.48Å; M119-L550 HydrophobicContact CE-CG 3.73Å; M119-R552 HydrophobicContact CE-CB 4Å; M119-R552 HydrophobicContact SD-CB 3.94Å
120	V	91.3	Very high	93.7	Very high	87 Å²	87	39 Å²	39	53%	0.527	21%	0.213	S	C	.	.			trans	-83.9	134.7	178.2	175.6	0	0	0	0	110.6	I114 H115 T118 L122	I114-V120 CarbonylContact C-O 3.57Å; I114-V120 WeakPolarHBondContact CA-O 3.27Å; I114-V120 WeakPolarHBondContact CG2-O 3.39Å; H115-V120 PolarHBondContact N-O 2.92Å; T118-V120 PolarHBondContact O-N 2.82Å; V120-L122 PolarHBondContact O-N 2.82Å
121	T	93.8	Very high	93.6	Very high	53 Å²	53	45.1 Å²	45.1	33%	0.325	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	121.6	175.4	-43.8	0	0	0	0	111.6	F83 F112 E123	F83-T121 VanDerWaalsContact CE2-OG1 3.24Å; F83-T121 WeakPolarHBondContact CE2-OG1 3.37Å; F112-T121 HydrophobicContact CD1-CG2 3.94Å; T121-E123 WeakPolarHBondContact CG2-O 3.34Å
122	L	94.1	Very high	93.5	Very high	76 Å²	76	49.3 Å²	49.3	40%	0.398	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-28.7	171.2	-62.3	174.3	0	0	0	112.2	Q102 R113 H115 V120	Q102-L122 HydrophobicContact CB-CD1 4.02Å; R113-L122 HydrophobicContact CB-CB 4.29Å; R113-L122 HydrophobicContact CG-CB 4.18Å; R113-L122 HydrophobicContact CG-CD1 4.39Å; R113-L122 PolarHBondContact NH2-O 2.92Å; R113-L122 WeakPolarHBondContact O-CA 3.49Å; R113-L122 PolarHBondContact O-N 3.3Å; H115-L122 HydrophobicContact CB-CD1 4.05Å; H115-L122 HydrophobicContact CB-CD2 4.15Å; H115-L122 HydrophobicContact CB-CG 4.06Å; V120-L122 PolarHBondContact O-N 2.82Å
123	E	95.2	Very high	93.3	Very high	19 Å²	19	50.8 Å²	50.8	9%	0.089	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	147.9	176.1	-160.2	-176.2	160.6	0	0	111.4	F112 R113 T121 L183 R184	F112-E123 WeakPolarHBondContact CA-O 3.33Å; R113-E123 HydrophobicContact CB-CB 3.75Å; R113-E123 IonicContact CZ-OE2 3.57Å; R113-E123 PolarHBondContact N-O 2.92Å; R113-E123 IonicContact NE-OE2 2.6Å; R113-E123 IonicContact NH2-OE2 3.65Å; R113-E123 PolarHBondContact O-N 2.95Å; R113-E123 VanDerWaalsContact O-N 3.08Å; T121-E123 WeakPolarHBondContact CG2-O 3.34Å; E123-L183 PolarHBondContact OE1-N 2.8Å; E123-L183 VanDerWaalsContact OE1-N 3.1Å; E123-L183 PolarHBondContact OE2-N 2.91Å; E123-R184 WeakPolarHBondContact OE1-CG 3.31Å; E123-R184 PolarHBondContact OE1-N 2.84Å; E123-R184 IonicContact OE1-NE 2.65Å
124	R	95.1	Very high	93.3	Very high	78 Å²	78	49.9 Å²	49.9	29%	0.294	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	132.4	164.1	179.9	-177.3	177.4	118.5	8.4	109.3	V110 F112 D126 R184	V110-R124 HydrophobicContact CG2-CG 3.64Å; F112-R124 HydrophobicContact CD1-CB 4.04Å; F112-R124 HydrophobicContact CD1-CG 4.13Å; F112-R124 HydrophobicContact CE1-CB 3.96Å; F112-R124 HydrophobicContact CE1-CG 3.67Å; F112-R124 HydrophobicContact CZ-CG 4.41Å; R124-D126 IonicContact CZ-OD1 3.4Å; R124-D126 IonicContact NE-OD1 3.83Å; R124-D126 PolarHBondContact NE-OD1 2.88Å; R124-D126 IonicContact NE-OD2 2.7Å; R124-D126 PolarHBondContact NE-OD2 2.03Å; R124-D126 VanDerWaalsContact NE-OD2 3.09Å; R124-D126 IonicContact NH2-OD1 3.27Å; R124-D126 PolarHBondContact NH2-OD1 3.13Å; R124-R184 PolarHBondContact O-NH2 2.89Å
125	L	95.4	Very high	93.3	Very high	17 Å²	17	53.4 Å²	53.4	9%	0.089	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	110.8	172.5	175.3	70.7	0	0	0	109.4	V110 V111 L127 L183 R184	V110-L125 WeakPolarHBondContact CA-O 3.47Å; V110-L125 WeakPolarHBondContact CG2-O 3.34Å; V111-L125 PolarHBondContact N-O 3.03Å; V111-L125 PolarHBondContact O-N 3.38Å; L125-L127 HydrophobicContact CD1-CD2 4.36Å; L125-L127 HydrophobicContact CD2-CD1 3.97Å; L125-L127 HydrophobicContact CD2-CD2 4.01Å; L125-L127 HydrophobicContact CD2-CG 4.07Å; L125-L127 HydrophobicContact CG-CD1 4.4Å; L125-L127 HydrophobicContact CG-CD2 3.99Å; L125-L127 HydrophobicContact CG-CG 3.99Å; L125-L183 HydrophobicContact CB-CB 4.26Å; L125-L183 HydrophobicContact CD2-CB 3.83Å; L125-L183 WeakPolarHBondContact CD2-O 3.01Å; L125-R184 HydrophobicContact CD1-CG 4.03Å
126	D	95.1	Very high	93.2	Very high	82 Å²	82	56 Å²	56	44%	0.439	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	130.8	174.9	-63.1	-76.8	0	0	0	110.8	R124	R124-D126 IonicContact CZ-OD1 3.4Å; R124-D126 IonicContact NE-OD1 3.83Å; R124-D126 PolarHBondContact NE-OD1 2.88Å; R124-D126 IonicContact NE-OD2 2.7Å; R124-D126 PolarHBondContact NE-OD2 2.03Å; R124-D126 VanDerWaalsContact NE-OD2 3.09Å; R124-D126 IonicContact NH2-OD1 3.27Å; R124-D126 PolarHBondContact NH2-OD1 3.13Å
127	L	94.2	Very high	93.4	Very high	13 Å²	13	56 Å²	56	7%	0.068	30%	0.304	C	S	.	.			trans	-135	54.6	-177	-63.2	179	0	0	0	111.5	D109 V111 L125 N149 I151 V165 L189	D109-L127 CarbonylContact O-C 3.15Å; D109-L127 PolarHBondContact O-N 3Å; V111-L127 HydrophobicContact CG2-CD1 3.92Å; L125-L127 HydrophobicContact CD1-CD2 4.36Å; L125-L127 HydrophobicContact CD2-CD1 3.97Å; L125-L127 HydrophobicContact CD2-CD2 4.01Å; L125-L127 HydrophobicContact CD2-CG 4.07Å; L125-L127 HydrophobicContact CG-CD1 4.4Å; L125-L127 HydrophobicContact CG-CD2 3.99Å; L125-L127 HydrophobicContact CG-CG 3.99Å; L127-N149 WeakPolarHBondContact O-CB 3.42Å; L127-N149 PolarHBondContact O-ND2 2.9Å; L127-I151 HydrophobicContact CD1-CD1 4.26Å; L127-V165 HydrophobicContact CD1-CG1 4.16Å; L127-L189 HydrophobicContact CB-CD1 3.9Å; L127-L189 HydrophobicContact CD1-CD1 4.17Å; L127-L189 HydrophobicContact CD2-CD1 4.04Å; L127-L189 HydrophobicContact CG-CD1 4.27Å
128	P	95.2	Very high	93.7	Very high	82 Å²	82	57.8 Å²	57.8	53%	0.532	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-67.1	152.8	179.9	30.3	-36.5	0	0	0	112.4	D109	D109-P128 HydrophobicContact CB-CB 4.12Å
129	A	93.7	Very high	93.9	Very high	7 Å²	7	61.1 Å²	61.1	6%	0.058	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-65.2	138.1	170.5	0	0	0	0	0	110.9	I134 N149 D169 A170	A129-I134 HydrophobicContact CB-CD1 4.39Å; A129-I134 HydrophobicContact CB-CG1 3.97Å; A129-I134 WeakPolarHBondContact O-CD1 3.28Å; A129-N149 HydrophobicContact CB-CB 4.39Å; A129-D169 WeakPolarHBondContact CA-OD1 3.48Å; A129-D169 WeakPolarHBondContact CB-OD1 3.39Å; A129-A170 HydrophobicContact CB-CB 3.72Å
130	P	93.4	Very high	93.8	Very high	64 Å²	64	65.3 Å²	65.3	42%	0.416	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-60.4	142.2	173.2	-23.4	33.3	0	0	0	111.8	S132 K133 I134	P130-S132 PolarHBondContact O-N 3.49Å; P130-S132 VanDerWaalsContact O-N 3.1Å; P130-K133 WeakPolarHBondContact O-CA 3.4Å; P130-K133 WeakPolarHBondContact O-CB 3.09Å; P130-K133 PolarHBondContact O-N 2.75Å; P130-I134 PolarHBondContact O-N 2.94Å
131	M	94.1	Very high	93.7	Very high	128 Å²	128	64.3 Å²	64.3	63%	0.631	35%	0.352	S	S	*	.	H	α-helix	trans	-52.1	-40.5	-176.3	-163.2	65	71.1	0	0	112.9	K133 I134 D135	M131-K133 PolarHBondContact O-N 3.33Å; M131-K133 VanDerWaalsContact O-N 3.17Å; M131-I134 CarbonylContact O-C 3.22Å; M131-I134 WeakPolarHBondContact O-CA 3.34Å; M131-I134 WeakPolarHBondContact O-CB 3.43Å; M131-I134 PolarHBondContact O-N 2.93Å; M131-I134 HydrophobicContact SD-CB 4.4Å; M131-I134 HydrophobicContact SD-CD1 4.29Å; M131-D135 VanDerWaalsContact O-CG 3.23Å; M131-D135 PolarHBondContact O-N 3Å
132	S	93.8	Very high	93.5	Very high	90 Å²	90	65.1 Å²	65.1	63%	0.629	35%	0.349	S	S	*	.	H	α-helix	trans	-61.2	-24.5	176.3	58.2	0	0	0	0	114.9	P130 R136	P130-S132 PolarHBondContact O-N 3.49Å; P130-S132 VanDerWaalsContact O-N 3.1Å; S132-R136 WeakPolarHBondContact O-CB 3.43Å; S132-R136 PolarHBondContact O-N 3.23Å
133	K	93.2	Very high	93.4	Very high	30 Å²	30	64.9 Å²	64.9	13%	0.13	35%	0.352	C	S	.	.	H	α-helix	trans	-81.2	-38.4	169.4	-60.7	-166.7	-170	178.6	0	111.6	P130 M131 R136 C137 D169 A170 K172 S174	P130-K133 WeakPolarHBondContact O-CA 3.4Å; P130-K133 WeakPolarHBondContact O-CB 3.09Å; P130-K133 PolarHBondContact O-N 2.75Å; M131-K133 PolarHBondContact O-N 3.33Å; M131-K133 VanDerWaalsContact O-N 3.17Å; K133-R136 PolarHBondContact O-N 3.48Å; K133-C137 WeakPolarHBondContact O-CB 3.33Å; K133-C137 PolarHBondContact O-N 3.48Å; K133-D169 WeakPolarHBondContact CD-OD1 3.43Å; K133-D169 IonicContact NZ-OD1 3.8Å; K133-D169 PolarHBondContact NZ-OD1 3.04Å; K133-D169 IonicContact NZ-OD2 3.3Å; K133-D169 PolarHBondContact NZ-OD2 3.31Å; K133-A170 HydrophobicContact CB-CB 3.97Å; K133-K172 HydrophobicContact CD-CB 4.23Å; K133-K172 HydrophobicContact CD-CD 4.26Å; K133-S174 PolarHBondContact NZ-OG 2.91Å
134	I	94.8	Very high	93.2	Very high	29 Å²	29	66 Å²	66	15%	0.149	37%	0.365	C	S	.	.	H	α-helix	trans	-60.8	-52.4	176.5	-55.9	-176.4	0	0	0	110	A129 P130 M131 R136 C137 Q138 C147 A170	A129-I134 HydrophobicContact CB-CD1 4.39Å; A129-I134 HydrophobicContact CB-CG1 3.97Å; A129-I134 WeakPolarHBondContact O-CD1 3.28Å; P130-I134 PolarHBondContact O-N 2.94Å; M131-I134 CarbonylContact O-C 3.22Å; M131-I134 WeakPolarHBondContact O-CA 3.34Å; M131-I134 WeakPolarHBondContact O-CB 3.43Å; M131-I134 PolarHBondContact O-N 2.93Å; M131-I134 HydrophobicContact SD-CB 4.4Å; M131-I134 HydrophobicContact SD-CD1 4.29Å; I134-R136 VanDerWaalsContact C-N 3.28Å; I134-R136 PolarHBondContact O-N 2.83Å; I134-C137 WeakPolarHBondContact O-CB 2.97Å; I134-C137 PolarHBondContact O-N 3.49Å; I134-C137 VanDerWaalsContact O-N 3.09Å; I134-Q138 WeakPolarHBondContact O-CG 3Å; I134-Q138 PolarHBondContact O-N 2.9Å; I134-C147 WeakPolarHBondContact CG1-O 3.04Å; I134-C147 HydrophobicContact CG2-CB 4.06Å; I134-A170 HydrophobicContact CG1-CB 4.43Å
135	D	94.9	Very high	92.9	Very high	74 Å²	74	68.5 Å²	68.5	40%	0.396	38%	0.38	S	S	.	.	H	α-helix	trans	-54.7	-45.6	176.4	-61.5	-31.9	0	0	0	110.9	M131 C137 Q138 M139	M131-D135 VanDerWaalsContact O-CG 3.23Å; M131-D135 PolarHBondContact O-N 3Å; D135-C137 PolarHBondContact O-N 3.01Å; D135-Q138 PolarHBondContact O-N 2.88Å; D135-M139 WeakPolarHBondContact O-CB 3.49Å; D135-M139 VanDerWaalsContact O-CG 3.32Å; D135-M139 WeakPolarHBondContact O-CG 3.41Å; D135-M139 PolarHBondContact O-N 3.22Å
136	R	93.5	Very high	92.8	Very high	105 Å²	105	69.2 Å²	69.2	40%	0.396	39%	0.385	S	S	.	.	H	α-helix	trans	-65.2	-39	178.1	-167.9	-176.4	70.7	143.9	12.4	112.7	S132 K133 I134 M139 L140	S132-R136 WeakPolarHBondContact O-CB 3.43Å; S132-R136 PolarHBondContact O-N 3.23Å; K133-R136 PolarHBondContact O-N 3.48Å; I134-R136 VanDerWaalsContact C-N 3.28Å; I134-R136 PolarHBondContact O-N 2.83Å; R136-M139 HydrophobicContact CB-CE 4.37Å; R136-M139 PolarHBondContact O-N 3.44Å; R136-L140 WeakPolarHBondContact O-CG 3.34Å; R136-L140 PolarHBondContact O-N 2.98Å; R136-L140 VanDerWaalsContact O-N 3.08Å
137	C	93.5	Very high	92.8	Very high	1 Å²	1	65.3 Å²	65.3	1%	0.007	36%	0.364	C	S	.	.	H	α-helix	trans	-63.8	-42.7	175.5	170.1	0	0	0	0	111.5	K133 I134 D135 L140 R142 C147 A170 F171	K133-C137 WeakPolarHBondContact O-CB 3.33Å; K133-C137 PolarHBondContact O-N 3.48Å; I134-C137 WeakPolarHBondContact O-CB 2.97Å; I134-C137 PolarHBondContact O-N 3.49Å; I134-C137 VanDerWaalsContact O-N 3.09Å; D135-C137 PolarHBondContact O-N 3.01Å; C137-L140 PolarHBondContact O-N 3.3Å; C137-R142 WeakPolarHBondContact O-CB 3.47Å; C137-R142 PolarHBondContact O-N 3.2Å; C137-C147 HydrophobicContact CB-CB 3.68Å; C137-C147 WeakPolarHBondContact CB-SG 3.13Å; C137-C147 WeakPolarHBondContact SG-CA 3.43Å; C137-C147 WeakPolarHBondContact SG-CB 3.04Å; C137-C147 CovalentContact SG-SG 2.04Å; C137-C147 PolarHBondContact SG-SG 2.6Å; C137-A170 HydrophobicContact CB-CB 4.13Å; C137-F171 WeakPolarHBondContact SG-CD2 3.49Å
138	Q	94	Very high	92.9	Very high	87 Å²	87	67 Å²	67	41%	0.407	37%	0.371	S	S	.	.	H	α-helix	trans	-67.9	-39.3	175.4	-65.6	-179.9	16.9	0	0	112	I134 D135 L140 G141 C147	I134-Q138 WeakPolarHBondContact O-CG 3Å; I134-Q138 PolarHBondContact O-N 2.9Å; D135-Q138 PolarHBondContact O-N 2.88Å; Q138-L140 PolarHBondContact O-N 2.82Å; Q138-G141 WeakPolarHBondContact O-CA 3.35Å; Q138-G141 PolarHBondContact O-N 2.95Å; Q138-C147 HydrophobicContact CG-CB 4.35Å
139	M	91.9	Very high	93	Very high	152 Å²	152	63 Å²	63	75%	0.749	35%	0.346	S	S	*	.	H	α-helix	trans	-62	-26.6	172.6	-75.1	-170.4	-69	0	0	113.3	D135 R136 G141	D135-M139 WeakPolarHBondContact O-CB 3.49Å; D135-M139 VanDerWaalsContact O-CG 3.32Å; D135-M139 WeakPolarHBondContact O-CG 3.41Å; D135-M139 PolarHBondContact O-N 3.22Å; R136-M139 HydrophobicContact CB-CE 4.37Å; R136-M139 PolarHBondContact O-N 3.44Å; M139-G141 PolarHBondContact O-N 3.11Å
140	L	88.7	Confident	93.1	Very high	97 Å²	97	63 Å²	63	51%	0.508	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	7.4	170.8	-68	170.6	0	0	0	113.4	R136 C137 Q138 F223	R136-L140 WeakPolarHBondContact O-CG 3.34Å; R136-L140 PolarHBondContact O-N 2.98Å; R136-L140 VanDerWaalsContact O-N 3.08Å; C137-L140 PolarHBondContact O-N 3.3Å; Q138-L140 PolarHBondContact O-N 2.82Å; L140-F223 HydrophobicContact CB-CZ 3.98Å; L140-F223 HydrophobicContact CD1-CE2 3.99Å; L140-F223 HydrophobicContact CD1-CZ 4.05Å
141	G	89.7	Confident	93.3	Very high	67 Å²	67	59.9 Å²	59.9	69%	0.691	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	18.3	175.8	0	0	0	0	0	114.7	Q138 M139	Q138-G141 WeakPolarHBondContact O-CA 3.35Å; Q138-G141 PolarHBondContact O-N 2.95Å; M139-G141 PolarHBondContact O-N 3.11Å
142	R	89.9	Confident	93.3	Very high	69 Å²	69	54.2 Å²	54.2	26%	0.26	30%	0.296	S	S	.	.			trans	-86.5	146.2	174.3	-60.5	-59.8	-171.7	-177.3	3.5	111	C137 V146 F171 F223	C137-R142 WeakPolarHBondContact O-CB 3.47Å; C137-R142 PolarHBondContact O-N 3.2Å; R142-V146 HydrophobicContact CB-CG2 4.06Å; R142-F171 HydrophobicContact CB-CE2 4.29Å; R142-F171 HydrophobicContact CG-CD2 4.38Å; R142-F171 HydrophobicContact CG-CE1 4.22Å; R142-F171 HydrophobicContact CG-CE2 4.04Å; R142-F171 HydrophobicContact CG-CZ 3.95Å; R142-F223 HydrophobicContact CG-CE2 4.41Å; R142-F223 HydrophobicContact CG-CZ 3.99Å; R142-F223 PolarHBondContact NH2-O 3.34Å
143	P	91.8	Very high	93.4	Very high	71 Å²	71	49.9 Å²	49.9	46%	0.461	27%	0.266	S	S	.	.			trans	-57.1	147.2	172.2	-15.9	22.3	0	0	0	112.1	E145 V146 C147	P143-E145 WeakPolarHBondContact CB-OE2 3.1Å; P143-E145 PolarHBondContact O-N 3.09Å; P143-V146 HydrophobicContact CB-CG2 4.12Å; P143-V146 HydrophobicContact CG-CG2 4.04Å; P143-V146 WeakPolarHBondContact O-CG2 3.04Å; P143-V146 PolarHBondContact O-N 2.87Å; P143-C147 PolarHBondContact O-N 2.79Å; P143-C147 PolarHBondContact O-SG 2.84Å
144	A	90.8	Very high	93.5	Very high	43 Å²	43	48.7 Å²	48.7	36%	0.355	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-59	-35.6	177.7	0	0	0	0	0	111.6	V146 C147 H148	A144-V146 PolarHBondContact O-N 2.94Å; A144-C147 PolarHBondContact O-N 2.95Å; A144-H148 PolarHBondContact O-CD2 2.88Å; A144-H148 VanDerWaalsContact O-CD2 3.31Å
145	E	90.4	Very high	93.4	Very high	130 Å²	130	47.4 Å²	47.4	61%	0.607	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-62.9	-23.7	-177.9	-57.9	77.9	-173.2	0	0	113.6	P143 H148	P143-E145 WeakPolarHBondContact CB-OE2 3.1Å; P143-E145 PolarHBondContact O-N 3.09Å; E145-H148 PolarHBondContact O-CD2 2.96Å
146	V	92.3	Very high	93.2	Very high	33 Å²	33	46.5 Å²	46.5	20%	0.2	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-101.8	-7.2	175	-61.4	0	0	0	0	113.1	R142 P143 A144 H148 F171 P201	R142-V146 HydrophobicContact CB-CG2 4.06Å; P143-V146 HydrophobicContact CB-CG2 4.12Å; P143-V146 HydrophobicContact CG-CG2 4.04Å; P143-V146 WeakPolarHBondContact O-CG2 3.04Å; P143-V146 PolarHBondContact O-N 2.87Å; A144-V146 PolarHBondContact O-N 2.94Å; V146-H148 PolarHBondContact O-N 2.95Å; V146-F171 HydrophobicContact CB-CE2 4.03Å; V146-F171 HydrophobicContact CB-CZ 4.42Å; V146-F171 HydrophobicContact CG2-CE2 3.75Å; V146-F171 HydrophobicContact CG2-CZ 4.07Å; V146-F171 WeakPolarHBondContact O-CE2 3.27Å; V146-P201 HydrophobicContact CB-CG 4.35Å; V146-P201 HydrophobicContact CG1-CG 4.48Å
147	C	96	Very high	93	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	-82.7	47.1	177.5	-66.4	0	0	0	0	112.5	I134 C137 Q138 P143 A144	I134-C147 WeakPolarHBondContact CG1-O 3.04Å; I134-C147 HydrophobicContact CG2-CB 4.06Å; C137-C147 HydrophobicContact CB-CB 3.68Å; C137-C147 WeakPolarHBondContact CB-SG 3.13Å; C137-C147 WeakPolarHBondContact SG-CA 3.43Å; C137-C147 WeakPolarHBondContact SG-CB 3.04Å; C137-C147 CovalentContact SG-SG 2.04Å; C137-C147 PolarHBondContact SG-SG 2.6Å; Q138-C147 HydrophobicContact CG-CB 4.35Å; P143-C147 PolarHBondContact O-N 2.79Å; P143-C147 PolarHBondContact O-SG 2.84Å; A144-C147 PolarHBondContact O-N 2.95Å
148	H	95.9	Very high	92.7	Very high	47 Å²	47	45.5 Å²	45.5	22%	0.218	26%	0.258	C	S	.	.	S	Bend	trans	-122	173	-178.9	-73.3	-97.8	0	0	0	111.2	R108 D109 A144 E145 V146 F150 T168 A170	R108-H148 HydrophobicContact CG-CB 3.65Å; D109-H148 IonicContact OD1-ND1 3.03Å; D109-H148 IonicContact OD2-CE1 3.83Å; D109-H148 IonicContact OD2-CG 3.06Å; D109-H148 IonicContact OD2-ND1 3.45Å; D109-H148 PolarHBondContact OD2-ND1 3.38Å; A144-H148 PolarHBondContact O-CD2 2.88Å; A144-H148 VanDerWaalsContact O-CD2 3.31Å; E145-H148 PolarHBondContact O-CD2 2.96Å; V146-H148 PolarHBondContact O-N 2.95Å; H148-F150 HydrophobicContact CB-CD2 4.27Å; H148-F150 HydrophobicContact CB-CE2 3.74Å; H148-F150 HydrophobicContact CB-CZ 4.11Å; H148-F150 PolarHBondContact O-N 3.31Å; H148-T168 PolarHBondContact O-OG1 2.84Å; H148-A170 PolarHBondContact O-N 3.41Å
149	N	96.1	Very high	92.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	28%	0.277	C	S	.	.			trans	-92.2	92.7	171.4	-172.6	19.7	0	0	0	111	D109 L127 A129 I151 G167 T168 D169	D109-N149 WeakPolarHBondContact CA-O 3.44Å; D109-N149 PolarHBondContact N-O 2.99Å; D109-N149 PolarHBondContact OD1-N 2.83Å; L127-N149 WeakPolarHBondContact O-CB 3.42Å; L127-N149 PolarHBondContact O-ND2 2.9Å; A129-N149 HydrophobicContact CB-CB 4.39Å; N149-I151 PolarHBondContact O-N 3.19Å; N149-G167 VanDerWaalsContact OD1-C 3.27Å; N149-G167 VanDerWaalsContact OD1-CA 3.31Å; N149-G167 WeakPolarHBondContact OD1-CA 3.49Å; N149-T168 PolarHBondContact OD1-N 2.99Å; N149-D169 HydrophobicContact CB-CB 4.38Å; N149-D169 WeakPolarHBondContact OD1-CA 3.49Å; N149-D169 PolarHBondContact OD1-N 2.75Å
150	F	96.5	Very high	91.9	Very high	5 Å²	5	39.1 Å²	39.1	2%	0.022	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-82.2	114.9	173.5	-62	-91.9	0	0	0	109	D90 K92 R108 H148 R152 G167 T168 P201	D90-F150 HydrophobicContact CB-CD1 3.73Å; D90-F150 HydrophobicContact CB-CE1 3.72Å; K92-F150 HydrophobicContact CD-CD1 4.45Å; R108-F150 HydrophobicContact CB-CD1 4.04Å; R108-F150 HydrophobicContact CB-CE1 3.95Å; R108-F150 HydrophobicContact CG-CD1 4.09Å; R108-F150 HydrophobicContact CG-CE1 3.74Å; R108-F150 HydrophobicContact CG-CZ 4.05Å; H148-F150 HydrophobicContact CB-CD2 4.27Å; H148-F150 HydrophobicContact CB-CE2 3.74Å; H148-F150 HydrophobicContact CB-CZ 4.11Å; H148-F150 PolarHBondContact O-N 3.31Å; F150-R152 HydrophobicContact CB-CG 4.45Å; F150-R152 WeakPolarHBondContact O-CG 3.5Å; F150-R152 PolarHBondContact O-N 2.86Å; F150-G167 CarbonylContact O-C 3.52Å; F150-G167 WeakPolarHBondContact O-CA 3.32Å; F150-T168 HydrophobicContact CB-CG2 4.12Å; F150-T168 WeakPolarHBondContact CD2-OG1 3.44Å; F150-T168 PolarHBondContact N-OG1 2.77Å; F150-T168 PolarHBondContact O-N 2.71Å; F150-P201 HydrophobicContact CB-CB 3.89Å; F150-P201 HydrophobicContact CD1-CB 4.23Å; F150-P201 HydrophobicContact CD2-CB 3.46Å; F150-P201 VanDerWaalsContact CD2-CB 3.46Å; F150-P201 HydrophobicContact CD2-CG 3.64Å; F150-P201 HydrophobicContact CE2-CB 4Å; F150-P201 HydrophobicContact CE2-CG 3.72Å; F150-P201 HydrophobicContact CG-CB 3.58Å; F150-P201 HydrophobicContact CG-CG 4.25Å; F150-P201 HydrophobicContact CZ-CG 4.37Å
151	I	96.9	Very high	92	Very high	0 Å²	0	41 Å²	41	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	123.7	175	-54	-59.6	0	0	0	108.9	A93 A107 V111 L127 N149 L154 V165	A93-I151 HydrophobicContact CB-CG2 4.45Å; A107-I151 PolarHBondContact O-N 2.84Å; V111-I151 HydrophobicContact CG2-CD1 4.28Å; V111-I151 HydrophobicContact CG2-CG1 3.85Å; V111-I151 HydrophobicContact CG2-CG2 4.16Å; L127-I151 HydrophobicContact CD1-CD1 4.26Å; N149-I151 PolarHBondContact O-N 3.19Å; I151-L154 HydrophobicContact CG2-CD2 4.22Å; I151-L154 HydrophobicContact CG2-CG 4.46Å; I151-V165 HydrophobicContact CD1-CG1 4.21Å; I151-V165 HydrophobicContact CG2-CG1 4.1Å
152	R	95.3	Very high	92.2	Very high	8 Å²	8	41.2 Å²	41.2	3%	0.03	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	-21.1	-170.9	-67.2	-72.4	-89.4	159.7	-5.8	113.7	F150 C166 T168 V197 P201 Y203 F205 F1101	F150-R152 HydrophobicContact CB-CG 4.45Å; F150-R152 WeakPolarHBondContact O-CG 3.5Å; F150-R152 PolarHBondContact O-N 2.86Å; R152-C166 PolarHBondContact N-O 3.2Å; R152-T168 HydrophobicContact CG-CG2 4.21Å; R152-V197 HydrophobicContact CB-CG1 3.81Å; R152-V197 HydrophobicContact CB-CG2 3.98Å; R152-V197 HydrophobicContact CG-CG1 4.11Å; R152-P201 PolarHBondContact NH2-O 2.04Å; R152-Y203 PolarHBondContact NH2-O 2.04Å; R152-F205 HydrophobicContact CB-CE1 4.01Å; R152-F205 HydrophobicContact CB-CZ 3.91Å; R152-F1101 WeakPolarHBondContact O-CE1 3.44Å; R152-F1101 VanDerWaalsContact O-CZ 3.26Å; R152-F1101 WeakPolarHBondContact O-CZ 3.45Å
153	V	95.1	Very high	92.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	131.3	173.3	167.8	0	0	0	0	109.9	A155 L164 C166 F196 V197 F205 Y207 F215	V153-A155 HydrophobicContact CG1-CB 4.42Å; V153-L164 HydrophobicContact CG1-CD2 4.45Å; V153-C166 HydrophobicContact CB-CB 4.11Å; V153-C166 PolarHBondContact N-O 3.05Å; V153-C166 PolarHBondContact O-N 2.96Å; V153-C166 VanDerWaalsContact O-N 3.11Å; V153-F196 VanDerWaalsContact CG2-O 3.24Å; V153-F196 WeakPolarHBondContact CG2-O 3.29Å; V153-V197 HydrophobicContact CB-CG2 3.98Å; V153-V197 HydrophobicContact CG2-CG2 3.62Å; V153-F205 HydrophobicContact CG2-CE2 3.88Å; V153-F205 HydrophobicContact CG2-CZ 4.01Å; V153-Y207 HydrophobicContact CB-CE1 4.32Å; V153-Y207 HydrophobicContact CG1-CE1 4.43Å; V153-Y207 HydrophobicContact CG1-CE2 4.11Å; V153-Y207 HydrophobicContact CG2-CD1 3.93Å; V153-Y207 HydrophobicContact CG2-CE1 3.68Å; V153-Y207 HydrophobicContact CG2-CG 4.47Å; V153-F215 HydrophobicContact CG1-CE2 3.88Å; V153-F215 HydrophobicContact CG1-CZ 4.09Å; V153-F215 HydrophobicContact CG2-CZ 4.09Å
154	L	94.9	Very high	92.4	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	118.5	164.6	-66.3	173.8	0	0	0	106.5	A93 M95 I104 I151 V163 L164 V165 Y207	A93-L154 HydrophobicContact CB-CD1 3.9Å; A93-L154 HydrophobicContact CB-CG 4.01Å; M95-L154 HydrophobicContact CB-CB 3.74Å; M95-L154 HydrophobicContact CB-CD1 4.27Å; M95-L154 HydrophobicContact SD-CB 4.18Å; I104-L154 HydrophobicContact CB-CD1 4.24Å; I104-L154 HydrophobicContact CG2-CD1 3.81Å; I104-L154 HydrophobicContact CG2-CD2 3.93Å; I104-L154 HydrophobicContact CG2-CG 4.48Å; I104-L154 VanDerWaalsContact O-CD1 3.3Å; I104-L154 WeakPolarHBondContact O-CD1 3.45Å; I151-L154 HydrophobicContact CG2-CD2 4.22Å; I151-L154 HydrophobicContact CG2-CG 4.46Å; L154-V163 HydrophobicContact CD2-CG2 4.41Å; L154-L164 WeakPolarHBondContact CA-O 3.15Å; L154-V165 HydrophobicContact CD2-CB 4.38Å; L154-V165 HydrophobicContact CD2-CG1 4.22Å; L154-V165 HydrophobicContact CD2-CG2 3.86Å; L154-Y207 PolarHBondContact N-OH 3.25Å; L154-Y207 VanDerWaalsContact N-OH 3.11Å; L154-Y207 PolarHBondContact O-OH 3.23Å
155	A	92.5	Very high	92.6	Very high	2 Å²	2	32.7 Å²	32.7	2%	0.017	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	138.3	179.8	0	0	0	0	0	110.7	V153 V163 L164 Y207 A209	V153-A155 HydrophobicContact CG1-CB 4.42Å; A155-V163 CarbonylContact O-C 3.49Å; A155-V163 WeakPolarHBondContact O-CA 3.45Å; A155-V163 WeakPolarHBondContact O-CG2 3.42Å; A155-L164 HydrophobicContact CB-CB 4.36Å; A155-L164 PolarHBondContact N-O 2.75Å; A155-L164 VanDerWaalsContact N-O 3.11Å; A155-L164 PolarHBondContact O-N 2.94Å; A155-Y207 HydrophobicContact CB-CE2 4.3Å; A155-A209 HydrophobicContact CB-CB 3.8Å
156	P	90.9	Very high	92.9	Very high	55 Å²	55	26.5 Å²	26.5	36%	0.357	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	136.4	174.7	30.4	-33.4	0	0	0	109.9	M180	P156-M180 HydrophobicContact CB-CE 4.4Å
157	E	90.4	Very high	93.1	Very high	19 Å²	19	24.9 Å²	24.9	9%	0.089	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-74.7	158.9	168.1	-72.4	-60.8	114.4	0	0	111.1	G159 G160 Q162 L164 I177 R234	E157-G159 PolarHBondContact O-N 3.46Å; E157-G160 PolarHBondContact O-N 2.94Å; E157-Q162 HydrophobicContact CB-CB 3.81Å; E157-Q162 HydrophobicContact CG-CB 3.76Å; E157-Q162 PolarHBondContact N-O 3.02Å; E157-L164 WeakPolarHBondContact OE1-CB 3.48Å; E157-I177 HydrophobicContact CG-CG2 3.96Å; E157-R234 VanDerWaalsContact CD-NH1 3.27Å; E157-R234 IonicContact OE1-CZ 3.96Å; E157-R234 IonicContact OE1-NH1 2.66Å; E157-R234 PolarHBondContact OE1-NH1 3.11Å; E157-R234 IonicContact OE1-NH2 2.67Å; E157-R234 IonicContact OE2-CZ 3.77Å; E157-R234 IonicContact OE2-NH1 3.33Å; E157-R234 PolarHBondContact OE2-NH1 2.84Å; E157-R234 IonicContact OE2-NH2 3.22Å; E157-R234 PolarHBondContact OE2-NH2 2.84Å
158	P	86.8	Confident	93	Very high	67 Å²	67	24.9 Å²	24.9	44%	0.435	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	132	170.3	-29.7	37.4	0	0	0	112.5	G160	P158-G160 VanDerWaalsContact C-N 3.31Å
159	G	83.4	Confident	93	Very high	78 Å²	78	22.9 Å²	22.9	80%	0.804	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	-5	-174	0	0	0	0	0	115.3	E157 Q161	E157-G159 PolarHBondContact O-N 3.46Å; G159-Q161 PolarHBondContact O-N 2.84Å; G159-Q161 VanDerWaalsContact O-N 3.09Å
160	G	85.6	Confident	93	Very high	27 Å²	27	22.9 Å²	22.9	28%	0.278	15%	0.146	S	C	.	.	S	Bend	trans	66.9	12.1	166.7	0	0	0	0	0	116.2	R100 E157 P158	R100-G160 PolarHBondContact NH1-O 2.95Å; R100-G160 PolarHBondContact NH2-O 2.03Å; E157-G160 PolarHBondContact O-N 2.94Å; P158-G160 VanDerWaalsContact C-N 3.31Å
161	Q	91	Very high	92.8	Very high	135 Å²	135	22.8 Å²	22.8	63%	0.631	15%	0.146	S	C	*	.	S	Bend	trans	-92.7	-19.2	176.4	-66	-168.6	-4.1	0	0	113.7	G159 Q179 M180	G159-Q161 PolarHBondContact O-N 2.84Å; G159-Q161 VanDerWaalsContact O-N 3.09Å; Q161-Q179 PolarHBondContact O-OE1 3.49Å; Q161-M180 VanDerWaalsContact O-CB 3.26Å; Q161-M180 WeakPolarHBondContact O-CB 3.47Å; Q161-M180 PolarHBondContact O-N 3.4Å
162	Q	93.2	Very high	92.6	Very high	72 Å²	72	27.8 Å²	27.8	34%	0.336	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	160.7	179.9	-70.3	175.9	-12.2	0	0	111	E157 I177 R178 M180	E157-Q162 HydrophobicContact CB-CB 3.81Å; E157-Q162 HydrophobicContact CG-CB 3.76Å; E157-Q162 PolarHBondContact N-O 3.02Å; Q162-I177 HydrophobicContact CB-CG2 3.89Å; Q162-I177 HydrophobicContact CG-CG2 4.28Å; Q162-R178 CarbonylContact C-O 3.58Å; Q162-R178 WeakPolarHBondContact CA-O 3.07Å; Q162-R178 WeakPolarHBondContact CB-O 3.47Å; Q162-M180 WeakPolarHBondContact O-CE 3Å
163	V	93.4	Very high	92.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130.5	176.8	57	0	0	0	0	110	M95 I104 L154 A155 V165 R178 M180 L183	M95-V163 HydrophobicContact CE-CB 4.18Å; M95-V163 HydrophobicContact CE-CG2 3.65Å; M95-V163 HydrophobicContact SD-CG2 3.91Å; I104-V163 HydrophobicContact CD1-CB 4.49Å; I104-V163 HydrophobicContact CD1-CG1 4.03Å; L154-V163 HydrophobicContact CD2-CG2 4.41Å; A155-V163 CarbonylContact O-C 3.49Å; A155-V163 WeakPolarHBondContact O-CA 3.45Å; A155-V163 WeakPolarHBondContact O-CG2 3.42Å; V163-V165 HydrophobicContact CG1-CG2 4.11Å; V163-V165 HydrophobicContact CG2-CG2 4.21Å; V163-R178 HydrophobicContact CG1-CB 3.91Å; V163-R178 PolarHBondContact N-O 2.84Å; V163-R178 PolarHBondContact O-N 3.41Å; V163-M180 HydrophobicContact CB-CE 4.06Å; V163-M180 HydrophobicContact CB-SD 3.81Å; V163-M180 HydrophobicContact CG1-SD 4.07Å; V163-L183 HydrophobicContact CG1-CD2 3.89Å
164	L	93.2	Very high	92.5	Very high	3 Å²	3	28 Å²	28	2%	0.016	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	122	165.9	179	65.3	0	0	0	109	V153 L154 A155 E157 C175 I177 F196 F215	V153-L164 HydrophobicContact CG1-CD2 4.45Å; L154-L164 WeakPolarHBondContact CA-O 3.15Å; A155-L164 HydrophobicContact CB-CB 4.36Å; A155-L164 PolarHBondContact N-O 2.75Å; A155-L164 VanDerWaalsContact N-O 3.11Å; A155-L164 PolarHBondContact O-N 2.94Å; E157-L164 WeakPolarHBondContact OE1-CB 3.48Å; L164-C175 HydrophobicContact CD1-CB 4.14Å; L164-I177 HydrophobicContact CD1-CG1 4.17Å; L164-F196 HydrophobicContact CD2-CD1 3.88Å; L164-F196 HydrophobicContact CD2-CE1 3.77Å; L164-F215 HydrophobicContact CD2-CD2 4.26Å; L164-F215 HydrophobicContact CD2-CE2 4.38Å
165	V	95.6	Very high	92.4	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	116.7	178	-179.8	0	0	0	0	108.5	V111 L127 I151 L154 V163 C175 S176 R178	V111-V165 HydrophobicContact CG2-CG1 3.81Å; L127-V165 HydrophobicContact CD1-CG1 4.16Å; I151-V165 HydrophobicContact CD1-CG1 4.21Å; I151-V165 HydrophobicContact CG2-CG1 4.1Å; L154-V165 HydrophobicContact CD2-CB 4.38Å; L154-V165 HydrophobicContact CD2-CG1 4.22Å; L154-V165 HydrophobicContact CD2-CG2 3.86Å; V163-V165 HydrophobicContact CG1-CG2 4.11Å; V163-V165 HydrophobicContact CG2-CG2 4.21Å; V165-C175 CarbonylContact O-C 3.5Å; V165-C175 WeakPolarHBondContact O-CA 3.38Å; V165-S176 PolarHBondContact N-O 3.22Å; V165-S176 PolarHBondContact O-N 2.97Å; V165-R178 HydrophobicContact CB-CG 4.31Å; V165-R178 HydrophobicContact CG2-CB 4.3Å; V165-R178 HydrophobicContact CG2-CG 3.82Å
166	C	96.1	Very high	92.5	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.4	176.2	-47.9	0	0	0	0	112.3	R152 V153 S174 C175 F196 V197	R152-C166 PolarHBondContact N-O 3.2Å; V153-C166 HydrophobicContact CB-CB 4.11Å; V153-C166 PolarHBondContact N-O 3.05Å; V153-C166 PolarHBondContact O-N 2.96Å; V153-C166 VanDerWaalsContact O-N 3.11Å; C166-S174 VanDerWaalsContact CA-O 3.31Å; C166-S174 WeakPolarHBondContact CA-O 3.37Å; C166-C175 HydrophobicContact CB-CB 4.08Å; C166-C175 WeakPolarHBondContact CB-SG 3.46Å; C166-C175 WeakPolarHBondContact SG-CB 3.28Å; C166-C175 CovalentContact SG-SG 2.03Å; C166-C175 PolarHBondContact SG-SG 2.85Å; C166-F196 HydrophobicContact CB-CB 4.39Å; C166-V197 HydrophobicContact CB-CG2 3.52Å
167	G	96.1	Very high	92.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	170.4	178.3	0	0	0	0	0	113.6	N149 F150 D169 P173 S174	N149-G167 VanDerWaalsContact OD1-C 3.27Å; N149-G167 VanDerWaalsContact OD1-CA 3.31Å; N149-G167 WeakPolarHBondContact OD1-CA 3.49Å; F150-G167 CarbonylContact O-C 3.52Å; F150-G167 WeakPolarHBondContact O-CA 3.32Å; G167-D169 VanDerWaalsContact C-N 3.29Å; G167-D169 PolarHBondContact O-N 2.71Å; G167-P173 WeakPolarHBondContact O-CA 3.43Å; G167-S174 PolarHBondContact N-O 3.34Å; G167-S174 VanDerWaalsContact N-O 3.08Å; G167-S174 PolarHBondContact O-N 2.84Å
168	T	95	Very high	92.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.158	C	C	.	.			trans	-69.7	-24.5	-174	59.9	0	0	0	0	113.6	H148 N149 F150 R152 A170 F171 K172 V197 P201	H148-T168 PolarHBondContact O-OG1 2.84Å; N149-T168 PolarHBondContact OD1-N 2.99Å; F150-T168 HydrophobicContact CB-CG2 4.12Å; F150-T168 WeakPolarHBondContact CD2-OG1 3.44Å; F150-T168 PolarHBondContact N-OG1 2.77Å; F150-T168 PolarHBondContact O-N 2.71Å; R152-T168 HydrophobicContact CG-CG2 4.21Å; T168-A170 PolarHBondContact O-N 3.01Å; T168-F171 PolarHBondContact O-N 3.03Å; T168-F171 VanDerWaalsContact O-N 3.09Å; T168-K172 CarbonylContact O-C 3.56Å; T168-K172 PolarHBondContact O-N 2.92Å; T168-V197 HydrophobicContact CG2-CG1 3.84Å; T168-P201 HydrophobicContact CG2-CB 4.07Å
169	D	95.1	Very high	93.1	Very high	4 Å²	4	26.6 Å²	26.6	2%	0.021	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	40.8	59.7	173.3	-164.5	-8.4	0	0	0	113.9	A129 K133 N149 G167 K172 S174	A129-D169 WeakPolarHBondContact CA-OD1 3.48Å; A129-D169 WeakPolarHBondContact CB-OD1 3.39Å; K133-D169 WeakPolarHBondContact CD-OD1 3.43Å; K133-D169 IonicContact NZ-OD1 3.8Å; K133-D169 PolarHBondContact NZ-OD1 3.04Å; K133-D169 IonicContact NZ-OD2 3.3Å; K133-D169 PolarHBondContact NZ-OD2 3.31Å; N149-D169 HydrophobicContact CB-CB 4.38Å; N149-D169 WeakPolarHBondContact OD1-CA 3.49Å; N149-D169 PolarHBondContact OD1-N 2.75Å; G167-D169 VanDerWaalsContact C-N 3.29Å; G167-D169 PolarHBondContact O-N 2.71Å; D169-K172 PolarHBondContact O-N 2.91Å; D169-S174 VanDerWaalsContact OD2-CB 3.32Å; D169-S174 WeakPolarHBondContact OD2-CB 3.45Å; D169-S174 PolarHBondContact OD2-OG 3.5Å; D169-S174 VanDerWaalsContact OD2-OG 3.08Å
170	A	95.1	Very high	93.6	Very high	1 Å²	1	23 Å²	23	1%	0.008	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	58.5	-175.2	0	0	0	0	0	113.7	A129 K133 I134 C137 H148 T168 K172	A129-A170 HydrophobicContact CB-CB 3.72Å; K133-A170 HydrophobicContact CB-CB 3.97Å; I134-A170 HydrophobicContact CG1-CB 4.43Å; C137-A170 HydrophobicContact CB-CB 4.13Å; H148-A170 PolarHBondContact O-N 3.41Å; T168-A170 PolarHBondContact O-N 3.01Å; A170-K172 VanDerWaalsContact C-N 3.26Å; A170-K172 PolarHBondContact O-N 2.86Å
171	F	92.9	Very high	93.9	Very high	3 Å²	3	26.6 Å²	26.6	1%	0.013	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	40.7	-176.4	-66.2	-111	0	0	0	112.4	C137 R142 V146 T168 Y199 D200 F223	C137-F171 WeakPolarHBondContact SG-CD2 3.49Å; R142-F171 HydrophobicContact CB-CE2 4.29Å; R142-F171 HydrophobicContact CG-CD2 4.38Å; R142-F171 HydrophobicContact CG-CE1 4.22Å; R142-F171 HydrophobicContact CG-CE2 4.04Å; R142-F171 HydrophobicContact CG-CZ 3.95Å; V146-F171 HydrophobicContact CB-CE2 4.03Å; V146-F171 HydrophobicContact CB-CZ 4.42Å; V146-F171 HydrophobicContact CG2-CE2 3.75Å; V146-F171 HydrophobicContact CG2-CZ 4.07Å; V146-F171 WeakPolarHBondContact O-CE2 3.27Å; T168-F171 PolarHBondContact O-N 3.03Å; T168-F171 VanDerWaalsContact O-N 3.09Å; F171-Y199 WeakPolarHBondContact CD1-O 3.46Å; F171-Y199 WeakPolarHBondContact CG-O 3.39Å; F171-Y199 VanDerWaalsContact O-CD1 3.31Å; F171-Y199 WeakPolarHBondContact O-CD1 3.39Å; F171-D200 HydrophobicContact CD1-CB 4.44Å; F171-D200 HydrophobicContact CE1-CB 3.63Å; F171-D200 WeakPolarHBondContact CE1-OD2 3.31Å; F171-D200 HydrophobicContact CZ-CB 4.16Å; F171-D200 WeakPolarHBondContact CZ-OD2 3.45Å; F171-F223 HydrophobicContact CB-CD2 3.9Å; F171-F223 HydrophobicContact CB-CE2 3.67Å; F171-F223 AromaticContact CD1-CD2 3.63Å; F171-F223 HydrophobicContact CD1-CD2 3.63Å; F171-F223 AromaticContact CD1-CE2 3.33Å; F171-F223 HydrophobicContact CD1-CE2 3.33Å; F171-F223 HydrophobicContact CD1-CZ 4.24Å; F171-F223 HydrophobicContact CE1-CE2 4.14Å; F171-F223 HydrophobicContact CG-CD2 4.18Å; F171-F223 AromaticContact CG-CE2 3.73Å; F171-F223 HydrophobicContact CG-CE2 3.73Å
172	K	92.5	Very high	94	Very high	104 Å²	104	22.1 Å²	22.1	45%	0.452	11%	0.108	S	C	.	.	S	Bend	trans	-144.3	76.1	167.5	-164.9	-166.5	178.5	-173.7	0	109.8	K133 T168 D169 A170 S174	K133-K172 HydrophobicContact CD-CB 4.23Å; K133-K172 HydrophobicContact CD-CD 4.26Å; T168-K172 CarbonylContact O-C 3.56Å; T168-K172 PolarHBondContact O-N 2.92Å; D169-K172 PolarHBondContact O-N 2.91Å; A170-K172 VanDerWaalsContact C-N 3.26Å; A170-K172 PolarHBondContact O-N 2.86Å; K172-S174 PolarHBondContact O-N 2.03Å; K172-S174 PolarHBondContact O-OG 2.84Å
173	P	93.6	Very high	94	Very high	5 Å²	5	18.7 Å²	18.7	3%	0.032	9%	0.092	C	C	.	.			trans	-44.5	128.8	-172.9	-32.7	37.4	0	0	0	113.8	G167 G193 V197 Y199	G167-P173 WeakPolarHBondContact O-CA 3.43Å; P173-G193 WeakPolarHBondContact CB-O 3.43Å; P173-G193 WeakPolarHBondContact O-CA 3.47Å; P173-G193 PolarHBondContact O-N 3.3Å; P173-V197 HydrophobicContact CB-CB 4.47Å; P173-V197 WeakPolarHBondContact CB-O 3.49Å; P173-V197 VanDerWaalsContact CG-O 3.32Å; P173-V197 WeakPolarHBondContact CG-O 3.33Å; P173-Y199 HydrophobicContact CG-CD1 4.26Å; P173-Y199 HydrophobicContact CG-CD2 4.05Å; P173-Y199 HydrophobicContact CG-CE1 4.42Å; P173-Y199 HydrophobicContact CG-CE2 4.2Å; P173-Y199 HydrophobicContact CG-CG 4.07Å
174	S	94.3	Very high	94	Very high	8 Å²	8	26.6 Å²	26.6	6%	0.056	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	144.5	-174.8	-60.8	0	0	0	0	110.9	K133 C166 G167 D169 K172	K133-S174 PolarHBondContact NZ-OG 2.91Å; C166-S174 VanDerWaalsContact CA-O 3.31Å; C166-S174 WeakPolarHBondContact CA-O 3.37Å; G167-S174 PolarHBondContact N-O 3.34Å; G167-S174 VanDerWaalsContact N-O 3.08Å; G167-S174 PolarHBondContact O-N 2.84Å; D169-S174 VanDerWaalsContact OD2-CB 3.32Å; D169-S174 WeakPolarHBondContact OD2-CB 3.45Å; D169-S174 PolarHBondContact OD2-OG 3.5Å; D169-S174 VanDerWaalsContact OD2-OG 3.08Å; K172-S174 PolarHBondContact O-N 2.03Å; K172-S174 PolarHBondContact O-OG 2.84Å
175	C	94.2	Very high	93.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	154.9	-179.3	-70.8	0	0	0	0	112.6	L164 V165 C166 S190 Q191	L164-C175 HydrophobicContact CD1-CB 4.14Å; V165-C175 CarbonylContact O-C 3.5Å; V165-C175 WeakPolarHBondContact O-CA 3.38Å; C166-C175 HydrophobicContact CB-CB 4.08Å; C166-C175 WeakPolarHBondContact CB-SG 3.46Å; C166-C175 WeakPolarHBondContact SG-CB 3.28Å; C166-C175 CovalentContact SG-SG 2.03Å; C166-C175 PolarHBondContact SG-SG 2.85Å; C175-S190 PolarHBondContact O-N 2.75Å; C175-Q191 HydrophobicContact CB-CB 4.09Å; C175-Q191 PolarHBondContact N-O 3.24Å; C175-Q191 PolarHBondContact O-N 3.04Å
176	S	93.8	Very high	93.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	148.6	169.2	61	0	0	0	0	111.1	V165 R178 T187 P188	V165-S176 PolarHBondContact N-O 3.22Å; V165-S176 PolarHBondContact O-N 2.97Å; S176-R178 PolarHBondContact OG-NE 3.05Å; S176-T187 WeakPolarHBondContact CA-OG1 3.48Å; S176-T187 WeakPolarHBondContact CB-O 3.27Å; S176-P188 WeakPolarHBondContact CB-O 3.46Å
177	I	92.6	Very high	92.6	Very high	32 Å²	32	37 Å²	37	16%	0.164	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.5	172.2	-60.8	175.9	0	0	0	108.4	E157 Q162 L164 G186 T187	E157-I177 HydrophobicContact CG-CG2 3.96Å; Q162-I177 HydrophobicContact CB-CG2 3.89Å; Q162-I177 HydrophobicContact CG-CG2 4.28Å; L164-I177 HydrophobicContact CD1-CG1 4.17Å; I177-G186 CarbonylContact O-C 3.46Å; I177-G186 WeakPolarHBondContact O-CA 3.4Å; I177-T187 PolarHBondContact N-OG1 2.82Å; I177-T187 VanDerWaalsContact N-OG1 3.12Å; I177-T187 PolarHBondContact O-N 2.83Å
178	R	94.2	Very high	91.6	Very high	18 Å²	18	41.3 Å²	41.3	7%	0.068	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	149.9	-167.3	-59.2	-87.1	169.5	176.3	-1.6	110	Q162 V163 V165 S176 L183 T187	Q162-R178 CarbonylContact C-O 3.58Å; Q162-R178 WeakPolarHBondContact CA-O 3.07Å; Q162-R178 WeakPolarHBondContact CB-O 3.47Å; V163-R178 HydrophobicContact CG1-CB 3.91Å; V163-R178 PolarHBondContact N-O 2.84Å; V163-R178 PolarHBondContact O-N 3.41Å; V165-R178 HydrophobicContact CB-CG 4.31Å; V165-R178 HydrophobicContact CG2-CB 4.3Å; V165-R178 HydrophobicContact CG2-CG 3.82Å; S176-R178 PolarHBondContact OG-NE 3.05Å; R178-L183 HydrophobicContact CB-CD2 4.29Å; R178-L183 WeakPolarHBondContact CD-O 3.42Å; R178-L183 PolarHBondContact NH1-O 2.9Å; R178-L183 VanDerWaalsContact NH1-O 3.08Å; R178-T187 PolarHBondContact NH2-O 3.05Å
179	Q	94.4	Very high	90.4	Very high	67 Å²	67	43.1 Å²	43.1	31%	0.313	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	131.6	176.5	-67.2	-72.3	-7.1	0	0	110.7	Q161 N181 D182 L183 K185	Q161-Q179 PolarHBondContact O-OE1 3.49Å; Q179-N181 PolarHBondContact O-N 3.33Å; Q179-D182 CarbonylContact O-C 3.58Å; Q179-D182 PolarHBondContact O-N 2.83Å; Q179-D182 VanDerWaalsContact O-N 3.14Å; Q179-L183 PolarHBondContact O-N 2.84Å; Q179-K185 HydrophobicContact CB-CB 4.19Å; Q179-K185 HydrophobicContact CG-CB 3.95Å; Q179-K185 PolarHBondContact N-O 3.06Å
180	M	93.1	Very high	89	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.015	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.6	-175.1	-156.2	80.7	78.7	0	0	113.5	M95 D97 Q102 I104 P156 Q161 Q162 V163	M95-M180 HydrophobicContact CE-CE 3.79Å; M95-M180 HydrophobicContact CE-SD 3.56Å; M95-M180 VanDerWaalsContact CE-SD 3.56Å; D97-M180 WeakPolarHBondContact OD2-CG 3.42Å; Q102-M180 PolarHBondContact NE2-O 2.79Å; Q102-M180 VanDerWaalsContact NE2-O 3.13Å; I104-M180 HydrophobicContact CD1-CG 4.29Å; I104-M180 HydrophobicContact CD1-SD 3.36Å; I104-M180 WeakPolarHBondContact CD1-SD 3.25Å; I104-M180 HydrophobicContact CG1-SD 4.49Å; P156-M180 HydrophobicContact CB-CE 4.4Å; Q161-M180 VanDerWaalsContact O-CB 3.26Å; Q161-M180 WeakPolarHBondContact O-CB 3.47Å; Q161-M180 PolarHBondContact O-N 3.4Å; Q162-M180 WeakPolarHBondContact O-CE 3Å; V163-M180 HydrophobicContact CB-CE 4.06Å; V163-M180 HydrophobicContact CB-SD 3.81Å; V163-M180 HydrophobicContact CG1-SD 4.07Å
181	N	92.6	Very high	87.7	Confident	102 Å²	102	50.9 Å²	50.9	55%	0.545	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-13	179.6	-71.6	2.1	0	0	0	113.8	R100 R113 Q179	R100-N181 WeakPolarHBondContact CD-OD1 3.45Å; R100-N181 PolarHBondContact NE-OD1 2.84Å; R113-N181 VanDerWaalsContact NH1-C 3.29Å; R113-N181 PolarHBondContact NH1-O 3.46Å; Q179-N181 PolarHBondContact O-N 3.33Å
182	D	93.9	Very high	86.9	Confident	41 Å²	41	57.8 Å²	57.8	22%	0.219	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	92.5	-174.1	-178.3	-16	0	0	0	108.6	Q179 R184 K185	Q179-D182 CarbonylContact O-C 3.58Å; Q179-D182 PolarHBondContact O-N 2.83Å; Q179-D182 VanDerWaalsContact O-N 3.14Å; D182-R184 PolarHBondContact O-N 3.31Å; D182-R184 WeakPolarHBondContact OD1-CB 3.5Å; D182-R184 PolarHBondContact OD1-N 2.69Å; D182-K185 HydrophobicContact CB-CB 4.45Å; D182-K185 HydrophobicContact CB-CD 4.22Å; D182-K185 HydrophobicContact CB-CG 4.36Å; D182-K185 WeakPolarHBondContact O-CB 3.01Å; D182-K185 PolarHBondContact O-N 2.79Å; D182-K185 PolarHBondContact OD1-N 3.33Å; D182-K185 WeakPolarHBondContact OD2-CD 3.04Å; D182-K185 VanDerWaalsContact OD2-CE 3.29Å; D182-K185 WeakPolarHBondContact OD2-CE 3.35Å; D182-K185 IonicContact OD2-NZ 3.84Å; D182-K185 PolarHBondContact OD2-NZ 2.9Å
183	L	93.2	Very high	86.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	-19.5	-173	-58.2	174.4	0	0	0	112.2	I104 V111 R113 E123 L125 V163 R178 Q179 K185	I104-L183 HydrophobicContact CD1-CD2 4Å; V111-L183 HydrophobicContact CG1-CD1 3.85Å; R113-L183 HydrophobicContact CB-CD1 4.04Å; E123-L183 PolarHBondContact OE1-N 2.8Å; E123-L183 VanDerWaalsContact OE1-N 3.1Å; E123-L183 PolarHBondContact OE2-N 2.91Å; L125-L183 HydrophobicContact CB-CB 4.26Å; L125-L183 HydrophobicContact CD2-CB 3.83Å; L125-L183 WeakPolarHBondContact CD2-O 3.01Å; V163-L183 HydrophobicContact CG1-CD2 3.89Å; R178-L183 HydrophobicContact CB-CD2 4.29Å; R178-L183 WeakPolarHBondContact CD-O 3.42Å; R178-L183 PolarHBondContact NH1-O 2.9Å; R178-L183 VanDerWaalsContact NH1-O 3.08Å; Q179-L183 PolarHBondContact O-N 2.84Å; L183-K185 PolarHBondContact O-N 2.9Å
184	R	91.6	Very high	86.2	Confident	166 Å²	166	55.5 Å²	55.5	63%	0.626	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	-29.7	171.8	-65.7	153.8	-174	-102.6	-12.9	111.7	E123 R124 L125 D182 G186	E123-R184 WeakPolarHBondContact OE1-CG 3.31Å; E123-R184 PolarHBondContact OE1-N 2.84Å; E123-R184 IonicContact OE1-NE 2.65Å; R124-R184 PolarHBondContact O-NH2 2.89Å; L125-R184 HydrophobicContact CD1-CG 4.03Å; D182-R184 PolarHBondContact O-N 3.31Å; D182-R184 WeakPolarHBondContact OD1-CB 3.5Å; D182-R184 PolarHBondContact OD1-N 2.69Å; R184-G186 PolarHBondContact O-N 2.95Å
185	K	91	Very high	85.9	Confident	128 Å²	128	55.2 Å²	55.2	56%	0.557	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	112.7	172.4	-68.1	179.6	179.4	117.2	0	110.6	Q179 D182 L183	Q179-K185 HydrophobicContact CB-CB 4.19Å; Q179-K185 HydrophobicContact CG-CB 3.95Å; Q179-K185 PolarHBondContact N-O 3.06Å; D182-K185 HydrophobicContact CB-CB 4.45Å; D182-K185 HydrophobicContact CB-CD 4.22Å; D182-K185 HydrophobicContact CB-CG 4.36Å; D182-K185 WeakPolarHBondContact O-CB 3.01Å; D182-K185 PolarHBondContact O-N 2.79Å; D182-K185 PolarHBondContact OD1-N 3.33Å; D182-K185 WeakPolarHBondContact OD2-CD 3.04Å; D182-K185 VanDerWaalsContact OD2-CE 3.29Å; D182-K185 WeakPolarHBondContact OD2-CE 3.35Å; D182-K185 IonicContact OD2-NZ 3.84Å; D182-K185 PolarHBondContact OD2-NZ 2.9Å; L183-K185 PolarHBondContact O-N 2.9Å
186	G	84.5	Confident	85.8	Confident	45 Å²	45	56 Å²	56	46%	0.464	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	174.2	-176.4	177.9	0	0	0	0	0	112.2	I177 R184	I177-G186 CarbonylContact O-C 3.46Å; I177-G186 WeakPolarHBondContact O-CA 3.4Å; R184-G186 PolarHBondContact O-N 2.95Å
187	T	81.3	Confident	85.9	Confident	49 Å²	49	56 Å²	56	30%	0.301	29%	0.293	S	S	.	.			trans	-70.5	153.2	169.1	68.1	0	0	0	0	110.1	S176 I177 R178	S176-T187 WeakPolarHBondContact CA-OG1 3.48Å; S176-T187 WeakPolarHBondContact CB-O 3.27Å; I177-T187 PolarHBondContact N-OG1 2.82Å; I177-T187 VanDerWaalsContact N-OG1 3.12Å; I177-T187 PolarHBondContact O-N 2.83Å; R178-T187 PolarHBondContact NH2-O 3.05Å
188	P	74.6	Confident	85.9	Confident	92 Å²	92	54.4 Å²	54.4	60%	0.597	29%	0.285	S	S	*	.			trans	-58.8	163	161.9	26.5	-33.6	0	0	0	111	S176 S190	S176-P188 WeakPolarHBondContact CB-O 3.46Å; P188-S190 VanDerWaalsContact C-N 3.28Å; P188-S190 PolarHBondContact O-N 3.15Å
189	L	70.7	Confident	85.8	Confident	38 Å²	38	55.5 Å²	55.5	20%	0.199	29%	0.289	C	S	.	.	S	Bend	trans	-70.9	86.8	167.3	-79.9	169.1	0	0	0	108.8	L127	L127-L189 HydrophobicContact CB-CD1 3.9Å; L127-L189 HydrophobicContact CD1-CD1 4.17Å; L127-L189 HydrophobicContact CD2-CD1 4.04Å; L127-L189 HydrophobicContact CG-CD1 4.27Å
190	S	65.9	Low	85.7	Confident	88 Å²	88	53.3 Å²	53.3	62%	0.615	28%	0.28	S	S	*	.			trans	-144	-4.1	-178.7	68.8	0	0	0	0	114.5	C175 P188	C175-S190 PolarHBondContact O-N 2.75Å; P188-S190 VanDerWaalsContact C-N 3.28Å; P188-S190 PolarHBondContact O-N 3.15Å
191	Q	66.8	Low	85.7	Confident	80 Å²	80	53.2 Å²	53.2	37%	0.374	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	141.9	170.3	-64.5	179.6	1.6	0	0	109.4	C175 G193	C175-Q191 HydrophobicContact CB-CB 4.09Å; C175-Q191 PolarHBondContact N-O 3.24Å; C175-Q191 PolarHBondContact O-N 3.04Å; Q191-G193 PolarHBondContact O-N 2.84Å
192	E	75.1	Confident	85.5	Confident	148 Å²	148	52 Å²	52	69%	0.692	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	116.6	179.3	-175	161.5	-138.8	0	0	110.5	I194	E192-I194 HydrophobicContact CG-CB 4.21Å; E192-I194 HydrophobicContact CG-CD1 4.04Å; E192-I194 HydrophobicContact CG-CG1 3.82Å; E192-I194 VanDerWaalsContact OE1-CD1 3.27Å; E192-I194 WeakPolarHBondContact OE1-CD1 2.98Å
193	G	84.3	Confident	85.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.27	C	S	.	.			trans	-91.6	8.1	-175.7	0	0	0	0	0	114.6	P173 Q191 G195 F196 V197	P173-G193 WeakPolarHBondContact CB-O 3.43Å; P173-G193 WeakPolarHBondContact O-CA 3.47Å; P173-G193 PolarHBondContact O-N 3.3Å; Q191-G193 PolarHBondContact O-N 2.84Å; G193-G195 PolarHBondContact O-N 2.82Å; G193-F196 WeakPolarHBondContact O-CB 3.4Å; G193-F196 PolarHBondContact O-N 3.1Å; G193-V197 PolarHBondContact O-N 3.3Å
194	I	88.8	Confident	85.2	Confident	61 Å²	61	54.3 Å²	54.3	31%	0.313	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-60.3	127.2	-178	-60.1	-177.3	0	0	0	109	E192 F196 Y199	E192-I194 HydrophobicContact CG-CB 4.21Å; E192-I194 HydrophobicContact CG-CD1 4.04Å; E192-I194 HydrophobicContact CG-CG1 3.82Å; E192-I194 VanDerWaalsContact OE1-CD1 3.27Å; E192-I194 WeakPolarHBondContact OE1-CD1 2.98Å; I194-F196 PolarHBondContact O-N 2.91Å; I194-Y199 VanDerWaalsContact CD1-OH 3.28Å; I194-Y199 WeakPolarHBondContact CD1-OH 3.2Å
195	G	88.1	Confident	85.4	Confident	2 Å²	2	46.4 Å²	46.4	2%	0.021	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	-15.1	-178.2	0	0	0	0	0	115.4	G193 I219 I233	G193-G195 PolarHBondContact O-N 2.82Å; G195-I219 WeakPolarHBondContact O-CD1 3.06Å; G195-I233 WeakPolarHBondContact O-CD1 3.43Å
196	F	92.4	Very high	85.6	Confident	15 Å²	15	40.4 Å²	40.4	7%	0.066	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-44.7	163.8	-68.6	-85.2	0	0	0	110.3	V153 L164 C166 G193 I194 F205 F215 I233 R234	V153-F196 VanDerWaalsContact CG2-O 3.24Å; V153-F196 WeakPolarHBondContact CG2-O 3.29Å; L164-F196 HydrophobicContact CD2-CD1 3.88Å; L164-F196 HydrophobicContact CD2-CE1 3.77Å; C166-F196 HydrophobicContact CB-CB 4.39Å; G193-F196 WeakPolarHBondContact O-CB 3.4Å; G193-F196 PolarHBondContact O-N 3.1Å; I194-F196 PolarHBondContact O-N 2.91Å; F196-F205 WeakPolarHBondContact O-CE2 3.27Å; F196-F215 HydrophobicContact CB-CE1 4.35Å; F196-F215 AromaticContact CD1-CD1 3.52Å; F196-F215 HydrophobicContact CD1-CD1 3.52Å; F196-F215 HydrophobicContact CD1-CD2 4.03Å; F196-F215 AromaticContact CD1-CE1 3.55Å; F196-F215 HydrophobicContact CD1-CE1 3.55Å; F196-F215 HydrophobicContact CD1-CE2 4.05Å; F196-F215 AromaticContact CD1-CG 3.77Å; F196-F215 HydrophobicContact CD1-CG 3.77Å; F196-F215 AromaticContact CD1-CZ 3.82Å; F196-F215 HydrophobicContact CD1-CZ 3.82Å; F196-F215 HydrophobicContact CE1-CB 3.98Å; F196-F215 AromaticContact CE1-CD1 3.76Å; F196-F215 HydrophobicContact CE1-CD1 3.76Å; F196-F215 HydrophobicContact CE1-CD2 4.1Å; F196-F215 HydrophobicContact CE1-CE1 4.27Å; F196-F215 AromaticContact CE1-CG 3.67Å; F196-F215 HydrophobicContact CE1-CG 3.67Å; F196-F215 HydrophobicContact CG-CD1 4.45Å; F196-F215 HydrophobicContact CG-CE1 4.26Å; F196-I233 HydrophobicContact CD2-CD1 4.49Å; F196-I233 HydrophobicContact CD2-CG2 4.12Å; F196-I233 HydrophobicContact CE1-CG2 4.46Å; F196-I233 HydrophobicContact CE2-CB 4.38Å; F196-I233 HydrophobicContact CE2-CG2 3.45Å; F196-I233 VanDerWaalsContact CE2-CG2 3.45Å; F196-I233 HydrophobicContact CZ-CB 4.26Å; F196-I233 HydrophobicContact CZ-CG2 3.65Å; F196-R234 HydrophobicContact CE1-CG 4.22Å; F196-R234 HydrophobicContact CZ-CG 3.91Å
197	V	94.2	Very high	86.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-135.9	137.5	-175.2	169.8	0	0	0	0	110	R152 V153 C166 T168 P173 G193	R152-V197 HydrophobicContact CB-CG1 3.81Å; R152-V197 HydrophobicContact CB-CG2 3.98Å; R152-V197 HydrophobicContact CG-CG1 4.11Å; V153-V197 HydrophobicContact CB-CG2 3.98Å; V153-V197 HydrophobicContact CG2-CG2 3.62Å; C166-V197 HydrophobicContact CB-CG2 3.52Å; T168-V197 HydrophobicContact CG2-CG1 3.84Å; P173-V197 HydrophobicContact CB-CB 4.47Å; P173-V197 WeakPolarHBondContact CB-O 3.49Å; P173-V197 VanDerWaalsContact CG-O 3.32Å; P173-V197 WeakPolarHBondContact CG-O 3.33Å; G193-V197 PolarHBondContact O-N 3.3Å
198	P	92.8	Very high	86.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.19	C	C	.	.			trans	-67.2	158.8	178.3	26.5	-36.1	0	0	0	111.4	Y203 F205 I219 P220	P198-Y203 HydrophobicContact CB-CD2 4.21Å; P198-F205 HydrophobicContact CG-CD1 3.76Å; P198-F205 HydrophobicContact CG-CE1 4.19Å; P198-F205 HydrophobicContact CG-CG 4.16Å; P198-I219 HydrophobicContact CB-CG1 4.31Å; P198-P220 HydrophobicContact CB-CG 4.08Å
199	Y	92.8	Very high	87.5	Confident	40 Å²	40	33 Å²	33	16%	0.157	17%	0.169	C	C	.	.	S	Bend	trans	-65.4	-45.2	176.6	-78.7	-101.8	0	0	0	112.5	F171 P173 I194 L221 F223	F171-Y199 WeakPolarHBondContact CD1-O 3.46Å; F171-Y199 WeakPolarHBondContact CG-O 3.39Å; F171-Y199 VanDerWaalsContact O-CD1 3.31Å; F171-Y199 WeakPolarHBondContact O-CD1 3.39Å; P173-Y199 HydrophobicContact CG-CD1 4.26Å; P173-Y199 HydrophobicContact CG-CD2 4.05Å; P173-Y199 HydrophobicContact CG-CE1 4.42Å; P173-Y199 HydrophobicContact CG-CE2 4.2Å; P173-Y199 HydrophobicContact CG-CG 4.07Å; I194-Y199 VanDerWaalsContact CD1-OH 3.28Å; I194-Y199 WeakPolarHBondContact CD1-OH 3.2Å; Y199-L221 WeakPolarHBondContact CE2-O 3.35Å; Y199-F223 HydrophobicContact CD1-CB 4.2Å; Y199-F223 HydrophobicContact CD1-CD2 4.25Å; Y199-F223 HydrophobicContact CG-CB 4.37Å
200	D	92.3	Very high	88.1	Confident	21 Å²	21	31.6 Å²	31.6	11%	0.112	16%	0.161	C	C	.	.	S	Bend	trans	-91.2	130.2	179	-164.3	-57.7	0	0	0	110.9	F171 E202 Y203	F171-D200 HydrophobicContact CD1-CB 4.44Å; F171-D200 HydrophobicContact CE1-CB 3.63Å; F171-D200 WeakPolarHBondContact CE1-OD2 3.31Å; F171-D200 HydrophobicContact CZ-CB 4.16Å; F171-D200 WeakPolarHBondContact CZ-OD2 3.45Å; D200-E202 PolarHBondContact O-N 2.95Å; D200-E202 WeakPolarHBondContact OD1-CB 3.05Å; D200-E202 PolarHBondContact OD1-N 3.36Å; D200-Y203 HydrophobicContact CB-CD1 4.04Å; D200-Y203 HydrophobicContact CB-CD2 3.54Å; D200-Y203 HydrophobicContact CB-CE1 4.08Å; D200-Y203 HydrophobicContact CB-CE2 3.57Å; D200-Y203 HydrophobicContact CB-CG 3.77Å; D200-Y203 PolarHBondContact O-N 3.5Å
201	P	92.5	Very high	88.8	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.006	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.5	179.7	30.4	-38.5	0	0	0	115	K92 V146 F150 R152 T168	K92-P201 PolarHBondContact NZ-O 2.04Å; V146-P201 HydrophobicContact CB-CG 4.35Å; V146-P201 HydrophobicContact CG1-CG 4.48Å; F150-P201 HydrophobicContact CB-CB 3.89Å; F150-P201 HydrophobicContact CD1-CB 4.23Å; F150-P201 HydrophobicContact CD2-CB 3.46Å; F150-P201 VanDerWaalsContact CD2-CB 3.46Å; F150-P201 HydrophobicContact CD2-CG 3.64Å; F150-P201 HydrophobicContact CE2-CB 4Å; F150-P201 HydrophobicContact CE2-CG 3.72Å; F150-P201 HydrophobicContact CG-CB 3.58Å; F150-P201 HydrophobicContact CG-CG 4.25Å; F150-P201 HydrophobicContact CZ-CG 4.37Å; R152-P201 PolarHBondContact NH2-O 2.04Å; T168-P201 HydrophobicContact CG2-CB 4.07Å
202	E	89.8	Confident	89.6	Confident	78 Å²	78	33.1 Å²	33.1	36%	0.364	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-5.7	174.8	-60.3	-64.9	104.4	0	0	113	K92 D200 R529	K92-E202 IonicContact NZ-OE1 2.85Å; K92-E202 PolarHBondContact NZ-OE1 3.03Å; D200-E202 PolarHBondContact O-N 2.95Å; D200-E202 WeakPolarHBondContact OD1-CB 3.05Å; D200-E202 PolarHBondContact OD1-N 3.36Å; E202-R529 IonicContact OE1-NH1 2.89Å; E202-R529 IonicContact OE2-NH1 3.83Å; E202-R529 PolarHBondContact OE2-NH1 3.21Å
203	Y	90.5	Very high	90	Very high	54 Å²	54	26.5 Å²	26.5	21%	0.212	14%	0.136	C	C	.	.	S	Bend	trans	-69.5	134.4	172.7	-70.7	-19.8	0	0	0	111.8	R152 P198 D200 P220 T224 G225	R152-Y203 PolarHBondContact NH2-O 2.04Å; P198-Y203 HydrophobicContact CB-CD2 4.21Å; D200-Y203 HydrophobicContact CB-CD1 4.04Å; D200-Y203 HydrophobicContact CB-CD2 3.54Å; D200-Y203 HydrophobicContact CB-CE1 4.08Å; D200-Y203 HydrophobicContact CB-CE2 3.57Å; D200-Y203 HydrophobicContact CB-CG 3.77Å; D200-Y203 PolarHBondContact O-N 3.5Å; Y203-P220 HydrophobicContact CD2-CB 4.21Å; Y203-P220 HydrophobicContact CD2-CG 3.56Å; Y203-P220 HydrophobicContact CE2-CG 4.38Å; Y203-P220 HydrophobicContact CG-CG 3.94Å; Y203-T224 PolarHBondContact OH-O 3.47Å; Y203-G225 PolarHBondContact OH-N 3.31Å
204	N	90.2	Very high	90.3	Very high	34 Å²	34	27.6 Å²	27.6	18%	0.182	14%	0.141	C	C	.	.			trans	-80.6	130.5	175.2	-80.5	-27.4	0	0	0	110.3	T274 T1096 S1098	N204-T274 HydrophobicContact CB-CG2 4.07Å; N204-T1096 PolarHBondContact ND2-O 2.88Å; N204-S1098 WeakPolarHBondContact CB-OG 3.37Å; N204-S1098 PolarHBondContact ND2-OG 2.88Å; N204-S1098 PolarHBondContact OD1-N 3.41Å; N204-S1098 PolarHBondContact OD1-OG 2.91Å
205	F	94.4	Very high	90.5	Very high	1 Å²	1	24.8 Å²	24.8	0%	0.004	13%	0.126	C	C	.	.			trans	-151.1	162.2	179.9	83.3	-70.4	0	0	0	109.3	R152 V153 F196 P198 Y207 G218 I219 T1099	R152-F205 HydrophobicContact CB-CE1 4.01Å; R152-F205 HydrophobicContact CB-CZ 3.91Å; V153-F205 HydrophobicContact CG2-CE2 3.88Å; V153-F205 HydrophobicContact CG2-CZ 4.01Å; F196-F205 WeakPolarHBondContact O-CE2 3.27Å; P198-F205 HydrophobicContact CG-CD1 3.76Å; P198-F205 HydrophobicContact CG-CE1 4.19Å; P198-F205 HydrophobicContact CG-CG 4.16Å; F205-Y207 AromaticContact CE2-CD1 3.78Å; F205-Y207 HydrophobicContact CE2-CD1 3.78Å; F205-Y207 HydrophobicContact CE2-CE1 4.41Å; F205-Y207 HydrophobicContact CZ-CD1 4.31Å; F205-G218 VanDerWaalsContact CA-O 3.28Å; F205-G218 WeakPolarHBondContact CA-O 3.24Å; F205-G218 WeakPolarHBondContact CB-O 3.33Å; F205-I219 HydrophobicContact CB-CB 4.17Å; F205-I219 HydrophobicContact CB-CD1 4.5Å; F205-I219 HydrophobicContact CB-CG1 3.96Å; F205-I219 HydrophobicContact CD2-CD1 4.03Å; F205-I219 HydrophobicContact CD2-CG1 4.38Å; F205-I219 HydrophobicContact CG-CD1 4.46Å; F205-I219 HydrophobicContact CG-CG1 4.44Å; F205-T1099 HydrophobicContact CD1-CG2 3.66Å; F205-T1099 HydrophobicContact CE1-CG2 3.49Å; F205-T1099 VanDerWaalsContact CE1-CG2 3.49Å; F205-T1099 HydrophobicContact CZ-CG2 4.35Å; F205-T1099 WeakPolarHBondContact O-CG2 3.06Å
206	T	95	Very high	90.8	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	153.9	175.9	-166.8	0	0	0	0	110.1	A217 G218 F275 A277 A278 F287	T206-A217 CarbonylContact O-C 3.5Å; T206-A217 VanDerWaalsContact O-CA 3.24Å; T206-A217 WeakPolarHBondContact O-CA 3.2Å; T206-G218 PolarHBondContact N-O 2.84Å; T206-G218 PolarHBondContact O-N 3.08Å; T206-F275 HydrophobicContact CG2-CB 3.87Å; T206-A277 WeakPolarHBondContact OG1-CA 3.44Å; T206-A278 HydrophobicContact CG2-CB 3.85Å; T206-A278 PolarHBondContact OG1-N 3.09Å; T206-F287 HydrophobicContact CG2-CD1 4.04Å; T206-F287 HydrophobicContact CG2-CE1 4.34Å
207	Y	95.3	Very high	90.9	Very high	9 Å²	9	24 Å²	24	4%	0.035	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	159.3	-178.4	73.5	-90.4	0	0	0	113.3	V153 L154 A155 F205 F215 F216 F1101 N1102	V153-Y207 HydrophobicContact CB-CE1 4.32Å; V153-Y207 HydrophobicContact CG1-CE1 4.43Å; V153-Y207 HydrophobicContact CG1-CE2 4.11Å; V153-Y207 HydrophobicContact CG2-CD1 3.93Å; V153-Y207 HydrophobicContact CG2-CE1 3.68Å; V153-Y207 HydrophobicContact CG2-CG 4.47Å; L154-Y207 PolarHBondContact N-OH 3.25Å; L154-Y207 VanDerWaalsContact N-OH 3.11Å; L154-Y207 PolarHBondContact O-OH 3.23Å; A155-Y207 HydrophobicContact CB-CE2 4.3Å; F205-Y207 AromaticContact CE2-CD1 3.78Å; F205-Y207 HydrophobicContact CE2-CD1 3.78Å; F205-Y207 HydrophobicContact CE2-CE1 4.41Å; F205-Y207 HydrophobicContact CZ-CD1 4.31Å; Y207-F215 HydrophobicContact CD1-CZ 4.48Å; Y207-F215 HydrophobicContact CD2-CD2 4.42Å; Y207-F215 AromaticContact CD2-CE2 3.43Å; Y207-F215 HydrophobicContact CD2-CE2 3.43Å; Y207-F215 VanDerWaalsContact CD2-CE2 3.43Å; Y207-F215 AromaticContact CD2-CZ 3.57Å; Y207-F215 HydrophobicContact CD2-CZ 3.57Å; Y207-F215 AromaticContact CE2-CE2 3.91Å; Y207-F215 HydrophobicContact CE2-CE2 3.91Å; Y207-F215 HydrophobicContact CE2-CZ 4.3Å; Y207-F215 HydrophobicContact CG-CE2 4.04Å; Y207-F215 AromaticContact CG-CZ 3.66Å; Y207-F215 HydrophobicContact CG-CZ 3.66Å; Y207-F216 CarbonylContact C-O 3.54Å; Y207-F216 WeakPolarHBondContact CA-O 3.35Å; Y207-F216 VanDerWaalsContact CB-O 3.32Å; Y207-F216 WeakPolarHBondContact CB-O 3.43Å; Y207-F1101 AromaticContact CE1-CD1 3.95Å; Y207-F1101 HydrophobicContact CE1-CD1 3.95Å; Y207-F1101 AromaticContact CE1-CE1 3.85Å; Y207-F1101 HydrophobicContact CE1-CE1 3.85Å; Y207-F1101 AromaticContact CZ-CD1 3.81Å; Y207-F1101 AromaticContact CZ-CE1 3.98Å; Y207-F1101 WeakPolarHBondContact OH-CD1 3.44Å; Y207-F1101 VanDerWaalsContact OH-CE1 3.23Å; Y207-F1101 WeakPolarHBondContact OH-CE1 3.02Å; Y207-N1102 PolarHBondContact O-ND2 3.17Å
208	V	93.7	Very high	90.9	Very high	4 Å²	4	24 Å²	24	2%	0.024	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	128.8	170.4	176	0	0	0	0	107.3	F216 A278 E280 I285 N1102	V208-F216 PolarHBondContact N-O 2.86Å; V208-F216 PolarHBondContact O-N 2.96Å; V208-A278 HydrophobicContact CG2-CB 3.68Å; V208-E280 HydrophobicContact CG1-CB 4.04Å; V208-I285 HydrophobicContact CB-CG2 4.5Å; V208-I285 HydrophobicContact CG1-CD1 4.47Å; V208-I285 HydrophobicContact CG2-CG2 4.21Å; V208-N1102 HydrophobicContact CG2-CB 4.47Å; V208-N1102 WeakPolarHBondContact CG2-ND2 3.44Å
209	A	91.2	Very high	91	Very high	19 Å²	19	24 Å²	24	16%	0.157	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124	160	0	0	0	0	0	107.1	A155 Q214 F215	A155-A209 HydrophobicContact CB-CB 3.8Å; A209-Q214 WeakPolarHBondContact CA-O 3.3Å; A209-F215 HydrophobicContact CB-CD2 4.18Å
210	D	83.9	Confident	90.9	Very high	7 Å²	7	22.1 Å²	22.1	4%	0.037	12%	0.115	C	C	.	.			trans	-84.8	170.6	179.9	98.8	-54.4	0	0	0	111.1	N212 G213 Q214 K322	D210-N212 PolarHBondContact O-N 2.03Å; D210-N212 WeakPolarHBondContact OD1-CA 3.42Å; D210-N212 PolarHBondContact OD1-N 3.25Å; D210-N212 VanDerWaalsContact OD1-N 3.08Å; D210-N212 VanDerWaalsContact OD2-CB 3.26Å; D210-N212 WeakPolarHBondContact OD2-CB 3.26Å; D210-N212 PolarHBondContact OD2-N 3.3Å; D210-N212 PolarHBondContact OD2-ND2 2.76Å; D210-G213 PolarHBondContact O-N 2.97Å; D210-G213 VanDerWaalsContact O-N 3.11Å; D210-G213 PolarHBondContact OD1-N 3.19Å; D210-Q214 PolarHBondContact N-O 2.92Å; D210-Q214 WeakPolarHBondContact OD1-CA 3.21Å; D210-Q214 VanDerWaalsContact OD1-CB 3.25Å; D210-Q214 WeakPolarHBondContact OD1-CB 3.36Å; D210-Q214 PolarHBondContact OD1-N 3.43Å; D210-K322 WeakPolarHBondContact OD2-CE 3.29Å; D210-K322 IonicContact OD2-NZ 3.29Å; D210-K322 PolarHBondContact OD2-NZ 2.86Å
211	I	81.5	Confident	90.7	Very high	95 Å²	95	22.5 Å²	22.5	49%	0.487	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.3	177.5	-165	167.2	0	0	0	114.3	Y1104	I211-Y1104 HydrophobicContact CB-CE1 4.19Å; I211-Y1104 HydrophobicContact CB-CE2 4.02Å; I211-Y1104 HydrophobicContact CD1-CE1 3.96Å; I211-Y1104 HydrophobicContact CG1-CE1 4.34Å
212	N	82.2	Confident	90.3	Very high	105 Å²	105	24.2 Å²	24.2	56%	0.561	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.4	178.2	-53	-58.8	0	0	0	113.4	D210 K322	D210-N212 PolarHBondContact O-N 2.03Å; D210-N212 WeakPolarHBondContact OD1-CA 3.42Å; D210-N212 PolarHBondContact OD1-N 3.25Å; D210-N212 VanDerWaalsContact OD1-N 3.08Å; D210-N212 VanDerWaalsContact OD2-CB 3.26Å; D210-N212 WeakPolarHBondContact OD2-CB 3.26Å; D210-N212 PolarHBondContact OD2-N 3.3Å; D210-N212 PolarHBondContact OD2-ND2 2.76Å; N212-K322 PolarHBondContact ND2-NZ 2.93Å
213	G	84.2	Confident	90.1	Very high	10 Å²	10	23 Å²	23	10%	0.103	12%	0.119	C	C	.	.	S	Bend	trans	81.3	15.6	-179.1	0	0	0	0	0	114.8	D210 R234	D210-G213 PolarHBondContact O-N 2.97Å; D210-G213 VanDerWaalsContact O-N 3.11Å; D210-G213 PolarHBondContact OD1-N 3.19Å; G213-R234 VanDerWaalsContact O-CB 3.27Å; G213-R234 WeakPolarHBondContact O-CB 3.34Å; G213-R234 PolarHBondContact O-NE 2.79Å
214	Q	90.2	Very high	89.8	Confident	22 Å²	22	24 Å²	24	10%	0.103	13%	0.131	C	C	.	.			trans	-67.5	143.2	159.7	-59.1	176	-13.8	0	0	109.3	A209 D210 F216 R234 D323	A209-Q214 WeakPolarHBondContact CA-O 3.3Å; D210-Q214 PolarHBondContact N-O 2.92Å; D210-Q214 WeakPolarHBondContact OD1-CA 3.21Å; D210-Q214 VanDerWaalsContact OD1-CB 3.25Å; D210-Q214 WeakPolarHBondContact OD1-CB 3.36Å; D210-Q214 PolarHBondContact OD1-N 3.43Å; Q214-F216 HydrophobicContact CB-CD2 4.32Å; Q214-F216 HydrophobicContact CB-CE2 3.63Å; Q214-F216 HydrophobicContact CB-CZ 4.37Å; Q214-R234 VanDerWaalsContact CA-O 3.29Å; Q214-R234 WeakPolarHBondContact CA-O 3.05Å; Q214-R234 WeakPolarHBondContact CB-O 3Å; Q214-D323 PolarHBondContact NE2-OD1 3Å
215	F	92.8	Very high	89.3	Confident	3 Å²	3	22.8 Å²	22.8	1%	0.013	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119	-178.1	-171	-83.9	0	0	0	109.6	V153 L164 F196 Y207 A209 A217 R232 I233 R234	V153-F215 HydrophobicContact CG1-CE2 3.88Å; V153-F215 HydrophobicContact CG1-CZ 4.09Å; V153-F215 HydrophobicContact CG2-CZ 4.09Å; L164-F215 HydrophobicContact CD2-CD2 4.26Å; L164-F215 HydrophobicContact CD2-CE2 4.38Å; F196-F215 HydrophobicContact CB-CE1 4.35Å; F196-F215 AromaticContact CD1-CD1 3.52Å; F196-F215 HydrophobicContact CD1-CD1 3.52Å; F196-F215 HydrophobicContact CD1-CD2 4.03Å; F196-F215 AromaticContact CD1-CE1 3.55Å; F196-F215 HydrophobicContact CD1-CE1 3.55Å; F196-F215 HydrophobicContact CD1-CE2 4.05Å; F196-F215 AromaticContact CD1-CG 3.77Å; F196-F215 HydrophobicContact CD1-CG 3.77Å; F196-F215 AromaticContact CD1-CZ 3.82Å; F196-F215 HydrophobicContact CD1-CZ 3.82Å; F196-F215 HydrophobicContact CE1-CB 3.98Å; F196-F215 AromaticContact CE1-CD1 3.76Å; F196-F215 HydrophobicContact CE1-CD1 3.76Å; F196-F215 HydrophobicContact CE1-CD2 4.1Å; F196-F215 HydrophobicContact CE1-CE1 4.27Å; F196-F215 AromaticContact CE1-CG 3.67Å; F196-F215 HydrophobicContact CE1-CG 3.67Å; F196-F215 HydrophobicContact CG-CD1 4.45Å; F196-F215 HydrophobicContact CG-CE1 4.26Å; Y207-F215 HydrophobicContact CD1-CZ 4.48Å; Y207-F215 HydrophobicContact CD2-CD2 4.42Å; Y207-F215 AromaticContact CD2-CE2 3.43Å; Y207-F215 HydrophobicContact CD2-CE2 3.43Å; Y207-F215 VanDerWaalsContact CD2-CE2 3.43Å; Y207-F215 AromaticContact CD2-CZ 3.57Å; Y207-F215 HydrophobicContact CD2-CZ 3.57Å; Y207-F215 AromaticContact CE2-CE2 3.91Å; Y207-F215 HydrophobicContact CE2-CE2 3.91Å; Y207-F215 HydrophobicContact CE2-CZ 4.3Å; Y207-F215 HydrophobicContact CG-CE2 4.04Å; Y207-F215 AromaticContact CG-CZ 3.66Å; Y207-F215 HydrophobicContact CG-CZ 3.66Å; A209-F215 HydrophobicContact CB-CD2 4.18Å; F215-A217 HydrophobicContact CE1-CB 3.97Å; F215-R232 CarbonylContact O-C 3.59Å; F215-R232 WeakPolarHBondContact O-CA 3.47Å; F215-I233 PolarHBondContact O-N 2.8Å; F215-R234 HydrophobicContact CB-CB 4.01Å; F215-R234 HydrophobicContact CB-CG 4.21Å; F215-R234 PolarHBondContact N-O 3.27Å
216	F	94.3	Very high	88.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.4	179.8	-60.8	-101.8	0	0	0	110.2	Y207 V208 Q214 V231 R232 I285 F287 V320 K322 F336	Y207-F216 CarbonylContact C-O 3.54Å; Y207-F216 WeakPolarHBondContact CA-O 3.35Å; Y207-F216 VanDerWaalsContact CB-O 3.32Å; Y207-F216 WeakPolarHBondContact CB-O 3.43Å; V208-F216 PolarHBondContact N-O 2.86Å; V208-F216 PolarHBondContact O-N 2.96Å; Q214-F216 HydrophobicContact CB-CD2 4.32Å; Q214-F216 HydrophobicContact CB-CE2 3.63Å; Q214-F216 HydrophobicContact CB-CZ 4.37Å; F216-V231 CarbonylContact C-O 3.55Å; F216-V231 WeakPolarHBondContact CA-O 3.45Å; F216-R232 HydrophobicContact CD1-CB 3.73Å; F216-R232 HydrophobicContact CD1-CG 4.02Å; F216-R232 HydrophobicContact CE1-CB 3.73Å; F216-R232 HydrophobicContact CE1-CG 3.77Å; F216-R232 HydrophobicContact CE2-CG 4.32Å; F216-R232 HydrophobicContact CG-CB 4.42Å; F216-R232 HydrophobicContact CG-CG 4.41Å; F216-R232 HydrophobicContact CZ-CB 4.41Å; F216-R232 VanDerWaalsContact CZ-CD 3.49Å; F216-R232 HydrophobicContact CZ-CG 3.93Å; F216-I285 HydrophobicContact CB-CG2 4.33Å; F216-I285 HydrophobicContact CD1-CG1 3.97Å; F216-I285 HydrophobicContact CD2-CD1 4.25Å; F216-I285 HydrophobicContact CD2-CG1 3.94Å; F216-I285 HydrophobicContact CE1-CG1 3.94Å; F216-I285 HydrophobicContact CE2-CD1 4.19Å; F216-I285 HydrophobicContact CE2-CG1 3.92Å; F216-I285 HydrophobicContact CG-CG1 3.97Å; F216-I285 HydrophobicContact CG-CG2 4.48Å; F216-I285 HydrophobicContact CZ-CG1 3.92Å; F216-F287 HydrophobicContact CB-CZ 4.1Å; F216-V320 HydrophobicContact CD1-CG2 4.47Å; F216-V320 HydrophobicContact CE1-CG2 4.49Å; F216-K322 HydrophobicContact CE2-CG 4.33Å; F216-K322 HydrophobicContact CZ-CB 4.5Å; F216-K322 HydrophobicContact CZ-CG 4.1Å; F216-K322 WeakPolarHBondContact CZ-O 3.43Å; F216-F336 HydrophobicContact CD1-CZ 4.27Å; F216-F336 HydrophobicContact CE1-CE1 4.29Å; F216-F336 HydrophobicContact CE1-CZ 4.33Å
217	A	95.2	Very high	88.1	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	149.3	177.4	0	0	0	0	0	113	T206 F215 I219 I230 V231	T206-A217 CarbonylContact O-C 3.5Å; T206-A217 VanDerWaalsContact O-CA 3.24Å; T206-A217 WeakPolarHBondContact O-CA 3.2Å; F215-A217 HydrophobicContact CE1-CB 3.97Å; A217-I219 HydrophobicContact CB-CB 4.34Å; A217-I219 HydrophobicContact CB-CG2 4.12Å; A217-I230 CarbonylContact O-C 3.54Å; A217-I230 VanDerWaalsContact O-CA 3.27Å; A217-I230 WeakPolarHBondContact O-CA 3.07Å; A217-V231 HydrophobicContact CB-CG2 4.03Å; A217-V231 PolarHBondContact N-O 2.03Å; A217-V231 WeakPolarHBondContact O-CG2 3.04Å; A217-V231 PolarHBondContact O-N 3.33Å
218	G	95	Very high	87.8	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	112.1	163.7	0	0	0	0	0	108	F205 T206 A229 F275	F205-G218 VanDerWaalsContact CA-O 3.28Å; F205-G218 WeakPolarHBondContact CA-O 3.24Å; F205-G218 WeakPolarHBondContact CB-O 3.33Å; T206-G218 PolarHBondContact N-O 2.84Å; T206-G218 PolarHBondContact O-N 3.08Å; G218-A229 WeakPolarHBondContact CA-O 3.43Å; G218-F275 VanDerWaalsContact O-CD2 3.26Å; G218-F275 WeakPolarHBondContact O-CD2 3.49Å; G218-F275 WeakPolarHBondContact O-CG 3.43Å
219	I	93.3	Very high	87.6	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	145.5	-157.9	-168.8	168.7	0	0	0	113.1	G195 P198 F205 A217 L221 A229 V231 F275	G195-I219 WeakPolarHBondContact O-CD1 3.06Å; P198-I219 HydrophobicContact CB-CG1 4.31Å; F205-I219 HydrophobicContact CB-CB 4.17Å; F205-I219 HydrophobicContact CB-CD1 4.5Å; F205-I219 HydrophobicContact CB-CG1 3.96Å; F205-I219 HydrophobicContact CD2-CD1 4.03Å; F205-I219 HydrophobicContact CD2-CG1 4.38Å; F205-I219 HydrophobicContact CG-CD1 4.46Å; F205-I219 HydrophobicContact CG-CG1 4.44Å; A217-I219 HydrophobicContact CB-CB 4.34Å; A217-I219 HydrophobicContact CB-CG2 4.12Å; I219-L221 HydrophobicContact CG2-CD2 3.84Å; I219-L221 HydrophobicContact CG2-CG 4.47Å; I219-A229 PolarHBondContact N-O 3.34Å; I219-A229 PolarHBondContact O-N 3.1Å; I219-V231 HydrophobicContact CG2-CG2 3.9Å; I219-F275 VanDerWaalsContact N-CE2 3.27Å
220	P	90.7	Very high	87.7	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	121.7	161	27.2	-31.2	0	0	0	111.1	P198 Y203 F228	P198-P220 HydrophobicContact CB-CG 4.08Å; Y203-P220 HydrophobicContact CD2-CB 4.21Å; Y203-P220 HydrophobicContact CD2-CG 3.56Å; Y203-P220 HydrophobicContact CE2-CG 4.38Å; Y203-P220 HydrophobicContact CG-CG 3.94Å; P220-F228 HydrophobicContact CB-CD1 3.82Å; P220-F228 HydrophobicContact CB-CE1 3.83Å; P220-F228 HydrophobicContact CG-CD1 4.35Å; P220-F228 HydrophobicContact CG-CE1 4.14Å
221	L	87.9	Confident	88.1	Confident	28 Å²	28	28.8 Å²	28.8	15%	0.147	16%	0.155	C	C	.	.			trans	-84.6	-6.1	-174.4	-67.7	176	0	0	0	114.6	Y199 I219 D227 A229 V231	Y199-L221 WeakPolarHBondContact CE2-O 3.35Å; I219-L221 HydrophobicContact CG2-CD2 3.84Å; I219-L221 HydrophobicContact CG2-CG 4.47Å; L221-D227 WeakPolarHBondContact CB-O 3.05Å; L221-D227 PolarHBondContact N-O 3.48Å; L221-A229 HydrophobicContact CD1-CB 3.6Å; L221-A229 HydrophobicContact CG-CB 4.14Å; L221-V231 HydrophobicContact CD1-CG1 4.05Å; L221-V231 HydrophobicContact CD2-CG1 4.1Å
222	D	84.7	Confident	88.6	Confident	37 Å²	37	24.5 Å²	24.5	20%	0.198	13%	0.133	C	C	.	.	S	Bend	trans	-131.1	171.9	-170.6	85.7	-69.9	0	0	0	113.2	T224 G225 D226 D227	D222-T224 PolarHBondContact OD2-N 3.02Å; D222-T224 PolarHBondContact OD2-OG1 2.9Å; D222-G225 PolarHBondContact OD1-N 3.37Å; D222-G225 PolarHBondContact OD2-N 2.03Å; D222-D226 PolarHBondContact OD1-N 3.12Å; D222-D227 HydrophobicContact CB-CB 4.26Å; D222-D227 PolarHBondContact OD1-N 3.46Å
223	F	85.4	Confident	88.9	Confident	52 Å²	52	20.5 Å²	20.5	23%	0.228	11%	0.111	C	C	.	.	S	Bend	trans	-73.4	-25	-175.9	177.8	-88.9	0	0	0	114.4	L140 R142 F171 Y199	L140-F223 HydrophobicContact CB-CZ 3.98Å; L140-F223 HydrophobicContact CD1-CE2 3.99Å; L140-F223 HydrophobicContact CD1-CZ 4.05Å; R142-F223 HydrophobicContact CG-CE2 4.41Å; R142-F223 HydrophobicContact CG-CZ 3.99Å; R142-F223 PolarHBondContact NH2-O 3.34Å; F171-F223 HydrophobicContact CB-CD2 3.9Å; F171-F223 HydrophobicContact CB-CE2 3.67Å; F171-F223 AromaticContact CD1-CD2 3.63Å; F171-F223 HydrophobicContact CD1-CD2 3.63Å; F171-F223 AromaticContact CD1-CE2 3.33Å; F171-F223 HydrophobicContact CD1-CE2 3.33Å; F171-F223 HydrophobicContact CD1-CZ 4.24Å; F171-F223 HydrophobicContact CE1-CE2 4.14Å; F171-F223 HydrophobicContact CG-CD2 4.18Å; F171-F223 AromaticContact CG-CE2 3.73Å; F171-F223 HydrophobicContact CG-CE2 3.73Å; Y199-F223 HydrophobicContact CD1-CB 4.2Å; Y199-F223 HydrophobicContact CD1-CD2 4.25Å; Y199-F223 HydrophobicContact CG-CB 4.37Å
224	T	84.1	Confident	89.1	Confident	76 Å²	76	22.2 Å²	22.2	47%	0.466	12%	0.115	S	C	.	.	S	Bend	trans	-90.9	-17	179.5	67	0	0	0	0	112.9	Y203 D222 D226	Y203-T224 PolarHBondContact OH-O 3.47Å; D222-T224 PolarHBondContact OD2-N 3.02Å; D222-T224 PolarHBondContact OD2-OG1 2.9Å; T224-D226 VanDerWaalsContact OG1-CG 3.26Å; T224-D226 PolarHBondContact OG1-OD2 3.4Å
225	G	79.6	Confident	88.9	Confident	8 Å²	8	23.3 Å²	23.3	8%	0.082	12%	0.124	C	C	.	.	S	Bend	trans	76.2	31.8	-175.4	0	0	0	0	0	112.2	Y203 D222 F228	Y203-G225 PolarHBondContact OH-N 3.31Å; D222-G225 PolarHBondContact OD1-N 3.37Å; D222-G225 PolarHBondContact OD2-N 2.03Å; G225-F228 WeakPolarHBondContact O-CE2 3.09Å; G225-F228 VanDerWaalsContact O-CZ 3.27Å; G225-F228 WeakPolarHBondContact O-CZ 3.43Å
226	D	80.5	Confident	88.1	Confident	109 Å²	109	28.3 Å²	28.3	58%	0.583	15%	0.154	S	C	*	.			trans	-101.7	-17.7	177.9	-70.6	-40.9	0	0	0	112.6	D222 T224	D222-D226 PolarHBondContact OD1-N 3.12Å; T224-D226 VanDerWaalsContact OG1-CG 3.26Å; T224-D226 PolarHBondContact OG1-OD2 3.4Å
227	D	84.4	Confident	87.1	Confident	13 Å²	13	34 Å²	34	7%	0.07	18%	0.184	C	C	.	.			trans	-107	72.8	178.4	-162.4	19.8	0	0	0	112.5	L221 D222 R241 R244	L221-D227 WeakPolarHBondContact CB-O 3.05Å; L221-D227 PolarHBondContact N-O 3.48Å; D222-D227 HydrophobicContact CB-CB 4.26Å; D222-D227 PolarHBondContact OD1-N 3.46Å; D227-R241 IonicContact OD1-CZ 3.12Å; D227-R241 IonicContact OD1-NH1 2.74Å; D227-R241 IonicContact OD1-NH2 2.62Å; D227-R241 PolarHBondContact OD1-NH2 3.24Å; D227-R241 IonicContact OD2-CZ 2.89Å; D227-R241 IonicContact OD2-NH1 3.16Å; D227-R241 PolarHBondContact OD2-NH1 3.43Å; D227-R241 IonicContact OD2-NH2 2.65Å; D227-R241 PolarHBondContact OD2-NH2 3.29Å; D227-R244 WeakPolarHBondContact OD1-CD 3.38Å; D227-R244 IonicContact OD1-CZ 2.86Å; D227-R244 IonicContact OD1-NE 3.67Å; D227-R244 PolarHBondContact OD1-NE 3.1Å; D227-R244 IonicContact OD1-NH1 3.81Å; D227-R244 PolarHBondContact OD1-NH1 3.28Å; D227-R244 IonicContact OD1-NH2 2.7Å; D227-R244 IonicContact OD2-CZ 2.66Å; D227-R244 IonicContact OD2-NH1 3.09Å; D227-R244 PolarHBondContact OD2-NH1 3.46Å
228	F	88.6	Confident	86.3	Confident	39 Å²	39	37.9 Å²	37.9	17%	0.171	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	135.5	172.3	-61.7	-87.5	0	0	0	112	P220 G225 P273 F275	P220-F228 HydrophobicContact CB-CD1 3.82Å; P220-F228 HydrophobicContact CB-CE1 3.83Å; P220-F228 HydrophobicContact CG-CD1 4.35Å; P220-F228 HydrophobicContact CG-CE1 4.14Å; G225-F228 WeakPolarHBondContact O-CE2 3.09Å; G225-F228 VanDerWaalsContact O-CZ 3.27Å; G225-F228 WeakPolarHBondContact O-CZ 3.43Å; F228-P273 HydrophobicContact CB-CG 3.51Å; F228-P273 HydrophobicContact CD1-CG 3.75Å; F228-P273 HydrophobicContact CD2-CG 4.26Å; F228-P273 HydrophobicContact CE1-CG 4.48Å; F228-P273 HydrophobicContact CG-CG 3.6Å; F228-F275 HydrophobicContact CD1-CE2 4.25Å
229	A	90.7	Very high	85.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	153.9	174.4	0	0	0	0	0	112.5	G218 I219 L221 V231 T242	G218-A229 WeakPolarHBondContact CA-O 3.43Å; I219-A229 PolarHBondContact N-O 3.34Å; I219-A229 PolarHBondContact O-N 3.1Å; L221-A229 HydrophobicContact CD1-CB 3.6Å; L221-A229 HydrophobicContact CG-CB 4.14Å; A229-V231 HydrophobicContact CB-CG1 3.69Å; A229-T242 VanDerWaalsContact CA-OG1 3.28Å; A229-T242 WeakPolarHBondContact CA-OG1 3.03Å
230	I	93.1	Very high	85.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131.3	151.4	-72.5	159.5	0	0	0	107	A217 R241 T242 L270 F275 F287 F289 F336 F339	A217-I230 CarbonylContact O-C 3.54Å; A217-I230 VanDerWaalsContact O-CA 3.27Å; A217-I230 WeakPolarHBondContact O-CA 3.07Å; I230-R241 CarbonylContact O-C 3.59Å; I230-R241 VanDerWaalsContact O-CA 3.31Å; I230-R241 WeakPolarHBondContact O-CA 3.3Å; I230-T242 HydrophobicContact CB-CG2 3.83Å; I230-T242 PolarHBondContact N-OG1 3.49Å; I230-T242 PolarHBondContact O-N 2.91Å; I230-L270 HydrophobicContact CD1-CD2 4.46Å; I230-L270 HydrophobicContact CG1-CD1 4.34Å; I230-F275 HydrophobicContact CD1-CE1 4.14Å; I230-F275 HydrophobicContact CG1-CE1 3.8Å; I230-F275 HydrophobicContact CG1-CZ 4.21Å; I230-F287 HydrophobicContact CD1-CB 3.87Å; I230-F287 HydrophobicContact CD1-CD1 4.21Å; I230-F287 HydrophobicContact CD1-CD2 3.9Å; I230-F287 HydrophobicContact CD1-CG 3.72Å; I230-F287 HydrophobicContact CG1-CD1 4.05Å; I230-F287 HydrophobicContact CG1-CD2 4.26Å; I230-F287 HydrophobicContact CG1-CE1 4.27Å; I230-F287 HydrophobicContact CG1-CE2 4.46Å; I230-F287 HydrophobicContact CG1-CG 4.04Å; I230-F287 HydrophobicContact CG1-CZ 4.46Å; I230-F287 HydrophobicContact CG2-CD2 3.92Å; I230-F287 HydrophobicContact CG2-CE1 4.22Å; I230-F287 HydrophobicContact CG2-CE2 3.43Å; I230-F287 VanDerWaalsContact CG2-CE2 3.43Å; I230-F287 HydrophobicContact CG2-CG 4.49Å; I230-F287 HydrophobicContact CG2-CZ 3.6Å; I230-F289 HydrophobicContact CD1-CE1 4.34Å; I230-F336 HydrophobicContact CG2-CE2 4.19Å; I230-F339 HydrophobicContact CD1-CD2 4.43Å; I230-F339 HydrophobicContact CD1-CE2 3.73Å
231	V	92.8	Very high	85.5	Confident	6 Å²	6	44.5 Å²	44.5	4%	0.036	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.6	-172	-64.1	0	0	0	0	112	F216 A217 I219 L221 A229 I233 L240 R241	F216-V231 CarbonylContact C-O 3.55Å; F216-V231 WeakPolarHBondContact CA-O 3.45Å; A217-V231 HydrophobicContact CB-CG2 4.03Å; A217-V231 PolarHBondContact N-O 2.03Å; A217-V231 WeakPolarHBondContact O-CG2 3.04Å; A217-V231 PolarHBondContact O-N 3.33Å; I219-V231 HydrophobicContact CG2-CG2 3.9Å; L221-V231 HydrophobicContact CD1-CG1 4.05Å; L221-V231 HydrophobicContact CD2-CG1 4.1Å; A229-V231 HydrophobicContact CB-CG1 3.69Å; V231-I233 HydrophobicContact CB-CD1 4.48Å; V231-I233 HydrophobicContact CB-CG1 4.14Å; V231-I233 HydrophobicContact CG2-CD1 3.69Å; V231-I233 HydrophobicContact CG2-CG1 3.85Å; V231-L240 CarbonylContact C-O 3.58Å; V231-L240 VanDerWaalsContact CA-O 3.23Å; V231-L240 WeakPolarHBondContact CA-O 3.03Å; V231-R241 HydrophobicContact CG1-CB 3.79Å
232	R	91.9	Very high	85.3	Confident	5 Å²	5	43.3 Å²	43.3	2%	0.019	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.5	157	-176.5	-177.8	69.4	-155.8	-3.5	107.7	F215 F216 R234 M238 L239 L240 K322 E324 F336	F215-R232 CarbonylContact O-C 3.59Å; F215-R232 WeakPolarHBondContact O-CA 3.47Å; F216-R232 HydrophobicContact CD1-CB 3.73Å; F216-R232 HydrophobicContact CD1-CG 4.02Å; F216-R232 HydrophobicContact CE1-CB 3.73Å; F216-R232 HydrophobicContact CE1-CG 3.77Å; F216-R232 HydrophobicContact CE2-CG 4.32Å; F216-R232 HydrophobicContact CG-CB 4.42Å; F216-R232 HydrophobicContact CG-CG 4.41Å; F216-R232 HydrophobicContact CZ-CB 4.41Å; F216-R232 VanDerWaalsContact CZ-CD 3.49Å; F216-R232 HydrophobicContact CZ-CG 3.93Å; R232-R234 WeakPolarHBondContact CD-O 3.33Å; R232-R234 WeakPolarHBondContact CG-O 3.32Å; R232-M238 PolarHBondContact NE-O 3.42Å; R232-M238 PolarHBondContact NH2-O 2.83Å; R232-L239 WeakPolarHBondContact O-CA 3.48Å; R232-L240 HydrophobicContact CB-CB 4.43Å; R232-L240 PolarHBondContact N-O 2.9Å; R232-L240 PolarHBondContact O-N 3.11Å; R232-L240 VanDerWaalsContact O-N 3.1Å; R232-K322 PolarHBondContact NH1-O 2.86Å; R232-E324 VanDerWaalsContact CZ-O 3.23Å; R232-E324 PolarHBondContact NH1-O 2.93Å; R232-E324 PolarHBondContact NH2-O 2.03Å; R232-F336 HydrophobicContact CB-CE1 4.41Å; R232-F336 HydrophobicContact CB-CZ 3.81Å
233	I	88.8	Confident	84.7	Confident	22 Å²	22	45.5 Å²	45.5	11%	0.113	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-20.7	-173.8	-57.7	164	0	0	0	112.1	G195 F196 F215 V231 L239	G195-I233 WeakPolarHBondContact O-CD1 3.43Å; F196-I233 HydrophobicContact CD2-CD1 4.49Å; F196-I233 HydrophobicContact CD2-CG2 4.12Å; F196-I233 HydrophobicContact CE1-CG2 4.46Å; F196-I233 HydrophobicContact CE2-CB 4.38Å; F196-I233 HydrophobicContact CE2-CG2 3.45Å; F196-I233 VanDerWaalsContact CE2-CG2 3.45Å; F196-I233 HydrophobicContact CZ-CB 4.26Å; F196-I233 HydrophobicContact CZ-CG2 3.65Å; F215-I233 PolarHBondContact O-N 2.8Å; V231-I233 HydrophobicContact CB-CD1 4.48Å; V231-I233 HydrophobicContact CB-CG1 4.14Å; V231-I233 HydrophobicContact CG2-CD1 3.69Å; V231-I233 HydrophobicContact CG2-CG1 3.85Å; I233-L239 HydrophobicContact CB-CD2 4.37Å; I233-L239 HydrophobicContact CG2-CD2 4.13Å; I233-L239 VanDerWaalsContact O-CD2 3.3Å; I233-L239 WeakPolarHBondContact O-CD2 3.36Å
234	R	87.9	Confident	83.9	Confident	45 Å²	45	47.3 Å²	47.3	17%	0.17	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.3	170.2	-70.1	175.4	56.6	164	0.5	110.4	E157 F196 G213 Q214 F215 R232	E157-R234 VanDerWaalsContact CD-NH1 3.27Å; E157-R234 IonicContact OE1-CZ 3.96Å; E157-R234 IonicContact OE1-NH1 2.66Å; E157-R234 PolarHBondContact OE1-NH1 3.11Å; E157-R234 IonicContact OE1-NH2 2.67Å; E157-R234 IonicContact OE2-CZ 3.77Å; E157-R234 IonicContact OE2-NH1 3.33Å; E157-R234 PolarHBondContact OE2-NH1 2.84Å; E157-R234 IonicContact OE2-NH2 3.22Å; E157-R234 PolarHBondContact OE2-NH2 2.84Å; F196-R234 HydrophobicContact CE1-CG 4.22Å; F196-R234 HydrophobicContact CZ-CG 3.91Å; G213-R234 VanDerWaalsContact O-CB 3.27Å; G213-R234 WeakPolarHBondContact O-CB 3.34Å; G213-R234 PolarHBondContact O-NE 2.79Å; Q214-R234 VanDerWaalsContact CA-O 3.29Å; Q214-R234 WeakPolarHBondContact CA-O 3.05Å; Q214-R234 WeakPolarHBondContact CB-O 3Å; F215-R234 HydrophobicContact CB-CB 4.01Å; F215-R234 HydrophobicContact CB-CG 4.21Å; F215-R234 PolarHBondContact N-O 3.27Å; R232-R234 WeakPolarHBondContact CD-O 3.33Å; R232-R234 WeakPolarHBondContact CG-O 3.32Å
235	P	85.4	Confident	82.5	Confident	46 Å²	46	44.9 Å²	44.9	30%	0.299	23%	0.225	S	C	.	.	S	Bend	cis	-75.7	155.3	-0.5	38.5	-39.6	0	0	0	111.8	D237 M238	P235-D237 VanDerWaalsContact C-N 3.26Å; P235-D237 VanDerWaalsContact CB-OD1 3.24Å; P235-D237 WeakPolarHBondContact CB-OD1 3.29Å; P235-D237 PolarHBondContact O-N 2.91Å; P235-M238 HydrophobicContact CG-CB 4.09Å; P235-M238 HydrophobicContact CG-CG 4.14Å; P235-M238 HydrophobicContact CG-SD 4.36Å; P235-M238 CarbonylContact O-C 3.53Å; P235-M238 PolarHBondContact O-N 2.91Å; P235-M238 VanDerWaalsContact O-N 3.1Å
236	V	76.4	Confident	80.9	Confident	108 Å²	108	47 Å²	47	66%	0.655	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-71.9	-20.1	-167.3	-178.2	0	0	0	0	112.9	M238 L239	V236-M238 VanDerWaalsContact C-N 3.33Å; V236-L239 WeakPolarHBondContact O-CG 3.4Å
237	D	74	Confident	78.9	Confident	118 Å²	118	52 Å²	52	63%	0.631	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-80.5	-9.7	173.3	61.6	-47.1	0	0	0	113.5	P235	P235-D237 VanDerWaalsContact C-N 3.26Å; P235-D237 VanDerWaalsContact CB-OD1 3.24Å; P235-D237 WeakPolarHBondContact CB-OD1 3.29Å; P235-D237 PolarHBondContact O-N 2.91Å
238	M	78.1	Confident	76.3	Confident	82 Å²	82	57.2 Å²	57.2	40%	0.404	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-130.7	47.7	-178.6	-50.7	-172.9	-160.7	0	0	112.1	R232 P235 V236 L240	R232-M238 PolarHBondContact NE-O 3.42Å; R232-M238 PolarHBondContact NH2-O 2.83Å; P235-M238 HydrophobicContact CG-CB 4.09Å; P235-M238 HydrophobicContact CG-CG 4.14Å; P235-M238 HydrophobicContact CG-SD 4.36Å; P235-M238 CarbonylContact O-C 3.53Å; P235-M238 PolarHBondContact O-N 2.91Å; P235-M238 VanDerWaalsContact O-N 3.1Å; V236-M238 VanDerWaalsContact C-N 3.33Å; M238-L240 PolarHBondContact O-N 3.25Å
239	L	84.5	Confident	73.5	Confident	81 Å²	81	61.7 Å²	61.7	42%	0.424	32%	0.315	S	S	.	.			trans	-59.3	129.3	174.4	-59.6	178	0	0	0	110.5	R232 I233 V236 M334	R232-L239 WeakPolarHBondContact O-CA 3.48Å; I233-L239 HydrophobicContact CB-CD2 4.37Å; I233-L239 HydrophobicContact CG2-CD2 4.13Å; I233-L239 VanDerWaalsContact O-CD2 3.3Å; I233-L239 WeakPolarHBondContact O-CD2 3.36Å; V236-L239 WeakPolarHBondContact O-CG 3.4Å; L239-M334 VanDerWaalsContact O-CB 3.3Å; L239-M334 WeakPolarHBondContact O-CB 3.32Å
240	L	87.6	Confident	70.6	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.021	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	141.5	171.1	-65	-179.8	0	0	0	109.5	V231 R232 M238 E324 M334 F336	V231-L240 CarbonylContact C-O 3.58Å; V231-L240 VanDerWaalsContact CA-O 3.23Å; V231-L240 WeakPolarHBondContact CA-O 3.03Å; R232-L240 HydrophobicContact CB-CB 4.43Å; R232-L240 PolarHBondContact N-O 2.9Å; R232-L240 PolarHBondContact O-N 3.11Å; R232-L240 VanDerWaalsContact O-N 3.1Å; M238-L240 PolarHBondContact O-N 3.25Å; L240-E324 HydrophobicContact CD1-CB 3.99Å; L240-E324 HydrophobicContact CD1-CG 4.44Å; L240-E324 WeakPolarHBondContact CD1-O 3.44Å; L240-M334 HydrophobicContact CD2-CB 4.23Å; L240-M334 HydrophobicContact CD2-CE 4Å; L240-F336 HydrophobicContact CB-CD1 3.99Å; L240-F336 HydrophobicContact CB-CD2 4.06Å; L240-F336 HydrophobicContact CB-CE1 3.75Å; L240-F336 HydrophobicContact CB-CE2 3.82Å; L240-F336 HydrophobicContact CB-CG 4.14Å; L240-F336 HydrophobicContact CB-CZ 3.67Å; L240-F336 HydrophobicContact CD1-CD1 3.64Å; L240-F336 HydrophobicContact CD1-CE1 3.64Å; L240-F336 HydrophobicContact CD1-CG 4.41Å; L240-F336 HydrophobicContact CD1-CZ 4.4Å; L240-F336 HydrophobicContact CG-CD1 4.46Å; L240-F336 HydrophobicContact CG-CE1 4.35Å
241	R	88.5	Confident	67.6	Low	56 Å²	56	78.4 Å²	78.4	21%	0.211	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	161.3	169.2	63.8	170.5	-69.1	168	1	112.7	D227 I230 V231 R243 M334 W335 F336	D227-R241 IonicContact OD1-CZ 3.12Å; D227-R241 IonicContact OD1-NH1 2.74Å; D227-R241 IonicContact OD1-NH2 2.62Å; D227-R241 PolarHBondContact OD1-NH2 3.24Å; D227-R241 IonicContact OD2-CZ 2.89Å; D227-R241 IonicContact OD2-NH1 3.16Å; D227-R241 PolarHBondContact OD2-NH1 3.43Å; D227-R241 IonicContact OD2-NH2 2.65Å; D227-R241 PolarHBondContact OD2-NH2 3.29Å; I230-R241 CarbonylContact O-C 3.59Å; I230-R241 VanDerWaalsContact O-CA 3.31Å; I230-R241 WeakPolarHBondContact O-CA 3.3Å; V231-R241 HydrophobicContact CG1-CB 3.79Å; R241-R243 PolarHBondContact O-N 3.39Å; R241-M334 PolarHBondContact N-O 3.27Å; R241-W335 WeakPolarHBondContact O-CA 3.08Å; R241-W335 VanDerWaalsContact O-CB 3.27Å; R241-W335 WeakPolarHBondContact O-CB 3.26Å; R241-F336 PolarHBondContact O-N 3.04Å; R241-F336 VanDerWaalsContact O-N 3.15Å
242	T	85	Confident	64.8	Low	3 Å²	3	80 Å²	80	2%	0.018	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-63.7	129.9	159.7	45.7	0	0	0	0	108.8	A229 I230 L270 F339	A229-T242 VanDerWaalsContact CA-OG1 3.28Å; A229-T242 WeakPolarHBondContact CA-OG1 3.03Å; I230-T242 HydrophobicContact CB-CG2 3.83Å; I230-T242 PolarHBondContact N-OG1 3.49Å; I230-T242 PolarHBondContact O-N 2.91Å; T242-L270 HydrophobicContact CG2-CD1 4.25Å; T242-L270 WeakPolarHBondContact OG1-CD1 3.24Å; T242-F339 HydrophobicContact CG2-CB 4.48Å; T242-F339 HydrophobicContact CG2-CD1 3.97Å; T242-F339 HydrophobicContact CG2-CD2 3.76Å; T242-F339 HydrophobicContact CG2-CE1 4.13Å; T242-F339 HydrophobicContact CG2-CE2 3.92Å; T242-F339 HydrophobicContact CG2-CG 3.79Å; T242-F339 HydrophobicContact CG2-CZ 4.11Å
243	R	72.4	Confident	62.1	Low	82 Å²	82	88 Å²	88	31%	0.309	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-57.7	135.4	-176.8	-171.4	175.8	-177.5	177.5	3.2	111.3	R241 L269 W335 N448	R241-R243 PolarHBondContact O-N 3.39Å; R243-L269 HydrophobicContact CB-CD1 3.88Å; R243-L269 WeakPolarHBondContact O-CD1 3.4Å; R243-L269 WeakPolarHBondContact O-CG 3.04Å; R243-W335 HydrophobicContact CB-CB 4.18Å; R243-W335 HydrophobicContact CB-CG 4.41Å; R243-W335 HydrophobicContact CG-CE3 4.3Å; R243-N448 PolarHBondContact NH1-OD1 2.95Å
244	R	67.5	Low	59.7	Low	90 Å²	90	95.1 Å²	95.1	34%	0.34	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-87.6	135.5	168.2	-160.6	173.9	-169.7	164.6	7.7	108.4	D227 G246 W268	D227-R244 WeakPolarHBondContact OD1-CD 3.38Å; D227-R244 IonicContact OD1-CZ 2.86Å; D227-R244 IonicContact OD1-NE 3.67Å; D227-R244 PolarHBondContact OD1-NE 3.1Å; D227-R244 IonicContact OD1-NH1 3.81Å; D227-R244 PolarHBondContact OD1-NH1 3.28Å; D227-R244 IonicContact OD1-NH2 2.7Å; D227-R244 IonicContact OD2-CZ 2.66Å; D227-R244 IonicContact OD2-NH1 3.09Å; D227-R244 PolarHBondContact OD2-NH1 3.46Å; R244-G246 PolarHBondContact O-N 2.79Å; R244-G246 VanDerWaalsContact O-N 3.09Å; R244-W268 HydrophobicContact CG-CE3 4.32Å; R244-W268 HydrophobicContact CG-CH2 4.13Å; R244-W268 HydrophobicContact CG-CZ3 3.57Å
245	P	54.9	Low	57.6	Low	26 Å²	26	97.1 Å²	97.1	17%	0.169	50%	0.498	C	S	.	.			trans	-66	113.3	171.5	27.8	-33.5	0	0	0	108.4	H266 W268	P245-H266 HydrophobicContact CB-CB 4.43Å; P245-H266 WeakPolarHBondContact CB-ND1 3.29Å; P245-H266 HydrophobicContact CG-CB 4.16Å; P245-H266 WeakPolarHBondContact CG-ND1 3.48Å; P245-H266 PolarHBondContact O-CE1 2.95Å; P245-H266 VanDerWaalsContact O-CE1 3.22Å; P245-H266 PolarHBondContact O-ND1 2.94Å; P245-H266 VanDerWaalsContact O-ND1 3.16Å; P245-W268 HydrophobicContact CG-CD2 3.73Å; P245-W268 HydrophobicContact CG-CE3 3.98Å; P245-W268 HydrophobicContact CG-CG 4.06Å; P245-W268 HydrophobicContact CG-CZ2 4.36Å; P245-W268 HydrophobicContact CG-CZ3 4.42Å
246	G	46.4	Very low	55.7	Low	52 Å²	52	104.7 Å²	104.7	54%	0.536	53%	0.527	S	S	.	.			trans	-60.2	135.3	-171.7	0	0	0	0	0	112.3	R244 T248 H266	R244-G246 PolarHBondContact O-N 2.79Å; R244-G246 VanDerWaalsContact O-N 3.09Å; G246-T248 PolarHBondContact O-N 2.8Å; G246-H266 PolarHBondContact O-CE1 3.43Å; G246-H266 VanDerWaalsContact O-CE1 3.3Å
247	R	38.3	Very low	54.3	Low	215 Å²	215	105.7 Å²	105.7	81%	0.811	53%	0.533	S	S	*	.			trans	-66.7	99.5	172	-82.5	-176.6	172.7	174.5	-0.7	109	L249	R247-L249 PolarHBondContact O-N 3.03Å
248	T	30.3	Very low	52.8	Low	121 Å²	121	104 Å²	104	74%	0.742	52%	0.524	S	S	*	.			trans	-65.6	103.3	163.2	-47.9	0	0	0	0	107.8	G246 L250	G246-T248 PolarHBondContact O-N 2.8Å; T248-L250 VanDerWaalsContact C-N 3.25Å; T248-L250 HydrophobicContact CG2-CG 4.4Å; T248-L250 PolarHBondContact O-N 2.91Å
249	L	28.5	Very low	51	Low	133 Å²	133	107.2 Å²	107.2	70%	0.696	54%	0.536	S	S	*	.			trans	-69.8	81.7	175.2	-75	165.4	0	0	0	109.8	R247 Y251	R247-L249 PolarHBondContact O-N 3.03Å; L249-Y251 HydrophobicContact CD2-CD2 4Å; L249-Y251 HydrophobicContact CD2-CE2 4.27Å; L249-Y251 PolarHBondContact O-N 2.97Å
250	L	30.9	Very low	48.8	Very low	127 Å²	127	107.5 Å²	107.5	67%	0.665	54%	0.544	S	S	*	.			trans	-76	64.2	160.8	-73.5	172.7	0	0	0	109.7	T248 G252	T248-L250 VanDerWaalsContact C-N 3.25Å; T248-L250 HydrophobicContact CG2-CG 4.4Å; T248-L250 PolarHBondContact O-N 2.91Å; L250-G252 VanDerWaalsContact C-N 3.31Å; L250-G252 PolarHBondContact O-N 2.76Å
251	Y	30	Very low	46.4	Very low	224 Å²	224	113.5 Å²	113.5	88%	0.878	58%	0.576	S	S	*	*			trans	-78.7	89	157.3	-99.7	-88.7	0	0	0	107.4	L249	L249-Y251 HydrophobicContact CD2-CD2 4Å; L249-Y251 HydrophobicContact CD2-CE2 4.27Å; L249-Y251 PolarHBondContact O-N 2.97Å
252	G	33.7	Very low	43.7	Very low	39 Å²	39	115.5 Å²	115.5	40%	0.402	59%	0.59	S	S	.	*	S	Bend	trans	-168.9	85.1	179	0	0	0	0	0	110.6	L250 F254	L250-G252 VanDerWaalsContact C-N 3.31Å; L250-G252 PolarHBondContact O-N 2.76Å; G252-F254 VanDerWaalsContact C-N 3.34Å; G252-F254 WeakPolarHBondContact O-CD2 3.49Å; G252-F254 PolarHBondContact O-N 3.18Å
253	D	35.9	Very low	41.4	Very low	175 Å²	175	121 Å²	121	94%	0.936	62%	0.619	S	S	*	*			trans	30.7	45.8	152	-55.8	-24.8	0	0	0	119.8
254	F	38.3	Very low	39.6	Very low	171 Å²	171	121.7 Å²	121.7	75%	0.75	63%	0.632	S	S	*	*			trans	-97.1	134.1	166.9	-79.1	-74.1	0	0	0	112	G252	G252-F254 VanDerWaalsContact C-N 3.34Å; G252-F254 WeakPolarHBondContact O-CD2 3.49Å; G252-F254 PolarHBondContact O-N 3.18Å
255	P	44.2	Very low	38	Very low	87 Å²	87	123.9 Å²	123.9	57%	0.565	65%	0.65	S	S	*	*			trans	-65.6	146.1	-173.8	24.9	-33.7	0	0	0	113	T257 L258	P255-T257 PolarHBondContact O-N 3.38Å; P255-L258 PolarHBondContact O-N 3.48Å
256	F	45.3	Very low	37.6	Very low	205 Å²	205	125.7 Å²	125.7	90%	0.899	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.6	-8.8	-167.4	-81.2	-91.6	0	0	0	117.6
257	T	46.6	Very low	37.8	Very low	128 Å²	128	126.3 Å²	126.3	79%	0.785	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-17.5	-176.6	52.6	0	0	0	0	114.2	P255	P255-T257 PolarHBondContact O-N 3.38Å
258	L	42.9	Very low	38.7	Very low	84 Å²	84	120.2 Å²	120.2	44%	0.44	62%	0.622	S	S	.	*	S	Bend	trans	-94.8	-6.5	-179.1	-98.3	147.8	0	0	0	114.9	P255 S260 L261	P255-L258 PolarHBondContact O-N 3.48Å; L258-S260 PolarHBondContact O-N 3.41Å; L258-L261 HydrophobicContact CD2-CB 4.5Å; L258-L261 HydrophobicContact CD2-CD1 4.03Å; L258-L261 PolarHBondContact O-N 3.43Å; L258-L261 VanDerWaalsContact O-N 3.08Å
259	F	38.5	Very low	40.7	Very low	148 Å²	148	115.3 Å²	115.3	65%	0.649	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-24.6	-175.6	-161.3	-100.2	0	0	0	114	L261 L263	F259-L261 VanDerWaalsContact C-N 3.34Å; F259-L261 PolarHBondContact O-N 3.07Å; F259-L263 HydrophobicContact CD1-CD1 4.42Å; F259-L263 HydrophobicContact CE1-CD1 4.23Å
260	S	39.4	Very low	43.2	Very low	87 Å²	87	109.4 Å²	109.4	61%	0.608	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-9.6	179.9	-159.4	0	0	0	0	114.8	L258	L258-S260 PolarHBondContact O-N 3.41Å
261	L	38	Very low	45.6	Very low	131 Å²	131	104.2 Å²	104.2	69%	0.686	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-19.2	179.2	-81.2	162.6	0	0	0	113.5	L258 F259	L258-L261 HydrophobicContact CD2-CB 4.5Å; L258-L261 HydrophobicContact CD2-CD1 4.03Å; L258-L261 PolarHBondContact O-N 3.43Å; L258-L261 VanDerWaalsContact O-N 3.08Å; F259-L261 VanDerWaalsContact C-N 3.34Å; F259-L261 PolarHBondContact O-N 3.07Å
262	L	31.8	Very low	48.2	Very low	98 Å²	98	96.8 Å²	96.8	51%	0.513	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-88.6	-11	-176.2	-80.7	159	0	0	0	114.6	V264	L262-V264 VanDerWaalsContact C-N 3.26Å; L262-V264 PolarHBondContact O-N 3.14Å
263	L	35.5	Very low	50.9	Low	118 Å²	118	95 Å²	95	62%	0.618	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-77.1	-3.2	-178.4	-75	168	0	0	0	114.8	F259	F259-L263 HydrophobicContact CD1-CD1 4.42Å; F259-L263 HydrophobicContact CE1-CD1 4.23Å
264	V	35.9	Very low	53.7	Low	96 Å²	96	87.8 Å²	87.8	58%	0.582	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-89	-8.4	-172.2	-154.3	0	0	0	0	113.5	L262	L262-V264 VanDerWaalsContact C-N 3.26Å; L262-V264 PolarHBondContact O-N 3.14Å
265	N	33.8	Very low	56.4	Low	136 Å²	136	79.7 Å²	79.7	73%	0.727	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-90.7	2.1	-174.2	-79.9	-8.6	0	0	0	115.7	F267	N265-F267 PolarHBondContact O-N 2.99Å
266	H	45.5	Very low	58.8	Low	65 Å²	65	75.6 Å²	75.6	30%	0.301	39%	0.391	S	S	.	.			trans	-91.5	84.5	172.2	-80.8	-86.9	0	0	0	111.4	P245 G246 W268	P245-H266 HydrophobicContact CB-CB 4.43Å; P245-H266 WeakPolarHBondContact CB-ND1 3.29Å; P245-H266 HydrophobicContact CG-CB 4.16Å; P245-H266 WeakPolarHBondContact CG-ND1 3.48Å; P245-H266 PolarHBondContact O-CE1 2.95Å; P245-H266 VanDerWaalsContact O-CE1 3.22Å; P245-H266 PolarHBondContact O-ND1 2.94Å; P245-H266 VanDerWaalsContact O-ND1 3.16Å; G246-H266 PolarHBondContact O-CE1 3.43Å; G246-H266 VanDerWaalsContact O-CE1 3.3Å; H266-W268 PolarHBondContact O-N 2.95Å; H266-W268 VanDerWaalsContact O-N 3.09Å
267	F	50.9	Low	61.1	Low	65 Å²	65	65.8 Å²	65.8	29%	0.285	35%	0.348	S	S	.	.			trans	-73.1	95.7	165.1	-81.5	-91.2	0	0	0	109.5	N265 I294 K404 W411	N265-F267 PolarHBondContact O-N 2.99Å; F267-I294 HydrophobicContact CD1-CG2 3.98Å; F267-I294 HydrophobicContact CE1-CG2 3.55Å; F267-I294 HydrophobicContact CZ-CG2 4.37Å; F267-K404 HydrophobicContact CD1-CD 4.32Å; F267-K404 HydrophobicContact CD2-CD 4.43Å; F267-K404 HydrophobicContact CE1-CD 3.75Å; F267-K404 HydrophobicContact CE2-CD 3.9Å; F267-K404 HydrophobicContact CZ-CD 3.58Å; F267-W411 AromaticContact CD1-CH2 4Å; F267-W411 HydrophobicContact CD1-CH2 4Å; F267-W411 AromaticContact CD1-CZ2 3.79Å; F267-W411 HydrophobicContact CD1-CZ2 3.79Å; F267-W411 HydrophobicContact CE1-CH2 4.31Å; F267-W411 AromaticContact CE1-CZ2 3.66Å; F267-W411 HydrophobicContact CE1-CZ2 3.66Å
268	W	56.5	Low	63.5	Low	87 Å²	87	59.7 Å²	59.7	33%	0.33	31%	0.311	S	S	.	.			trans	-71.6	133.2	173.2	-61.5	85.1	0	0	0	109.9	R244 P245 H266 L270 I294	R244-W268 HydrophobicContact CG-CE3 4.32Å; R244-W268 HydrophobicContact CG-CH2 4.13Å; R244-W268 HydrophobicContact CG-CZ3 3.57Å; P245-W268 HydrophobicContact CG-CD2 3.73Å; P245-W268 HydrophobicContact CG-CE3 3.98Å; P245-W268 HydrophobicContact CG-CG 4.06Å; P245-W268 HydrophobicContact CG-CZ2 4.36Å; P245-W268 HydrophobicContact CG-CZ3 4.42Å; H266-W268 PolarHBondContact O-N 2.95Å; H266-W268 VanDerWaalsContact O-N 3.09Å; W268-L270 WeakPolarHBondContact CB-O 3.44Å; W268-L270 PolarHBondContact O-N 3.06Å; W268-I294 WeakPolarHBondContact O-CD1 3.39Å
269	L	72.4	Confident	65.9	Low	18 Å²	18	56.5 Å²	56.5	9%	0.094	29%	0.293	C	S	.	.	S	Bend	trans	-66.2	-22.1	177.4	-57.9	-162.7	0	0	0	112.8	R243 F339 K341 Y451	R243-L269 HydrophobicContact CB-CD1 3.88Å; R243-L269 WeakPolarHBondContact O-CD1 3.4Å; R243-L269 WeakPolarHBondContact O-CG 3.04Å; L269-F339 HydrophobicContact CB-CE1 4.13Å; L269-F339 HydrophobicContact CD1-CD1 4.26Å; L269-F339 HydrophobicContact CD1-CE1 4.46Å; L269-K341 WeakPolarHBondContact O-CE 3.37Å; L269-K341 PolarHBondContact O-NZ 2.94Å; L269-Y451 HydrophobicContact CD1-CD1 3.93Å; L269-Y451 HydrophobicContact CD1-CE1 3.47Å; L269-Y451 VanDerWaalsContact CD1-CE1 3.47Å; L269-Y451 HydrophobicContact CD1-CE2 4.44Å; L269-Y451 HydrophobicContact CD2-CD1 3.79Å; L269-Y451 HydrophobicContact CD2-CD2 3.36Å; L269-Y451 HydrophobicContact CD2-CE1 3.75Å; L269-Y451 HydrophobicContact CD2-CE2 3.29Å; L269-Y451 HydrophobicContact CD2-CG 3.6Å; L269-Y451 VanDerWaalsContact CD2-CZ 3.49Å; L269-Y451 HydrophobicContact CG-CD1 4.41Å; L269-Y451 HydrophobicContact CG-CE1 4.25Å; L269-Y451 HydrophobicContact CG-CE2 4.5Å
270	L	80.6	Confident	68.5	Low	8 Å²	8	50.7 Å²	50.7	4%	0.042	27%	0.268	C	S	.	.	S	Bend	trans	-139.6	124.9	178.7	-65	168.3	0	0	0	106.7	I230 T242 W268 P273 F275 F289 E291 F339	I230-L270 HydrophobicContact CD1-CD2 4.46Å; I230-L270 HydrophobicContact CG1-CD1 4.34Å; T242-L270 HydrophobicContact CG2-CD1 4.25Å; T242-L270 WeakPolarHBondContact OG1-CD1 3.24Å; W268-L270 WeakPolarHBondContact CB-O 3.44Å; W268-L270 PolarHBondContact O-N 3.06Å; L270-P273 HydrophobicContact CB-CG 4.01Å; L270-F275 HydrophobicContact CD1-CZ 4.13Å; L270-F289 HydrophobicContact CD2-CE1 4.14Å; L270-F289 HydrophobicContact CD2-CE2 3.63Å; L270-F289 HydrophobicContact CD2-CZ 3.41Å; L270-F289 VanDerWaalsContact CD2-CZ 3.41Å; L270-E291 WeakPolarHBondContact CA-OE2 2.94Å; L270-F339 HydrophobicContact CD2-CZ 4.08Å
271	S	81.7	Confident	71	Confident	18 Å²	18	47.5 Å²	47.5	13%	0.126	24%	0.244	C	C	.	.	S	Bend	trans	-121.4	94.2	-171	-163.3	0	0	0	0	112.6	E291 T292 I294	S271-E291 PolarHBondContact N-OE2 2.84Å; S271-E291 VanDerWaalsContact N-OE2 3.12Å; S271-E291 WeakPolarHBondContact O-CB 3.48Å; S271-T292 WeakPolarHBondContact O-CB 3.34Å; S271-T292 PolarHBondContact O-N 2.88Å; S271-T292 PolarHBondContact O-OG1 2.79Å; S271-I294 VanDerWaalsContact CB-CD1 3.49Å
272	D	84.7	Confident	73.2	Confident	69 Å²	69	44.2 Å²	44.2	37%	0.369	24%	0.242	S	C	.	.	S	Bend	trans	51.5	53	-169.5	-168	28.2	0	0	0	112.2	R1093	D272-R1093 IonicContact OD2-NH2 3.6Å
273	P	91.7	Very high	75.8	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.013	24%	0.236	C	C	.	.			trans	-71.7	135.8	-179.5	34.1	-39.7	0	0	0	112.1	F228 L270 F275 F289 H290 E291	F228-P273 HydrophobicContact CB-CG 3.51Å; F228-P273 HydrophobicContact CD1-CG 3.75Å; F228-P273 HydrophobicContact CD2-CG 4.26Å; F228-P273 HydrophobicContact CE1-CG 4.48Å; F228-P273 HydrophobicContact CG-CG 3.6Å; L270-P273 HydrophobicContact CB-CG 4.01Å; P273-F275 HydrophobicContact CB-CE1 4.36Å; P273-F275 HydrophobicContact CB-CE2 4.07Å; P273-F275 HydrophobicContact CB-CZ 3.99Å; P273-F275 HydrophobicContact CG-CD2 4.47Å; P273-F275 HydrophobicContact CG-CE2 3.67Å; P273-F275 HydrophobicContact CG-CZ 3.75Å; P273-F289 HydrophobicContact CB-CD2 3.81Å; P273-F289 HydrophobicContact CB-CE2 4.36Å; P273-F289 HydrophobicContact CB-CG 4.38Å; P273-H290 CarbonylContact C-O 3.59Å; P273-H290 WeakPolarHBondContact CA-O 3.43Å; P273-E291 HydrophobicContact CB-CB 4.3Å
274	T	93.6	Very high	78.3	Confident	23 Å²	23	39 Å²	39	14%	0.141	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	104.9	163.8	-60.8	0	0	0	0	108.7	N204 F289 H290	N204-T274 HydrophobicContact CB-CG2 4.07Å; T274-F289 WeakPolarHBondContact O-CA 3.32Å; T274-F289 WeakPolarHBondContact O-CB 3.49Å; T274-H290 WeakPolarHBondContact CB-NE2 3.45Å; T274-H290 PolarHBondContact N-O 2.94Å; T274-H290 PolarHBondContact O-N 3.04Å
275	F	94.6	Very high	81.1	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	134.3	-179.3	-61.5	-79.4	0	0	0	112.1	T206 G218 I219 F228 I230 L270 P273 F289 S1098	T206-F275 HydrophobicContact CG2-CB 3.87Å; G218-F275 VanDerWaalsContact O-CD2 3.26Å; G218-F275 WeakPolarHBondContact O-CD2 3.49Å; G218-F275 WeakPolarHBondContact O-CG 3.43Å; I219-F275 VanDerWaalsContact N-CE2 3.27Å; F228-F275 HydrophobicContact CD1-CE2 4.25Å; I230-F275 HydrophobicContact CD1-CE1 4.14Å; I230-F275 HydrophobicContact CG1-CE1 3.8Å; I230-F275 HydrophobicContact CG1-CZ 4.21Å; L270-F275 HydrophobicContact CD1-CZ 4.13Å; P273-F275 HydrophobicContact CB-CE1 4.36Å; P273-F275 HydrophobicContact CB-CE2 4.07Å; P273-F275 HydrophobicContact CB-CZ 3.99Å; P273-F275 HydrophobicContact CG-CD2 4.47Å; P273-F275 HydrophobicContact CG-CE2 3.67Å; P273-F275 HydrophobicContact CG-CZ 3.75Å; F275-F289 HydrophobicContact CD1-CB 3.86Å; F275-F289 HydrophobicContact CD1-CD1 4.08Å; F275-F289 HydrophobicContact CD1-CG 4.16Å; F275-F289 HydrophobicContact CE1-CB 4.41Å; F275-F289 HydrophobicContact CE1-CD1 4.07Å; F275-F289 HydrophobicContact CE1-CG 4.26Å; F275-F289 HydrophobicContact CG-CB 4.4Å; F275-S1098 PolarHBondContact O-OG 3.12Å
276	V	94.4	Very high	84	Confident	1 Å²	1	28 Å²	28	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	-31.5	-175.3	-56.9	0	0	0	0	114.7	F288 V357 Q358 V360	V276-F288 HydrophobicContact CG2-CB 3.91Å; V276-F288 WeakPolarHBondContact CG2-O 3.4Å; V276-F288 PolarHBondContact N-O 2.72Å; V276-V357 WeakPolarHBondContact CG1-O 3.48Å; V276-V357 HydrophobicContact CG2-CG1 3.95Å; V276-V357 HydrophobicContact CG2-CG2 4.18Å; V276-Q358 WeakPolarHBondContact CB-O 3.44Å; V276-Q358 WeakPolarHBondContact CG1-O 3.27Å; V276-V360 HydrophobicContact CG2-CG2 4.26Å
277	A	94.9	Very high	86.5	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	158.4	177.2	0	0	0	0	0	111.3	T206 Y279 F288 V360	T206-A277 WeakPolarHBondContact OG1-CA 3.44Å; A277-Y279 HydrophobicContact CB-CE2 3.74Å; A277-F288 HydrophobicContact CB-CB 4.35Å; A277-F288 PolarHBondContact N-O 2.74Å; A277-F288 PolarHBondContact O-N 2.84Å; A277-V360 HydrophobicContact CB-CB 4.16Å
278	A	95.7	Very high	88.7	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	158.9	165.1	0	0	0	0	0	109	T206 V208 Y286 F287 N1102	T206-A278 HydrophobicContact CG2-CB 3.85Å; T206-A278 PolarHBondContact OG1-N 3.09Å; V208-A278 HydrophobicContact CG2-CB 3.68Å; A278-Y286 CarbonylContact C-O 3.54Å; A278-Y286 WeakPolarHBondContact CA-O 3.25Å; A278-Y286 WeakPolarHBondContact CB-O 3.25Å; A278-F287 HydrophobicContact CB-CD1 3.62Å; A278-F287 HydrophobicContact CB-CE1 3.68Å; A278-F287 HydrophobicContact CB-CG 4.23Å; A278-F287 HydrophobicContact CB-CZ 4.35Å; A278-N1102 VanDerWaalsContact O-CG 3.24Å; A278-N1102 PolarHBondContact O-ND2 3.3Å; A278-N1102 PolarHBondContact O-OD1 2.82Å
279	Y	94.5	Very high	90.6	Very high	17 Å²	17	17.7 Å²	17.7	7%	0.067	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	137.4	-179.6	-66	-79.7	0	0	0	111.9	A277 I285 Y286 F288 V360 D361 F362 F369 K1100	A277-Y279 HydrophobicContact CB-CE2 3.74Å; Y279-I285 CarbonylContact O-C 3.57Å; Y279-I285 WeakPolarHBondContact O-CA 3.16Å; Y279-Y286 PolarHBondContact N-O 2.03Å; Y279-Y286 PolarHBondContact O-N 2.85Å; Y279-F288 HydrophobicContact CD2-CD2 4.1Å; Y279-F288 AromaticContact CD2-CE2 3.87Å; Y279-F288 HydrophobicContact CD2-CE2 3.87Å; Y279-F288 HydrophobicContact CE2-CD2 4.23Å; Y279-F288 HydrophobicContact CE2-CE2 4.21Å; Y279-V360 HydrophobicContact CE2-CB 4.46Å; Y279-V360 HydrophobicContact CE2-CG1 4.27Å; Y279-V360 PolarHBondContact OH-O 3.49Å; Y279-D361 WeakPolarHBondContact OH-CA 3.43Å; Y279-F362 HydrophobicContact CD1-CB 3.99Å; Y279-F362 HydrophobicContact CE1-CB 3.78Å; Y279-F362 HydrophobicContact CE2-CB 4.42Å; Y279-F362 HydrophobicContact CG-CB 4.41Å; Y279-F369 AromaticContact CD2-CE1 3.84Å; Y279-F369 HydrophobicContact CD2-CE1 3.84Å; Y279-F369 HydrophobicContact CE2-CD1 4.45Å; Y279-F369 HydrophobicContact CE2-CE1 4.19Å; Y279-F369 HydrophobicContact CG-CE1 4.39Å; Y279-K1100 PolarHBondContact OH-NZ 3.49Å
280	E	92.5	Very high	91.7	Very high	25 Å²	25	18 Å²	18	12%	0.117	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	118.5	164.3	179.9	178.5	-171	0	0	109.9	V208 I285 K322 R364 Y1104	V208-E280 HydrophobicContact CG1-CB 4.04Å; E280-I285 HydrophobicContact CB-CD1 3.87Å; E280-I285 HydrophobicContact CG-CD1 3.97Å; E280-K322 IonicContact OE1-NZ 2.84Å; E280-K322 PolarHBondContact OE1-NZ 2.95Å; E280-R364 PolarHBondContact O-NH2 2.96Å; E280-Y1104 WeakPolarHBondContact OE2-CE2 3.49Å
281	I	91.3	Very high	92.1	Very high	20 Å²	20	17.6 Å²	17.6	10%	0.103	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	106.5	-178.4	-54.6	175.6	0	0	0	108.6	E283 F284 Y286 F362 F369 L390	I281-E283 PolarHBondContact O-N 3.18Å; I281-F284 PolarHBondContact N-O 3.47Å; I281-F284 PolarHBondContact O-N 3.36Å; I281-Y286 HydrophobicContact CB-CD2 3.93Å; I281-Y286 HydrophobicContact CB-CE2 3.91Å; I281-Y286 HydrophobicContact CD1-CD2 3.98Å; I281-Y286 HydrophobicContact CD1-CE2 4.4Å; I281-Y286 HydrophobicContact CG1-CD2 4.21Å; I281-Y286 HydrophobicContact CG2-CE2 4.4Å; I281-F362 HydrophobicContact CD1-CD1 3.99Å; I281-F362 HydrophobicContact CD1-CD2 4.33Å; I281-F362 HydrophobicContact CD1-CE1 3.66Å; I281-F362 HydrophobicContact CD1-CE2 4.03Å; I281-F362 HydrophobicContact CD1-CG 4.32Å; I281-F362 HydrophobicContact CD1-CZ 3.69Å; I281-F362 HydrophobicContact CG1-CD1 4.38Å; I281-F362 HydrophobicContact CG1-CE1 3.89Å; I281-F362 HydrophobicContact CG1-CZ 4.26Å; I281-F362 HydrophobicContact CG2-CZ 4.43Å; I281-F369 HydrophobicContact CD1-CE1 4.05Å; I281-F369 HydrophobicContact CD1-CE2 4.4Å; I281-F369 HydrophobicContact CD1-CZ 3.45Å; I281-F369 VanDerWaalsContact CD1-CZ 3.45Å; I281-L390 HydrophobicContact CD1-CD1 4.37Å; I281-L390 HydrophobicContact CG2-CD1 4.31Å; I281-L390 HydrophobicContact CG2-CD2 3.64Å
282	G	85.8	Confident	92.3	Very high	62 Å²	62	17 Å²	17	64%	0.639	10%	0.1	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	-130.4	-175.4	0	0	0	0	0	111.8	F284	G282-F284 VanDerWaalsContact C-N 3.25Å; G282-F284 PolarHBondContact O-N 3.11Å
283	E	84.5	Confident	92.1	Very high	83 Å²	83	13.8 Å²	13.8	39%	0.388	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	0.3	-178.9	-47.9	-74.8	125.5	0	0	113.3	I281 K322	I281-E283 PolarHBondContact O-N 3.18Å; E283-K322 WeakPolarHBondContact O-CB 3.48Å; E283-K322 PolarHBondContact O-N 3.35Å
284	F	89.9	Confident	91.2	Very high	25 Å²	25	14.8 Å²	14.8	11%	0.11	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	147	-170.5	-61.3	-83.3	0	0	0	113	I281 G282 Y286 R319 V320 C321 H421	I281-F284 PolarHBondContact N-O 3.47Å; I281-F284 PolarHBondContact O-N 3.36Å; G282-F284 VanDerWaalsContact C-N 3.25Å; G282-F284 PolarHBondContact O-N 3.11Å; F284-Y286 HydrophobicContact CB-CD2 4.19Å; F284-Y286 HydrophobicContact CB-CE2 3.73Å; F284-R319 HydrophobicContact CD1-CB 4.45Å; F284-R319 HydrophobicContact CD1-CG 4.35Å; F284-V320 VanDerWaalsContact CA-O 3.31Å; F284-V320 WeakPolarHBondContact CA-O 3.36Å; F284-C321 WeakPolarHBondContact CE1-SG 3.41Å; F284-H421 AromaticContact CE1-CD2 3.89Å
285	I	92.9	Very high	90	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	118.4	162.4	-48.5	-58.4	0	0	0	108.1	V208 F216 Y279 E280 F287 R319 V320 K322	V208-I285 HydrophobicContact CB-CG2 4.5Å; V208-I285 HydrophobicContact CG1-CD1 4.47Å; V208-I285 HydrophobicContact CG2-CG2 4.21Å; F216-I285 HydrophobicContact CB-CG2 4.33Å; F216-I285 HydrophobicContact CD1-CG1 3.97Å; F216-I285 HydrophobicContact CD2-CD1 4.25Å; F216-I285 HydrophobicContact CD2-CG1 3.94Å; F216-I285 HydrophobicContact CE1-CG1 3.94Å; F216-I285 HydrophobicContact CE2-CD1 4.19Å; F216-I285 HydrophobicContact CE2-CG1 3.92Å; F216-I285 HydrophobicContact CG-CG1 3.97Å; F216-I285 HydrophobicContact CG-CG2 4.48Å; F216-I285 HydrophobicContact CZ-CG1 3.92Å; Y279-I285 CarbonylContact O-C 3.57Å; Y279-I285 WeakPolarHBondContact O-CA 3.16Å; E280-I285 HydrophobicContact CB-CD1 3.87Å; E280-I285 HydrophobicContact CG-CD1 3.97Å; I285-F287 HydrophobicContact CB-CE2 4.14Å; I285-F287 HydrophobicContact CG2-CD2 4.22Å; I285-F287 HydrophobicContact CG2-CE2 3.51Å; I285-F287 HydrophobicContact CG2-CZ 3.84Å; I285-R319 WeakPolarHBondContact O-CA 3.38Å; I285-V320 HydrophobicContact CB-CG2 3.93Å; I285-V320 HydrophobicContact CG1-CG2 4.5Å; I285-V320 PolarHBondContact N-O 2.9Å; I285-V320 PolarHBondContact O-N 2.85Å; I285-K322 HydrophobicContact CD1-CG 4.46Å; I285-K322 HydrophobicContact CG1-CB 4.46Å
286	Y	95.8	Very high	88.5	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	145.2	175.6	-70.9	-91.7	0	0	0	110.7	A278 Y279 I281 F284 V317 A318 R319 L390 I393 E394 F397	A278-Y286 CarbonylContact C-O 3.54Å; A278-Y286 WeakPolarHBondContact CA-O 3.25Å; A278-Y286 WeakPolarHBondContact CB-O 3.25Å; Y279-Y286 PolarHBondContact N-O 2.03Å; Y279-Y286 PolarHBondContact O-N 2.85Å; I281-Y286 HydrophobicContact CB-CD2 3.93Å; I281-Y286 HydrophobicContact CB-CE2 3.91Å; I281-Y286 HydrophobicContact CD1-CD2 3.98Å; I281-Y286 HydrophobicContact CD1-CE2 4.4Å; I281-Y286 HydrophobicContact CG1-CD2 4.21Å; I281-Y286 HydrophobicContact CG2-CE2 4.4Å; F284-Y286 HydrophobicContact CB-CD2 4.19Å; F284-Y286 HydrophobicContact CB-CE2 3.73Å; Y286-V317 HydrophobicContact CD1-CG2 4.07Å; Y286-A318 CarbonylContact C-O 3.55Å; Y286-A318 VanDerWaalsContact CA-O 3.24Å; Y286-A318 WeakPolarHBondContact CA-O 3.47Å; Y286-R319 HydrophobicContact CD1-CB 3.87Å; Y286-R319 HydrophobicContact CE1-CB 3.87Å; Y286-R319 HydrophobicContact CG-CB 4.45Å; Y286-L390 HydrophobicContact CE2-CD1 4.27Å; Y286-I393 HydrophobicContact CD1-CG2 4.45Å; Y286-I393 HydrophobicContact CE1-CG2 3.97Å; Y286-E394 WeakPolarHBondContact OH-CG 3.35Å; Y286-E394 PolarHBondContact OH-OE1 2.9Å; Y286-F397 HydrophobicContact CD1-CE2 4.32Å; Y286-F397 HydrophobicContact CE1-CD2 4.3Å; Y286-F397 AromaticContact CE1-CE2 3.9Å; Y286-F397 HydrophobicContact CE1-CE2 3.9Å
287	F	97	Very high	86.7	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	136.4	176.9	-72.4	-91.3	0	0	0	110.7	T206 F216 I230 A278 I285 F289 V317 A318 V320	T206-F287 HydrophobicContact CG2-CD1 4.04Å; T206-F287 HydrophobicContact CG2-CE1 4.34Å; F216-F287 HydrophobicContact CB-CZ 4.1Å; I230-F287 HydrophobicContact CD1-CB 3.87Å; I230-F287 HydrophobicContact CD1-CD1 4.21Å; I230-F287 HydrophobicContact CD1-CD2 3.9Å; I230-F287 HydrophobicContact CD1-CG 3.72Å; I230-F287 HydrophobicContact CG1-CD1 4.05Å; I230-F287 HydrophobicContact CG1-CD2 4.26Å; I230-F287 HydrophobicContact CG1-CE1 4.27Å; I230-F287 HydrophobicContact CG1-CE2 4.46Å; I230-F287 HydrophobicContact CG1-CG 4.04Å; I230-F287 HydrophobicContact CG1-CZ 4.46Å; I230-F287 HydrophobicContact CG2-CD2 3.92Å; I230-F287 HydrophobicContact CG2-CE1 4.22Å; I230-F287 HydrophobicContact CG2-CE2 3.43Å; I230-F287 VanDerWaalsContact CG2-CE2 3.43Å; I230-F287 HydrophobicContact CG2-CG 4.49Å; I230-F287 HydrophobicContact CG2-CZ 3.6Å; A278-F287 HydrophobicContact CB-CD1 3.62Å; A278-F287 HydrophobicContact CB-CE1 3.68Å; A278-F287 HydrophobicContact CB-CG 4.23Å; A278-F287 HydrophobicContact CB-CZ 4.35Å; I285-F287 HydrophobicContact CB-CE2 4.14Å; I285-F287 HydrophobicContact CG2-CD2 4.22Å; I285-F287 HydrophobicContact CG2-CE2 3.51Å; I285-F287 HydrophobicContact CG2-CZ 3.84Å; F287-F289 HydrophobicContact CB-CD1 4.41Å; F287-F289 HydrophobicContact CB-CE1 4.48Å; F287-V317 CarbonylContact O-C 3.48Å; F287-V317 WeakPolarHBondContact O-CA 3.16Å; F287-A318 HydrophobicContact CB-CB 4.39Å; F287-A318 PolarHBondContact N-O 2.83Å; F287-A318 PolarHBondContact O-N 3.12Å; F287-V320 HydrophobicContact CE2-CG2 4.17Å
288	F	97.9	Very high	84.4	Confident	1 Å²	1	23.9 Å²	23.9	0%	0.004	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.2	176.6	-67.2	-95.9	0	0	0	109.8	V276 A277 Y279 R316 V317 L344 V360 F369	V276-F288 HydrophobicContact CG2-CB 3.91Å; V276-F288 WeakPolarHBondContact CG2-O 3.4Å; V276-F288 PolarHBondContact N-O 2.72Å; A277-F288 HydrophobicContact CB-CB 4.35Å; A277-F288 PolarHBondContact N-O 2.74Å; A277-F288 PolarHBondContact O-N 2.84Å; Y279-F288 HydrophobicContact CD2-CD2 4.1Å; Y279-F288 AromaticContact CD2-CE2 3.87Å; Y279-F288 HydrophobicContact CD2-CE2 3.87Å; Y279-F288 HydrophobicContact CE2-CD2 4.23Å; Y279-F288 HydrophobicContact CE2-CE2 4.21Å; F288-R316 WeakPolarHBondContact CA-O 3.12Å; F288-V317 HydrophobicContact CD1-CB 4.04Å; F288-V317 HydrophobicContact CD1-CG2 4.18Å; F288-V317 HydrophobicContact CE1-CB 3.75Å; F288-V317 HydrophobicContact CE1-CG2 3.65Å; F288-V317 HydrophobicContact CE2-CG2 4.14Å; F288-V317 HydrophobicContact CZ-CB 4.27Å; F288-V317 HydrophobicContact CZ-CG2 3.63Å; F288-L344 HydrophobicContact CD1-CD2 3.88Å; F288-L344 HydrophobicContact CE1-CD2 4.01Å; F288-V360 HydrophobicContact CB-CG2 3.86Å; F288-V360 HydrophobicContact CD1-CG1 4.38Å; F288-V360 HydrophobicContact CD1-CG2 3.85Å; F288-V360 HydrophobicContact CD2-CG1 4.48Å; F288-V360 HydrophobicContact CE1-CG1 4.31Å; F288-V360 HydrophobicContact CE2-CG1 4.44Å; F288-V360 HydrophobicContact CG-CB 4.41Å; F288-V360 HydrophobicContact CG-CG1 4.45Å; F288-V360 HydrophobicContact CG-CG2 3.84Å; F288-V360 HydrophobicContact CZ-CG1 4.34Å; F288-F369 HydrophobicContact CE2-CD1 4.03Å; F288-F369 AromaticContact CE2-CE1 3.63Å; F288-F369 HydrophobicContact CE2-CE1 3.63Å; F288-F369 HydrophobicContact CE2-CZ 4.15Å; F288-F369 AromaticContact CZ-CD1 3.72Å; F288-F369 HydrophobicContact CZ-CD1 3.72Å; F288-F369 HydrophobicContact CZ-CD2 4.47Å; F288-F369 AromaticContact CZ-CE1 3.62Å; F288-F369 HydrophobicContact CZ-CE1 3.62Å; F288-F369 HydrophobicContact CZ-CE2 4.38Å; F288-F369 HydrophobicContact CZ-CG 4.13Å; F288-F369 AromaticContact CZ-CZ 3.94Å; F288-F369 HydrophobicContact CZ-CZ 3.94Å
289	F	96.2	Very high	81.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	164.9	-178.2	55.3	-84.9	0	0	0	110.4	I230 L270 P273 T274 F275 F287 E291 S315 R316 A318 K341	I230-F289 HydrophobicContact CD1-CE1 4.34Å; L270-F289 HydrophobicContact CD2-CE1 4.14Å; L270-F289 HydrophobicContact CD2-CE2 3.63Å; L270-F289 HydrophobicContact CD2-CZ 3.41Å; L270-F289 VanDerWaalsContact CD2-CZ 3.41Å; P273-F289 HydrophobicContact CB-CD2 3.81Å; P273-F289 HydrophobicContact CB-CE2 4.36Å; P273-F289 HydrophobicContact CB-CG 4.38Å; T274-F289 WeakPolarHBondContact O-CA 3.32Å; T274-F289 WeakPolarHBondContact O-CB 3.49Å; F275-F289 HydrophobicContact CD1-CB 3.86Å; F275-F289 HydrophobicContact CD1-CD1 4.08Å; F275-F289 HydrophobicContact CD1-CG 4.16Å; F275-F289 HydrophobicContact CE1-CB 4.41Å; F275-F289 HydrophobicContact CE1-CD1 4.07Å; F275-F289 HydrophobicContact CE1-CG 4.26Å; F275-F289 HydrophobicContact CG-CB 4.4Å; F287-F289 HydrophobicContact CB-CD1 4.41Å; F287-F289 HydrophobicContact CB-CE1 4.48Å; F289-E291 HydrophobicContact CD2-CB 4.12Å; F289-E291 HydrophobicContact CD2-CG 4.25Å; F289-E291 HydrophobicContact CE2-CB 4.21Å; F289-E291 HydrophobicContact CE2-CG 3.99Å; F289-S315 CarbonylContact O-C 3.55Å; F289-R316 HydrophobicContact CD1-CB 4.31Å; F289-R316 HydrophobicContact CD2-CB 3.97Å; F289-R316 HydrophobicContact CD2-CG 4.04Å; F289-R316 HydrophobicContact CE1-CB 4.03Å; F289-R316 HydrophobicContact CE2-CB 3.67Å; F289-R316 HydrophobicContact CE2-CG 3.59Å; F289-R316 HydrophobicContact CG-CB 4.28Å; F289-R316 HydrophobicContact CZ-CB 3.69Å; F289-R316 HydrophobicContact CZ-CG 4.01Å; F289-R316 PolarHBondContact N-O 3.34Å; F289-R316 PolarHBondContact O-N 3.46Å; F289-A318 HydrophobicContact CE1-CB 3.74Å; F289-A318 HydrophobicContact CZ-CB 4.27Å; F289-K341 HydrophobicContact CZ-CD 4.15Å
290	H	94.6	Very high	79.1	Confident	23 Å²	23	37.8 Å²	37.8	11%	0.106	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.3	159.4	68.3	93.5	0	0	0	109.8	P273 T274 Y314 N356 V357	P273-H290 CarbonylContact C-O 3.59Å; P273-H290 WeakPolarHBondContact CA-O 3.43Å; T274-H290 WeakPolarHBondContact CB-NE2 3.45Å; T274-H290 PolarHBondContact N-O 2.94Å; T274-H290 PolarHBondContact O-N 3.04Å; H290-Y314 VanDerWaalsContact CA-O 3.29Å; H290-Y314 WeakPolarHBondContact CA-O 3.42Å; H290-N356 PolarHBondContact ND1-OD1 3.31Å; H290-V357 HydrophobicContact CB-CG1 4.38Å; H290-V357 PolarHBondContact CD2-O 2.85Å; H290-V357 VanDerWaalsContact CD2-O 3.29Å
291	E	90.6	Very high	76.4	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	173	-176.8	61.4	166.6	-177.5	0	0	110.4	L270 S271 P273 F289 A293 T313 Y314 R316 K341	L270-E291 WeakPolarHBondContact CA-OE2 2.94Å; S271-E291 PolarHBondContact N-OE2 2.84Å; S271-E291 VanDerWaalsContact N-OE2 3.12Å; S271-E291 WeakPolarHBondContact O-CB 3.48Å; P273-E291 HydrophobicContact CB-CB 4.3Å; F289-E291 HydrophobicContact CD2-CB 4.12Å; F289-E291 HydrophobicContact CD2-CG 4.25Å; F289-E291 HydrophobicContact CE2-CB 4.21Å; F289-E291 HydrophobicContact CE2-CG 3.99Å; E291-A293 PolarHBondContact O-N 2.7Å; E291-T313 CarbonylContact O-C 3.5Å; E291-T313 WeakPolarHBondContact O-CA 2.97Å; E291-Y314 PolarHBondContact N-O 2.02Å; E291-Y314 PolarHBondContact O-N 2.89Å; E291-R316 HydrophobicContact CG-CG 3.89Å; E291-R316 IonicContact OE1-CZ 2.7Å; E291-R316 IonicContact OE1-NE 2.82Å; E291-R316 PolarHBondContact OE1-NE 3.35Å; E291-R316 IonicContact OE1-NH2 3.58Å; E291-R316 PolarHBondContact OE1-NH2 3.36Å; E291-K341 VanDerWaalsContact OE1-CE 3.3Å; E291-K341 WeakPolarHBondContact OE1-CE 3.01Å; E291-K341 IonicContact OE1-NZ 3.17Å; E291-K341 PolarHBondContact OE1-NZ 2.93Å; E291-K341 IonicContact OE2-NZ 2.71Å; E291-K341 PolarHBondContact OE2-NZ 3.05Å
292	T	85	Confident	73.8	Confident	6 Å²	6	49.4 Å²	49.4	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	130.9	166.1	-66.1	0	0	0	0	110.9	S271 I294 I297 R311 D312	S271-T292 WeakPolarHBondContact O-CB 3.34Å; S271-T292 PolarHBondContact O-N 2.88Å; S271-T292 PolarHBondContact O-OG1 2.79Å; T292-I294 PolarHBondContact O-N 3.22Å; T292-I294 VanDerWaalsContact O-N 3.16Å; T292-I297 HydrophobicContact CG2-CD1 3.72Å; T292-R311 HydrophobicContact CG2-CB 4.04Å; T292-R311 HydrophobicContact CG2-CG 4.44Å; T292-D312 WeakPolarHBondContact CA-O 3.16Å
293	A	81.5	Confident	71.5	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.008	27%	0.265	C	S	.	.			trans	-76	92.5	175.9	0	0	0	0	0	111.3	E291 E295 I297 D312 Y314	E291-A293 PolarHBondContact O-N 2.7Å; A293-E295 VanDerWaalsContact C-N 3.29Å; A293-E295 PolarHBondContact O-N 3.13Å; A293-I297 WeakPolarHBondContact O-CG1 3.32Å; A293-D312 HydrophobicContact CB-CB 4.26Å; A293-D312 PolarHBondContact N-O 2.66Å; A293-Y314 HydrophobicContact CB-CD1 4.37Å; A293-Y314 HydrophobicContact CB-CD2 3.31Å; A293-Y314 HydrophobicContact CB-CE2 3.54Å; A293-Y314 HydrophobicContact CB-CG 3.77Å
294	I	71.9	Confident	69.3	Low	23 Å²	23	58.1 Å²	58.1	12%	0.118	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-23.6	-179.3	-49.2	166.6	0	0	0	111.6	F267 W268 S271 T292 D296	F267-I294 HydrophobicContact CD1-CG2 3.98Å; F267-I294 HydrophobicContact CE1-CG2 3.55Å; F267-I294 HydrophobicContact CZ-CG2 4.37Å; W268-I294 WeakPolarHBondContact O-CD1 3.39Å; S271-I294 VanDerWaalsContact CB-CD1 3.49Å; T292-I294 PolarHBondContact O-N 3.22Å; T292-I294 VanDerWaalsContact O-N 3.16Å; I294-D296 VanDerWaalsContact C-N 3.33Å; I294-D296 PolarHBondContact O-N 2.79Å
295	E	67.7	Low	66.9	Low	30 Å²	30	68 Å²	68	14%	0.14	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-39.6	177.4	54.8	-93.9	-120.3	0	0	113.2	A293 A298 Y314 R316	A293-E295 VanDerWaalsContact C-N 3.29Å; A293-E295 PolarHBondContact O-N 3.13Å; E295-A298 WeakPolarHBondContact O-CB 3.41Å; E295-Y314 HydrophobicContact CG-CD2 4.4Å; E295-Y314 HydrophobicContact CG-CE2 4.14Å; E295-R316 IonicContact OE1-CZ 3.35Å; E295-R316 VanDerWaalsContact OE1-CZ 3.22Å; E295-R316 IonicContact OE1-NH1 2.74Å; E295-R316 PolarHBondContact OE1-NH1 2.7Å; E295-R316 IonicContact OE1-NH2 3.67Å; E295-R316 PolarHBondContact OE1-NH2 2.75Å; E295-R316 IonicContact OE2-CZ 3.58Å; E295-R316 IonicContact OE2-NH1 3.69Å; E295-R316 IonicContact OE2-NH2 2.66Å; E295-R316 PolarHBondContact OE2-NH2 3.01Å
296	D	64.8	Low	64.2	Low	64 Å²	64	69.9 Å²	69.9	34%	0.342	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-84.9	-25.7	-174.5	-60.3	-8.5	0	0	0	112.6	I294 A298 F299 Y314	I294-D296 VanDerWaalsContact C-N 3.33Å; I294-D296 PolarHBondContact O-N 2.79Å; D296-A298 PolarHBondContact O-N 2.95Å; D296-F299 PolarHBondContact O-N 2.87Å; D296-F299 VanDerWaalsContact O-N 3.08Å; D296-Y314 WeakPolarHBondContact OD2-CE2 3.17Å; D296-Y314 PolarHBondContact OD2-OH 2.93Å
297	I	56.1	Low	61.3	Low	84 Å²	84	79.2 Å²	79.2	43%	0.431	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-59.5	-14.8	174.9	-64.7	173	0	0	0	111.6	T292 A293 F299	T292-I297 HydrophobicContact CG2-CD1 3.72Å; A293-I297 WeakPolarHBondContact O-CG1 3.32Å; I297-F299 VanDerWaalsContact C-N 3.28Å; I297-F299 PolarHBondContact O-N 3.49Å
298	A	46.4	Very low	58.5	Low	37 Å²	37	89 Å²	89	31%	0.306	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-72.4	-9.8	175.7	0	0	0	0	0	115.2	E295 D296	E295-A298 WeakPolarHBondContact O-CB 3.41Å; D296-A298 PolarHBondContact O-N 2.95Å
299	F	41.1	Very low	55.9	Low	181 Å²	181	95.9 Å²	95.9	79%	0.794	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-107.4	-6.9	-174	-109.7	-86.2	0	0	0	116.4	D296 I297 Q301	D296-F299 PolarHBondContact O-N 2.87Å; D296-F299 VanDerWaalsContact O-N 3.08Å; I297-F299 VanDerWaalsContact C-N 3.28Å; I297-F299 PolarHBondContact O-N 3.49Å; F299-Q301 PolarHBondContact O-N 3.32Å
300	E	38.2	Very low	53.5	Low	127 Å²	127	99 Å²	99	59%	0.593	47%	0.469	S	S	*	.			trans	-74.7	113.8	177.3	-71.2	-164.1	152.9	0	0	111.9
301	Q	34.3	Very low	51.9	Low	168 Å²	168	106.2 Å²	106.2	79%	0.785	50%	0.495	S	S	*	.			trans	-59.2	151.6	171.9	-72.4	-172.3	-4.9	0	0	111.8	F299 D303	F299-Q301 PolarHBondContact O-N 3.32Å; Q301-D303 PolarHBondContact O-N 2.99Å
302	P	37.2	Very low	51	Low	121 Å²	121	108.9 Å²	108.9	79%	0.786	51%	0.509	S	S	*	.			trans	-77	34.3	-171.4	33.9	-38.7	0	0	0	114.7	R304	P302-R304 PolarHBondContact O-N 3.22Å
303	D	37.5	Very low	51	Low	113 Å²	113	110.2 Å²	110.2	60%	0.604	52%	0.517	S	S	*	.			trans	-71.3	112.1	172.6	-169.2	1.7	0	0	0	110.1	Q301 R305 S306	Q301-D303 PolarHBondContact O-N 2.99Å; D303-R305 PolarHBondContact O-N 3.19Å; D303-S306 PolarHBondContact O-N 3.42Å; D303-S306 PolarHBondContact O-OG 2.78Å
304	R	39.4	Very low	51.4	Low	216 Å²	216	111 Å²	111	82%	0.815	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	6.3	-162.8	-64.2	-176.6	179.6	-177.7	1	114.9	P302	P302-R304 PolarHBondContact O-N 3.22Å
305	R	39.4	Very low	52.6	Low	231 Å²	231	110 Å²	110	87%	0.872	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-12.2	-176.8	-67.5	-177.3	174.9	-177	0	114.6	D303 R307	D303-R305 PolarHBondContact O-N 3.19Å; R305-R307 VanDerWaalsContact C-N 3.34Å; R305-R307 PolarHBondContact O-N 2.99Å
306	S	36.3	Very low	53.9	Low	40 Å²	40	108.5 Å²	108.5	28%	0.28	51%	0.508	S	S	.	.			trans	-83.5	9.2	-177.7	62.1	0	0	0	0	115.6	D303 F308 F309	D303-S306 PolarHBondContact O-N 3.42Å; D303-S306 PolarHBondContact O-OG 2.78Å; S306-F308 PolarHBondContact O-N 3.5Å; S306-F309 WeakPolarHBondContact O-CD2 3.29Å; S306-F309 PolarHBondContact O-N 3.12Å
307	R	34.9	Very low	55.4	Low	197 Å²	197	105.5 Å²	105.5	74%	0.743	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	13.9	-169.2	-140.6	-172.8	-62.4	-168.9	-0.3	116.6	R305	R305-R307 VanDerWaalsContact C-N 3.34Å; R305-R307 PolarHBondContact O-N 2.99Å
308	F	37.7	Very low	57.3	Low	206 Å²	206	101.5 Å²	101.5	90%	0.904	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-0.8	175.1	-87.6	-82.2	0	0	0	114	S306 A310	S306-F308 PolarHBondContact O-N 3.5Å; F308-A310 PolarHBondContact O-N 3.5Å
309	F	42.3	Very low	59.4	Low	145 Å²	145	99.9 Å²	99.9	64%	0.636	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-66.2	131.5	172.7	-79.2	-89.3	0	0	0	110.1	S306	S306-F309 WeakPolarHBondContact O-CD2 3.29Å; S306-F309 PolarHBondContact O-N 3.12Å
310	A	47.6	Very low	61.7	Low	66 Å²	66	91.2 Å²	91.2	55%	0.545	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-61.5	150	175.2	0	0	0	0	0	109.5	F308 R378	F308-A310 PolarHBondContact O-N 3.5Å; A310-R378 PolarHBondContact O-NH1 2.84Å; A310-R378 PolarHBondContact O-NH2 2.96Å
311	R	59.8	Low	64	Low	174 Å²	174	85.3 Å²	85.3	66%	0.657	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-77.2	135.8	171.4	-64.2	172.5	176.5	177.7	-1.8	108.8	T292 R378	T292-R311 HydrophobicContact CG2-CB 4.04Å; T292-R311 HydrophobicContact CG2-CG 4.44Å; R311-R378 VanDerWaalsContact C-NH2 3.33Å
312	D	71	Confident	66.4	Low	56 Å²	56	78 Å²	78	30%	0.299	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-68.6	148.6	171.1	-75.2	-56.7	0	0	0	110.9	T292 A293 R378	T292-D312 WeakPolarHBondContact CA-O 3.16Å; A293-D312 HydrophobicContact CB-CB 4.26Å; A293-D312 PolarHBondContact N-O 2.66Å; D312-R378 VanDerWaalsContact N-NH2 3.17Å; D312-R378 IonicContact OD1-CZ 3.41Å; D312-R378 IonicContact OD1-NE 3.04Å; D312-R378 PolarHBondContact OD1-NE 3.04Å; D312-R378 IonicContact OD1-NH2 3.87Å; D312-R378 PolarHBondContact OD1-NH2 3.13Å; D312-R378 IonicContact OD2-CZ 3.23Å; D312-R378 VanDerWaalsContact OD2-CZ 3.29Å; D312-R378 IonicContact OD2-NE 2.67Å; D312-R378 IonicContact OD2-NH1 2.93Å; D312-R378 IonicContact OD2-NH2 2.67Å; D312-R378 PolarHBondContact OD2-NH2 2.96Å
313	T	85.1	Confident	68.5	Low	34 Å²	34	75 Å²	75	21%	0.209	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.6	-179.6	47.4	0	0	0	0	109	E291 D355 N356 S376	E291-T313 CarbonylContact O-C 3.5Å; E291-T313 WeakPolarHBondContact O-CA 2.97Å; T313-D355 WeakPolarHBondContact O-CB 3.45Å; T313-N356 WeakPolarHBondContact CB-OD1 3.44Å; T313-N356 PolarHBondContact OG1-OD1 2.99Å; T313-S376 PolarHBondContact OG1-OG 2.84Å
314	Y	91.3	Very high	70.3	Confident	19 Å²	19	70 Å²	70	8%	0.075	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	139.2	176.8	-72.9	-23	0	0	0	112.2	H290 E291 A293 E295 D296 R343 D355	H290-Y314 VanDerWaalsContact CA-O 3.29Å; H290-Y314 WeakPolarHBondContact CA-O 3.42Å; E291-Y314 PolarHBondContact N-O 2.02Å; E291-Y314 PolarHBondContact O-N 2.89Å; A293-Y314 HydrophobicContact CB-CD1 4.37Å; A293-Y314 HydrophobicContact CB-CD2 3.31Å; A293-Y314 HydrophobicContact CB-CE2 3.54Å; A293-Y314 HydrophobicContact CB-CG 3.77Å; E295-Y314 HydrophobicContact CG-CD2 4.4Å; E295-Y314 HydrophobicContact CG-CE2 4.14Å; D296-Y314 WeakPolarHBondContact OD2-CE2 3.17Å; D296-Y314 PolarHBondContact OD2-OH 2.93Å; Y314-R343 VanDerWaalsContact CE2-NH1 3.3Å; Y314-R343 PolarHBondContact OH-NH1 3.49Å; Y314-D355 CarbonylContact C-O 3.59Å; Y314-D355 HydrophobicContact CD1-CB 4.08Å; Y314-D355 WeakPolarHBondContact CD1-OD1 3.36Å
315	S	95.7	Very high	72	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	142.2	169	-69.7	0	0	0	0	111	F289 R343 L344 D355 V357	F289-S315 CarbonylContact O-C 3.55Å; S315-R343 WeakPolarHBondContact O-CA 3.04Å; S315-L344 WeakPolarHBondContact CB-O 3.45Å; S315-L344 PolarHBondContact O-N 3.33Å; S315-D355 WeakPolarHBondContact CB-O 3.31Å; S315-D355 PolarHBondContact N-O 2.92Å; S315-D355 VanDerWaalsContact OG-C 3.26Å; S315-D355 PolarHBondContact OG-O 2.82Å; S315-V357 WeakPolarHBondContact OG-CB 3.42Å; S315-V357 WeakPolarHBondContact OG-CG1 3.38Å; S315-V357 PolarHBondContact OG-N 3.43Å
316	R	95.5	Very high	73.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.2	-176.9	-56.8	-59.9	-167.9	-164.4	-2.4	110.8	F288 F289 E291 E295 K341 A342	F288-R316 WeakPolarHBondContact CA-O 3.12Å; F289-R316 HydrophobicContact CD1-CB 4.31Å; F289-R316 HydrophobicContact CD2-CB 3.97Å; F289-R316 HydrophobicContact CD2-CG 4.04Å; F289-R316 HydrophobicContact CE1-CB 4.03Å; F289-R316 HydrophobicContact CE2-CB 3.67Å; F289-R316 HydrophobicContact CE2-CG 3.59Å; F289-R316 HydrophobicContact CG-CB 4.28Å; F289-R316 HydrophobicContact CZ-CB 3.69Å; F289-R316 HydrophobicContact CZ-CG 4.01Å; F289-R316 PolarHBondContact N-O 3.34Å; F289-R316 PolarHBondContact O-N 3.46Å; E291-R316 HydrophobicContact CG-CG 3.89Å; E291-R316 IonicContact OE1-CZ 2.7Å; E291-R316 IonicContact OE1-NE 2.82Å; E291-R316 PolarHBondContact OE1-NE 3.35Å; E291-R316 IonicContact OE1-NH2 3.58Å; E291-R316 PolarHBondContact OE1-NH2 3.36Å; E295-R316 IonicContact OE1-CZ 3.35Å; E295-R316 VanDerWaalsContact OE1-CZ 3.22Å; E295-R316 IonicContact OE1-NH1 2.74Å; E295-R316 PolarHBondContact OE1-NH1 2.7Å; E295-R316 IonicContact OE1-NH2 3.67Å; E295-R316 PolarHBondContact OE1-NH2 2.75Å; E295-R316 IonicContact OE2-CZ 3.58Å; E295-R316 IonicContact OE2-NH1 3.69Å; E295-R316 IonicContact OE2-NH2 2.66Å; E295-R316 PolarHBondContact OE2-NH2 3.01Å; R316-K341 HydrophobicContact CG-CD 4.45Å; R316-A342 VanDerWaalsContact CA-O 3.28Å; R316-A342 WeakPolarHBondContact CA-O 3.34Å
317	V	97	Very high	75	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	136.4	151.2	59.6	0	0	0	0	107.7	Y286 F287 F288 K341 A342 I393 F397 V457	Y286-V317 HydrophobicContact CD1-CG2 4.07Å; F287-V317 CarbonylContact O-C 3.48Å; F287-V317 WeakPolarHBondContact O-CA 3.16Å; F288-V317 HydrophobicContact CD1-CB 4.04Å; F288-V317 HydrophobicContact CD1-CG2 4.18Å; F288-V317 HydrophobicContact CE1-CB 3.75Å; F288-V317 HydrophobicContact CE1-CG2 3.65Å; F288-V317 HydrophobicContact CE2-CG2 4.14Å; F288-V317 HydrophobicContact CZ-CB 4.27Å; F288-V317 HydrophobicContact CZ-CG2 3.63Å; V317-K341 CarbonylContact O-C 3.51Å; V317-K341 VanDerWaalsContact O-CA 3.29Å; V317-K341 WeakPolarHBondContact O-CA 3.28Å; V317-A342 HydrophobicContact CG1-CB 4.22Å; V317-A342 PolarHBondContact N-O 3.25Å; V317-A342 VanDerWaalsContact N-O 3.08Å; V317-A342 PolarHBondContact O-N 2.82Å; V317-I393 HydrophobicContact CG1-CG2 4.16Å; V317-I393 HydrophobicContact CG2-CG2 4.13Å; V317-F397 HydrophobicContact CG1-CE2 4.19Å; V317-F397 HydrophobicContact CG1-CZ 4.09Å; V317-F397 HydrophobicContact CG2-CE2 4.27Å; V317-F397 HydrophobicContact CG2-CZ 4.35Å; V317-F397 WeakPolarHBondContact O-CZ 3.32Å; V317-V457 HydrophobicContact CG1-CG2 3.94Å
318	A	94.8	Very high	76.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	159.2	173.9	0	0	0	0	0	110.7	Y286 F287 F289 F339 S340 K341	Y286-A318 CarbonylContact C-O 3.55Å; Y286-A318 VanDerWaalsContact CA-O 3.24Å; Y286-A318 WeakPolarHBondContact CA-O 3.47Å; F287-A318 HydrophobicContact CB-CB 4.39Å; F287-A318 PolarHBondContact N-O 2.83Å; F287-A318 PolarHBondContact O-N 3.12Å; F289-A318 HydrophobicContact CE1-CB 3.74Å; F289-A318 HydrophobicContact CZ-CB 4.27Å; A318-F339 HydrophobicContact CB-CE2 3.79Å; A318-F339 HydrophobicContact CB-CZ 4.44Å; A318-S340 CarbonylContact C-O 3.58Å; A318-S340 WeakPolarHBondContact CA-O 3.35Å; A318-S340 VanDerWaalsContact CB-O 3.31Å; A318-S340 WeakPolarHBondContact CB-O 3.38Å; A318-K341 HydrophobicContact CB-CB 3.76Å
319	R	91.9	Very high	77.4	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.011	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	151.9	173	70	176.4	-169.8	-175.4	0.4	112.3	F284 I285 Y286 F339 S340 F397 P419 H421	F284-R319 HydrophobicContact CD1-CB 4.45Å; F284-R319 HydrophobicContact CD1-CG 4.35Å; I285-R319 WeakPolarHBondContact O-CA 3.38Å; Y286-R319 HydrophobicContact CD1-CB 3.87Å; Y286-R319 HydrophobicContact CE1-CB 3.87Å; Y286-R319 HydrophobicContact CG-CB 4.45Å; R319-F339 WeakPolarHBondContact O-CA 3.4Å; R319-S340 WeakPolarHBondContact CG-OG 3.23Å; R319-S340 PolarHBondContact N-O 3Å; R319-S340 PolarHBondContact O-N 2.81Å; R319-F397 HydrophobicContact CB-CE2 4.38Å; R319-F397 HydrophobicContact CB-CZ 4.34Å; R319-F397 HydrophobicContact CG-CD1 4.15Å; R319-F397 HydrophobicContact CG-CD2 4.24Å; R319-F397 HydrophobicContact CG-CE1 4.07Å; R319-F397 HydrophobicContact CG-CE2 4.15Å; R319-F397 HydrophobicContact CG-CG 4.25Å; R319-F397 HydrophobicContact CG-CZ 4.06Å; R319-P419 PolarHBondContact NH2-O 2.85Å; R319-H421 PolarHBondContact NH2-CD2 3.11Å; R319-H421 PolarHBondContact NH2-NE2 3.13Å
320	V	88.6	Confident	77.9	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	149.4	166.1	-64.5	0	0	0	0	109.3	F216 F284 I285 F287 F336 F339	F216-V320 HydrophobicContact CD1-CG2 4.47Å; F216-V320 HydrophobicContact CE1-CG2 4.49Å; F284-V320 VanDerWaalsContact CA-O 3.31Å; F284-V320 WeakPolarHBondContact CA-O 3.36Å; I285-V320 HydrophobicContact CB-CG2 3.93Å; I285-V320 HydrophobicContact CG1-CG2 4.5Å; I285-V320 PolarHBondContact N-O 2.9Å; I285-V320 PolarHBondContact O-N 2.85Å; F287-V320 HydrophobicContact CE2-CG2 4.17Å; V320-F336 HydrophobicContact CB-CD1 3.84Å; V320-F336 HydrophobicContact CB-CE1 4Å; V320-F336 HydrophobicContact CB-CG 4.31Å; V320-F336 HydrophobicContact CG1-CB 4.15Å; V320-F336 HydrophobicContact CG1-CD1 3.87Å; V320-F336 HydrophobicContact CG1-CD2 4.13Å; V320-F336 HydrophobicContact CG1-CE1 4.23Å; V320-F336 HydrophobicContact CG1-CE2 4.48Å; V320-F336 HydrophobicContact CG1-CG 3.81Å; V320-F336 HydrophobicContact CG2-CD1 4.39Å; V320-F336 HydrophobicContact CG2-CE1 4.03Å; V320-F336 HydrophobicContact CG2-CZ 4.33Å; V320-F339 HydrophobicContact CG1-CB 4Å; V320-F339 HydrophobicContact CG1-CD2 3.93Å; V320-F339 HydrophobicContact CG1-CG 4.47Å
321	C	87	Confident	78.1	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.02	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	134.6	168.5	-71	0	0	0	0	110.1	F284 E324 T338	F284-C321 WeakPolarHBondContact CE1-SG 3.41Å; C321-E324 HydrophobicContact CB-CB 4.24Å; C321-T338 HydrophobicContact CB-CG2 3.92Å; C321-T338 PolarHBondContact N-OG1 3.49Å
322	K	83.7	Confident	77.8	Confident	15 Å²	15	40.5 Å²	40.5	7%	0.065	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-56.3	-177.9	178.3	-179.9	172.2	174.3	0	112.1	D210 N212 F216 R232 E280 E283 I285 E324	D210-K322 WeakPolarHBondContact OD2-CE 3.29Å; D210-K322 IonicContact OD2-NZ 3.29Å; D210-K322 PolarHBondContact OD2-NZ 2.86Å; N212-K322 PolarHBondContact ND2-NZ 2.93Å; F216-K322 HydrophobicContact CE2-CG 4.33Å; F216-K322 HydrophobicContact CZ-CB 4.5Å; F216-K322 HydrophobicContact CZ-CG 4.1Å; F216-K322 WeakPolarHBondContact CZ-O 3.43Å; R232-K322 PolarHBondContact NH1-O 2.86Å; E280-K322 IonicContact OE1-NZ 2.84Å; E280-K322 PolarHBondContact OE1-NZ 2.95Å; E283-K322 WeakPolarHBondContact O-CB 3.48Å; E283-K322 PolarHBondContact O-N 3.35Å; I285-K322 HydrophobicContact CD1-CG 4.46Å; I285-K322 HydrophobicContact CG1-CB 4.46Å; K322-E324 VanDerWaalsContact C-N 3.26Å; K322-E324 PolarHBondContact O-N 2.87Å
323	D	81.5	Confident	77.3	Confident	58 Å²	58	41.9 Å²	41.9	31%	0.31	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	34.8	-176.5	-58.9	-47.9	0	0	0	113.1	Q214	Q214-D323 PolarHBondContact NE2-OD1 3Å
324	E	76.5	Confident	76.8	Confident	6 Å²	6	44 Å²	44	3%	0.028	25%	0.249	C	C	.	.			trans	-70.9	133.2	174.6	-160	-168.6	146.6	0	0	110.7	R232 L240 C321 K322 T337 T338	R232-E324 VanDerWaalsContact CZ-O 3.23Å; R232-E324 PolarHBondContact NH1-O 2.93Å; R232-E324 PolarHBondContact NH2-O 2.03Å; L240-E324 HydrophobicContact CD1-CB 3.99Å; L240-E324 HydrophobicContact CD1-CG 4.44Å; L240-E324 WeakPolarHBondContact CD1-O 3.44Å; C321-E324 HydrophobicContact CB-CB 4.24Å; K322-E324 VanDerWaalsContact C-N 3.26Å; K322-E324 PolarHBondContact O-N 2.87Å; E324-T337 WeakPolarHBondContact OE1-CA 3.03Å; E324-T337 VanDerWaalsContact OE1-CB 3.29Å; E324-T337 WeakPolarHBondContact OE1-CB 3.48Å; E324-T337 PolarHBondContact OE1-N 3Å; E324-T337 PolarHBondContact OE1-OG1 3.28Å; E324-T337 PolarHBondContact OE2-N 3.24Å; E324-T338 HydrophobicContact CG-CG2 4.14Å; E324-T338 VanDerWaalsContact OE2-CB 3.3Å; E324-T338 WeakPolarHBondContact OE2-CB 3.3Å; E324-T338 VanDerWaalsContact OE2-CG2 3.31Å; E324-T338 WeakPolarHBondContact OE2-CG2 3.35Å; E324-T338 PolarHBondContact OE2-N 3.47Å; E324-T338 PolarHBondContact OE2-OG1 3.47Å
325	P	74.4	Confident	76.1	Confident	59 Å²	59	43.6 Å²	43.6	38%	0.383	25%	0.248	S	C	.	.			trans	-85.8	-12.7	173.4	33.9	-36.2	0	0	0	113.8	L438	P325-L438 HydrophobicContact CG-CD2 3.88Å
326	G	71.8	Confident	75.4	Confident	8 Å²	8	43.9 Å²	43.9	8%	0.082	25%	0.249	C	C	.	.			trans	89.2	-169.7	-169.3	0	0	0	0	0	113.5
327	P	68.1	Low	74.4	Confident	32 Å²	32	46.5 Å²	46.5	21%	0.208	27%	0.265	C	S	.	.			trans	-67.1	145.2	178.8	28.4	-35.2	0	0	0	112.2	K329 W335 T337	P327-K329 VanDerWaalsContact C-N 3.3Å; P327-K329 PolarHBondContact O-N 2.84Å; P327-W335 HydrophobicContact CB-CZ2 4.31Å; P327-W335 WeakPolarHBondContact CD-O 3.44Å; P327-W335 HydrophobicContact CG-CD2 4.39Å; P327-W335 HydrophobicContact CG-CZ2 4.21Å; P327-T337 HydrophobicContact CB-CG2 4.38Å
328	T	63.7	Low	73.6	Confident	95 Å²	95	47.3 Å²	47.3	58%	0.583	27%	0.27	S	S	*	.	S	Bend	trans	-82.5	-0.7	-176	60.8	0	0	0	0	114.9	G441	T328-G441 WeakPolarHBondContact OG1-CA 3.41Å; T328-G441 PolarHBondContact OG1-O 2.93Å
329	K	58.4	Low	73.2	Confident	123 Å²	123	47.5 Å²	47.5	54%	0.535	27%	0.271	S	S	.	.	S	Bend	trans	-116	143.9	177.8	-69.9	-176.9	-179.2	177.4	0	108.5	P327 S331	P327-K329 VanDerWaalsContact C-N 3.3Å; P327-K329 PolarHBondContact O-N 2.84Å; K329-S331 PolarHBondContact O-N 3.15Å
330	S	51.8	Low	73	Confident	122 Å²	122	47.9 Å²	47.9	85%	0.853	27%	0.274	S	S	*	.			trans	-70.1	66.9	179.6	58.1	0	0	0	0	112.1
331	S	52.8	Low	73.1	Confident	46 Å²	46	48 Å²	48	32%	0.322	27%	0.274	S	S	.	.			trans	-65	134.3	148.8	161.8	0	0	0	0	107.8	K329 D333 W335	K329-S331 PolarHBondContact O-N 3.15Å; S331-D333 PolarHBondContact O-N 2.84Å; S331-D333 PolarHBondContact OG-N 3.06Å; S331-D333 PolarHBondContact OG-O 3.36Å; S331-W335 WeakPolarHBondContact OG-CZ3 3.37Å
332	D	53.2	Low	73.4	Confident	172 Å²	172	47.9 Å²	47.9	92%	0.92	27%	0.273	S	S	*	.	S	Bend	trans	-61	-23.7	175.2	-61.2	-45.7	0	0	0	112.3
333	D	61.3	Low	73.9	Confident	85 Å²	85	48.3 Å²	48.3	46%	0.455	27%	0.274	S	S	.	.	S	Bend	trans	-92.2	118.4	169.8	-74.5	-35.2	0	0	0	110.6	S331 W335	S331-D333 PolarHBondContact O-N 2.84Å; S331-D333 PolarHBondContact OG-N 3.06Å; S331-D333 PolarHBondContact OG-O 3.36Å; D333-W335 HydrophobicContact CB-CE3 3.83Å; D333-W335 HydrophobicContact CB-CZ3 3.98Å; D333-W335 WeakPolarHBondContact O-CZ3 2.89Å
334	M	73.8	Confident	74.6	Confident	78 Å²	78	45.6 Å²	45.6	38%	0.384	26%	0.26	S	S	.	.			trans	-88.5	123.5	166.2	-72.1	-172.2	67.5	0	0	111.2	L239 L240 R241	L239-M334 VanDerWaalsContact O-CB 3.3Å; L239-M334 WeakPolarHBondContact O-CB 3.32Å; L240-M334 HydrophobicContact CD2-CB 4.23Å; L240-M334 HydrophobicContact CD2-CE 4Å; R241-M334 PolarHBondContact N-O 3.27Å
335	W	77.8	Confident	75.4	Confident	11 Å²	11	45.8 Å²	45.8	4%	0.042	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-134.6	158	-177.1	64.8	71.3	0	0	0	114.6	R241 R243 P327 S331 D333 T337	R241-W335 WeakPolarHBondContact O-CA 3.08Å; R241-W335 VanDerWaalsContact O-CB 3.27Å; R241-W335 WeakPolarHBondContact O-CB 3.26Å; R243-W335 HydrophobicContact CB-CB 4.18Å; R243-W335 HydrophobicContact CB-CG 4.41Å; R243-W335 HydrophobicContact CG-CE3 4.3Å; P327-W335 HydrophobicContact CB-CZ2 4.31Å; P327-W335 WeakPolarHBondContact CD-O 3.44Å; P327-W335 HydrophobicContact CG-CD2 4.39Å; P327-W335 HydrophobicContact CG-CZ2 4.21Å; S331-W335 WeakPolarHBondContact OG-CZ3 3.37Å; D333-W335 HydrophobicContact CB-CE3 3.83Å; D333-W335 HydrophobicContact CB-CZ3 3.98Å; D333-W335 WeakPolarHBondContact O-CZ3 2.89Å; W335-T337 PolarHBondContact O-N 2.9Å
336	F	80.6	Confident	76.4	Confident	6 Å²	6	43 Å²	43	3%	0.026	24%	0.243	C	C	.	.			trans	-68.2	113.9	167.6	-65.8	-76.8	0	0	0	111	F216 I230 R232 L240 R241 V320 T338 F339	F216-F336 HydrophobicContact CD1-CZ 4.27Å; F216-F336 HydrophobicContact CE1-CE1 4.29Å; F216-F336 HydrophobicContact CE1-CZ 4.33Å; I230-F336 HydrophobicContact CG2-CE2 4.19Å; R232-F336 HydrophobicContact CB-CE1 4.41Å; R232-F336 HydrophobicContact CB-CZ 3.81Å; L240-F336 HydrophobicContact CB-CD1 3.99Å; L240-F336 HydrophobicContact CB-CD2 4.06Å; L240-F336 HydrophobicContact CB-CE1 3.75Å; L240-F336 HydrophobicContact CB-CE2 3.82Å; L240-F336 HydrophobicContact CB-CG 4.14Å; L240-F336 HydrophobicContact CB-CZ 3.67Å; L240-F336 HydrophobicContact CD1-CD1 3.64Å; L240-F336 HydrophobicContact CD1-CE1 3.64Å; L240-F336 HydrophobicContact CD1-CG 4.41Å; L240-F336 HydrophobicContact CD1-CZ 4.4Å; L240-F336 HydrophobicContact CG-CD1 4.46Å; L240-F336 HydrophobicContact CG-CE1 4.35Å; R241-F336 PolarHBondContact O-N 3.04Å; R241-F336 VanDerWaalsContact O-N 3.15Å; V320-F336 HydrophobicContact CB-CD1 3.84Å; V320-F336 HydrophobicContact CB-CE1 4Å; V320-F336 HydrophobicContact CB-CG 4.31Å; V320-F336 HydrophobicContact CG1-CB 4.15Å; V320-F336 HydrophobicContact CG1-CD1 3.87Å; V320-F336 HydrophobicContact CG1-CD2 4.13Å; V320-F336 HydrophobicContact CG1-CE1 4.23Å; V320-F336 HydrophobicContact CG1-CE2 4.48Å; V320-F336 HydrophobicContact CG1-CG 3.81Å; V320-F336 HydrophobicContact CG2-CD1 4.39Å; V320-F336 HydrophobicContact CG2-CE1 4.03Å; V320-F336 HydrophobicContact CG2-CZ 4.33Å; F336-T338 VanDerWaalsContact C-N 3.32Å; F336-F339 HydrophobicContact CB-CB 3.85Å
337	T	74.6	Confident	77.3	Confident	55 Å²	55	43.4 Å²	43.4	34%	0.337	24%	0.243	S	C	.	.	S	Bend	trans	-78.9	-17	169.7	69.1	0	0	0	0	112.3	E324 P327 W335	E324-T337 WeakPolarHBondContact OE1-CA 3.03Å; E324-T337 VanDerWaalsContact OE1-CB 3.29Å; E324-T337 WeakPolarHBondContact OE1-CB 3.48Å; E324-T337 PolarHBondContact OE1-N 3Å; E324-T337 PolarHBondContact OE1-OG1 3.28Å; E324-T337 PolarHBondContact OE2-N 3.24Å; P327-T337 HydrophobicContact CB-CG2 4.38Å; W335-T337 PolarHBondContact O-N 2.9Å
338	T	80.4	Confident	78.3	Confident	16 Å²	16	42.2 Å²	42.2	10%	0.098	24%	0.236	C	C	.	.	S	Bend	trans	-95.4	-5.3	179.4	64.8	0	0	0	0	114.2	C321 E324 F336 S340	C321-T338 HydrophobicContact CB-CG2 3.92Å; C321-T338 PolarHBondContact N-OG1 3.49Å; E324-T338 HydrophobicContact CG-CG2 4.14Å; E324-T338 VanDerWaalsContact OE2-CB 3.3Å; E324-T338 WeakPolarHBondContact OE2-CB 3.3Å; E324-T338 VanDerWaalsContact OE2-CG2 3.31Å; E324-T338 WeakPolarHBondContact OE2-CG2 3.35Å; E324-T338 PolarHBondContact OE2-N 3.47Å; E324-T338 PolarHBondContact OE2-OG1 3.47Å; F336-T338 VanDerWaalsContact C-N 3.32Å; T338-S340 PolarHBondContact O-N 3.13Å; T338-S340 PolarHBondContact O-OG 2.92Å
339	F	85.5	Confident	79.1	Confident	5 Å²	5	39 Å²	39	2%	0.022	22%	0.219	C	C	.	.			trans	-59.7	124.6	-179.4	174.2	-106.6	0	0	0	111.9	I230 T242 L269 L270 A318 R319 V320 F336 K341 Y451	I230-F339 HydrophobicContact CD1-CD2 4.43Å; I230-F339 HydrophobicContact CD1-CE2 3.73Å; T242-F339 HydrophobicContact CG2-CB 4.48Å; T242-F339 HydrophobicContact CG2-CD1 3.97Å; T242-F339 HydrophobicContact CG2-CD2 3.76Å; T242-F339 HydrophobicContact CG2-CE1 4.13Å; T242-F339 HydrophobicContact CG2-CE2 3.92Å; T242-F339 HydrophobicContact CG2-CG 3.79Å; T242-F339 HydrophobicContact CG2-CZ 4.11Å; L269-F339 HydrophobicContact CB-CE1 4.13Å; L269-F339 HydrophobicContact CD1-CD1 4.26Å; L269-F339 HydrophobicContact CD1-CE1 4.46Å; L270-F339 HydrophobicContact CD2-CZ 4.08Å; A318-F339 HydrophobicContact CB-CE2 3.79Å; A318-F339 HydrophobicContact CB-CZ 4.44Å; R319-F339 WeakPolarHBondContact O-CA 3.4Å; V320-F339 HydrophobicContact CG1-CB 4Å; V320-F339 HydrophobicContact CG1-CD2 3.93Å; V320-F339 HydrophobicContact CG1-CG 4.47Å; F336-F339 HydrophobicContact CB-CB 3.85Å; F339-K341 HydrophobicContact CZ-CB 4.44Å; F339-K341 HydrophobicContact CZ-CD 4.43Å; F339-K341 HydrophobicContact CZ-CG 4.5Å; F339-Y451 AromaticContact CD1-CD1 3.8Å; F339-Y451 HydrophobicContact CD1-CD1 3.8Å; F339-Y451 HydrophobicContact CD1-CE1 4.28Å; F339-Y451 HydrophobicContact CE1-CD1 4.21Å
340	S	86.8	Confident	80.1	Confident	10 Å²	10	36.5 Å²	36.5	7%	0.07	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	145.3	177.8	46.1	0	0	0	0	110	A318 R319 T338 F397	A318-S340 CarbonylContact C-O 3.58Å; A318-S340 WeakPolarHBondContact CA-O 3.35Å; A318-S340 VanDerWaalsContact CB-O 3.31Å; A318-S340 WeakPolarHBondContact CB-O 3.38Å; R319-S340 WeakPolarHBondContact CG-OG 3.23Å; R319-S340 PolarHBondContact N-O 3Å; R319-S340 PolarHBondContact O-N 2.81Å; T338-S340 PolarHBondContact O-N 3.13Å; T338-S340 PolarHBondContact O-OG 2.92Å; S340-F397 WeakPolarHBondContact O-CE1 3.26Å
341	K	91.4	Very high	81.5	Confident	3 Å²	3	32.7 Å²	32.7	1%	0.013	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	147.4	176.1	64.2	176.1	-177.7	-170.7	0	112.3	L269 F289 E291 R316 V317 A318 F339 Y451 I452 M453	L269-K341 WeakPolarHBondContact O-CE 3.37Å; L269-K341 PolarHBondContact O-NZ 2.94Å; F289-K341 HydrophobicContact CZ-CD 4.15Å; E291-K341 VanDerWaalsContact OE1-CE 3.3Å; E291-K341 WeakPolarHBondContact OE1-CE 3.01Å; E291-K341 IonicContact OE1-NZ 3.17Å; E291-K341 PolarHBondContact OE1-NZ 2.93Å; E291-K341 IonicContact OE2-NZ 2.71Å; E291-K341 PolarHBondContact OE2-NZ 3.05Å; R316-K341 HydrophobicContact CG-CD 4.45Å; V317-K341 CarbonylContact O-C 3.51Å; V317-K341 VanDerWaalsContact O-CA 3.29Å; V317-K341 WeakPolarHBondContact O-CA 3.28Å; A318-K341 HydrophobicContact CB-CB 3.76Å; F339-K341 HydrophobicContact CZ-CB 4.44Å; F339-K341 HydrophobicContact CZ-CD 4.43Å; F339-K341 HydrophobicContact CZ-CG 4.5Å; K341-Y451 WeakPolarHBondContact CG-O 3.38Å; K341-Y451 PolarHBondContact N-O 2.66Å; K341-I452 HydrophobicContact CG-CG1 4.33Å; K341-I452 CarbonylContact O-C 3.5Å; K341-I452 VanDerWaalsContact O-CA 3.32Å; K341-I452 WeakPolarHBondContact O-CA 3.41Å; K341-M453 PolarHBondContact O-N 2.88Å
342	A	93.1	Very high	83	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	150.8	175.3	0	0	0	0	0	110	R316 V317 V396 F397 M453 V457	R316-A342 VanDerWaalsContact CA-O 3.28Å; R316-A342 WeakPolarHBondContact CA-O 3.34Å; V317-A342 HydrophobicContact CG1-CB 4.22Å; V317-A342 PolarHBondContact N-O 3.25Å; V317-A342 VanDerWaalsContact N-O 3.08Å; V317-A342 PolarHBondContact O-N 2.82Å; A342-V396 HydrophobicContact CB-CG1 3.56Å; A342-F397 HydrophobicContact CB-CE1 4.29Å; A342-F397 HydrophobicContact CB-CZ 4.45Å; A342-M453 HydrophobicContact CB-CB 3.93Å; A342-M453 HydrophobicContact CB-CG 3.94Å; A342-V457 HydrophobicContact CB-CG2 4.31Å
343	R	93.9	Very high	84.7	Confident	24 Å²	24	26.6 Å²	26.6	9%	0.091	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	133	170.3	-174.8	176.6	175.5	174.5	-1.2	109.4	Y314 S315 V345 D355 A456 V457	Y314-R343 VanDerWaalsContact CE2-NH1 3.3Å; Y314-R343 PolarHBondContact OH-NH1 3.49Å; S315-R343 WeakPolarHBondContact O-CA 3.04Å; R343-V345 HydrophobicContact CG-CG2 3.98Å; R343-D355 IonicContact CZ-OD1 3.13Å; R343-D355 IonicContact NE-OD1 2.74Å; R343-D355 IonicContact NH2-OD1 2.72Å; R343-D355 PolarHBondContact NH2-OD1 2.97Å; R343-A456 HydrophobicContact CB-CB 4.03Å; R343-A456 HydrophobicContact CG-CB 4.49Å; R343-A456 CarbonylContact O-C 3.48Å; R343-A456 WeakPolarHBondContact O-CA 3.32Å; R343-V457 PolarHBondContact O-N 2.9Å
344	L	96.2	Very high	86.1	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-103.8	120	171.6	-173.7	66.9	0	0	0	107.6	F288 S315 F373 Y388 V457	F288-L344 HydrophobicContact CD1-CD2 3.88Å; F288-L344 HydrophobicContact CE1-CD2 4.01Å; S315-L344 WeakPolarHBondContact CB-O 3.45Å; S315-L344 PolarHBondContact O-N 3.33Å; L344-F373 HydrophobicContact CD2-CE1 4.13Å; L344-F373 HydrophobicContact CD2-CZ 3.76Å; L344-F373 HydrophobicContact CG-CE1 4.25Å; L344-F373 HydrophobicContact CG-CZ 3.96Å; L344-Y388 HydrophobicContact CD1-CD1 3.67Å; L344-Y388 HydrophobicContact CD1-CD2 4.02Å; L344-Y388 HydrophobicContact CD1-CE1 3.47Å; L344-Y388 VanDerWaalsContact CD1-CE1 3.47Å; L344-Y388 HydrophobicContact CD1-CE2 3.85Å; L344-Y388 HydrophobicContact CD1-CG 3.93Å; L344-Y388 HydrophobicContact CD2-CE2 4.32Å; L344-Y388 HydrophobicContact CG-CE1 4.2Å; L344-Y388 HydrophobicContact CG-CE2 4.18Å; L344-V457 HydrophobicContact CD1-CB 3.83Å; L344-V457 HydrophobicContact CD1-CG1 3.81Å
345	V	95	Very high	86.9	Confident	10 Å²	10	19.4 Å²	19.4	6%	0.061	13%	0.133	C	C	.	.			trans	-107.7	132.5	-173.6	174.3	0	0	0	0	110	R343 I347 L353 Y388 A456 V457 L458 P459	R343-V345 HydrophobicContact CG-CG2 3.98Å; V345-I347 HydrophobicContact CG1-CB 4.27Å; V345-I347 HydrophobicContact CG1-CG2 4.46Å; V345-L353 HydrophobicContact CG1-CD2 3.91Å; V345-Y388 WeakPolarHBondContact O-CE1 3.38Å; V345-Y388 PolarHBondContact O-OH 3.42Å; V345-A456 HydrophobicContact CG2-CB 3.83Å; V345-V457 PolarHBondContact N-O 3.19Å; V345-L458 HydrophobicContact CB-CD2 4.09Å; V345-L458 HydrophobicContact CG1-CD2 4.2Å; V345-L458 HydrophobicContact CG2-CD2 4.44Å; V345-P459 WeakPolarHBondContact O-CD 3.36Å
346	C	95.1	Very high	87.6	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	13%	0.134	C	C	.	.			trans	-123.4	123.7	163.1	-168.8	0	0	0	0	108.1	F354 F373 C386	C346-F354 HydrophobicContact CB-CB 4.43Å; C346-F354 PolarHBondContact O-N 2.02Å; C346-F373 HydrophobicContact CB-CB 4.28Å; C346-F373 HydrophobicContact CB-CD1 3.94Å; C346-F373 HydrophobicContact CB-CD2 3.48Å; C346-F373 VanDerWaalsContact CB-CD2 3.48Å; C346-F373 HydrophobicContact CB-CE1 4.1Å; C346-F373 HydrophobicContact CB-CE2 3.67Å; C346-F373 HydrophobicContact CB-CG 3.64Å; C346-F373 HydrophobicContact CB-CZ 3.99Å; C346-C386 WeakPolarHBondContact CA-SG 3.34Å; C346-C386 HydrophobicContact CB-CB 3.85Å; C346-C386 WeakPolarHBondContact CB-SG 3.32Å; C346-C386 WeakPolarHBondContact SG-CB 3.49Å; C346-C386 CovalentContact SG-SG 2.04Å; C346-C386 PolarHBondContact SG-SG 2.89Å
347	I	90.8	Very high	88.3	Confident	17 Å²	17	19.3 Å²	19.3	9%	0.087	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-136.6	140	-171.6	-168.7	172.6	0	0	0	109.1	V345 Q352 L353 N462 R463 S464 I1018	V345-I347 HydrophobicContact CG1-CB 4.27Å; V345-I347 HydrophobicContact CG1-CG2 4.46Å; I347-Q352 CarbonylContact C-O 3.51Å; I347-Q352 WeakPolarHBondContact CA-O 3.45Å; I347-L353 HydrophobicContact CB-CD2 3.96Å; I347-L353 HydrophobicContact CD1-CD2 4.06Å; I347-L353 HydrophobicContact CG1-CD2 3.97Å; I347-L353 HydrophobicContact CG1-CG 4.46Å; I347-N462 WeakPolarHBondContact CG2-O 3.36Å; I347-R463 CarbonylContact O-C 3.53Å; I347-R463 VanDerWaalsContact O-C 3.28Å; I347-R463 VanDerWaalsContact O-CA 3.26Å; I347-R463 WeakPolarHBondContact O-CA 3.31Å; I347-S464 PolarHBondContact O-N 3.35Å; I347-I1018 HydrophobicContact CD1-CD1 4.3Å
348	T	88.1	Confident	89.3	Confident	8 Å²	8	17 Å²	17	5%	0.049	12%	0.119	C	C	.	.			trans	-84.6	167.7	177.9	68.9	0	0	0	0	112.4	G350 G351 Q352 F354 S464 D467	T348-G350 PolarHBondContact O-N 3.03Å; T348-G351 PolarHBondContact O-N 2.84Å; T348-Q352 HydrophobicContact CG2-CB 4.31Å; T348-Q352 PolarHBondContact N-O 3.44Å; T348-Q352 WeakPolarHBondContact OG1-CB 3.47Å; T348-Q352 PolarHBondContact OG1-N 2.98Å; T348-Q352 VanDerWaalsContact OG1-N 3.13Å; T348-F354 HydrophobicContact CG2-CD2 3.95Å; T348-F354 HydrophobicContact CG2-CE2 3.39Å; T348-F354 HydrophobicContact CG2-CZ 4.31Å; T348-S464 WeakPolarHBondContact CA-OG 3.37Å; T348-D467 HydrophobicContact CG2-CB 3.65Å; T348-D467 WeakPolarHBondContact CG2-OD1 3.44Å
349	A	81.7	Confident	90.1	Very high	27 Å²	27	16.3 Å²	16.3	22%	0.223	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-38.2	172.3	0	0	0	0	0	112	G351 F1016	A349-G351 PolarHBondContact O-N 2.88Å; A349-F1016 WeakPolarHBondContact O-CD2 3.35Å; A349-F1016 WeakPolarHBondContact O-CE2 3.36Å
350	G	79.3	Confident	90.6	Very high	71 Å²	71	16 Å²	16	73%	0.732	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	8.2	173.6	0	0	0	0	0	115.7	T348 Q352	T348-G350 PolarHBondContact O-N 3.03Å; G350-Q352 PolarHBondContact O-N 2.94Å
351	G	81.5	Confident	91.1	Very high	41 Å²	41	16.6 Å²	16.6	42%	0.423	12%	0.115	S	C	.	.			trans	78.9	9.4	176.5	0	0	0	0	0	116	T348 A349	T348-G351 PolarHBondContact O-N 2.84Å; A349-G351 PolarHBondContact O-N 2.88Å
352	Q	83.1	Confident	91.3	Very high	50 Å²	50	17.6 Å²	17.6	23%	0.234	12%	0.12	C	C	.	.			trans	-76.1	130.1	177.3	-176.7	178.3	-15.4	0	0	110.6	I347 T348 G350 F354	I347-Q352 CarbonylContact C-O 3.51Å; I347-Q352 WeakPolarHBondContact CA-O 3.45Å; T348-Q352 HydrophobicContact CG2-CB 4.31Å; T348-Q352 PolarHBondContact N-O 3.44Å; T348-Q352 WeakPolarHBondContact OG1-CB 3.47Å; T348-Q352 PolarHBondContact OG1-N 2.98Å; T348-Q352 VanDerWaalsContact OG1-N 3.13Å; G350-Q352 PolarHBondContact O-N 2.94Å; Q352-F354 HydrophobicContact CB-CE2 4.09Å; Q352-F354 HydrophobicContact CG-CD2 4.34Å; Q352-F354 HydrophobicContact CG-CE2 3.67Å; Q352-F354 HydrophobicContact CG-CZ 4.28Å
353	L	88.2	Confident	91.3	Very high	40 Å²	40	17.7 Å²	17.7	21%	0.209	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-89.6	142.2	177.9	-69.9	163.4	0	0	0	112.4	V345 I347 L995	V345-L353 HydrophobicContact CG1-CD2 3.91Å; I347-L353 HydrophobicContact CB-CD2 3.96Å; I347-L353 HydrophobicContact CD1-CD2 4.06Å; I347-L353 HydrophobicContact CG1-CD2 3.97Å; I347-L353 HydrophobicContact CG1-CG 4.46Å; L353-L995 HydrophobicContact CD1-CD1 3.86Å
354	F	91.9	Very high	91.1	Very high	3 Å²	3	23.4 Å²	23.4	1%	0.013	14%	0.142	C	C	.	.			trans	-123	83.4	176.7	-73	-103.5	0	0	0	108.9	C346 T348 Q352 N356 F373 A375 A384 D467	C346-F354 HydrophobicContact CB-CB 4.43Å; C346-F354 PolarHBondContact O-N 2.02Å; T348-F354 HydrophobicContact CG2-CD2 3.95Å; T348-F354 HydrophobicContact CG2-CE2 3.39Å; T348-F354 HydrophobicContact CG2-CZ 4.31Å; Q352-F354 HydrophobicContact CB-CE2 4.09Å; Q352-F354 HydrophobicContact CG-CD2 4.34Å; Q352-F354 HydrophobicContact CG-CE2 3.67Å; Q352-F354 HydrophobicContact CG-CZ 4.28Å; F354-N356 PolarHBondContact O-N 2.96Å; F354-F373 HydrophobicContact CB-CB 3.66Å; F354-F373 WeakPolarHBondContact O-CB 3.49Å; F354-F373 WeakPolarHBondContact O-CD1 3.08Å; F354-A375 HydrophobicContact CD1-CB 4.05Å; F354-A375 HydrophobicContact CE1-CB 3.94Å; F354-A384 HydrophobicContact CB-CB 4.03Å; F354-A384 HydrophobicContact CD1-CB 3.84Å; F354-A384 HydrophobicContact CD2-CB 3.79Å; F354-A384 HydrophobicContact CE1-CB 4.27Å; F354-A384 HydrophobicContact CE2-CB 4.25Å; F354-A384 HydrophobicContact CG-CB 3.59Å; F354-A384 HydrophobicContact CZ-CB 4.46Å; F354-D467 HydrophobicContact CZ-CB 4.49Å
355	D	89.8	Confident	90.6	Very high	10 Å²	10	28.9 Å²	28.9	5%	0.053	17%	0.167	C	C	.	.			trans	-85.4	-1.4	-166.3	-57.7	-82.6	0	0	0	116	T313 Y314 S315 R343	T313-D355 WeakPolarHBondContact O-CB 3.45Å; Y314-D355 CarbonylContact C-O 3.59Å; Y314-D355 HydrophobicContact CD1-CB 4.08Å; Y314-D355 WeakPolarHBondContact CD1-OD1 3.36Å; S315-D355 WeakPolarHBondContact CB-O 3.31Å; S315-D355 PolarHBondContact N-O 2.92Å; S315-D355 VanDerWaalsContact OG-C 3.26Å; S315-D355 PolarHBondContact OG-O 2.82Å; R343-D355 IonicContact CZ-OD1 3.13Å; R343-D355 IonicContact NE-OD1 2.74Å; R343-D355 IonicContact NH2-OD1 2.72Å; R343-D355 PolarHBondContact NH2-OD1 2.97Å
356	N	92.7	Very high	90.2	Very high	14 Å²	14	32.9 Å²	32.9	8%	0.075	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	89.5	-178.3	-51.2	-76.3	0	0	0	112.6	H290 T313 F354 Q358 F373 T374 S376	H290-N356 PolarHBondContact ND1-OD1 3.31Å; T313-N356 WeakPolarHBondContact CB-OD1 3.44Å; T313-N356 PolarHBondContact OG1-OD1 2.99Å; F354-N356 PolarHBondContact O-N 2.96Å; N356-Q358 PolarHBondContact O-N 3.01Å; N356-Q358 PolarHBondContact O-NE2 3.12Å; N356-F373 CarbonylContact O-C 3.48Å; N356-F373 WeakPolarHBondContact O-CA 3.18Å; N356-T374 PolarHBondContact N-O 3.24Å; N356-T374 PolarHBondContact ND2-O 3.41Å; N356-T374 PolarHBondContact O-N 2.81Å; N356-T374 PolarHBondContact O-OG1 3.46Å; N356-S376 VanDerWaalsContact ND2-CA 3.32Å; N356-S376 WeakPolarHBondContact ND2-CA 3.5Å; N356-S376 PolarHBondContact ND2-N 3.04Å; N356-S376 PolarHBondContact ND2-OG 2.71Å
357	V	96.4	Very high	90.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	127.7	172.1	66.1	0	0	0	0	110.1	V276 H290 S315 V360 A371 V372 F373	V276-V357 WeakPolarHBondContact CG1-O 3.48Å; V276-V357 HydrophobicContact CG2-CG1 3.95Å; V276-V357 HydrophobicContact CG2-CG2 4.18Å; H290-V357 HydrophobicContact CB-CG1 4.38Å; H290-V357 PolarHBondContact CD2-O 2.85Å; H290-V357 VanDerWaalsContact CD2-O 3.29Å; S315-V357 WeakPolarHBondContact OG-CB 3.42Å; S315-V357 WeakPolarHBondContact OG-CG1 3.38Å; S315-V357 PolarHBondContact OG-N 3.43Å; V357-V360 HydrophobicContact CG2-CG2 3.65Å; V357-A371 HydrophobicContact CG2-CB 4.2Å; V357-V372 WeakPolarHBondContact CA-O 3.42Å; V357-F373 HydrophobicContact CB-CD1 3.76Å; V357-F373 HydrophobicContact CB-CE1 3.65Å; V357-F373 HydrophobicContact CB-CG 4.49Å; V357-F373 HydrophobicContact CB-CZ 4.27Å; V357-F373 HydrophobicContact CG2-CD1 4.36Å; V357-F373 HydrophobicContact CG2-CE1 4.06Å; V357-F373 HydrophobicContact CG2-CZ 4.18Å
358	Q	95	Very high	90.2	Very high	7 Å²	7	33.5 Å²	33.5	3%	0.033	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-32.3	179.6	-61.4	-53.7	-57.4	0	0	112.4	V276 N356 V372 T374 T1096	V276-Q358 WeakPolarHBondContact CB-O 3.44Å; V276-Q358 WeakPolarHBondContact CG1-O 3.27Å; N356-Q358 PolarHBondContact O-N 3.01Å; N356-Q358 PolarHBondContact O-NE2 3.12Å; Q358-V372 HydrophobicContact CB-CG2 4.31Å; Q358-V372 PolarHBondContact N-O 3.11Å; Q358-T374 HydrophobicContact CG-CG2 3.71Å; Q358-T374 PolarHBondContact NE2-OG1 3.09Å; Q358-T374 VanDerWaalsContact NE2-OG1 3.13Å; Q358-T1096 PolarHBondContact OE1-OG1 3.44Å
359	S	96.6	Very high	90.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	149	179.3	-178.7	0	0	0	0	110.5	A371 V372 V474 I476	S359-A371 VanDerWaalsContact O-CA 3.31Å; S359-A371 WeakPolarHBondContact O-CA 3.47Å; S359-V372 PolarHBondContact O-N 2.91Å; S359-V474 WeakPolarHBondContact CB-O 3.46Å; S359-I476 PolarHBondContact OG-N 3.38Å
360	V	97	Very high	91.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	145.3	177.3	-173.3	0	0	0	0	108.4	V276 A277 Y279 F288 V357 F369 Y370 A371 K1100	V276-V360 HydrophobicContact CG2-CG2 4.26Å; A277-V360 HydrophobicContact CB-CB 4.16Å; Y279-V360 HydrophobicContact CE2-CB 4.46Å; Y279-V360 HydrophobicContact CE2-CG1 4.27Å; Y279-V360 PolarHBondContact OH-O 3.49Å; F288-V360 HydrophobicContact CB-CG2 3.86Å; F288-V360 HydrophobicContact CD1-CG1 4.38Å; F288-V360 HydrophobicContact CD1-CG2 3.85Å; F288-V360 HydrophobicContact CD2-CG1 4.48Å; F288-V360 HydrophobicContact CE1-CG1 4.31Å; F288-V360 HydrophobicContact CE2-CG1 4.44Å; F288-V360 HydrophobicContact CG-CB 4.41Å; F288-V360 HydrophobicContact CG-CG1 4.45Å; F288-V360 HydrophobicContact CG-CG2 3.84Å; F288-V360 HydrophobicContact CZ-CG1 4.34Å; V357-V360 HydrophobicContact CG2-CG2 3.65Å; V360-F369 HydrophobicContact CG1-CB 4.14Å; V360-F369 HydrophobicContact CG1-CD1 3.81Å; V360-F369 HydrophobicContact CG1-CG 4.42Å; V360-Y370 CarbonylContact C-O 3.51Å; V360-Y370 WeakPolarHBondContact CA-O 3.03Å; V360-A371 HydrophobicContact CB-CB 4.37Å; V360-A371 HydrophobicContact CG1-CB 4.3Å; V360-A371 HydrophobicContact CG2-CB 3.88Å; V360-K1100 PolarHBondContact O-NZ 2.9Å
361	D	96.7	Very high	92.3	Very high	21 Å²	21	28.4 Å²	28.4	11%	0.112	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	151.3	165.8	-159.5	17.9	0	0	0	112.2	Y279 F369 Y370 I476 A477 V478 K1100	Y279-D361 WeakPolarHBondContact OH-CA 3.43Å; D361-F369 CarbonylContact O-C 3.59Å; D361-F369 VanDerWaalsContact O-CA 3.24Å; D361-F369 WeakPolarHBondContact O-CA 3.29Å; D361-Y370 PolarHBondContact N-O 2.89Å; D361-Y370 PolarHBondContact O-N 3.37Å; D361-I476 HydrophobicContact CB-CG2 4.42Å; D361-A477 VanDerWaalsContact OD2-CA 3.26Å; D361-A477 WeakPolarHBondContact OD2-CA 3.32Å; D361-V478 HydrophobicContact CB-CG2 4.21Å; D361-V478 PolarHBondContact OD2-N 3.43Å; D361-K1100 IonicContact OD1-NZ 2.72Å; D361-K1100 PolarHBondContact OD1-NZ 3.06Å
362	F	95.5	Very high	93.1	Very high	25 Å²	25	26.5 Å²	26.5	11%	0.11	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	111.6	-174	-179.5	-121	0	0	0	110.9	Y279 I281 R364 L368 F369 L390	Y279-F362 HydrophobicContact CD1-CB 3.99Å; Y279-F362 HydrophobicContact CE1-CB 3.78Å; Y279-F362 HydrophobicContact CE2-CB 4.42Å; Y279-F362 HydrophobicContact CG-CB 4.41Å; I281-F362 HydrophobicContact CD1-CD1 3.99Å; I281-F362 HydrophobicContact CD1-CD2 4.33Å; I281-F362 HydrophobicContact CD1-CE1 3.66Å; I281-F362 HydrophobicContact CD1-CE2 4.03Å; I281-F362 HydrophobicContact CD1-CG 4.32Å; I281-F362 HydrophobicContact CD1-CZ 3.69Å; I281-F362 HydrophobicContact CG1-CD1 4.38Å; I281-F362 HydrophobicContact CG1-CE1 3.89Å; I281-F362 HydrophobicContact CG1-CZ 4.26Å; I281-F362 HydrophobicContact CG2-CZ 4.43Å; F362-R364 HydrophobicContact CD1-CB 4.07Å; F362-R364 HydrophobicContact CE1-CB 3.77Å; F362-R364 HydrophobicContact CE1-CG 4.08Å; F362-R364 PolarHBondContact O-N 2.04Å; F362-L368 WeakPolarHBondContact CA-O 3Å; F362-L368 WeakPolarHBondContact CD2-O 3.41Å; F362-F369 HydrophobicContact CB-CD1 3.84Å; F362-F369 HydrophobicContact CB-CE1 3.83Å; F362-F369 AromaticContact CD2-CD1 3.6Å; F362-F369 HydrophobicContact CD2-CD1 3.6Å; F362-F369 AromaticContact CD2-CD2 4Å; F362-F369 HydrophobicContact CD2-CD2 4Å; F362-F369 AromaticContact CD2-CE1 3.43Å; F362-F369 HydrophobicContact CD2-CE1 3.43Å; F362-F369 VanDerWaalsContact CD2-CE1 3.43Å; F362-F369 AromaticContact CD2-CE2 3.85Å; F362-F369 HydrophobicContact CD2-CE2 3.85Å; F362-F369 AromaticContact CD2-CG 3.9Å; F362-F369 HydrophobicContact CD2-CG 3.9Å; F362-F369 AromaticContact CD2-CZ 3.59Å; F362-F369 HydrophobicContact CD2-CZ 3.59Å; F362-F369 HydrophobicContact CE2-CD2 4.28Å; F362-F369 HydrophobicContact CE2-CE1 4.18Å; F362-F369 AromaticContact CE2-CE2 3.89Å; F362-F369 HydrophobicContact CE2-CE2 3.89Å; F362-F369 AromaticContact CE2-CZ 3.86Å; F362-F369 HydrophobicContact CE2-CZ 3.86Å; F362-F369 HydrophobicContact CG-CD1 4.07Å; F362-F369 AromaticContact CG-CE1 3.77Å; F362-F369 HydrophobicContact CG-CE1 3.77Å; F362-F369 HydrophobicContact CG-CZ 4.24Å; F362-L390 HydrophobicContact CZ-CD2 4.39Å
363	V	93	Very high	93.7	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	94.9	171.2	-175.3	0	0	0	0	107.1	E365 E366 G367 L368 Y370 V478 Y490	V363-E365 VanDerWaalsContact C-N 3.27Å; V363-E365 PolarHBondContact O-N 2.86Å; V363-E366 HydrophobicContact CG1-CB 4.37Å; V363-E366 PolarHBondContact O-N 2.75Å; V363-G367 PolarHBondContact O-N 3.22Å; V363-L368 HydrophobicContact CB-CB 4.41Å; V363-L368 PolarHBondContact N-O 2.84Å; V363-L368 PolarHBondContact O-N 3.46Å; V363-Y370 HydrophobicContact CG2-CD2 4.1Å; V363-Y370 HydrophobicContact CG2-CE2 4.01Å; V363-V478 HydrophobicContact CG2-CB 4.09Å; V363-V478 HydrophobicContact CG2-CG1 3.83Å; V363-Y490 HydrophobicContact CG1-CD1 4.38Å; V363-Y490 HydrophobicContact CG1-CE1 4.11Å
364	R	89.6	Confident	93.9	Very high	143 Å²	143	23.3 Å²	23.3	54%	0.54	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-33.2	-170.8	175	176.6	-82.2	169.1	-7.9	112.8	E280 F362 E366	E280-R364 PolarHBondContact O-NH2 2.96Å; F362-R364 HydrophobicContact CD1-CB 4.07Å; F362-R364 HydrophobicContact CE1-CB 3.77Å; F362-R364 HydrophobicContact CE1-CG 4.08Å; F362-R364 PolarHBondContact O-N 2.04Å; R364-E366 VanDerWaalsContact C-N 3.28Å; R364-E366 PolarHBondContact O-N 3.32Å
365	E	86.3	Confident	93.6	Very high	116 Å²	116	23.9 Å²	23.9	54%	0.542	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-37.8	-178	-60.4	83.6	175	0	0	111.6	V363 K537	V363-E365 VanDerWaalsContact C-N 3.27Å; V363-E365 PolarHBondContact O-N 2.86Å; E365-K537 VanDerWaalsContact CD-NZ 3.27Å; E365-K537 IonicContact OE1-NZ 3.01Å; E365-K537 PolarHBondContact OE1-NZ 2.78Å; E365-K537 IonicContact OE2-NZ 3.59Å; E365-K537 PolarHBondContact OE2-NZ 3.34Å
366	E	85.9	Confident	92.9	Very high	94 Å²	94	23.8 Å²	23.8	44%	0.439	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-4.1	-173.1	-67	-64.7	144.5	0	0	113.4	V363 R364 L368 Y490	V363-E366 HydrophobicContact CG1-CB 4.37Å; V363-E366 PolarHBondContact O-N 2.75Å; R364-E366 VanDerWaalsContact C-N 3.28Å; R364-E366 PolarHBondContact O-N 3.32Å; E366-L368 VanDerWaalsContact C-N 3.31Å; E366-L368 HydrophobicContact CB-CD1 4Å; E366-L368 HydrophobicContact CB-CG 4.04Å; E366-L368 PolarHBondContact O-N 2.96Å; E366-Y490 HydrophobicContact CG-CE1 4.24Å; E366-Y490 WeakPolarHBondContact CG-OH 3.4Å
367	G	92.7	Very high	91.6	Very high	14 Å²	14	32.1 Å²	32.1	14%	0.144	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	31.3	-176.6	0	0	0	0	0	113.5	V363 L390	V363-G367 PolarHBondContact O-N 3.22Å; G367-L390 VanDerWaalsContact O-CB 3.3Å; G367-L390 WeakPolarHBondContact O-CB 3.47Å; G367-L390 PolarHBondContact O-N 3.45Å
368	L	94.4	Very high	89.7	Confident	16 Å²	16	37 Å²	37	8%	0.084	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.5	-176.7	-67.5	174.4	0	0	0	112.1	F362 V363 E366 Y370 K389 Y490	F362-L368 WeakPolarHBondContact CA-O 3Å; F362-L368 WeakPolarHBondContact CD2-O 3.41Å; V363-L368 HydrophobicContact CB-CB 4.41Å; V363-L368 PolarHBondContact N-O 2.84Å; V363-L368 PolarHBondContact O-N 3.46Å; E366-L368 VanDerWaalsContact C-N 3.31Å; E366-L368 HydrophobicContact CB-CD1 4Å; E366-L368 HydrophobicContact CB-CG 4.04Å; E366-L368 PolarHBondContact O-N 2.96Å; L368-Y370 HydrophobicContact CB-CE2 4.18Å; L368-Y370 HydrophobicContact CD1-CE2 4.48Å; L368-K389 HydrophobicContact CD2-CB 4.4Å; L368-K389 HydrophobicContact CD2-CG 4.22Å; L368-Y490 HydrophobicContact CD1-CE1 4.36Å; L368-Y490 HydrophobicContact CD1-CE2 4.27Å
369	F	97.2	Very high	88	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.1	166.7	-64.2	-86.9	0	0	0	110.4	Y279 I281 F288 V360 D361 F362 H387 Y388 L390 I393	Y279-F369 AromaticContact CD2-CE1 3.84Å; Y279-F369 HydrophobicContact CD2-CE1 3.84Å; Y279-F369 HydrophobicContact CE2-CD1 4.45Å; Y279-F369 HydrophobicContact CE2-CE1 4.19Å; Y279-F369 HydrophobicContact CG-CE1 4.39Å; I281-F369 HydrophobicContact CD1-CE1 4.05Å; I281-F369 HydrophobicContact CD1-CE2 4.4Å; I281-F369 HydrophobicContact CD1-CZ 3.45Å; I281-F369 VanDerWaalsContact CD1-CZ 3.45Å; F288-F369 HydrophobicContact CE2-CD1 4.03Å; F288-F369 AromaticContact CE2-CE1 3.63Å; F288-F369 HydrophobicContact CE2-CE1 3.63Å; F288-F369 HydrophobicContact CE2-CZ 4.15Å; F288-F369 AromaticContact CZ-CD1 3.72Å; F288-F369 HydrophobicContact CZ-CD1 3.72Å; F288-F369 HydrophobicContact CZ-CD2 4.47Å; F288-F369 AromaticContact CZ-CE1 3.62Å; F288-F369 HydrophobicContact CZ-CE1 3.62Å; F288-F369 HydrophobicContact CZ-CE2 4.38Å; F288-F369 HydrophobicContact CZ-CG 4.13Å; F288-F369 AromaticContact CZ-CZ 3.94Å; F288-F369 HydrophobicContact CZ-CZ 3.94Å; V360-F369 HydrophobicContact CG1-CB 4.14Å; V360-F369 HydrophobicContact CG1-CD1 3.81Å; V360-F369 HydrophobicContact CG1-CG 4.42Å; D361-F369 CarbonylContact O-C 3.59Å; D361-F369 VanDerWaalsContact O-CA 3.24Å; D361-F369 WeakPolarHBondContact O-CA 3.29Å; F362-F369 HydrophobicContact CB-CD1 3.84Å; F362-F369 HydrophobicContact CB-CE1 3.83Å; F362-F369 AromaticContact CD2-CD1 3.6Å; F362-F369 HydrophobicContact CD2-CD1 3.6Å; F362-F369 AromaticContact CD2-CD2 4Å; F362-F369 HydrophobicContact CD2-CD2 4Å; F362-F369 AromaticContact CD2-CE1 3.43Å; F362-F369 HydrophobicContact CD2-CE1 3.43Å; F362-F369 VanDerWaalsContact CD2-CE1 3.43Å; F362-F369 AromaticContact CD2-CE2 3.85Å; F362-F369 HydrophobicContact CD2-CE2 3.85Å; F362-F369 AromaticContact CD2-CG 3.9Å; F362-F369 HydrophobicContact CD2-CG 3.9Å; F362-F369 AromaticContact CD2-CZ 3.59Å; F362-F369 HydrophobicContact CD2-CZ 3.59Å; F362-F369 HydrophobicContact CE2-CD2 4.28Å; F362-F369 HydrophobicContact CE2-CE1 4.18Å; F362-F369 AromaticContact CE2-CE2 3.89Å; F362-F369 HydrophobicContact CE2-CE2 3.89Å; F362-F369 AromaticContact CE2-CZ 3.86Å; F362-F369 HydrophobicContact CE2-CZ 3.86Å; F362-F369 HydrophobicContact CG-CD1 4.07Å; F362-F369 AromaticContact CG-CE1 3.77Å; F362-F369 HydrophobicContact CG-CE1 3.77Å; F362-F369 HydrophobicContact CG-CZ 4.24Å; F369-H387 CarbonylContact O-C 3.53Å; F369-H387 WeakPolarHBondContact O-CA 3.09Å; F369-H387 WeakPolarHBondContact O-CB 3.4Å; F369-Y388 PolarHBondContact N-O 3.49Å; F369-Y388 PolarHBondContact O-N 2.04Å; F369-L390 HydrophobicContact CE2-CB 4.18Å; F369-L390 HydrophobicContact CE2-CD1 3.9Å; F369-L390 HydrophobicContact CZ-CD1 4.34Å; F369-I393 HydrophobicContact CD2-CD1 3.45Å; F369-I393 VanDerWaalsContact CD2-CD1 3.45Å; F369-I393 HydrophobicContact CE2-CD1 3.54Å; F369-I393 HydrophobicContact CG-CD1 4.38Å
370	Y	97.4	Very high	86.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.5	166.2	-71	-97.4	0	0	0	109.1	V360 D361 V363 L368 H387 L465 V478 Y490 L492 H506	V360-Y370 CarbonylContact C-O 3.51Å; V360-Y370 WeakPolarHBondContact CA-O 3.03Å; D361-Y370 PolarHBondContact N-O 2.89Å; D361-Y370 PolarHBondContact O-N 3.37Å; V363-Y370 HydrophobicContact CG2-CD2 4.1Å; V363-Y370 HydrophobicContact CG2-CE2 4.01Å; L368-Y370 HydrophobicContact CB-CE2 4.18Å; L368-Y370 HydrophobicContact CD1-CE2 4.48Å; Y370-H387 HydrophobicContact CD1-CB 3.74Å; Y370-H387 HydrophobicContact CE1-CB 3.83Å; Y370-H387 AromaticContact CE1-ND1 3.78Å; Y370-H387 HydrophobicContact CG-CB 4.19Å; Y370-L465 HydrophobicContact CD1-CD1 4.07Å; Y370-L465 HydrophobicContact CE1-CD1 3.83Å; Y370-V478 HydrophobicContact CD2-CB 4.4Å; Y370-V478 HydrophobicContact CD2-CG1 4.11Å; Y370-V478 HydrophobicContact CD2-CG2 3.97Å; Y370-V478 HydrophobicContact CE2-CG1 4.13Å; Y370-V478 HydrophobicContact CG-CG2 3.91Å; Y370-Y490 WeakPolarHBondContact OH-CD2 3.46Å; Y370-L492 HydrophobicContact CD1-CD2 3.7Å; Y370-L492 HydrophobicContact CD1-CG 4.19Å; Y370-L492 HydrophobicContact CE1-CD1 4.19Å; Y370-L492 HydrophobicContact CE1-CD2 3.98Å; Y370-L492 HydrophobicContact CE1-CG 4.35Å; Y370-H506 AromaticContact CE1-ND1 3.86Å; Y370-H506 AromaticContact CZ-ND1 3.81Å; Y370-H506 PolarHBondContact OH-CE1 2.95Å; Y370-H506 PolarHBondContact OH-ND1 3.38Å
371	A	97.8	Very high	85.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	142.2	-177.2	0	0	0	0	0	112.3	V357 S359 V360 F373 I385 C386 Y388	V357-A371 HydrophobicContact CG2-CB 4.2Å; S359-A371 VanDerWaalsContact O-CA 3.31Å; S359-A371 WeakPolarHBondContact O-CA 3.47Å; V360-A371 HydrophobicContact CB-CB 4.37Å; V360-A371 HydrophobicContact CG1-CB 4.3Å; V360-A371 HydrophobicContact CG2-CB 3.88Å; A371-F373 HydrophobicContact CB-CD2 4.31Å; A371-F373 HydrophobicContact CB-CE2 3.47Å; A371-F373 VanDerWaalsContact CB-CE2 3.47Å; A371-F373 HydrophobicContact CB-CZ 3.91Å; A371-I385 WeakPolarHBondContact O-CA 3.41Å; A371-C386 PolarHBondContact N-O 2.69Å; A371-C386 PolarHBondContact O-N 2.67Å; A371-Y388 HydrophobicContact CB-CE2 4.19Å
372	V	97.2	Very high	84.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.5	171.8	-75.4	0	0	0	0	109.8	V357 Q358 S359 A384 I385 Y473 I476 V494	V357-V372 WeakPolarHBondContact CA-O 3.42Å; Q358-V372 HydrophobicContact CB-CG2 4.31Å; Q358-V372 PolarHBondContact N-O 3.11Å; S359-V372 PolarHBondContact O-N 2.91Å; V372-A384 WeakPolarHBondContact CA-O 3.34Å; V372-I385 HydrophobicContact CG1-CG1 3.96Å; V372-Y473 HydrophobicContact CG1-CD2 4.14Å; V372-Y473 HydrophobicContact CG1-CG 4.38Å; V372-I476 HydrophobicContact CG1-CB 4.09Å; V372-I476 HydrophobicContact CG1-CD1 4.24Å; V372-I476 HydrophobicContact CG1-CG2 4.5Å; V372-I476 HydrophobicContact CG2-CB 4.25Å; V372-I476 HydrophobicContact CG2-CG2 4.1Å; V372-V494 HydrophobicContact CG1-CG1 4.07Å
373	F	95.8	Very high	84.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.4	-179.8	-60.5	-105.5	0	0	0	109.9	L344 C346 F354 N356 V357 A371 S383 A384 C386 Y388	L344-F373 HydrophobicContact CD2-CE1 4.13Å; L344-F373 HydrophobicContact CD2-CZ 3.76Å; L344-F373 HydrophobicContact CG-CE1 4.25Å; L344-F373 HydrophobicContact CG-CZ 3.96Å; C346-F373 HydrophobicContact CB-CB 4.28Å; C346-F373 HydrophobicContact CB-CD1 3.94Å; C346-F373 HydrophobicContact CB-CD2 3.48Å; C346-F373 VanDerWaalsContact CB-CD2 3.48Å; C346-F373 HydrophobicContact CB-CE1 4.1Å; C346-F373 HydrophobicContact CB-CE2 3.67Å; C346-F373 HydrophobicContact CB-CG 3.64Å; C346-F373 HydrophobicContact CB-CZ 3.99Å; F354-F373 HydrophobicContact CB-CB 3.66Å; F354-F373 WeakPolarHBondContact O-CB 3.49Å; F354-F373 WeakPolarHBondContact O-CD1 3.08Å; N356-F373 CarbonylContact O-C 3.48Å; N356-F373 WeakPolarHBondContact O-CA 3.18Å; V357-F373 HydrophobicContact CB-CD1 3.76Å; V357-F373 HydrophobicContact CB-CE1 3.65Å; V357-F373 HydrophobicContact CB-CG 4.49Å; V357-F373 HydrophobicContact CB-CZ 4.27Å; V357-F373 HydrophobicContact CG2-CD1 4.36Å; V357-F373 HydrophobicContact CG2-CE1 4.06Å; V357-F373 HydrophobicContact CG2-CZ 4.18Å; A371-F373 HydrophobicContact CB-CD2 4.31Å; A371-F373 HydrophobicContact CB-CE2 3.47Å; A371-F373 VanDerWaalsContact CB-CE2 3.47Å; A371-F373 HydrophobicContact CB-CZ 3.91Å; F373-S383 CarbonylContact O-C 3.59Å; F373-S383 WeakPolarHBondContact O-CA 3.39Å; F373-S383 WeakPolarHBondContact O-CB 3.08Å; F373-A384 PolarHBondContact N-O 2.9Å; F373-A384 PolarHBondContact O-N 2.98Å; F373-C386 HydrophobicContact CD2-CB 4.38Å; F373-C386 HydrophobicContact CE2-CB 3.91Å; F373-Y388 AromaticContact CE2-CE2 3.96Å; F373-Y388 HydrophobicContact CE2-CE2 3.96Å; F373-Y388 WeakPolarHBondContact CE2-OH 3.34Å; F373-Y388 AromaticContact CZ-CE2 3.89Å; F373-Y388 HydrophobicContact CZ-CE2 3.89Å; F373-Y388 AromaticContact CZ-CZ 3.88Å; F373-Y388 WeakPolarHBondContact CZ-OH 3.29Å
374	T	93.1	Very high	84.8	Confident	23 Å²	23	50 Å²	50	14%	0.141	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148	171.2	52	0	0	0	0	111.1	N356 Q358 G382	N356-T374 PolarHBondContact N-O 3.24Å; N356-T374 PolarHBondContact ND2-O 3.41Å; N356-T374 PolarHBondContact O-N 2.81Å; N356-T374 PolarHBondContact O-OG1 3.46Å; Q358-T374 HydrophobicContact CG-CG2 3.71Å; Q358-T374 PolarHBondContact NE2-OG1 3.09Å; Q358-T374 VanDerWaalsContact NE2-OG1 3.13Å; T374-G382 WeakPolarHBondContact CA-O 3.39Å
375	A	85.5	Confident	85.1	Confident	16 Å²	16	43.2 Å²	43.2	13%	0.132	21%	0.208	C	C	.	.			trans	-63.3	140.4	176.2	0	0	0	0	0	111.1	F354 H379 I380 G382	F354-A375 HydrophobicContact CD1-CB 4.05Å; F354-A375 HydrophobicContact CE1-CB 3.94Å; A375-H379 HydrophobicContact CB-CB 4.31Å; A375-I380 WeakPolarHBondContact CB-O 3.42Å; A375-G382 PolarHBondContact N-O 2.82Å; A375-G382 VanDerWaalsContact N-O 3.16Å
376	S	75.1	Confident	85.6	Confident	8 Å²	8	37.7 Å²	37.7	6%	0.056	18%	0.183	C	C	.	.			trans	-63.8	151	170.6	-69	0	0	0	0	110.7	T313 N356 R378 H379	T313-S376 PolarHBondContact OG1-OG 2.84Å; N356-S376 VanDerWaalsContact ND2-CA 3.32Å; N356-S376 WeakPolarHBondContact ND2-CA 3.5Å; N356-S376 PolarHBondContact ND2-N 3.04Å; N356-S376 PolarHBondContact ND2-OG 2.71Å; S376-R378 PolarHBondContact O-N 2.66Å; S376-H379 PolarHBondContact O-N 2.84Å
377	K	64.6	Low	86	Confident	188 Å²	188	33.4 Å²	33.4	82%	0.817	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-12.1	-173.8	-67.6	-171.5	177.6	-171.6	0	115.9
378	R	58.1	Low	86.2	Confident	104 Å²	104	32.8 Å²	32.8	39%	0.392	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-21.2	174	-64.7	-169.8	-130.3	-106.9	-16.6	113.8	A310 R311 D312 S376	A310-R378 PolarHBondContact O-NH1 2.84Å; A310-R378 PolarHBondContact O-NH2 2.96Å; R311-R378 VanDerWaalsContact C-NH2 3.33Å; D312-R378 VanDerWaalsContact N-NH2 3.17Å; D312-R378 IonicContact OD1-CZ 3.41Å; D312-R378 IonicContact OD1-NE 3.04Å; D312-R378 PolarHBondContact OD1-NE 3.04Å; D312-R378 IonicContact OD1-NH2 3.87Å; D312-R378 PolarHBondContact OD1-NH2 3.13Å; D312-R378 IonicContact OD2-CZ 3.23Å; D312-R378 VanDerWaalsContact OD2-CZ 3.29Å; D312-R378 IonicContact OD2-NE 2.67Å; D312-R378 IonicContact OD2-NH1 2.93Å; D312-R378 IonicContact OD2-NH2 2.67Å; D312-R378 PolarHBondContact OD2-NH2 2.96Å; S376-R378 PolarHBondContact O-N 2.66Å
379	H	59.8	Low	86.3	Confident	93 Å²	93	36.3 Å²	36.3	43%	0.431	17%	0.17	S	C	.	.	S	Bend	trans	-108.3	169.3	-173.7	-59.2	-68.4	0	0	0	111.7	A375 S376 M381	A375-H379 HydrophobicContact CB-CB 4.31Å; S376-H379 PolarHBondContact O-N 2.84Å; H379-M381 PolarHBondContact O-N 3.35Å
380	I	61	Low	86.2	Confident	108 Å²	108	37.5 Å²	37.5	55%	0.554	18%	0.177	S	C	*	.			trans	-53.8	131.4	172.7	-57.6	174.6	0	0	0	107.8	A375	A375-I380 WeakPolarHBondContact CB-O 3.42Å
381	M	73.7	Confident	86.1	Confident	124 Å²	124	41 Å²	41	61%	0.611	20%	0.198	S	C	*	.	S	Bend	trans	-56.3	146.5	177.2	-68.3	-162	125.8	0	0	110.1	H379 Q469 Q472	H379-M381 PolarHBondContact O-N 3.35Å; M381-Q469 CarbonylContact O-C 3.6Å; M381-Q472 VanDerWaalsContact CE-NE2 3.32Å
382	G	86.1	Confident	85.9	Confident	3 Å²	3	44 Å²	44	3%	0.031	21%	0.214	C	C	.	.			trans	162.9	178.6	-178.6	0	0	0	0	0	112.2	T374 A375 V468 D471	T374-G382 WeakPolarHBondContact CA-O 3.39Å; A375-G382 PolarHBondContact N-O 2.82Å; A375-G382 VanDerWaalsContact N-O 3.16Å; G382-V468 CarbonylContact C-O 3.59Å; G382-V468 WeakPolarHBondContact CA-O 3.33Å; G382-D471 CarbonylContact C-O 3.16Å
383	S	94	Very high	85.9	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.4	177.5	-52.4	0	0	0	0	112	F373 D467 V468 D471 Q472 Y473	F373-S383 CarbonylContact O-C 3.59Å; F373-S383 WeakPolarHBondContact O-CA 3.39Å; F373-S383 WeakPolarHBondContact O-CB 3.08Å; S383-D467 CarbonylContact O-C 3.48Å; S383-D467 VanDerWaalsContact O-CA 3.28Å; S383-D467 WeakPolarHBondContact O-CA 3.3Å; S383-V468 PolarHBondContact N-O 2.04Å; S383-V468 WeakPolarHBondContact O-CG2 3.35Å; S383-V468 PolarHBondContact O-N 2.99Å; S383-D471 WeakPolarHBondContact CB-O 3.34Å; S383-D471 PolarHBondContact N-O 2.95Å; S383-D471 PolarHBondContact OG-O 2.8Å; S383-Q472 VanDerWaalsContact OG-CA 3.32Å; S383-Q472 WeakPolarHBondContact OG-CA 3.46Å; S383-Y473 PolarHBondContact OG-N 3.44Å
384	A	94.8	Very high	85.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148.4	171.7	0	0	0	0	0	110.7	F354 V372 F373 R466 D467	F354-A384 HydrophobicContact CB-CB 4.03Å; F354-A384 HydrophobicContact CD1-CB 3.84Å; F354-A384 HydrophobicContact CD2-CB 3.79Å; F354-A384 HydrophobicContact CE1-CB 4.27Å; F354-A384 HydrophobicContact CE2-CB 4.25Å; F354-A384 HydrophobicContact CG-CB 3.59Å; F354-A384 HydrophobicContact CZ-CB 4.46Å; V372-A384 WeakPolarHBondContact CA-O 3.34Å; F373-A384 PolarHBondContact N-O 2.9Å; F373-A384 PolarHBondContact O-N 2.98Å; A384-R466 CarbonylContact C-O 3.54Å; A384-R466 WeakPolarHBondContact CA-O 3.42Å; A384-D467 HydrophobicContact CB-CB 4.05Å
385	I	96.4	Very high	85.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.3	169.8	-59	167.6	0	0	0	107	A371 V372 S464 L465 R466 Y473 I476 L492 V494 Y504 L513	A371-I385 WeakPolarHBondContact O-CA 3.41Å; V372-I385 HydrophobicContact CG1-CG1 3.96Å; I385-S464 CarbonylContact O-C 3.48Å; I385-S464 WeakPolarHBondContact O-CA 3.43Å; I385-L465 HydrophobicContact CG2-CB 4.38Å; I385-L465 HydrophobicContact CG2-CD1 4.3Å; I385-L465 PolarHBondContact O-N 3.27Å; I385-R466 HydrophobicContact CD1-CB 4.38Å; I385-R466 PolarHBondContact N-O 2.82Å; I385-Y473 HydrophobicContact CD1-CD2 4.4Å; I385-Y473 HydrophobicContact CD1-CE2 4.03Å; I385-Y473 HydrophobicContact CG1-CD2 4.1Å; I385-Y473 HydrophobicContact CG1-CE2 4.09Å; I385-I476 HydrophobicContact CG2-CD1 4.4Å; I385-L492 HydrophobicContact CG2-CD2 4.23Å; I385-V494 HydrophobicContact CD1-CG2 3.95Å; I385-Y504 HydrophobicContact CD1-CE2 4.35Å; I385-L513 HydrophobicContact CB-CD1 4.16Å; I385-L513 HydrophobicContact CD1-CD1 3.65Å; I385-L513 HydrophobicContact CG2-CD1 3.98Å
386	C	96.3	Very high	86.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.3	173.1	-79.8	0	0	0	0	110	C346 A371 F373 Y388 P459	C346-C386 WeakPolarHBondContact CA-SG 3.34Å; C346-C386 HydrophobicContact CB-CB 3.85Å; C346-C386 WeakPolarHBondContact CB-SG 3.32Å; C346-C386 WeakPolarHBondContact SG-CB 3.49Å; C346-C386 CovalentContact SG-SG 2.04Å; C346-C386 PolarHBondContact SG-SG 2.89Å; A371-C386 PolarHBondContact N-O 2.69Å; A371-C386 PolarHBondContact O-N 2.67Å; F373-C386 HydrophobicContact CD2-CB 4.38Å; F373-C386 HydrophobicContact CE2-CB 3.91Å; C386-Y388 HydrophobicContact CB-CE2 3.8Å; C386-Y388 VanDerWaalsContact CB-OH 3.27Å; C386-Y388 WeakPolarHBondContact CB-OH 3.31Å; C386-P459 HydrophobicContact CB-CB 3.97Å
387	H	95.5	Very high	86.8	Confident	5 Å²	5	47.7 Å²	47.7	2%	0.023	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	151.7	171.8	65.4	-179.6	0	0	0	112.4	F369 Y370 P459 L460 L465 H506	F369-H387 CarbonylContact O-C 3.53Å; F369-H387 WeakPolarHBondContact O-CA 3.09Å; F369-H387 WeakPolarHBondContact O-CB 3.4Å; Y370-H387 HydrophobicContact CD1-CB 3.74Å; Y370-H387 HydrophobicContact CE1-CB 3.83Å; Y370-H387 AromaticContact CE1-ND1 3.78Å; Y370-H387 HydrophobicContact CG-CB 4.19Å; H387-P459 CarbonylContact O-C 3.46Å; H387-P459 VanDerWaalsContact O-CA 3.23Å; H387-P459 WeakPolarHBondContact O-CA 3.32Å; H387-L460 PolarHBondContact O-N 3.38Å; H387-L465 HydrophobicContact CB-CD1 3.94Å; H387-H506 AromaticContact CE1-CE1 3.46Å; H387-H506 PolarHBondContact CE1-CE1 3.46Å; H387-H506 VanDerWaalsContact CE1-CE1 3.46Å; H387-H506 AromaticContact CE1-NE2 3.74Å; H387-H506 AromaticContact ND1-CE1 3.58Å
388	Y	96.8	Very high	87.9	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	139.6	-171.6	-51.7	-87.1	0	0	0	110	L344 V345 F369 A371 F373 C386 V457 L458 P459	L344-Y388 HydrophobicContact CD1-CD1 3.67Å; L344-Y388 HydrophobicContact CD1-CD2 4.02Å; L344-Y388 HydrophobicContact CD1-CE1 3.47Å; L344-Y388 VanDerWaalsContact CD1-CE1 3.47Å; L344-Y388 HydrophobicContact CD1-CE2 3.85Å; L344-Y388 HydrophobicContact CD1-CG 3.93Å; L344-Y388 HydrophobicContact CD2-CE2 4.32Å; L344-Y388 HydrophobicContact CG-CE1 4.2Å; L344-Y388 HydrophobicContact CG-CE2 4.18Å; V345-Y388 WeakPolarHBondContact O-CE1 3.38Å; V345-Y388 PolarHBondContact O-OH 3.42Å; F369-Y388 PolarHBondContact N-O 3.49Å; F369-Y388 PolarHBondContact O-N 2.04Å; A371-Y388 HydrophobicContact CB-CE2 4.19Å; F373-Y388 AromaticContact CE2-CE2 3.96Å; F373-Y388 HydrophobicContact CE2-CE2 3.96Å; F373-Y388 WeakPolarHBondContact CE2-OH 3.34Å; F373-Y388 AromaticContact CZ-CE2 3.89Å; F373-Y388 HydrophobicContact CZ-CE2 3.89Å; F373-Y388 AromaticContact CZ-CZ 3.88Å; F373-Y388 WeakPolarHBondContact CZ-OH 3.29Å; C386-Y388 HydrophobicContact CB-CE2 3.8Å; C386-Y388 VanDerWaalsContact CB-OH 3.27Å; C386-Y388 WeakPolarHBondContact CB-OH 3.31Å; Y388-V457 HydrophobicContact CD1-CG1 3.69Å; Y388-V457 HydrophobicContact CE1-CG1 4.36Å; Y388-V457 HydrophobicContact CG-CG1 4.37Å; Y388-L458 VanDerWaalsContact CD1-O 3.3Å; Y388-L458 WeakPolarHBondContact CD1-O 3.44Å; Y388-P459 HydrophobicContact CD1-CB 4.41Å; Y388-P459 HydrophobicContact CE1-CB 3.94Å
389	K	95.5	Very high	89.2	Confident	90 Å²	90	38.8 Å²	38.8	39%	0.391	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	139.2	172.5	-152.4	167.7	177.8	168.8	0	110.4	L368 T391 D392 I393 L460	L368-K389 HydrophobicContact CD2-CB 4.4Å; L368-K389 HydrophobicContact CD2-CG 4.22Å; K389-T391 WeakPolarHBondContact CD-OG1 3.26Å; K389-T391 VanDerWaalsContact CG-OG1 3.31Å; K389-T391 WeakPolarHBondContact CG-OG1 3.41Å; K389-T391 PolarHBondContact O-N 2.73Å; K389-D392 VanDerWaalsContact CB-OD2 3.31Å; K389-D392 WeakPolarHBondContact CB-OD2 3.29Å; K389-D392 PolarHBondContact O-N 2.82Å; K389-I393 PolarHBondContact O-N 3.07Å; K389-L460 HydrophobicContact CB-CD1 3.99Å; K389-L460 HydrophobicContact CD-CD1 4.37Å
390	L	95.6	Very high	90.4	Very high	25 Å²	25	36.1 Å²	36.1	13%	0.131	20%	0.196	C	C	.	.	H	α-helix	trans	-55.7	-37.5	175.2	175.5	65.3	0	0	0	111.6	I281 Y286 F362 G367 F369 D392 I393 E394	I281-L390 HydrophobicContact CD1-CD1 4.37Å; I281-L390 HydrophobicContact CG2-CD1 4.31Å; I281-L390 HydrophobicContact CG2-CD2 3.64Å; Y286-L390 HydrophobicContact CE2-CD1 4.27Å; F362-L390 HydrophobicContact CZ-CD2 4.39Å; G367-L390 VanDerWaalsContact O-CB 3.3Å; G367-L390 WeakPolarHBondContact O-CB 3.47Å; G367-L390 PolarHBondContact O-N 3.45Å; F369-L390 HydrophobicContact CE2-CB 4.18Å; F369-L390 HydrophobicContact CE2-CD1 3.9Å; F369-L390 HydrophobicContact CZ-CD1 4.34Å; L390-D392 PolarHBondContact O-N 3.25Å; L390-I393 PolarHBondContact O-N 2.91Å; L390-E394 HydrophobicContact CD1-CG 4.27Å; L390-E394 HydrophobicContact CG-CG 4.42Å; L390-E394 WeakPolarHBondContact O-CB 3.32Å; L390-E394 WeakPolarHBondContact O-CG 3.49Å; L390-E394 PolarHBondContact O-N 2.99Å
391	T	94.8	Very high	91.3	Very high	74 Å²	74	31.1 Å²	31.1	45%	0.454	17%	0.171	S	C	.	.	H	α-helix	trans	-58	-34.4	176.8	52	0	0	0	0	113.1	K389 A395	K389-T391 WeakPolarHBondContact CD-OG1 3.26Å; K389-T391 VanDerWaalsContact CG-OG1 3.31Å; K389-T391 WeakPolarHBondContact CG-OG1 3.41Å; K389-T391 PolarHBondContact O-N 2.73Å; T391-A395 VanDerWaalsContact O-CB 3.29Å; T391-A395 WeakPolarHBondContact O-CB 3.04Å; T391-A395 PolarHBondContact O-N 2.63Å
392	D	94.9	Very high	91.3	Very high	62 Å²	62	26.8 Å²	26.8	33%	0.332	15%	0.15	S	C	.	.	H	α-helix	trans	-82.2	-37.6	-174	-49.5	-16.8	0	0	0	109.6	K389 L390 A395 V396	K389-D392 VanDerWaalsContact CB-OD2 3.31Å; K389-D392 WeakPolarHBondContact CB-OD2 3.29Å; K389-D392 PolarHBondContact O-N 2.82Å; L390-D392 PolarHBondContact O-N 3.25Å; D392-A395 PolarHBondContact O-N 3.25Å; D392-V396 WeakPolarHBondContact O-CG2 3.4Å; D392-V396 PolarHBondContact O-N 3.12Å
393	I	95.6	Very high	90.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.2	-48.7	167.5	-67.3	167.6	0	0	0	110.2	Y286 V317 F369 K389 L390 V396 F397 V457	Y286-I393 HydrophobicContact CD1-CG2 4.45Å; Y286-I393 HydrophobicContact CE1-CG2 3.97Å; V317-I393 HydrophobicContact CG1-CG2 4.16Å; V317-I393 HydrophobicContact CG2-CG2 4.13Å; F369-I393 HydrophobicContact CD2-CD1 3.45Å; F369-I393 VanDerWaalsContact CD2-CD1 3.45Å; F369-I393 HydrophobicContact CE2-CD1 3.54Å; F369-I393 HydrophobicContact CG-CD1 4.38Å; K389-I393 PolarHBondContact O-N 3.07Å; L390-I393 PolarHBondContact O-N 2.91Å; I393-V396 PolarHBondContact O-N 2.83Å; I393-F397 HydrophobicContact CG2-CD2 3.82Å; I393-F397 HydrophobicContact CG2-CE2 3.51Å; I393-F397 WeakPolarHBondContact O-CD2 3.48Å; I393-F397 PolarHBondContact O-N 3.24Å; I393-F397 VanDerWaalsContact O-N 3.09Å; I393-V457 HydrophobicContact CG1-CB 4.47Å; I393-V457 HydrophobicContact CG1-CG1 3.59Å; I393-V457 HydrophobicContact CG1-CG2 4.08Å
394	E	93.3	Very high	88.7	Confident	54 Å²	54	29.2 Å²	29.2	25%	0.252	16%	0.16	S	C	.	.	H	α-helix	trans	-64.1	-41.3	177.8	-74.7	-175	171.3	0	0	112.6	Y286 L390 V396 F397 K398	Y286-E394 WeakPolarHBondContact OH-CG 3.35Å; Y286-E394 PolarHBondContact OH-OE1 2.9Å; L390-E394 HydrophobicContact CD1-CG 4.27Å; L390-E394 HydrophobicContact CG-CG 4.42Å; L390-E394 WeakPolarHBondContact O-CB 3.32Å; L390-E394 WeakPolarHBondContact O-CG 3.49Å; L390-E394 PolarHBondContact O-N 2.99Å; E394-V396 VanDerWaalsContact C-N 3.3Å; E394-V396 PolarHBondContact O-N 3.32Å; E394-F397 PolarHBondContact O-N 2.6Å; E394-K398 VanDerWaalsContact O-CG 3.31Å; E394-K398 WeakPolarHBondContact O-CG 3.42Å; E394-K398 PolarHBondContact O-N 3.02Å
395	A	92.7	Very high	86.8	Confident	59 Å²	59	30.2 Å²	30.2	49%	0.488	17%	0.171	S	C	.	.	H	α-helix	trans	-61.6	-37.6	175.5	0	0	0	0	0	112.2	T391 D392 K398 G399	T391-A395 VanDerWaalsContact O-CB 3.29Å; T391-A395 WeakPolarHBondContact O-CB 3.04Å; T391-A395 PolarHBondContact O-N 2.63Å; D392-A395 PolarHBondContact O-N 3.25Å; A395-K398 PolarHBondContact O-N 3Å; A395-G399 PolarHBondContact O-N 3.3Å; A395-G399 VanDerWaalsContact O-N 3.12Å
396	V	92.9	Very high	84.8	Confident	13 Å²	13	39.5 Å²	39.5	8%	0.079	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-45.7	173.1	165.5	0	0	0	0	111.4	A342 D392 I393 E394 K398 G399 M453 K455 V457	A342-V396 HydrophobicContact CB-CG1 3.56Å; D392-V396 WeakPolarHBondContact O-CG2 3.4Å; D392-V396 PolarHBondContact O-N 3.12Å; I393-V396 PolarHBondContact O-N 2.83Å; E394-V396 VanDerWaalsContact C-N 3.3Å; E394-V396 PolarHBondContact O-N 3.32Å; V396-K398 VanDerWaalsContact C-N 3.3Å; V396-K398 PolarHBondContact O-N 2.78Å; V396-G399 PolarHBondContact O-N 2.91Å; V396-M453 HydrophobicContact CG1-CB 3.96Å; V396-M453 HydrophobicContact CG1-CG 4.3Å; V396-M453 WeakPolarHBondContact O-CE 3.45Å; V396-K455 HydrophobicContact CB-CB 4.49Å; V396-K455 HydrophobicContact CG1-CB 4.14Å; V396-K455 WeakPolarHBondContact CG1-O 3.45Å; V396-K455 HydrophobicContact CG2-CB 3.95Å; V396-V457 HydrophobicContact CB-CG2 4.06Å; V396-V457 HydrophobicContact CG1-CG2 4.08Å; V396-V457 HydrophobicContact CG2-CG2 4Å
397	F	90	Very high	82.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.4	-25.4	177.4	-72.8	-65	0	0	0	114.2	Y286 V317 R319 S340 A342 I393 E394 G399 N416 M453	Y286-F397 HydrophobicContact CD1-CE2 4.32Å; Y286-F397 HydrophobicContact CE1-CD2 4.3Å; Y286-F397 AromaticContact CE1-CE2 3.9Å; Y286-F397 HydrophobicContact CE1-CE2 3.9Å; V317-F397 HydrophobicContact CG1-CE2 4.19Å; V317-F397 HydrophobicContact CG1-CZ 4.09Å; V317-F397 HydrophobicContact CG2-CE2 4.27Å; V317-F397 HydrophobicContact CG2-CZ 4.35Å; V317-F397 WeakPolarHBondContact O-CZ 3.32Å; R319-F397 HydrophobicContact CB-CE2 4.38Å; R319-F397 HydrophobicContact CB-CZ 4.34Å; R319-F397 HydrophobicContact CG-CD1 4.15Å; R319-F397 HydrophobicContact CG-CD2 4.24Å; R319-F397 HydrophobicContact CG-CE1 4.07Å; R319-F397 HydrophobicContact CG-CE2 4.15Å; R319-F397 HydrophobicContact CG-CG 4.25Å; R319-F397 HydrophobicContact CG-CZ 4.06Å; S340-F397 WeakPolarHBondContact O-CE1 3.26Å; A342-F397 HydrophobicContact CB-CE1 4.29Å; A342-F397 HydrophobicContact CB-CZ 4.45Å; I393-F397 HydrophobicContact CG2-CD2 3.82Å; I393-F397 HydrophobicContact CG2-CE2 3.51Å; I393-F397 WeakPolarHBondContact O-CD2 3.48Å; I393-F397 PolarHBondContact O-N 3.24Å; I393-F397 VanDerWaalsContact O-N 3.09Å; E394-F397 PolarHBondContact O-N 2.6Å; F397-G399 VanDerWaalsContact C-N 3.3Å; F397-N416 PolarHBondContact O-ND2 2.94Å; F397-N416 VanDerWaalsContact O-ND2 3.07Å; F397-M453 HydrophobicContact CD1-CG 3.72Å; F397-M453 HydrophobicContact CD1-SD 4.13Å; F397-M453 HydrophobicContact CE1-CG 4.18Å; F397-M453 WeakPolarHBondContact O-CE 3.27Å
398	K	88.3	Confident	80.8	Confident	90 Å²	90	45.3 Å²	45.3	39%	0.391	27%	0.269	S	S	.	.	H	α-helix	trans	-76.6	-16.5	169.7	-67.6	177.1	-166.5	-144.5	0	113	E394 A395 V396 P419 D420	E394-K398 VanDerWaalsContact O-CG 3.31Å; E394-K398 WeakPolarHBondContact O-CG 3.42Å; E394-K398 PolarHBondContact O-N 3.02Å; A395-K398 PolarHBondContact O-N 3Å; V396-K398 VanDerWaalsContact C-N 3.3Å; V396-K398 PolarHBondContact O-N 2.78Å; K398-P419 HydrophobicContact CB-CB 3.9Å; K398-P419 HydrophobicContact CG-CB 4.14Å; K398-P419 WeakPolarHBondContact CG-O 3.06Å; K398-P419 WeakPolarHBondContact O-CB 3.32Å; K398-D420 WeakPolarHBondContact CE-OD1 2.99Å; K398-D420 IonicContact NZ-OD1 3.7Å; K398-D420 PolarHBondContact NZ-OD1 2.93Å
399	G	85	Confident	78.7	Confident	14 Å²	14	49.9 Å²	49.9	14%	0.144	30%	0.297	C	S	.	.	S	Bend	trans	-75.3	-177.3	-179.3	0	0	0	0	0	114.7	A395 V396 F397 N416 M453	A395-G399 PolarHBondContact O-N 3.3Å; A395-G399 VanDerWaalsContact O-N 3.12Å; V396-G399 PolarHBondContact O-N 2.91Å; F397-G399 VanDerWaalsContact C-N 3.3Å; G399-N416 WeakPolarHBondContact O-CB 3.45Å; G399-M453 WeakPolarHBondContact O-CE 3.23Å
400	P	84.9	Confident	77	Confident	37 Å²	37	48.6 Å²	48.6	24%	0.24	30%	0.299	C	S	.	.			trans	-62	151.6	175.8	-19.7	32.3	0	0	0	113.1	S413 R414 M453 E454	P400-S413 WeakPolarHBondContact CB-OG 3.07Å; P400-R414 WeakPolarHBondContact CA-O 3.4Å; P400-R414 WeakPolarHBondContact CB-O 3.28Å; P400-M453 WeakPolarHBondContact O-CE 3.4Å; P400-E454 HydrophobicContact CB-CB 4.49Å; P400-E454 WeakPolarHBondContact CB-OE2 2.99Å; P400-E454 PolarHBondContact O-N 3.06Å
401	A	79.4	Confident	75.5	Confident	4 Å²	4	50 Å²	50	3%	0.033	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	156	176.8	0	0	0	0	0	111.2	F403 S413 R414 I452 M453	A401-F403 HydrophobicContact CB-CD2 4.49Å; A401-F403 HydrophobicContact CB-CE2 3.77Å; A401-F403 HydrophobicContact CB-CZ 4.36Å; A401-F403 WeakPolarHBondContact O-CD2 3.37Å; A401-F403 WeakPolarHBondContact O-CE2 3.32Å; A401-S413 WeakPolarHBondContact O-CA 3.44Å; A401-R414 PolarHBondContact N-O 3.36Å; A401-R414 PolarHBondContact O-N 3.49Å; A401-I452 CarbonylContact C-O 3.39Å; A401-I452 WeakPolarHBondContact CA-O 3.32Å; A401-M453 HydrophobicContact CB-CE 4.06Å; A401-M453 HydrophobicContact CB-SD 4.26Å
402	L	74.6	Confident	74.3	Confident	32 Å²	32	50.7 Å²	50.7	17%	0.168	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	126.7	175.4	-66.7	173.9	0	0	0	110.1	W411 I452 E454	L402-W411 HydrophobicContact CB-CB 4.31Å; L402-W411 HydrophobicContact CB-CE3 3.96Å; L402-W411 HydrophobicContact CD2-CB 4.32Å; L402-I452 HydrophobicContact CB-CB 4.45Å; L402-I452 HydrophobicContact CD1-CG2 4.08Å; L402-I452 PolarHBondContact N-O 3.08Å; L402-E454 HydrophobicContact CD2-CB 4.02Å; L402-E454 HydrophobicContact CD2-CG 4.22Å; L402-E454 HydrophobicContact CG-CB 4.06Å
403	F	66.9	Low	73.3	Confident	10 Å²	10	50.1 Å²	50.1	4%	0.044	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.7	-179.7	-68	-104.6	0	0	0	109.2	A401 L412 R414 Q449 K450	A401-F403 HydrophobicContact CB-CD2 4.49Å; A401-F403 HydrophobicContact CB-CE2 3.77Å; A401-F403 HydrophobicContact CB-CZ 4.36Å; A401-F403 WeakPolarHBondContact O-CD2 3.37Å; A401-F403 WeakPolarHBondContact O-CE2 3.32Å; F403-L412 PolarHBondContact N-O 2.8Å; F403-L412 PolarHBondContact O-N 3.45Å; F403-R414 HydrophobicContact CB-CG 4.37Å; F403-R414 HydrophobicContact CD2-CB 3.56Å; F403-R414 HydrophobicContact CD2-CG 3.66Å; F403-R414 HydrophobicContact CE2-CB 3.59Å; F403-R414 HydrophobicContact CE2-CG 4.2Å; F403-R414 HydrophobicContact CG-CB 4.38Å; F403-R414 HydrophobicContact CG-CG 4.08Å; F403-R414 HydrophobicContact CZ-CB 4.41Å; F403-Q449 HydrophobicContact CD1-CB 3.55Å; F403-Q449 HydrophobicContact CE1-CB 4.06Å; F403-K450 HydrophobicContact CE1-CG 3.9Å; F403-K450 HydrophobicContact CZ-CG 3.96Å
404	K	59.5	Low	72.2	Confident	44 Å²	44	55.2 Å²	55.2	19%	0.191	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	114.1	166.6	-167.4	160.2	-177.2	157.7	0	108.8	F267 S408 T409 W411	F267-K404 HydrophobicContact CD1-CD 4.32Å; F267-K404 HydrophobicContact CD2-CD 4.43Å; F267-K404 HydrophobicContact CE1-CD 3.75Å; F267-K404 HydrophobicContact CE2-CD 3.9Å; F267-K404 HydrophobicContact CZ-CD 3.58Å; K404-S408 WeakPolarHBondContact CE-O 3.43Å; K404-T409 VanDerWaalsContact CE-O 3.24Å; K404-T409 WeakPolarHBondContact CE-O 3.13Å; K404-T409 PolarHBondContact NZ-O 2.82Å; K404-W411 HydrophobicContact CB-CD2 4.16Å; K404-W411 HydrophobicContact CB-CE3 3.81Å; K404-W411 HydrophobicContact CB-CH2 4.35Å; K404-W411 HydrophobicContact CB-CZ3 3.91Å; K404-W411 HydrophobicContact CD-CZ2 4.39Å
405	G	53.9	Low	71.5	Confident	22 Å²	22	57.9 Å²	57.9	23%	0.227	35%	0.345	C	S	.	.			trans	-68.4	153.6	174.7	0	0	0	0	0	111.5	G407 S408	G405-G407 PolarHBondContact O-N 3.48Å; G405-S408 WeakPolarHBondContact O-CB 3.46Å; G405-S408 PolarHBondContact O-N 2.9Å
406	E	54.3	Low	70.6	Confident	194 Å²	194	56.4 Å²	56.4	91%	0.907	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	127	170.8	-70.4	177.8	167.2	0	0	109.6	S408	E406-S408 PolarHBondContact O-N 3.21Å
407	G	52.5	Low	69.2	Low	88 Å²	88	59 Å²	59	91%	0.907	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	-9.4	-176.6	0	0	0	0	0	116.3	G405	G405-G407 PolarHBondContact O-N 3.48Å
408	S	54.7	Low	68	Low	40 Å²	40	60.9 Å²	60.9	28%	0.28	36%	0.36	S	S	.	.			trans	-69.9	141.8	172.6	-173.7	0	0	0	0	110.5	K404 G405 E406 C410	K404-S408 WeakPolarHBondContact CE-O 3.43Å; G405-S408 WeakPolarHBondContact O-CB 3.46Å; G405-S408 PolarHBondContact O-N 2.9Å; E406-S408 PolarHBondContact O-N 3.21Å; S408-C410 PolarHBondContact OG-N 3.01Å; S408-C410 PolarHBondContact OG-O 2.71Å
409	T	54.6	Low	67	Low	95 Å²	95	58.7 Å²	58.7	58%	0.583	36%	0.355	S	S	*	.	S	Bend	trans	-84.6	-40	163.8	47.7	0	0	0	0	111.2	K404	K404-T409 VanDerWaalsContact CE-O 3.24Å; K404-T409 WeakPolarHBondContact CE-O 3.13Å; K404-T409 PolarHBondContact NZ-O 2.82Å
410	C	58.5	Low	66	Low	64 Å²	64	61.4 Å²	61.4	43%	0.432	37%	0.366	S	S	.	.	S	Bend	trans	-79.8	154.8	-177.6	-55.5	0	0	0	0	113.2	S408	S408-C410 PolarHBondContact OG-N 3.01Å; S408-C410 PolarHBondContact OG-O 2.71Å
411	W	65.3	Low	64.8	Low	54 Å²	54	61.2 Å²	61.2	21%	0.205	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	136.9	168.1	-63.2	89.7	0	0	0	109.8	F267 L402 K404 I452	F267-W411 AromaticContact CD1-CH2 4Å; F267-W411 HydrophobicContact CD1-CH2 4Å; F267-W411 AromaticContact CD1-CZ2 3.79Å; F267-W411 HydrophobicContact CD1-CZ2 3.79Å; F267-W411 HydrophobicContact CE1-CH2 4.31Å; F267-W411 AromaticContact CE1-CZ2 3.66Å; F267-W411 HydrophobicContact CE1-CZ2 3.66Å; L402-W411 HydrophobicContact CB-CB 4.31Å; L402-W411 HydrophobicContact CB-CE3 3.96Å; L402-W411 HydrophobicContact CD2-CB 4.32Å; K404-W411 HydrophobicContact CB-CD2 4.16Å; K404-W411 HydrophobicContact CB-CE3 3.81Å; K404-W411 HydrophobicContact CB-CH2 4.35Å; K404-W411 HydrophobicContact CB-CZ3 3.91Å; K404-W411 HydrophobicContact CD-CZ2 4.39Å; W411-I452 HydrophobicContact CH2-CD1 3.9Å; W411-I452 HydrophobicContact CZ2-CD1 4.23Å; W411-I452 HydrophobicContact CZ3-CD1 4.31Å
412	L	68	Low	63.2	Low	88 Å²	88	65.6 Å²	65.6	46%	0.461	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.7	178.4	-63.2	173.4	0	0	0	109.7	F403	F403-L412 PolarHBondContact N-O 2.8Å; F403-L412 PolarHBondContact O-N 3.45Å
413	S	75.1	Confident	61.7	Low	51 Å²	51	66.2 Å²	66.2	36%	0.357	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	138.4	169.9	-177	0	0	0	0	110.8	P400 A401 E454	P400-S413 WeakPolarHBondContact CB-OG 3.07Å; A401-S413 WeakPolarHBondContact O-CA 3.44Å; S413-E454 VanDerWaalsContact CB-OE1 3.24Å; S413-E454 WeakPolarHBondContact CB-OE1 3.45Å; S413-E454 WeakPolarHBondContact CB-OE2 3.12Å; S413-E454 PolarHBondContact OG-OE1 3.05Å; S413-E454 PolarHBondContact OG-OE2 3.29Å
414	R	72.7	Confident	60.1	Low	106 Å²	106	70.2 Å²	70.2	40%	0.4	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	149.5	165.9	-52	-178.4	172.5	-170.6	-4.7	110.2	P400 A401 F403 N416	P400-R414 WeakPolarHBondContact CA-O 3.4Å; P400-R414 WeakPolarHBondContact CB-O 3.28Å; A401-R414 PolarHBondContact N-O 3.36Å; A401-R414 PolarHBondContact O-N 3.49Å; F403-R414 HydrophobicContact CB-CG 4.37Å; F403-R414 HydrophobicContact CD2-CB 3.56Å; F403-R414 HydrophobicContact CD2-CG 3.66Å; F403-R414 HydrophobicContact CE2-CB 3.59Å; F403-R414 HydrophobicContact CE2-CG 4.2Å; F403-R414 HydrophobicContact CG-CB 4.38Å; F403-R414 HydrophobicContact CG-CG 4.08Å; F403-R414 HydrophobicContact CZ-CB 4.41Å; R414-N416 PolarHBondContact O-N 2.91Å
415	P	77.1	Confident	58.8	Low	110 Å²	110	73.5 Å²	73.5	71%	0.714	45%	0.451	S	S	*	.			trans	-53.1	136.2	173.5	-25.5	34.5	0	0	0	111.7	P417	P415-P417 VanDerWaalsContact O-CD 3.28Å; P415-P417 WeakPolarHBondContact O-CD 3.02Å
416	N	74.3	Confident	57.7	Low	28 Å²	28	83.8 Å²	83.8	15%	0.15	48%	0.482	C	S	.	.			trans	-72	116.5	174.1	178.7	-0.9	0	0	0	109.2	F397 G399 R414 S418	F397-N416 PolarHBondContact O-ND2 2.94Å; F397-N416 VanDerWaalsContact O-ND2 3.07Å; G399-N416 WeakPolarHBondContact O-CB 3.45Å; R414-N416 PolarHBondContact O-N 2.91Å; N416-S418 PolarHBondContact O-N 3.4Å; N416-S418 PolarHBondContact OD1-N 3.43Å; N416-S418 PolarHBondContact OD1-O 2.84Å
417	P	63.7	Low	56.8	Low	67 Å²	67	85.7 Å²	85.7	44%	0.435	48%	0.481	S	S	.	.	S	Bend	trans	-77.7	-0.4	-177.5	34.2	-37.9	0	0	0	113.5	P415 Y443	P415-P417 VanDerWaalsContact O-CD 3.28Å; P415-P417 WeakPolarHBondContact O-CD 3.02Å; P417-Y443 WeakPolarHBondContact CB-OH 3.45Å; P417-Y443 HydrophobicContact CG-CE1 4.19Å
418	S	66	Low	55.8	Low	41 Å²	41	86.6 Å²	86.6	29%	0.287	47%	0.469	S	S	.	.			trans	-146.8	66.3	179.6	-167.6	0	0	0	0	110.6	N416 D420 H421	N416-S418 PolarHBondContact O-N 3.4Å; N416-S418 PolarHBondContact OD1-N 3.43Å; N416-S418 PolarHBondContact OD1-O 2.84Å; S418-D420 PolarHBondContact O-N 3.28Å; S418-H421 PolarHBondContact O-N 2.81Å; S418-H421 WeakPolarHBondContact OG-CA 3.32Å
419	P	66.3	Low	54.6	Low	44 Å²	44	93.9 Å²	93.9	29%	0.286	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-43.3	-170.7	25	-34.4	0	0	0	113.3	R319 K398	R319-P419 PolarHBondContact NH2-O 2.85Å; K398-P419 HydrophobicContact CB-CB 3.9Å; K398-P419 HydrophobicContact CG-CB 4.14Å; K398-P419 WeakPolarHBondContact CG-O 3.06Å; K398-P419 WeakPolarHBondContact O-CB 3.32Å
420	D	63.8	Low	53.6	Low	71 Å²	71	94.6 Å²	94.6	38%	0.38	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-8.2	-179.3	-58	-66	0	0	0	113.5	K398 S418 V422	K398-D420 WeakPolarHBondContact CE-OD1 2.99Å; K398-D420 IonicContact NZ-OD1 3.7Å; K398-D420 PolarHBondContact NZ-OD1 2.93Å; S418-D420 PolarHBondContact O-N 3.28Å; D420-V422 HydrophobicContact CB-CB 3.98Å; D420-V422 HydrophobicContact CB-CG2 3.68Å; D420-V422 PolarHBondContact O-N 3.25Å
421	H	59.7	Low	52.3	Low	33 Å²	33	102.8 Å²	102.8	15%	0.153	53%	0.526	C	S	.	.			trans	52.9	7.5	-161.1	-55.5	-92.2	0	0	0	115.2	F284 R319 S418 V423	F284-H421 AromaticContact CE1-CD2 3.89Å; R319-H421 PolarHBondContact NH2-CD2 3.11Å; R319-H421 PolarHBondContact NH2-NE2 3.13Å; S418-H421 PolarHBondContact O-N 2.81Å; S418-H421 WeakPolarHBondContact OG-CA 3.32Å; H421-V423 PolarHBondContact O-N 3.28Å
422	V	45.7	Very low	50.6	Low	96 Å²	96	111.4 Å²	111.4	58%	0.582	56%	0.558	S	S	*	*			trans	-72.4	116.1	179.1	172.2	0	0	0	0	110.3	D420 S424	D420-V422 HydrophobicContact CB-CB 3.98Å; D420-V422 HydrophobicContact CB-CG2 3.68Å; D420-V422 PolarHBondContact O-N 3.25Å; V422-S424 PolarHBondContact O-N 3.38Å
423	V	42.4	Very low	49	Very low	45 Å²	45	114.7 Å²	114.7	27%	0.273	58%	0.575	S	S	.	*			trans	-72.2	107.8	170.4	179.9	0	0	0	0	108.9	H421 S425 R439 Y440	H421-V423 PolarHBondContact O-N 3.28Å; V423-S425 PolarHBondContact O-N 2.64Å; V423-S425 VanDerWaalsContact O-N 3.08Å; V423-R439 WeakPolarHBondContact CG1-O 3.46Å; V423-Y440 HydrophobicContact CG1-CD2 4.2Å
424	S	35.2	Very low	46.8	Very low	93 Å²	93	119.5 Å²	119.5	65%	0.65	60%	0.595	S	S	*	*			trans	-68.2	105.6	177.5	64.7	0	0	0	0	111	V422 R426	V422-S424 PolarHBondContact O-N 3.38Å; S424-R426 PolarHBondContact O-N 3.37Å
425	S	30.7	Very low	45.2	Very low	114 Å²	114	120.1 Å²	120.1	80%	0.797	61%	0.606	S	S	*	*			trans	-75.9	113.2	174.6	61.6	0	0	0	0	111.1	V423	V423-S425 PolarHBondContact O-N 2.64Å; V423-S425 VanDerWaalsContact O-N 3.08Å
426	R	31.9	Very low	43.5	Very low	237 Å²	237	123.3 Å²	123.3	89%	0.894	60%	0.604	S	S	*	*			trans	-134.9	81.5	161.8	-80.4	-165.8	179.2	-167.8	2.1	110.5	S424	S424-R426 PolarHBondContact O-N 3.37Å
427	R	34.1	Very low	42.2	Very low	234 Å²	234	123.3 Å²	123.3	88%	0.883	61%	0.606	S	S	*	*	S	Bend	trans	161.4	114.8	130.6	-88.2	178.2	-121	-149.3	2.8	112.4
428	V	32	Very low	41.3	Very low	107 Å²	107	123.5 Å²	123.5	65%	0.648	60%	0.603	S	S	*	*			trans	47.4	107.2	140.7	-151.7	0	0	0	0	119
429	F	29.3	Very low	39.9	Very low	194 Å²	194	132 Å²	132	85%	0.851	63%	0.629	S	S	*	*				171.9	149.2	109.1	-92.7	-70.4	0	0	0	109.6
430	P	34.7	Very low	38.6	Very low	109 Å²	109	138 Å²	138	71%	0.708	65%	0.647	S	S	*	*			trans	-98.8	120.4	-161	35.4	-30.9	0	0	0	114.2
431	Y	31.3	Very low	37.5	Very low	237 Å²	237	136.2 Å²	136.2	93%	0.929	65%	0.645	S	S	*	*			trans	-136.2	146.2	133.5	-118.1	-93.9	0	0	0	108.3
432	R	29.7	Very low	36.4	Very low	234 Å²	234	141.5 Å²	141.5	88%	0.883	68%	0.675	S	S	*	*			trans	-84.5	158.5	-159	-64.6	175.4	169.8	169.5	-4.5	113.1
433	I	33.6	Very low	36.3	Very low	157 Å²	157	141.4 Å²	141.4	81%	0.805	67%	0.665	S	S	*	*	S	Bend	trans	96.6	123.3	162.8	-56.1	163.5	0	0	0	115.6
434	L	28.7	Very low	36.4	Very low	152 Å²	152	142.6 Å²	142.6	80%	0.796	67%	0.669	S	S	*	*			trans	-24.2	125	-178.4	-68.7	85	0	0	0	117.9
435	L	38.3	Very low	36.9	Very low	120 Å²	120	148.5 Å²	148.5	63%	0.628	68%	0.677	S	S	*	*			trans	-147.1	107.4	151.2	-94.3	149.5	0	0	0	108.3	L438	L435-L438 HydrophobicContact CB-CD1 3.89Å; L435-L438 HydrophobicContact CB-CG 4.18Å; L435-L438 HydrophobicContact CD1-CD1 3.73Å; L435-L438 HydrophobicContact CD2-CD1 3.84Å; L435-L438 HydrophobicContact CD2-CG 4.05Å; L435-L438 HydrophobicContact CG-CD1 4Å
436	R	42.1	Very low	37.6	Very low	177 Å²	177	149.3 Å²	149.3	67%	0.668	66%	0.664	S	S	*	*	S	Bend	trans	-90.1	-5	-170.6	-105.8	177.6	174.4	173.1	-3.1	115.6
437	C	46.4	Very low	38.4	Very low	28 Å²	28	138.7 Å²	138.7	19%	0.189	63%	0.626	C	S	.	*	S	Bend	trans	-119.2	11.7	-171.9	-65.7	0	0	0	0	115.2
438	L	44.7	Very low	39	Very low	71 Å²	71	130.6 Å²	130.6	37%	0.372	60%	0.6	S	S	.	*			trans	-102.1	138.9	-171.3	-65.8	-173.5	0	0	0	115.3	P325 L435	P325-L438 HydrophobicContact CG-CD2 3.88Å; L435-L438 HydrophobicContact CB-CD1 3.89Å; L435-L438 HydrophobicContact CB-CG 4.18Å; L435-L438 HydrophobicContact CD1-CD1 3.73Å; L435-L438 HydrophobicContact CD2-CD1 3.84Å; L435-L438 HydrophobicContact CD2-CG 4.05Å; L435-L438 HydrophobicContact CG-CD1 4Å
439	R	38.4	Very low	40.2	Very low	220 Å²	220	127.8 Å²	127.8	83%	0.83	58%	0.58	S	S	*	*			trans	79.7	92.9	173	-58.1	-176.4	-179.4	-179.9	1.4	117.7	V423	V423-R439 WeakPolarHBondContact CG1-O 3.46Å
440	Y	38.4	Very low	41.5	Very low	169 Å²	169	120.4 Å²	120.4	66%	0.663	55%	0.547	S	S	*	.			trans	-147.5	83.5	138.4	-113.8	-75.3	0	0	0	112.3	V423 N442	V423-Y440 HydrophobicContact CG1-CD2 4.2Å; Y440-N442 PolarHBondContact O-N 3.46Å; Y440-N442 VanDerWaalsContact O-N 3.11Å
441	G	39.6	Very low	43.1	Very low	34 Å²	34	116.7 Å²	116.7	35%	0.351	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	22.7	-174.9	0	0	0	0	0	117.2	T328	T328-G441 WeakPolarHBondContact OG1-CA 3.41Å; T328-G441 PolarHBondContact OG1-O 2.93Å
442	N	37.6	Very low	45.4	Very low	143 Å²	143	105.8 Å²	105.8	77%	0.765	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	11.8	-174	-97	-17	0	0	0	114.3	Y440	Y440-N442 PolarHBondContact O-N 3.46Å; Y440-N442 VanDerWaalsContact O-N 3.11Å
443	Y	43.7	Very low	48.2	Very low	95 Å²	95	95.1 Å²	95.1	37%	0.373	44%	0.437	S	S	.	.			trans	-96.7	10.7	-175.3	-122.9	-85.4	0	0	0	115.4	P417 R445 Y446 S447	P417-Y443 WeakPolarHBondContact CB-OH 3.45Å; P417-Y443 HydrophobicContact CG-CE1 4.19Å; Y443-R445 VanDerWaalsContact C-N 3.3Å; Y443-R445 PolarHBondContact O-N 3.44Å; Y443-R445 VanDerWaalsContact O-N 3.16Å; Y443-Y446 HydrophobicContact CE1-CD2 4.32Å; Y443-Y446 HydrophobicContact CE1-CG 4.31Å; Y443-Y446 PolarHBondContact O-N 2.88Å; Y443-S447 PolarHBondContact O-N 2.91Å
444	D	44.4	Very low	50.7	Low	69 Å²	69	90.8 Å²	90.8	37%	0.369	41%	0.414	S	S	.	.	H	α-helix	trans	-53.1	-39.3	-168.6	-144.1	-8.1	0	0	0	114	Y446 N448	D444-Y446 PolarHBondContact O-N 2.91Å; D444-N448 PolarHBondContact O-ND2 2.78Å
445	R	44.8	Very low	53.6	Low	218 Å²	218	88.5 Å²	88.5	82%	0.823	40%	0.397	S	S	*	.	H	α-helix	trans	-74.8	-22.2	-177.4	-150.6	174.8	-168.4	179.1	3.6	114.2	Y443	Y443-R445 VanDerWaalsContact C-N 3.3Å; Y443-R445 PolarHBondContact O-N 3.44Å; Y443-R445 VanDerWaalsContact O-N 3.16Å
446	Y	45.6	Very low	56.2	Low	131 Å²	131	83.7 Å²	83.7	51%	0.514	38%	0.375	S	S	.	.	H	α-helix	trans	-108.4	-10.8	-179.3	-68.5	-75.3	0	0	0	113.5	Y443 D444 N448	Y443-Y446 HydrophobicContact CE1-CD2 4.32Å; Y443-Y446 HydrophobicContact CE1-CG 4.31Å; Y443-Y446 PolarHBondContact O-N 2.88Å; D444-Y446 PolarHBondContact O-N 2.91Å; Y446-N448 PolarHBondContact O-N 3.42Å
447	S	48.5	Very low	58.8	Low	13 Å²	13	75.3 Å²	75.3	9%	0.091	34%	0.344	C	S	.	.	H	α-helix	trans	-64.1	-26.1	173.5	-166.9	0	0	0	0	112.6	Y443 Q449	Y443-S447 PolarHBondContact O-N 2.91Å; S447-Q449 PolarHBondContact O-N 2.99Å
448	N	48.4	Very low	61.1	Low	65 Å²	65	77.2 Å²	77.2	35%	0.348	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	4.2	-170.2	-59.5	-22.5	0	0	0	114.4	R243 D444 Y446 Y451	R243-N448 PolarHBondContact NH1-OD1 2.95Å; D444-N448 PolarHBondContact O-ND2 2.78Å; Y446-N448 PolarHBondContact O-N 3.42Å; N448-Y451 WeakPolarHBondContact O-CE2 3.19Å
449	Q	55.4	Low	63.5	Low	47 Å²	47	74 Å²	74	22%	0.22	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.1	3	-173.9	-61	177.7	-12.6	0	0	113.5	F403 S447	F403-Q449 HydrophobicContact CD1-CB 3.55Å; F403-Q449 HydrophobicContact CE1-CB 4.06Å; S447-Q449 PolarHBondContact O-N 2.99Å
450	K	56.7	Low	66	Low	40 Å²	40	67.3 Å²	67.3	17%	0.174	32%	0.315	C	S	.	.			trans	-104.3	81.9	-172.5	-66.4	179.5	-172.2	177.9	0	111.7	F403	F403-K450 HydrophobicContact CE1-CG 3.9Å; F403-K450 HydrophobicContact CZ-CG 3.96Å
451	Y	68.2	Low	68.4	Low	31 Å²	31	61.9 Å²	61.9	12%	0.122	30%	0.297	C	S	.	.			trans	-126.9	-36.9	-177.4	-57.8	-58.7	0	0	0	114.8	L269 F339 K341 N448	L269-Y451 HydrophobicContact CD1-CD1 3.93Å; L269-Y451 HydrophobicContact CD1-CE1 3.47Å; L269-Y451 VanDerWaalsContact CD1-CE1 3.47Å; L269-Y451 HydrophobicContact CD1-CE2 4.44Å; L269-Y451 HydrophobicContact CD2-CD1 3.79Å; L269-Y451 HydrophobicContact CD2-CD2 3.36Å; L269-Y451 HydrophobicContact CD2-CE1 3.75Å; L269-Y451 HydrophobicContact CD2-CE2 3.29Å; L269-Y451 HydrophobicContact CD2-CG 3.6Å; L269-Y451 VanDerWaalsContact CD2-CZ 3.49Å; L269-Y451 HydrophobicContact CG-CD1 4.41Å; L269-Y451 HydrophobicContact CG-CE1 4.25Å; L269-Y451 HydrophobicContact CG-CE2 4.5Å; F339-Y451 AromaticContact CD1-CD1 3.8Å; F339-Y451 HydrophobicContact CD1-CD1 3.8Å; F339-Y451 HydrophobicContact CD1-CE1 4.28Å; F339-Y451 HydrophobicContact CE1-CD1 4.21Å; K341-Y451 WeakPolarHBondContact CG-O 3.38Å; K341-Y451 PolarHBondContact N-O 2.66Å; N448-Y451 WeakPolarHBondContact O-CE2 3.19Å
452	I	81.4	Confident	70.8	Confident	7 Å²	7	64.6 Å²	64.6	4%	0.036	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.4	-172.9	-53.3	-179.4	0	0	0	109.6	K341 A401 L402 W411	K341-I452 HydrophobicContact CG-CG1 4.33Å; K341-I452 CarbonylContact O-C 3.5Å; K341-I452 VanDerWaalsContact O-CA 3.32Å; K341-I452 WeakPolarHBondContact O-CA 3.41Å; A401-I452 CarbonylContact C-O 3.39Å; A401-I452 WeakPolarHBondContact CA-O 3.32Å; L402-I452 HydrophobicContact CB-CB 4.45Å; L402-I452 HydrophobicContact CD1-CG2 4.08Å; L402-I452 PolarHBondContact N-O 3.08Å; W411-I452 HydrophobicContact CH2-CD1 3.9Å; W411-I452 HydrophobicContact CZ2-CD1 4.23Å; W411-I452 HydrophobicContact CZ3-CD1 4.31Å
453	M	87.8	Confident	73.3	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.049	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	141.4	172.5	-51.9	-45.9	-59.8	0	0	110.6	K341 A342 V396 F397 G399 P400 A401	K341-M453 PolarHBondContact O-N 2.88Å; A342-M453 HydrophobicContact CB-CB 3.93Å; A342-M453 HydrophobicContact CB-CG 3.94Å; V396-M453 HydrophobicContact CG1-CB 3.96Å; V396-M453 HydrophobicContact CG1-CG 4.3Å; V396-M453 WeakPolarHBondContact O-CE 3.45Å; F397-M453 HydrophobicContact CD1-CG 3.72Å; F397-M453 HydrophobicContact CD1-SD 4.13Å; F397-M453 HydrophobicContact CE1-CG 4.18Å; F397-M453 WeakPolarHBondContact O-CE 3.27Å; G399-M453 WeakPolarHBondContact O-CE 3.23Å; P400-M453 WeakPolarHBondContact O-CE 3.4Å; A401-M453 HydrophobicContact CB-CE 4.06Å; A401-M453 HydrophobicContact CB-SD 4.26Å
454	E	86	Confident	75.7	Confident	67 Å²	67	56.3 Å²	56.3	31%	0.313	26%	0.262	S	S	.	.	S	Bend	trans	-70	-34.5	177.8	173.6	-176.6	-144.9	0	0	112.4	P400 L402 S413 R1020	P400-E454 HydrophobicContact CB-CB 4.49Å; P400-E454 WeakPolarHBondContact CB-OE2 2.99Å; P400-E454 PolarHBondContact O-N 3.06Å; L402-E454 HydrophobicContact CD2-CB 4.02Å; L402-E454 HydrophobicContact CD2-CG 4.22Å; L402-E454 HydrophobicContact CG-CB 4.06Å; S413-E454 VanDerWaalsContact CB-OE1 3.24Å; S413-E454 WeakPolarHBondContact CB-OE1 3.45Å; S413-E454 WeakPolarHBondContact CB-OE2 3.12Å; S413-E454 PolarHBondContact OG-OE1 3.05Å; S413-E454 PolarHBondContact OG-OE2 3.29Å; E454-R1020 PolarHBondContact O-NH1 2.88Å; E454-R1020 PolarHBondContact O-NH2 2.93Å
455	K	90	Very high	78	Confident	103 Å²	103	53.4 Å²	53.4	45%	0.448	25%	0.247	S	C	.	.	S	Bend	trans	-81.6	137.6	176	-66.5	-169.7	176.8	-174.7	0	109.6	V396	V396-K455 HydrophobicContact CB-CB 4.49Å; V396-K455 HydrophobicContact CG1-CB 4.14Å; V396-K455 WeakPolarHBondContact CG1-O 3.45Å; V396-K455 HydrophobicContact CG2-CB 3.95Å
456	A	92.6	Very high	80.2	Confident	19 Å²	19	46.6 Å²	46.6	16%	0.157	22%	0.221	C	C	.	.			trans	-90.4	149.3	168.1	0	0	0	0	0	108.9	R343 V345	R343-A456 HydrophobicContact CB-CB 4.03Å; R343-A456 HydrophobicContact CG-CB 4.49Å; R343-A456 CarbonylContact O-C 3.48Å; R343-A456 WeakPolarHBondContact O-CA 3.32Å; V345-A456 HydrophobicContact CG2-CB 3.83Å
457	V	96.2	Very high	82.4	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.012	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-80.9	115.2	170	-175.4	0	0	0	0	107.6	V317 A342 R343 L344 V345 Y388 I393 V396	V317-V457 HydrophobicContact CG1-CG2 3.94Å; A342-V457 HydrophobicContact CB-CG2 4.31Å; R343-V457 PolarHBondContact O-N 2.9Å; L344-V457 HydrophobicContact CD1-CB 3.83Å; L344-V457 HydrophobicContact CD1-CG1 3.81Å; V345-V457 PolarHBondContact N-O 3.19Å; Y388-V457 HydrophobicContact CD1-CG1 3.69Å; Y388-V457 HydrophobicContact CE1-CG1 4.36Å; Y388-V457 HydrophobicContact CG-CG1 4.37Å; I393-V457 HydrophobicContact CG1-CB 4.47Å; I393-V457 HydrophobicContact CG1-CG1 3.59Å; I393-V457 HydrophobicContact CG1-CG2 4.08Å; V396-V457 HydrophobicContact CB-CG2 4.06Å; V396-V457 HydrophobicContact CG1-CG2 4.08Å; V396-V457 HydrophobicContact CG2-CG2 4Å
458	L	94.9	Very high	84.4	Confident	68 Å²	68	44 Å²	44	36%	0.356	22%	0.215	S	C	.	.			trans	-91.8	153.4	175.5	-62.4	-179	0	0	0	110.2	V345 Y388	V345-L458 HydrophobicContact CB-CD2 4.09Å; V345-L458 HydrophobicContact CG1-CD2 4.2Å; V345-L458 HydrophobicContact CG2-CD2 4.44Å; Y388-L458 VanDerWaalsContact CD1-O 3.3Å; Y388-L458 WeakPolarHBondContact CD1-O 3.44Å
459	P	94.3	Very high	85.9	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.013	23%	0.231	C	C	.	.			trans	-70.2	155.1	175.6	32	-34.1	0	0	0	110.5	V345 C386 H387 Y388 L461 N462 R463	V345-P459 WeakPolarHBondContact O-CD 3.36Å; C386-P459 HydrophobicContact CB-CB 3.97Å; H387-P459 CarbonylContact O-C 3.46Å; H387-P459 VanDerWaalsContact O-CA 3.23Å; H387-P459 WeakPolarHBondContact O-CA 3.32Å; Y388-P459 HydrophobicContact CD1-CB 4.41Å; Y388-P459 HydrophobicContact CE1-CB 3.94Å; P459-L461 PolarHBondContact O-N 2.91Å; P459-L461 VanDerWaalsContact O-N 3.13Å; P459-N462 WeakPolarHBondContact O-CA 3.27Å; P459-N462 PolarHBondContact O-N 3.21Å; P459-R463 WeakPolarHBondContact CG-O 3.24Å
460	L	91.6	Very high	86.9	Confident	80 Å²	80	49.8 Å²	49.8	42%	0.419	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-37.5	-172.6	-161.7	83.2	0	0	0	113.6	H387 K389 N462	H387-L460 PolarHBondContact O-N 3.38Å; K389-L460 HydrophobicContact CB-CD1 3.99Å; K389-L460 HydrophobicContact CD-CD1 4.37Å; L460-N462 VanDerWaalsContact C-N 3.34Å
461	L	88.3	Confident	88.1	Confident	55 Å²	55	49.2 Å²	49.2	29%	0.288	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	4.6	178.4	-60.9	177.6	0	0	0	113.7	P459 R463 L465	P459-L461 PolarHBondContact O-N 2.91Å; P459-L461 VanDerWaalsContact O-N 3.13Å; L461-R463 HydrophobicContact CB-CG 4.03Å; L461-R463 PolarHBondContact O-N 3.41Å; L461-L465 HydrophobicContact CD1-CD2 3.75Å; L461-L465 HydrophobicContact CD1-CG 4.48Å
462	N	90.1	Very high	89.1	Confident	92 Å²	92	50.5 Å²	50.5	49%	0.492	26%	0.256	S	S	.	.	S	Bend	trans	54.5	6.2	-165	-64.7	-51.7	0	0	0	115.6	I347 P459 L460	I347-N462 WeakPolarHBondContact CG2-O 3.36Å; P459-N462 WeakPolarHBondContact O-CA 3.27Å; P459-N462 PolarHBondContact O-N 3.21Å; L460-N462 VanDerWaalsContact C-N 3.34Å
463	R	90.8	Very high	89.7	Confident	56 Å²	56	50.2 Å²	50.2	21%	0.211	25%	0.254	C	S	.	.	S	Bend	trans	-137.7	170.8	174.2	67.2	-178.3	-165.7	166	10.1	111.3	I347 P459 L461 E1013	I347-R463 CarbonylContact O-C 3.53Å; I347-R463 VanDerWaalsContact O-C 3.28Å; I347-R463 VanDerWaalsContact O-CA 3.26Å; I347-R463 WeakPolarHBondContact O-CA 3.31Å; P459-R463 WeakPolarHBondContact CG-O 3.24Å; L461-R463 HydrophobicContact CB-CG 4.03Å; L461-R463 PolarHBondContact O-N 3.41Å; R463-E1013 IonicContact NH1-OE2 2.69Å; R463-E1013 PolarHBondContact NH1-OE2 3.41Å
464	S	92.8	Very high	90	Very high	7 Å²	7	50 Å²	50	5%	0.049	25%	0.254	C	S	.	.			trans	-61.1	141.9	167.8	45.7	0	0	0	0	110.5	I347 T348 I385 D467	I347-S464 PolarHBondContact O-N 3.35Å; T348-S464 WeakPolarHBondContact CA-OG 3.37Å; I385-S464 CarbonylContact O-C 3.48Å; I385-S464 WeakPolarHBondContact O-CA 3.43Å; S464-D467 PolarHBondContact OG-OD1 2.93Å
465	L	92.7	Very high	90.4	Very high	9 Å²	9	47 Å²	47	5%	0.047	24%	0.24	C	C	.	.	S	Bend	trans	-66.7	-30	166.4	-87.8	172	0	0	0	111.8	Y370 I385 H387 L461 L513	Y370-L465 HydrophobicContact CD1-CD1 4.07Å; Y370-L465 HydrophobicContact CE1-CD1 3.83Å; I385-L465 HydrophobicContact CG2-CB 4.38Å; I385-L465 HydrophobicContact CG2-CD1 4.3Å; I385-L465 PolarHBondContact O-N 3.27Å; H387-L465 HydrophobicContact CB-CD1 3.94Å; L461-L465 HydrophobicContact CD1-CD2 3.75Å; L461-L465 HydrophobicContact CD1-CG 4.48Å; L465-L513 HydrophobicContact CB-CD1 3.92Å; L465-L513 HydrophobicContact CB-CG 3.98Å; L465-L513 HydrophobicContact CD1-CD1 4.48Å; L465-L513 HydrophobicContact CD1-CD2 4.26Å; L465-L513 HydrophobicContact CD2-CD2 4.42Å
466	R	92.8	Very high	90.7	Very high	75 Å²	75	42.1 Å²	42.1	28%	0.283	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	142.4	178.7	-175.8	179.6	-175.5	103.4	9.3	109.7	A384 I385 Y504 L513	A384-R466 CarbonylContact C-O 3.54Å; A384-R466 WeakPolarHBondContact CA-O 3.42Å; I385-R466 HydrophobicContact CD1-CB 4.38Å; I385-R466 PolarHBondContact N-O 2.82Å; R466-Y504 PolarHBondContact NE-OH 2.83Å; R466-L513 HydrophobicContact CB-CB 4.44Å; R466-L513 HydrophobicContact CB-CD1 3.87Å; R466-L513 HydrophobicContact CB-CG 4.41Å; R466-L513 PolarHBondContact NH1-O 3.33Å
467	D	90.5	Very high	90.9	Very high	68 Å²	68	41.4 Å²	41.4	36%	0.364	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	159.1	168.4	51.7	-81.7	0	0	0	112.2	T348 F354 S383 A384 S464	T348-D467 HydrophobicContact CG2-CB 3.65Å; T348-D467 WeakPolarHBondContact CG2-OD1 3.44Å; F354-D467 HydrophobicContact CZ-CB 4.49Å; S383-D467 CarbonylContact O-C 3.48Å; S383-D467 VanDerWaalsContact O-CA 3.28Å; S383-D467 WeakPolarHBondContact O-CA 3.3Å; A384-D467 HydrophobicContact CB-CB 4.05Å; S464-D467 PolarHBondContact OG-OD1 2.93Å
468	V	90	Very high	90.9	Very high	20 Å²	20	41.5 Å²	41.5	12%	0.121	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	138	-174.7	-70.8	0	0	0	0	111.1	G382 S383 D471 Y473	G382-V468 CarbonylContact C-O 3.59Å; G382-V468 WeakPolarHBondContact CA-O 3.33Å; S383-V468 PolarHBondContact N-O 2.04Å; S383-V468 WeakPolarHBondContact O-CG2 3.35Å; S383-V468 PolarHBondContact O-N 2.99Å; V468-D471 HydrophobicContact CB-CB 4.5Å; V468-D471 HydrophobicContact CG2-CB 3.83Å; V468-Y473 WeakPolarHBondContact CG1-OH 3.39Å; V468-Y473 HydrophobicContact CG2-CE1 4.31Å; V468-Y473 HydrophobicContact CG2-CE2 3.79Å; V468-Y473 WeakPolarHBondContact CG2-OH 3.37Å
469	Q	79.7	Confident	90.9	Very high	147 Å²	147	38.9 Å²	38.9	69%	0.687	20%	0.199	S	C	*	.	S	Bend	trans	-91.6	2.6	-174.4	-62.1	-177.3	-6.6	0	0	115.4	M381	M381-Q469 CarbonylContact O-C 3.6Å
470	S	76.7	Confident	90.8	Very high	87 Å²	87	40.2 Å²	40.2	61%	0.608	21%	0.209	S	C	*	.	S	Bend	trans	-129.4	-38.2	-176.9	49.9	0	0	0	0	113.1
471	D	82.3	Confident	90.7	Very high	28 Å²	28	36.9 Å²	36.9	15%	0.15	19%	0.192	C	C	.	.			trans	-85.9	141.4	-166.3	-39.8	-24	0	0	0	110.2	G382 S383 V468 Y473 E496 K502	G382-D471 CarbonylContact C-O 3.16Å; S383-D471 WeakPolarHBondContact CB-O 3.34Å; S383-D471 PolarHBondContact N-O 2.95Å; S383-D471 PolarHBondContact OG-O 2.8Å; V468-D471 HydrophobicContact CB-CB 4.5Å; V468-D471 HydrophobicContact CG2-CB 3.83Å; D471-Y473 HydrophobicContact CB-CD1 4.29Å; D471-Y473 HydrophobicContact CB-CE1 3.74Å; D471-E496 HydrophobicContact CB-CG 4.16Å; D471-K502 IonicContact OD2-NZ 2.78Å; D471-K502 PolarHBondContact OD2-NZ 2.83Å
472	Q	89.4	Confident	90.7	Very high	59 Å²	59	39.6 Å²	39.6	28%	0.276	20%	0.203	S	C	.	.			trans	-107.9	97.7	175.8	-69.1	-175.6	6.4	0	0	109.7	M381 S383 E496 A497	M381-Q472 VanDerWaalsContact CE-NE2 3.32Å; S383-Q472 VanDerWaalsContact OG-CA 3.32Å; S383-Q472 WeakPolarHBondContact OG-CA 3.46Å; Q472-E496 CarbonylContact O-C 3.53Å; Q472-E496 VanDerWaalsContact O-CA 3.26Å; Q472-E496 WeakPolarHBondContact O-CA 3.24Å; Q472-A497 HydrophobicContact CB-CB 4.1Å; Q472-A497 PolarHBondContact O-N 2.97Å
473	Y	94.2	Very high	90.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	129.1	176.6	-59.7	-25.5	0	0	0	110.4	V372 S383 I385 V468 D471 V494 L495 E496 Y504	V372-Y473 HydrophobicContact CG1-CD2 4.14Å; V372-Y473 HydrophobicContact CG1-CG 4.38Å; S383-Y473 PolarHBondContact OG-N 3.44Å; I385-Y473 HydrophobicContact CD1-CD2 4.4Å; I385-Y473 HydrophobicContact CD1-CE2 4.03Å; I385-Y473 HydrophobicContact CG1-CD2 4.1Å; I385-Y473 HydrophobicContact CG1-CE2 4.09Å; V468-Y473 WeakPolarHBondContact CG1-OH 3.39Å; V468-Y473 HydrophobicContact CG2-CE1 4.31Å; V468-Y473 HydrophobicContact CG2-CE2 3.79Å; V468-Y473 WeakPolarHBondContact CG2-OH 3.37Å; D471-Y473 HydrophobicContact CB-CD1 4.29Å; D471-Y473 HydrophobicContact CB-CE1 3.74Å; Y473-V494 HydrophobicContact CD1-CG1 3.55Å; Y473-V494 HydrophobicContact CD2-CG1 3.72Å; Y473-V494 HydrophobicContact CE1-CG1 4Å; Y473-V494 HydrophobicContact CE2-CG1 4.13Å; Y473-V494 HydrophobicContact CG-CG1 3.43Å; Y473-V494 VanDerWaalsContact CG-CG1 3.43Å; Y473-L495 WeakPolarHBondContact CA-O 3.23Å; Y473-E496 HydrophobicContact CD1-CG 3.68Å; Y473-E496 HydrophobicContact CE1-CG 3.79Å; Y473-Y504 PolarHBondContact OH-OH 2.82Å
474	V	93.1	Very high	89.6	Confident	7 Å²	7	37.8 Å²	37.8	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	-27.9	-174.4	-62.8	0	0	0	0	113.7	S359 L495 A497 T1096	S359-V474 WeakPolarHBondContact CB-O 3.46Å; V474-L495 HydrophobicContact CG2-CB 4.3Å; V474-L495 HydrophobicContact CG2-CD2 4.04Å; V474-L495 HydrophobicContact CG2-CG 3.91Å; V474-L495 WeakPolarHBondContact CG2-O 3.47Å; V474-L495 PolarHBondContact N-O 2.91Å; V474-A497 HydrophobicContact CG1-CB 3.88Å; V474-T1096 HydrophobicContact CG1-CG2 3.9Å
475	K	95.3	Very high	88.7	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.9	176.7	-70.2	-78.4	171.8	156.2	0	111.5	V494 L495 N532 M533 P1097 T1099	K475-V494 WeakPolarHBondContact O-CA 3.24Å; K475-L495 HydrophobicContact CB-CB 3.96Å; K475-L495 HydrophobicContact CB-CD2 4.24Å; K475-L495 HydrophobicContact CG-CD2 4.34Å; K475-L495 PolarHBondContact O-N 3.28Å; K475-N532 PolarHBondContact NZ-OD1 3.33Å; K475-M533 HydrophobicContact CB-CB 4.31Å; K475-M533 HydrophobicContact CB-CE 3.99Å; K475-P1097 WeakPolarHBondContact CE-O 3.5Å; K475-P1097 PolarHBondContact NZ-O 2.86Å; K475-T1099 PolarHBondContact NZ-O 2.94Å
476	I	97	Very high	88	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.8	169.7	-172	163.8	0	0	0	110.1	S359 D361 V372 I385 V478 L492 F493 V494	S359-I476 PolarHBondContact OG-N 3.38Å; D361-I476 HydrophobicContact CB-CG2 4.42Å; V372-I476 HydrophobicContact CG1-CB 4.09Å; V372-I476 HydrophobicContact CG1-CD1 4.24Å; V372-I476 HydrophobicContact CG1-CG2 4.5Å; V372-I476 HydrophobicContact CG2-CB 4.25Å; V372-I476 HydrophobicContact CG2-CG2 4.1Å; I385-I476 HydrophobicContact CG2-CD1 4.4Å; I476-V478 HydrophobicContact CD1-CG2 4.21Å; I476-V478 HydrophobicContact CG1-CG2 4.01Å; I476-L492 HydrophobicContact CD1-CD2 4.21Å; I476-F493 CarbonylContact C-O 3.4Å; I476-F493 VanDerWaalsContact CA-O 3.32Å; I476-F493 WeakPolarHBondContact CA-O 3.43Å; I476-V494 HydrophobicContact CD1-CG2 4.12Å; I476-V494 HydrophobicContact CG1-CG2 4.17Å
477	A	96.8	Very high	87.6	Confident	3 Å²	3	46.5 Å²	46.5	3%	0.025	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	144.6	166.2	0	0	0	0	0	108.6	D361 F493 M533 L535 L542	D361-A477 VanDerWaalsContact OD2-CA 3.26Å; D361-A477 WeakPolarHBondContact OD2-CA 3.32Å; A477-F493 PolarHBondContact N-O 3.24Å; A477-F493 PolarHBondContact O-N 2.86Å; A477-M533 HydrophobicContact CB-CE 3.91Å; A477-L535 HydrophobicContact CB-CB 4.11Å; A477-L542 HydrophobicContact CB-CD2 4.29Å
478	V	96	Very high	87.5	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.024	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.4	-171.4	-172.3	0	0	0	0	109.9	D361 V363 Y370 I476 V491 L492 L535	D361-V478 HydrophobicContact CB-CG2 4.21Å; D361-V478 PolarHBondContact OD2-N 3.43Å; V363-V478 HydrophobicContact CG2-CB 4.09Å; V363-V478 HydrophobicContact CG2-CG1 3.83Å; Y370-V478 HydrophobicContact CD2-CB 4.4Å; Y370-V478 HydrophobicContact CD2-CG1 4.11Å; Y370-V478 HydrophobicContact CD2-CG2 3.97Å; Y370-V478 HydrophobicContact CE2-CG1 4.13Å; Y370-V478 HydrophobicContact CG-CG2 3.91Å; I476-V478 HydrophobicContact CD1-CG2 4.21Å; I476-V478 HydrophobicContact CG1-CG2 4.01Å; V478-V491 WeakPolarHBondContact CA-O 3.33Å; V478-L492 HydrophobicContact CG1-CD1 4.15Å; V478-L492 HydrophobicContact CG1-CG 4.22Å; V478-L492 HydrophobicContact CG2-CB 4.44Å; V478-L492 HydrophobicContact CG2-CG 3.94Å; V478-L535 VanDerWaalsContact O-CD2 3.32Å; V478-L535 WeakPolarHBondContact O-CD2 3.4Å
479	D	94.8	Very high	87.6	Confident	13 Å²	13	43.8 Å²	43.8	7%	0.07	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	153.8	173.8	-161.5	21.3	0	0	0	111.2	Y490 V491 F493 L535 Y574	D479-Y490 CarbonylContact O-C 3.52Å; D479-Y490 WeakPolarHBondContact O-CA 3.06Å; D479-V491 PolarHBondContact N-O 2.73Å; D479-V491 PolarHBondContact O-N 2.84Å; D479-F493 HydrophobicContact CB-CE2 4.5Å; D479-L535 HydrophobicContact CB-CD2 3.7Å; D479-Y574 WeakPolarHBondContact CB-OH 3.05Å; D479-Y574 WeakPolarHBondContact OD2-CE1 3.18Å; D479-Y574 PolarHBondContact OD2-OH 3.36Å
480	S	91.7	Very high	88.2	Confident	31 Å²	31	37.3 Å²	37.3	22%	0.217	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	111.6	-179.6	53.3	0	0	0	0	108.5	K537	S480-K537 PolarHBondContact OG-NZ 3.28Å
481	V	90.2	Very high	89.1	Confident	9 Å²	9	33.2 Å²	33.2	6%	0.055	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120	-169.5	-171	0	0	0	0	110	V483 A489 V491 P573 Y574	V481-V483 PolarHBondContact O-N 3.08Å; V481-A489 PolarHBondContact N-O 2.75Å; V481-A489 PolarHBondContact O-N 3.22Å; V481-V491 HydrophobicContact CG2-CG2 3.83Å; V481-P573 HydrophobicContact CB-CB 4.11Å; V481-P573 HydrophobicContact CG1-CB 3.97Å; V481-P573 HydrophobicContact CG2-CB 4.47Å; V481-Y574 HydrophobicContact CB-CE1 4.49Å; V481-Y574 HydrophobicContact CG1-CD1 4.11Å; V481-Y574 HydrophobicContact CG1-CE1 4.3Å; V481-Y574 HydrophobicContact CG2-CD1 3.95Å; V481-Y574 HydrophobicContact CG2-CE1 3.35Å
482	E	87	Confident	89.9	Confident	112 Å²	112	31.9 Å²	31.9	52%	0.523	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	122.5	174.5	-66.8	-53.8	125	0	0	111.3	T488	E482-T488 WeakPolarHBondContact OE1-CB 3.43Å; E482-T488 WeakPolarHBondContact OE1-CG2 3.4Å; E482-T488 PolarHBondContact OE1-OG1 3.32Å
483	V	83.6	Confident	90.3	Very high	10 Å²	10	29.1 Å²	29.1	6%	0.061	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.5	-175.9	177.9	0	0	0	0	109.9	V481 N485 V486 G487 A489 P573 I601	V481-V483 PolarHBondContact O-N 3.08Å; V483-N485 PolarHBondContact O-N 2.96Å; V483-V486 HydrophobicContact CB-CB 4.1Å; V483-V486 HydrophobicContact CG1-CB 3.8Å; V483-V486 HydrophobicContact CG1-CG2 3.9Å; V483-V486 PolarHBondContact O-N 3.44Å; V483-G487 WeakPolarHBondContact CB-O 3.36Å; V483-G487 PolarHBondContact N-O 2.87Å; V483-G487 PolarHBondContact O-N 3.46Å; V483-A489 HydrophobicContact CG2-CB 3.76Å; V483-P573 HydrophobicContact CG2-CB 4.07Å; V483-I601 HydrophobicContact CB-CD1 4.23Å; V483-I601 HydrophobicContact CG1-CD1 3.5Å; V483-I601 VanDerWaalsContact CG1-CD1 3.5Å; V483-I601 HydrophobicContact CG1-CG1 3.92Å; V483-I601 HydrophobicContact CG2-CD1 3.65Å
484	R	74.5	Confident	90.4	Very high	100 Å²	100	29.1 Å²	29.1	38%	0.377	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	127.2	177	-67.4	-178.4	177.2	-173.7	-4.8	110	V486 D592 D594	R484-V486 PolarHBondContact O-N 2.52Å; R484-V486 VanDerWaalsContact O-N 3.13Å; R484-D592 PolarHBondContact NH2-O 3.38Å; R484-D594 PolarHBondContact NH1-O 3.01Å; R484-D594 VanDerWaalsContact NH1-O 3.09Å
485	N	74.3	Confident	90.6	Very high	177 Å²	177	28.9 Å²	28.9	95%	0.947	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	8.4	177	-51.3	-17.7	0	0	0	116.5	V483	V483-N485 PolarHBondContact O-N 2.96Å
486	V	78.5	Confident	90.4	Very high	67 Å²	67	29.7 Å²	29.7	41%	0.406	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-27.4	175.6	-176.3	0	0	0	0	111.6	V483 R484 L507	V483-V486 HydrophobicContact CB-CB 4.1Å; V483-V486 HydrophobicContact CG1-CB 3.8Å; V483-V486 HydrophobicContact CG1-CG2 3.9Å; V483-V486 PolarHBondContact O-N 3.44Å; R484-V486 PolarHBondContact O-N 2.52Å; R484-V486 VanDerWaalsContact O-N 3.13Å; V486-L507 HydrophobicContact CG1-CD1 3.98Å; V486-L507 HydrophobicContact CG1-CD2 3.9Å
487	G	84.3	Confident	90	Very high	31 Å²	31	32.4 Å²	32.4	32%	0.32	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	88.7	-149.1	-175	0	0	0	0	0	112	V483 A489	V483-G487 WeakPolarHBondContact CB-O 3.36Å; V483-G487 PolarHBondContact N-O 2.87Å; V483-G487 PolarHBondContact O-N 3.46Å; G487-A489 PolarHBondContact O-N 2.9Å
488	T	88.3	Confident	89.6	Confident	31 Å²	31	35.2 Å²	35.2	19%	0.19	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	116.9	-175.2	-44.3	0	0	0	0	112	E482 Y490 P508	E482-T488 WeakPolarHBondContact OE1-CB 3.43Å; E482-T488 WeakPolarHBondContact OE1-CG2 3.4Å; E482-T488 PolarHBondContact OE1-OG1 3.32Å; T488-Y490 HydrophobicContact CG2-CE1 4.17Å; T488-P508 VanDerWaalsContact O-CD 3.27Å; T488-P508 WeakPolarHBondContact O-CD 3.05Å
489	A	90.9	Very high	89.3	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	137.1	167.9	0	0	0	0	0	110.5	V481 V483 G487 L507 P573	V481-A489 PolarHBondContact N-O 2.75Å; V481-A489 PolarHBondContact O-N 3.22Å; V483-A489 HydrophobicContact CG2-CB 3.76Å; G487-A489 PolarHBondContact O-N 2.9Å; A489-L507 HydrophobicContact CB-CD2 3.5Å; A489-P573 HydrophobicContact CB-CB 4.06Å; A489-P573 HydrophobicContact CB-CG 3.94Å
490	Y	94.1	Very high	89.2	Confident	11 Å²	11	36 Å²	36	4%	0.043	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	130.1	173.8	-48.1	-77	0	0	0	110.4	V363 E366 L368 Y370 D479 T488 S505 H506 P508	V363-Y490 HydrophobicContact CG1-CD1 4.38Å; V363-Y490 HydrophobicContact CG1-CE1 4.11Å; E366-Y490 HydrophobicContact CG-CE1 4.24Å; E366-Y490 WeakPolarHBondContact CG-OH 3.4Å; L368-Y490 HydrophobicContact CD1-CE1 4.36Å; L368-Y490 HydrophobicContact CD1-CE2 4.27Å; Y370-Y490 WeakPolarHBondContact OH-CD2 3.46Å; D479-Y490 CarbonylContact O-C 3.52Å; D479-Y490 WeakPolarHBondContact O-CA 3.06Å; T488-Y490 HydrophobicContact CG2-CE1 4.17Å; Y490-S505 CarbonylContact O-C 3.58Å; Y490-S505 WeakPolarHBondContact O-CA 3.09Å; Y490-H506 AromaticContact CD2-ND1 3.62Å; Y490-H506 PolarHBondContact N-O 3.04Å; Y490-H506 PolarHBondContact O-N 3.36Å; Y490-P508 HydrophobicContact CE2-CG 3.96Å
491	V	95.5	Very high	89.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	112.1	174.4	-175.1	0	0	0	0	109.8	V478 D479 V481 F493 K503 Y504 P573 Y574	V478-V491 WeakPolarHBondContact CA-O 3.33Å; D479-V491 PolarHBondContact N-O 2.73Å; D479-V491 PolarHBondContact O-N 2.84Å; V481-V491 HydrophobicContact CG2-CG2 3.83Å; V491-F493 HydrophobicContact CB-CE2 4.37Å; V491-F493 HydrophobicContact CG1-CD2 4.49Å; V491-F493 HydrophobicContact CG1-CE1 4.39Å; V491-F493 HydrophobicContact CG1-CE2 3.84Å; V491-F493 HydrophobicContact CG1-CZ 3.8Å; V491-K503 HydrophobicContact CG1-CD 4.45Å; V491-K503 HydrophobicContact CG1-CG 3.84Å; V491-Y504 CarbonylContact C-O 3.58Å; V491-Y504 VanDerWaalsContact CA-O 3.29Å; V491-Y504 WeakPolarHBondContact CA-O 3.09Å; V491-Y504 WeakPolarHBondContact CG1-O 3.46Å; V491-P573 HydrophobicContact CG2-CB 3.95Å; V491-P573 HydrophobicContact CG2-CG 3.78Å; V491-Y574 HydrophobicContact CB-CE2 4.07Å; V491-Y574 HydrophobicContact CG1-CE2 3.81Å; V491-Y574 HydrophobicContact CG2-CE2 3.97Å
492	L	97.5	Very high	89.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.3	-177.4	-65	64	0	0	0	109.5	Y370 I385 I476 V478 V494 K503 Y504 H506 L513	Y370-L492 HydrophobicContact CD1-CD2 3.7Å; Y370-L492 HydrophobicContact CD1-CG 4.19Å; Y370-L492 HydrophobicContact CE1-CD1 4.19Å; Y370-L492 HydrophobicContact CE1-CD2 3.98Å; Y370-L492 HydrophobicContact CE1-CG 4.35Å; I385-L492 HydrophobicContact CG2-CD2 4.23Å; I476-L492 HydrophobicContact CD1-CD2 4.21Å; V478-L492 HydrophobicContact CG1-CD1 4.15Å; V478-L492 HydrophobicContact CG1-CG 4.22Å; V478-L492 HydrophobicContact CG2-CB 4.44Å; V478-L492 HydrophobicContact CG2-CG 3.94Å; L492-V494 HydrophobicContact CB-CG2 4.47Å; L492-K503 CarbonylContact O-C 3.56Å; L492-K503 WeakPolarHBondContact O-CA 3.13Å; L492-Y504 PolarHBondContact N-O 2.7Å; L492-Y504 PolarHBondContact O-N 2.89Å; L492-H506 HydrophobicContact CD1-CB 3.83Å; L492-L513 HydrophobicContact CD1-CD2 4.41Å; L492-L513 HydrophobicContact CD2-CD1 3.91Å; L492-L513 HydrophobicContact CD2-CD2 3.9Å
493	F	98	Very high	90	Very high	1 Å²	1	30.1 Å²	30.1	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.9	171.8	-60.2	-85.8	0	0	0	108.7	I476 A477 D479 V491 L501 K503 M533 L542 L555 Y574	I476-F493 CarbonylContact C-O 3.4Å; I476-F493 VanDerWaalsContact CA-O 3.32Å; I476-F493 WeakPolarHBondContact CA-O 3.43Å; A477-F493 PolarHBondContact N-O 3.24Å; A477-F493 PolarHBondContact O-N 2.86Å; D479-F493 HydrophobicContact CB-CE2 4.5Å; V491-F493 HydrophobicContact CB-CE2 4.37Å; V491-F493 HydrophobicContact CG1-CD2 4.49Å; V491-F493 HydrophobicContact CG1-CE1 4.39Å; V491-F493 HydrophobicContact CG1-CE2 3.84Å; V491-F493 HydrophobicContact CG1-CZ 3.8Å; F493-L501 HydrophobicContact CB-CD1 4.27Å; F493-K503 HydrophobicContact CD1-CB 4.18Å; F493-K503 HydrophobicContact CD1-CG 4.02Å; F493-K503 HydrophobicContact CE1-CB 4.28Å; F493-K503 HydrophobicContact CE1-CD 3.85Å; F493-K503 HydrophobicContact CE1-CG 3.71Å; F493-K503 HydrophobicContact CZ-CG 4.41Å; F493-M533 HydrophobicContact CB-CE 4.26Å; F493-M533 HydrophobicContact CB-SD 4.3Å; F493-M533 WeakPolarHBondContact O-CE 3.27Å; F493-L542 HydrophobicContact CB-CD1 4.03Å; F493-L542 HydrophobicContact CD1-CD1 3.51Å; F493-L542 HydrophobicContact CD2-CD1 4.23Å; F493-L542 HydrophobicContact CD2-CD2 4.44Å; F493-L542 HydrophobicContact CE1-CD1 3.9Å; F493-L542 HydrophobicContact CG-CD1 3.67Å; F493-L542 HydrophobicContact CG-CD2 4.44Å; F493-L542 HydrophobicContact CZ-CD1 4.42Å; F493-L555 HydrophobicContact CE1-CD2 4.32Å; F493-L555 HydrophobicContact CE2-CD2 3.76Å; F493-L555 HydrophobicContact CZ-CB 4.09Å; F493-L555 HydrophobicContact CZ-CD2 3.56Å; F493-L555 HydrophobicContact CZ-CG 4.33Å; F493-Y574 AromaticContact CZ-CE2 3.92Å; F493-Y574 HydrophobicContact CZ-CE2 3.92Å
494	V	97.2	Very high	90.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	117.2	-171.8	-179	0	0	0	0	109.5	V372 I385 Y473 K475 I476 L492 K502 Y504	V372-V494 HydrophobicContact CG1-CG1 4.07Å; I385-V494 HydrophobicContact CD1-CG2 3.95Å; Y473-V494 HydrophobicContact CD1-CG1 3.55Å; Y473-V494 HydrophobicContact CD2-CG1 3.72Å; Y473-V494 HydrophobicContact CE1-CG1 4Å; Y473-V494 HydrophobicContact CE2-CG1 4.13Å; Y473-V494 HydrophobicContact CG-CG1 3.43Å; Y473-V494 VanDerWaalsContact CG-CG1 3.43Å; K475-V494 WeakPolarHBondContact O-CA 3.24Å; I476-V494 HydrophobicContact CD1-CG2 4.12Å; I476-V494 HydrophobicContact CG1-CG2 4.17Å; L492-V494 HydrophobicContact CB-CG2 4.47Å; V494-K502 PolarHBondContact N-O 3.34Å; V494-K502 PolarHBondContact O-N 3.19Å; V494-Y504 HydrophobicContact CB-CD2 4.47Å; V494-Y504 HydrophobicContact CB-CE2 4.12Å; V494-Y504 HydrophobicContact CG2-CD2 3.97Å; V494-Y504 HydrophobicContact CG2-CE2 4Å
495	L	96.4	Very high	91.5	Very high	3 Å²	3	25 Å²	25	2%	0.016	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.5	-179.3	179.8	63.3	0	0	0	110.8	Y473 V474 K475 L501 L521 I530 M533	Y473-L495 WeakPolarHBondContact CA-O 3.23Å; V474-L495 HydrophobicContact CG2-CB 4.3Å; V474-L495 HydrophobicContact CG2-CD2 4.04Å; V474-L495 HydrophobicContact CG2-CG 3.91Å; V474-L495 WeakPolarHBondContact CG2-O 3.47Å; V474-L495 PolarHBondContact N-O 2.91Å; K475-L495 HydrophobicContact CB-CB 3.96Å; K475-L495 HydrophobicContact CB-CD2 4.24Å; K475-L495 HydrophobicContact CG-CD2 4.34Å; K475-L495 PolarHBondContact O-N 3.28Å; L495-L501 HydrophobicContact CB-CD1 4.32Å; L495-L521 HydrophobicContact CD1-CD1 3.54Å; L495-I530 HydrophobicContact CD1-CD1 4.2Å; L495-I530 HydrophobicContact CD2-CB 4.37Å; L495-I530 HydrophobicContact CD2-CG2 3.82Å; L495-M533 HydrophobicContact CB-CE 4.41Å; L495-M533 HydrophobicContact CB-SD 4.4Å
496	E	92.4	Very high	92.5	Very high	19 Å²	19	16.9 Å²	16.9	9%	0.089	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	151.7	168.7	-71.6	172.1	-162.1	0	0	112.8	D471 Q472 Y473 S498 G499 T500 K502	D471-E496 HydrophobicContact CB-CG 4.16Å; Q472-E496 CarbonylContact O-C 3.53Å; Q472-E496 VanDerWaalsContact O-CA 3.26Å; Q472-E496 WeakPolarHBondContact O-CA 3.24Å; Y473-E496 HydrophobicContact CD1-CG 3.68Å; Y473-E496 HydrophobicContact CE1-CG 3.79Å; E496-S498 WeakPolarHBondContact CB-OG 3.49Å; E496-S498 PolarHBondContact O-N 2.91Å; E496-S498 VanDerWaalsContact O-N 3.11Å; E496-S498 PolarHBondContact OE2-OG 3.35Å; E496-G499 PolarHBondContact O-N 3.34Å; E496-T500 WeakPolarHBondContact CB-O 3.15Å; E496-T500 PolarHBondContact N-O 2.82Å; E496-K502 WeakPolarHBondContact OE1-CD 3.44Å; E496-K502 WeakPolarHBondContact OE1-CE 3.46Å; E496-K502 IonicContact OE1-NZ 3.92Å; E496-K502 PolarHBondContact OE1-NZ 3.18Å
497	A	88.8	Confident	93	Very high	58 Å²	58	14.1 Å²	14.1	48%	0.479	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-24.5	170.8	0	0	0	0	0	113.4	Q472 V474 G499	Q472-A497 HydrophobicContact CB-CB 4.1Å; Q472-A497 PolarHBondContact O-N 2.97Å; V474-A497 HydrophobicContact CG1-CB 3.88Å; A497-G499 PolarHBondContact O-N 3.16Å
498	S	86.6	Confident	92.8	Very high	62 Å²	62	16.5 Å²	16.5	43%	0.434	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.4	173.7	62.4	0	0	0	0	113.3	E496 T500 K522	E496-S498 WeakPolarHBondContact CB-OG 3.49Å; E496-S498 PolarHBondContact O-N 2.91Å; E496-S498 VanDerWaalsContact O-N 3.11Å; E496-S498 PolarHBondContact OE2-OG 3.35Å; S498-T500 WeakPolarHBondContact OG-CB 3.04Å; S498-T500 PolarHBondContact OG-N 2.65Å; S498-T500 PolarHBondContact OG-OG1 2.62Å; S498-T500 VanDerWaalsContact OG-OG1 3.12Å; S498-K522 WeakPolarHBondContact O-CE 3.42Å
499	G	89.9	Confident	92.2	Very high	4 Å²	4	24 Å²	24	4%	0.041	14%	0.139	C	C	.	.	S	Bend	trans	94.1	12.1	-166.9	0	0	0	0	0	114	E496 A497 L521	E496-G499 PolarHBondContact O-N 3.34Å; A497-G499 PolarHBondContact O-N 3.16Å; G499-L521 VanDerWaalsContact O-CB 3.27Å; G499-L521 WeakPolarHBondContact O-CB 3.33Å; G499-L521 WeakPolarHBondContact O-CG 3.4Å; G499-L521 PolarHBondContact O-N 2.65Å
500	T	92.8	Very high	91.3	Very high	30 Å²	30	26.1 Å²	26.1	18%	0.184	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	134	172.9	-52.9	0	0	0	0	110.4	E496 S498 V518	E496-T500 WeakPolarHBondContact CB-O 3.15Å; E496-T500 PolarHBondContact N-O 2.82Å; S498-T500 WeakPolarHBondContact OG-CB 3.04Å; S498-T500 PolarHBondContact OG-N 2.65Å; S498-T500 PolarHBondContact OG-OG1 2.62Å; S498-T500 VanDerWaalsContact OG-OG1 3.12Å; T500-V518 HydrophobicContact CG2-CG1 3.4Å; T500-V518 VanDerWaalsContact CG2-CG1 3.4Å
501	L	95.9	Very high	90.4	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.8	175.1	-179.6	75	0	0	0	109.9	F493 L495 V518 I519 L521 M533 L542 F544	F493-L501 HydrophobicContact CB-CD1 4.27Å; L495-L501 HydrophobicContact CB-CD1 4.32Å; L501-V518 CarbonylContact O-C 3.41Å; L501-I519 HydrophobicContact CB-CB 4.27Å; L501-I519 HydrophobicContact CD2-CD1 4.32Å; L501-I519 PolarHBondContact N-O 3.37Å; L501-I519 PolarHBondContact O-N 3.42Å; L501-L521 HydrophobicContact CB-CD1 4.05Å; L501-L521 HydrophobicContact CB-CD2 4.18Å; L501-L521 HydrophobicContact CB-CG 4.06Å; L501-L521 HydrophobicContact CD2-CD2 4.34Å; L501-M533 HydrophobicContact CD1-CE 4.37Å; L501-M533 HydrophobicContact CD1-SD 3.43Å; L501-M533 WeakPolarHBondContact CD1-SD 3.34Å; L501-L542 HydrophobicContact CD2-CD1 4Å; L501-F544 HydrophobicContact CD1-CE1 4.26Å; L501-F544 HydrophobicContact CD1-CZ 4.1Å; L501-F544 HydrophobicContact CD2-CE2 4.49Å; L501-F544 HydrophobicContact CD2-CZ 3.74Å; L501-F544 HydrophobicContact CG-CZ 4.49Å
502	K	95.1	Very high	89.7	Confident	27 Å²	27	37.8 Å²	37.8	12%	0.117	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.7	173.9	-66.2	-175.1	168.8	149.8	0	109.9	D471 V494 E496 Y504 L515 V518	D471-K502 IonicContact OD2-NZ 2.78Å; D471-K502 PolarHBondContact OD2-NZ 2.83Å; V494-K502 PolarHBondContact N-O 3.34Å; V494-K502 PolarHBondContact O-N 3.19Å; E496-K502 WeakPolarHBondContact OE1-CD 3.44Å; E496-K502 WeakPolarHBondContact OE1-CE 3.46Å; E496-K502 IonicContact OE1-NZ 3.92Å; E496-K502 PolarHBondContact OE1-NZ 3.18Å; K502-Y504 HydrophobicContact CB-CD2 4.43Å; K502-Y504 HydrophobicContact CB-CE2 3.61Å; K502-Y504 VanDerWaalsContact CD-OH 3.3Å; K502-Y504 WeakPolarHBondContact CD-OH 3.3Å; K502-L515 HydrophobicContact CB-CD1 4.13Å; K502-L515 HydrophobicContact CG-CD1 4.44Å; K502-V518 HydrophobicContact CG-CG1 4.41Å; K502-V518 HydrophobicContact CG-CG2 4.28Å
503	K	96.1	Very high	89.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	126.2	176.8	179.7	-173.7	170.8	-179.8	0	108.5	V491 L492 F493 L516 E517 L555 D572	V491-K503 HydrophobicContact CG1-CD 4.45Å; V491-K503 HydrophobicContact CG1-CG 3.84Å; L492-K503 CarbonylContact O-C 3.56Å; L492-K503 WeakPolarHBondContact O-CA 3.13Å; F493-K503 HydrophobicContact CD1-CB 4.18Å; F493-K503 HydrophobicContact CD1-CG 4.02Å; F493-K503 HydrophobicContact CE1-CB 4.28Å; F493-K503 HydrophobicContact CE1-CD 3.85Å; F493-K503 HydrophobicContact CE1-CG 3.71Å; F493-K503 HydrophobicContact CZ-CG 4.41Å; K503-L516 HydrophobicContact CB-CB 4.49Å; K503-L516 HydrophobicContact CD-CB 4.23Å; K503-L516 HydrophobicContact CD-CD1 4.33Å; K503-L516 HydrophobicContact CG-CB 4.16Å; K503-L516 HydrophobicContact CG-CD1 4.17Å; K503-L516 PolarHBondContact O-N 3.35Å; K503-E517 HydrophobicContact CB-CB 4.09Å; K503-E517 HydrophobicContact CD-CB 4.31Å; K503-E517 HydrophobicContact CD-CG 4.16Å; K503-E517 WeakPolarHBondContact CD-OE1 3.5Å; K503-E517 PolarHBondContact N-O 2.83Å; K503-E517 IonicContact NZ-OE1 3.72Å; K503-E517 PolarHBondContact NZ-OE1 2.88Å; K503-E517 PolarHBondContact O-N 3.4Å; K503-L555 PolarHBondContact NZ-O 3.44Å; K503-L555 VanDerWaalsContact NZ-O 3.16Å; K503-D572 WeakPolarHBondContact CE-OD1 3.31Å; K503-D572 IonicContact NZ-OD1 2.83Å; K503-D572 PolarHBondContact NZ-OD1 3.25Å; K503-D572 VanDerWaalsContact NZ-OD1 3.16Å; K503-D572 IonicContact NZ-OD2 2.85Å; K503-D572 PolarHBondContact NZ-OD2 2.6Å
504	Y	95.3	Very high	89.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	148.4	179.2	-59.2	-82.6	0	0	0	111.2	I385 R466 Y473 V491 L492 V494 K502 L513 C514 L515	I385-Y504 HydrophobicContact CD1-CE2 4.35Å; R466-Y504 PolarHBondContact NE-OH 2.83Å; Y473-Y504 PolarHBondContact OH-OH 2.82Å; V491-Y504 CarbonylContact C-O 3.58Å; V491-Y504 VanDerWaalsContact CA-O 3.29Å; V491-Y504 WeakPolarHBondContact CA-O 3.09Å; V491-Y504 WeakPolarHBondContact CG1-O 3.46Å; L492-Y504 PolarHBondContact N-O 2.7Å; L492-Y504 PolarHBondContact O-N 2.89Å; V494-Y504 HydrophobicContact CB-CD2 4.47Å; V494-Y504 HydrophobicContact CB-CE2 4.12Å; V494-Y504 HydrophobicContact CG2-CD2 3.97Å; V494-Y504 HydrophobicContact CG2-CE2 4Å; K502-Y504 HydrophobicContact CB-CD2 4.43Å; K502-Y504 HydrophobicContact CB-CE2 3.61Å; K502-Y504 VanDerWaalsContact CD-OH 3.3Å; K502-Y504 WeakPolarHBondContact CD-OH 3.3Å; Y504-L513 HydrophobicContact CD1-CB 4.11Å; Y504-L513 HydrophobicContact CG-CB 4.35Å; Y504-C514 CarbonylContact C-O 3.59Å; Y504-C514 WeakPolarHBondContact CA-O 3.02Å; Y504-L515 HydrophobicContact CD1-CB 4Å; Y504-L515 HydrophobicContact CD1-CD1 3.97Å; Y504-L515 HydrophobicContact CE1-CB 3.81Å; Y504-L515 HydrophobicContact CE1-CD1 3.5Å; Y504-L515 HydrophobicContact CE1-CG 4.19Å
505	S	94.3	Very high	88.9	Confident	2 Å²	2	40 Å²	40	1%	0.014	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	153.1	158	45.8	0	0	0	0	111	Y490 C514 L516	Y490-S505 CarbonylContact O-C 3.58Å; Y490-S505 WeakPolarHBondContact O-CA 3.09Å; S505-C514 PolarHBondContact N-O 3.34Å; S505-C514 PolarHBondContact O-N 2.74Å; S505-C514 WeakPolarHBondContact OG-CB 3.43Å; S505-L516 WeakPolarHBondContact OG-CD2 3.32Å
506	H	93.6	Very high	88.6	Confident	7 Å²	7	40.6 Å²	40.6	3%	0.032	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	117.4	173.2	178.7	-126.5	0	0	0	108	Y370 H387 Y490 L492 L513	Y370-H506 AromaticContact CE1-ND1 3.86Å; Y370-H506 AromaticContact CZ-ND1 3.81Å; Y370-H506 PolarHBondContact OH-CE1 2.95Å; Y370-H506 PolarHBondContact OH-ND1 3.38Å; H387-H506 AromaticContact CE1-CE1 3.46Å; H387-H506 PolarHBondContact CE1-CE1 3.46Å; H387-H506 VanDerWaalsContact CE1-CE1 3.46Å; H387-H506 AromaticContact CE1-NE2 3.74Å; H387-H506 AromaticContact ND1-CE1 3.58Å; Y490-H506 AromaticContact CD2-ND1 3.62Å; Y490-H506 PolarHBondContact N-O 3.04Å; Y490-H506 PolarHBondContact O-N 3.36Å; L492-H506 HydrophobicContact CD1-CB 3.83Å; H506-L513 HydrophobicContact CB-CD2 3.51Å
507	L	89.2	Confident	88.6	Confident	10 Å²	10	40 Å²	40	5%	0.052	21%	0.214	C	C	.	.			trans	-94.5	142.2	171.1	-62.1	-176.1	0	0	0	109.4	V486 A489 E509 E510 I601	V486-L507 HydrophobicContact CG1-CD1 3.98Å; V486-L507 HydrophobicContact CG1-CD2 3.9Å; A489-L507 HydrophobicContact CB-CD2 3.5Å; L507-E509 PolarHBondContact O-N 3.25Å; L507-E509 VanDerWaalsContact O-N 3.11Å; L507-E510 HydrophobicContact CB-CB 4.22Å; L507-E510 HydrophobicContact CB-CG 4Å; L507-E510 HydrophobicContact CD1-CG 4.45Å; L507-E510 PolarHBondContact O-N 3.45Å; L507-I601 HydrophobicContact CD1-CG2 4.08Å; L507-I601 WeakPolarHBondContact CD1-O 3.45Å; L507-I601 HydrophobicContact CD2-CG2 4.26Å; L507-I601 HydrophobicContact CG-CG2 4.48Å
508	P	81.3	Confident	88.8	Confident	81 Å²	81	38 Å²	38	53%	0.526	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.6	-179.3	-23.9	30.7	0	0	0	115.2	T488 Y490	T488-P508 VanDerWaalsContact O-CD 3.27Å; T488-P508 WeakPolarHBondContact O-CD 3.05Å; Y490-P508 HydrophobicContact CE2-CG 3.96Å
509	E	76	Confident	89.1	Confident	189 Å²	189	35.1 Å²	35.1	88%	0.883	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-17.6	178.7	-57.8	-170.9	164.2	0	0	113.1	L507	L507-E509 PolarHBondContact O-N 3.25Å; L507-E509 VanDerWaalsContact O-N 3.11Å
510	E	72.1	Confident	89.3	Confident	43 Å²	43	38 Å²	38	20%	0.201	19%	0.187	C	C	.	.			trans	-93	134.2	-177.9	-68.6	-179.7	176.9	0	0	111.1	L507 E512 G603	L507-E510 HydrophobicContact CB-CB 4.22Å; L507-E510 HydrophobicContact CB-CG 4Å; L507-E510 HydrophobicContact CD1-CG 4.45Å; L507-E510 PolarHBondContact O-N 3.45Å; E510-E512 VanDerWaalsContact C-N 3.26Å; E510-E512 PolarHBondContact O-N 2.85Å; E510-G603 WeakPolarHBondContact OE1-CA 3.45Å; E510-G603 PolarHBondContact OE1-N 3.44Å
511	K	74.5	Confident	89.3	Confident	142 Å²	142	36.5 Å²	36.5	62%	0.617	18%	0.178	S	C	*	.	S	Bend	trans	-84.8	9.1	-178.9	-64.4	-177.8	179.4	177.6	0	114.1
512	E	81	Confident	89.1	Confident	114 Å²	114	38.5 Å²	38.5	53%	0.533	19%	0.187	S	C	.	.	S	Bend	trans	-142.5	167	-167.9	-68.3	-174	-161.9	0	0	113.2	E510	E510-E512 VanDerWaalsContact C-N 3.26Å; E510-E512 PolarHBondContact O-N 2.85Å
513	L	91.8	Very high	88.7	Confident	9 Å²	9	40.8 Å²	40.8	5%	0.047	20%	0.197	C	C	.	.			trans	-108	111.8	178.3	-64.7	-177.9	0	0	0	112.8	I385 L465 R466 L492 Y504 H506	I385-L513 HydrophobicContact CB-CD1 4.16Å; I385-L513 HydrophobicContact CD1-CD1 3.65Å; I385-L513 HydrophobicContact CG2-CD1 3.98Å; L465-L513 HydrophobicContact CB-CD1 3.92Å; L465-L513 HydrophobicContact CB-CG 3.98Å; L465-L513 HydrophobicContact CD1-CD1 4.48Å; L465-L513 HydrophobicContact CD1-CD2 4.26Å; L465-L513 HydrophobicContact CD2-CD2 4.42Å; R466-L513 HydrophobicContact CB-CB 4.44Å; R466-L513 HydrophobicContact CB-CD1 3.87Å; R466-L513 HydrophobicContact CB-CG 4.41Å; R466-L513 PolarHBondContact NH1-O 3.33Å; L492-L513 HydrophobicContact CD1-CD2 4.41Å; L492-L513 HydrophobicContact CD2-CD1 3.91Å; L492-L513 HydrophobicContact CD2-CD2 3.9Å; Y504-L513 HydrophobicContact CD1-CB 4.11Å; Y504-L513 HydrophobicContact CG-CB 4.35Å; H506-L513 HydrophobicContact CB-CD2 3.51Å
514	C	91.2	Very high	87.8	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.014	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	122	177.7	-62.1	0	0	0	0	111.8	Y504 S505 L516 C604	Y504-C514 CarbonylContact C-O 3.59Å; Y504-C514 WeakPolarHBondContact CA-O 3.02Å; S505-C514 PolarHBondContact N-O 3.34Å; S505-C514 PolarHBondContact O-N 2.74Å; S505-C514 WeakPolarHBondContact OG-CB 3.43Å; C514-L516 PolarHBondContact O-N 3.42Å; C514-C604 WeakPolarHBondContact CA-SG 3.49Å; C514-C604 HydrophobicContact CB-CB 3.63Å; C514-C604 WeakPolarHBondContact CB-SG 3.31Å; C514-C604 WeakPolarHBondContact SG-CA 3.17Å; C514-C604 WeakPolarHBondContact SG-CB 3.42Å; C514-C604 PolarHBondContact SG-N 3.41Å; C514-C604 CovalentContact SG-SG 2.04Å; C514-C604 PolarHBondContact SG-SG 3.03Å
515	L	91.8	Very high	87.1	Confident	38 Å²	38	55.6 Å²	55.6	20%	0.199	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.1	178.7	180	63.5	0	0	0	110.9	L69 K502 Y504 V518	L69-L515 HydrophobicContact CD1-CD2 3.8Å; L69-L515 HydrophobicContact CD1-CG 4.18Å; L69-L515 HydrophobicContact CD2-CG 4.48Å; L69-L515 HydrophobicContact CG-CD2 4.48Å; K502-L515 HydrophobicContact CB-CD1 4.13Å; K502-L515 HydrophobicContact CG-CD1 4.44Å; Y504-L515 HydrophobicContact CD1-CB 4Å; Y504-L515 HydrophobicContact CD1-CD1 3.97Å; Y504-L515 HydrophobicContact CE1-CB 3.81Å; Y504-L515 HydrophobicContact CE1-CD1 3.5Å; Y504-L515 HydrophobicContact CE1-CG 4.19Å; L515-V518 HydrophobicContact CD1-CG2 4.02Å; L515-V518 HydrophobicContact CD2-CG2 3.94Å; L515-V518 HydrophobicContact CG-CG2 4.34Å
516	L	91.7	Very high	86.4	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.073	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-43.9	-178.9	-60	-179.6	0	0	0	113.1	L69 K503 S505 C514 D572 P605	L69-L516 VanDerWaalsContact CD2-C 3.49Å; L69-L516 WeakPolarHBondContact CD2-O 3.37Å; K503-L516 HydrophobicContact CB-CB 4.49Å; K503-L516 HydrophobicContact CD-CB 4.23Å; K503-L516 HydrophobicContact CD-CD1 4.33Å; K503-L516 HydrophobicContact CG-CB 4.16Å; K503-L516 HydrophobicContact CG-CD1 4.17Å; K503-L516 PolarHBondContact O-N 3.35Å; S505-L516 WeakPolarHBondContact OG-CD2 3.32Å; C514-L516 PolarHBondContact O-N 3.42Å; L516-D572 HydrophobicContact CD1-CB 4.43Å; L516-P605 HydrophobicContact CD2-CG 3.62Å
517	E	91.4	Very high	85.9	Confident	8 Å²	8	64 Å²	64	4%	0.037	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	153	-176.1	-59.8	-178.8	-106.7	0	0	112.1	K503 I519 R557	K503-E517 HydrophobicContact CB-CB 4.09Å; K503-E517 HydrophobicContact CD-CB 4.31Å; K503-E517 HydrophobicContact CD-CG 4.16Å; K503-E517 WeakPolarHBondContact CD-OE1 3.5Å; K503-E517 PolarHBondContact N-O 2.83Å; K503-E517 IonicContact NZ-OE1 3.72Å; K503-E517 PolarHBondContact NZ-OE1 2.88Å; K503-E517 PolarHBondContact O-N 3.4Å; E517-I519 HydrophobicContact CB-CD1 4.34Å; E517-I519 HydrophobicContact CB-CG1 4.19Å; E517-R557 VanDerWaalsContact CD-NH2 3.34Å; E517-R557 IonicContact OE1-CZ 3.64Å; E517-R557 IonicContact OE1-NE 3.36Å; E517-R557 IonicContact OE1-NH2 2.95Å; E517-R557 PolarHBondContact OE1-NH2 3.47Å; E517-R557 IonicContact OE2-CZ 3.97Å; E517-R557 IonicContact OE2-NE 3.33Å; E517-R557 PolarHBondContact OE2-NE 3.42Å; E517-R557 IonicContact OE2-NH2 3.48Å; E517-R557 PolarHBondContact OE2-NH2 3Å
518	V	92.8	Very high	85.6	Confident	15 Å²	15	63.9 Å²	63.9	9%	0.091	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	114.6	171.3	-178.2	0	0	0	0	108.7	L69 R70 V71 T500 L501 K502 L515	L69-V518 HydrophobicContact CG-CG2 4.34Å; L69-V518 PolarHBondContact O-N 3.12Å; R70-V518 CarbonylContact C-O 3.55Å; R70-V518 VanDerWaalsContact CA-O 3.22Å; R70-V518 WeakPolarHBondContact CA-O 3.29Å; R70-V518 HydrophobicContact CG-CB 4.12Å; R70-V518 HydrophobicContact CG-CG1 4.31Å; V71-V518 PolarHBondContact N-O 3.02Å; T500-V518 HydrophobicContact CG2-CG1 3.4Å; T500-V518 VanDerWaalsContact CG2-CG1 3.4Å; L501-V518 CarbonylContact O-C 3.41Å; K502-V518 HydrophobicContact CG-CG1 4.41Å; K502-V518 HydrophobicContact CG-CG2 4.28Å; L515-V518 HydrophobicContact CD1-CG2 4.02Å; L515-V518 HydrophobicContact CD2-CG2 3.94Å; L515-V518 HydrophobicContact CG-CG2 4.34Å
519	I	93.7	Very high	86	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.2	-165.6	-55.4	170.3	0	0	0	110.1	V71 L76 L501 E517 L521	V71-I519 HydrophobicContact CB-CB 4.43Å; V71-I519 HydrophobicContact CB-CG1 4.07Å; V71-I519 HydrophobicContact CB-CG2 4.33Å; V71-I519 HydrophobicContact CG1-CG2 4.48Å; V71-I519 HydrophobicContact CG2-CG1 4.16Å; L76-I519 HydrophobicContact CD1-CG2 3.76Å; L76-I519 HydrophobicContact CD2-CG2 3.8Å; L76-I519 HydrophobicContact CG-CG2 4.25Å; L501-I519 HydrophobicContact CB-CB 4.27Å; L501-I519 HydrophobicContact CD2-CD1 4.32Å; L501-I519 PolarHBondContact N-O 3.37Å; L501-I519 PolarHBondContact O-N 3.42Å; E517-I519 HydrophobicContact CB-CD1 4.34Å; E517-I519 HydrophobicContact CB-CG1 4.19Å; I519-L521 HydrophobicContact CG2-CD2 4.22Å
520	E	92.9	Very high	86.7	Confident	64 Å²	64	56.1 Å²	56.1	30%	0.299	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	111.3	177.5	-68.1	167.9	-174.1	0	0	110.6	V71 S72 Y73 L76 K522	V71-E520 PolarHBondContact O-N 2.91Å; S72-E520 WeakPolarHBondContact CA-OE2 3.4Å; Y73-E520 WeakPolarHBondContact CA-O 3.48Å; Y73-E520 PolarHBondContact N-OE2 3.3Å; L76-E520 WeakPolarHBondContact CD2-O 3.1Å; E520-K522 VanDerWaalsContact C-N 3.31Å; E520-K522 PolarHBondContact O-N 2.99Å
521	L	93.9	Very high	87.6	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.268	C	S	.	.	S	Bend	trans	-84.1	-6	-177.8	-56.6	-179.2	0	0	0	114.1	Y73 L76 L495 G499 L501 I519 I530 F544 M546 I553	Y73-L521 VanDerWaalsContact CD2-C 3.42Å; Y73-L521 WeakPolarHBondContact CD2-O 3.46Å; Y73-L521 VanDerWaalsContact CE2-O 3.23Å; Y73-L521 WeakPolarHBondContact CE2-O 3.44Å; L76-L521 HydrophobicContact CD2-CD2 4.04Å; L495-L521 HydrophobicContact CD1-CD1 3.54Å; G499-L521 VanDerWaalsContact O-CB 3.27Å; G499-L521 WeakPolarHBondContact O-CB 3.33Å; G499-L521 WeakPolarHBondContact O-CG 3.4Å; G499-L521 PolarHBondContact O-N 2.65Å; L501-L521 HydrophobicContact CB-CD1 4.05Å; L501-L521 HydrophobicContact CB-CD2 4.18Å; L501-L521 HydrophobicContact CB-CG 4.06Å; L501-L521 HydrophobicContact CD2-CD2 4.34Å; I519-L521 HydrophobicContact CG2-CD2 4.22Å; L521-I530 HydrophobicContact CB-CD1 3.92Å; L521-I530 HydrophobicContact CD1-CD1 3.75Å; L521-I530 HydrophobicContact CG-CD1 4.5Å; L521-F544 HydrophobicContact CD1-CD1 3.67Å; L521-F544 HydrophobicContact CD1-CE1 3.42Å; L521-F544 VanDerWaalsContact CD1-CE1 3.42Å; L521-F544 HydrophobicContact CD1-CG 4.33Å; L521-F544 HydrophobicContact CD1-CZ 3.94Å; L521-F544 HydrophobicContact CD2-CE2 4.43Å; L521-F544 HydrophobicContact CD2-CZ 4.34Å; L521-M546 HydrophobicContact CB-CE 4.27Å; L521-I553 HydrophobicContact CD2-CD1 3.39Å
522	K	90.4	Very high	88.4	Confident	42 Å²	42	47.8 Å²	47.8	18%	0.183	24%	0.238	C	C	.	.	S	Bend	trans	-156.9	160.3	177.6	62.3	177.5	-173	162.9	0	109.7	S498 E520 D526 V528	S498-K522 WeakPolarHBondContact O-CE 3.42Å; E520-K522 VanDerWaalsContact C-N 3.31Å; E520-K522 PolarHBondContact O-N 2.99Å; K522-D526 HydrophobicContact CB-CB 4.01Å; K522-D526 WeakPolarHBondContact CD-O 3.13Å; K522-D526 PolarHBondContact NZ-O 3.41Å; K522-V528 HydrophobicContact CD-CB 4.38Å; K522-V528 WeakPolarHBondContact CD-O 3.29Å; K522-V528 PolarHBondContact NZ-O 2.86Å
523	K	87.3	Confident	89	Confident	76 Å²	76	42.5 Å²	42.5	33%	0.33	21%	0.214	S	C	.	.			trans	-71.1	153.8	169.6	-56.8	-160.3	179.1	-156.3	0	110	Y73 D74 S525 D526	Y73-K523 HydrophobicContact CD1-CD 4.26Å; Y73-K523 HydrophobicContact CD1-CG 3.56Å; Y73-K523 HydrophobicContact CE1-CG 4.11Å; Y73-K523 HydrophobicContact CG-CG 4.2Å; D74-K523 WeakPolarHBondContact OD1-CE 3.11Å; D74-K523 IonicContact OD1-NZ 2.99Å; D74-K523 PolarHBondContact OD1-NZ 3.04Å; D74-K523 IonicContact OD2-NZ 3.35Å; D74-K523 PolarHBondContact OD2-NZ 2.03Å; K523-S525 PolarHBondContact O-N 3.41Å; K523-D526 HydrophobicContact CB-CB 4.5Å; K523-D526 WeakPolarHBondContact O-CB 3.36Å; K523-D526 PolarHBondContact O-N 3.26Å
524	E	77.1	Confident	89	Confident	207 Å²	207	42.4 Å²	42.4	97%	0.967	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-30.3	177.4	-168.5	172.2	-165.7	0	0	112.4
525	S	80.2	Confident	89.1	Confident	103 Å²	103	43.5 Å²	43.5	72%	0.72	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-15.9	172.5	58.8	0	0	0	0	115.1	K523 N527	K523-S525 PolarHBondContact O-N 3.41Å; S525-N527 PolarHBondContact O-N 2.64Å
526	D	80.2	Confident	89.2	Confident	44 Å²	44	42 Å²	42	24%	0.235	21%	0.211	C	C	.	.			trans	-79.7	105	-177.4	-85.5	17.9	0	0	0	109.8	K522 K523 V528 R549	K522-D526 HydrophobicContact CB-CB 4.01Å; K522-D526 WeakPolarHBondContact CD-O 3.13Å; K522-D526 PolarHBondContact NZ-O 3.41Å; K523-D526 HydrophobicContact CB-CB 4.5Å; K523-D526 WeakPolarHBondContact O-CB 3.36Å; K523-D526 PolarHBondContact O-N 3.26Å; D526-V528 HydrophobicContact CB-CG2 4.12Å; D526-V528 PolarHBondContact O-N 3.4Å; D526-R549 IonicContact OD2-CZ 3.77Å; D526-R549 IonicContact OD2-NH1 3.7Å; D526-R549 IonicContact OD2-NH2 2.91Å; D526-R549 PolarHBondContact OD2-NH2 2.9Å
527	N	82.2	Confident	89	Confident	143 Å²	143	45 Å²	45	77%	0.765	22%	0.223	S	C	*	.			trans	-75.2	60.2	166.1	-166.5	13.1	0	0	0	111.4	S525	S525-N527 PolarHBondContact O-N 2.64Å
528	V	83.3	Confident	88.7	Confident	6 Å²	6	50 Å²	50	4%	0.036	25%	0.246	C	C	.	.			trans	-103.2	125.5	173.9	176	0	0	0	0	108.5	K522 D526 M546 D547	K522-V528 HydrophobicContact CD-CB 4.38Å; K522-V528 WeakPolarHBondContact CD-O 3.29Å; K522-V528 PolarHBondContact NZ-O 2.86Å; D526-V528 HydrophobicContact CB-CG2 4.12Å; D526-V528 PolarHBondContact O-N 3.4Å; V528-M546 HydrophobicContact CG1-CB 3.79Å; V528-M546 HydrophobicContact CG1-CG 4.42Å; V528-M546 HydrophobicContact CG1-SD 3.95Å; V528-D547 HydrophobicContact CG1-CB 4.34Å
529	R	89.4	Confident	88.4	Confident	89 Å²	89	51.9 Å²	51.9	34%	0.336	25%	0.253	S	S	.	.			trans	-83.8	140.1	170.3	-60.1	-176.9	-66.4	160.1	3.2	109.4	D90 E202 F531 M546 D547	D90-R529 IonicContact OD1-NH2 4Å; D90-R529 PolarHBondContact OD1-NH2 3.01Å; E202-R529 IonicContact OE1-NH1 2.89Å; E202-R529 IonicContact OE2-NH1 3.83Å; E202-R529 PolarHBondContact OE2-NH1 3.21Å; R529-F531 HydrophobicContact CB-CE1 4.3Å; R529-M546 CarbonylContact O-C 3.58Å; R529-M546 VanDerWaalsContact O-CA 3.24Å; R529-M546 WeakPolarHBondContact O-CA 3.33Å; R529-M546 WeakPolarHBondContact O-CB 3.31Å; R529-D547 HydrophobicContact CB-CB 4.25Å; R529-D547 IonicContact CZ-OD1 2.82Å; R529-D547 IonicContact NE-OD1 3.27Å; R529-D547 PolarHBondContact NE-OD1 2.84Å; R529-D547 IonicContact NH2-OD1 3.9Å; R529-D547 PolarHBondContact NH2-OD1 3.5Å; R529-D547 PolarHBondContact O-N 2.88Å
530	I	92.5	Very high	88.3	Confident	18 Å²	18	55.2 Å²	55.2	9%	0.092	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	116	174.5	-54.9	177.4	0	0	0	106.6	L495 L521 F544 M546 P1097	L495-I530 HydrophobicContact CD1-CD1 4.2Å; L495-I530 HydrophobicContact CD2-CB 4.37Å; L495-I530 HydrophobicContact CD2-CG2 3.82Å; L521-I530 HydrophobicContact CB-CD1 3.92Å; L521-I530 HydrophobicContact CD1-CD1 3.75Å; L521-I530 HydrophobicContact CG-CD1 4.5Å; I530-F544 HydrophobicContact CG2-CD1 4.13Å; I530-M546 HydrophobicContact CD1-CE 4.05Å; I530-M546 HydrophobicContact CG1-CE 4.05Å; I530-M546 HydrophobicContact CG1-CG 4.15Å; I530-M546 HydrophobicContact CG1-SD 4.24Å; I530-M546 HydrophobicContact CG2-CG 4.38Å; I530-P1097 WeakPolarHBondContact O-CG 3.12Å
531	F	90.9	Very high	88.3	Confident	10 Å²	10	52.2 Å²	52.2	4%	0.044	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-24.3	-177	-55.1	-66.8	0	0	0	113.3	F91 K92 R529 T545 M546 D547 P1097	F91-F531 WeakPolarHBondContact O-CD2 3.08Å; K92-F531 HydrophobicContact CG-CD1 4.33Å; K92-F531 HydrophobicContact CG-CD2 3.97Å; K92-F531 HydrophobicContact CG-CE1 4.43Å; K92-F531 HydrophobicContact CG-CE2 4.05Å; K92-F531 HydrophobicContact CG-CG 4.09Å; K92-F531 HydrophobicContact CG-CZ 4.28Å; R529-F531 HydrophobicContact CB-CE1 4.3Å; F531-T545 PolarHBondContact N-O 3.35Å; F531-M546 VanDerWaalsContact CE2-C 3.47Å; F531-D547 HydrophobicContact CE2-CB 4.39Å; F531-D547 HydrophobicContact CZ-CB 4.41Å; F531-P1097 WeakPolarHBondContact O-CB 3.26Å
532	N	90.1	Very high	88.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	162.9	-177.6	-144.6	1.4	0	0	0	114	K475 Q534 F544 T545 T1099 F1101	K475-N532 PolarHBondContact NZ-OD1 3.33Å; N532-Q534 PolarHBondContact ND2-NE2 3.09Å; N532-Q534 VanDerWaalsContact ND2-NE2 3.13Å; N532-F544 VanDerWaalsContact O-CA 3.3Å; N532-F544 WeakPolarHBondContact O-CA 3.27Å; N532-T545 HydrophobicContact CB-CG2 4.36Å; N532-T545 WeakPolarHBondContact CB-OG1 3.41Å; N532-T545 PolarHBondContact N-O 3.27Å; N532-T545 PolarHBondContact O-N 3.16Å; N532-T1099 PolarHBondContact ND2-O 3.49Å; N532-T1099 PolarHBondContact OD1-O 3.14Å; N532-F1101 WeakPolarHBondContact ND2-CD2 3.36Å
533	M	94.6	Very high	88.6	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.02	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	129	170.1	175.8	175.2	73.7	0	0	107.6	K475 A477 F493 L495 L501 L542 F543 F544	K475-M533 HydrophobicContact CB-CB 4.31Å; K475-M533 HydrophobicContact CB-CE 3.99Å; A477-M533 HydrophobicContact CB-CE 3.91Å; F493-M533 HydrophobicContact CB-CE 4.26Å; F493-M533 HydrophobicContact CB-SD 4.3Å; F493-M533 WeakPolarHBondContact O-CE 3.27Å; L495-M533 HydrophobicContact CB-CE 4.41Å; L495-M533 HydrophobicContact CB-SD 4.4Å; L501-M533 HydrophobicContact CD1-CE 4.37Å; L501-M533 HydrophobicContact CD1-SD 3.43Å; L501-M533 WeakPolarHBondContact CD1-SD 3.34Å; M533-L542 HydrophobicContact CG-CD2 3.94Å; M533-L542 HydrophobicContact SD-CD2 4.28Å; M533-F543 CarbonylContact C-O 3.5Å; M533-F543 WeakPolarHBondContact CA-O 3.39Å; M533-F544 HydrophobicContact CB-CD1 3.88Å; M533-F544 HydrophobicContact CB-CE1 3.66Å; M533-F544 HydrophobicContact CB-CZ 4.4Å; M533-F544 HydrophobicContact CG-CD1 4.05Å; M533-F544 HydrophobicContact CG-CE1 3.41Å; M533-F544 VanDerWaalsContact CG-CE1 3.41Å; M533-F544 HydrophobicContact CG-CZ 3.67Å; M533-F544 HydrophobicContact SD-CE1 3.44Å; M533-F544 WeakPolarHBondContact SD-CE1 3.17Å; M533-F544 HydrophobicContact SD-CZ 3.6Å
534	Q	92	Very high	89	Confident	7 Å²	7	46.7 Å²	46.7	3%	0.033	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.3	178	-63.5	-177.4	31.8	0	0	110.4	F96 N532 L542 F543	F96-Q534 HydrophobicContact CE2-CB 4.07Å; F96-Q534 VanDerWaalsContact CE2-OE1 3.32Å; F96-Q534 HydrophobicContact CZ-CB 4.44Å; N532-Q534 PolarHBondContact ND2-NE2 3.09Å; N532-Q534 VanDerWaalsContact ND2-NE2 3.13Å; Q534-L542 CarbonylContact O-C 3.54Å; Q534-L542 WeakPolarHBondContact O-CA 3.49Å; Q534-F543 PolarHBondContact N-O 3.39Å; Q534-F543 PolarHBondContact O-N 3.47Å
535	L	93.6	Very high	89.8	Confident	25 Å²	25	36.9 Å²	36.9	13%	0.131	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	134.8	175.2	173.7	60.7	0	0	0	110.2	A477 V478 D479 K537 L542 L555	A477-L535 HydrophobicContact CB-CB 4.11Å; V478-L535 VanDerWaalsContact O-CD2 3.32Å; V478-L535 WeakPolarHBondContact O-CD2 3.4Å; D479-L535 HydrophobicContact CB-CD2 3.7Å; L535-K537 HydrophobicContact CD2-CG 4.29Å; L535-K537 HydrophobicContact CG-CG 4.41Å; L535-L542 HydrophobicContact CB-CD2 4.04Å; L535-L542 HydrophobicContact CD1-CD2 4.28Å; L535-L555 HydrophobicContact CD1-CD1 3.75Å; L535-L555 HydrophobicContact CD1-CD2 3.46Å; L535-L555 VanDerWaalsContact CD1-CD2 3.46Å; L535-L555 HydrophobicContact CD1-CG 4.22Å
536	H	92	Very high	90.5	Very high	6 Å²	6	32 Å²	32	3%	0.028	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	89.7	170	-164	-66.9	0	0	0	110.5	F96 S98 Q116 E538 K539 R540 A541 F543	F96-H536 AromaticContact CD1-CD2 3.35Å; F96-H536 WeakPolarHBondContact CD1-CD2 3.25Å; F96-H536 HydrophobicContact CE1-CB 4.37Å; F96-H536 AromaticContact CE1-CD2 3.75Å; F96-H536 AromaticContact CG-CD2 3.49Å; F96-H536 VanDerWaalsContact CG-CD2 3.49Å; F96-H536 WeakPolarHBondContact CG-CD2 3.39Å; F96-H536 HydrophobicContact CZ-CB 4.39Å; S98-H536 PolarHBondContact OG-CE1 3.2Å; S98-H536 PolarHBondContact OG-NE2 2.93Å; S98-H536 VanDerWaalsContact OG-NE2 3.15Å; Q116-H536 PolarHBondContact NE2-CD2 2.94Å; Q116-H536 PolarHBondContact NE2-NE2 2.8Å; H536-E538 IonicContact CE1-OE2 3.17Å; H536-E538 PolarHBondContact CE1-OE2 2.83Å; H536-E538 PolarHBondContact O-N 3Å; H536-K539 HydrophobicContact CB-CB 4.31Å; H536-K539 WeakPolarHBondContact ND1-CB 3.48Å; H536-K539 WeakPolarHBondContact ND1-CG 3.33Å; H536-K539 PolarHBondContact ND1-N 2.83Å; H536-K539 PolarHBondContact O-N 2.84Å; H536-R540 PolarHBondContact O-N 2.93Å; H536-R540 VanDerWaalsContact O-N 3.12Å; H536-A541 PolarHBondContact N-O 3.29Å; H536-F543 HydrophobicContact CB-CD2 4.36Å; H536-F543 HydrophobicContact CB-CE2 4.06Å
537	K	87.5	Confident	91	Very high	78 Å²	78	30.9 Å²	30.9	34%	0.339	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-45.6	-54.8	-174.1	-64.7	-163.2	-178.9	-172	0	112.3	E365 S480 L535 K539 R540	E365-K537 VanDerWaalsContact CD-NZ 3.27Å; E365-K537 IonicContact OE1-NZ 3.01Å; E365-K537 PolarHBondContact OE1-NZ 2.78Å; E365-K537 IonicContact OE2-NZ 3.59Å; E365-K537 PolarHBondContact OE2-NZ 3.34Å; S480-K537 PolarHBondContact OG-NZ 3.28Å; L535-K537 HydrophobicContact CD2-CG 4.29Å; L535-K537 HydrophobicContact CG-CG 4.41Å; K537-K539 VanDerWaalsContact C-N 3.26Å; K537-K539 PolarHBondContact O-N 2.92Å; K537-K539 VanDerWaalsContact O-N 3.16Å; K537-R540 PolarHBondContact O-N 2.9Å
538	E	85.2	Confident	91.5	Very high	111 Å²	111	28.5 Å²	28.5	52%	0.519	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-59.8	-30.2	-177.1	-54.6	176.7	146.4	0	0	114.7	S98 H536	S98-E538 PolarHBondContact OG-OE2 3.28Å; H536-E538 IonicContact CE1-OE2 3.17Å; H536-E538 PolarHBondContact CE1-OE2 2.83Å; H536-E538 PolarHBondContact O-N 3Å
539	K	87.6	Confident	91.9	Very high	55 Å²	55	29.1 Å²	29.1	24%	0.239	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-99.1	2.1	-176.9	-71	-67	-166.3	166	0	112.3	N101 D117 H536 K537 A541	N101-K539 WeakPolarHBondContact OD1-CE 3.46Å; N101-K539 PolarHBondContact OD1-NZ 3.07Å; D117-K539 WeakPolarHBondContact OD1-CD 3.27Å; D117-K539 WeakPolarHBondContact OD1-CE 3.37Å; D117-K539 IonicContact OD1-NZ 2.73Å; D117-K539 PolarHBondContact OD1-NZ 2.91Å; D117-K539 IonicContact OD2-NZ 3.75Å; D117-K539 PolarHBondContact OD2-NZ 2.87Å; H536-K539 HydrophobicContact CB-CB 4.31Å; H536-K539 WeakPolarHBondContact ND1-CB 3.48Å; H536-K539 WeakPolarHBondContact ND1-CG 3.33Å; H536-K539 PolarHBondContact ND1-N 2.83Å; H536-K539 PolarHBondContact O-N 2.84Å; K537-K539 VanDerWaalsContact C-N 3.26Å; K537-K539 PolarHBondContact O-N 2.92Å; K537-K539 VanDerWaalsContact O-N 3.16Å; K539-A541 PolarHBondContact O-N 3.05Å
540	R	91.2	Very high	92.1	Very high	72 Å²	72	24.9 Å²	24.9	27%	0.272	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.4	49.1	-179.1	-59.4	178.7	60.5	89.9	11.6	112.2	H536 K537 P554 L555 E556	H536-R540 PolarHBondContact O-N 2.93Å; H536-R540 VanDerWaalsContact O-N 3.12Å; K537-R540 PolarHBondContact O-N 2.9Å; R540-P554 WeakPolarHBondContact O-CA 3.47Å; R540-L555 VanDerWaalsContact C-CG 3.46Å; R540-L555 HydrophobicContact CB-CD1 4.22Å; R540-L555 PolarHBondContact O-N 3.43Å; R540-E556 IonicContact CZ-OE1 3.76Å; R540-E556 IonicContact CZ-OE2 3.67Å; R540-E556 IonicContact NE-OE1 3.41Å; R540-E556 PolarHBondContact NE-OE1 3.04Å; R540-E556 VanDerWaalsContact NE-OE1 3.14Å; R540-E556 IonicContact NE-OE2 2.69Å; R540-E556 PolarHBondContact NE-OE2 3.45Å; R540-E556 VanDerWaalsContact NH2-CD 3.34Å; R540-E556 IonicContact NH2-OE1 3.79Å; R540-E556 IonicContact NH2-OE2 3.07Å; R540-E556 PolarHBondContact NH2-OE2 3.36Å
541	A	93.5	Very high	92.2	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	149.1	-178.9	0	0	0	0	0	113.5	H536 K539 F543 R552 I553	H536-A541 PolarHBondContact N-O 3.29Å; K539-A541 PolarHBondContact O-N 3.05Å; A541-F543 HydrophobicContact CB-CE2 4Å; A541-R552 HydrophobicContact CB-CG 4.04Å; A541-I553 CarbonylContact C-O 3.58Å; A541-I553 VanDerWaalsContact CA-O 3.24Å; A541-I553 WeakPolarHBondContact CA-O 3.19Å; A541-I553 WeakPolarHBondContact CB-O 3.46Å
542	L	95.5	Very high	92.4	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.01	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	140.1	163.8	-71	162.7	0	0	0	110.2	A477 F493 L501 M533 Q534 L535 F544 R552 I553 L555	A477-L542 HydrophobicContact CB-CD2 4.29Å; F493-L542 HydrophobicContact CB-CD1 4.03Å; F493-L542 HydrophobicContact CD1-CD1 3.51Å; F493-L542 HydrophobicContact CD2-CD1 4.23Å; F493-L542 HydrophobicContact CD2-CD2 4.44Å; F493-L542 HydrophobicContact CE1-CD1 3.9Å; F493-L542 HydrophobicContact CG-CD1 3.67Å; F493-L542 HydrophobicContact CG-CD2 4.44Å; F493-L542 HydrophobicContact CZ-CD1 4.42Å; L501-L542 HydrophobicContact CD2-CD1 4Å; M533-L542 HydrophobicContact CG-CD2 3.94Å; M533-L542 HydrophobicContact SD-CD2 4.28Å; Q534-L542 CarbonylContact O-C 3.54Å; Q534-L542 WeakPolarHBondContact O-CA 3.49Å; L535-L542 HydrophobicContact CB-CD2 4.04Å; L535-L542 HydrophobicContact CD1-CD2 4.28Å; L542-F544 HydrophobicContact CB-CD2 4.35Å; L542-F544 HydrophobicContact CB-CE2 3.5Å; L542-F544 HydrophobicContact CB-CZ 4.02Å; L542-F544 HydrophobicContact CD1-CE2 4.27Å; L542-F544 HydrophobicContact CD1-CZ 4.09Å; L542-F544 HydrophobicContact CG-CE2 4.47Å; L542-R552 CarbonylContact O-C 3.58Å; L542-R552 WeakPolarHBondContact O-CA 3.46Å; L542-I553 PolarHBondContact N-O 3.49Å; L542-I553 PolarHBondContact O-N 2.03Å; L542-L555 HydrophobicContact CD1-CD2 4.24Å; L542-L555 HydrophobicContact CD2-CD2 4.49Å; L542-L555 HydrophobicContact CG-CD2 3.75Å
543	F	95.3	Very high	92.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.3	173.5	-69	-106.3	0	0	0	109.9	L94 F96 I103 Q116 M119 M533 Q534 H536 A541 L551 R552	L94-F543 HydrophobicContact CD2-CB 3.74Å; L94-F543 HydrophobicContact CD2-CG 4.49Å; F96-F543 HydrophobicContact CE1-CB 4.49Å; F96-F543 HydrophobicContact CE1-CD1 4.04Å; F96-F543 AromaticContact CE1-CD2 3.55Å; F96-F543 HydrophobicContact CE1-CD2 3.55Å; F96-F543 HydrophobicContact CE1-CE1 4.08Å; F96-F543 AromaticContact CE1-CE2 3.6Å; F96-F543 HydrophobicContact CE1-CE2 3.6Å; F96-F543 AromaticContact CE1-CG 3.78Å; F96-F543 HydrophobicContact CE1-CG 3.78Å; F96-F543 AromaticContact CE1-CZ 3.87Å; F96-F543 HydrophobicContact CE1-CZ 3.87Å; F96-F543 HydrophobicContact CZ-CB 3.95Å; F96-F543 HydrophobicContact CZ-CD1 4.35Å; F96-F543 AromaticContact CZ-CD2 3.53Å; F96-F543 HydrophobicContact CZ-CD2 3.53Å; F96-F543 HydrophobicContact CZ-CE2 4.06Å; F96-F543 AromaticContact CZ-CG 3.69Å; F96-F543 HydrophobicContact CZ-CG 3.69Å; I103-F543 HydrophobicContact CD1-CD1 4.36Å; I103-F543 HydrophobicContact CD1-CE1 4.12Å; Q116-F543 HydrophobicContact CG-CZ 4.04Å; M119-F543 HydrophobicContact SD-CE1 4.08Å; M533-F543 CarbonylContact C-O 3.5Å; M533-F543 WeakPolarHBondContact CA-O 3.39Å; Q534-F543 PolarHBondContact N-O 3.39Å; Q534-F543 PolarHBondContact O-N 3.47Å; H536-F543 HydrophobicContact CB-CD2 4.36Å; H536-F543 HydrophobicContact CB-CE2 4.06Å; A541-F543 HydrophobicContact CB-CE2 4Å; F543-L551 CarbonylContact C-O 3.55Å; F543-L551 WeakPolarHBondContact CA-O 3.12Å; F543-R552 HydrophobicContact CD1-CB 4.01Å; F543-R552 HydrophobicContact CD1-CG 4.23Å; F543-R552 HydrophobicContact CE1-CB 3.89Å; F543-R552 HydrophobicContact CE1-CG 3.77Å; F543-R552 HydrophobicContact CE2-CG 4.16Å; F543-R552 HydrophobicContact CZ-CB 4.37Å; F543-R552 VanDerWaalsContact CZ-CD 3.49Å; F543-R552 HydrophobicContact CZ-CG 3.73Å
544	F	95.5	Very high	92.5	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	119.9	-178.3	-64.2	-94.3	0	0	0	110.4	L501 L521 I530 N532 M533 L542 M546 L550 L551 I553	L501-F544 HydrophobicContact CD1-CE1 4.26Å; L501-F544 HydrophobicContact CD1-CZ 4.1Å; L501-F544 HydrophobicContact CD2-CE2 4.49Å; L501-F544 HydrophobicContact CD2-CZ 3.74Å; L501-F544 HydrophobicContact CG-CZ 4.49Å; L521-F544 HydrophobicContact CD1-CD1 3.67Å; L521-F544 HydrophobicContact CD1-CE1 3.42Å; L521-F544 VanDerWaalsContact CD1-CE1 3.42Å; L521-F544 HydrophobicContact CD1-CG 4.33Å; L521-F544 HydrophobicContact CD1-CZ 3.94Å; L521-F544 HydrophobicContact CD2-CE2 4.43Å; L521-F544 HydrophobicContact CD2-CZ 4.34Å; I530-F544 HydrophobicContact CG2-CD1 4.13Å; N532-F544 VanDerWaalsContact O-CA 3.3Å; N532-F544 WeakPolarHBondContact O-CA 3.27Å; M533-F544 HydrophobicContact CB-CD1 3.88Å; M533-F544 HydrophobicContact CB-CE1 3.66Å; M533-F544 HydrophobicContact CB-CZ 4.4Å; M533-F544 HydrophobicContact CG-CD1 4.05Å; M533-F544 HydrophobicContact CG-CE1 3.41Å; M533-F544 VanDerWaalsContact CG-CE1 3.41Å; M533-F544 HydrophobicContact CG-CZ 3.67Å; M533-F544 HydrophobicContact SD-CE1 3.44Å; M533-F544 WeakPolarHBondContact SD-CE1 3.17Å; M533-F544 HydrophobicContact SD-CZ 3.6Å; L542-F544 HydrophobicContact CB-CD2 4.35Å; L542-F544 HydrophobicContact CB-CE2 3.5Å; L542-F544 HydrophobicContact CB-CZ 4.02Å; L542-F544 HydrophobicContact CD1-CE2 4.27Å; L542-F544 HydrophobicContact CD1-CZ 4.09Å; L542-F544 HydrophobicContact CG-CE2 4.47Å; F544-M546 HydrophobicContact CB-CE 3.77Å; F544-M546 HydrophobicContact CG-CE 4.42Å; F544-L550 WeakPolarHBondContact O-CA 3.38Å; F544-L550 WeakPolarHBondContact O-CD1 3.44Å; F544-L551 HydrophobicContact CB-CB 4.31Å; F544-L551 PolarHBondContact N-O 3.37Å; F544-L551 PolarHBondContact O-N 2.87Å; F544-I553 HydrophobicContact CD2-CD1 3.89Å; F544-I553 HydrophobicContact CD2-CG1 4.37Å; F544-I553 HydrophobicContact CE2-CD1 3.62Å; F544-I553 HydrophobicContact CE2-CG1 4.25Å
545	T	93.9	Very high	92.6	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.006	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	129.2	174.2	79.8	0	0	0	0	108.9	F91 L94 F531 N532 L550	F91-T545 WeakPolarHBondContact O-CB 3.32Å; F91-T545 PolarHBondContact O-OG1 2.86Å; L94-T545 HydrophobicContact CB-CG2 3.7Å; L94-T545 HydrophobicContact CD2-CG2 3.94Å; L94-T545 HydrophobicContact CG-CG2 4.43Å; F531-T545 PolarHBondContact N-O 3.35Å; N532-T545 HydrophobicContact CB-CG2 4.36Å; N532-T545 WeakPolarHBondContact CB-OG1 3.41Å; N532-T545 PolarHBondContact N-O 3.27Å; N532-T545 PolarHBondContact O-N 3.16Å; T545-L550 HydrophobicContact CG2-CD1 3.86Å
546	M	94.4	Very high	92.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	173.3	-172.4	-49	-174.2	173.5	0	0	112.1	F91 L521 V528 R529 I530 F531 F544 K548 R549 L551	F91-M546 WeakPolarHBondContact CB-O 3.4Å; F91-M546 WeakPolarHBondContact CD2-O 3.41Å; F91-M546 PolarHBondContact N-O 2.03Å; L521-M546 HydrophobicContact CB-CE 4.27Å; V528-M546 HydrophobicContact CG1-CB 3.79Å; V528-M546 HydrophobicContact CG1-CG 4.42Å; V528-M546 HydrophobicContact CG1-SD 3.95Å; R529-M546 CarbonylContact O-C 3.58Å; R529-M546 VanDerWaalsContact O-CA 3.24Å; R529-M546 WeakPolarHBondContact O-CA 3.33Å; R529-M546 WeakPolarHBondContact O-CB 3.31Å; I530-M546 HydrophobicContact CD1-CE 4.05Å; I530-M546 HydrophobicContact CG1-CE 4.05Å; I530-M546 HydrophobicContact CG1-CG 4.15Å; I530-M546 HydrophobicContact CG1-SD 4.24Å; I530-M546 HydrophobicContact CG2-CG 4.38Å; F531-M546 VanDerWaalsContact CE2-C 3.47Å; F544-M546 HydrophobicContact CB-CE 3.77Å; F544-M546 HydrophobicContact CG-CE 4.42Å; M546-K548 VanDerWaalsContact C-N 3.27Å; M546-K548 PolarHBondContact O-N 2.85Å; M546-R549 WeakPolarHBondContact CA-O 3.11Å; M546-R549 HydrophobicContact CB-CG 4.23Å; M546-R549 WeakPolarHBondContact CB-O 3.34Å; M546-R549 HydrophobicContact CG-CG 4.43Å; M546-R549 PolarHBondContact N-O 2.81Å; M546-R549 HydrophobicContact SD-CG 3.85Å; M546-L551 HydrophobicContact CE-CB 4Å; M546-L551 HydrophobicContact CE-CD2 3.68Å
547	D	91.4	Very high	92.4	Very high	22 Å²	22	28.2 Å²	28.2	12%	0.118	13%	0.125	C	C	.	.	S	Bend	trans	-52.5	-40.3	178.9	-163.2	80.7	0	0	0	113.5	T89 D90 V528 R529 F531	T89-D547 CarbonylContact C-O 3.6Å; T89-D547 WeakPolarHBondContact CA-O 3.5Å; T89-D547 WeakPolarHBondContact CB-O 3.03Å; D90-D547 PolarHBondContact N-O 3.07Å; V528-D547 HydrophobicContact CG1-CB 4.34Å; R529-D547 HydrophobicContact CB-CB 4.25Å; R529-D547 IonicContact CZ-OD1 2.82Å; R529-D547 IonicContact NE-OD1 3.27Å; R529-D547 PolarHBondContact NE-OD1 2.84Å; R529-D547 IonicContact NH2-OD1 3.9Å; R529-D547 PolarHBondContact NH2-OD1 3.5Å; R529-D547 PolarHBondContact O-N 2.88Å; F531-D547 HydrophobicContact CE2-CB 4.39Å; F531-D547 HydrophobicContact CZ-CB 4.41Å
548	K	91	Very high	92.6	Very high	93 Å²	93	24.8 Å²	24.8	40%	0.404	11%	0.111	S	C	.	.	S	Bend	trans	-123.1	-12.1	-174.2	-59.2	-177.4	-178.5	177.9	0	115	E84 F91 M546	E84-K548 WeakPolarHBondContact CG-O 3.48Å; F91-K548 VanDerWaalsContact CE2-C 3.42Å; F91-K548 WeakPolarHBondContact CE2-O 3.39Å; M546-K548 VanDerWaalsContact C-N 3.27Å; M546-K548 PolarHBondContact O-N 2.85Å
549	R	91.8	Very high	92.7	Very high	18 Å²	18	24 Å²	24	7%	0.068	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	156.6	-169.3	57.9	-171.7	171.9	-131.2	1.6	113.2	Y73 F83 E84 D526 M546	Y73-R549 VanDerWaalsContact OH-CZ 3.25Å; Y73-R549 PolarHBondContact OH-NH2 3.4Å; F83-R549 CarbonylContact O-C 3.59Å; F83-R549 WeakPolarHBondContact O-CA 3.31Å; F83-R549 WeakPolarHBondContact O-CB 3.47Å; E84-R549 HydrophobicContact CB-CB 4.09Å; D526-R549 IonicContact OD2-CZ 3.77Å; D526-R549 IonicContact OD2-NH1 3.7Å; D526-R549 IonicContact OD2-NH2 2.91Å; D526-R549 PolarHBondContact OD2-NH2 2.9Å; M546-R549 WeakPolarHBondContact CA-O 3.11Å; M546-R549 HydrophobicContact CB-CG 4.23Å; M546-R549 WeakPolarHBondContact CB-O 3.34Å; M546-R549 HydrophobicContact CG-CG 4.43Å; M546-R549 PolarHBondContact N-O 2.81Å; M546-R549 HydrophobicContact SD-CG 3.85Å
550	L	94.1	Very high	92.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.9	161.4	178.2	75.1	0	0	0	107.9	R82 F83 L94 I103 V105 M119 F544 T545	R82-L550 CarbonylContact C-O 3.28Å; R82-L550 VanDerWaalsContact CA-O 3.28Å; R82-L550 WeakPolarHBondContact CA-O 3.27Å; F83-L550 HydrophobicContact CB-CB 4.34Å; F83-L550 PolarHBondContact N-O 2.99Å; F83-L550 PolarHBondContact O-N 3.18Å; L94-L550 HydrophobicContact CD1-CD1 4.48Å; L94-L550 HydrophobicContact CD2-CD1 4.21Å; I103-L550 HydrophobicContact CD1-CD2 3.51Å; V105-L550 HydrophobicContact CG2-CD2 4.02Å; M119-L550 HydrophobicContact CE-CB 4.37Å; M119-L550 HydrophobicContact CE-CD2 3.48Å; M119-L550 VanDerWaalsContact CE-CD2 3.48Å; M119-L550 HydrophobicContact CE-CG 3.73Å; F544-L550 WeakPolarHBondContact O-CA 3.38Å; F544-L550 WeakPolarHBondContact O-CD1 3.44Å; T545-L550 HydrophobicContact CG2-CD1 3.86Å
551	L	94.2	Very high	92.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	129.5	-178.5	-177.6	67.2	0	0	0	110.1	L77 A80 R82 F543 F544 M546 I553	L77-L551 HydrophobicContact CD2-CD1 4.37Å; A80-L551 HydrophobicContact CB-CD1 4.05Å; R82-L551 HydrophobicContact CB-CD1 3.92Å; F543-L551 CarbonylContact C-O 3.55Å; F543-L551 WeakPolarHBondContact CA-O 3.12Å; F544-L551 HydrophobicContact CB-CB 4.31Å; F544-L551 PolarHBondContact N-O 3.37Å; F544-L551 PolarHBondContact O-N 2.87Å; M546-L551 HydrophobicContact CE-CB 4Å; M546-L551 HydrophobicContact CE-CD2 3.68Å; L551-I553 HydrophobicContact CD2-CD1 3.84Å; L551-I553 HydrophobicContact CD2-CG1 4.21Å; L551-I553 HydrophobicContact CG-CD1 4.15Å; L551-I553 HydrophobicContact CG-CG1 3.97Å
552	R	94.8	Very high	92	Very high	43 Å²	43	26.5 Å²	26.5	16%	0.162	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.6	177.2	174	-176.3	171.3	-92	0.9	109.3	A80 S81 M119 A541 L542 F543	A80-R552 WeakPolarHBondContact CA-O 3.14Å; A80-R552 WeakPolarHBondContact CB-O 3.29Å; S81-R552 PolarHBondContact N-O 2.87Å; S81-R552 PolarHBondContact O-N 3.16Å; S81-R552 PolarHBondContact OG-NH1 3.02Å; M119-R552 HydrophobicContact CE-CB 4Å; M119-R552 HydrophobicContact SD-CB 3.94Å; A541-R552 HydrophobicContact CB-CG 4.04Å; L542-R552 CarbonylContact O-C 3.58Å; L542-R552 WeakPolarHBondContact O-CA 3.46Å; F543-R552 HydrophobicContact CD1-CB 4.01Å; F543-R552 HydrophobicContact CD1-CG 4.23Å; F543-R552 HydrophobicContact CE1-CB 3.89Å; F543-R552 HydrophobicContact CE1-CG 3.77Å; F543-R552 HydrophobicContact CE2-CG 4.16Å; F543-R552 HydrophobicContact CZ-CB 4.37Å; F543-R552 VanDerWaalsContact CZ-CD 3.49Å; F543-R552 HydrophobicContact CZ-CG 3.73Å
553	I	94.3	Very high	91.6	Very high	2 Å²	2	28 Å²	28	1%	0.01	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127.4	-175	-54.2	173.9	0	0	0	109	L76 A80 L521 A541 L542 F544 L551	L76-I553 HydrophobicContact CD1-CD1 4.08Å; L76-I553 HydrophobicContact CD1-CG1 4.29Å; L76-I553 HydrophobicContact CD1-CG2 3.68Å; L76-I553 HydrophobicContact CD2-CD1 3.92Å; L76-I553 HydrophobicContact CG-CD1 4.41Å; A80-I553 HydrophobicContact CB-CG1 4.12Å; L521-I553 HydrophobicContact CD2-CD1 3.39Å; A541-I553 CarbonylContact C-O 3.58Å; A541-I553 VanDerWaalsContact CA-O 3.24Å; A541-I553 WeakPolarHBondContact CA-O 3.19Å; A541-I553 WeakPolarHBondContact CB-O 3.46Å; L542-I553 PolarHBondContact N-O 3.49Å; L542-I553 PolarHBondContact O-N 2.03Å; F544-I553 HydrophobicContact CD2-CD1 3.89Å; F544-I553 HydrophobicContact CD2-CG1 4.37Å; F544-I553 HydrophobicContact CE2-CD1 3.62Å; F544-I553 HydrophobicContact CE2-CG1 4.25Å; L551-I553 HydrophobicContact CD2-CD1 3.84Å; L551-I553 HydrophobicContact CD2-CG1 4.21Å; L551-I553 HydrophobicContact CG-CD1 4.15Å; L551-I553 HydrophobicContact CG-CG1 3.97Å
554	P	93.4	Very high	91.3	Very high	33 Å²	33	30.6 Å²	30.6	21%	0.214	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	151.8	172.2	-23.4	34.3	0	0	0	112.9	N79 R540 R557	N79-P554 WeakPolarHBondContact O-CD 3.35Å; R540-P554 WeakPolarHBondContact O-CA 3.47Å; P554-R557 PolarHBondContact O-NH1 3.43Å
555	L	93.7	Very high	90.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	-70.3	-42.9	179	-57.7	172.5	0	0	0	111.6	F493 K503 L535 R540 L542 R557 Y574	F493-L555 HydrophobicContact CE1-CD2 4.32Å; F493-L555 HydrophobicContact CE2-CD2 3.76Å; F493-L555 HydrophobicContact CZ-CB 4.09Å; F493-L555 HydrophobicContact CZ-CD2 3.56Å; F493-L555 HydrophobicContact CZ-CG 4.33Å; K503-L555 PolarHBondContact NZ-O 3.44Å; K503-L555 VanDerWaalsContact NZ-O 3.16Å; L535-L555 HydrophobicContact CD1-CD1 3.75Å; L535-L555 HydrophobicContact CD1-CD2 3.46Å; L535-L555 VanDerWaalsContact CD1-CD2 3.46Å; L535-L555 HydrophobicContact CD1-CG 4.22Å; R540-L555 VanDerWaalsContact C-CG 3.46Å; R540-L555 HydrophobicContact CB-CD1 4.22Å; R540-L555 PolarHBondContact O-N 3.43Å; L542-L555 HydrophobicContact CD1-CD2 4.24Å; L542-L555 HydrophobicContact CD2-CD2 4.49Å; L542-L555 HydrophobicContact CG-CD2 3.75Å; L555-R557 PolarHBondContact O-NH2 2.83Å; L555-Y574 HydrophobicContact CB-CD2 4.28Å; L555-Y574 HydrophobicContact CB-CE1 4.33Å; L555-Y574 HydrophobicContact CB-CE2 3.75Å; L555-Y574 HydrophobicContact CD1-CE1 4.27Å
556	E	91.1	Very high	90.4	Very high	41 Å²	41	42.4 Å²	42.4	19%	0.192	22%	0.218	C	C	.	.			trans	-87.5	152.1	175.8	61.9	-92.7	-158.6	0	0	115	R540 A586	R540-E556 IonicContact CZ-OE1 3.76Å; R540-E556 IonicContact CZ-OE2 3.67Å; R540-E556 IonicContact NE-OE1 3.41Å; R540-E556 PolarHBondContact NE-OE1 3.04Å; R540-E556 VanDerWaalsContact NE-OE1 3.14Å; R540-E556 IonicContact NE-OE2 2.69Å; R540-E556 PolarHBondContact NE-OE2 3.45Å; R540-E556 VanDerWaalsContact NH2-CD 3.34Å; R540-E556 IonicContact NH2-OE1 3.79Å; R540-E556 IonicContact NH2-OE2 3.07Å; R540-E556 PolarHBondContact NH2-OE2 3.36Å; E556-A586 HydrophobicContact CB-CB 4.5Å; E556-A586 HydrophobicContact CG-CB 3.88Å
557	R	91.1	Very high	90.2	Very high	21 Å²	21	42.4 Å²	42.4	8%	0.079	22%	0.218	C	C	.	.			trans	-134.1	33.8	167.2	-88.4	159.3	-62.9	-60.1	-22.6	111.5	E517 P554 L555 S559 R560	E517-R557 VanDerWaalsContact CD-NH2 3.34Å; E517-R557 IonicContact OE1-CZ 3.64Å; E517-R557 IonicContact OE1-NE 3.36Å; E517-R557 IonicContact OE1-NH2 2.95Å; E517-R557 PolarHBondContact OE1-NH2 3.47Å; E517-R557 IonicContact OE2-CZ 3.97Å; E517-R557 IonicContact OE2-NE 3.33Å; E517-R557 PolarHBondContact OE2-NE 3.42Å; E517-R557 IonicContact OE2-NH2 3.48Å; E517-R557 PolarHBondContact OE2-NH2 3Å; P554-R557 PolarHBondContact O-NH1 3.43Å; L555-R557 PolarHBondContact O-NH2 2.83Å; R557-S559 PolarHBondContact O-N 2.77Å; R557-R560 WeakPolarHBondContact O-CB 3.44Å; R557-R560 PolarHBondContact O-N 3.03Å
558	C	91.1	Very high	90.1	Very high	6 Å²	6	43 Å²	43	4%	0.041	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-51.3	-34.1	-170.1	-48	0	0	0	0	114.6	R560 H561 C575 C584	C558-R560 PolarHBondContact O-N 2.77Å; C558-H561 PolarHBondContact O-CD2 2.97Å; C558-H561 PolarHBondContact O-N 2.85Å; C558-C575 WeakPolarHBondContact CA-SG 3.43Å; C558-C575 HydrophobicContact CB-CB 3.77Å; C558-C575 WeakPolarHBondContact CB-SG 3.29Å; C558-C575 WeakPolarHBondContact SG-CA 3.36Å; C558-C575 WeakPolarHBondContact SG-CB 3.28Å; C558-C575 CovalentContact SG-SG 2.04Å; C558-C575 PolarHBondContact SG-SG 2.74Å; C558-C584 HydrophobicContact CB-CB 4.43Å; C558-C584 VanDerWaalsContact O-CB 3.28Å; C558-C584 WeakPolarHBondContact O-CB 3.46Å
559	S	87.9	Confident	89.9	Confident	94 Å²	94	39 Å²	39	66%	0.657	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	-59.5	-13.8	176.9	53	0	0	0	0	115.1	R557 H561	R557-S559 PolarHBondContact O-N 2.77Å; S559-H561 VanDerWaalsContact C-N 3.27Å
560	R	86.5	Confident	89.8	Confident	64 Å²	64	38.9 Å²	38.9	24%	0.242	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-67.3	-25.4	171.2	-162.9	178	-161.6	-127.7	-6.9	113.1	S68 R70 E75 R557 C558 A562	S68-R560 PolarHBondContact O-NH1 2.05Å; R70-R560 PolarHBondContact O-NH2 3.18Å; E75-R560 IonicContact OE1-CZ 2.79Å; E75-R560 IonicContact OE1-NE 2.67Å; E75-R560 PolarHBondContact OE1-NE 2.94Å; E75-R560 IonicContact OE1-NH2 3.97Å; E75-R560 PolarHBondContact OE1-NH2 3.06Å; E75-R560 IonicContact OE2-CZ 3.67Å; E75-R560 IonicContact OE2-NE 2.66Å; E75-R560 IonicContact OE2-NH2 3.27Å; E75-R560 PolarHBondContact OE2-NH2 2.67Å; R557-R560 WeakPolarHBondContact O-CB 3.44Å; R557-R560 PolarHBondContact O-N 3.03Å; C558-R560 PolarHBondContact O-N 2.77Å; R560-A562 PolarHBondContact O-N 2.82Å
561	H	86.8	Confident	89.6	Confident	33 Å²	33	40.1 Å²	40.1	15%	0.153	21%	0.214	C	C	.	.			trans	-93.9	88.6	-176.3	-54.4	-90.5	0	0	0	110.2	C558 S559 S563 R566 C567 A570 C584	C558-H561 PolarHBondContact O-CD2 2.97Å; C558-H561 PolarHBondContact O-N 2.85Å; S559-H561 VanDerWaalsContact C-N 3.27Å; H561-S563 VanDerWaalsContact C-N 3.28Å; H561-S563 PolarHBondContact O-N 2.83Å; H561-R566 HydrophobicContact CB-CB 4.31Å; H561-R566 PolarHBondContact ND1-O 3.4Å; H561-C567 HydrophobicContact CB-CB 3.95Å; H561-A570 WeakPolarHBondContact CE1-CB 3.24Å; H561-A570 WeakPolarHBondContact ND1-CB 3.35Å; H561-C584 HydrophobicContact CB-CB 3.88Å; H561-C584 VanDerWaalsContact O-CB 3.26Å; H561-C584 WeakPolarHBondContact O-CB 3.33Å
562	A	84.9	Confident	89.5	Confident	83 Å²	83	40.2 Å²	40.2	69%	0.686	22%	0.215	S	C	*	.			trans	-72.8	-7.4	-173.4	0	0	0	0	0	116	R560	R560-A562 PolarHBondContact O-N 2.82Å
563	S	85.3	Confident	89.4	Confident	33 Å²	33	38.2 Å²	38.2	23%	0.231	21%	0.207	C	C	.	.	S	Bend	trans	-136.1	159.6	179.1	82.2	0	0	0	0	112.2	H561 E565 R566 C567	H561-S563 VanDerWaalsContact C-N 3.28Å; H561-S563 PolarHBondContact O-N 2.83Å; S563-E565 VanDerWaalsContact C-N 3.32Å; S563-E565 WeakPolarHBondContact CB-OE2 3.04Å; S563-E565 PolarHBondContact O-N 3.41Å; S563-E565 PolarHBondContact OG-OE2 2.79Å; S563-R566 PolarHBondContact O-N 2.72Å; S563-R566 PolarHBondContact OG-N 3.16Å; S563-C567 WeakPolarHBondContact O-CB 3.48Å; S563-C567 PolarHBondContact O-N 3.34Å
564	E	89.1	Confident	89.2	Confident	55 Å²	55	38.1 Å²	38.1	26%	0.257	21%	0.206	S	C	.	.	H	α-helix	trans	-56.6	-45.7	-179.8	-172	156.7	175.1	0	0	110.9	R566 C567 I568 W577 R579	E564-R566 PolarHBondContact O-N 3.33Å; E564-C567 PolarHBondContact O-N 2.66Å; E564-I568 HydrophobicContact CG-CD1 3.62Å; E564-I568 HydrophobicContact CG-CG1 4.41Å; E564-I568 WeakPolarHBondContact O-CB 2.97Å; E564-I568 WeakPolarHBondContact O-CG1 3.25Å; E564-I568 PolarHBondContact O-N 3Å; E564-W577 HydrophobicContact CB-CD2 3.82Å; E564-W577 HydrophobicContact CB-CE3 4.46Å; E564-W577 HydrophobicContact CB-CG 3.96Å; E564-W577 HydrophobicContact CB-CZ2 4.08Å; E564-W577 VanDerWaalsContact CD-NE1 3.34Å; E564-W577 HydrophobicContact CG-CB 4.28Å; E564-W577 HydrophobicContact CG-CD2 4.16Å; E564-W577 HydrophobicContact CG-CG 3.72Å; E564-W577 PolarHBondContact OE2-NE1 2.81Å; E564-R579 IonicContact OE1-CZ 3.92Å; E564-R579 IonicContact OE1-NE 3.13Å; E564-R579 PolarHBondContact OE1-NE 2.84Å; E564-R579 IonicContact OE1-NH2 3.15Å; E564-R579 PolarHBondContact OE1-NH2 2.86Å
565	E	85.2	Confident	89.2	Confident	128 Å²	128	36.7 Å²	36.7	60%	0.598	20%	0.197	S	C	*	.	H	α-helix	trans	-65.1	-38.2	-178.8	-45.2	79.3	-175.9	0	0	111.9	S563 G569	S563-E565 VanDerWaalsContact C-N 3.32Å; S563-E565 WeakPolarHBondContact CB-OE2 3.04Å; S563-E565 PolarHBondContact O-N 3.41Å; S563-E565 PolarHBondContact OG-OE2 2.79Å; E565-G569 WeakPolarHBondContact O-CA 2.81Å; E565-G569 PolarHBondContact O-N 3.16Å
566	R	86.3	Confident	89	Confident	121 Å²	121	36.7 Å²	36.7	46%	0.457	20%	0.197	S	C	.	.	H	α-helix	trans	-75.4	-28.3	176.8	-72.6	-173.6	-178.5	-175.6	2.6	113	H561 S563 E564 A570	H561-R566 HydrophobicContact CB-CB 4.31Å; H561-R566 PolarHBondContact ND1-O 3.4Å; S563-R566 PolarHBondContact O-N 2.72Å; S563-R566 PolarHBondContact OG-N 3.16Å; E564-R566 PolarHBondContact O-N 3.33Å; R566-A570 VanDerWaalsContact O-CB 3.24Å; R566-A570 WeakPolarHBondContact O-CB 3.42Å; R566-A570 PolarHBondContact O-N 3.49Å
567	C	89.4	Confident	89	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-76.6	-53.7	179.3	-176.8	0	0	0	0	110.3	H561 S563 E564 A570 G576 W577 C584	H561-C567 HydrophobicContact CB-CB 3.95Å; S563-C567 WeakPolarHBondContact O-CB 3.48Å; S563-C567 PolarHBondContact O-N 3.34Å; E564-C567 PolarHBondContact O-N 2.66Å; C567-A570 PolarHBondContact O-N 2.95Å; C567-G576 PolarHBondContact SG-O 3.34Å; C567-W577 HydrophobicContact CB-CB 4.25Å; C567-W577 HydrophobicContact CB-CE3 3.85Å; C567-W577 PolarHBondContact SG-N 2.81Å; C567-W577 VanDerWaalsContact SG-N 3.43Å; C567-C584 HydrophobicContact CB-CB 3.55Å; C567-C584 WeakPolarHBondContact CB-SG 3.44Å; C567-C584 VanDerWaalsContact SG-CA 3.5Å; C567-C584 WeakPolarHBondContact SG-CB 3.45Å; C567-C584 CovalentContact SG-SG 2.03Å; C567-C584 PolarHBondContact SG-SG 2.72Å
568	I	89.2	Confident	88.9	Confident	34 Å²	34	34.9 Å²	34.9	17%	0.174	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-47.5	177.6	-62.2	175.9	0	0	0	109.7	E564 A570 K571 W577 V598 L600	E564-I568 HydrophobicContact CG-CD1 3.62Å; E564-I568 HydrophobicContact CG-CG1 4.41Å; E564-I568 WeakPolarHBondContact O-CB 2.97Å; E564-I568 WeakPolarHBondContact O-CG1 3.25Å; E564-I568 PolarHBondContact O-N 3Å; I568-A570 PolarHBondContact O-N 3.49Å; I568-K571 WeakPolarHBondContact O-CG 3.17Å; I568-K571 PolarHBondContact O-N 2.85Å; I568-W577 HydrophobicContact CG1-CB 4.3Å; I568-V598 HydrophobicContact CD1-CB 4.39Å; I568-V598 HydrophobicContact CD1-CG1 3.81Å; I568-L600 HydrophobicContact CG2-CB 3.59Å; I568-L600 HydrophobicContact CG2-CD2 4.27Å
569	G	87.9	Confident	88.8	Confident	10 Å²	10	40.5 Å²	40.5	10%	0.103	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-9.1	-178.9	0	0	0	0	0	115.4	E565 K571	E565-G569 WeakPolarHBondContact O-CA 2.81Å; E565-G569 PolarHBondContact O-N 3.16Å; G569-K571 VanDerWaalsContact C-N 3.31Å
570	A	88.6	Confident	88.6	Confident	14 Å²	14	39.2 Å²	39.2	12%	0.116	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-17.6	169.3	0	0	0	0	0	113.2	H561 R566 C567 I568 D572 P605	H561-A570 WeakPolarHBondContact CE1-CB 3.24Å; H561-A570 WeakPolarHBondContact ND1-CB 3.35Å; R566-A570 VanDerWaalsContact O-CB 3.24Å; R566-A570 WeakPolarHBondContact O-CB 3.42Å; R566-A570 PolarHBondContact O-N 3.49Å; C567-A570 PolarHBondContact O-N 2.95Å; I568-A570 PolarHBondContact O-N 3.49Å; A570-D572 PolarHBondContact O-N 2.98Å; A570-P605 VanDerWaalsContact O-CG 3.27Å; A570-P605 WeakPolarHBondContact O-CG 3.28Å
571	K	90.4	Very high	88.5	Confident	26 Å²	26	39.8 Å²	39.8	11%	0.113	22%	0.215	C	C	.	.			trans	45.6	31.2	176.1	-51.3	-166.5	-178.1	-163.9	0	114.8	I568 G569 P573 D602 G603 P605	I568-K571 WeakPolarHBondContact O-CG 3.17Å; I568-K571 PolarHBondContact O-N 2.85Å; G569-K571 VanDerWaalsContact C-N 3.31Å; K571-P573 WeakPolarHBondContact O-CD 3.43Å; K571-D602 WeakPolarHBondContact CE-OD1 3.37Å; K571-D602 PolarHBondContact NZ-O 3.34Å; K571-D602 IonicContact NZ-OD1 2.73Å; K571-D602 PolarHBondContact NZ-OD1 3.03Å; K571-G603 WeakPolarHBondContact CD-O 3.4Å; K571-P605 HydrophobicContact CB-CG 4.24Å
572	D	91.9	Very high	88.6	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	24%	0.242	C	C	.	.			trans	-77.4	119.7	177.1	-179.7	-1.7	0	0	0	108.8	K503 L516 A570 Y574 C575 Q599	K503-D572 WeakPolarHBondContact CE-OD1 3.31Å; K503-D572 IonicContact NZ-OD1 2.83Å; K503-D572 PolarHBondContact NZ-OD1 3.25Å; K503-D572 VanDerWaalsContact NZ-OD1 3.16Å; K503-D572 IonicContact NZ-OD2 2.85Å; K503-D572 PolarHBondContact NZ-OD2 2.6Å; L516-D572 HydrophobicContact CD1-CB 4.43Å; A570-D572 PolarHBondContact O-N 2.98Å; D572-Y574 PolarHBondContact O-N 2.82Å; D572-Y574 WeakPolarHBondContact OD1-CD2 3.42Å; D572-Y574 PolarHBondContact OD1-N 2.89Å; D572-C575 HydrophobicContact CB-CB 4.14Å; D572-C575 PolarHBondContact O-N 2.83Å; D572-C575 PolarHBondContact OD2-SG 2.9Å; D572-C575 VanDerWaalsContact OD2-SG 3.41Å; D572-Q599 PolarHBondContact O-NE2 3.22Å
573	P	92.5	Very high	89	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-22.9	-179.9	-28.6	37.4	0	0	0	114.8	V481 V483 A489 V491 K571 Q599 I601	V481-P573 HydrophobicContact CB-CB 4.11Å; V481-P573 HydrophobicContact CG1-CB 3.97Å; V481-P573 HydrophobicContact CG2-CB 4.47Å; V483-P573 HydrophobicContact CG2-CB 4.07Å; A489-P573 HydrophobicContact CB-CB 4.06Å; A489-P573 HydrophobicContact CB-CG 3.94Å; V491-P573 HydrophobicContact CG2-CB 3.95Å; V491-P573 HydrophobicContact CG2-CG 3.78Å; K571-P573 WeakPolarHBondContact O-CD 3.43Å; P573-Q599 VanDerWaalsContact C-NE2 3.3Å; P573-Q599 PolarHBondContact O-NE2 2.88Å; P573-I601 HydrophobicContact CB-CD1 3.94Å; P573-I601 HydrophobicContact CG-CD1 3.94Å
574	Y	92.1	Very high	89.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-14.9	175.3	-57.2	-62.3	0	0	0	115.1	D479 V481 V491 F493 L555 D572 A586 T587	D479-Y574 WeakPolarHBondContact CB-OH 3.05Å; D479-Y574 WeakPolarHBondContact OD2-CE1 3.18Å; D479-Y574 PolarHBondContact OD2-OH 3.36Å; V481-Y574 HydrophobicContact CB-CE1 4.49Å; V481-Y574 HydrophobicContact CG1-CD1 4.11Å; V481-Y574 HydrophobicContact CG1-CE1 4.3Å; V481-Y574 HydrophobicContact CG2-CD1 3.95Å; V481-Y574 HydrophobicContact CG2-CE1 3.35Å; V491-Y574 HydrophobicContact CB-CE2 4.07Å; V491-Y574 HydrophobicContact CG1-CE2 3.81Å; V491-Y574 HydrophobicContact CG2-CE2 3.97Å; F493-Y574 AromaticContact CZ-CE2 3.92Å; F493-Y574 HydrophobicContact CZ-CE2 3.92Å; L555-Y574 HydrophobicContact CB-CD2 4.28Å; L555-Y574 HydrophobicContact CB-CE1 4.33Å; L555-Y574 HydrophobicContact CB-CE2 3.75Å; L555-Y574 HydrophobicContact CD1-CE1 4.27Å; D572-Y574 PolarHBondContact O-N 2.82Å; D572-Y574 WeakPolarHBondContact OD1-CD2 3.42Å; D572-Y574 PolarHBondContact OD1-N 2.89Å; Y574-A586 CarbonylContact O-C 3.54Å; Y574-A586 VanDerWaalsContact O-CA 3.22Å; Y574-A586 WeakPolarHBondContact O-CA 3.45Å; Y574-T587 PolarHBondContact O-N 3.3Å
575	C	92.2	Very high	89.3	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.02	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	141.4	-166.7	-60.8	0	0	0	0	113.7	C558 D572 T585 Q599	C558-C575 WeakPolarHBondContact CA-SG 3.43Å; C558-C575 HydrophobicContact CB-CB 3.77Å; C558-C575 WeakPolarHBondContact CB-SG 3.29Å; C558-C575 WeakPolarHBondContact SG-CA 3.36Å; C558-C575 WeakPolarHBondContact SG-CB 3.28Å; C558-C575 CovalentContact SG-SG 2.04Å; C558-C575 PolarHBondContact SG-SG 2.74Å; D572-C575 HydrophobicContact CB-CB 4.14Å; D572-C575 PolarHBondContact O-N 2.83Å; D572-C575 PolarHBondContact OD2-SG 2.9Å; D572-C575 VanDerWaalsContact OD2-SG 3.41Å; C575-T585 WeakPolarHBondContact CA-O 3.26Å; C575-Q599 WeakPolarHBondContact O-CG 3.4Å; C575-Q599 PolarHBondContact O-NE2 3.26Å
576	G	90.6	Very high	89.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	162.8	173.6	0	0	0	0	0	111.3	C567 C584 T585 W597 V598	C567-G576 PolarHBondContact SG-O 3.34Å; G576-C584 CarbonylContact O-C 3.43Å; G576-C584 WeakPolarHBondContact O-CA 3.13Å; G576-T585 PolarHBondContact N-O 2.99Å; G576-T585 PolarHBondContact O-N 2.82Å; G576-W597 PolarHBondContact O-NE1 3.07Å; G576-V598 CarbonylContact C-O 3.54Å; G576-V598 WeakPolarHBondContact CA-O 3.22Å
577	W	90.9	Very high	89	Confident	20 Å²	20	39 Å²	39	8%	0.076	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.5	-175.4	-175.7	-104.3	0	0	0	110.6	E564 C567 I568 K582 C584 W597 V598	E564-W577 HydrophobicContact CB-CD2 3.82Å; E564-W577 HydrophobicContact CB-CE3 4.46Å; E564-W577 HydrophobicContact CB-CG 3.96Å; E564-W577 HydrophobicContact CB-CZ2 4.08Å; E564-W577 VanDerWaalsContact CD-NE1 3.34Å; E564-W577 HydrophobicContact CG-CB 4.28Å; E564-W577 HydrophobicContact CG-CD2 4.16Å; E564-W577 HydrophobicContact CG-CG 3.72Å; E564-W577 PolarHBondContact OE2-NE1 2.81Å; C567-W577 HydrophobicContact CB-CB 4.25Å; C567-W577 HydrophobicContact CB-CE3 3.85Å; C567-W577 PolarHBondContact SG-N 2.81Å; C567-W577 VanDerWaalsContact SG-N 3.43Å; I568-W577 HydrophobicContact CG1-CB 4.3Å; W577-K582 VanDerWaalsContact CH2-C 3.46Å; W577-K582 VanDerWaalsContact CH2-O 3.25Å; W577-K582 WeakPolarHBondContact CH2-O 3.4Å; W577-K582 VanDerWaalsContact CZ2-C 3.5Å; W577-K582 HydrophobicContact CZ2-CB 4.24Å; W577-C584 HydrophobicContact CE3-CB 4.06Å; W577-C584 VanDerWaalsContact CE3-N 3.31Å; W577-C584 HydrophobicContact CZ3-CB 4.4Å; W577-W597 WeakPolarHBondContact O-CA 3.39Å; W577-V598 PolarHBondContact N-O 3.4Å; W577-V598 PolarHBondContact O-N 2.94Å
578	S	89.3	Confident	87.8	Confident	4 Å²	4	49.2 Å²	49.2	3%	0.028	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111	169.1	171.4	0	0	0	0	108.4	A580 T581 K582 R583 D594	S578-A580 VanDerWaalsContact C-N 3.28Å; S578-A580 PolarHBondContact O-N 2.77Å; S578-T581 VanDerWaalsContact CB-OG1 3.24Å; S578-T581 WeakPolarHBondContact CB-OG1 3.46Å; S578-T581 PolarHBondContact O-N 2.9Å; S578-T581 PolarHBondContact OG-N 2.69Å; S578-T581 PolarHBondContact OG-OG1 3.36Å; S578-T581 VanDerWaalsContact OG-OG1 3.09Å; S578-K582 WeakPolarHBondContact O-CA 3.39Å; S578-K582 PolarHBondContact O-N 3.27Å; S578-R583 PolarHBondContact N-O 2.93Å; S578-R583 PolarHBondContact O-N 2.7Å; S578-D594 PolarHBondContact OG-OD2 3.34Å
579	R	87.1	Confident	86.2	Confident	124 Å²	124	48.8 Å²	48.8	47%	0.468	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-32.6	177.2	-57.3	173.7	162.7	159.4	0.9	111.4	E564 T581 K582 E596	E564-R579 IonicContact OE1-CZ 3.92Å; E564-R579 IonicContact OE1-NE 3.13Å; E564-R579 PolarHBondContact OE1-NE 2.84Å; E564-R579 IonicContact OE1-NH2 3.15Å; E564-R579 PolarHBondContact OE1-NH2 2.86Å; R579-T581 VanDerWaalsContact C-N 3.31Å; R579-T581 PolarHBondContact O-N 3.27Å; R579-K582 VanDerWaalsContact O-CG 3.31Å; R579-K582 WeakPolarHBondContact O-CG 3.38Å; R579-K582 PolarHBondContact O-N 3.13Å; R579-E596 HydrophobicContact CB-CB 4.06Å; R579-E596 PolarHBondContact N-O 3.25Å
580	A	83.6	Confident	84.2	Confident	67 Å²	67	53.9 Å²	53.9	55%	0.554	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-43.3	174.1	0	0	0	0	0	112.4	S578 E596	S578-A580 VanDerWaalsContact C-N 3.28Å; S578-A580 PolarHBondContact O-N 2.77Å; A580-E596 VanDerWaalsContact CA-OE2 3.27Å; A580-E596 WeakPolarHBondContact CA-OE2 3.43Å; A580-E596 WeakPolarHBondContact CB-OE2 3.22Å; A580-E596 PolarHBondContact N-OE2 2.68Å
581	T	85.9	Confident	82.3	Confident	76 Å²	76	61.1 Å²	61.1	47%	0.466	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-8.1	179.7	63.1	0	0	0	0	114.4	S578 R579 R583	S578-T581 VanDerWaalsContact CB-OG1 3.24Å; S578-T581 WeakPolarHBondContact CB-OG1 3.46Å; S578-T581 PolarHBondContact O-N 2.9Å; S578-T581 PolarHBondContact OG-N 2.69Å; S578-T581 PolarHBondContact OG-OG1 3.36Å; S578-T581 VanDerWaalsContact OG-OG1 3.09Å; R579-T581 VanDerWaalsContact C-N 3.31Å; R579-T581 PolarHBondContact O-N 3.27Å; T581-R583 WeakPolarHBondContact O-CG 3.49Å; T581-R583 PolarHBondContact O-N 2.79Å
582	K	89.4	Confident	80.6	Confident	162 Å²	162	62 Å²	62	70%	0.704	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	43.5	-173	-58.9	-174.9	-179.3	180	0	112.7	W577 S578 R579	W577-K582 VanDerWaalsContact CH2-C 3.46Å; W577-K582 VanDerWaalsContact CH2-O 3.25Å; W577-K582 WeakPolarHBondContact CH2-O 3.4Å; W577-K582 VanDerWaalsContact CZ2-C 3.5Å; W577-K582 HydrophobicContact CZ2-CB 4.24Å; S578-K582 WeakPolarHBondContact O-CA 3.39Å; S578-K582 PolarHBondContact O-N 3.27Å; R579-K582 VanDerWaalsContact O-CG 3.31Å; R579-K582 WeakPolarHBondContact O-CG 3.38Å; R579-K582 PolarHBondContact O-N 3.13Å
583	R	91.4	Very high	78.8	Confident	178 Å²	178	66.9 Å²	66.9	67%	0.672	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	148.7	-177.9	-71	176.5	-175.1	-173.6	1.3	110.5	S578 T581 T585	S578-R583 PolarHBondContact N-O 2.93Å; S578-R583 PolarHBondContact O-N 2.7Å; T581-R583 WeakPolarHBondContact O-CG 3.49Å; T581-R583 PolarHBondContact O-N 2.79Å; R583-T585 HydrophobicContact CB-CG2 4.31Å; R583-T585 PolarHBondContact O-N 2.99Å
584	C	91.1	Very high	77.2	Confident	9 Å²	9	68.5 Å²	68.5	6%	0.061	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	117.4	166.2	-163	0	0	0	0	109	C558 H561 C567 G576 W577	C558-C584 HydrophobicContact CB-CB 4.43Å; C558-C584 VanDerWaalsContact O-CB 3.28Å; C558-C584 WeakPolarHBondContact O-CB 3.46Å; H561-C584 HydrophobicContact CB-CB 3.88Å; H561-C584 VanDerWaalsContact O-CB 3.26Å; H561-C584 WeakPolarHBondContact O-CB 3.33Å; C567-C584 HydrophobicContact CB-CB 3.55Å; C567-C584 WeakPolarHBondContact CB-SG 3.44Å; C567-C584 VanDerWaalsContact SG-CA 3.5Å; C567-C584 WeakPolarHBondContact SG-CB 3.45Å; C567-C584 CovalentContact SG-SG 2.03Å; C567-C584 PolarHBondContact SG-SG 2.72Å; G576-C584 CarbonylContact O-C 3.43Å; G576-C584 WeakPolarHBondContact O-CA 3.13Å; W577-C584 HydrophobicContact CE3-CB 4.06Å; W577-C584 VanDerWaalsContact CE3-N 3.31Å; W577-C584 HydrophobicContact CZ3-CB 4.4Å
585	T	90.6	Very high	75.7	Confident	43 Å²	43	77.4 Å²	77.4	26%	0.264	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	158.6	-175.4	58.1	0	0	0	0	110.7	C575 G576 R583 W597	C575-T585 WeakPolarHBondContact CA-O 3.26Å; G576-T585 PolarHBondContact N-O 2.99Å; G576-T585 PolarHBondContact O-N 2.82Å; R583-T585 HydrophobicContact CB-CG2 4.31Å; R583-T585 PolarHBondContact O-N 2.99Å; T585-W597 PolarHBondContact OG1-NE1 3Å
586	A	88.2	Confident	74.9	Confident	26 Å²	26	82 Å²	82	22%	0.215	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	144.6	173.2	0	0	0	0	0	110.7	E556 Y574 R588	E556-A586 HydrophobicContact CB-CB 4.5Å; E556-A586 HydrophobicContact CG-CB 3.88Å; Y574-A586 CarbonylContact O-C 3.54Å; Y574-A586 VanDerWaalsContact O-CA 3.22Å; Y574-A586 WeakPolarHBondContact O-CA 3.45Å; A586-R588 PolarHBondContact O-N 3.03Å
587	T	76.7	Confident	74.5	Confident	20 Å²	20	82.9 Å²	82.9	12%	0.123	42%	0.421	C	S	.	.			trans	-58.3	126.6	167.1	178.6	0	0	0	0	109.9	Y574 G589	Y574-T587 PolarHBondContact O-N 3.3Å; T587-G589 PolarHBondContact O-N 3.12Å; T587-G589 PolarHBondContact OG1-N 2.73Å
588	R	64.1	Low	74.3	Confident	215 Å²	215	83.8 Å²	83.8	81%	0.811	43%	0.428	S	S	*	.			trans	-89.2	14.5	176.1	-69	-178.2	169.7	-179.4	-2.2	112.7	A586 D592	A586-R588 PolarHBondContact O-N 3.03Å; R588-D592 HydrophobicContact CB-CB 4.45Å; R588-D592 WeakPolarHBondContact CD-OD2 3.32Å
589	G	55.5	Low	74.2	Confident	25 Å²	25	85.2 Å²	85.2	26%	0.258	44%	0.435	S	S	.	.			trans	89.7	-178.6	-174	0	0	0	0	0	112.6	T587 L591	T587-G589 PolarHBondContact O-N 3.12Å; T587-G589 PolarHBondContact OG1-N 2.73Å; G589-L591 PolarHBondContact O-N 2.89Å
590	P	47	Very low	74.1	Confident	117 Å²	117	83.1 Å²	83.1	76%	0.76	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-3	-169.3	26.5	-35.3	0	0	0	115.4
591	L	48.9	Very low	74.1	Confident	165 Å²	165	80.2 Å²	80.2	86%	0.864	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	12.1	-172.5	-67.6	171.4	0	0	0	114.7	G589 P593	G589-L591 PolarHBondContact O-N 2.89Å; L591-P593 VanDerWaalsContact O-CD 3.26Å; L591-P593 WeakPolarHBondContact O-CD 3.47Å
592	D	53.2	Low	73.8	Confident	45 Å²	45	81.1 Å²	81.1	24%	0.241	41%	0.409	C	S	.	.			trans	-81.7	112.1	176.5	-155.6	-32.4	0	0	0	111.3	R484 R588 D594	R484-D592 PolarHBondContact NH2-O 3.38Å; R588-D592 HydrophobicContact CB-CB 4.45Å; R588-D592 WeakPolarHBondContact CD-OD2 3.32Å; D592-D594 PolarHBondContact O-N 3.45Å; D592-D594 VanDerWaalsContact O-N 3.13Å; D592-D594 PolarHBondContact OD1-N 2.93Å
593	P	54.4	Low	73.3	Confident	106 Å²	106	74.5 Å²	74.5	69%	0.688	39%	0.387	S	S	*	.			trans	-75.6	8.1	-178.6	34.3	-37.6	0	0	0	113.7	L591 H595	L591-P593 VanDerWaalsContact O-CD 3.26Å; L591-P593 WeakPolarHBondContact O-CD 3.47Å; P593-H595 VanDerWaalsContact C-N 3.32Å; P593-H595 PolarHBondContact O-CD2 3.34Å; P593-H595 PolarHBondContact O-N 3.21Å
594	D	59.9	Low	73	Confident	33 Å²	33	68.8 Å²	68.8	18%	0.176	37%	0.374	C	S	.	.			trans	-63.9	90.9	171.3	-166.8	2.5	0	0	0	110.5	R484 S578 D592 E596 W597	R484-D594 PolarHBondContact NH1-O 3.01Å; R484-D594 VanDerWaalsContact NH1-O 3.09Å; S578-D594 PolarHBondContact OG-OD2 3.34Å; D592-D594 PolarHBondContact O-N 3.45Å; D592-D594 VanDerWaalsContact O-N 3.13Å; D592-D594 PolarHBondContact OD1-N 2.93Å; D594-E596 PolarHBondContact O-N 3.22Å; D594-E596 WeakPolarHBondContact OD1-CA 3.26Å; D594-E596 VanDerWaalsContact OD1-CB 3.25Å; D594-E596 WeakPolarHBondContact OD1-CB 3.42Å; D594-E596 PolarHBondContact OD1-N 3.16Å; D594-W597 HydrophobicContact CB-CB 4.08Å; D594-W597 WeakPolarHBondContact O-CB 3.2Å; D594-W597 PolarHBondContact O-N 2.84Å; D594-W597 VanDerWaalsContact O-N 3.16Å; D594-W597 PolarHBondContact OD1-N 3.46Å
595	H	60.7	Low	72.6	Confident	188 Å²	188	69 Å²	69	87%	0.87	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.7	168.5	-72.2	-75.9	0	0	0	112.1	P593	P593-H595 VanDerWaalsContact C-N 3.32Å; P593-H595 PolarHBondContact O-CD2 3.34Å; P593-H595 PolarHBondContact O-N 3.21Å
596	E	73.9	Confident	71.5	Confident	100 Å²	100	71.3 Å²	71.3	47%	0.467	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	5.7	175.1	-50.5	-164.3	160.2	0	0	113.6	R579 A580 D594	R579-E596 HydrophobicContact CB-CB 4.06Å; R579-E596 PolarHBondContact N-O 3.25Å; A580-E596 VanDerWaalsContact CA-OE2 3.27Å; A580-E596 WeakPolarHBondContact CA-OE2 3.43Å; A580-E596 WeakPolarHBondContact CB-OE2 3.22Å; A580-E596 PolarHBondContact N-OE2 2.68Å; D594-E596 PolarHBondContact O-N 3.22Å; D594-E596 WeakPolarHBondContact OD1-CA 3.26Å; D594-E596 VanDerWaalsContact OD1-CB 3.25Å; D594-E596 WeakPolarHBondContact OD1-CB 3.42Å; D594-E596 PolarHBondContact OD1-N 3.16Å
597	W	83.6	Confident	70.1	Confident	18 Å²	18	72 Å²	72	7%	0.068	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	112.4	173.4	-164.7	90.6	0	0	0	111.4	G576 W577 T585 D594 Q599	G576-W597 PolarHBondContact O-NE1 3.07Å; W577-W597 WeakPolarHBondContact O-CA 3.39Å; T585-W597 PolarHBondContact OG1-NE1 3Å; D594-W597 HydrophobicContact CB-CB 4.08Å; D594-W597 WeakPolarHBondContact O-CB 3.2Å; D594-W597 PolarHBondContact O-N 2.84Å; D594-W597 VanDerWaalsContact O-N 3.16Å; D594-W597 PolarHBondContact OD1-N 3.46Å; W597-Q599 HydrophobicContact CE3-CB 4.16Å; W597-Q599 HydrophobicContact CH2-CB 3.81Å; W597-Q599 HydrophobicContact CH2-CG 4.21Å; W597-Q599 HydrophobicContact CZ3-CB 3.45Å; W597-Q599 VanDerWaalsContact CZ3-CB 3.45Å; W597-Q599 HydrophobicContact CZ3-CG 4.25Å
598	V	86.4	Confident	69.4	Low	39 Å²	39	80.6 Å²	80.6	24%	0.236	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.6	-172.8	-175.9	0	0	0	0	111.1	I568 G576 W577	I568-V598 HydrophobicContact CD1-CB 4.39Å; I568-V598 HydrophobicContact CD1-CG1 3.81Å; G576-V598 CarbonylContact C-O 3.54Å; G576-V598 WeakPolarHBondContact CA-O 3.22Å; W577-V598 PolarHBondContact N-O 3.4Å; W577-V598 PolarHBondContact O-N 2.94Å
599	Q	87.3	Confident	69.3	Low	34 Å²	34	72.5 Å²	72.5	16%	0.159	39%	0.39	C	S	.	.			trans	-136.8	150.8	173.5	-177.5	179.6	44.9	0	0	108.4	D572 P573 C575 W597 I601	D572-Q599 PolarHBondContact O-NE2 3.22Å; P573-Q599 VanDerWaalsContact C-NE2 3.3Å; P573-Q599 PolarHBondContact O-NE2 2.88Å; C575-Q599 WeakPolarHBondContact O-CG 3.4Å; C575-Q599 PolarHBondContact O-NE2 3.26Å; W597-Q599 HydrophobicContact CE3-CB 4.16Å; W597-Q599 HydrophobicContact CH2-CB 3.81Å; W597-Q599 HydrophobicContact CH2-CG 4.21Å; W597-Q599 HydrophobicContact CZ3-CB 3.45Å; W597-Q599 VanDerWaalsContact CZ3-CB 3.45Å; W597-Q599 HydrophobicContact CZ3-CG 4.25Å; Q599-I601 HydrophobicContact CG-CD1 4.19Å; Q599-I601 HydrophobicContact CG-CG1 3.93Å
600	L	85.4	Confident	69.6	Low	79 Å²	79	74.5 Å²	74.5	41%	0.414	40%	0.398	S	S	.	.			trans	-141.3	124.1	177	-171.7	71.1	0	0	0	108.8	I568 D602	I568-L600 HydrophobicContact CG2-CB 3.59Å; I568-L600 HydrophobicContact CG2-CD2 4.27Å; L600-D602 WeakPolarHBondContact CD2-OD1 3.4Å; L600-D602 VanDerWaalsContact CG-OD1 3.27Å; L600-D602 WeakPolarHBondContact CG-OD1 3.49Å
601	I	83.5	Confident	70.5	Confident	7 Å²	7	70.7 Å²	70.7	4%	0.036	37%	0.372	C	S	.	.			trans	-134.5	69.8	-179.1	-37.9	-168.8	0	0	0	108.9	V483 L507 P573 Q599	V483-I601 HydrophobicContact CB-CD1 4.23Å; V483-I601 HydrophobicContact CG1-CD1 3.5Å; V483-I601 VanDerWaalsContact CG1-CD1 3.5Å; V483-I601 HydrophobicContact CG1-CG1 3.92Å; V483-I601 HydrophobicContact CG2-CD1 3.65Å; L507-I601 HydrophobicContact CD1-CG2 4.08Å; L507-I601 WeakPolarHBondContact CD1-O 3.45Å; L507-I601 HydrophobicContact CD2-CG2 4.26Å; L507-I601 HydrophobicContact CG-CG2 4.48Å; P573-I601 HydrophobicContact CB-CD1 3.94Å; P573-I601 HydrophobicContact CG-CD1 3.94Å; Q599-I601 HydrophobicContact CG-CD1 4.19Å; Q599-I601 HydrophobicContact CG-CG1 3.93Å
602	D	78.4	Confident	71.8	Confident	94 Å²	94	67.2 Å²	67.2	50%	0.503	35%	0.351	S	S	.	.	S	Bend	trans	-118.3	79.4	-179.1	58.8	-12.5	0	0	0	110.3	K571 L600	K571-D602 WeakPolarHBondContact CE-OD1 3.37Å; K571-D602 PolarHBondContact NZ-O 3.34Å; K571-D602 IonicContact NZ-OD1 2.73Å; K571-D602 PolarHBondContact NZ-OD1 3.03Å; L600-D602 WeakPolarHBondContact CD2-OD1 3.4Å; L600-D602 VanDerWaalsContact CG-OD1 3.27Å; L600-D602 WeakPolarHBondContact CG-OD1 3.49Å
603	G	78.3	Confident	73.1	Confident	24 Å²	24	65.6 Å²	65.6	25%	0.247	35%	0.346	C	S	.	.	S	Bend	trans	87.6	-177.1	-170.6	0	0	0	0	0	114.1	E510 K571	E510-G603 WeakPolarHBondContact OE1-CA 3.45Å; E510-G603 PolarHBondContact OE1-N 3.44Å; K571-G603 WeakPolarHBondContact CD-O 3.4Å
604	C	86	Confident	74.4	Confident	57 Å²	57	66.4 Å²	66.4	39%	0.385	34%	0.34	S	S	.	.	S	Bend	trans	-75.1	158.8	-172.9	-59.4	0	0	0	0	115.3	C514 T606	C514-C604 WeakPolarHBondContact CA-SG 3.49Å; C514-C604 HydrophobicContact CB-CB 3.63Å; C514-C604 WeakPolarHBondContact CB-SG 3.31Å; C514-C604 WeakPolarHBondContact SG-CA 3.17Å; C514-C604 WeakPolarHBondContact SG-CB 3.42Å; C514-C604 PolarHBondContact SG-N 3.41Å; C514-C604 CovalentContact SG-SG 2.04Å; C514-C604 PolarHBondContact SG-SG 3.03Å; C604-T606 PolarHBondContact O-N 3.35Å
605	P	83.2	Confident	75.8	Confident	15 Å²	15	67.3 Å²	67.3	10%	0.097	34%	0.342	C	S	.	.			trans	-61	131.2	174.8	-19.3	29.8	0	0	0	112.5	L516 A570 K571 M607	L516-P605 HydrophobicContact CD2-CG 3.62Å; A570-P605 VanDerWaalsContact O-CG 3.27Å; A570-P605 WeakPolarHBondContact O-CG 3.28Å; K571-P605 HydrophobicContact CB-CG 4.24Å; P605-M607 HydrophobicContact CB-SD 3.75Å; P605-M607 PolarHBondContact O-N 2.7Å; P605-M607 VanDerWaalsContact O-N 3.07Å
606	T	66.8	Low	76.8	Confident	90 Å²	90	58.8 Å²	58.8	55%	0.552	31%	0.305	S	S	*	.			trans	-83.4	83.3	177	52.8	0	0	0	0	110.6	C604 R608 F609	C604-T606 PolarHBondContact O-N 3.35Å; T606-R608 PolarHBondContact O-N 3.13Å; T606-F609 WeakPolarHBondContact O-CD2 3.35Å; T606-F609 WeakPolarHBondContact O-CE2 3.3Å; T606-F609 WeakPolarHBondContact O-CZ 3.4Å
607	M	58.8	Low	77.5	Confident	42 Å²	42	59.6 Å²	59.6	21%	0.207	32%	0.318	C	S	.	.			trans	-59.7	-20.4	-169.8	-60.4	-51.9	-42.4	0	0	116.1	S68 L69 P605 F609	S68-M607 WeakPolarHBondContact OG-CE 3.42Å; L69-M607 HydrophobicContact CB-CE 3.79Å; L69-M607 HydrophobicContact CD1-CE 4.19Å; L69-M607 HydrophobicContact CD1-CG 4.07Å; L69-M607 HydrophobicContact CD1-SD 4.21Å; L69-M607 HydrophobicContact CD2-CE 3.69Å; L69-M607 HydrophobicContact CD2-SD 3.81Å; L69-M607 HydrophobicContact CG-CE 4.09Å; L69-M607 HydrophobicContact CG-SD 4.48Å; P605-M607 HydrophobicContact CB-SD 3.75Å; P605-M607 PolarHBondContact O-N 2.7Å; P605-M607 VanDerWaalsContact O-N 3.07Å; M607-F609 PolarHBondContact O-N 3.28Å
608	R	62.2	Low	77.7	Confident	199 Å²	199	62.1 Å²	62.1	75%	0.751	33%	0.328	S	S	*	.			trans	-79.6	51	-177.9	-59.3	-173.5	-177	174.2	3.5	113.4	T606 F648	T606-R608 PolarHBondContact O-N 3.13Å; R608-F648 HydrophobicContact CB-CB 4.06Å; R608-F648 HydrophobicContact CB-CD1 3.8Å; R608-F648 HydrophobicContact CB-CD2 4.41Å; R608-F648 HydrophobicContact CB-CE1 4.32Å; R608-F648 HydrophobicContact CB-CG 3.85Å; R608-F648 HydrophobicContact CG-CD1 3.76Å; R608-F648 HydrophobicContact CG-CE1 3.85Å; R608-F648 HydrophobicContact CG-CG 4.29Å; R608-F648 HydrophobicContact CG-CZ 4.42Å; R608-F648 WeakPolarHBondContact O-CB 3.4Å
609	F	61.8	Low	77.7	Confident	46 Å²	46	62.2 Å²	62.2	20%	0.202	33%	0.331	C	S	.	.			trans	-66.9	135.4	172.5	-66.2	-76	0	0	0	110.8	T606 M607 V611 F648	T606-F609 WeakPolarHBondContact O-CD2 3.35Å; T606-F609 WeakPolarHBondContact O-CE2 3.3Å; T606-F609 WeakPolarHBondContact O-CZ 3.4Å; M607-F609 PolarHBondContact O-N 3.28Å; F609-V611 PolarHBondContact O-N 3.09Å; F609-F648 WeakPolarHBondContact O-CD2 3.48Å
610	P	62.7	Low	77.8	Confident	67 Å²	67	68.2 Å²	68.2	44%	0.435	36%	0.359	S	S	.	.			trans	-54.6	111.5	175.3	-27.3	35.3	0	0	0	112.1	H612 F648	P610-H612 PolarHBondContact O-N 2.82Å; P610-F648 WeakPolarHBondContact CA-O 3.47Å
611	V	65	Low	77.7	Confident	36 Å²	36	68.6 Å²	68.6	22%	0.218	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-90.8	104.1	173.9	-179.4	0	0	0	0	106.9	F609 P644 P646 K647 F648 G650	F609-V611 PolarHBondContact O-N 3.09Å; V611-P644 HydrophobicContact CG1-CB 4.02Å; V611-P644 HydrophobicContact CG1-CG 3.66Å; V611-P646 VanDerWaalsContact O-CA 3.27Å; V611-P646 WeakPolarHBondContact O-CA 3.48Å; V611-K647 HydrophobicContact CB-CB 4.04Å; V611-K647 HydrophobicContact CG2-CB 4.23Å; V611-K647 PolarHBondContact N-O 3.25Å; V611-K647 PolarHBondContact O-N 2.82Å; V611-F648 HydrophobicContact CG2-CD2 4.36Å; V611-G650 WeakPolarHBondContact O-CA 3.46Å
612	H	77.3	Confident	77.7	Confident	92 Å²	92	72 Å²	72	43%	0.426	38%	0.376	S	S	.	.			trans	-63.8	133.7	174	-59.7	-73.5	0	0	0	110.5	P610 R651	P610-H612 PolarHBondContact O-N 2.82Å; H612-R651 WeakPolarHBondContact ND1-CB 3.18Å; H612-R651 WeakPolarHBondContact ND1-CG 3.32Å; H612-R651 PolarHBondContact ND1-N 2.78Å
613	G	80.4	Confident	77.7	Confident	12 Å²	12	72 Å²	72	12%	0.124	38%	0.379	C	S	.	.			trans	-63.8	134.6	174.1	0	0	0	0	0	111.4	P644 R651	G613-P644 CarbonylContact C-O 3.56Å; G613-P644 VanDerWaalsContact CA-O 3.29Å; G613-P644 WeakPolarHBondContact CA-O 3.47Å; G613-R651 PolarHBondContact N-O 2.89Å
614	Q	81.3	Confident	77.6	Confident	123 Å²	123	71.5 Å²	71.5	58%	0.575	37%	0.372	S	S	*	.			trans	-121.6	143.6	165.6	-57.8	177.3	22.6	0	0	109.6	D642 S643 P644 C653	Q614-D642 PolarHBondContact O-N 2.04Å; Q614-S643 WeakPolarHBondContact CB-O 3.16Å; Q614-S643 PolarHBondContact O-N 2.73Å; Q614-S643 VanDerWaalsContact O-N 3.08Å; Q614-P644 PolarHBondContact N-O 2.91Å; Q614-C653 PolarHBondContact N-SG 2.99Å; Q614-C653 VanDerWaalsContact N-SG 3.42Å
615	Y	87.8	Confident	76.8	Confident	51 Å²	51	74.9 Å²	74.9	20%	0.2	40%	0.396	C	S	.	.			trans	-70.9	133.5	176.9	-82.9	-61.7	0	0	0	110.6	R639 N640 C641 C653 E654 G655	Y615-R639 HydrophobicContact CD1-CB 4.26Å; Y615-R639 HydrophobicContact CD1-CG 3.54Å; Y615-R639 HydrophobicContact CE1-CG 3.92Å; Y615-R639 VanDerWaalsContact CE2-NH2 3.33Å; Y615-R639 HydrophobicContact CG-CG 4.07Å; Y615-N640 WeakPolarHBondContact CA-O 3.37Å; Y615-N640 WeakPolarHBondContact CD1-O 3.46Å; Y615-C641 HydrophobicContact CD1-CB 4.39Å; Y615-C641 HydrophobicContact CE1-CB 4.24Å; Y615-C653 HydrophobicContact CD1-CB 4.06Å; Y615-C653 HydrophobicContact CD2-CB 3.6Å; Y615-C653 HydrophobicContact CE1-CB 3.86Å; Y615-C653 HydrophobicContact CE2-CB 3.38Å; Y615-C653 HydrophobicContact CG-CB 3.95Å; Y615-E654 WeakPolarHBondContact CE2-O 3.38Å; Y615-G655 PolarHBondContact OH-O 3.29Å
616	G	83.3	Confident	75.7	Confident	9 Å²	9	84.4 Å²	84.4	9%	0.093	43%	0.43	C	S	.	.			trans	-65.3	175.8	164.1	0	0	0	0	0	112.4	N640 S643	G616-N640 PolarHBondContact N-O 2.64Å; G616-S643 VanDerWaalsContact CA-CB 3.48Å; G616-S643 WeakPolarHBondContact CA-OG 3.45Å
617	P	87.2	Confident	75.2	Confident	117 Å²	117	88.6 Å²	88.6	76%	0.76	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-56.5	150.2	173.6	26.3	-34.6	0	0	0	110.9
618	W	87.8	Confident	75.1	Confident	71 Å²	71	88 Å²	88	27%	0.269	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-64.3	145	168.8	-71.6	107.4	0	0	0	110.6	R637 R639 E659	W618-R637 HydrophobicContact CD2-CG 4.17Å; W618-R637 HydrophobicContact CE3-CB 4.35Å; W618-R637 HydrophobicContact CE3-CG 3.71Å; W618-R637 HydrophobicContact CZ3-CG 4.2Å; W618-R639 HydrophobicContact CD2-CB 4.12Å; W618-R639 HydrophobicContact CD2-CG 4.04Å; W618-R639 VanDerWaalsContact CE2-CD 3.5Å; W618-R639 HydrophobicContact CE3-CB 3.79Å; W618-R639 HydrophobicContact CE3-CG 3.65Å; W618-R639 HydrophobicContact CH2-CG 3.87Å; W618-R639 VanDerWaalsContact CH2-NE 3.35Å; W618-R639 HydrophobicContact CZ2-CG 4.24Å; W618-R639 HydrophobicContact CZ3-CB 4.19Å; W618-R639 HydrophobicContact CZ3-CG 3.57Å; W618-E659 HydrophobicContact CH2-CB 3.62Å; W618-E659 HydrophobicContact CZ2-CB 4.17Å; W618-E659 WeakPolarHBondContact CZ2-OE2 3.24Å; W618-E659 HydrophobicContact CZ3-CB 3.82Å
619	S	88.1	Confident	74.8	Confident	42 Å²	42	84.8 Å²	84.8	29%	0.294	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-62.5	163	163.8	76.2	0	0	0	0	111	R637 V638	S619-R637 WeakPolarHBondContact O-CB 3.32Å; S619-R637 WeakPolarHBondContact OG-CA 3.19Å; S619-V638 WeakPolarHBondContact CB-O 3.32Å; S619-V638 PolarHBondContact N-O 2.81Å; S619-V638 PolarHBondContact OG-N 3.08Å; S619-V638 PolarHBondContact OG-O 2.87Å
620	E	87.7	Confident	74.5	Confident	159 Å²	159	89.8 Å²	89.8	74%	0.743	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-54.5	154.2	160.1	-68.1	-54.6	136.9	0	0	111.4	T622	E620-T622 PolarHBondContact O-N 3.21Å
621	W	83.4	Confident	74	Confident	87 Å²	87	88 Å²	88	33%	0.33	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-69.9	128.9	173.3	-69.8	99.4	0	0	0	109.9	L635 R637 E659 N661	W621-L635 HydrophobicContact CE3-CB 3.92Å; W621-R637 HydrophobicContact CD2-CB 4.13Å; W621-R637 HydrophobicContact CD2-CG 4.03Å; W621-R637 HydrophobicContact CE3-CB 4.02Å; W621-R637 HydrophobicContact CE3-CG 3.89Å; W621-R637 HydrophobicContact CH2-CG 3.93Å; W621-R637 HydrophobicContact CZ2-CG 4.06Å; W621-R637 HydrophobicContact CZ3-CB 4.41Å; W621-R637 HydrophobicContact CZ3-CG 3.84Å; W621-E659 HydrophobicContact CH2-CB 4.38Å; W621-E659 HydrophobicContact CH2-CG 3.93Å; W621-N661 HydrophobicContact CE3-CB 4.36Å; W621-N661 HydrophobicContact CH2-CB 3.7Å; W621-N661 HydrophobicContact CZ3-CB 3.6Å
622	T	83.7	Confident	73.7	Confident	78 Å²	78	94.7 Å²	94.7	48%	0.479	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	157.3	-179.3	55.5	0	0	0	0	110.1	E620 C624 L635 C636	E620-T622 PolarHBondContact O-N 3.21Å; T622-C624 PolarHBondContact O-N 2.96Å; T622-L635 CarbonylContact O-C 3.51Å; T622-L635 WeakPolarHBondContact O-CA 3.28Å; T622-C636 PolarHBondContact N-O 2.86Å; T622-C636 PolarHBondContact O-N 3.35Å; T622-C636 PolarHBondContact OG1-O 3.33Å; T622-C636 VanDerWaalsContact OG1-O 3.06Å
623	V	79.9	Confident	73.2	Confident	96 Å²	96	95.6 Å²	95.6	58%	0.582	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	128	173.8	-178.7	0	0	0	0	109	S625 C634 L635	V623-S625 PolarHBondContact O-N 2.84Å; V623-C634 WeakPolarHBondContact CA-O 3.24Å; V623-L635 HydrophobicContact CG2-CD2 4.49Å
624	C	74.5	Confident	72.9	Confident	13 Å²	13	95.2 Å²	95.2	9%	0.088	48%	0.483	C	S	.	.			trans	-57.1	130.7	179.7	-62.5	0	0	0	0	110.8	T622 W626 C634 C636	T622-C624 PolarHBondContact O-N 2.96Å; C624-W626 PolarHBondContact O-N 3.31Å; C624-C634 HydrophobicContact CB-CB 3.98Å; C624-C634 PolarHBondContact N-O 3.09Å; C624-C636 HydrophobicContact CB-CB 4.03Å; C624-C636 WeakPolarHBondContact CB-SG 3.29Å; C624-C636 WeakPolarHBondContact SG-CB 3.36Å; C624-C636 PolarHBondContact SG-N 3.18Å; C624-C636 CovalentContact SG-SG 2.04Å; C624-C636 PolarHBondContact SG-SG 2.84Å
625	S	69.6	Low	72.9	Confident	127 Å²	127	92.1 Å²	92.1	89%	0.888	47%	0.47	S	S	*	.	S	Bend	trans	-68	-23.1	179.1	47.8	0	0	0	0	113.2	V623	V623-S625 PolarHBondContact O-N 2.84Å
626	W	60.7	Low	72.7	Confident	216 Å²	216	90.8 Å²	90.8	82%	0.818	47%	0.467	S	S	*	.	S	Bend	trans	-87.4	119.5	163	-97.5	60	0	0	0	110.2	C624 P628	C624-W626 PolarHBondContact O-N 3.31Å; W626-P628 VanDerWaalsContact O-CD 3.3Å; W626-P628 WeakPolarHBondContact O-CD 3.4Å
627	K	56.4	Low	72.9	Confident	177 Å²	177	93.2 Å²	93.2	77%	0.77	47%	0.474	S	S	*	.			trans	-87.6	108.6	168.9	-65.7	-172.3	175.3	-165.7	0	109.2
628	P	55.4	Low	73	Confident	29 Å²	29	90.7 Å²	90.7	19%	0.188	46%	0.456	C	S	.	.			trans	-66.5	141.8	168	28.6	-32.3	0	0	0	109.3	W626 Y630 S631 C634	W626-P628 VanDerWaalsContact O-CD 3.3Å; W626-P628 WeakPolarHBondContact O-CD 3.4Å; P628-Y630 PolarHBondContact O-N 2.97Å; P628-S631 PolarHBondContact O-N 3.48Å; P628-C634 WeakPolarHBondContact CG-SG 3.4Å
629	T	56.3	Low	73.1	Confident	133 Å²	133	89.3 Å²	89.3	82%	0.816	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-1	-173.8	6.9	0	0	0	0	115.7
630	Y	56.5	Low	73.2	Confident	151 Å²	151	91 Å²	91	59%	0.592	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.7	5	-171.7	-61.7	-77.3	0	0	0	114.6	P628 P696	P628-Y630 PolarHBondContact O-N 2.97Å; Y630-P696 HydrophobicContact CE2-CB 4.37Å
631	S	52.3	Low	73.1	Confident	29 Å²	29	85 Å²	85	20%	0.203	43%	0.432	C	S	.	.			trans	-147.3	121.1	172	178.5	0	0	0	0	111.3	P628 N662	P628-S631 PolarHBondContact O-N 3.48Å; S631-N662 PolarHBondContact OG-O 2.96Å
632	E	57.8	Low	73.1	Confident	177 Å²	177	84.8 Å²	84.8	83%	0.827	44%	0.437	S	S	*	.	S	Bend	trans	-84.3	-12.9	-177.5	-62.4	-164.2	133.2	0	0	114.3
633	N	67.6	Low	72.7	Confident	110 Å²	110	83.9 Å²	83.9	59%	0.588	43%	0.434	S	S	*	.			trans	-125.1	40.6	-168.3	-72.7	-39.9	0	0	0	113.8	N662	N633-N662 PolarHBondContact O-ND2 2.9Å; N633-N662 VanDerWaalsContact O-ND2 3.11Å
634	C	73.4	Confident	72.4	Confident	5 Å²	5	81.9 Å²	81.9	3%	0.034	42%	0.423	C	S	.	.			trans	-68.7	126	175.2	-89	0	0	0	0	112.7	V623 C624 P628 C663	V623-C634 WeakPolarHBondContact CA-O 3.24Å; C624-C634 HydrophobicContact CB-CB 3.98Å; C624-C634 PolarHBondContact N-O 3.09Å; P628-C634 WeakPolarHBondContact CG-SG 3.4Å; C634-C663 WeakPolarHBondContact CA-SG 3.43Å; C634-C663 HydrophobicContact CB-CB 4.45Å; C634-C663 WeakPolarHBondContact CB-SG 3.35Å; C634-C663 VanDerWaalsContact SG-CA 3.59Å; C634-C663 WeakPolarHBondContact SG-CB 3.48Å; C634-C663 CovalentContact SG-SG 2.02Å; C634-C663 PolarHBondContact SG-SG 2.81Å
635	L	81	Confident	72.6	Confident	58 Å²	58	83 Å²	83	30%	0.304	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130.4	177.6	-65.4	176	0	0	0	110.8	W621 T622 V623 V660 N661	W621-L635 HydrophobicContact CE3-CB 3.92Å; T622-L635 CarbonylContact O-C 3.51Å; T622-L635 WeakPolarHBondContact O-CA 3.28Å; V623-L635 HydrophobicContact CG2-CD2 4.49Å; L635-V660 CarbonylContact O-C 3.52Å; L635-V660 WeakPolarHBondContact O-CA 3.42Å; L635-N661 HydrophobicContact CB-CB 4.47Å; L635-N661 PolarHBondContact N-O 3.11Å; L635-N661 PolarHBondContact O-N 2.83Å
636	C	83.3	Confident	73.1	Confident	22 Å²	22	78.7 Å²	78.7	15%	0.149	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.9	179.7	-78.7	0	0	0	0	110.1	T622 C624 E659	T622-C636 PolarHBondContact N-O 2.86Å; T622-C636 PolarHBondContact O-N 3.35Å; T622-C636 PolarHBondContact OG1-O 3.33Å; T622-C636 VanDerWaalsContact OG1-O 3.06Å; C624-C636 HydrophobicContact CB-CB 4.03Å; C624-C636 WeakPolarHBondContact CB-SG 3.29Å; C624-C636 WeakPolarHBondContact SG-CB 3.36Å; C624-C636 PolarHBondContact SG-N 3.18Å; C624-C636 CovalentContact SG-SG 2.04Å; C624-C636 PolarHBondContact SG-SG 2.84Å; C636-E659 WeakPolarHBondContact CA-O 3.47Å
637	R	89	Confident	73.6	Confident	60 Å²	60	72.4 Å²	72.4	23%	0.226	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	149.9	161.1	63.7	178.1	-175.4	-169.7	-7.7	110.5	W618 S619 W621 I658 E659	W618-R637 HydrophobicContact CD2-CG 4.17Å; W618-R637 HydrophobicContact CE3-CB 4.35Å; W618-R637 HydrophobicContact CE3-CG 3.71Å; W618-R637 HydrophobicContact CZ3-CG 4.2Å; S619-R637 WeakPolarHBondContact O-CB 3.32Å; S619-R637 WeakPolarHBondContact OG-CA 3.19Å; W621-R637 HydrophobicContact CD2-CB 4.13Å; W621-R637 HydrophobicContact CD2-CG 4.03Å; W621-R637 HydrophobicContact CE3-CB 4.02Å; W621-R637 HydrophobicContact CE3-CG 3.89Å; W621-R637 HydrophobicContact CH2-CG 3.93Å; W621-R637 HydrophobicContact CZ2-CG 4.06Å; W621-R637 HydrophobicContact CZ3-CB 4.41Å; W621-R637 HydrophobicContact CZ3-CG 3.84Å; R637-I658 WeakPolarHBondContact O-CA 3.45Å; R637-E659 HydrophobicContact CG-CB 3.92Å; R637-E659 IonicContact CZ-OE1 3.55Å; R637-E659 IonicContact CZ-OE2 3.75Å; R637-E659 PolarHBondContact N-O 2.88Å; R637-E659 IonicContact NE-OE1 3.21Å; R637-E659 IonicContact NE-OE2 3.69Å; R637-E659 PolarHBondContact NE-OE2 3.45Å; R637-E659 IonicContact NH2-OE1 3.21Å; R637-E659 PolarHBondContact NH2-OE1 3.31Å; R637-E659 IonicContact NH2-OE2 2.65Å; R637-E659 PolarHBondContact NH2-OE2 2.81Å; R637-E659 PolarHBondContact O-N 3.26Å
638	V	88.3	Confident	74.2	Confident	64 Å²	64	67.3 Å²	67.3	39%	0.388	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	149.7	-174.9	-58.5	0	0	0	0	110.8	S619 K657 I658	S619-V638 WeakPolarHBondContact CB-O 3.32Å; S619-V638 PolarHBondContact N-O 2.81Å; S619-V638 PolarHBondContact OG-N 3.08Å; S619-V638 PolarHBondContact OG-O 2.87Å; V638-K657 WeakPolarHBondContact CA-O 3.48Å; V638-I658 HydrophobicContact CG1-CD1 4.47Å; V638-I658 HydrophobicContact CG1-CG1 4.03Å; V638-I658 HydrophobicContact CG1-CG2 4.2Å
639	R	91	Very high	74.6	Confident	43 Å²	43	69.7 Å²	69.7	16%	0.162	39%	0.388	C	S	.	.			trans	-134.7	151.1	171.1	58.4	-176.8	-179.6	163.7	2	109.9	Y615 W618 P656 K657	Y615-R639 HydrophobicContact CD1-CB 4.26Å; Y615-R639 HydrophobicContact CD1-CG 3.54Å; Y615-R639 HydrophobicContact CE1-CG 3.92Å; Y615-R639 VanDerWaalsContact CE2-NH2 3.33Å; Y615-R639 HydrophobicContact CG-CG 4.07Å; W618-R639 HydrophobicContact CD2-CB 4.12Å; W618-R639 HydrophobicContact CD2-CG 4.04Å; W618-R639 VanDerWaalsContact CE2-CD 3.5Å; W618-R639 HydrophobicContact CE3-CB 3.79Å; W618-R639 HydrophobicContact CE3-CG 3.65Å; W618-R639 HydrophobicContact CH2-CG 3.87Å; W618-R639 VanDerWaalsContact CH2-NE 3.35Å; W618-R639 HydrophobicContact CZ2-CG 4.24Å; W618-R639 HydrophobicContact CZ3-CB 4.19Å; W618-R639 HydrophobicContact CZ3-CG 3.57Å; R639-P656 VanDerWaalsContact CZ-O 3.3Å; R639-P656 PolarHBondContact NE-O 2.91Å; R639-P656 PolarHBondContact NH2-O 2.71Å; R639-K657 PolarHBondContact N-O 2.79Å; R639-K657 WeakPolarHBondContact O-CE 3.41Å; R639-K657 WeakPolarHBondContact O-CG 3.14Å
640	N	89.2	Confident	75.3	Confident	77 Å²	77	63.9 Å²	63.9	41%	0.412	36%	0.355	S	S	.	.			trans	-106.2	151.8	177.9	-76.8	-33.7	0	0	0	111	Y615 G616 D642 K657	Y615-N640 WeakPolarHBondContact CA-O 3.37Å; Y615-N640 WeakPolarHBondContact CD1-O 3.46Å; G616-N640 PolarHBondContact N-O 2.64Å; N640-D642 VanDerWaalsContact C-N 3.26Å; N640-D642 HydrophobicContact CB-CB 4.2Å; N640-D642 VanDerWaalsContact CB-CG 3.49Å; N640-D642 WeakPolarHBondContact CB-OD2 3.16Å; N640-D642 PolarHBondContact O-N 3.27Å; N640-K657 WeakPolarHBondContact OD1-CE 3.34Å; N640-K657 PolarHBondContact OD1-NZ 3.18Å
641	C	86.4	Confident	76.5	Confident	33 Å²	33	64.5 Å²	64.5	22%	0.223	36%	0.356	C	S	.	.	S	Bend	trans	-90	67.8	175.8	-173	0	0	0	0	108.2	Y615 A645 P646 C653	Y615-C641 HydrophobicContact CD1-CB 4.39Å; Y615-C641 HydrophobicContact CE1-CB 4.24Å; C641-A645 VanDerWaalsContact O-CA 3.32Å; C641-A645 WeakPolarHBondContact O-CA 3.49Å; C641-P646 VanDerWaalsContact SG-CD 3.54Å; C641-C653 WeakPolarHBondContact CA-SG 3.13Å; C641-C653 HydrophobicContact CB-CB 3.82Å; C641-C653 WeakPolarHBondContact CB-SG 3.14Å; C641-C653 WeakPolarHBondContact SG-CB 3.32Å; C641-C653 PolarHBondContact SG-N 2.91Å; C641-C653 VanDerWaalsContact SG-N 3.35Å; C641-C653 CovalentContact SG-SG 2.02Å; C641-C653 PolarHBondContact SG-SG 2.8Å
642	D	83.5	Confident	78.1	Confident	83 Å²	83	70 Å²	70	44%	0.444	38%	0.378	S	S	.	.			trans	-132.6	-1.1	-167.2	59.5	6.1	0	0	0	114.2	Q614 N640 P644 A645	Q614-D642 PolarHBondContact O-N 2.04Å; N640-D642 VanDerWaalsContact C-N 3.26Å; N640-D642 HydrophobicContact CB-CB 4.2Å; N640-D642 VanDerWaalsContact CB-CG 3.49Å; N640-D642 WeakPolarHBondContact CB-OD2 3.16Å; N640-D642 PolarHBondContact O-N 3.27Å; D642-P644 VanDerWaalsContact C-CA 3.41Å; D642-P644 CarbonylContact O-C 3.53Å; D642-P644 WeakPolarHBondContact O-CA 3.22Å; D642-A645 VanDerWaalsContact C-N 3.26Å; D642-A645 PolarHBondContact O-N 2.67Å
643	S	73.8	Confident	79.5	Confident	59 Å²	59	62.4 Å²	62.4	41%	0.413	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	50.1	-166.4	-60.6	0	0	0	0	114.8	Q614 G616	Q614-S643 WeakPolarHBondContact CB-O 3.16Å; Q614-S643 PolarHBondContact O-N 2.73Å; Q614-S643 VanDerWaalsContact O-N 3.08Å; G616-S643 VanDerWaalsContact CA-CB 3.48Å; G616-S643 WeakPolarHBondContact CA-OG 3.45Å
644	P	75.3	Confident	80.3	Confident	53 Å²	53	64.5 Å²	64.5	34%	0.344	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	cis	-93	164	8.9	36.1	-35.9	0	0	0	113.2	V611 G613 Q614 D642	V611-P644 HydrophobicContact CG1-CB 4.02Å; V611-P644 HydrophobicContact CG1-CG 3.66Å; G613-P644 CarbonylContact C-O 3.56Å; G613-P644 VanDerWaalsContact CA-O 3.29Å; G613-P644 WeakPolarHBondContact CA-O 3.47Å; Q614-P644 PolarHBondContact N-O 2.91Å; D642-P644 VanDerWaalsContact C-CA 3.41Å; D642-P644 CarbonylContact O-C 3.53Å; D642-P644 WeakPolarHBondContact O-CA 3.22Å
645	A	79	Confident	80.9	Confident	38 Å²	38	66.7 Å²	66.7	31%	0.314	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-70.4	148.6	168.8	0	0	0	0	0	111.9	C641 D642 K647	C641-A645 VanDerWaalsContact O-CA 3.32Å; C641-A645 WeakPolarHBondContact O-CA 3.49Å; D642-A645 VanDerWaalsContact C-N 3.26Å; D642-A645 PolarHBondContact O-N 2.67Å; A645-K647 PolarHBondContact O-N 2.73Å
646	P	78.5	Confident	81.1	Confident	35 Å²	35	67.6 Å²	67.6	23%	0.227	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-57.6	127.4	172.8	-18.3	27	0	0	0	111.7	V611 C641	V611-P646 VanDerWaalsContact O-CA 3.27Å; V611-P646 WeakPolarHBondContact O-CA 3.48Å; C641-P646 VanDerWaalsContact SG-CD 3.54Å
647	K	70.9	Confident	81.4	Confident	84 Å²	84	72 Å²	72	37%	0.365	40%	0.4	S	S	.	.	B	Isolated β-bridge	trans	-136	158	173.8	-67.2	-178.2	174.1	176.9	0	111	Y65 V611 A645 G649 G650	Y65-K647 PolarHBondContact O-NZ 2.62Å; V611-K647 HydrophobicContact CB-CB 4.04Å; V611-K647 HydrophobicContact CG2-CB 4.23Å; V611-K647 PolarHBondContact N-O 3.25Å; V611-K647 PolarHBondContact O-N 2.82Å; A645-K647 PolarHBondContact O-N 2.73Å; K647-G649 VanDerWaalsContact C-N 3.3Å; K647-G649 PolarHBondContact O-N 2.78Å; K647-G650 PolarHBondContact O-N 2.97Å
648	F	69.3	Low	81.1	Confident	70 Å²	70	73.5 Å²	73.5	31%	0.307	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	41.3	172.7	-48.5	-54.9	0	0	0	114.5	D66 R608 F609 P610 V611 G650	D66-F648 HydrophobicContact CB-CZ 4.31Å; D66-F648 WeakPolarHBondContact OD2-CZ 3.3Å; R608-F648 HydrophobicContact CB-CB 4.06Å; R608-F648 HydrophobicContact CB-CD1 3.8Å; R608-F648 HydrophobicContact CB-CD2 4.41Å; R608-F648 HydrophobicContact CB-CE1 4.32Å; R608-F648 HydrophobicContact CB-CG 3.85Å; R608-F648 HydrophobicContact CG-CD1 3.76Å; R608-F648 HydrophobicContact CG-CE1 3.85Å; R608-F648 HydrophobicContact CG-CG 4.29Å; R608-F648 HydrophobicContact CG-CZ 4.42Å; R608-F648 WeakPolarHBondContact O-CB 3.4Å; F609-F648 WeakPolarHBondContact O-CD2 3.48Å; P610-F648 WeakPolarHBondContact CA-O 3.47Å; V611-F648 HydrophobicContact CG2-CD2 4.36Å; F648-G650 VanDerWaalsContact C-N 3.33Å; F648-G650 PolarHBondContact O-N 2.75Å
649	G	63.6	Low	81	Confident	79 Å²	79	73.6 Å²	73.6	81%	0.814	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	8.2	-178.7	0	0	0	0	0	115.2	K647	K647-G649 VanDerWaalsContact C-N 3.3Å; K647-G649 PolarHBondContact O-N 2.78Å
650	G	71.7	Confident	80.3	Confident	11 Å²	11	74.4 Å²	74.4	11%	0.113	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-61.6	150.1	173.3	0	0	0	0	0	113.3	V611 K647 F648	V611-G650 WeakPolarHBondContact O-CA 3.46Å; K647-G650 PolarHBondContact O-N 2.97Å; F648-G650 VanDerWaalsContact C-N 3.33Å; F648-G650 PolarHBondContact O-N 2.75Å
651	R	81.1	Confident	79.5	Confident	165 Å²	165	75 Å²	75	62%	0.623	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-56.4	143.3	178.7	-64.6	177.9	-170.2	-172.3	5.3	111.2	H612 G613 E654	H612-R651 WeakPolarHBondContact ND1-CB 3.18Å; H612-R651 WeakPolarHBondContact ND1-CG 3.32Å; H612-R651 PolarHBondContact ND1-N 2.78Å; G613-R651 PolarHBondContact N-O 2.89Å; R651-E654 IonicContact NH1-OE1 2.79Å
652	Q	87.2	Confident	78.8	Confident	143 Å²	143	78 Å²	78	67%	0.668	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-64.1	158	166.3	-68	-70	-15.7	0	0	110.5	E654	Q652-E654 PolarHBondContact O-N 3.12Å
653	C	87	Confident	78.1	Confident	18 Å²	18	74.2 Å²	74.2	12%	0.122	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-64.8	131.6	176.2	-61.2	0	0	0	0	111.5	Q614 Y615 C641	Q614-C653 PolarHBondContact N-SG 2.99Å; Q614-C653 VanDerWaalsContact N-SG 3.42Å; Y615-C653 HydrophobicContact CD1-CB 4.06Å; Y615-C653 HydrophobicContact CD2-CB 3.6Å; Y615-C653 HydrophobicContact CE1-CB 3.86Å; Y615-C653 HydrophobicContact CE2-CB 3.38Å; Y615-C653 HydrophobicContact CG-CB 3.95Å; C641-C653 WeakPolarHBondContact CA-SG 3.13Å; C641-C653 HydrophobicContact CB-CB 3.82Å; C641-C653 WeakPolarHBondContact CB-SG 3.14Å; C641-C653 WeakPolarHBondContact SG-CB 3.32Å; C641-C653 PolarHBondContact SG-N 2.91Å; C641-C653 VanDerWaalsContact SG-N 3.35Å; C641-C653 CovalentContact SG-SG 2.02Å; C641-C653 PolarHBondContact SG-SG 2.8Å
654	E	85.1	Confident	78	Confident	155 Å²	155	75.5 Å²	75.5	72%	0.724	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-89.8	126.4	179.6	-66.8	176.3	-164	0	0	111.1	Y615 R651 Q652	Y615-E654 WeakPolarHBondContact CE2-O 3.38Å; R651-E654 IonicContact NH1-OE1 2.79Å; Q652-E654 PolarHBondContact O-N 3.12Å
655	G	84.9	Confident	77.8	Confident	51 Å²	51	73.8 Å²	73.8	53%	0.526	41%	0.409	S	S	.	.	S	Bend	trans	123.3	-176.7	178.7	0	0	0	0	0	114.1	Y615	Y615-G655 PolarHBondContact OH-O 3.29Å
656	P	86.3	Confident	77.8	Confident	77 Å²	77	76.4 Å²	76.4	50%	0.5	42%	0.415	S	S	.	.			trans	-75.8	140	179.5	28.9	-34.4	0	0	0	112	R639	R639-P656 VanDerWaalsContact CZ-O 3.3Å; R639-P656 PolarHBondContact NE-O 2.91Å; R639-P656 PolarHBondContact NH2-O 2.71Å
657	K	87.9	Confident	78	Confident	113 Å²	113	75.4 Å²	75.4	49%	0.491	41%	0.41	S	S	.	.	S	Bend	trans	-78.1	-29.7	171.5	-167.1	-174.7	174.9	175.4	0	112.6	V638 R639 N640	V638-K657 WeakPolarHBondContact CA-O 3.48Å; R639-K657 PolarHBondContact N-O 2.79Å; R639-K657 WeakPolarHBondContact O-CE 3.41Å; R639-K657 WeakPolarHBondContact O-CG 3.14Å; N640-K657 WeakPolarHBondContact OD1-CE 3.34Å; N640-K657 PolarHBondContact OD1-NZ 3.18Å
658	I	84.3	Confident	78.8	Confident	92 Å²	92	79.4 Å²	79.4	47%	0.472	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.2	-176.8	-51	-175.3	0	0	0	107.4	R637 V638 V660	R637-I658 WeakPolarHBondContact O-CA 3.45Å; V638-I658 HydrophobicContact CG1-CD1 4.47Å; V638-I658 HydrophobicContact CG1-CG1 4.03Å; V638-I658 HydrophobicContact CG1-CG2 4.2Å; I658-V660 HydrophobicContact CG2-CG2 4.17Å
659	E	84.2	Confident	79.8	Confident	67 Å²	67	78.8 Å²	78.8	31%	0.313	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.3	172.1	-170	-176.6	155.5	0	0	108.9	W618 W621 C636 R637	W618-E659 HydrophobicContact CH2-CB 3.62Å; W618-E659 HydrophobicContact CZ2-CB 4.17Å; W618-E659 WeakPolarHBondContact CZ2-OE2 3.24Å; W618-E659 HydrophobicContact CZ3-CB 3.82Å; W621-E659 HydrophobicContact CH2-CB 4.38Å; W621-E659 HydrophobicContact CH2-CG 3.93Å; C636-E659 WeakPolarHBondContact CA-O 3.47Å; R637-E659 HydrophobicContact CG-CB 3.92Å; R637-E659 IonicContact CZ-OE1 3.55Å; R637-E659 IonicContact CZ-OE2 3.75Å; R637-E659 PolarHBondContact N-O 2.88Å; R637-E659 IonicContact NE-OE1 3.21Å; R637-E659 IonicContact NE-OE2 3.69Å; R637-E659 PolarHBondContact NE-OE2 3.45Å; R637-E659 IonicContact NH2-OE1 3.21Å; R637-E659 PolarHBondContact NH2-OE1 3.31Å; R637-E659 IonicContact NH2-OE2 2.65Å; R637-E659 PolarHBondContact NH2-OE2 2.81Å; R637-E659 PolarHBondContact O-N 3.26Å
660	V	77	Confident	81	Confident	60 Å²	60	76.8 Å²	76.8	36%	0.364	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	133.7	-171.7	-176.3	0	0	0	0	109	L635 I658 C663 Y700	L635-V660 CarbonylContact O-C 3.52Å; L635-V660 WeakPolarHBondContact O-CA 3.42Å; I658-V660 HydrophobicContact CG2-CG2 4.17Å; V660-C663 HydrophobicContact CG1-CB 3.91Å; V660-C663 WeakPolarHBondContact CG1-SG 3.4Å; V660-Y700 HydrophobicContact CG1-CD1 4.18Å; V660-Y700 HydrophobicContact CG1-CE1 4.43Å
661	N	73.1	Confident	81.8	Confident	88 Å²	88	79.1 Å²	79.1	47%	0.471	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	153.6	179	-168	5.9	0	0	0	110	W621 L635 C663	W621-N661 HydrophobicContact CE3-CB 4.36Å; W621-N661 HydrophobicContact CH2-CB 3.7Å; W621-N661 HydrophobicContact CZ3-CB 3.6Å; L635-N661 HydrophobicContact CB-CB 4.47Å; L635-N661 PolarHBondContact N-O 3.11Å; L635-N661 PolarHBondContact O-N 2.83Å; N661-C663 PolarHBondContact O-N 2.84Å; N661-C663 PolarHBondContact O-SG 3.49Å
662	N	71.1	Confident	82.2	Confident	96 Å²	96	74.9 Å²	74.9	51%	0.513	40%	0.399	S	S	.	.	S	Bend	trans	65.4	29.4	176.5	-150.5	35.2	0	0	0	115.8	S631 N633	S631-N662 PolarHBondContact OG-O 2.96Å; N633-N662 PolarHBondContact O-ND2 2.9Å; N633-N662 VanDerWaalsContact O-ND2 3.11Å
663	C	69.4	Low	82.2	Confident	4 Å²	4	69.9 Å²	69.9	3%	0.027	39%	0.386	C	S	.	.			trans	-119.8	7.4	-177	-59.1	0	0	0	0	115.4	C634 V660 N661 V665 Y700	C634-C663 WeakPolarHBondContact CA-SG 3.43Å; C634-C663 HydrophobicContact CB-CB 4.45Å; C634-C663 WeakPolarHBondContact CB-SG 3.35Å; C634-C663 VanDerWaalsContact SG-CA 3.59Å; C634-C663 WeakPolarHBondContact SG-CB 3.48Å; C634-C663 CovalentContact SG-SG 2.02Å; C634-C663 PolarHBondContact SG-SG 2.81Å; V660-C663 HydrophobicContact CG1-CB 3.91Å; V660-C663 WeakPolarHBondContact CG1-SG 3.4Å; N661-C663 PolarHBondContact O-N 2.84Å; N661-C663 PolarHBondContact O-SG 3.49Å; C663-V665 WeakPolarHBondContact O-CG2 3.44Å; C663-V665 PolarHBondContact O-N 2.88Å; C663-V665 VanDerWaalsContact O-N 3.09Å; C663-Y700 HydrophobicContact CB-CD1 4.24Å; C663-Y700 HydrophobicContact CB-CD2 3.94Å; C663-Y700 HydrophobicContact CB-CG 3.78Å; C663-Y700 VanDerWaalsContact O-CD2 3.32Å; C663-Y700 WeakPolarHBondContact O-CD2 3.3Å
664	T	70.8	Confident	82.1	Confident	86 Å²	86	76.7 Å²	76.7	53%	0.528	42%	0.419	S	S	.	.			trans	-56	112.9	-172.3	50.2	0	0	0	0	112.6	Y700	T664-Y700 WeakPolarHBondContact CG2-O 3.45Å
665	V	71	Confident	82.3	Confident	17 Å²	17	72.2 Å²	72.2	10%	0.103	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-100	107.4	176.8	-180	0	0	0	0	109.1	C663 P696 P698 D699 Y700 G702	C663-V665 WeakPolarHBondContact O-CG2 3.44Å; C663-V665 PolarHBondContact O-N 2.88Å; C663-V665 VanDerWaalsContact O-N 3.09Å; V665-P696 HydrophobicContact CG1-CB 3.94Å; V665-P696 HydrophobicContact CG1-CG 3.45Å; V665-P696 VanDerWaalsContact CG1-CG 3.45Å; V665-P698 WeakPolarHBondContact O-CA 3.43Å; V665-D699 HydrophobicContact CB-CB 4.02Å; V665-D699 HydrophobicContact CG2-CB 4.4Å; V665-D699 PolarHBondContact N-O 3.28Å; V665-D699 PolarHBondContact O-N 3.44Å; V665-Y700 HydrophobicContact CG2-CD2 4.33Å; V665-G702 WeakPolarHBondContact O-CA 3.27Å
666	H	80	Confident	82.3	Confident	94 Å²	94	71.3 Å²	71.3	44%	0.435	38%	0.381	S	S	.	.			trans	-70	134.3	173.9	-65.5	-43.4	0	0	0	111.6	R703	H666-R703 PolarHBondContact ND1-N 3.18Å
667	G	83.5	Confident	82.2	Confident	13 Å²	13	72.8 Å²	72.8	13%	0.134	39%	0.394	C	S	.	.			trans	-62.3	136.6	177	0	0	0	0	0	111.9	P696 R703 C705	G667-P696 WeakPolarHBondContact CA-O 3.42Å; G667-R703 PolarHBondContact N-O 3.23Å; G667-C705 PolarHBondContact O-SG 3.47Å
668	R	86.7	Confident	82.2	Confident	168 Å²	168	69.9 Å²	69.9	63%	0.634	39%	0.387	S	S	*	.			trans	-123.5	147.7	169.3	-63.2	178.1	-178.4	178.1	-1.1	110.5	S694 N695 P696 C705	R668-S694 PolarHBondContact O-N 3.04Å; R668-N695 VanDerWaalsContact CB-O 3.29Å; R668-N695 WeakPolarHBondContact CB-O 3.4Å; R668-N695 PolarHBondContact O-N 3.35Å; R668-P696 PolarHBondContact N-O 3.35Å; R668-C705 PolarHBondContact N-SG 3.17Å; R668-C705 VanDerWaalsContact N-SG 3.4Å
669	W	90.7	Very high	82.1	Confident	58 Å²	58	69.6 Å²	69.6	22%	0.22	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-66.2	143.7	175.5	-68.5	112.8	0	0	0	111.9	R691 Y692 C693 C705 S706 G707	W669-R691 HydrophobicContact CD2-CG 4.02Å; W669-R691 HydrophobicContact CE3-CB 4.25Å; W669-R691 HydrophobicContact CE3-CG 3.52Å; W669-R691 HydrophobicContact CZ3-CG 4Å; W669-R691 WeakPolarHBondContact CZ3-O 3.38Å; W669-Y692 CarbonylContact C-O 3.48Å; W669-Y692 WeakPolarHBondContact CA-O 3.36Å; W669-C693 HydrophobicContact CE3-CB 4.35Å; W669-C693 HydrophobicContact CZ3-CB 4.14Å; W669-C705 HydrophobicContact CD2-CB 3.8Å; W669-C705 HydrophobicContact CE3-CB 4.34Å; W669-C705 HydrophobicContact CG-CB 4.26Å; W669-C705 HydrophobicContact CH2-CB 4.11Å; W669-C705 HydrophobicContact CZ2-CB 3.51Å; W669-C705 HydrophobicContact CZ3-CB 4.5Å; W669-S706 PolarHBondContact NE1-O 3.38Å; W669-G707 WeakPolarHBondContact CZ2-O 3.49Å
670	T	88.7	Confident	81.8	Confident	36 Å²	36	68.2 Å²	68.2	22%	0.221	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-59.8	165.1	157.5	62.4	0	0	0	0	110.3	R691 Y692 S694 N695	T670-R691 WeakPolarHBondContact OG1-CA 3.4Å; T670-Y692 PolarHBondContact N-O 3.34Å; T670-Y692 PolarHBondContact OG1-N 2.99Å; T670-S694 VanDerWaalsContact CG2-OG 3.27Å; T670-S694 WeakPolarHBondContact CG2-OG 3.46Å; T670-N695 HydrophobicContact CG2-CB 4.1Å
671	G	87.2	Confident	81.9	Confident	60 Å²	60	71.5 Å²	71.5	62%	0.619	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-52.7	153.8	155.2	0	0	0	0	0	110.6
672	W	90.3	Very high	82.2	Confident	76 Å²	76	69.4 Å²	69.4	29%	0.288	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-65.3	134.9	170.8	-72.5	108.9	0	0	0	110	R689 R691 Q711	W672-R689 HydrophobicContact CB-CG 4.44Å; W672-R689 HydrophobicContact CD2-CG 4.21Å; W672-R689 HydrophobicContact CE3-CG 3.73Å; W672-R689 HydrophobicContact CZ3-CG 4.34Å; W672-R689 WeakPolarHBondContact CZ3-O 3.26Å; W672-R691 HydrophobicContact CD2-CB 4.12Å; W672-R691 HydrophobicContact CD2-CG 4.1Å; W672-R691 HydrophobicContact CE3-CB 3.71Å; W672-R691 HydrophobicContact CE3-CG 3.67Å; W672-R691 HydrophobicContact CH2-CG 3.69Å; W672-R691 VanDerWaalsContact CH2-NE 3.33Å; W672-R691 VanDerWaalsContact CZ2-CD 3.47Å; W672-R691 HydrophobicContact CZ2-CG 4.14Å; W672-R691 VanDerWaalsContact CZ2-CZ 3.48Å; W672-R691 VanDerWaalsContact CZ2-NE 3.27Å; W672-R691 HydrophobicContact CZ3-CB 4Å; W672-R691 HydrophobicContact CZ3-CG 3.46Å; W672-R691 VanDerWaalsContact CZ3-CG 3.46Å; W672-Q711 HydrophobicContact CE3-CB 4.24Å; W672-Q711 HydrophobicContact CH2-CB 3.5Å; W672-Q711 VanDerWaalsContact CH2-CB 3.5Å; W672-Q711 HydrophobicContact CZ2-CB 3.84Å; W672-Q711 HydrophobicContact CZ3-CB 3.7Å
673	G	86.9	Confident	82.4	Confident	39 Å²	39	66.2 Å²	66.2	40%	0.402	40%	0.395	S	S	.	.			trans	-66.9	176	169.5	0	0	0	0	0	112.4	Y690	G673-Y690 PolarHBondContact N-O 3.18Å
674	I	84.7	Confident	82.8	Confident	160 Å²	160	73.4 Å²	73.4	82%	0.821	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-57.6	149.4	173.4	57.9	173.7	0	0	0	111.4	R689	I674-R689 WeakPolarHBondContact O-CB 3.36Å
675	W	89.1	Confident	83.2	Confident	61 Å²	61	69.5 Å²	69.5	23%	0.231	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-70.2	143	169.6	-74.4	113.5	0	0	0	110.9	R687 R689 Q711 E713	W675-R687 HydrophobicContact CB-CG 4.46Å; W675-R687 HydrophobicContact CD2-CG 4Å; W675-R687 HydrophobicContact CE3-CB 4.08Å; W675-R687 HydrophobicContact CE3-CG 3.61Å; W675-R687 HydrophobicContact CG-CG 4.4Å; W675-R687 HydrophobicContact CZ3-CG 4.11Å; W675-R687 WeakPolarHBondContact CZ3-O 3.34Å; W675-R689 HydrophobicContact CD2-CB 3.98Å; W675-R689 HydrophobicContact CD2-CG 3.91Å; W675-R689 HydrophobicContact CE3-CB 3.73Å; W675-R689 HydrophobicContact CE3-CG 3.72Å; W675-R689 HydrophobicContact CG-CB 4.48Å; W675-R689 HydrophobicContact CH2-CG 3.78Å; W675-R689 HydrophobicContact CZ2-CG 3.95Å; W675-R689 HydrophobicContact CZ3-CB 4.12Å; W675-R689 HydrophobicContact CZ3-CG 3.68Å; W675-Q711 HydrophobicContact CH2-CB 4.16Å; W675-Q711 HydrophobicContact CH2-CG 3.86Å; W675-Q711 WeakPolarHBondContact CZ3-O 3.44Å; W675-E713 HydrophobicContact CE3-CB 4.47Å; W675-E713 HydrophobicContact CH2-CB 3.33Å; W675-E713 HydrophobicContact CH2-CG 4.43Å; W675-E713 HydrophobicContact CZ2-CB 3.77Å; W675-E713 HydrophobicContact CZ2-CG 4.44Å; W675-E713 WeakPolarHBondContact CZ2-OE2 3.45Å; W675-E713 HydrophobicContact CZ3-CB 3.72Å; W675-E713 PolarHBondContact NE1-OE2 2.62Å
676	S	85.2	Confident	83.9	Confident	32 Å²	32	70.6 Å²	70.6	22%	0.224	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-64.3	164.9	167.4	75.4	0	0	0	0	111.8	R687 H688	S676-R687 WeakPolarHBondContact O-CB 3.41Å; S676-R687 WeakPolarHBondContact OG-CA 3.44Å; S676-H688 VanDerWaalsContact CB-CE1 3.41Å; S676-H688 WeakPolarHBondContact CB-CE1 3.24Å; S676-H688 PolarHBondContact N-O 2.91Å; S676-H688 PolarHBondContact OG-CE1 2.71Å; S676-H688 PolarHBondContact OG-N 3.33Å; S676-H688 PolarHBondContact OG-ND1 3.22Å
677	S	84.9	Confident	84.4	Confident	109 Å²	109	69.9 Å²	69.9	76%	0.762	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-55	154.2	156.7	-49.7	0	0	0	0	110.9
678	C	88	Confident	84.8	Confident	52 Å²	52	72.4 Å²	72.4	35%	0.351	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-68.2	138	175.1	-60.6	0	0	0	0	110.9	A680 S685 C715	C678-A680 PolarHBondContact O-N 3.48Å; C678-S685 WeakPolarHBondContact CB-OG 3.41Å; C678-C715 VanDerWaalsContact CA-SG 3.6Å; C678-C715 HydrophobicContact CB-CB 3.71Å; C678-C715 WeakPolarHBondContact CB-SG 3.36Å; C678-C715 WeakPolarHBondContact SG-CB 3.02Å; C678-C715 CovalentContact SG-SG 2.03Å; C678-C715 PolarHBondContact SG-SG 3.2Å
679	S	82.5	Confident	85	Confident	85 Å²	85	67.1 Å²	67.1	59%	0.594	40%	0.398	S	S	*	.	S	Bend	trans	-65.1	-18.3	-173.7	61.3	0	0	0	0	115.2	S685 S686	S679-S685 PolarHBondContact N-OG 3.08Å; S679-S686 WeakPolarHBondContact CB-O 3.44Å; S679-S686 PolarHBondContact N-O 3.02Å; S679-S686 PolarHBondContact OG-N 3.06Å; S679-S686 PolarHBondContact OG-O 3.29Å
680	A	78	Confident	85	Confident	39 Å²	39	69.6 Å²	69.6	32%	0.322	41%	0.408	S	S	.	.			trans	-148.9	156.9	174.8	0	0	0	0	0	110.9	C678 S685	C678-A680 PolarHBondContact O-N 3.48Å; A680-S685 PolarHBondContact N-OG 3.06Å; A680-S685 WeakPolarHBondContact O-CB 3.47Å; A680-S685 PolarHBondContact O-OG 3.34Å
681	T	79.2	Confident	85.2	Confident	129 Å²	129	70 Å²	70	79%	0.791	41%	0.406	S	S	*	.	S	Bend	trans	-91.1	-9.8	177.6	47.9	0	0	0	0	114.1
682	C	77.9	Confident	85.3	Confident	43 Å²	43	74.2 Å²	74.2	29%	0.291	40%	0.404	S	S	.	.	S	Bend	trans	-142.5	161.3	169.2	74.7	0	0	0	0	111	P718 C720	C682-P718 WeakPolarHBondContact CA-O 3.36Å; C682-P718 WeakPolarHBondContact CB-O 3.49Å; C682-C720 HydrophobicContact CB-CB 3.92Å; C682-C720 WeakPolarHBondContact CB-SG 3.38Å; C682-C720 PolarHBondContact O-SG 3.38Å; C682-C720 VanDerWaalsContact O-SG 3.42Å; C682-C720 WeakPolarHBondContact SG-CA 3.23Å; C682-C720 WeakPolarHBondContact SG-CB 3.46Å; C682-C720 CovalentContact SG-SG 2.05Å; C682-C720 PolarHBondContact SG-SG 2.8Å
683	G	76	Confident	85.2	Confident	29 Å²	29	72.5 Å²	72.5	30%	0.299	40%	0.403	S	S	.	.	S	Bend	trans	73.2	-155.4	174.2	0	0	0	0	0	113.5	S685 V717 P718 C720	G683-S685 PolarHBondContact O-N 3.5Å; G683-V717 WeakPolarHBondContact O-CG2 3.26Å; G683-P718 PolarHBondContact N-O 3.02Å; G683-P718 VanDerWaalsContact N-O 3.08Å; G683-C720 PolarHBondContact N-SG 2.93Å
684	I	77.5	Confident	85.1	Confident	156 Å²	156	73.8 Å²	73.8	80%	0.8	41%	0.406	S	S	*	.	S	Bend	trans	-72	109	-178.4	-57.9	177.3	0	0	0	109.1	Y714	I684-Y714 HydrophobicContact CG2-CD1 4.23Å; I684-Y714 HydrophobicContact CG2-CE1 4.06Å
685	S	80.3	Confident	84.9	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.021	39%	0.39	C	S	.	.			trans	-126.5	143.6	-175.9	-171.3	0	0	0	0	110.1	C678 S679 A680 G683 Y714 C715	C678-S685 WeakPolarHBondContact CB-OG 3.41Å; S679-S685 PolarHBondContact N-OG 3.08Å; A680-S685 PolarHBondContact N-OG 3.06Å; A680-S685 WeakPolarHBondContact O-CB 3.47Å; A680-S685 PolarHBondContact O-OG 3.34Å; G683-S685 PolarHBondContact O-N 3.5Å; S685-Y714 WeakPolarHBondContact O-CA 3.38Å; S685-C715 PolarHBondContact O-N 3.24Å
686	S	85.7	Confident	84.6	Confident	41 Å²	41	68.7 Å²	68.7	29%	0.287	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.9	-179.6	68.6	0	0	0	0	111.7	S679 E713	S679-S686 WeakPolarHBondContact CB-O 3.44Å; S679-S686 PolarHBondContact N-O 3.02Å; S679-S686 PolarHBondContact OG-N 3.06Å; S679-S686 PolarHBondContact OG-O 3.29Å; S686-E713 CarbonylContact C-O 3.54Å; S686-E713 WeakPolarHBondContact CA-O 3.45Å
687	R	90.6	Very high	84.4	Confident	78 Å²	78	69.5 Å²	69.5	29%	0.294	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	153.5	166.3	58.7	-175.7	-164.7	-163.4	-4.1	109.7	W675 S676 H712 E713	W675-R687 HydrophobicContact CB-CG 4.46Å; W675-R687 HydrophobicContact CD2-CG 4Å; W675-R687 HydrophobicContact CE3-CB 4.08Å; W675-R687 HydrophobicContact CE3-CG 3.61Å; W675-R687 HydrophobicContact CG-CG 4.4Å; W675-R687 HydrophobicContact CZ3-CG 4.11Å; W675-R687 WeakPolarHBondContact CZ3-O 3.34Å; S676-R687 WeakPolarHBondContact O-CB 3.41Å; S676-R687 WeakPolarHBondContact OG-CA 3.44Å; R687-H712 WeakPolarHBondContact O-CA 3.43Å; R687-E713 HydrophobicContact CG-CB 4.1Å; R687-E713 IonicContact CZ-OE2 2.73Å; R687-E713 PolarHBondContact N-O 3.38Å; R687-E713 IonicContact NE-OE2 2.77Å; R687-E713 PolarHBondContact NE-OE2 3.27Å; R687-E713 IonicContact NH2-OE1 3.14Å; R687-E713 PolarHBondContact NH2-OE1 2.94Å; R687-E713 VanDerWaalsContact NH2-OE1 3.12Å; R687-E713 IonicContact NH2-OE2 2.68Å; R687-E713 PolarHBondContact NH2-OE2 2.75Å; R687-E713 PolarHBondContact O-N 2.81Å
688	H	90.2	Very high	84.3	Confident	66 Å²	66	67 Å²	67	31%	0.306	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	152.5	179.5	61.9	-93.9	0	0	0	111.3	S676 Y690 Q711	S676-H688 VanDerWaalsContact CB-CE1 3.41Å; S676-H688 WeakPolarHBondContact CB-CE1 3.24Å; S676-H688 PolarHBondContact N-O 2.91Å; S676-H688 PolarHBondContact OG-CE1 2.71Å; S676-H688 PolarHBondContact OG-N 3.33Å; S676-H688 PolarHBondContact OG-ND1 3.22Å; H688-Y690 AromaticContact CD2-CE2 3.36Å; H688-Y690 WeakPolarHBondContact CD2-CE2 3.11Å; H688-Y690 AromaticContact CD2-CZ 3.62Å; H688-Y690 PolarHBondContact CD2-OH 2.96Å; H688-Y690 AromaticContact NE2-CE2 3.69Å; H688-Q711 CarbonylContact C-O 3.53Å; H688-Q711 VanDerWaalsContact CA-O 3.27Å; H688-Q711 WeakPolarHBondContact CA-O 3.31Å
689	R	92.2	Very high	83.5	Confident	57 Å²	57	68.3 Å²	68.3	22%	0.215	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	153.5	171.6	66.1	179.6	-174.2	-179.2	-2	111.6	W672 I674 W675 V710 Q711	W672-R689 HydrophobicContact CB-CG 4.44Å; W672-R689 HydrophobicContact CD2-CG 4.21Å; W672-R689 HydrophobicContact CE3-CG 3.73Å; W672-R689 HydrophobicContact CZ3-CG 4.34Å; W672-R689 WeakPolarHBondContact CZ3-O 3.26Å; I674-R689 WeakPolarHBondContact O-CB 3.36Å; W675-R689 HydrophobicContact CD2-CB 3.98Å; W675-R689 HydrophobicContact CD2-CG 3.91Å; W675-R689 HydrophobicContact CE3-CB 3.73Å; W675-R689 HydrophobicContact CE3-CG 3.72Å; W675-R689 HydrophobicContact CG-CB 4.48Å; W675-R689 HydrophobicContact CH2-CG 3.78Å; W675-R689 HydrophobicContact CZ2-CG 3.95Å; W675-R689 HydrophobicContact CZ3-CB 4.12Å; W675-R689 HydrophobicContact CZ3-CG 3.68Å; R689-V710 WeakPolarHBondContact O-CA 3.38Å; R689-Q711 HydrophobicContact CG-CB 4.04Å; R689-Q711 VanDerWaalsContact CZ-OE1 3.28Å; R689-Q711 PolarHBondContact N-O 2.83Å; R689-Q711 PolarHBondContact O-N 2.75Å
690	Y	90.5	Very high	82.9	Confident	110 Å²	110	69.4 Å²	69.4	43%	0.431	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	152.8	-173.8	-61.3	-81.8	0	0	0	112.4	G673 H688 G709 V710	G673-Y690 PolarHBondContact N-O 3.18Å; H688-Y690 AromaticContact CD2-CE2 3.36Å; H688-Y690 WeakPolarHBondContact CD2-CE2 3.11Å; H688-Y690 AromaticContact CD2-CZ 3.62Å; H688-Y690 PolarHBondContact CD2-OH 2.96Å; H688-Y690 AromaticContact NE2-CE2 3.69Å; Y690-G709 CarbonylContact C-O 3.49Å; Y690-G709 WeakPolarHBondContact CA-O 3.36Å; Y690-V710 HydrophobicContact CD1-CG1 4.43Å; Y690-V710 HydrophobicContact CD1-CG2 3.86Å; Y690-V710 HydrophobicContact CE1-CG1 4.23Å; Y690-V710 HydrophobicContact CE1-CG2 3.87Å
691	R	92.5	Very high	82.4	Confident	45 Å²	45	71.2 Å²	71.2	17%	0.17	39%	0.394	C	S	.	.			trans	-141.8	148.5	164.1	63.1	178.5	180	176.6	-2	109.6	W669 T670 W672 P708 G709	W669-R691 HydrophobicContact CD2-CG 4.02Å; W669-R691 HydrophobicContact CE3-CB 4.25Å; W669-R691 HydrophobicContact CE3-CG 3.52Å; W669-R691 HydrophobicContact CZ3-CG 4Å; W669-R691 WeakPolarHBondContact CZ3-O 3.38Å; T670-R691 WeakPolarHBondContact OG1-CA 3.4Å; W672-R691 HydrophobicContact CD2-CB 4.12Å; W672-R691 HydrophobicContact CD2-CG 4.1Å; W672-R691 HydrophobicContact CE3-CB 3.71Å; W672-R691 HydrophobicContact CE3-CG 3.67Å; W672-R691 HydrophobicContact CH2-CG 3.69Å; W672-R691 VanDerWaalsContact CH2-NE 3.33Å; W672-R691 VanDerWaalsContact CZ2-CD 3.47Å; W672-R691 HydrophobicContact CZ2-CG 4.14Å; W672-R691 VanDerWaalsContact CZ2-CZ 3.48Å; W672-R691 VanDerWaalsContact CZ2-NE 3.27Å; W672-R691 HydrophobicContact CZ3-CB 4Å; W672-R691 HydrophobicContact CZ3-CG 3.46Å; W672-R691 VanDerWaalsContact CZ3-CG 3.46Å; R691-P708 VanDerWaalsContact CZ-O 3.25Å; R691-P708 PolarHBondContact NE-O 2.89Å; R691-P708 PolarHBondContact NH2-O 2.82Å; R691-G709 PolarHBondContact N-O 2.79Å
692	Y	88.5	Confident	82.1	Confident	148 Å²	148	65.7 Å²	65.7	58%	0.58	36%	0.362	S	S	*	.			trans	-112.8	148.9	-174.3	-58	-80.1	0	0	0	110.7	W669 T670 S694	W669-Y692 CarbonylContact C-O 3.48Å; W669-Y692 WeakPolarHBondContact CA-O 3.36Å; T670-Y692 PolarHBondContact N-O 3.34Å; T670-Y692 PolarHBondContact OG1-N 2.99Å; Y692-S694 WeakPolarHBondContact CB-OG 3.41Å; Y692-S694 PolarHBondContact O-N 3.42Å
693	C	89.8	Confident	82.1	Confident	40 Å²	40	72.5 Å²	72.5	27%	0.27	38%	0.382	S	S	.	.	S	Bend	trans	-85.3	65.7	176.2	-172.7	0	0	0	0	109.7	W669 A697 C705	W669-C693 HydrophobicContact CE3-CB 4.35Å; W669-C693 HydrophobicContact CZ3-CB 4.14Å; C693-A697 WeakPolarHBondContact O-CA 2.79Å; C693-C705 WeakPolarHBondContact CA-SG 3.21Å; C693-C705 HydrophobicContact CB-CB 3.82Å; C693-C705 WeakPolarHBondContact CB-SG 3.39Å; C693-C705 WeakPolarHBondContact SG-CB 3.44Å; C693-C705 PolarHBondContact SG-N 3.47Å; C693-C705 CovalentContact SG-SG 2.03Å; C693-C705 PolarHBondContact SG-SG 3.01Å
694	S	85.2	Confident	82.6	Confident	67 Å²	67	76 Å²	76	47%	0.469	40%	0.399	S	S	.	.			trans	-139.9	12.5	-167.6	58.3	0	0	0	0	115.1	R668 T670 Y692	R668-S694 PolarHBondContact O-N 3.04Å; T670-S694 VanDerWaalsContact CG2-OG 3.27Å; T670-S694 WeakPolarHBondContact CG2-OG 3.46Å; Y692-S694 WeakPolarHBondContact CB-OG 3.41Å; Y692-S694 PolarHBondContact O-N 3.42Å
695	N	80.3	Confident	83	Confident	91 Å²	91	69.5 Å²	69.5	49%	0.487	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	57.2	-175.9	-169.1	35.5	0	0	0	115.2	R668 T670	R668-N695 VanDerWaalsContact CB-O 3.29Å; R668-N695 WeakPolarHBondContact CB-O 3.4Å; R668-N695 PolarHBondContact O-N 3.35Å; T670-N695 HydrophobicContact CG2-CB 4.1Å
696	P	82.8	Confident	83.2	Confident	22 Å²	22	74.8 Å²	74.8	14%	0.143	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	cis	-89.4	168.7	5.2	35.2	-36	0	0	0	112.9	Y630 V665 G667 R668	Y630-P696 HydrophobicContact CE2-CB 4.37Å; V665-P696 HydrophobicContact CG1-CB 3.94Å; V665-P696 HydrophobicContact CG1-CG 3.45Å; V665-P696 VanDerWaalsContact CG1-CG 3.45Å; G667-P696 WeakPolarHBondContact CA-O 3.42Å; R668-P696 PolarHBondContact N-O 3.35Å
697	A	80	Confident	83.2	Confident	50 Å²	50	75.3 Å²	75.3	41%	0.413	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-70.5	156.4	167	0	0	0	0	0	110.7	C693 D699	C693-A697 WeakPolarHBondContact O-CA 2.79Å; A697-D699 PolarHBondContact O-N 3.23Å
698	P	82.3	Confident	83.1	Confident	55 Å²	55	75.7 Å²	75.7	36%	0.357	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-64.8	128.7	173.2	-12.4	25.6	0	0	0	111	V665 G702	V665-P698 WeakPolarHBondContact O-CA 3.43Å; P698-G702 WeakPolarHBondContact CB-O 3.13Å
699	D	72.1	Confident	82.9	Confident	80 Å²	80	73.7 Å²	73.7	43%	0.428	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-141.8	160.8	179.6	-160.8	3	0	0	0	111.2	V665 A697 G701 G702	V665-D699 HydrophobicContact CB-CB 4.02Å; V665-D699 HydrophobicContact CG2-CB 4.4Å; V665-D699 PolarHBondContact N-O 3.28Å; V665-D699 PolarHBondContact O-N 3.44Å; A697-D699 PolarHBondContact O-N 3.23Å; D699-G701 PolarHBondContact O-N 3.47Å; D699-G701 VanDerWaalsContact O-N 3.14Å; D699-G702 PolarHBondContact O-N 3.17Å
700	Y	70.7	Confident	82.7	Confident	109 Å²	109	73.5 Å²	73.5	43%	0.427	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	38.7	-178.2	-51.7	-79.3	0	0	0	114.4	V660 C663 T664 V665	V660-Y700 HydrophobicContact CG1-CD1 4.18Å; V660-Y700 HydrophobicContact CG1-CE1 4.43Å; C663-Y700 HydrophobicContact CB-CD1 4.24Å; C663-Y700 HydrophobicContact CB-CD2 3.94Å; C663-Y700 HydrophobicContact CB-CG 3.78Å; C663-Y700 VanDerWaalsContact O-CD2 3.32Å; C663-Y700 WeakPolarHBondContact O-CD2 3.3Å; T664-Y700 WeakPolarHBondContact CG2-O 3.45Å; V665-Y700 HydrophobicContact CG2-CD2 4.33Å
701	G	67.3	Low	82.8	Confident	77 Å²	77	71.5 Å²	71.5	79%	0.794	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	12.9	-179	0	0	0	0	0	115.3	D699	D699-G701 PolarHBondContact O-N 3.47Å; D699-G701 VanDerWaalsContact O-N 3.14Å
702	G	72.7	Confident	82.6	Confident	12 Å²	12	75.4 Å²	75.4	12%	0.124	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-66	142.5	175.9	0	0	0	0	0	114.5	V665 P698 D699	V665-G702 WeakPolarHBondContact O-CA 3.27Å; P698-G702 WeakPolarHBondContact CB-O 3.13Å; D699-G702 PolarHBondContact O-N 3.17Å
703	R	78	Confident	82.6	Confident	187 Å²	187	71.9 Å²	71.9	71%	0.706	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-49.8	141.1	171.9	-61.1	176.2	-174.3	-172.7	2.4	113.3	H666 G667	H666-R703 PolarHBondContact ND1-N 3.18Å; G667-R703 PolarHBondContact N-O 3.23Å
704	P	84.7	Confident	82.5	Confident	101 Å²	101	78.8 Å²	78.8	66%	0.656	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-70.3	163.1	170.9	31.7	-36	0	0	0	112.1	S706	P704-S706 PolarHBondContact O-N 2.73Å
705	C	87.2	Confident	82.4	Confident	20 Å²	20	76.5 Å²	76.5	14%	0.135	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-68.6	127.2	-179.8	-55.7	0	0	0	0	112.7	G667 R668 W669 C693	G667-C705 PolarHBondContact O-SG 3.47Å; R668-C705 PolarHBondContact N-SG 3.17Å; R668-C705 VanDerWaalsContact N-SG 3.4Å; W669-C705 HydrophobicContact CD2-CB 3.8Å; W669-C705 HydrophobicContact CE3-CB 4.34Å; W669-C705 HydrophobicContact CG-CB 4.26Å; W669-C705 HydrophobicContact CH2-CB 4.11Å; W669-C705 HydrophobicContact CZ2-CB 3.51Å; W669-C705 HydrophobicContact CZ3-CB 4.5Å; C693-C705 WeakPolarHBondContact CA-SG 3.21Å; C693-C705 HydrophobicContact CB-CB 3.82Å; C693-C705 WeakPolarHBondContact CB-SG 3.39Å; C693-C705 WeakPolarHBondContact SG-CB 3.44Å; C693-C705 PolarHBondContact SG-N 3.47Å; C693-C705 CovalentContact SG-SG 2.03Å; C693-C705 PolarHBondContact SG-SG 3.01Å
706	S	85	Confident	82.6	Confident	115 Å²	115	80.5 Å²	80.5	80%	0.804	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-79.5	134	175	-59.1	0	0	0	0	112.6	W669 P704	W669-S706 PolarHBondContact NE1-O 3.38Å; P704-S706 PolarHBondContact O-N 2.73Å
707	G	85.4	Confident	82.2	Confident	52 Å²	52	81 Å²	81	54%	0.536	46%	0.464	S	S	.	.	S	Bend	trans	111.9	177.5	177.5	0	0	0	0	0	113.8	W669	W669-G707 WeakPolarHBondContact CZ2-O 3.49Å
708	P	87.5	Confident	82.1	Confident	85 Å²	85	82.8 Å²	82.8	55%	0.552	47%	0.472	S	S	*	.			trans	-80.6	144.6	-179.8	31.8	-35.3	0	0	0	111.9	R691 V710	R691-P708 VanDerWaalsContact CZ-O 3.25Å; R691-P708 PolarHBondContact NE-O 2.89Å; R691-P708 PolarHBondContact NH2-O 2.82Å; P708-V710 VanDerWaalsContact C-N 3.27Å
709	G	86	Confident	81.1	Confident	25 Å²	25	85.3 Å²	85.3	26%	0.258	49%	0.488	S	S	.	.	S	Bend	trans	-80.9	-2.5	171.1	0	0	0	0	0	114.4	Y690 R691	Y690-G709 CarbonylContact C-O 3.49Å; Y690-G709 WeakPolarHBondContact CA-O 3.36Å; R691-G709 PolarHBondContact N-O 2.79Å
710	V	88.6	Confident	80.4	Confident	52 Å²	52	83.7 Å²	83.7	32%	0.315	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.5	-179.1	-168.9	0	0	0	0	108.7	R689 Y690 P708	R689-V710 WeakPolarHBondContact O-CA 3.38Å; Y690-V710 HydrophobicContact CD1-CG1 4.43Å; Y690-V710 HydrophobicContact CD1-CG2 3.86Å; Y690-V710 HydrophobicContact CE1-CG1 4.23Å; Y690-V710 HydrophobicContact CE1-CG2 3.87Å; P708-V710 VanDerWaalsContact C-N 3.27Å
711	Q	92	Very high	79.6	Confident	68 Å²	68	84.8 Å²	84.8	32%	0.318	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.4	168.2	-170.7	-178.1	-6	0	0	109	W672 W675 H688 R689	W672-Q711 HydrophobicContact CE3-CB 4.24Å; W672-Q711 HydrophobicContact CH2-CB 3.5Å; W672-Q711 VanDerWaalsContact CH2-CB 3.5Å; W672-Q711 HydrophobicContact CZ2-CB 3.84Å; W672-Q711 HydrophobicContact CZ3-CB 3.7Å; W675-Q711 HydrophobicContact CH2-CB 4.16Å; W675-Q711 HydrophobicContact CH2-CG 3.86Å; W675-Q711 WeakPolarHBondContact CZ3-O 3.44Å; H688-Q711 CarbonylContact C-O 3.53Å; H688-Q711 VanDerWaalsContact CA-O 3.27Å; H688-Q711 WeakPolarHBondContact CA-O 3.31Å; R689-Q711 HydrophobicContact CG-CB 4.04Å; R689-Q711 VanDerWaalsContact CZ-OE1 3.28Å; R689-Q711 PolarHBondContact N-O 2.83Å; R689-Q711 PolarHBondContact O-N 2.75Å
712	H	88.3	Confident	78.6	Confident	128 Å²	128	86.5 Å²	86.5	59%	0.593	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	146.9	173.4	-59.9	-92.1	0	0	0	109.3	R687	R687-H712 WeakPolarHBondContact O-CA 3.43Å
713	E	89.7	Confident	76.9	Confident	74 Å²	74	91.2 Å²	91.2	35%	0.346	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	141.6	175	-178	-177.6	-164.2	0	0	108.4	W675 S686 R687	W675-E713 HydrophobicContact CE3-CB 4.47Å; W675-E713 HydrophobicContact CH2-CB 3.33Å; W675-E713 HydrophobicContact CH2-CG 4.43Å; W675-E713 HydrophobicContact CZ2-CB 3.77Å; W675-E713 HydrophobicContact CZ2-CG 4.44Å; W675-E713 WeakPolarHBondContact CZ2-OE2 3.45Å; W675-E713 HydrophobicContact CZ3-CB 3.72Å; W675-E713 PolarHBondContact NE1-OE2 2.62Å; S686-E713 CarbonylContact C-O 3.54Å; S686-E713 WeakPolarHBondContact CA-O 3.45Å; R687-E713 HydrophobicContact CG-CB 4.1Å; R687-E713 IonicContact CZ-OE2 2.73Å; R687-E713 PolarHBondContact N-O 3.38Å; R687-E713 IonicContact NE-OE2 2.77Å; R687-E713 PolarHBondContact NE-OE2 3.27Å; R687-E713 IonicContact NH2-OE1 3.14Å; R687-E713 PolarHBondContact NH2-OE1 2.94Å; R687-E713 VanDerWaalsContact NH2-OE1 3.12Å; R687-E713 IonicContact NH2-OE2 2.68Å; R687-E713 PolarHBondContact NH2-OE2 2.75Å; R687-E713 PolarHBondContact O-N 2.81Å
714	Y	86.2	Confident	75.1	Confident	185 Å²	185	89.1 Å²	89.1	73%	0.725	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	141	176.2	-65.7	-76.2	0	0	0	110.3	I684 S685	I684-Y714 HydrophobicContact CG2-CD1 4.23Å; I684-Y714 HydrophobicContact CG2-CE1 4.06Å; S685-Y714 WeakPolarHBondContact O-CA 3.38Å
715	C	84.5	Confident	72.8	Confident	18 Å²	18	91.9 Å²	91.9	12%	0.122	54%	0.539	C	S	.	.			trans	-89.8	139.5	173.6	-68.8	0	0	0	0	110.9	C678 S685 V717	C678-C715 VanDerWaalsContact CA-SG 3.6Å; C678-C715 HydrophobicContact CB-CB 3.71Å; C678-C715 WeakPolarHBondContact CB-SG 3.36Å; C678-C715 WeakPolarHBondContact SG-CB 3.02Å; C678-C715 CovalentContact SG-SG 2.03Å; C678-C715 PolarHBondContact SG-SG 3.2Å; S685-C715 PolarHBondContact O-N 3.24Å; C715-V717 HydrophobicContact CB-CG1 3.99Å; C715-V717 PolarHBondContact O-N 3.14Å; C715-V717 VanDerWaalsContact O-N 3.15Å
716	D	82.8	Confident	70.3	Confident	175 Å²	175	96.8 Å²	96.8	94%	0.936	57%	0.569	S	S	*	*			trans	-80	89.9	168.7	-159.8	10.6	0	0	0	108.4
717	V	74.6	Confident	68.4	Low	32 Å²	32	97 Å²	97	19%	0.194	57%	0.567	C	S	.	*			trans	-119.9	149	178.5	-67.9	0	0	0	0	109.6	G683 C715	G683-V717 WeakPolarHBondContact O-CG2 3.26Å; C715-V717 HydrophobicContact CB-CG1 3.99Å; C715-V717 PolarHBondContact O-N 3.14Å; C715-V717 VanDerWaalsContact O-N 3.15Å
718	P	77.6	Confident	66.4	Low	89 Å²	89	98.7 Å²	98.7	58%	0.578	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-57.2	144.7	-178.7	22	-33.2	0	0	0	111.7	C682 G683 C720	C682-P718 WeakPolarHBondContact CA-O 3.36Å; C682-P718 WeakPolarHBondContact CB-O 3.49Å; G683-P718 PolarHBondContact N-O 3.02Å; G683-P718 VanDerWaalsContact N-O 3.08Å; P718-C720 PolarHBondContact O-N 2.95Å
719	P	62.7	Low	64.7	Low	108 Å²	108	99.1 Å²	99.1	70%	0.701	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-58.2	136.9	174.6	24.4	-33	0	0	0	109.9
720	C	57.5	Low	63.2	Low	45 Å²	45	105.2 Å²	105.2	30%	0.304	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-57.8	149.7	170.4	-63.7	0	0	0	0	109.7	C682 G683 P718 T722	C682-C720 HydrophobicContact CB-CB 3.92Å; C682-C720 WeakPolarHBondContact CB-SG 3.38Å; C682-C720 PolarHBondContact O-SG 3.38Å; C682-C720 VanDerWaalsContact O-SG 3.42Å; C682-C720 WeakPolarHBondContact SG-CA 3.23Å; C682-C720 WeakPolarHBondContact SG-CB 3.46Å; C682-C720 CovalentContact SG-SG 2.05Å; C682-C720 PolarHBondContact SG-SG 2.8Å; G683-C720 PolarHBondContact N-SG 2.93Å; P718-C720 PolarHBondContact O-N 2.95Å; C720-T722 WeakPolarHBondContact O-CG2 3.41Å; C720-T722 PolarHBondContact O-N 2.82Å
721	P	54.2	Low	62	Low	133 Å²	133	110.4 Å²	110.4	86%	0.864	62%	0.619	S	S	*	*			trans	-57	108.7	178	22.4	-33.1	0	0	0	110.4
722	T	46	Very low	61.3	Low	113 Å²	113	111.9 Å²	111.9	69%	0.693	62%	0.621	S	S	*	*			trans	-102.2	123.8	-172.2	33.2	0	0	0	0	111.6	C720 N724	C720-T722 WeakPolarHBondContact O-CG2 3.41Å; C720-T722 PolarHBondContact O-N 2.82Å; T722-N724 PolarHBondContact O-N 3.02Å
723	S	36.5	Very low	61.1	Low	110 Å²	110	109.2 Å²	109.2	77%	0.769	61%	0.611	S	S	*	*	S	Bend	trans	-70.9	105.8	146.6	54.8	0	0	0	0	108.8
724	N	39.4	Very low	60.9	Low	143 Å²	143	106.2 Å²	106.2	77%	0.765	60%	0.601	S	S	*	*	S	Bend	trans	69.9	86	155.6	-54	-22.5	0	0	0	119.2	T722	T722-N724 PolarHBondContact O-N 3.02Å
725	I	36.4	Very low	60.9	Low	159 Å²	159	103.4 Å²	103.4	82%	0.815	59%	0.594	S	S	*	*				50.1	133.3	120.9	-55.5	173.3	0	0	0	120.6
726	V	35	Very low	61.3	Low	124 Å²	124	105.3 Å²	105.3	75%	0.752	60%	0.599	S	S	*	*			trans	-70.7	148.1	-173.5	175.6	0	0	0	0	115.2
727	P	45.1	Very low	61.7	Low	120 Å²	120	98.3 Å²	98.3	78%	0.779	56%	0.563	S	S	*	*				-118.2	153.9	123.2	-5.5	25.3	0	0	0	113.2
728	A	44.7	Very low	62.5	Low	87 Å²	87	100.9 Å²	100.9	72%	0.719	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-62.7	137.6	-175.7	0	0	0	0	0	113
729	P	51.6	Low	63.2	Low	94 Å²	94	100.1 Å²	100.1	61%	0.61	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-77.9	132.6	-172.8	30.2	-34.6	0	0	0	112.9	N767	P729-N767 PolarHBondContact O-ND2 3Å
730	L	53.9	Low	64.5	Low	153 Å²	153	97.8 Å²	97.8	80%	0.801	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-62.3	157.5	178.4	-67.5	163.1	0	0	0	113.1	R732 N767	L730-R732 PolarHBondContact O-N 2.73Å; L730-N767 PolarHBondContact O-ND2 2.9Å
731	R	64.2	Low	66.1	Low	161 Å²	161	101.2 Å²	101.2	61%	0.608	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-61.8	124.3	167.7	-172.2	174.9	-171.9	-128.1	-8.1	108.8	G768 D770	R731-G768 PolarHBondContact NE-O 3.01Å; R731-G768 PolarHBondContact NH2-O 3.46Å; R731-D770 IonicContact NH2-OD1 2.91Å; R731-D770 PolarHBondContact NH2-OD1 3.02Å
732	R	77.4	Confident	67.9	Low	98 Å²	98	97.7 Å²	97.7	37%	0.37	55%	0.549	S	S	.	.	B	Isolated β-bridge	trans	-130.2	109.5	-172.7	-168	-178.5	70.8	-165.5	6.3	110.5	L730 P763 S764 P765 M766	L730-R732 PolarHBondContact O-N 2.73Å; R732-P763 HydrophobicContact CG-CG 4.02Å; R732-S764 PolarHBondContact NE-O 3.25Å; R732-S764 PolarHBondContact NH2-O 3.09Å; R732-P765 WeakPolarHBondContact O-CA 3.1Å; R732-M766 HydrophobicContact CB-CB 4.44Å; R732-M766 PolarHBondContact N-O 2.57Å; R732-M766 VanDerWaalsContact N-O 3.09Å; R732-M766 PolarHBondContact NH2-SD 2.75Å; R732-M766 PolarHBondContact O-N 3.34Å
733	N	84.1	Confident	70	Confident	72 Å²	72	99 Å²	99	39%	0.385	55%	0.545	S	S	.	.			trans	-64.7	145.5	175	-71.4	6.9	0	0	0	110.4	G769 D770	N733-G769 WeakPolarHBondContact OD1-CA 3.47Å; N733-D770 PolarHBondContact ND2-OD2 2.74Å; N733-D770 PolarHBondContact OD1-N 2.86Å; N733-D770 PolarHBondContact OD1-OD2 2.82Å
734	G	84.1	Confident	72.3	Confident	12 Å²	12	99.7 Å²	99.7	12%	0.124	55%	0.547	C	S	.	.			trans	-67	138.5	177.5	0	0	0	0	0	111.9	P763 D770	G734-P763 WeakPolarHBondContact CA-O 3.27Å; G734-D770 PolarHBondContact N-O 3.33Å
735	Q	87.1	Confident	74.7	Confident	126 Å²	126	94.9 Å²	94.9	59%	0.589	52%	0.524	S	S	*	.			trans	-122.9	150.3	165.1	-51.7	173.5	-4.8	0	0	110.2	D761 N762 P763	Q735-D761 PolarHBondContact O-N 3.04Å; Q735-N762 WeakPolarHBondContact CB-O 3.42Å; Q735-N762 CarbonylContact O-C 3.53Å; Q735-N762 PolarHBondContact O-N 2.71Å; Q735-N762 VanDerWaalsContact O-N 3.12Å; Q735-P763 PolarHBondContact N-O 3.29Å
736	W	92.5	Very high	76.9	Confident	58 Å²	58	91.1 Å²	91.1	22%	0.22	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-67.9	137.5	179.7	-70.2	113	0	0	0	111.4	R758 S759 C760 C772 L773 G774	W736-R758 VanDerWaalsContact CD1-NH1 3.29Å; W736-R758 HydrophobicContact CD2-CG 4.02Å; W736-R758 HydrophobicContact CE3-CB 4.23Å; W736-R758 HydrophobicContact CE3-CG 3.48Å; W736-R758 VanDerWaalsContact CE3-CG 3.48Å; W736-R758 HydrophobicContact CZ3-CG 3.91Å; W736-S759 WeakPolarHBondContact CA-O 3.16Å; W736-C760 HydrophobicContact CE3-CB 4.26Å; W736-C760 HydrophobicContact CZ3-CB 4.08Å; W736-C772 HydrophobicContact CD2-CB 3.67Å; W736-C772 HydrophobicContact CE3-CB 4.2Å; W736-C772 HydrophobicContact CG-CB 4.12Å; W736-C772 HydrophobicContact CH2-CB 4.07Å; W736-C772 HydrophobicContact CZ2-CB 3.51Å; W736-C772 HydrophobicContact CZ3-CB 4.39Å; W736-L773 PolarHBondContact NE1-O 3.34Å; W736-G774 VanDerWaalsContact CZ2-O 3.27Å; W736-G774 WeakPolarHBondContact CZ2-O 3.44Å
737	S	90.8	Very high	78.9	Confident	27 Å²	27	89.7 Å²	89.7	19%	0.189	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-62.7	161.9	159.4	36.8	0	0	0	0	111.8	W739 S759 D761	S737-W739 PolarHBondContact O-N 2.86Å; S737-S759 PolarHBondContact N-O 3.22Å; S737-S759 WeakPolarHBondContact OG-CA 3.36Å; S737-S759 WeakPolarHBondContact OG-CB 3.29Å; S737-S759 PolarHBondContact OG-N 3.44Å; S737-S759 PolarHBondContact OG-O 3.22Å; S737-D761 WeakPolarHBondContact CB-OD1 3.31Å; S737-D761 PolarHBondContact OG-OD1 3.46Å
738	A	91	Very high	80.5	Confident	87 Å²	87	93.3 Å²	93.3	72%	0.719	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-52	140.2	165.6	0	0	0	0	0	109.9
739	W	93.2	Very high	82.2	Confident	72 Å²	72	90.1 Å²	90.1	27%	0.273	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-58.6	140.7	174	-72.9	106.9	0	0	0	111.1	S737 R756 R758 E778	S737-W739 PolarHBondContact O-N 2.86Å; W739-R756 HydrophobicContact CD2-CG 4.02Å; W739-R756 HydrophobicContact CE3-CB 4.21Å; W739-R756 HydrophobicContact CE3-CG 3.6Å; W739-R756 HydrophobicContact CG-CG 4.44Å; W739-R756 HydrophobicContact CZ3-CG 4.06Å; W739-R758 HydrophobicContact CD2-CB 3.99Å; W739-R758 HydrophobicContact CD2-CG 4.01Å; W739-R758 HydrophobicContact CE3-CB 3.7Å; W739-R758 HydrophobicContact CE3-CG 3.68Å; W739-R758 HydrophobicContact CH2-CG 3.72Å; W739-R758 VanDerWaalsContact CZ2-CD 3.45Å; W739-R758 HydrophobicContact CZ2-CG 4.05Å; W739-R758 HydrophobicContact CZ3-CB 4.06Å; W739-R758 HydrophobicContact CZ3-CG 3.54Å; W739-E778 HydrophobicContact CH2-CB 3.63Å; W739-E778 HydrophobicContact CZ2-CB 4.12Å; W739-E778 WeakPolarHBondContact CZ2-OE2 3.3Å; W739-E778 HydrophobicContact CZ3-CB 3.93Å
740	T	90.6	Very high	83.2	Confident	59 Å²	59	87.8 Å²	87.8	36%	0.362	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-59.8	152.4	166	55.5	0	0	0	0	110.5	W742 R756 T757	T740-W742 PolarHBondContact O-N 3.14Å; T740-R756 WeakPolarHBondContact O-CB 3.43Å; T740-T757 WeakPolarHBondContact CG2-O 3.31Å; T740-T757 WeakPolarHBondContact CG2-OG1 3.41Å; T740-T757 PolarHBondContact N-O 3.03Å; T740-T757 PolarHBondContact OG1-N 3.34Å; T740-T757 PolarHBondContact OG1-O 3.34Å; T740-T757 PolarHBondContact OG1-OG1 3.23Å
741	P	91.4	Very high	84.4	Confident	118 Å²	118	81.7 Å²	81.7	77%	0.766	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-52.6	141.5	168.7	-25.7	34.9	0	0	0	110.9	K743	P741-K743 PolarHBondContact O-N 3.09Å
742	W	91	Very high	85.2	Confident	58 Å²	58	74 Å²	74	22%	0.22	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-55.4	130	175.3	-75.2	113	0	0	0	110.8	T740 R754 R756 E778 E780	T740-W742 PolarHBondContact O-N 3.14Å; W742-R754 HydrophobicContact CB-CG 4.4Å; W742-R754 HydrophobicContact CD2-CG 3.9Å; W742-R754 HydrophobicContact CE3-CB 3.97Å; W742-R754 HydrophobicContact CE3-CG 3.6Å; W742-R754 HydrophobicContact CG-CG 4.28Å; W742-R754 HydrophobicContact CZ3-CG 4.1Å; W742-R754 WeakPolarHBondContact CZ3-O 3.34Å; W742-R756 HydrophobicContact CD2-CB 3.92Å; W742-R756 HydrophobicContact CD2-CG 3.93Å; W742-R756 VanDerWaalsContact CE2-CD 3.45Å; W742-R756 HydrophobicContact CE3-CB 3.69Å; W742-R756 HydrophobicContact CE3-CG 3.76Å; W742-R756 VanDerWaalsContact CE3-N 3.33Å; W742-R756 HydrophobicContact CG-CB 4.49Å; W742-R756 HydrophobicContact CH2-CB 4.49Å; W742-R756 HydrophobicContact CH2-CG 3.65Å; W742-R756 VanDerWaalsContact CZ2-CD 3.48Å; W742-R756 HydrophobicContact CZ2-CG 3.82Å; W742-R756 HydrophobicContact CZ3-CB 4.02Å; W742-R756 HydrophobicContact CZ3-CG 3.63Å; W742-E778 HydrophobicContact CH2-CB 4.22Å; W742-E778 HydrophobicContact CH2-CG 4Å; W742-E778 WeakPolarHBondContact CZ3-O 3.05Å; W742-E780 HydrophobicContact CH2-CB 3.42Å; W742-E780 VanDerWaalsContact CH2-CB 3.42Å; W742-E780 HydrophobicContact CZ2-CB 3.72Å; W742-E780 HydrophobicContact CZ2-CG 4.41Å; W742-E780 WeakPolarHBondContact CZ2-OE2 3.34Å; W742-E780 HydrophobicContact CZ3-CB 3.89Å; W742-E780 PolarHBondContact NE1-OE2 3.12Å
743	K	89.1	Confident	85.7	Confident	142 Å²	142	75.6 Å²	75.6	62%	0.617	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-60.6	154.5	168	-70.3	-163.4	175	-163.1	0	110.7	P741 R754 K755	P741-K743 PolarHBondContact O-N 3.09Å; K743-R754 VanDerWaalsContact O-CB 3.29Å; K743-R754 WeakPolarHBondContact O-CB 3.5Å; K743-K755 WeakPolarHBondContact CB-O 3.39Å; K743-K755 PolarHBondContact N-O 3.16Å
744	P	86.9	Confident	86	Confident	123 Å²	123	76.2 Å²	76.2	80%	0.799	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-51	147.7	172	-26.9	35.2	0	0	0	112.3
745	C	88.2	Confident	86.3	Confident	42 Å²	42	78.7 Å²	78.7	28%	0.284	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-62.8	140.9	-179.4	-163.2	0	0	0	0	111.6	K747 C782	C745-K747 WeakPolarHBondContact CB-O 3.45Å; C745-K747 PolarHBondContact O-N 3.06Å; C745-K747 PolarHBondContact SG-O 2.8Å; C745-C782 VanDerWaalsContact CA-SG 3.56Å; C745-C782 HydrophobicContact CB-CB 3.94Å; C745-C782 WeakPolarHBondContact CB-SG 3.4Å; C745-C782 WeakPolarHBondContact SG-CB 3.24Å; C745-C782 PolarHBondContact SG-O 3Å; C745-C782 CovalentContact SG-SG 2.03Å; C745-C782 PolarHBondContact SG-SG 3.28Å
746	S	84	Confident	86.6	Confident	80 Å²	80	75.6 Å²	75.6	56%	0.559	41%	0.406	S	S	*	.	S	Bend	trans	-65.2	-18.7	-179.8	66.8	0	0	0	0	114.5	G752 F753	S746-G752 WeakPolarHBondContact OG-CA 3.24Å; S746-F753 WeakPolarHBondContact CB-O 3.5Å; S746-F753 PolarHBondContact N-O 3.09Å; S746-F753 PolarHBondContact OG-N 3.26Å; S746-F753 PolarHBondContact OG-O 2.82Å
747	K	76.5	Confident	86.6	Confident	95 Å²	95	75.3 Å²	75.3	41%	0.413	41%	0.411	S	S	.	.			trans	-135.9	151.9	169.2	-55.6	-169.4	-159.1	151.5	0	110.1	C745 C749 G750 G751	C745-K747 WeakPolarHBondContact CB-O 3.45Å; C745-K747 PolarHBondContact O-N 3.06Å; C745-K747 PolarHBondContact SG-O 2.8Å; K747-C749 WeakPolarHBondContact CB-O 3.47Å; K747-G750 PolarHBondContact NZ-O 3.25Å; K747-G751 VanDerWaalsContact CD-O 3.25Å; K747-G751 WeakPolarHBondContact CD-O 3.24Å; K747-G751 WeakPolarHBondContact CE-O 3.48Å; K747-G751 PolarHBondContact NZ-O 3.34Å
748	K	77.7	Confident	86.7	Confident	196 Å²	196	76.4 Å²	76.4	85%	0.852	41%	0.411	S	S	*	.	S	Bend	trans	-80.9	-27.4	173.8	-66.8	-176	178.1	-179.8	0	113.1
749	C	81	Confident	86.6	Confident	19 Å²	19	75.3 Å²	75.3	13%	0.128	40%	0.398	C	S	.	.	S	Bend	trans	-151.3	165.8	-178.3	61.7	0	0	0	0	109.5	K747 G751 G783 Q785 C787	K747-C749 WeakPolarHBondContact CB-O 3.47Å; C749-G751 PolarHBondContact O-N 3.21Å; C749-G783 CarbonylContact C-O 3.59Å; C749-G783 VanDerWaalsContact CA-O 3.24Å; C749-G783 WeakPolarHBondContact CA-O 3.41Å; C749-Q785 CarbonylContact C-O 3.55Å; C749-Q785 WeakPolarHBondContact CA-O 3.28Å; C749-Q785 WeakPolarHBondContact CB-O 3.49Å; C749-C787 HydrophobicContact CB-CB 3.93Å; C749-C787 WeakPolarHBondContact CB-SG 3.27Å; C749-C787 WeakPolarHBondContact SG-CA 3.04Å; C749-C787 WeakPolarHBondContact SG-CB 2.9Å; C749-C787 CovalentContact SG-SG 2.04Å; C749-C787 PolarHBondContact SG-SG 2.73Å
750	G	72.8	Confident	86.4	Confident	46 Å²	46	73.7 Å²	73.7	47%	0.474	40%	0.397	S	S	.	.	S	Bend	trans	69	29.9	175.4	0	0	0	0	0	115.1	K747 G783 Q785	K747-G750 PolarHBondContact NZ-O 3.25Å; G750-G783 PolarHBondContact N-O 2.84Å; G750-Q785 PolarHBondContact N-O 3.3Å
751	G	78.1	Confident	86	Confident	24 Å²	24	74.6 Å²	74.6	25%	0.247	40%	0.4	C	S	.	.	S	Bend	trans	75.3	109.2	171.3	0	0	0	0	0	114.3	K747 C749 G783	K747-G751 VanDerWaalsContact CD-O 3.25Å; K747-G751 WeakPolarHBondContact CD-O 3.24Å; K747-G751 WeakPolarHBondContact CE-O 3.48Å; K747-G751 PolarHBondContact NZ-O 3.34Å; C749-G751 PolarHBondContact O-N 3.21Å; G751-G783 PolarHBondContact N-O 3.19Å
752	G	82.8	Confident	85.6	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.01	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	-168.9	173.6	0	0	0	0	0	111.7	S746 C782	S746-G752 WeakPolarHBondContact OG-CA 3.24Å; G752-C782 CarbonylContact C-O 3.54Å; G752-C782 WeakPolarHBondContact CA-O 3.18Å; G752-C782 PolarHBondContact N-O 2.86Å; G752-C782 PolarHBondContact O-N 3.09Å; G752-C782 VanDerWaalsContact O-O 3.12Å
753	F	86.8	Confident	85.3	Confident	130 Å²	130	72.7 Å²	72.7	57%	0.57	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	141	-177.6	-42.2	-75.3	0	0	0	110.5	S746 E780	S746-F753 WeakPolarHBondContact CB-O 3.5Å; S746-F753 PolarHBondContact N-O 3.09Å; S746-F753 PolarHBondContact OG-N 3.26Å; S746-F753 PolarHBondContact OG-O 2.82Å; F753-E780 CarbonylContact C-O 3.6Å; F753-E780 VanDerWaalsContact CA-O 3.32Å; F753-E780 WeakPolarHBondContact CA-O 3.45Å
754	R	90.4	Very high	85	Confident	86 Å²	86	68.4 Å²	68.4	33%	0.325	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	156.7	167.1	56.5	-175.1	-164.6	-168.6	-5.6	110	W742 K743 F779 E780 C782	W742-R754 HydrophobicContact CB-CG 4.4Å; W742-R754 HydrophobicContact CD2-CG 3.9Å; W742-R754 HydrophobicContact CE3-CB 3.97Å; W742-R754 HydrophobicContact CE3-CG 3.6Å; W742-R754 HydrophobicContact CG-CG 4.28Å; W742-R754 HydrophobicContact CZ3-CG 4.1Å; W742-R754 WeakPolarHBondContact CZ3-O 3.34Å; K743-R754 VanDerWaalsContact O-CB 3.29Å; K743-R754 WeakPolarHBondContact O-CB 3.5Å; R754-F779 WeakPolarHBondContact O-CA 3.26Å; R754-E780 HydrophobicContact CG-CB 4.02Å; R754-E780 IonicContact CZ-OE1 3.12Å; R754-E780 IonicContact CZ-OE2 2.71Å; R754-E780 PolarHBondContact N-O 3.3Å; R754-E780 IonicContact NE-OE2 2.71Å; R754-E780 PolarHBondContact NE-OE2 3.08Å; R754-E780 IonicContact NH2-OE1 3.91Å; R754-E780 PolarHBondContact NH2-OE1 3.19Å; R754-E780 IonicContact NH2-OE2 3.11Å; R754-E780 PolarHBondContact NH2-OE2 3.32Å; R754-E780 PolarHBondContact O-N 3.06Å; R754-E780 VanDerWaalsContact O-N 3.08Å; R754-C782 HydrophobicContact CG-CB 4.34Å; R754-C782 PolarHBondContact N-SG 2.94Å
755	K	91.3	Very high	84.8	Confident	64 Å²	64	64.5 Å²	64.5	28%	0.278	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134.6	-176.5	-175.6	178	-174.3	169.8	0	111.5	K743 E778 F779	K743-K755 WeakPolarHBondContact CB-O 3.39Å; K743-K755 PolarHBondContact N-O 3.16Å; K755-E778 WeakPolarHBondContact CA-O 3.49Å; K755-F779 HydrophobicContact CB-CD1 4.17Å; K755-F779 HydrophobicContact CB-CE1 4.2Å; K755-F779 HydrophobicContact CD-CD1 4.5Å; K755-F779 HydrophobicContact CD-CE1 3.75Å; K755-F779 HydrophobicContact CD-CZ 3.96Å; K755-F779 HydrophobicContact CG-CD1 4.23Å; K755-F779 HydrophobicContact CG-CE1 3.96Å; K755-F779 HydrophobicContact CG-CZ 4.35Å
756	R	93.3	Very high	84.2	Confident	61 Å²	61	66.5 Å²	66.5	23%	0.23	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	161.2	168	65.9	-179.6	-178.1	-163.3	-7.3	111.5	W739 T740 W742 Q777 E778	W739-R756 HydrophobicContact CD2-CG 4.02Å; W739-R756 HydrophobicContact CE3-CB 4.21Å; W739-R756 HydrophobicContact CE3-CG 3.6Å; W739-R756 HydrophobicContact CG-CG 4.44Å; W739-R756 HydrophobicContact CZ3-CG 4.06Å; T740-R756 WeakPolarHBondContact O-CB 3.43Å; W742-R756 HydrophobicContact CD2-CB 3.92Å; W742-R756 HydrophobicContact CD2-CG 3.93Å; W742-R756 VanDerWaalsContact CE2-CD 3.45Å; W742-R756 HydrophobicContact CE3-CB 3.69Å; W742-R756 HydrophobicContact CE3-CG 3.76Å; W742-R756 VanDerWaalsContact CE3-N 3.33Å; W742-R756 HydrophobicContact CG-CB 4.49Å; W742-R756 HydrophobicContact CH2-CB 4.49Å; W742-R756 HydrophobicContact CH2-CG 3.65Å; W742-R756 VanDerWaalsContact CZ2-CD 3.48Å; W742-R756 HydrophobicContact CZ2-CG 3.82Å; W742-R756 HydrophobicContact CZ3-CB 4.02Å; W742-R756 HydrophobicContact CZ3-CG 3.63Å; R756-Q777 WeakPolarHBondContact O-CA 3.36Å; R756-E778 HydrophobicContact CG-CB 3.93Å; R756-E778 IonicContact CZ-OE1 2.99Å; R756-E778 IonicContact CZ-OE2 2.71Å; R756-E778 PolarHBondContact N-O 3.04Å; R756-E778 IonicContact NE-OE1 2.84Å; R756-E778 IonicContact NE-OE2 2.77Å; R756-E778 PolarHBondContact NE-OE2 3.16Å; R756-E778 IonicContact NH2-OE1 3.67Å; R756-E778 PolarHBondContact NH2-OE1 3.4Å; R756-E778 IonicContact NH2-OE2 3.16Å; R756-E778 PolarHBondContact NH2-OE2 3.25Å; R756-E778 PolarHBondContact O-N 3.06Å
757	T	91	Very high	83.6	Confident	51 Å²	51	66.8 Å²	66.8	31%	0.313	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	151.3	-174.2	59.3	0	0	0	0	111.3	T740 S776 Q777	T740-T757 WeakPolarHBondContact CG2-O 3.31Å; T740-T757 WeakPolarHBondContact CG2-OG1 3.41Å; T740-T757 PolarHBondContact N-O 3.03Å; T740-T757 PolarHBondContact OG1-N 3.34Å; T740-T757 PolarHBondContact OG1-O 3.34Å; T740-T757 PolarHBondContact OG1-OG1 3.23Å; T757-S776 CarbonylContact C-O 3.43Å; T757-S776 VanDerWaalsContact CA-O 3.31Å; T757-S776 WeakPolarHBondContact CA-O 3.28Å; T757-Q777 HydrophobicContact CG2-CG 4.2Å
758	R	93.1	Very high	83.2	Confident	51 Å²	51	65 Å²	65	19%	0.192	36%	0.362	C	S	.	.			trans	-140.7	153.9	174	59.2	178.6	177.8	176.7	-0.2	110.3	W736 W739 S775 S776	W736-R758 VanDerWaalsContact CD1-NH1 3.29Å; W736-R758 HydrophobicContact CD2-CG 4.02Å; W736-R758 HydrophobicContact CE3-CB 4.23Å; W736-R758 HydrophobicContact CE3-CG 3.48Å; W736-R758 VanDerWaalsContact CE3-CG 3.48Å; W736-R758 HydrophobicContact CZ3-CG 3.91Å; W739-R758 HydrophobicContact CD2-CB 3.99Å; W739-R758 HydrophobicContact CD2-CG 4.01Å; W739-R758 HydrophobicContact CE3-CB 3.7Å; W739-R758 HydrophobicContact CE3-CG 3.68Å; W739-R758 HydrophobicContact CH2-CG 3.72Å; W739-R758 VanDerWaalsContact CZ2-CD 3.45Å; W739-R758 HydrophobicContact CZ2-CG 4.05Å; W739-R758 HydrophobicContact CZ3-CB 4.06Å; W739-R758 HydrophobicContact CZ3-CG 3.54Å; R758-S775 VanDerWaalsContact CZ-O 3.28Å; R758-S775 PolarHBondContact NE-O 2.92Å; R758-S775 PolarHBondContact NH2-O 3.02Å; R758-S776 PolarHBondContact N-O 3.24Å; R758-S776 WeakPolarHBondContact O-CB 3.46Å
759	S	88.9	Confident	83.2	Confident	63 Å²	63	56.2 Å²	56.2	44%	0.441	33%	0.327	S	S	.	.			trans	-109.8	153.7	-179.9	-69.1	0	0	0	0	110.5	W736 S737 D761	W736-S759 WeakPolarHBondContact CA-O 3.16Å; S737-S759 PolarHBondContact N-O 3.22Å; S737-S759 WeakPolarHBondContact OG-CA 3.36Å; S737-S759 WeakPolarHBondContact OG-CB 3.29Å; S737-S759 PolarHBondContact OG-N 3.44Å; S737-S759 PolarHBondContact OG-O 3.22Å; S759-D761 VanDerWaalsContact C-N 3.26Å; S759-D761 VanDerWaalsContact C-OD1 3.3Å; S759-D761 WeakPolarHBondContact CB-OD1 3.37Å; S759-D761 WeakPolarHBondContact CB-OD2 3.34Å; S759-D761 PolarHBondContact O-N 2.6Å; S759-D761 VanDerWaalsContact O-OD1 3.13Å
760	C	89	Confident	83.2	Confident	38 Å²	38	59.3 Å²	59.3	26%	0.257	34%	0.342	S	S	.	.	S	Bend	trans	-92	63.8	176.8	-175	0	0	0	0	109.2	W736 S764 P765 C772	W736-C760 HydrophobicContact CE3-CB 4.26Å; W736-C760 HydrophobicContact CZ3-CB 4.08Å; C760-S764 WeakPolarHBondContact O-CA 2.93Å; C760-P765 WeakPolarHBondContact O-CD 3.49Å; C760-C772 WeakPolarHBondContact CA-SG 3.4Å; C760-C772 HydrophobicContact CB-CB 3.85Å; C760-C772 WeakPolarHBondContact CB-SG 3.12Å; C760-C772 WeakPolarHBondContact SG-CB 3.41Å; C760-C772 PolarHBondContact SG-N 3.35Å; C760-C772 CovalentContact SG-SG 2.03Å; C760-C772 PolarHBondContact SG-SG 3.16Å
761	D	83.6	Confident	83.6	Confident	78 Å²	78	63.4 Å²	63.4	42%	0.417	35%	0.353	S	S	.	.			trans	-135.8	-0.4	-165.3	58.1	-8.7	0	0	0	115.2	Q735 S737 S759 P763 S764	Q735-D761 PolarHBondContact O-N 3.04Å; S737-D761 WeakPolarHBondContact CB-OD1 3.31Å; S737-D761 PolarHBondContact OG-OD1 3.46Å; S759-D761 VanDerWaalsContact C-N 3.26Å; S759-D761 VanDerWaalsContact C-OD1 3.3Å; S759-D761 WeakPolarHBondContact CB-OD1 3.37Å; S759-D761 WeakPolarHBondContact CB-OD2 3.34Å; S759-D761 PolarHBondContact O-N 2.6Å; S759-D761 VanDerWaalsContact O-OD1 3.13Å; D761-P763 VanDerWaalsContact C-CA 3.47Å; D761-P763 CarbonylContact O-C 3.58Å; D761-P763 WeakPolarHBondContact O-CA 3.38Å; D761-S764 WeakPolarHBondContact CA-OG 3.39Å; D761-S764 PolarHBondContact O-N 3.31Å; D761-S764 VanDerWaalsContact O-N 3.12Å
762	N	81.3	Confident	84.1	Confident	104 Å²	104	63.2 Å²	63.2	56%	0.556	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	65.9	-177.1	-168.7	50.2	0	0	0	113.6	Q735	Q735-N762 WeakPolarHBondContact CB-O 3.42Å; Q735-N762 CarbonylContact O-C 3.53Å; Q735-N762 PolarHBondContact O-N 2.71Å; Q735-N762 VanDerWaalsContact O-N 3.12Å
763	P	86.1	Confident	84.1	Confident	33 Å²	33	70.9 Å²	70.9	21%	0.214	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	cis	-97.9	156.7	5.5	37.3	-32.9	0	0	0	112.7	R732 G734 Q735 D761	R732-P763 HydrophobicContact CG-CG 4.02Å; G734-P763 WeakPolarHBondContact CA-O 3.27Å; Q735-P763 PolarHBondContact N-O 3.29Å; D761-P763 VanDerWaalsContact C-CA 3.47Å; D761-P763 CarbonylContact O-C 3.58Å; D761-P763 WeakPolarHBondContact O-CA 3.38Å
764	S	81.8	Confident	84.1	Confident	51 Å²	51	67.5 Å²	67.5	36%	0.357	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-59.6	145.5	170.8	-47.5	0	0	0	0	111.4	R732 C760 D761 M766	R732-S764 PolarHBondContact NE-O 3.25Å; R732-S764 PolarHBondContact NH2-O 3.09Å; C760-S764 WeakPolarHBondContact O-CA 2.93Å; D761-S764 WeakPolarHBondContact CA-OG 3.39Å; D761-S764 PolarHBondContact O-N 3.31Å; D761-S764 VanDerWaalsContact O-N 3.12Å; S764-M766 PolarHBondContact O-N 2.91Å
765	P	83.9	Confident	83.9	Confident	41 Å²	41	67.3 Å²	67.3	27%	0.266	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-54	128.4	169.3	-16.1	23.8	0	0	0	110.5	R732 C760	R732-P765 WeakPolarHBondContact O-CA 3.1Å; C760-P765 WeakPolarHBondContact O-CD 3.49Å
766	M	74.3	Confident	83.8	Confident	84 Å²	84	67 Å²	67	41%	0.414	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-134.7	152.1	176.7	-76.5	-172.7	72.8	0	0	111	R732 S764 G768 G769	R732-M766 HydrophobicContact CB-CB 4.44Å; R732-M766 PolarHBondContact N-O 2.57Å; R732-M766 VanDerWaalsContact N-O 3.09Å; R732-M766 PolarHBondContact NH2-SD 2.75Å; R732-M766 PolarHBondContact O-N 3.34Å; S764-M766 PolarHBondContact O-N 2.91Å; M766-G768 PolarHBondContact O-N 2.84Å; M766-G769 PolarHBondContact O-N 2.81Å; M766-G769 VanDerWaalsContact O-N 3.11Å
767	N	73	Confident	83.7	Confident	87 Å²	87	68.3 Å²	68.3	47%	0.465	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	37.5	177	-49.8	-37	0	0	0	113.1	P729 L730	P729-N767 PolarHBondContact O-ND2 3Å; L730-N767 PolarHBondContact O-ND2 2.9Å
768	G	67.7	Low	83.8	Confident	57 Å²	57	69 Å²	69	59%	0.588	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	19.3	179	0	0	0	0	0	115.3	R731 M766	R731-G768 PolarHBondContact NE-O 3.01Å; R731-G768 PolarHBondContact NH2-O 3.46Å; M766-G768 PolarHBondContact O-N 2.84Å
769	G	77.8	Confident	83.7	Confident	12 Å²	12	73 Å²	73	12%	0.124	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-65.9	158.7	169.5	0	0	0	0	0	113.4	N733 M766	N733-G769 WeakPolarHBondContact OD1-CA 3.47Å; M766-G769 PolarHBondContact O-N 2.81Å; M766-G769 VanDerWaalsContact O-N 3.11Å
770	D	79.8	Confident	83.8	Confident	84 Å²	84	73.5 Å²	73.5	45%	0.449	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-70.8	151	-173.2	-50.1	-45.8	0	0	0	112.4	R731 N733 G734	R731-D770 IonicContact NH2-OD1 2.91Å; R731-D770 PolarHBondContact NH2-OD1 3.02Å; N733-D770 PolarHBondContact ND2-OD2 2.74Å; N733-D770 PolarHBondContact OD1-N 2.86Å; N733-D770 PolarHBondContact OD1-OD2 2.82Å; G734-D770 PolarHBondContact N-O 3.33Å
771	N	82.5	Confident	83.7	Confident	131 Å²	131	75.5 Å²	75.5	70%	0.701	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-72.7	153.6	175.5	-93.8	-31.6	0	0	0	112.1	L773	N771-L773 PolarHBondContact O-N 3.36Å
772	C	87	Confident	83.9	Confident	20 Å²	20	72.5 Å²	72.5	14%	0.135	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-62.7	126.7	178.7	-53.7	0	0	0	0	112.3	W736 C760	W736-C772 HydrophobicContact CD2-CB 3.67Å; W736-C772 HydrophobicContact CE3-CB 4.2Å; W736-C772 HydrophobicContact CG-CB 4.12Å; W736-C772 HydrophobicContact CH2-CB 4.07Å; W736-C772 HydrophobicContact CZ2-CB 3.51Å; W736-C772 HydrophobicContact CZ3-CB 4.39Å; C760-C772 WeakPolarHBondContact CA-SG 3.4Å; C760-C772 HydrophobicContact CB-CB 3.85Å; C760-C772 WeakPolarHBondContact CB-SG 3.12Å; C760-C772 WeakPolarHBondContact SG-CB 3.41Å; C760-C772 PolarHBondContact SG-N 3.35Å; C760-C772 CovalentContact SG-SG 2.03Å; C760-C772 PolarHBondContact SG-SG 3.16Å
773	L	83.8	Confident	83.7	Confident	162 Å²	162	68.4 Å²	68.4	85%	0.848	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-78.9	136	177.4	-69.6	168	0	0	0	112	W736 N771	W736-L773 PolarHBondContact NE1-O 3.34Å; N771-L773 PolarHBondContact O-N 3.36Å
774	G	86.2	Confident	83.3	Confident	60 Å²	60	72.4 Å²	72.4	62%	0.619	43%	0.432	S	S	*	.	S	Bend	trans	106	-178.6	178	0	0	0	0	0	114.6	W736	W736-G774 VanDerWaalsContact CZ2-O 3.27Å; W736-G774 WeakPolarHBondContact CZ2-O 3.44Å
775	S	85.9	Confident	83	Confident	82 Å²	82	77.4 Å²	77.4	57%	0.573	45%	0.449	S	S	*	.			trans	-78.8	143	-177.6	-57.2	0	0	0	0	112.7	R758 Q777	R758-S775 VanDerWaalsContact CZ-O 3.28Å; R758-S775 PolarHBondContact NE-O 2.92Å; R758-S775 PolarHBondContact NH2-O 3.02Å; S775-Q777 VanDerWaalsContact C-N 3.27Å; S775-Q777 WeakPolarHBondContact CB-O 3.49Å
776	S	89.5	Confident	82.5	Confident	56 Å²	56	82.9 Å²	82.9	39%	0.392	47%	0.472	S	S	.	.	S	Bend	trans	-81.8	-2.1	170.7	56.4	0	0	0	0	113.8	T757 R758	T757-S776 CarbonylContact C-O 3.43Å; T757-S776 VanDerWaalsContact CA-O 3.31Å; T757-S776 WeakPolarHBondContact CA-O 3.28Å; R758-S776 PolarHBondContact N-O 3.24Å; R758-S776 WeakPolarHBondContact O-CB 3.46Å
777	Q	91.5	Very high	82.5	Confident	89 Å²	89	79.5 Å²	79.5	42%	0.416	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	145.4	-176.7	-52.8	-171.7	-2.7	0	0	109.7	R756 T757 S775	R756-Q777 WeakPolarHBondContact O-CA 3.36Å; T757-Q777 HydrophobicContact CG2-CG 4.2Å; S775-Q777 VanDerWaalsContact C-N 3.27Å; S775-Q777 WeakPolarHBondContact CB-O 3.49Å
778	E	92.9	Very high	82.6	Confident	67 Å²	67	82.7 Å²	82.7	31%	0.313	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	148.5	178.9	-167.5	-177.6	161.2	0	0	109.8	W739 W742 K755 R756	W739-E778 HydrophobicContact CH2-CB 3.63Å; W739-E778 HydrophobicContact CZ2-CB 4.12Å; W739-E778 WeakPolarHBondContact CZ2-OE2 3.3Å; W739-E778 HydrophobicContact CZ3-CB 3.93Å; W742-E778 HydrophobicContact CH2-CB 4.22Å; W742-E778 HydrophobicContact CH2-CG 4Å; W742-E778 WeakPolarHBondContact CZ3-O 3.05Å; K755-E778 WeakPolarHBondContact CA-O 3.49Å; R756-E778 HydrophobicContact CG-CB 3.93Å; R756-E778 IonicContact CZ-OE1 2.99Å; R756-E778 IonicContact CZ-OE2 2.71Å; R756-E778 PolarHBondContact N-O 3.04Å; R756-E778 IonicContact NE-OE1 2.84Å; R756-E778 IonicContact NE-OE2 2.77Å; R756-E778 PolarHBondContact NE-OE2 3.16Å; R756-E778 IonicContact NH2-OE1 3.67Å; R756-E778 PolarHBondContact NH2-OE1 3.4Å; R756-E778 IonicContact NH2-OE2 3.16Å; R756-E778 PolarHBondContact NH2-OE2 3.25Å; R756-E778 PolarHBondContact O-N 3.06Å
779	F	91.4	Very high	82.8	Confident	133 Å²	133	84.6 Å²	84.6	58%	0.583	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.5	-179.1	-63.4	-93.2	0	0	0	109.4	R754 K755	R754-F779 WeakPolarHBondContact O-CA 3.26Å; K755-F779 HydrophobicContact CB-CD1 4.17Å; K755-F779 HydrophobicContact CB-CE1 4.2Å; K755-F779 HydrophobicContact CD-CD1 4.5Å; K755-F779 HydrophobicContact CD-CE1 3.75Å; K755-F779 HydrophobicContact CD-CZ 3.96Å; K755-F779 HydrophobicContact CG-CD1 4.23Å; K755-F779 HydrophobicContact CG-CE1 3.96Å; K755-F779 HydrophobicContact CG-CZ 4.35Å
780	E	90.9	Very high	82.4	Confident	74 Å²	74	85.3 Å²	85.3	35%	0.346	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	140.3	179.7	-174.2	-173.4	-175.8	0	0	109.7	W742 F753 R754	W742-E780 HydrophobicContact CH2-CB 3.42Å; W742-E780 VanDerWaalsContact CH2-CB 3.42Å; W742-E780 HydrophobicContact CZ2-CB 3.72Å; W742-E780 HydrophobicContact CZ2-CG 4.41Å; W742-E780 WeakPolarHBondContact CZ2-OE2 3.34Å; W742-E780 HydrophobicContact CZ3-CB 3.89Å; W742-E780 PolarHBondContact NE1-OE2 3.12Å; F753-E780 CarbonylContact C-O 3.6Å; F753-E780 VanDerWaalsContact CA-O 3.32Å; F753-E780 WeakPolarHBondContact CA-O 3.45Å; R754-E780 HydrophobicContact CG-CB 4.02Å; R754-E780 IonicContact CZ-OE1 3.12Å; R754-E780 IonicContact CZ-OE2 2.71Å; R754-E780 PolarHBondContact N-O 3.3Å; R754-E780 IonicContact NE-OE2 2.71Å; R754-E780 PolarHBondContact NE-OE2 3.08Å; R754-E780 IonicContact NH2-OE1 3.91Å; R754-E780 PolarHBondContact NH2-OE1 3.19Å; R754-E780 IonicContact NH2-OE2 3.11Å; R754-E780 PolarHBondContact NH2-OE2 3.32Å; R754-E780 PolarHBondContact O-N 3.06Å; R754-E780 VanDerWaalsContact O-N 3.08Å
781	S	86.5	Confident	81.9	Confident	80 Å²	80	85 Å²	85	56%	0.559	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.2	142.1	173.5	-45.2	0	0	0	0	111
782	C	88.5	Confident	81.2	Confident	15 Å²	15	84.3 Å²	84.3	10%	0.101	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	166.1	175.5	52.6	0	0	0	0	111.2	C745 G752 R754	C745-C782 VanDerWaalsContact CA-SG 3.56Å; C745-C782 HydrophobicContact CB-CB 3.94Å; C745-C782 WeakPolarHBondContact CB-SG 3.4Å; C745-C782 WeakPolarHBondContact SG-CB 3.24Å; C745-C782 PolarHBondContact SG-O 3Å; C745-C782 CovalentContact SG-SG 2.03Å; C745-C782 PolarHBondContact SG-SG 3.28Å; G752-C782 CarbonylContact C-O 3.54Å; G752-C782 WeakPolarHBondContact CA-O 3.18Å; G752-C782 PolarHBondContact N-O 2.86Å; G752-C782 PolarHBondContact O-N 3.09Å; G752-C782 VanDerWaalsContact O-O 3.12Å; R754-C782 HydrophobicContact CG-CB 4.34Å; R754-C782 PolarHBondContact N-SG 2.94Å
783	G	77.2	Confident	80.3	Confident	19 Å²	19	86.1 Å²	86.1	20%	0.196	46%	0.463	C	S	.	.			trans	72.6	30.2	178.6	0	0	0	0	0	113	C749 G750 G751 Q785	C749-G783 CarbonylContact C-O 3.59Å; C749-G783 VanDerWaalsContact CA-O 3.24Å; C749-G783 WeakPolarHBondContact CA-O 3.41Å; G750-G783 PolarHBondContact N-O 2.84Å; G751-G783 PolarHBondContact N-O 3.19Å; G783-Q785 PolarHBondContact O-N 2.99Å
784	D	76.6	Confident	79.4	Confident	117 Å²	117	79.9 Å²	79.9	63%	0.626	43%	0.432	S	S	*	.			trans	-74.2	-0.3	-179	-50.7	-64.8	0	0	0	113.6
785	Q	76.5	Confident	78.8	Confident	155 Å²	155	85 Å²	85	72%	0.724	44%	0.441	S	S	*	.	S	Bend	trans	-63.5	139.3	169.9	-66.6	179.8	-15.7	0	0	110.1	C749 G750 G783	C749-Q785 CarbonylContact C-O 3.55Å; C749-Q785 WeakPolarHBondContact CA-O 3.28Å; C749-Q785 WeakPolarHBondContact CB-O 3.49Å; G750-Q785 PolarHBondContact N-O 3.3Å; G783-Q785 PolarHBondContact O-N 2.99Å
786	Q	72.8	Confident	78.3	Confident	157 Å²	157	85.4 Å²	85.4	73%	0.734	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-63.6	138.3	174.5	-75.3	-177	-11	0	0	110.3
787	C	74.3	Confident	77.5	Confident	13 Å²	13	85.2 Å²	85.2	9%	0.088	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-67.2	145.2	173.4	-64.4	0	0	0	0	111.1	C749 R822	C749-C787 HydrophobicContact CB-CB 3.93Å; C749-C787 WeakPolarHBondContact CB-SG 3.27Å; C749-C787 WeakPolarHBondContact SG-CA 3.04Å; C749-C787 WeakPolarHBondContact SG-CB 2.9Å; C749-C787 CovalentContact SG-SG 2.04Å; C749-C787 PolarHBondContact SG-SG 2.73Å; C787-R822 HydrophobicContact CB-CB 4.3Å
788	E	75.3	Confident	76.7	Confident	153 Å²	153	89.6 Å²	89.6	72%	0.715	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-62.9	148	176	-164.2	170.2	-169.1	0	0	110.6	V790	E788-V790 PolarHBondContact O-N 3.22Å
789	E	72.9	Confident	75.8	Confident	97 Å²	97	90.3 Å²	90.3	45%	0.453	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	112	-177.8	-174.4	166.7	-177.9	0	0	110.8	V791 S820 R822	E789-V791 HydrophobicContact CG-CG2 4.29Å; E789-S820 WeakPolarHBondContact OE1-CB 3.19Å; E789-S820 PolarHBondContact OE1-OG 2.87Å; E789-R822 HydrophobicContact CB-CG 4.23Å
790	V	68.9	Low	74.7	Confident	27 Å²	27	85.7 Å²	85.7	16%	0.164	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	113.2	176.7	-179	0	0	0	0	108.4	E788 S820 A821 P826 L829	E788-V790 PolarHBondContact O-N 3.22Å; V790-S820 VanDerWaalsContact O-CA 3.29Å; V790-S820 WeakPolarHBondContact O-CA 3.49Å; V790-A821 PolarHBondContact N-O 3.23Å; V790-A821 PolarHBondContact O-N 3.16Å; V790-A821 VanDerWaalsContact O-N 3.11Å; V790-P826 HydrophobicContact CG1-CB 3.97Å; V790-P826 HydrophobicContact CG2-CB 4.24Å; V790-P826 HydrophobicContact CG2-CG 4.18Å; V790-L829 HydrophobicContact CG1-CD2 4.5Å
791	V	68.8	Low	73.8	Confident	79 Å²	79	87.8 Å²	87.8	48%	0.479	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	127.8	174	-171.6	0	0	0	0	109.5	E789 C819	E789-V791 HydrophobicContact CG-CG2 4.29Å; V791-C819 WeakPolarHBondContact CA-O 3.35Å
792	R	67.7	Low	72.9	Confident	115 Å²	115	88 Å²	88	43%	0.434	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.7	164.6	-62.4	-157	-163.3	-159.6	15.1	111.1	S818 C819 P826 D827 L829	R792-S818 WeakPolarHBondContact O-CA 3.37Å; R792-C819 PolarHBondContact N-O 2.96Å; R792-C819 PolarHBondContact O-N 2.91Å; R792-P826 PolarHBondContact NH2-O 2.94Å; R792-D827 IonicContact NH2-OD1 3.78Å; R792-D827 PolarHBondContact NH2-OD1 3.06Å; R792-D827 VanDerWaalsContact NH2-OD1 3.15Å; R792-L829 HydrophobicContact CB-CD2 3.79Å; R792-L829 HydrophobicContact CG-CD2 3.79Å
793	V	68	Low	71.9	Confident	59 Å²	59	92.2 Å²	92.2	36%	0.358	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	141.6	177.6	-168.4	0	0	0	0	107.4	R816 F817	V793-R816 HydrophobicContact CG1-CG 4.34Å; V793-F817 CarbonylContact C-O 3.44Å; V793-F817 VanDerWaalsContact CA-O 3.29Å; V793-F817 WeakPolarHBondContact CA-O 3.36Å; V793-F817 WeakPolarHBondContact CG1-O 3.48Å
794	S	65.5	Low	71.3	Confident	30 Å²	30	97.1 Å²	97.1	21%	0.21	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-77.4	166.3	172	74.2	0	0	0	0	111.7	F817	S794-F817 PolarHBondContact N-O 3.17Å; S794-F817 WeakPolarHBondContact OG-CD2 3.19Å; S794-F817 PolarHBondContact OG-N 2.93Å
795	E	73.2	Confident	70.6	Confident	169 Å²	169	93.7 Å²	93.7	79%	0.79	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-59	158.7	156.2	-62.2	-53.6	141.1	0	0	111.2
796	W	75.5	Confident	69.9	Low	89 Å²	89	93 Å²	93	34%	0.337	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-71.8	144.4	170.7	-73.8	103.1	0	0	0	111.2	R814 Y815 R816 E837	W796-R814 HydrophobicContact CD2-CG 4.48Å; W796-R814 HydrophobicContact CE3-CG 3.73Å; W796-R814 HydrophobicContact CZ3-CG 4.12Å; W796-Y815 CarbonylContact C-O 3.51Å; W796-Y815 WeakPolarHBondContact CA-O 3.46Å; W796-R816 HydrophobicContact CD2-CB 3.89Å; W796-R816 HydrophobicContact CD2-CG 4.26Å; W796-R816 HydrophobicContact CE3-CB 3.76Å; W796-R816 HydrophobicContact CE3-CG 4.11Å; W796-R816 HydrophobicContact CG-CB 4.42Å; W796-R816 HydrophobicContact CH2-CB 4.47Å; W796-R816 HydrophobicContact CH2-CG 3.92Å; W796-R816 HydrophobicContact CZ2-CG 4.08Å; W796-R816 HydrophobicContact CZ3-CB 4.06Å; W796-R816 HydrophobicContact CZ3-CG 3.94Å; W796-E837 HydrophobicContact CH2-CB 3.7Å; W796-E837 WeakPolarHBondContact CH2-OE2 3.47Å; W796-E837 WeakPolarHBondContact CZ2-OE2 3.32Å; W796-E837 HydrophobicContact CZ3-CB 3.69Å
797	T	73	Confident	69.2	Low	53 Å²	53	90.8 Å²	90.8	33%	0.325	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-67	164.6	165.3	67.5	0	0	0	0	110.9	Y815	T797-Y815 HydrophobicContact CG2-CD2 4.39Å; T797-Y815 PolarHBondContact N-O 3.32Å; T797-Y815 PolarHBondContact OG1-N 3Å
798	Q	73.9	Confident	68.6	Low	181 Å²	181	92 Å²	92	85%	0.846	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-62.1	159.4	163.6	-64.3	-173	-4.2	0	0	110.7
799	W	75.4	Confident	68.1	Low	81 Å²	81	85.1 Å²	85.1	31%	0.307	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-75.2	127.5	175.9	-68.7	98.9	0	0	0	110.6	H812 Q813 R814 E837 K839	W799-H812 HydrophobicContact CE3-CB 4.06Å; W799-Q813 CarbonylContact C-O 3.59Å; W799-Q813 WeakPolarHBondContact CA-O 3.22Å; W799-R814 HydrophobicContact CD2-CB 4.12Å; W799-R814 HydrophobicContact CD2-CG 4.01Å; W799-R814 HydrophobicContact CE3-CB 4.02Å; W799-R814 HydrophobicContact CE3-CG 3.9Å; W799-R814 HydrophobicContact CH2-CG 3.99Å; W799-R814 HydrophobicContact CZ2-CG 4.09Å; W799-R814 HydrophobicContact CZ3-CB 4.44Å; W799-R814 HydrophobicContact CZ3-CG 3.88Å; W799-E837 HydrophobicContact CH2-CG 4.01Å; W799-K839 HydrophobicContact CD2-CD 4.16Å; W799-K839 HydrophobicContact CE3-CD 4.01Å; W799-K839 HydrophobicContact CE3-CG 4Å; W799-K839 HydrophobicContact CH2-CB 4.21Å; W799-K839 HydrophobicContact CH2-CD 3.7Å; W799-K839 HydrophobicContact CH2-CG 3.92Å; W799-K839 HydrophobicContact CZ2-CD 3.85Å; W799-K839 HydrophobicContact CZ3-CB 4.16Å; W799-K839 HydrophobicContact CZ3-CD 3.78Å; W799-K839 HydrophobicContact CZ3-CG 3.61Å
800	G	67.7	Low	67.8	Low	37 Å²	37	81.9 Å²	81.9	38%	0.381	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	141.3	170.7	0	0	0	0	0	111.9	H812 Q813	G800-H812 CarbonylContact O-C 3.52Å; G800-H812 VanDerWaalsContact O-CA 3.23Å; G800-H812 WeakPolarHBondContact O-CA 3.27Å; G800-Q813 PolarHBondContact N-O 3.04Å; G800-Q813 PolarHBondContact O-N 2.83Å
801	K	72.2	Confident	68.1	Low	118 Å²	118	82.3 Å²	82.3	51%	0.513	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	135.6	169.1	177.1	-176.8	172	177.4	0	108.9	E804 L810 L811	K801-E804 IonicContact NZ-OE1 3.33Å; K801-E804 PolarHBondContact NZ-OE1 2.83Å; K801-L810 HydrophobicContact CD-CD2 3.98Å; K801-L810 VanDerWaalsContact CE-CD2 3.4Å; K801-L810 VanDerWaalsContact NZ-CD2 3.31Å; K801-L811 WeakPolarHBondContact CA-O 3.34Å
802	I	67.4	Low	68.4	Low	84 Å²	84	80.1 Å²	80.1	43%	0.431	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-47.2	178.7	-62.2	-152.8	0	0	0	112.5	L811 Q813	I802-L811 PolarHBondContact N-O 2.86Å; I802-Q813 HydrophobicContact CD1-CB 3.76Å; I802-Q813 HydrophobicContact CD1-CG 3.64Å; I802-Q813 HydrophobicContact CG1-CB 4.22Å; I802-Q813 HydrophobicContact CG1-CG 4.2Å
803	D	67.7	Low	69	Low	103 Å²	103	76.1 Å²	76.1	55%	0.551	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.5	166.3	-172.1	-145.1	-16.2	0	0	0	112.8	L811	D803-L811 HydrophobicContact CB-CB 4.41Å; D803-L811 HydrophobicContact CB-CD2 4.42Å; D803-L811 PolarHBondContact O-N 2.98Å
804	E	64.4	Low	69.6	Low	122 Å²	122	76 Å²	76	57%	0.57	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	115.1	169.5	-86.2	170	-152.6	0	0	109.9	K801 L810	K801-E804 IonicContact NZ-OE1 3.33Å; K801-E804 PolarHBondContact NZ-OE1 2.83Å; E804-L810 HydrophobicContact CG-CD2 3.78Å
805	T	62.6	Low	70.1	Confident	45 Å²	45	78.1 Å²	78.1	28%	0.276	42%	0.415	S	S	.	.			trans	-67.2	152.1	179	63.2	0	0	0	0	110.6	S807 G808 G809	T805-S807 PolarHBondContact O-N 3.13Å; T805-S807 PolarHBondContact OG1-OG 2.8Å; T805-G808 PolarHBondContact O-N 2.89Å; T805-G809 PolarHBondContact N-O 2.79Å; T805-G809 WeakPolarHBondContact OG1-CA 3.06Å; T805-G809 PolarHBondContact OG1-N 2.87Å; T805-G809 PolarHBondContact OG1-O 3.46Å; T805-G809 VanDerWaalsContact OG1-O 3.09Å
806	S	61.6	Low	70.1	Confident	140 Å²	140	74.5 Å²	74.5	98%	0.979	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-6.1	180	47.8	0	0	0	0	115
807	S	57.1	Low	69.6	Low	111 Å²	111	73.4 Å²	73.4	78%	0.776	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	7.4	170	51.9	0	0	0	0	114.1	T805	T805-S807 PolarHBondContact O-N 3.13Å; T805-S807 PolarHBondContact OG1-OG 2.8Å
808	G	61.5	Low	69.2	Low	40 Å²	40	73.7 Å²	73.7	41%	0.412	40%	0.396	S	S	.	.	S	Bend	trans	84.8	10.1	178	0	0	0	0	0	115.3	T805 P843	T805-G808 PolarHBondContact O-N 2.89Å; G808-P843 VanDerWaalsContact O-CD 3.26Å; G808-P843 WeakPolarHBondContact O-CD 3.35Å; G808-P843 VanDerWaalsContact O-CG 3.29Å; G808-P843 WeakPolarHBondContact O-CG 3.07Å
809	G	65.6	Low	68.6	Low	7 Å²	7	65.8 Å²	65.8	7%	0.072	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-88	144.3	178.8	0	0	0	0	0	113	T805 C841	T805-G809 PolarHBondContact N-O 2.79Å; T805-G809 WeakPolarHBondContact OG1-CA 3.06Å; T805-G809 PolarHBondContact OG1-N 2.87Å; T805-G809 PolarHBondContact OG1-O 3.46Å; T805-G809 VanDerWaalsContact OG1-O 3.09Å; G809-C841 CarbonylContact C-O 3.55Å; G809-C841 WeakPolarHBondContact CA-O 3.23Å
810	L	65.8	Low	68.2	Low	30 Å²	30	65.1 Å²	65.1	16%	0.157	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	116.3	176.8	-60.6	165	0	0	0	110	K801 E804 V840 C841 P843	K801-L810 HydrophobicContact CD-CD2 3.98Å; K801-L810 VanDerWaalsContact CE-CD2 3.4Å; K801-L810 VanDerWaalsContact NZ-CD2 3.31Å; E804-L810 HydrophobicContact CG-CD2 3.78Å; L810-V840 CarbonylContact O-C 3.59Å; L810-V840 WeakPolarHBondContact O-CA 3.15Å; L810-C841 HydrophobicContact CB-CB 4.23Å; L810-C841 PolarHBondContact N-O 2.67Å; L810-C841 PolarHBondContact O-N 3.38Å; L810-P843 HydrophobicContact CD1-CB 4.49Å
811	L	74.8	Confident	68.1	Low	35 Å²	35	64.9 Å²	64.9	18%	0.183	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	123.7	173.4	-176.6	67.9	0	0	0	110.3	K801 I802 D803 E838 V840	K801-L811 WeakPolarHBondContact CA-O 3.34Å; I802-L811 PolarHBondContact N-O 2.86Å; D803-L811 HydrophobicContact CB-CB 4.41Å; D803-L811 HydrophobicContact CB-CD2 4.42Å; D803-L811 PolarHBondContact O-N 2.98Å; L811-E838 HydrophobicContact CD1-CB 4.4Å; L811-V840 HydrophobicContact CD1-CG2 3.96Å
812	H	76	Confident	68.1	Low	34 Å²	34	65.9 Å²	65.9	16%	0.157	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.6	175.8	-70.3	-144.6	0	0	0	109.8	W799 G800 E838 K839	W799-H812 HydrophobicContact CE3-CB 4.06Å; G800-H812 CarbonylContact O-C 3.52Å; G800-H812 VanDerWaalsContact O-CA 3.23Å; G800-H812 WeakPolarHBondContact O-CA 3.27Å; H812-E838 CarbonylContact O-C 3.6Å; H812-E838 WeakPolarHBondContact O-CA 3.11Å; H812-K839 HydrophobicContact CB-CG 3.86Å; H812-K839 PolarHBondContact N-O 3.22Å; H812-K839 PolarHBondContact O-N 3.44Å
813	Q	79.8	Confident	68	Low	31 Å²	31	63.9 Å²	63.9	15%	0.145	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	156.9	172.6	-71.1	-169	-6.6	0	0	112.3	W799 G800 I802 Y815 V836 E837 E838	W799-Q813 CarbonylContact C-O 3.59Å; W799-Q813 WeakPolarHBondContact CA-O 3.22Å; G800-Q813 PolarHBondContact N-O 3.04Å; G800-Q813 PolarHBondContact O-N 2.83Å; I802-Q813 HydrophobicContact CD1-CB 3.76Å; I802-Q813 HydrophobicContact CD1-CG 3.64Å; I802-Q813 HydrophobicContact CG1-CB 4.22Å; I802-Q813 HydrophobicContact CG1-CG 4.2Å; Q813-Y815 PolarHBondContact OE1-OH 3.49Å; Q813-V836 HydrophobicContact CG-CG1 4.25Å; Q813-E837 CarbonylContact C-O 3.54Å; Q813-E837 VanDerWaalsContact CA-O 3.28Å; Q813-E837 WeakPolarHBondContact CA-O 3.31Å; Q813-E838 HydrophobicContact CG-CB 4.39Å; Q813-E838 HydrophobicContact CG-CG 4.05Å; Q813-E838 PolarHBondContact NE2-OE1 3.11Å
814	R	81.1	Confident	68	Low	57 Å²	57	62.7 Å²	62.7	22%	0.215	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	167.2	162.3	66.8	171.5	-177.1	-167	-9.6	111	W796 W799 E837	W796-R814 HydrophobicContact CD2-CG 4.48Å; W796-R814 HydrophobicContact CE3-CG 3.73Å; W796-R814 HydrophobicContact CZ3-CG 4.12Å; W799-R814 HydrophobicContact CD2-CB 4.12Å; W799-R814 HydrophobicContact CD2-CG 4.01Å; W799-R814 HydrophobicContact CE3-CB 4.02Å; W799-R814 HydrophobicContact CE3-CG 3.9Å; W799-R814 HydrophobicContact CH2-CG 3.99Å; W799-R814 HydrophobicContact CZ2-CG 4.09Å; W799-R814 HydrophobicContact CZ3-CB 4.44Å; W799-R814 HydrophobicContact CZ3-CG 3.88Å; R814-E837 HydrophobicContact CG-CB 4.11Å; R814-E837 IonicContact CZ-OE1 2.75Å; R814-E837 IonicContact CZ-OE2 2.73Å; R814-E837 PolarHBondContact N-O 3.11Å; R814-E837 IonicContact NE-OE1 3.83Å; R814-E837 IonicContact NE-OE2 3.41Å; R814-E837 PolarHBondContact NE-OE2 2.9Å; R814-E837 VanDerWaalsContact NH2-CD 3.25Å; R814-E837 IonicContact NH2-OE1 3.2Å; R814-E837 PolarHBondContact NH2-OE1 3.05Å; R814-E837 IonicContact NH2-OE2 2.62Å; R814-E837 PolarHBondContact NH2-OE2 3.23Å; R814-E837 PolarHBondContact O-N 3.03Å
815	Y	76.5	Confident	68.1	Low	74 Å²	74	60 Å²	60	29%	0.29	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	151.4	-171.4	-47.6	-68.7	0	0	0	113.5	W796 T797 Q813 L834 T835 V836	W796-Y815 CarbonylContact C-O 3.51Å; W796-Y815 WeakPolarHBondContact CA-O 3.46Å; T797-Y815 HydrophobicContact CG2-CD2 4.39Å; T797-Y815 PolarHBondContact N-O 3.32Å; T797-Y815 PolarHBondContact OG1-N 3Å; Q813-Y815 PolarHBondContact OE1-OH 3.49Å; Y815-L834 HydrophobicContact CD1-CD2 3.33Å; Y815-L834 HydrophobicContact CD1-CG 3.96Å; Y815-L834 HydrophobicContact CD2-CD2 4.35Å; Y815-L834 HydrophobicContact CE1-CD2 3.83Å; Y815-L834 HydrophobicContact CG-CD1 4.27Å; Y815-L834 HydrophobicContact CG-CD2 3.63Å; Y815-L834 HydrophobicContact CG-CG 4.09Å; Y815-T835 WeakPolarHBondContact CA-O 3.23Å; Y815-V836 HydrophobicContact CD1-CB 4.31Å; Y815-V836 HydrophobicContact CD1-CG1 4.12Å; Y815-V836 HydrophobicContact CD1-CG2 3.94Å; Y815-V836 HydrophobicContact CE1-CB 4.48Å; Y815-V836 HydrophobicContact CE1-CG1 3.94Å; Y815-V836 HydrophobicContact CE1-CG2 4.02Å
816	R	73.7	Confident	68.3	Low	92 Å²	92	60.4 Å²	60.4	35%	0.347	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	155	161.7	76.1	175.6	-164.5	178.2	4.9	111.1	V793 W796 T835	V793-R816 HydrophobicContact CG1-CG 4.34Å; W796-R816 HydrophobicContact CD2-CB 3.89Å; W796-R816 HydrophobicContact CD2-CG 4.26Å; W796-R816 HydrophobicContact CE3-CB 3.76Å; W796-R816 HydrophobicContact CE3-CG 4.11Å; W796-R816 HydrophobicContact CG-CB 4.42Å; W796-R816 HydrophobicContact CH2-CB 4.47Å; W796-R816 HydrophobicContact CH2-CG 3.92Å; W796-R816 HydrophobicContact CZ2-CG 4.08Å; W796-R816 HydrophobicContact CZ3-CB 4.06Å; W796-R816 HydrophobicContact CZ3-CG 3.94Å; R816-T835 WeakPolarHBondContact CG-OG1 3.45Å; R816-T835 PolarHBondContact N-O 2.93Å; R816-T835 PolarHBondContact O-N 2.79Å; R816-T835 PolarHBondContact O-OG1 3.23Å
817	F	63.4	Low	68.6	Low	66 Å²	66	59.6 Å²	59.6	29%	0.289	33%	0.329	S	S	.	.			trans	-106.8	136	-177	-55.1	-110.7	0	0	0	108.6	V793 S794 P833 L834	V793-F817 CarbonylContact C-O 3.44Å; V793-F817 VanDerWaalsContact CA-O 3.29Å; V793-F817 WeakPolarHBondContact CA-O 3.36Å; V793-F817 WeakPolarHBondContact CG1-O 3.48Å; S794-F817 PolarHBondContact N-O 3.17Å; S794-F817 WeakPolarHBondContact OG-CD2 3.19Å; S794-F817 PolarHBondContact OG-N 2.93Å; F817-P833 HydrophobicContact CD1-CB 3.76Å; F817-P833 HydrophobicContact CD1-CG 4.12Å; F817-P833 HydrophobicContact CE1-CB 3.66Å; F817-P833 HydrophobicContact CE1-CG 3.87Å; F817-L834 HydrophobicContact CD1-CD1 3.76Å; F817-L834 HydrophobicContact CD2-CD1 4.03Å; F817-L834 HydrophobicContact CE1-CD1 3.44Å; F817-L834 VanDerWaalsContact CE1-CD1 3.44Å; F817-L834 HydrophobicContact CE2-CD1 3.73Å; F817-L834 HydrophobicContact CG-CD1 4.04Å; F817-L834 HydrophobicContact CZ-CD1 3.42Å; F817-L834 VanDerWaalsContact CZ-CD1 3.42Å
818	S	66.2	Low	69.1	Low	59 Å²	59	58.7 Å²	58.7	41%	0.413	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133.4	175.3	60.9	0	0	0	0	110.4	R792	R792-S818 WeakPolarHBondContact O-CA 3.37Å
819	C	59.7	Low	69.2	Low	15 Å²	15	58.1 Å²	58.1	10%	0.101	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	131.3	179.1	-57.2	0	0	0	0	109.8	V791 R792 L829 M831 K832	V791-C819 WeakPolarHBondContact CA-O 3.35Å; R792-C819 PolarHBondContact N-O 2.96Å; R792-C819 PolarHBondContact O-N 2.91Å; C819-L829 HydrophobicContact CB-CD1 4.4Å; C819-L829 HydrophobicContact CB-CD2 4.22Å; C819-L829 HydrophobicContact CB-CG 4.33Å; C819-M831 VanDerWaalsContact SG-CA 3.53Å; C819-K832 PolarHBondContact SG-N 3.21Å
820	S	68.1	Low	68.8	Low	68 Å²	68	63.8 Å²	63.8	48%	0.476	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.2	167	76.8	0	0	0	0	111	E789 V790	E789-S820 WeakPolarHBondContact OE1-CB 3.19Å; E789-S820 PolarHBondContact OE1-OG 2.87Å; V790-S820 VanDerWaalsContact O-CA 3.29Å; V790-S820 WeakPolarHBondContact O-CA 3.49Å
821	A	64.8	Low	68.3	Low	32 Å²	32	67.2 Å²	67.2	26%	0.264	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	149.8	171.6	0	0	0	0	0	110.6	V790 L823 L829	V790-A821 PolarHBondContact N-O 3.23Å; V790-A821 PolarHBondContact O-N 3.16Å; V790-A821 VanDerWaalsContact O-N 3.11Å; A821-L823 HydrophobicContact CB-CD1 3.81Å; A821-L823 HydrophobicContact CB-CD2 4.45Å; A821-L823 HydrophobicContact CB-CG 3.77Å; A821-L823 PolarHBondContact O-N 2.71Å; A821-L829 HydrophobicContact CB-CD1 3.56Å
822	R	71.8	Confident	67.3	Low	138 Å²	138	73 Å²	73	52%	0.521	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	85.9	176.2	-65	-178.8	-177	-163.7	-4	109.5	C787 E789	C787-R822 HydrophobicContact CB-CB 4.3Å; E789-R822 HydrophobicContact CB-CG 4.23Å
823	L	66.3	Low	66.4	Low	42 Å²	42	76 Å²	76	22%	0.22	40%	0.399	C	S	.	.			trans	-112.8	140.9	-171.5	-66.8	168.8	0	0	0	111.4	A821 N825 D828 L829	A821-L823 HydrophobicContact CB-CD1 3.81Å; A821-L823 HydrophobicContact CB-CD2 4.45Å; A821-L823 HydrophobicContact CB-CG 3.77Å; A821-L823 PolarHBondContact O-N 2.71Å; L823-N825 WeakPolarHBondContact CB-O 3.43Å; L823-N825 PolarHBondContact O-N 2.91Å; L823-D828 HydrophobicContact CD1-CB 4.16Å; L823-D828 HydrophobicContact CD2-CB 4.38Å; L823-L829 HydrophobicContact CD1-CB 3.9Å; L823-L829 HydrophobicContact CD1-CD1 3.84Å
824	P	67	Low	65.5	Low	79 Å²	79	78.2 Å²	78.2	51%	0.513	41%	0.411	S	S	.	.	S	Bend	trans	-70.5	-15.9	173.3	28.3	-32.7	0	0	0	113.1
825	N	67.1	Low	64.8	Low	65 Å²	65	78.1 Å²	78.1	35%	0.348	42%	0.416	S	S	.	.	S	Bend	trans	-132.9	125	173.9	-177.6	25.3	0	0	0	110.4	L823 D827 D828	L823-N825 WeakPolarHBondContact CB-O 3.43Å; L823-N825 PolarHBondContact O-N 2.91Å; N825-D827 PolarHBondContact O-N 2.65Å; N825-D827 VanDerWaalsContact O-N 3.1Å; N825-D828 PolarHBondContact ND2-OD1 3.2Å; N825-D828 PolarHBondContact O-N 3.46Å
826	P	66.4	Low	64.6	Low	54 Å²	54	78.2 Å²	78.2	35%	0.351	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-9.8	178.6	-25.9	35.9	0	0	0	116.7	V790 R792	V790-P826 HydrophobicContact CG1-CB 3.97Å; V790-P826 HydrophobicContact CG2-CB 4.24Å; V790-P826 HydrophobicContact CG2-CG 4.18Å; R792-P826 PolarHBondContact NH2-O 2.94Å
827	D	68.1	Low	64.8	Low	123 Å²	123	77 Å²	77	66%	0.658	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-10.7	-179.1	-59.7	-34.3	0	0	0	113.2	R792 N825 L829	R792-D827 IonicContact NH2-OD1 3.78Å; R792-D827 PolarHBondContact NH2-OD1 3.06Å; R792-D827 VanDerWaalsContact NH2-OD1 3.15Å; N825-D827 PolarHBondContact O-N 2.65Å; N825-D827 VanDerWaalsContact O-N 3.1Å; D827-L829 PolarHBondContact O-N 3.21Å
828	D	67.2	Low	65.3	Low	92 Å²	92	79.5 Å²	79.5	49%	0.492	44%	0.435	S	S	.	.			trans	-80.3	7.1	177.9	-58.2	-14.7	0	0	0	112.8	L823 N825 V830	L823-D828 HydrophobicContact CD1-CB 4.16Å; L823-D828 HydrophobicContact CD2-CB 4.38Å; N825-D828 PolarHBondContact ND2-OD1 3.2Å; N825-D828 PolarHBondContact O-N 3.46Å; D828-V830 PolarHBondContact O-N 2.85Å
829	L	63	Low	65.5	Low	28 Å²	28	79.2 Å²	79.2	15%	0.147	43%	0.427	C	S	.	.			trans	-83.2	98.9	-172.1	-170.9	77	0	0	0	112.3	V790 R792 C819 A821 L823 D827	V790-L829 HydrophobicContact CG1-CD2 4.5Å; R792-L829 HydrophobicContact CB-CD2 3.79Å; R792-L829 HydrophobicContact CG-CD2 3.79Å; C819-L829 HydrophobicContact CB-CD1 4.4Å; C819-L829 HydrophobicContact CB-CD2 4.22Å; C819-L829 HydrophobicContact CB-CG 4.33Å; A821-L829 HydrophobicContact CB-CD1 3.56Å; L823-L829 HydrophobicContact CD1-CB 3.9Å; L823-L829 HydrophobicContact CD1-CD1 3.84Å; D827-L829 PolarHBondContact O-N 3.21Å
830	V	58.7	Low	65.8	Low	126 Å²	126	82.2 Å²	82.2	76%	0.764	45%	0.445	S	S	*	.			trans	-81.7	127	176	-175.8	0	0	0	0	111.3	D828	D828-V830 PolarHBondContact O-N 2.85Å
831	M	54.3	Low	65.7	Low	101 Å²	101	79.1 Å²	79.1	50%	0.498	42%	0.423	S	S	.	.			trans	-78.5	147.5	-174.2	-74.7	-176.3	161.6	0	0	115	C819	C819-M831 VanDerWaalsContact SG-CA 3.53Å
832	K	55.2	Low	65.7	Low	157 Å²	157	79 Å²	79	68%	0.683	42%	0.422	S	S	*	.			trans	-140.4	154.6	169.5	-69.5	-172.9	178.8	-179.6	0	112.5	C819	C819-K832 PolarHBondContact SG-N 3.21Å
833	P	55.7	Low	65.2	Low	98 Å²	98	75.6 Å²	75.6	64%	0.636	42%	0.418	S	S	*	.			trans	-87.8	164.2	-173.8	-6.6	28.7	0	0	0	113.3	F817	F817-P833 HydrophobicContact CD1-CB 3.76Å; F817-P833 HydrophobicContact CD1-CG 4.12Å; F817-P833 HydrophobicContact CE1-CB 3.66Å; F817-P833 HydrophobicContact CE1-CG 3.87Å
834	L	60.6	Low	65	Low	77 Å²	77	83.6 Å²	83.6	40%	0.403	45%	0.445	S	S	.	.			cis	-161.2	148.1	0	-157.3	65.9	0	0	0	109.5	Y815 F817	Y815-L834 HydrophobicContact CD1-CD2 3.33Å; Y815-L834 HydrophobicContact CD1-CG 3.96Å; Y815-L834 HydrophobicContact CD2-CD2 4.35Å; Y815-L834 HydrophobicContact CE1-CD2 3.83Å; Y815-L834 HydrophobicContact CG-CD1 4.27Å; Y815-L834 HydrophobicContact CG-CD2 3.63Å; Y815-L834 HydrophobicContact CG-CG 4.09Å; F817-L834 HydrophobicContact CD1-CD1 3.76Å; F817-L834 HydrophobicContact CD2-CD1 4.03Å; F817-L834 HydrophobicContact CE1-CD1 3.44Å; F817-L834 VanDerWaalsContact CE1-CD1 3.44Å; F817-L834 HydrophobicContact CE2-CD1 3.73Å; F817-L834 HydrophobicContact CG-CD1 4.04Å; F817-L834 HydrophobicContact CZ-CD1 3.42Å; F817-L834 VanDerWaalsContact CZ-CD1 3.42Å
835	T	68.1	Low	64.5	Low	54 Å²	54	83 Å²	83	33%	0.331	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.1	162.1	31.1	0	0	0	0	109.7	Y815 R816	Y815-T835 WeakPolarHBondContact CA-O 3.23Å; R816-T835 WeakPolarHBondContact CG-OG1 3.45Å; R816-T835 PolarHBondContact N-O 2.93Å; R816-T835 PolarHBondContact O-N 2.79Å; R816-T835 PolarHBondContact O-OG1 3.23Å
836	V	71.8	Confident	63.9	Low	77 Å²	77	86.8 Å²	86.8	47%	0.467	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	146	-172.4	-171.5	0	0	0	0	110.5	Q813 Y815 E838	Q813-V836 HydrophobicContact CG-CG1 4.25Å; Y815-V836 HydrophobicContact CD1-CB 4.31Å; Y815-V836 HydrophobicContact CD1-CG1 4.12Å; Y815-V836 HydrophobicContact CD1-CG2 3.94Å; Y815-V836 HydrophobicContact CE1-CB 4.48Å; Y815-V836 HydrophobicContact CE1-CG1 3.94Å; Y815-V836 HydrophobicContact CE1-CG2 4.02Å; V836-E838 HydrophobicContact CG1-CG 4.21Å
837	E	77.4	Confident	63.4	Low	66 Å²	66	90.7 Å²	90.7	31%	0.308	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	137	166.8	-173.8	-175.9	170.4	0	0	109.3	W796 W799 Q813 R814	W796-E837 HydrophobicContact CH2-CB 3.7Å; W796-E837 WeakPolarHBondContact CH2-OE2 3.47Å; W796-E837 WeakPolarHBondContact CZ2-OE2 3.32Å; W796-E837 HydrophobicContact CZ3-CB 3.69Å; W799-E837 HydrophobicContact CH2-CG 4.01Å; Q813-E837 CarbonylContact C-O 3.54Å; Q813-E837 VanDerWaalsContact CA-O 3.28Å; Q813-E837 WeakPolarHBondContact CA-O 3.31Å; R814-E837 HydrophobicContact CG-CB 4.11Å; R814-E837 IonicContact CZ-OE1 2.75Å; R814-E837 IonicContact CZ-OE2 2.73Å; R814-E837 PolarHBondContact N-O 3.11Å; R814-E837 IonicContact NE-OE1 3.83Å; R814-E837 IonicContact NE-OE2 3.41Å; R814-E837 PolarHBondContact NE-OE2 2.9Å; R814-E837 VanDerWaalsContact NH2-CD 3.25Å; R814-E837 IonicContact NH2-OE1 3.2Å; R814-E837 PolarHBondContact NH2-OE1 3.05Å; R814-E837 IonicContact NH2-OE2 2.62Å; R814-E837 PolarHBondContact NH2-OE2 3.23Å; R814-E837 PolarHBondContact O-N 3.03Å
838	E	74	Confident	63	Low	118 Å²	118	86.1 Å²	86.1	55%	0.551	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.4	150.5	-174	-39.7	-167.9	118.8	0	0	111.2	L811 H812 Q813 V836	L811-E838 HydrophobicContact CD1-CB 4.4Å; H812-E838 CarbonylContact O-C 3.6Å; H812-E838 WeakPolarHBondContact O-CA 3.11Å; Q813-E838 HydrophobicContact CG-CB 4.39Å; Q813-E838 HydrophobicContact CG-CG 4.05Å; Q813-E838 PolarHBondContact NE2-OE1 3.11Å; V836-E838 HydrophobicContact CG1-CG 4.21Å
839	K	69.9	Low	62.3	Low	54 Å²	54	85.5 Å²	85.5	24%	0.235	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155.2	167.6	70.2	-177.2	178.2	-174.3	0	111.2	W799 H812 C848	W799-K839 HydrophobicContact CD2-CD 4.16Å; W799-K839 HydrophobicContact CE3-CD 4.01Å; W799-K839 HydrophobicContact CE3-CG 4Å; W799-K839 HydrophobicContact CH2-CB 4.21Å; W799-K839 HydrophobicContact CH2-CD 3.7Å; W799-K839 HydrophobicContact CH2-CG 3.92Å; W799-K839 HydrophobicContact CZ2-CD 3.85Å; W799-K839 HydrophobicContact CZ3-CB 4.16Å; W799-K839 HydrophobicContact CZ3-CD 3.78Å; W799-K839 HydrophobicContact CZ3-CG 3.61Å; H812-K839 HydrophobicContact CB-CG 3.86Å; H812-K839 PolarHBondContact N-O 3.22Å; H812-K839 PolarHBondContact O-N 3.44Å; K839-C848 HydrophobicContact CD-CB 4.21Å; K839-C848 PolarHBondContact NZ-O 3.41Å
840	V	66.8	Low	61.3	Low	78 Å²	78	91.1 Å²	91.1	47%	0.473	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.8	173.8	-176.6	0	0	0	0	109.4	L810 L811	L810-V840 CarbonylContact O-C 3.59Å; L810-V840 WeakPolarHBondContact O-CA 3.15Å; L811-V840 HydrophobicContact CD1-CG2 3.96Å
841	C	65	Low	60.4	Low	3 Å²	3	89.4 Å²	89.4	2%	0.02	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	148.8	175.1	-46.8	0	0	0	0	111.3	G809 L810 C848	G809-C841 CarbonylContact C-O 3.55Å; G809-C841 WeakPolarHBondContact CA-O 3.23Å; L810-C841 HydrophobicContact CB-CB 4.23Å; L810-C841 PolarHBondContact N-O 2.67Å; L810-C841 PolarHBondContact O-N 3.38Å; C841-C848 HydrophobicContact CB-CB 4.08Å; C841-C848 WeakPolarHBondContact CB-SG 3.45Å; C841-C848 WeakPolarHBondContact SG-CB 3.34Å; C841-C848 CovalentContact SG-SG 2.03Å; C841-C848 PolarHBondContact SG-SG 3.34Å
842	A	65.6	Low	59.8	Low	29 Å²	29	87.2 Å²	87.2	24%	0.24	48%	0.476	C	S	.	.			trans	-74.1	144.2	165.1	0	0	0	0	0	110.3	W844 I845	A842-W844 PolarHBondContact O-N 2.67Å; A842-I845 HydrophobicContact CB-CD1 4.12Å; A842-I845 HydrophobicContact CB-CG1 4.34Å; A842-I845 PolarHBondContact O-N 2.89Å; A842-I845 VanDerWaalsContact O-N 3.12Å
843	P	60.8	Low	59	Low	67 Å²	67	83.2 Å²	83.2	44%	0.435	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-7	-169.1	25.6	-33.3	0	0	0	115.1	G808 L810	G808-P843 VanDerWaalsContact O-CD 3.26Å; G808-P843 WeakPolarHBondContact O-CD 3.35Å; G808-P843 VanDerWaalsContact O-CG 3.29Å; G808-P843 WeakPolarHBondContact O-CG 3.07Å; L810-P843 HydrophobicContact CD1-CB 4.49Å
844	W	62	Low	58.4	Low	210 Å²	210	82.3 Å²	82.3	80%	0.795	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	4.8	177.4	24.6	82.6	0	0	0	114.3	A842	A842-W844 PolarHBondContact O-N 2.67Å
845	I	57.5	Low	57.1	Low	66 Å²	66	85.7 Å²	85.7	34%	0.338	48%	0.484	S	S	.	.			trans	-116.6	105.2	-172.3	-59.9	-178.2	0	0	0	111	A842 N847 L851	A842-I845 HydrophobicContact CB-CD1 4.12Å; A842-I845 HydrophobicContact CB-CG1 4.34Å; A842-I845 PolarHBondContact O-N 2.89Å; A842-I845 VanDerWaalsContact O-N 3.12Å; I845-N847 VanDerWaalsContact C-N 3.34Å; I845-N847 WeakPolarHBondContact CG2-O 3.48Å; I845-N847 PolarHBondContact O-N 3.24Å; I845-L851 HydrophobicContact CB-CD1 4.37Å; I845-L851 HydrophobicContact CD1-CD1 3.46Å; I845-L851 VanDerWaalsContact CD1-CD1 3.46Å; I845-L851 HydrophobicContact CG1-CD1 4.47Å; I845-L851 HydrophobicContact CG2-CD1 4.05Å
846	T	54.2	Low	55.8	Low	145 Å²	145	86.5 Å²	86.5	89%	0.89	50%	0.496	S	S	*	.	S	Bend	trans	-71.4	-23.4	-177.6	48.4	0	0	0	0	114.2
847	N	54.9	Low	54.2	Low	136 Å²	136	88.1 Å²	88.1	73%	0.727	52%	0.518	S	S	*	.			trans	-112.3	91.2	175	-93.9	-29.3	0	0	0	110.7	I845 A849	I845-N847 VanDerWaalsContact C-N 3.34Å; I845-N847 WeakPolarHBondContact CG2-O 3.48Å; I845-N847 PolarHBondContact O-N 3.24Å; N847-A849 PolarHBondContact O-N 3.15Å
848	C	60.3	Low	52.7	Low	26 Å²	26	88 Å²	88	18%	0.176	52%	0.524	C	S	.	.			trans	-73.8	59.7	176	-50.3	0	0	0	0	113.1	K839 C841	K839-C848 HydrophobicContact CD-CB 4.21Å; K839-C848 PolarHBondContact NZ-O 3.41Å; C841-C848 HydrophobicContact CB-CB 4.08Å; C841-C848 WeakPolarHBondContact CB-SG 3.45Å; C841-C848 WeakPolarHBondContact SG-CB 3.34Å; C841-C848 CovalentContact SG-SG 2.03Å; C841-C848 PolarHBondContact SG-SG 3.34Å
849	A	53.4	Low	51.8	Low	79 Å²	79	83.4 Å²	83.4	65%	0.653	51%	0.505	S	S	*	.	S	Bend	trans	-93.8	113.1	169.5	0	0	0	0	0	108.9	N847 L851	N847-A849 PolarHBondContact O-N 3.15Å; A849-L851 PolarHBondContact O-N 3.33Å
850	D	41.4	Very low	51.7	Low	147 Å²	147	82 Å²	82	79%	0.786	50%	0.503	S	S	*	.			trans	43.4	59.4	169.5	-65.8	-2.9	0	0	0	117.4	S852	D850-S852 PolarHBondContact O-N 3.41Å; D850-S852 VanDerWaalsContact O-N 3.11Å
851	L	39.8	Very low	51.9	Low	89 Å²	89	82.5 Å²	82.5	47%	0.466	50%	0.5	S	S	.	.			trans	-85.3	65.7	162.5	-81	161.9	0	0	0	111.9	I845 A849	I845-L851 HydrophobicContact CB-CD1 4.37Å; I845-L851 HydrophobicContact CD1-CD1 3.46Å; I845-L851 VanDerWaalsContact CD1-CD1 3.46Å; I845-L851 HydrophobicContact CG1-CD1 4.47Å; I845-L851 HydrophobicContact CG2-CD1 4.05Å; A849-L851 PolarHBondContact O-N 3.33Å
852	S	41.1	Very low	52.7	Low	56 Å²	56	84.9 Å²	84.9	39%	0.392	51%	0.509	S	S	.	.			trans	-67.5	124.4	148.8	54.7	0	0	0	0	109.4	D850	D850-S852 PolarHBondContact O-N 3.41Å; D850-S852 VanDerWaalsContact O-N 3.11Å
853	I	39.1	Very low	53.5	Low	72 Å²	72	84.8 Å²	84.8	37%	0.369	51%	0.507	S	S	.	.	S	Bend	trans	80	135.1	163.8	-50.7	165.5	0	0	0	115.2	I900	I853-I900 HydrophobicContact CD1-CD1 4.01Å; I853-I900 HydrophobicContact CD1-CG1 4.14Å; I853-I900 HydrophobicContact CG1-CD1 3.62Å; I853-I900 HydrophobicContact CG1-CG1 4.29Å
854	S	42	Very low	54.4	Low	80 Å²	80	88.1 Å²	88.1	56%	0.559	53%	0.526	S	S	*	.			trans	-46.5	146.7	169.2	44.5	0	0	0	0	113.9	A856	S854-A856 PolarHBondContact O-N 2.81Å
855	P	34.2	Very low	55.5	Low	147 Å²	147	81 Å²	81	96%	0.955	50%	0.499	S	S	*	.	S	Bend	trans	-72.1	67.7	167.4	32.4	-35	0	0	0	110.9
856	A	41	Very low	56.8	Low	71 Å²	71	80.4 Å²	80.4	59%	0.587	50%	0.5	S	S	*	.	S	Bend	trans	-160.4	95	174.1	0	0	0	0	0	109.9	S854	S854-A856 PolarHBondContact O-N 2.81Å
857	A	37.9	Very low	58.2	Low	111 Å²	111	81.5 Å²	81.5	92%	0.917	50%	0.495	S	S	*	.			trans	56.1	71	159	0	0	0	0	0	118.8
858	S	45.1	Very low	59.5	Low	63 Å²	63	77.3 Å²	77.3	44%	0.441	47%	0.469	S	S	.	.			trans	-133.1	116	156.8	174.7	0	0	0	0	109.4	A860	S858-A860 PolarHBondContact O-N 2.88Å
859	S	56.5	Low	60.6	Low	22 Å²	22	78.1 Å²	78.1	15%	0.154	48%	0.475	C	S	.	.			trans	-83.9	10	-175.3	56.6	0	0	0	0	114.1	S888 T889 N890	S859-S888 WeakPolarHBondContact O-CA 3.26Å; S859-S888 PolarHBondContact OG-OG 3.05Å; S859-T889 PolarHBondContact O-N 3.03Å; S859-T889 VanDerWaalsContact O-N 3.1Å; S859-T889 PolarHBondContact O-OG1 2.79Å; S859-N890 VanDerWaalsContact CB-CG 3.5Å; S859-N890 WeakPolarHBondContact CB-ND2 3.34Å; S859-N890 PolarHBondContact OG-ND2 2.85Å
860	A	66.2	Low	61.8	Low	24 Å²	24	80.6 Å²	80.6	20%	0.198	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.4	-172.5	0	0	0	0	0	112.9	S858 M887 I897	S858-A860 PolarHBondContact O-N 2.88Å; A860-M887 CarbonylContact C-O 3.57Å; A860-M887 VanDerWaalsContact CA-O 3.3Å; A860-M887 WeakPolarHBondContact CA-O 3.43Å; A860-I897 HydrophobicContact CB-CG2 3.52Å
861	H	72.1	Confident	63.8	Low	89 Å²	89	75 Å²	75	41%	0.412	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	158.3	176.2	64.8	-79.4	0	0	0	111.4	M887 C899	H861-M887 PolarHBondContact N-O 3.25Å; H861-M887 PolarHBondContact ND1-O 3.42Å; H861-M887 PolarHBondContact O-N 2.91Å; H861-C899 PolarHBondContact O-SG 2.98Å; H861-C899 VanDerWaalsContact O-SG 3.42Å
862	W	81.8	Confident	65.8	Low	54 Å²	54	75.1 Å²	75.1	21%	0.205	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	140.7	173.2	-74.2	113.1	0	0	0	111.4	R884 C886 C899 I900 G901 T903	W862-R884 HydrophobicContact CD2-CG 4.11Å; W862-R884 HydrophobicContact CE3-CB 4.25Å; W862-R884 HydrophobicContact CE3-CG 3.53Å; W862-R884 HydrophobicContact CZ3-CG 3.92Å; W862-C886 HydrophobicContact CE3-CB 4.35Å; W862-C886 HydrophobicContact CZ3-CB 4.06Å; W862-C899 HydrophobicContact CD2-CB 3.74Å; W862-C899 HydrophobicContact CE3-CB 4.12Å; W862-C899 HydrophobicContact CG-CB 4.36Å; W862-C899 HydrophobicContact CH2-CB 3.8Å; W862-C899 HydrophobicContact CZ2-CB 3.38Å; W862-C899 HydrophobicContact CZ3-CB 4.15Å; W862-I900 PolarHBondContact NE1-O 3.17Å; W862-G901 VanDerWaalsContact CZ2-O 3.24Å; W862-G901 WeakPolarHBondContact CZ2-O 3.36Å; W862-T903 HydrophobicContact CH2-CG2 3.75Å; W862-T903 HydrophobicContact CZ3-CG2 3.87Å
863	S	82.4	Confident	67.4	Low	27 Å²	27	78.7 Å²	78.7	19%	0.189	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-62.3	162.7	163.8	80.3	0	0	0	0	110.7	W865 L885	S863-W865 PolarHBondContact O-N 3.48Å; S863-L885 PolarHBondContact N-O 3.15Å; S863-L885 PolarHBondContact OG-N 2.88Å
864	V	80.2	Confident	69	Low	137 Å²	137	81.8 Å²	81.8	83%	0.83	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-53.4	141	161.6	-169	0	0	0	0	108.7
865	W	84.5	Confident	70.7	Confident	60 Å²	60	80.3 Å²	80.3	23%	0.227	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-61.8	143.9	171.6	-76.3	105.4	0	0	0	110.7	S863 R882 Q883 R884 E905	S863-W865 PolarHBondContact O-N 3.48Å; W865-R882 HydrophobicContact CD2-CG 4.18Å; W865-R882 HydrophobicContact CE3-CB 4.26Å; W865-R882 HydrophobicContact CE3-CG 3.62Å; W865-R882 HydrophobicContact CZ3-CG 4.06Å; W865-Q883 CarbonylContact C-O 3.46Å; W865-Q883 VanDerWaalsContact CE3-C 3.45Å; W865-R884 HydrophobicContact CD2-CB 4.03Å; W865-R884 HydrophobicContact CD2-CG 4.01Å; W865-R884 HydrophobicContact CE3-CB 3.81Å; W865-R884 HydrophobicContact CE3-CG 3.77Å; W865-R884 HydrophobicContact CH2-CG 3.79Å; W865-R884 HydrophobicContact CZ2-CG 4.04Å; W865-R884 VanDerWaalsContact CZ2-NE 3.28Å; W865-R884 HydrophobicContact CZ3-CB 4.18Å; W865-R884 HydrophobicContact CZ3-CG 3.65Å; W865-E905 HydrophobicContact CH2-CB 3.74Å; W865-E905 HydrophobicContact CZ2-CB 4.4Å; W865-E905 HydrophobicContact CZ3-CB 3.9Å
866	S	85.1	Confident	72.3	Confident	53 Å²	53	74.3 Å²	74.3	37%	0.371	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-60.3	159	166.5	77.5	0	0	0	0	110.9	R882 Q883	S866-R882 WeakPolarHBondContact O-CB 3.19Å; S866-R882 WeakPolarHBondContact OG-CA 3.3Å; S866-Q883 PolarHBondContact N-O 3.03Å; S866-Q883 PolarHBondContact OG-N 2.69Å
867	E	82.4	Confident	74	Confident	168 Å²	168	73.3 Å²	73.3	79%	0.785	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-51.9	151.2	159.9	-73.4	-56.5	142.6	0	0	111.3
868	W	82.4	Confident	76	Confident	49 Å²	49	68 Å²	68	19%	0.186	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-69.2	131.6	173.4	-73.8	101.8	0	0	0	109.9	Q880 R882 E905 R907	W868-Q880 HydrophobicContact CB-CB 4.23Å; W868-Q880 HydrophobicContact CD2-CB 4.42Å; W868-Q880 HydrophobicContact CE3-CB 3.76Å; W868-Q880 WeakPolarHBondContact CZ3-O 3.38Å; W868-R882 HydrophobicContact CD2-CB 4.12Å; W868-R882 HydrophobicContact CD2-CG 4.03Å; W868-R882 HydrophobicContact CE3-CB 3.95Å; W868-R882 HydrophobicContact CE3-CG 3.87Å; W868-R882 HydrophobicContact CH2-CG 3.77Å; W868-R882 HydrophobicContact CZ2-CG 3.91Å; W868-R882 VanDerWaalsContact CZ2-NE 3.33Å; W868-R882 HydrophobicContact CZ3-CB 4.27Å; W868-R882 HydrophobicContact CZ3-CG 3.73Å; W868-E905 HydrophobicContact CH2-CB 4.26Å; W868-E905 HydrophobicContact CH2-CG 3.92Å; W868-R907 HydrophobicContact CD2-CG 4.24Å; W868-R907 HydrophobicContact CE3-CG 3.88Å; W868-R907 HydrophobicContact CH2-CB 3.78Å; W868-R907 HydrophobicContact CH2-CG 3.72Å; W868-R907 HydrophobicContact CZ2-CB 4.39Å; W868-R907 HydrophobicContact CZ2-CG 4.1Å; W868-R907 HydrophobicContact CZ3-CB 3.96Å; W868-R907 HydrophobicContact CZ3-CG 3.61Å
869	S	83.3	Confident	77.6	Confident	43 Å²	43	67.3 Å²	67.3	30%	0.301	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-54.9	157.6	172.9	76.2	0	0	0	0	111.5	Q880 N881	S869-Q880 WeakPolarHBondContact O-CB 3.4Å; S869-Q880 VanDerWaalsContact O-CD 3.25Å; S869-Q880 WeakPolarHBondContact O-CG 3.37Å; S869-Q880 PolarHBondContact O-NE2 2.78Å; S869-Q880 WeakPolarHBondContact OG-CA 3.28Å; S869-N881 PolarHBondContact N-O 3.48Å; S869-N881 PolarHBondContact OG-N 2.95Å
870	V	79.8	Confident	79.1	Confident	131 Å²	131	67.7 Å²	67.7	79%	0.794	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-51.2	145	166.4	-74.7	0	0	0	0	111.2	T872	V870-T872 PolarHBondContact O-N 2.83Å
871	C	83.5	Confident	80.1	Confident	30 Å²	30	68.7 Å²	68.7	20%	0.203	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-67	128.1	178.7	-174.2	0	0	0	0	110.1	R873 Q880 C909 N910	C871-R873 PolarHBondContact O-N 2.8Å; C871-R873 PolarHBondContact SG-O 2.82Å; C871-Q880 HydrophobicContact CB-CG 4.08Å; C871-C909 WeakPolarHBondContact CA-SG 3.46Å; C871-C909 HydrophobicContact CB-CB 3.87Å; C871-C909 WeakPolarHBondContact CB-SG 3.38Å; C871-C909 WeakPolarHBondContact SG-CB 3.45Å; C871-C909 CovalentContact SG-SG 2.01Å; C871-C909 PolarHBondContact SG-SG 2.92Å; C871-N910 PolarHBondContact SG-ND2 2.84Å; C871-N910 VanDerWaalsContact SG-ND2 3.35Å
872	T	82.1	Confident	80.9	Confident	90 Å²	90	67.4 Å²	67.4	55%	0.552	37%	0.37	S	S	*	.	S	Bend	trans	-65.6	-9.3	-176.2	53.5	0	0	0	0	114.9	V870 T879	V870-T872 PolarHBondContact O-N 2.83Å; T872-T879 WeakPolarHBondContact CG2-O 3.39Å; T872-T879 PolarHBondContact N-O 2.99Å; T872-T879 PolarHBondContact OG1-N 3.29Å; T872-T879 PolarHBondContact OG1-O 3.35Å; T872-T879 PolarHBondContact OG1-OG1 2.71Å
873	R	74.3	Confident	81.1	Confident	132 Å²	132	70.5 Å²	70.5	50%	0.498	39%	0.387	S	S	.	.			trans	-141.4	144.5	173.8	-58.9	-178.1	172.6	-173.7	-5.8	110.9	C871 C875 G876 N910	C871-R873 PolarHBondContact O-N 2.8Å; C871-R873 PolarHBondContact SG-O 2.82Å; R873-C875 VanDerWaalsContact C-N 3.35Å; R873-C875 WeakPolarHBondContact CB-O 3.29Å; R873-G876 VanDerWaalsContact CD-O 3.25Å; R873-G876 WeakPolarHBondContact CD-O 3.47Å; R873-G876 PolarHBondContact NH1-O 2.81Å; R873-N910 PolarHBondContact O-ND2 2.77Å
874	V	73	Confident	81.3	Confident	137 Å²	137	70.9 Å²	70.9	83%	0.83	38%	0.384	S	S	*	.	S	Bend	trans	-75	-27.2	178.5	-146.6	0	0	0	0	112.3	N910	V874-N910 PolarHBondContact O-ND2 2.85Å
875	C	77.3	Confident	81.4	Confident	49 Å²	49	70.5 Å²	70.5	33%	0.331	38%	0.377	S	S	.	.	S	Bend	trans	-155.2	168.8	174.8	52.5	0	0	0	0	108.4	R873 N910 C914	R873-C875 VanDerWaalsContact C-N 3.35Å; R873-C875 WeakPolarHBondContact CB-O 3.29Å; C875-N910 CarbonylContact C-O 3.48Å; C875-C914 HydrophobicContact CB-CB 4.02Å; C875-C914 WeakPolarHBondContact CB-SG 3.45Å; C875-C914 VanDerWaalsContact SG-CA 3.6Å; C875-C914 WeakPolarHBondContact SG-CB 3.44Å; C875-C914 CovalentContact SG-SG 2.03Å; C875-C914 PolarHBondContact SG-SG 3.11Å
876	G	68.4	Low	81.2	Confident	21 Å²	21	69.7 Å²	69.7	22%	0.216	38%	0.38	C	S	.	.	S	Bend	trans	71.4	46.7	178.2	0	0	0	0	0	114.2	R873 N910 K912	R873-G876 VanDerWaalsContact CD-O 3.25Å; R873-G876 WeakPolarHBondContact CD-O 3.47Å; R873-G876 PolarHBondContact NH1-O 2.81Å; G876-N910 PolarHBondContact N-O 3.11Å; G876-N910 VanDerWaalsContact N-O 3.13Å; G876-K912 PolarHBondContact N-O 2.7Å
877	S	75.4	Confident	80.7	Confident	49 Å²	49	71.5 Å²	71.5	34%	0.343	38%	0.384	S	S	.	.	S	Bend	trans	59.8	75.7	169.1	-58.9	0	0	0	0	114.6	C909 N910 V911	S877-C909 CarbonylContact C-O 3.45Å; S877-C909 WeakPolarHBondContact CA-O 3.38Å; S877-N910 PolarHBondContact N-O 2.82Å; S877-V911 WeakPolarHBondContact OG-CG1 3.26Å
878	G	80.1	Confident	79.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-177.4	166.1	0	0	0	0	0	112.7	L908 C909	G878-L908 WeakPolarHBondContact O-CA 3.5Å; G878-C909 PolarHBondContact N-O 3.41Å; G878-C909 PolarHBondContact O-N 3.13Å; G878-C909 PolarHBondContact O-SG 2.77Å; G878-C909 VanDerWaalsContact O-SG 3.41Å
879	T	79.9	Confident	78.9	Confident	49 Å²	49	67.4 Å²	67.4	30%	0.301	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	149	175.3	48.7	0	0	0	0	111.4	T872 T906 R907 L908 C909	T872-T879 WeakPolarHBondContact CG2-O 3.39Å; T872-T879 PolarHBondContact N-O 2.99Å; T872-T879 PolarHBondContact OG1-N 3.29Å; T872-T879 PolarHBondContact OG1-O 3.35Å; T872-T879 PolarHBondContact OG1-OG1 2.71Å; T879-T906 HydrophobicContact CG2-CG2 4.23Å; T879-R907 CarbonylContact C-O 3.58Å; T879-R907 VanDerWaalsContact CA-O 3.27Å; T879-R907 WeakPolarHBondContact CA-O 3.32Å; T879-L908 HydrophobicContact CG2-CD2 4.22Å; T879-C909 PolarHBondContact N-SG 3.37Å
880	Q	88.2	Confident	77.7	Confident	29 Å²	29	69.3 Å²	69.3	14%	0.136	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	148.3	165.7	-60.7	-176.4	-64.8	0	0	109.1	W868 S869 C871 T906 R907 C909	W868-Q880 HydrophobicContact CB-CB 4.23Å; W868-Q880 HydrophobicContact CD2-CB 4.42Å; W868-Q880 HydrophobicContact CE3-CB 3.76Å; W868-Q880 WeakPolarHBondContact CZ3-O 3.38Å; S869-Q880 WeakPolarHBondContact O-CB 3.4Å; S869-Q880 VanDerWaalsContact O-CD 3.25Å; S869-Q880 WeakPolarHBondContact O-CG 3.37Å; S869-Q880 PolarHBondContact O-NE2 2.78Å; S869-Q880 WeakPolarHBondContact OG-CA 3.28Å; C871-Q880 HydrophobicContact CB-CG 4.08Å; Q880-T906 CarbonylContact O-C 3.5Å; Q880-T906 VanDerWaalsContact O-CA 3.3Å; Q880-T906 WeakPolarHBondContact O-CA 3.37Å; Q880-R907 HydrophobicContact CB-CG 4.22Å; Q880-R907 PolarHBondContact N-O 2.74Å; Q880-R907 PolarHBondContact O-N 2.85Å; Q880-C909 HydrophobicContact CG-CB 4Å
881	N	85.5	Confident	76.5	Confident	45 Å²	45	70 Å²	70	24%	0.241	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146.4	175.5	-55.2	-92.5	0	0	0	110.3	S869 K904 E905 T906	S869-N881 PolarHBondContact N-O 3.48Å; S869-N881 PolarHBondContact OG-N 2.95Å; N881-K904 WeakPolarHBondContact OD1-CE 3.11Å; N881-K904 PolarHBondContact OD1-NZ 3.24Å; N881-E905 CarbonylContact C-O 3.49Å; N881-E905 VanDerWaalsContact CA-O 3.28Å; N881-E905 WeakPolarHBondContact CA-O 3.46Å; N881-T906 PolarHBondContact OD1-OG1 2.78Å; N881-T906 VanDerWaalsContact OD1-OG1 3.05Å
882	R	90.1	Very high	75.3	Confident	62 Å²	62	77.1 Å²	77.1	23%	0.234	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	158.4	163.5	64.1	176.1	-176.5	-174.3	-5.2	111.1	W865 S866 W868 K904 E905	W865-R882 HydrophobicContact CD2-CG 4.18Å; W865-R882 HydrophobicContact CE3-CB 4.26Å; W865-R882 HydrophobicContact CE3-CG 3.62Å; W865-R882 HydrophobicContact CZ3-CG 4.06Å; S866-R882 WeakPolarHBondContact O-CB 3.19Å; S866-R882 WeakPolarHBondContact OG-CA 3.3Å; W868-R882 HydrophobicContact CD2-CB 4.12Å; W868-R882 HydrophobicContact CD2-CG 4.03Å; W868-R882 HydrophobicContact CE3-CB 3.95Å; W868-R882 HydrophobicContact CE3-CG 3.87Å; W868-R882 HydrophobicContact CH2-CG 3.77Å; W868-R882 HydrophobicContact CZ2-CG 3.91Å; W868-R882 VanDerWaalsContact CZ2-NE 3.33Å; W868-R882 HydrophobicContact CZ3-CB 4.27Å; W868-R882 HydrophobicContact CZ3-CG 3.73Å; R882-K904 WeakPolarHBondContact O-CA 3.33Å; R882-E905 HydrophobicContact CG-CB 3.94Å; R882-E905 IonicContact CZ-OE2 2.67Å; R882-E905 PolarHBondContact N-O 3.33Å; R882-E905 IonicContact NE-OE1 3.18Å; R882-E905 IonicContact NE-OE2 3.83Å; R882-E905 PolarHBondContact NE-OE2 2.98Å; R882-E905 IonicContact NH2-OE1 2.71Å; R882-E905 PolarHBondContact NH2-OE1 2.8Å; R882-E905 IonicContact NH2-OE2 2.73Å; R882-E905 PolarHBondContact NH2-OE2 2.91Å; R882-E905 PolarHBondContact O-N 3.33Å
883	Q	85.7	Confident	73.7	Confident	120 Å²	120	79 Å²	79	56%	0.561	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	154.5	-176.1	-69.5	-179.2	-50.1	0	0	112.1	W865 S866 T903 K904	W865-Q883 CarbonylContact C-O 3.46Å; W865-Q883 VanDerWaalsContact CE3-C 3.45Å; S866-Q883 PolarHBondContact N-O 3.03Å; S866-Q883 PolarHBondContact OG-N 2.69Å; Q883-T903 CarbonylContact C-O 3.59Å; Q883-T903 VanDerWaalsContact CA-O 3.26Å; Q883-T903 WeakPolarHBondContact CA-O 3.17Å; Q883-K904 HydrophobicContact CG-CB 4.23Å; Q883-K904 HydrophobicContact CG-CG 4.1Å
884	R	87.1	Confident	72.7	Confident	34 Å²	34	80.3 Å²	80.3	13%	0.128	44%	0.444	C	S	.	.			trans	-140.5	148.9	171.8	60	176.1	179	179.1	0.6	110.8	W862 W865 P902 T903	W862-R884 HydrophobicContact CD2-CG 4.11Å; W862-R884 HydrophobicContact CE3-CB 4.25Å; W862-R884 HydrophobicContact CE3-CG 3.53Å; W862-R884 HydrophobicContact CZ3-CG 3.92Å; W865-R884 HydrophobicContact CD2-CB 4.03Å; W865-R884 HydrophobicContact CD2-CG 4.01Å; W865-R884 HydrophobicContact CE3-CB 3.81Å; W865-R884 HydrophobicContact CE3-CG 3.77Å; W865-R884 HydrophobicContact CH2-CG 3.79Å; W865-R884 HydrophobicContact CZ2-CG 4.04Å; W865-R884 VanDerWaalsContact CZ2-NE 3.28Å; W865-R884 HydrophobicContact CZ3-CB 4.18Å; W865-R884 HydrophobicContact CZ3-CG 3.65Å; R884-P902 PolarHBondContact NE-O 2.84Å; R884-P902 PolarHBondContact NH2-O 2.9Å; R884-P902 VanDerWaalsContact NH2-O 3.11Å; R884-T903 PolarHBondContact N-O 2.87Å
885	L	81.3	Confident	72.1	Confident	130 Å²	130	76 Å²	76	68%	0.681	43%	0.426	S	S	*	.			trans	-101	149.5	-179.7	-67	168	0	0	0	110.3	S863	S863-L885 PolarHBondContact N-O 3.15Å; S863-L885 PolarHBondContact OG-N 2.88Å
886	C	79.7	Confident	71.1	Confident	42 Å²	42	78.7 Å²	78.7	28%	0.284	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.6	171.4	-176.7	0	0	0	0	109	W862 I897 C899	W862-C886 HydrophobicContact CE3-CB 4.35Å; W862-C886 HydrophobicContact CZ3-CB 4.06Å; C886-I897 WeakPolarHBondContact SG-CG2 3.36Å; C886-C899 WeakPolarHBondContact CA-SG 3.19Å; C886-C899 HydrophobicContact CB-CB 3.76Å; C886-C899 WeakPolarHBondContact CB-SG 3.48Å; C886-C899 WeakPolarHBondContact SG-CB 3.37Å; C886-C899 PolarHBondContact SG-N 2.95Å; C886-C899 CovalentContact SG-SG 2.03Å; C886-C899 PolarHBondContact SG-SG 3.42Å
887	M	75.1	Confident	70.8	Confident	92 Å²	92	82.1 Å²	82.1	45%	0.453	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.2	-173.6	-59.7	-177.2	69.4	0	0	109.7	A860 H861	A860-M887 CarbonylContact C-O 3.57Å; A860-M887 VanDerWaalsContact CA-O 3.3Å; A860-M887 WeakPolarHBondContact CA-O 3.43Å; H861-M887 PolarHBondContact N-O 3.25Å; H861-M887 PolarHBondContact ND1-O 3.42Å; H861-M887 PolarHBondContact O-N 2.91Å
888	S	64	Low	70.2	Confident	37 Å²	37	89.1 Å²	89.1	26%	0.259	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	142	170.7	178.7	0	0	0	0	110	S859 N890	S859-S888 WeakPolarHBondContact O-CA 3.26Å; S859-S888 PolarHBondContact OG-OG 3.05Å; S888-N890 PolarHBondContact OG-N 2.85Å; S888-N890 VanDerWaalsContact OG-N 3.1Å; S888-N890 PolarHBondContact OG-O 2.84Å
889	T	63.9	Low	69.9	Low	94 Å²	94	90.2 Å²	90.2	58%	0.577	48%	0.483	S	S	*	.	S	Bend	trans	-87.4	-11	170.2	58.1	0	0	0	0	113.3	S859	S859-T889 PolarHBondContact O-N 3.03Å; S859-T889 VanDerWaalsContact O-N 3.1Å; S859-T889 PolarHBondContact O-OG1 2.79Å
890	N	56.9	Low	69.4	Low	82 Å²	82	92.8 Å²	92.8	44%	0.439	49%	0.493	S	S	.	.			trans	-100.3	120	-178.8	-69.5	1.1	0	0	0	110.2	S859 S888 E892	S859-N890 VanDerWaalsContact CB-CG 3.5Å; S859-N890 WeakPolarHBondContact CB-ND2 3.34Å; S859-N890 PolarHBondContact OG-ND2 2.85Å; S888-N890 PolarHBondContact OG-N 2.85Å; S888-N890 VanDerWaalsContact OG-N 3.1Å; S888-N890 PolarHBondContact OG-O 2.84Å; N890-E892 VanDerWaalsContact C-N 3.32Å; N890-E892 PolarHBondContact O-N 3.46Å
891	V	55.7	Low	68.6	Low	145 Å²	145	93.5 Å²	93.5	88%	0.879	51%	0.508	S	S	*	.	S	Bend	trans	-84	-5.4	-173.5	-178.8	0	0	0	0	112.8
892	E	57.6	Low	68.2	Low	181 Å²	181	95 Å²	95	85%	0.846	52%	0.521	S	S	*	.			trans	-120.7	4.6	-167.7	-61.1	-171.8	152.2	0	0	115.6	N890 T894	N890-E892 VanDerWaalsContact C-N 3.32Å; N890-E892 PolarHBondContact O-N 3.46Å; E892-T894 PolarHBondContact O-N 2.88Å
893	E	49.1	Very low	67.9	Low	130 Å²	130	96.2 Å²	96.2	61%	0.607	54%	0.535	S	S	*	.			trans	-87.2	111.1	177.4	-77.1	-178	163.5	0	0	112.4	G895	E893-G895 PolarHBondContact O-N 3.24Å
894	T	52.1	Low	67.8	Low	159 Å²	159	95.5 Å²	95.5	98%	0.975	53%	0.53	S	S	*	.			trans	-77.1	32	178.8	50.2	0	0	0	0	114.1	E892	E892-T894 PolarHBondContact O-N 2.88Å
895	G	60.2	Low	67.7	Low	45 Å²	45	97 Å²	97	46%	0.464	54%	0.539	S	S	.	.	S	Bend	trans	-117.6	155.9	-179	0	0	0	0	0	113.2	E893 I897	E893-G895 PolarHBondContact O-N 3.24Å; G895-I897 PolarHBondContact O-N 3.24Å
896	P	57.6	Low	67.7	Low	107 Å²	107	94.5 Å²	94.5	70%	0.695	53%	0.529	S	S	*	.			trans	-66.5	116.4	174.9	27	-33.2	0	0	0	110.5	R898	P896-R898 WeakPolarHBondContact O-CG 3.43Å; P896-R898 PolarHBondContact O-N 2.88Å
897	I	61.8	Low	67.7	Low	93 Å²	93	97.7 Å²	97.7	48%	0.477	54%	0.535	S	S	.	.			trans	-58.8	124.8	179.4	-47	172.1	0	0	0	109.6	A860 C886 G895	A860-I897 HydrophobicContact CB-CG2 3.52Å; C886-I897 WeakPolarHBondContact SG-CG2 3.36Å; G895-I897 PolarHBondContact O-N 3.24Å
898	R	62.5	Low	67.7	Low	195 Å²	195	97.7 Å²	97.7	74%	0.736	54%	0.536	S	S	*	.			trans	-113.7	98.8	-177.6	-56.6	-169.3	-164.7	-144.1	4.4	112.3	P896	P896-R898 WeakPolarHBondContact O-CG 3.43Å; P896-R898 PolarHBondContact O-N 2.88Å
899	C	73.8	Confident	68.4	Low	24 Å²	24	96.5 Å²	96.5	16%	0.162	53%	0.528	C	S	.	.			trans	-91.4	141.3	161.9	-60	0	0	0	0	110	H861 W862 C886	H861-C899 PolarHBondContact O-SG 2.98Å; H861-C899 VanDerWaalsContact O-SG 3.42Å; W862-C899 HydrophobicContact CD2-CB 3.74Å; W862-C899 HydrophobicContact CE3-CB 4.12Å; W862-C899 HydrophobicContact CG-CB 4.36Å; W862-C899 HydrophobicContact CH2-CB 3.8Å; W862-C899 HydrophobicContact CZ2-CB 3.38Å; W862-C899 HydrophobicContact CZ3-CB 4.15Å; C886-C899 WeakPolarHBondContact CA-SG 3.19Å; C886-C899 HydrophobicContact CB-CB 3.76Å; C886-C899 WeakPolarHBondContact CB-SG 3.48Å; C886-C899 WeakPolarHBondContact SG-CB 3.37Å; C886-C899 PolarHBondContact SG-N 2.95Å; C886-C899 CovalentContact SG-SG 2.03Å; C886-C899 PolarHBondContact SG-SG 3.42Å
900	I	69.4	Low	69	Low	102 Å²	102	94.5 Å²	94.5	52%	0.523	51%	0.514	S	S	.	.			trans	-91.8	127.9	179.5	-59.5	-168.8	0	0	0	110.2	I853 W862	I853-I900 HydrophobicContact CD1-CD1 4.01Å; I853-I900 HydrophobicContact CD1-CG1 4.14Å; I853-I900 HydrophobicContact CG1-CD1 3.62Å; I853-I900 HydrophobicContact CG1-CG1 4.29Å; W862-I900 PolarHBondContact NE1-O 3.17Å
901	G	70.7	Confident	69.7	Low	44 Å²	44	94.9 Å²	94.9	45%	0.454	52%	0.519	S	S	.	.	S	Bend	trans	118.3	176.8	179.5	0	0	0	0	0	113.6	W862	W862-G901 VanDerWaalsContact CZ2-O 3.24Å; W862-G901 WeakPolarHBondContact CZ2-O 3.36Å
902	P	78.7	Confident	69.8	Low	77 Å²	77	96.4 Å²	96.4	50%	0.5	51%	0.513	S	S	.	.			trans	-76.2	146.3	-177.6	29.6	-35.5	0	0	0	112.6	R884	R884-P902 PolarHBondContact NE-O 2.84Å; R884-P902 PolarHBondContact NH2-O 2.9Å; R884-P902 VanDerWaalsContact NH2-O 3.11Å
903	T	82.9	Confident	70.1	Confident	88 Å²	88	92.9 Å²	92.9	54%	0.54	51%	0.506	S	S	.	.	S	Bend	trans	-82	-15.8	170.6	53.5	0	0	0	0	113.2	W862 Q883 R884	W862-T903 HydrophobicContact CH2-CG2 3.75Å; W862-T903 HydrophobicContact CZ3-CG2 3.87Å; Q883-T903 CarbonylContact C-O 3.59Å; Q883-T903 VanDerWaalsContact CA-O 3.26Å; Q883-T903 WeakPolarHBondContact CA-O 3.17Å; R884-T903 PolarHBondContact N-O 2.87Å
904	K	83.9	Confident	70.9	Confident	104 Å²	104	90.1 Å²	90.1	45%	0.452	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	137.9	-176.2	-177.7	-177.7	176.5	-174.8	0	110.1	N881 R882 Q883	N881-K904 WeakPolarHBondContact OD1-CE 3.11Å; N881-K904 PolarHBondContact OD1-NZ 3.24Å; R882-K904 WeakPolarHBondContact O-CA 3.33Å; Q883-K904 HydrophobicContact CG-CB 4.23Å; Q883-K904 HydrophobicContact CG-CG 4.1Å
905	E	84.4	Confident	71.3	Confident	66 Å²	66	89.3 Å²	89.3	31%	0.308	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.3	176	-167.4	-172.4	151.9	0	0	110	W865 W868 N881 R882	W865-E905 HydrophobicContact CH2-CB 3.74Å; W865-E905 HydrophobicContact CZ2-CB 4.4Å; W865-E905 HydrophobicContact CZ3-CB 3.9Å; W868-E905 HydrophobicContact CH2-CB 4.26Å; W868-E905 HydrophobicContact CH2-CG 3.92Å; N881-E905 CarbonylContact C-O 3.49Å; N881-E905 VanDerWaalsContact CA-O 3.28Å; N881-E905 WeakPolarHBondContact CA-O 3.46Å; R882-E905 HydrophobicContact CG-CB 3.94Å; R882-E905 IonicContact CZ-OE2 2.67Å; R882-E905 PolarHBondContact N-O 3.33Å; R882-E905 IonicContact NE-OE1 3.18Å; R882-E905 IonicContact NE-OE2 3.83Å; R882-E905 PolarHBondContact NE-OE2 2.98Å; R882-E905 IonicContact NH2-OE1 2.71Å; R882-E905 PolarHBondContact NH2-OE1 2.8Å; R882-E905 IonicContact NH2-OE2 2.73Å; R882-E905 PolarHBondContact NH2-OE2 2.91Å; R882-E905 PolarHBondContact O-N 3.33Å
906	T	81.2	Confident	70.8	Confident	78 Å²	78	90.5 Å²	90.5	48%	0.479	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	129.8	-178.7	-52.9	0	0	0	0	110	T879 Q880 N881	T879-T906 HydrophobicContact CG2-CG2 4.23Å; Q880-T906 CarbonylContact O-C 3.5Å; Q880-T906 VanDerWaalsContact O-CA 3.3Å; Q880-T906 WeakPolarHBondContact O-CA 3.37Å; N881-T906 PolarHBondContact OD1-OG1 2.78Å; N881-T906 VanDerWaalsContact OD1-OG1 3.05Å
907	R	79.6	Confident	70.1	Confident	109 Å²	109	92.1 Å²	92.1	41%	0.411	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	155.7	174.2	74.8	177.7	-177.4	178.7	0.6	112.2	W868 T879 Q880	W868-R907 HydrophobicContact CD2-CG 4.24Å; W868-R907 HydrophobicContact CE3-CG 3.88Å; W868-R907 HydrophobicContact CH2-CB 3.78Å; W868-R907 HydrophobicContact CH2-CG 3.72Å; W868-R907 HydrophobicContact CZ2-CB 4.39Å; W868-R907 HydrophobicContact CZ2-CG 4.1Å; W868-R907 HydrophobicContact CZ3-CB 3.96Å; W868-R907 HydrophobicContact CZ3-CG 3.61Å; T879-R907 CarbonylContact C-O 3.58Å; T879-R907 VanDerWaalsContact CA-O 3.27Å; T879-R907 WeakPolarHBondContact CA-O 3.32Å; Q880-R907 HydrophobicContact CB-CG 4.22Å; Q880-R907 PolarHBondContact N-O 2.74Å; Q880-R907 PolarHBondContact O-N 2.85Å
908	L	75.6	Confident	69	Low	91 Å²	91	97.1 Å²	97.1	48%	0.476	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	149.3	168.7	-71	169.5	0	0	0	110.7	G878 T879	G878-L908 WeakPolarHBondContact O-CA 3.5Å; T879-L908 HydrophobicContact CG2-CD2 4.22Å
909	C	79.4	Confident	67.9	Low	13 Å²	13	93.8 Å²	93.8	9%	0.088	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	159.8	178.3	55	0	0	0	0	110	C871 S877 G878 T879 Q880 V911	C871-C909 WeakPolarHBondContact CA-SG 3.46Å; C871-C909 HydrophobicContact CB-CB 3.87Å; C871-C909 WeakPolarHBondContact CB-SG 3.38Å; C871-C909 WeakPolarHBondContact SG-CB 3.45Å; C871-C909 CovalentContact SG-SG 2.01Å; C871-C909 PolarHBondContact SG-SG 2.92Å; S877-C909 CarbonylContact C-O 3.45Å; S877-C909 WeakPolarHBondContact CA-O 3.38Å; G878-C909 PolarHBondContact N-O 3.41Å; G878-C909 PolarHBondContact O-N 3.13Å; G878-C909 PolarHBondContact O-SG 2.77Å; G878-C909 VanDerWaalsContact O-SG 3.41Å; T879-C909 PolarHBondContact N-SG 3.37Å; Q880-C909 HydrophobicContact CG-CB 4Å; C909-V911 VanDerWaalsContact C-N 3.26Å; C909-V911 PolarHBondContact O-N 3.1Å
910	N	76.1	Confident	66.2	Low	52 Å²	52	98.9 Å²	98.9	28%	0.278	56%	0.564	S	S	.	*			trans	50.8	42.5	178.5	-64.4	-18.7	0	0	0	114.3	C871 R873 V874 C875 G876 S877 K912	C871-N910 PolarHBondContact SG-ND2 2.84Å; C871-N910 VanDerWaalsContact SG-ND2 3.35Å; R873-N910 PolarHBondContact O-ND2 2.77Å; V874-N910 PolarHBondContact O-ND2 2.85Å; C875-N910 CarbonylContact C-O 3.48Å; G876-N910 PolarHBondContact N-O 3.11Å; G876-N910 VanDerWaalsContact N-O 3.13Å; S877-N910 PolarHBondContact N-O 2.82Å; N910-K912 PolarHBondContact O-N 3.19Å
911	V	72.3	Confident	64.7	Low	90 Å²	90	103.6 Å²	103.6	55%	0.545	58%	0.581	S	S	.	*			trans	-66.6	-5.1	-174.3	-150.1	0	0	0	0	114.2	S877 C909	S877-V911 WeakPolarHBondContact OG-CG1 3.26Å; C909-V911 VanDerWaalsContact C-N 3.26Å; C909-V911 PolarHBondContact O-N 3.1Å
912	K	57	Low	63.4	Low	176 Å²	176	108.8 Å²	108.8	77%	0.765	60%	0.599	S	S	*	*	S	Bend	trans	-78.3	138.7	176.8	-69.1	-171.6	176.9	-173.6	0	110.5	G876 N910	G876-K912 PolarHBondContact N-O 2.7Å; N910-K912 PolarHBondContact O-N 3.19Å
913	P	63.9	Low	61.9	Low	107 Å²	107	110.4 Å²	110.4	70%	0.695	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-63.8	143	177.9	26.8	-34.4	0	0	0	111.4	T915	P913-T915 PolarHBondContact O-N 2.89Å
914	C	66.8	Low	59.7	Low	72 Å²	72	113.6 Å²	113.6	49%	0.486	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-67.7	117.8	172.9	-56.2	0	0	0	0	110.1	C875 G916	C875-C914 HydrophobicContact CB-CB 4.02Å; C875-C914 WeakPolarHBondContact CB-SG 3.45Å; C875-C914 VanDerWaalsContact SG-CA 3.6Å; C875-C914 WeakPolarHBondContact SG-CB 3.44Å; C875-C914 CovalentContact SG-SG 2.03Å; C875-C914 PolarHBondContact SG-SG 3.11Å; C914-G916 PolarHBondContact O-N 3.04Å
915	T	58.7	Low	57.6	Low	143 Å²	143	113.3 Å²	113.3	88%	0.877	63%	0.631	S	S	*	*			trans	-76.7	104.3	171.2	48.3	0	0	0	0	109.4	P913	P913-T915 PolarHBondContact O-N 2.89Å
916	G	50.9	Low	55.3	Low	70 Å²	70	122 Å²	122	72%	0.722	66%	0.661	S	S	*	*			trans	-81.4	136.5	-163.9	0	0	0	0	0	116.3	C914	C914-G916 PolarHBondContact O-N 3.04Å
917	T	43.2	Very low	53.5	Low	141 Å²	141	125.5 Å²	125.5	87%	0.865	68%	0.677	S	S	*	*				-126.4	148.9	124.3	37.1	0	0	0	0	107.9
918	Q	37.7	Very low	52.2	Low	198 Å²	198	124.5 Å²	124.5	93%	0.925	69%	0.685	S	S	*	*			trans	-75.6	129.4	-172.5	-60.5	162.3	-73	0	0	111
919	V	39.3	Very low	51.2	Low	125 Å²	125	126.2 Å²	126.2	76%	0.758	70%	0.699	S	S	*	*			trans	-140.9	131.7	149.2	-169.8	0	0	0	0	108.4
920	D	38.2	Very low	50.3	Low	130 Å²	130	127.3 Å²	127.3	70%	0.695	71%	0.707	S	S	*	*			trans	-76.7	128.3	179.9	-157.3	-18	0	0	0	110	N922	D920-N922 VanDerWaalsContact C-N 3.32Å; D920-N922 PolarHBondContact O-N 3.08Å
921	F	39.2	Very low	49.7	Very low	201 Å²	201	127.9 Å²	127.9	88%	0.882	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	9.3	-162.8	-110.1	-84.1	0	0	0	115.2
922	N	42.7	Very low	50	Low	154 Å²	154	126.7 Å²	126.7	82%	0.824	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	5.4	-176.7	-85.4	-25.8	0	0	0	115.4	D920	D920-N922 VanDerWaalsContact C-N 3.32Å; D920-N922 PolarHBondContact O-N 3.08Å
923	T	47.4	Very low	51	Low	111 Å²	111	120 Å²	120	68%	0.681	68%	0.676	S	S	*	*	S	Bend	trans	-134.4	106.7	177.7	41.8	0	0	0	0	113.9
924	L	37	Very low	51.6	Low	155 Å²	155	119.3 Å²	119.3	81%	0.812	67%	0.673	S	S	*	*			trans	67.7	106.6	140.4	-75.1	154.9	0	0	0	120.6
925	S	38	Very low	52.3	Low	98 Å²	98	119.2 Å²	119.2	69%	0.685	66%	0.662	S	S	*	*				66.2	107.4	127.8	63	0	0	0	0	121.5
926	R	36.6	Very low	53.3	Low	248 Å²	248	113.6 Å²	113.6	94%	0.936	63%	0.629	S	S	*	*			trans	43.2	96.7	131.3	-68	-178	175.1	174.4	-1.9	117.9
927	D	43.4	Very low	54.6	Low	151 Å²	151	117.1 Å²	117.1	81%	0.807	63%	0.631	S	S	*	*			trans	-145.9	135.9	132	-140.1	1.5	0	0	0	108.8	T929	D927-T929 PolarHBondContact O-N 3.2Å
928	P	52	Low	56.6	Low	89 Å²	89	113.4 Å²	113.4	58%	0.578	60%	0.603	S	S	*	*			trans	-89.6	89.8	-165.8	34	-31	0	0	0	111.7	S930	P928-S930 PolarHBondContact O-N 3.17Å
929	T	55.5	Low	58.6	Low	126 Å²	126	106.6 Å²	106.6	77%	0.773	58%	0.575	S	S	*	*			trans	-66.7	121	171.6	46.1	0	0	0	0	111.1	D927 S931	D927-T929 PolarHBondContact O-N 3.2Å; T929-S931 PolarHBondContact O-N 2.84Å
930	S	60.6	Low	60.6	Low	36 Å²	36	109.4 Å²	109.4	25%	0.252	58%	0.58	S	S	.	*			trans	-61.8	125.8	-179.6	-56.4	0	0	0	0	112.1	P928 N957 G958 A959 Q960	P928-S930 PolarHBondContact O-N 3.17Å; S930-N957 WeakPolarHBondContact CA-O 3.41Å; S930-G958 WeakPolarHBondContact OG-CA 3.25Å; S930-A959 PolarHBondContact OG-N 3.36Å; S930-Q960 WeakPolarHBondContact CB-O 3.33Å; S930-Q960 WeakPolarHBondContact OG-CA 3.38Å; S930-Q960 PolarHBondContact OG-N 2.84Å; S930-Q960 PolarHBondContact OG-O 3.21Å
931	S	62.4	Low	62.8	Low	65 Å²	65	105.2 Å²	105.2	46%	0.455	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.9	145	-178.6	58.8	0	0	0	0	111.7	T929 N957	T929-S931 PolarHBondContact O-N 2.84Å; S931-N957 PolarHBondContact N-O 2.95Å; S931-N957 WeakPolarHBondContact O-CA 3.32Å; S931-N957 WeakPolarHBondContact O-CB 3.44Å; S931-N957 PolarHBondContact O-N 3.45Å
932	W	80	Confident	64.9	Low	65 Å²	65	99.7 Å²	99.7	25%	0.246	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	136.8	174	-74.9	110.8	0	0	0	111.3	R954 C956 C962 V963 G964	W932-R954 HydrophobicContact CD2-CG 4.16Å; W932-R954 HydrophobicContact CE3-CB 4.21Å; W932-R954 HydrophobicContact CE3-CG 3.57Å; W932-R954 HydrophobicContact CZ3-CG 3.98Å; W932-C956 HydrophobicContact CE3-CB 4.31Å; W932-C956 HydrophobicContact CH2-CB 4.48Å; W932-C956 HydrophobicContact CZ3-CB 4.07Å; W932-C962 HydrophobicContact CD2-CB 3.75Å; W932-C962 HydrophobicContact CE3-CB 4.26Å; W932-C962 HydrophobicContact CG-CB 4.24Å; W932-C962 HydrophobicContact CH2-CB 4Å; W932-C962 HydrophobicContact CZ2-CB 3.44Å; W932-C962 VanDerWaalsContact CZ2-CB 3.44Å; W932-C962 VanDerWaalsContact CZ2-O 3.26Å; W932-C962 WeakPolarHBondContact CZ2-O 3.44Å; W932-C962 HydrophobicContact CZ3-CB 4.38Å; W932-V963 PolarHBondContact NE1-O 3.2Å; W932-G964 WeakPolarHBondContact CZ2-O 3.47Å
933	S	77.1	Confident	66.5	Low	35 Å²	35	94.3 Å²	94.3	25%	0.245	52%	0.523	C	S	.	.	P	Polyproline II helix	trans	-59.4	167.3	162.9	79.9	0	0	0	0	110.9	V955	S933-V955 WeakPolarHBondContact CB-O 3.24Å; S933-V955 PolarHBondContact N-O 2.91Å; S933-V955 PolarHBondContact OG-N 2.88Å; S933-V955 PolarHBondContact OG-O 3.43Å
934	C	76.6	Confident	67.7	Low	92 Å²	92	95.7 Å²	95.7	62%	0.622	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-53.4	145.9	161.1	-58.8	0	0	0	0	110
935	W	81.4	Confident	69.5	Low	70 Å²	70	89.4 Å²	89.4	27%	0.265	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-62.1	144.4	163.3	-72.3	101.7	0	0	0	109.7	R952 W953 R954 E965 Q968	W935-R952 HydrophobicContact CD2-CG 4.25Å; W935-R952 HydrophobicContact CE3-CB 4.32Å; W935-R952 HydrophobicContact CE3-CG 3.63Å; W935-R952 HydrophobicContact CZ3-CG 4.1Å; W935-W953 CarbonylContact C-O 3.49Å; W935-W953 WeakPolarHBondContact CA-O 3.42Å; W935-R954 HydrophobicContact CD2-CB 4.19Å; W935-R954 HydrophobicContact CD2-CG 3.97Å; W935-R954 HydrophobicContact CE3-CB 4.04Å; W935-R954 HydrophobicContact CE3-CG 3.79Å; W935-R954 HydrophobicContact CH2-CG 3.93Å; W935-R954 HydrophobicContact CZ2-CG 4.1Å; W935-R954 HydrophobicContact CZ3-CB 4.45Å; W935-R954 HydrophobicContact CZ3-CG 3.77Å; W935-E965 HydrophobicContact CH2-CB 4.46Å; W935-E965 WeakPolarHBondContact CH2-O 3.39Å; W935-Q968 HydrophobicContact CH2-CB 3.72Å; W935-Q968 HydrophobicContact CZ2-CB 4.36Å; W935-Q968 HydrophobicContact CZ3-CB 3.87Å
936	S	80.6	Confident	71.2	Confident	26 Å²	26	85.8 Å²	85.8	18%	0.182	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-59.4	163.7	161.3	72.7	0	0	0	0	110.4	R952 W953	S936-R952 VanDerWaalsContact OG-CA 3.31Å; S936-R952 WeakPolarHBondContact OG-CA 3.3Å; S936-R952 WeakPolarHBondContact OG-CB 3.42Å; S936-W953 PolarHBondContact N-O 3.11Å; S936-W953 PolarHBondContact OG-N 3.23Å
937	D	77.8	Confident	73.3	Confident	143 Å²	143	82.8 Å²	82.8	77%	0.765	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-57.8	155.9	159.5	-65	-49.5	0	0	0	109.9
938	F	83.9	Confident	75.1	Confident	63 Å²	63	75.8 Å²	75.8	28%	0.276	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-69.7	140.5	169.9	-83.2	-77.2	0	0	0	109.5	K950 Q951 R952 I970	F938-K950 HydrophobicContact CB-CB 4.28Å; F938-K950 HydrophobicContact CB-CD 3.89Å; F938-K950 HydrophobicContact CB-CG 4.25Å; F938-K950 HydrophobicContact CD1-CB 4.08Å; F938-K950 HydrophobicContact CD1-CD 4.04Å; F938-K950 HydrophobicContact CD1-CG 3.66Å; F938-K950 HydrophobicContact CE1-CG 4.24Å; F938-K950 HydrophobicContact CG-CD 3.93Å; F938-K950 HydrophobicContact CG-CG 4.08Å; F938-Q951 CarbonylContact C-O 3.48Å; F938-Q951 VanDerWaalsContact CA-O 3.28Å; F938-Q951 WeakPolarHBondContact CA-O 3.3Å; F938-R952 HydrophobicContact CD1-CB 3.99Å; F938-R952 HydrophobicContact CD1-CG 3.92Å; F938-R952 HydrophobicContact CE1-CB 4.19Å; F938-R952 HydrophobicContact CE1-CG 3.59Å; F938-R952 HydrophobicContact CE2-CG 4.33Å; F938-R952 HydrophobicContact CG-CB 4.32Å; F938-R952 HydrophobicContact CG-CG 4.42Å; F938-R952 VanDerWaalsContact CZ-CD 3.41Å; F938-R952 HydrophobicContact CZ-CG 3.8Å; F938-I970 HydrophobicContact CE1-CB 4.3Å; F938-I970 HydrophobicContact CE1-CD1 4.06Å; F938-I970 HydrophobicContact CE1-CG1 3.96Å; F938-I970 HydrophobicContact CE2-CD1 4.28Å; F938-I970 HydrophobicContact CZ-CB 4.49Å; F938-I970 HydrophobicContact CZ-CD1 3.44Å; F938-I970 VanDerWaalsContact CZ-CD1 3.44Å; F938-I970 HydrophobicContact CZ-CG1 3.87Å
939	T	81.8	Confident	76.8	Confident	55 Å²	55	74.4 Å²	74.4	34%	0.337	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-54.7	162.9	164.1	64.4	0	0	0	0	110.5	K950 Q951 W953	T939-K950 WeakPolarHBondContact O-CB 3.34Å; T939-Q951 HydrophobicContact CG2-CB 4.3Å; T939-Q951 PolarHBondContact N-O 3.41Å; T939-Q951 PolarHBondContact OG1-N 3.1Å; T939-W953 HydrophobicContact CG2-CZ3 4.08Å
940	E	79.9	Confident	78.4	Confident	184 Å²	184	71.7 Å²	71.7	86%	0.86	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-56.3	158.2	160.6	-60	-162.1	161	0	0	110.5
941	C	84.4	Confident	79.7	Confident	42 Å²	42	73.6 Å²	73.6	28%	0.284	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-65.6	136.7	174.6	-61.1	0	0	0	0	109.1	A943 A948 V949 C972 L974	C941-A943 PolarHBondContact O-N 3.02Å; C941-A948 HydrophobicContact CB-CB 3.86Å; C941-V949 CarbonylContact C-O 3.5Å; C941-V949 WeakPolarHBondContact CA-O 3.11Å; C941-C972 HydrophobicContact CB-CB 3.76Å; C941-C972 WeakPolarHBondContact CB-SG 3.17Å; C941-C972 WeakPolarHBondContact SG-CB 3.33Å; C941-C972 CovalentContact SG-SG 2.04Å; C941-C972 PolarHBondContact SG-SG 2.9Å; C941-L974 HydrophobicContact CB-CD1 4.1Å
942	S	83.3	Confident	81	Confident	85 Å²	85	73.3 Å²	73.3	59%	0.594	40%	0.4	S	S	*	.	S	Bend	trans	-61	-7	-174	64	0	0	0	0	116.2	V949	S942-V949 WeakPolarHBondContact CB-O 3.29Å; S942-V949 PolarHBondContact N-O 3.45Å; S942-V949 PolarHBondContact OG-N 3.05Å
943	A	75.9	Confident	81.4	Confident	41 Å²	41	77.2 Å²	77.2	34%	0.339	42%	0.415	S	S	.	.	S	Bend	trans	-147.2	160.9	170.9	0	0	0	0	0	109.2	C941 C945 A948 L974	C941-A943 PolarHBondContact O-N 3.02Å; A943-C945 VanDerWaalsContact C-N 3.32Å; A943-A948 HydrophobicContact CB-CB 4.07Å; A943-L974 WeakPolarHBondContact O-CD1 3.44Å
944	T	73.1	Confident	81.7	Confident	140 Å²	140	77.7 Å²	77.7	86%	0.859	41%	0.411	S	S	*	.	S	Bend	trans	-83.6	-7.3	179	48.6	0	0	0	0	113.7
945	C	76.2	Confident	81.9	Confident	23 Å²	23	77.5 Å²	77.5	16%	0.155	41%	0.407	C	S	.	.	S	Bend	trans	-160	170.9	-177.8	56.4	0	0	0	0	110.5	A943 R975 C977	A943-C945 VanDerWaalsContact C-N 3.32Å; C945-R975 CarbonylContact C-O 3.51Å; C945-R975 WeakPolarHBondContact CA-O 3.38Å; C945-R975 WeakPolarHBondContact CB-O 3.48Å; C945-C977 VanDerWaalsContact CB-CA 3.47Å; C945-C977 HydrophobicContact CB-CB 3.8Å; C945-C977 WeakPolarHBondContact CB-SG 3.37Å; C945-C977 PolarHBondContact O-SG 3.4Å; C945-C977 WeakPolarHBondContact SG-CA 3.49Å; C945-C977 WeakPolarHBondContact SG-CB 3.49Å; C945-C977 CovalentContact SG-SG 2.03Å; C945-C977 PolarHBondContact SG-SG 3.43Å
946	G	73.7	Confident	81.9	Confident	23 Å²	23	76.3 Å²	76.3	24%	0.237	41%	0.409	C	S	.	.	S	Bend	trans	71.2	-156.6	-179.4	0	0	0	0	0	113.9	A948 L974 R975	G946-A948 PolarHBondContact O-N 3.22Å; G946-L974 PolarHBondContact O-N 3.36Å; G946-R975 PolarHBondContact N-O 2.99Å
947	E	78.7	Confident	81.4	Confident	185 Å²	185	79.3 Å²	79.3	86%	0.864	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	116.5	170.1	-65.5	-154.6	141.9	0	0	110.1
948	A	82	Confident	80.8	Confident	3 Å²	3	74.6 Å²	74.6	3%	0.025	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	168.2	176.3	0	0	0	0	0	110.6	C941 A943 G946 A971 C972 L974	C941-A948 HydrophobicContact CB-CB 3.86Å; A943-A948 HydrophobicContact CB-CB 4.07Å; G946-A948 PolarHBondContact O-N 3.22Å; A948-A971 CarbonylContact O-C 3.59Å; A948-A971 WeakPolarHBondContact O-CA 3.31Å; A948-C972 HydrophobicContact CB-CB 4.11Å; A948-C972 PolarHBondContact N-O 3.08Å; A948-C972 PolarHBondContact O-N 2.92Å; A948-L974 HydrophobicContact CB-CD1 3.96Å
949	V	87.3	Confident	79.5	Confident	61 Å²	61	75.9 Å²	75.9	37%	0.37	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	150.3	174.4	-66.2	0	0	0	0	111.4	C941 S942 T969 I970	C941-V949 CarbonylContact C-O 3.5Å; C941-V949 WeakPolarHBondContact CA-O 3.11Å; S942-V949 WeakPolarHBondContact CB-O 3.29Å; S942-V949 PolarHBondContact N-O 3.45Å; S942-V949 PolarHBondContact OG-N 3.05Å; V949-T969 HydrophobicContact CB-CG2 3.8Å; V949-T969 HydrophobicContact CG1-CG2 4.1Å; V949-T969 HydrophobicContact CG2-CG2 4.29Å; V949-I970 WeakPolarHBondContact CA-O 3.24Å
950	K	90.2	Very high	78.7	Confident	68 Å²	68	80.8 Å²	80.8	30%	0.296	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.9	170.3	59.2	-178.8	-174.7	-178.3	0	110.8	F938 T939 T969 I970	F938-K950 HydrophobicContact CB-CB 4.28Å; F938-K950 HydrophobicContact CB-CD 3.89Å; F938-K950 HydrophobicContact CB-CG 4.25Å; F938-K950 HydrophobicContact CD1-CB 4.08Å; F938-K950 HydrophobicContact CD1-CD 4.04Å; F938-K950 HydrophobicContact CD1-CG 3.66Å; F938-K950 HydrophobicContact CE1-CG 4.24Å; F938-K950 HydrophobicContact CG-CD 3.93Å; F938-K950 HydrophobicContact CG-CG 4.08Å; T939-K950 WeakPolarHBondContact O-CB 3.34Å; K950-T969 WeakPolarHBondContact O-CA 3.34Å; K950-I970 PolarHBondContact N-O 3.04Å; K950-I970 PolarHBondContact O-N 3.3Å
951	Q	87.2	Confident	78.2	Confident	76 Å²	76	81.2 Å²	81.2	36%	0.355	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	153	-172.2	-62	-171.8	-25.4	0	0	112.1	F938 T939 Q968 T969	F938-Q951 CarbonylContact C-O 3.48Å; F938-Q951 VanDerWaalsContact CA-O 3.28Å; F938-Q951 WeakPolarHBondContact CA-O 3.3Å; T939-Q951 HydrophobicContact CG2-CB 4.3Å; T939-Q951 PolarHBondContact N-O 3.41Å; T939-Q951 PolarHBondContact OG1-N 3.1Å; Q951-Q968 CarbonylContact C-O 3.54Å; Q951-Q968 WeakPolarHBondContact CA-O 3.38Å; Q951-T969 HydrophobicContact CG-CG2 4.11Å
952	R	89.4	Confident	77.7	Confident	60 Å²	60	80 Å²	80	23%	0.226	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	159	169.4	62.8	176.3	-171.7	175.9	-2.4	111.5	W935 S936 F938 Q967 Q968	W935-R952 HydrophobicContact CD2-CG 4.25Å; W935-R952 HydrophobicContact CE3-CB 4.32Å; W935-R952 HydrophobicContact CE3-CG 3.63Å; W935-R952 HydrophobicContact CZ3-CG 4.1Å; S936-R952 VanDerWaalsContact OG-CA 3.31Å; S936-R952 WeakPolarHBondContact OG-CA 3.3Å; S936-R952 WeakPolarHBondContact OG-CB 3.42Å; F938-R952 HydrophobicContact CD1-CB 3.99Å; F938-R952 HydrophobicContact CD1-CG 3.92Å; F938-R952 HydrophobicContact CE1-CB 4.19Å; F938-R952 HydrophobicContact CE1-CG 3.59Å; F938-R952 HydrophobicContact CE2-CG 4.33Å; F938-R952 HydrophobicContact CG-CB 4.32Å; F938-R952 HydrophobicContact CG-CG 4.42Å; F938-R952 VanDerWaalsContact CZ-CD 3.41Å; F938-R952 HydrophobicContact CZ-CG 3.8Å; R952-Q967 CarbonylContact O-C 3.55Å; R952-Q967 VanDerWaalsContact O-CA 3.31Å; R952-Q967 WeakPolarHBondContact O-CA 3.31Å; R952-Q968 HydrophobicContact CG-CB 3.99Å; R952-Q968 VanDerWaalsContact CZ-OE1 3.28Å; R952-Q968 PolarHBondContact N-O 3.22Å; R952-Q968 PolarHBondContact O-N 2.86Å
953	W	88.4	Confident	77.4	Confident	146 Å²	146	82.8 Å²	82.8	55%	0.553	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	162.3	-175.7	53.9	88.6	0	0	0	113.2	W935 S936 T939 S966	W935-W953 CarbonylContact C-O 3.49Å; W935-W953 WeakPolarHBondContact CA-O 3.42Å; S936-W953 PolarHBondContact N-O 3.11Å; S936-W953 PolarHBondContact OG-N 3.23Å; T939-W953 HydrophobicContact CG2-CZ3 4.08Å; W953-S966 CarbonylContact C-O 3.55Å; W953-S966 VanDerWaalsContact CA-O 3.27Å; W953-S966 WeakPolarHBondContact CA-O 3.5Å
954	R	84.4	Confident	77.5	Confident	46 Å²	46	83.2 Å²	83.2	17%	0.174	46%	0.464	C	S	.	.			trans	-147.8	150.1	171.8	55.9	175.2	-179.7	164.4	4.9	110.9	W932 W935 E965 S966	W932-R954 HydrophobicContact CD2-CG 4.16Å; W932-R954 HydrophobicContact CE3-CB 4.21Å; W932-R954 HydrophobicContact CE3-CG 3.57Å; W932-R954 HydrophobicContact CZ3-CG 3.98Å; W935-R954 HydrophobicContact CD2-CB 4.19Å; W935-R954 HydrophobicContact CD2-CG 3.97Å; W935-R954 HydrophobicContact CE3-CB 4.04Å; W935-R954 HydrophobicContact CE3-CG 3.79Å; W935-R954 HydrophobicContact CH2-CG 3.93Å; W935-R954 HydrophobicContact CZ2-CG 4.1Å; W935-R954 HydrophobicContact CZ3-CB 4.45Å; W935-R954 HydrophobicContact CZ3-CG 3.77Å; R954-E965 PolarHBondContact NE-O 2.9Å; R954-E965 PolarHBondContact NH2-O 2.87Å; R954-S966 PolarHBondContact N-O 2.9Å
955	V	79.4	Confident	77.9	Confident	88 Å²	88	83.2 Å²	83.2	53%	0.533	45%	0.454	S	S	.	.			trans	-103.6	143.6	-176.7	-176.3	0	0	0	0	109.8	S933	S933-V955 WeakPolarHBondContact CB-O 3.24Å; S933-V955 PolarHBondContact N-O 2.91Å; S933-V955 PolarHBondContact OG-N 2.88Å; S933-V955 PolarHBondContact OG-O 3.43Å
956	C	81.4	Confident	78.4	Confident	44 Å²	44	85.3 Å²	85.3	30%	0.297	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.2	171.7	-179.3	0	0	0	0	110.2	W932 Q960 C962	W932-C956 HydrophobicContact CE3-CB 4.31Å; W932-C956 HydrophobicContact CH2-CB 4.48Å; W932-C956 HydrophobicContact CZ3-CB 4.07Å; C956-Q960 PolarHBondContact SG-O 3.22Å; C956-C962 WeakPolarHBondContact CA-SG 3.28Å; C956-C962 HydrophobicContact CB-CB 3.67Å; C956-C962 WeakPolarHBondContact CB-SG 3.32Å; C956-C962 WeakPolarHBondContact SG-CB 3.3Å; C956-C962 PolarHBondContact SG-N 2.82Å; C956-C962 CovalentContact SG-SG 2.03Å; C956-C962 PolarHBondContact SG-SG 3.11Å
957	N	70.1	Confident	79	Confident	90 Å²	90	88.6 Å²	88.6	48%	0.481	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	94	178.2	-64.8	-21.8	0	0	0	109.5	S930 S931	S930-N957 WeakPolarHBondContact CA-O 3.41Å; S931-N957 PolarHBondContact N-O 2.95Å; S931-N957 WeakPolarHBondContact O-CA 3.32Å; S931-N957 WeakPolarHBondContact O-CB 3.44Å; S931-N957 PolarHBondContact O-N 3.45Å
958	G	65.5	Low	79.5	Confident	43 Å²	43	83 Å²	83	44%	0.443	45%	0.453	S	S	.	.	S	Bend	trans	164.5	-178	174.2	0	0	0	0	0	113.6	S930	S930-G958 WeakPolarHBondContact OG-CA 3.25Å
959	A	58.3	Low	79.8	Confident	90 Å²	90	86.2 Å²	86.2	74%	0.744	47%	0.472	S	S	*	.	S	Bend	trans	-89.2	-6.1	-174.9	0	0	0	0	0	114.6	S930	S930-A959 PolarHBondContact OG-N 3.36Å
960	Q	63.3	Low	79.7	Confident	158 Å²	158	86.6 Å²	86.6	74%	0.738	47%	0.471	S	S	*	.	S	Bend	trans	-130.3	160.9	-179.1	-69.2	-176.4	-11	0	0	111.6	S930 C956 C962	S930-Q960 WeakPolarHBondContact CB-O 3.33Å; S930-Q960 WeakPolarHBondContact OG-CA 3.38Å; S930-Q960 PolarHBondContact OG-N 2.84Å; S930-Q960 PolarHBondContact OG-O 3.21Å; C956-Q960 PolarHBondContact SG-O 3.22Å; Q960-C962 PolarHBondContact O-N 3.07Å
961	E	70	Confident	79.3	Confident	193 Å²	193	86.9 Å²	86.9	90%	0.902	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-59.8	127.6	-177.9	-133.1	171.7	-169.9	0	0	113
962	C	74.6	Confident	78.9	Confident	18 Å²	18	83.8 Å²	83.8	12%	0.122	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-82.8	134.9	176	-67	0	0	0	0	111	W932 C956 Q960 G964	W932-C962 HydrophobicContact CD2-CB 3.75Å; W932-C962 HydrophobicContact CE3-CB 4.26Å; W932-C962 HydrophobicContact CG-CB 4.24Å; W932-C962 HydrophobicContact CH2-CB 4Å; W932-C962 HydrophobicContact CZ2-CB 3.44Å; W932-C962 VanDerWaalsContact CZ2-CB 3.44Å; W932-C962 VanDerWaalsContact CZ2-O 3.26Å; W932-C962 WeakPolarHBondContact CZ2-O 3.44Å; W932-C962 HydrophobicContact CZ3-CB 4.38Å; C956-C962 WeakPolarHBondContact CA-SG 3.28Å; C956-C962 HydrophobicContact CB-CB 3.67Å; C956-C962 WeakPolarHBondContact CB-SG 3.32Å; C956-C962 WeakPolarHBondContact SG-CB 3.3Å; C956-C962 PolarHBondContact SG-N 2.82Å; C956-C962 CovalentContact SG-SG 2.03Å; C956-C962 PolarHBondContact SG-SG 3.11Å; Q960-C962 PolarHBondContact O-N 3.07Å; C962-G964 PolarHBondContact O-N 3.29Å
963	V	76.7	Confident	78	Confident	143 Å²	143	92.1 Å²	92.1	87%	0.867	51%	0.505	S	S	*	.	S	Bend	trans	-76.7	118.7	-179.3	-179	0	0	0	0	111.7	W932	W932-V963 PolarHBondContact NE1-O 3.2Å
964	G	77.6	Confident	77	Confident	49 Å²	49	88.4 Å²	88.4	51%	0.505	50%	0.495	S	S	.	.	S	Bend	trans	124.5	177.6	170	0	0	0	0	0	114.8	W932 C962 S966	W932-G964 WeakPolarHBondContact CZ2-O 3.47Å; C962-G964 PolarHBondContact O-N 3.29Å; G964-S966 PolarHBondContact O-N 3.19Å
965	E	82.5	Confident	76.2	Confident	140 Å²	140	97.1 Å²	97.1	65%	0.654	53%	0.528	S	S	*	.			trans	-62.8	130.2	-178.5	-66.7	-64.8	132.1	0	0	113	W935 R954 Q967	W935-E965 HydrophobicContact CH2-CB 4.46Å; W935-E965 WeakPolarHBondContact CH2-O 3.39Å; R954-E965 PolarHBondContact NE-O 2.9Å; R954-E965 PolarHBondContact NH2-O 2.87Å; E965-Q967 WeakPolarHBondContact CB-O 3.06Å
966	S	85.2	Confident	75.3	Confident	68 Å²	68	101.4 Å²	101.4	48%	0.476	54%	0.542	S	S	.	.	S	Bend	trans	-80.4	-17.1	170.4	56.2	0	0	0	0	113.2	W953 R954 G964	W953-S966 CarbonylContact C-O 3.55Å; W953-S966 VanDerWaalsContact CA-O 3.27Å; W953-S966 WeakPolarHBondContact CA-O 3.5Å; R954-S966 PolarHBondContact N-O 2.9Å; G964-S966 PolarHBondContact O-N 3.19Å
967	Q	86.8	Confident	74.2	Confident	91 Å²	91	102.1 Å²	102.1	43%	0.425	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	147.4	-179.6	-177.4	173.5	-14.1	0	0	110.3	R952 E965	R952-Q967 CarbonylContact O-C 3.55Å; R952-Q967 VanDerWaalsContact O-CA 3.31Å; R952-Q967 WeakPolarHBondContact O-CA 3.31Å; E965-Q967 WeakPolarHBondContact CB-O 3.06Å
968	Q	88.3	Confident	73.6	Confident	68 Å²	68	103.1 Å²	103.1	32%	0.318	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.4	127.5	173.5	-172.8	178.4	22.7	0	0	111.1	W935 Q951 R952 I970	W935-Q968 HydrophobicContact CH2-CB 3.72Å; W935-Q968 HydrophobicContact CZ2-CB 4.36Å; W935-Q968 HydrophobicContact CZ3-CB 3.87Å; Q951-Q968 CarbonylContact C-O 3.54Å; Q951-Q968 WeakPolarHBondContact CA-O 3.38Å; R952-Q968 HydrophobicContact CG-CB 3.99Å; R952-Q968 VanDerWaalsContact CZ-OE1 3.28Å; R952-Q968 PolarHBondContact N-O 3.22Å; R952-Q968 PolarHBondContact O-N 2.86Å; Q968-I970 HydrophobicContact CG-CG1 4.22Å
969	T	89.3	Confident	72.7	Confident	71 Å²	71	104.3 Å²	104.3	44%	0.436	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.5	134.8	175	-54.8	0	0	0	0	109.5	V949 K950 Q951	V949-T969 HydrophobicContact CB-CG2 3.8Å; V949-T969 HydrophobicContact CG1-CG2 4.1Å; V949-T969 HydrophobicContact CG2-CG2 4.29Å; K950-T969 WeakPolarHBondContact O-CA 3.34Å; Q951-T969 HydrophobicContact CG-CG2 4.11Å
970	I	84.3	Confident	71.9	Confident	68 Å²	68	103.4 Å²	103.4	35%	0.349	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.9	140.1	176.6	-58.5	-172.1	0	0	0	109.4	F938 V949 K950 Q968	F938-I970 HydrophobicContact CE1-CB 4.3Å; F938-I970 HydrophobicContact CE1-CD1 4.06Å; F938-I970 HydrophobicContact CE1-CG1 3.96Å; F938-I970 HydrophobicContact CE2-CD1 4.28Å; F938-I970 HydrophobicContact CZ-CB 4.49Å; F938-I970 HydrophobicContact CZ-CD1 3.44Å; F938-I970 VanDerWaalsContact CZ-CD1 3.44Å; F938-I970 HydrophobicContact CZ-CG1 3.87Å; V949-I970 WeakPolarHBondContact CA-O 3.24Å; K950-I970 PolarHBondContact N-O 3.04Å; K950-I970 PolarHBondContact O-N 3.3Å; Q968-I970 HydrophobicContact CG-CG1 4.22Å
971	A	82.2	Confident	70.5	Confident	75 Å²	75	105.1 Å²	105.1	62%	0.62	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68.9	136.7	174.4	0	0	0	0	0	112.4	A948	A948-A971 CarbonylContact O-C 3.59Å; A948-A971 WeakPolarHBondContact O-CA 3.31Å
972	C	78.7	Confident	69.1	Low	11 Å²	11	101.2 Å²	101.2	7%	0.074	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.2	120	164.7	-58.3	0	0	0	0	108.7	C941 A948 L974	C941-C972 HydrophobicContact CB-CB 3.76Å; C941-C972 WeakPolarHBondContact CB-SG 3.17Å; C941-C972 WeakPolarHBondContact SG-CB 3.33Å; C941-C972 CovalentContact SG-SG 2.04Å; C941-C972 PolarHBondContact SG-SG 2.9Å; A948-C972 HydrophobicContact CB-CB 4.11Å; A948-C972 PolarHBondContact N-O 3.08Å; A948-C972 PolarHBondContact O-N 2.92Å; C972-L974 HydrophobicContact CB-CG 4.25Å
973	R	71	Confident	67.4	Low	235 Å²	235	104.7 Å²	104.7	89%	0.887	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.7	107.7	160.3	-81.7	-174.3	179.1	162.8	0.6	108.5
974	L	67.4	Low	66.2	Low	67 Å²	67	100.8 Å²	100.8	35%	0.351	55%	0.554	S	S	.	*			trans	-98.4	175.1	170.9	-61.1	170.4	0	0	0	109.2	C941 A943 G946 A948 C972	C941-L974 HydrophobicContact CB-CD1 4.1Å; A943-L974 WeakPolarHBondContact O-CD1 3.44Å; G946-L974 PolarHBondContact O-N 3.36Å; A948-L974 HydrophobicContact CB-CD1 3.96Å; C972-L974 HydrophobicContact CB-CG 4.25Å
975	R	67.1	Low	64.9	Low	230 Å²	230	102.2 Å²	102.2	87%	0.868	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-55.8	146.3	163.8	-91.5	-177.4	167.4	176	-5.1	108.5	C945 G946 C977	C945-R975 CarbonylContact C-O 3.51Å; C945-R975 WeakPolarHBondContact CA-O 3.38Å; C945-R975 WeakPolarHBondContact CB-O 3.48Å; G946-R975 PolarHBondContact N-O 2.99Å; R975-C977 PolarHBondContact O-N 2.99Å
976	E	60.1	Low	64.3	Low	177 Å²	177	100 Å²	100	83%	0.827	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-48.8	137.7	168	-69.9	170.8	167.2	0	0	109.1
977	C	58.3	Low	63.6	Low	60 Å²	60	98.3 Å²	98.3	41%	0.405	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-58.3	138.4	173.9	-72.2	0	0	0	0	108.8	C945 R975 A979	C945-C977 VanDerWaalsContact CB-CA 3.47Å; C945-C977 HydrophobicContact CB-CB 3.8Å; C945-C977 WeakPolarHBondContact CB-SG 3.37Å; C945-C977 PolarHBondContact O-SG 3.4Å; C945-C977 WeakPolarHBondContact SG-CA 3.49Å; C945-C977 WeakPolarHBondContact SG-CB 3.49Å; C945-C977 CovalentContact SG-SG 2.03Å; C945-C977 PolarHBondContact SG-SG 3.43Å; R975-C977 PolarHBondContact O-N 2.99Å; C977-A979 PolarHBondContact O-N 3.21Å
978	P	58.5	Low	63	Low	111 Å²	111	98.3 Å²	98.3	72%	0.721	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-54.3	116.1	159.7	25.8	-31.3	0	0	0	106	G980	P978-G980 WeakPolarHBondContact O-CA 3.33Å; P978-G980 PolarHBondContact O-N 2.95Å
979	A	46.8	Very low	62.6	Low	68 Å²	68	98.3 Å²	98.3	56%	0.562	54%	0.54	S	S	*	.			trans	-54.7	112.3	178.9	0	0	0	0	0	106.8	C977 E981 E982	C977-A979 PolarHBondContact O-N 3.21Å; A979-E981 PolarHBondContact O-N 2.85Å; A979-E982 HydrophobicContact CB-CG 4.31Å; A979-E982 PolarHBondContact O-N 3.09Å
980	G	41.3	Very low	61.8	Low	71 Å²	71	97.4 Å²	97.4	73%	0.732	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	99.8	-155.7	0	0	0	0	0	111.2	P978 E982	P978-G980 WeakPolarHBondContact O-CA 3.33Å; P978-G980 PolarHBondContact O-N 2.95Å; G980-E982 PolarHBondContact O-N 2.88Å
981	E	34.8	Very low	61.3	Low	193 Å²	193	103.4 Å²	103.4	90%	0.902	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	27	56.7	-170.7	-68.8	-174.2	130	0	0	113	A979 S983	A979-E981 PolarHBondContact O-N 2.85Å; E981-S983 PolarHBondContact O-N 3.26Å
982	E	38.7	Very low	60.8	Low	111 Å²	111	102.8 Å²	102.8	52%	0.519	55%	0.551	S	S	.	*			trans	-65.5	93.1	169.5	-77.1	-162	-179.5	0	0	107.7	A979 G980 T984	A979-E982 HydrophobicContact CB-CG 4.31Å; A979-E982 PolarHBondContact O-N 3.09Å; G980-E982 PolarHBondContact O-N 2.88Å; E982-T984 PolarHBondContact O-N 3Å
983	S	40.8	Very low	60	Low	91 Å²	91	105.8 Å²	105.8	64%	0.636	57%	0.566	S	S	*	*			trans	-44.6	99.2	-168	-178.3	0	0	0	0	110.9	E981 T985	E981-S983 PolarHBondContact O-N 3.26Å; S983-T985 PolarHBondContact O-N 3.15Å
984	T	50.1	Low	59.3	Low	61 Å²	61	104.2 Å²	104.2	37%	0.374	57%	0.569	S	S	.	*			trans	-70.1	100.6	175.3	40	0	0	0	0	107.4	E982 Q1002	E982-T984 PolarHBondContact O-N 3Å; T984-Q1002 VanDerWaalsContact CB-NE2 3.27Å; T984-Q1002 HydrophobicContact CG2-CG 4.03Å; T984-Q1002 PolarHBondContact OG1-NE2 2.98Å
985	T	51.3	Low	58.4	Low	79 Å²	79	103.1 Å²	103.1	49%	0.485	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.5	125.7	179.5	49.6	0	0	0	0	108.5	S983 V1003	S983-T985 PolarHBondContact O-N 3.15Å; T985-V1003 PolarHBondContact N-O 3.24Å; T985-V1003 WeakPolarHBondContact O-CA 3.47Å; T985-V1003 WeakPolarHBondContact O-CB 3.43Å; T985-V1003 PolarHBondContact O-N 3.49Å
986	W	68.9	Low	58.2	Low	94 Å²	94	96.7 Å²	96.7	36%	0.356	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	140	167.7	-71.6	101	0	0	0	109.8	R1000 Q1002 E1017	W986-R1000 HydrophobicContact CD2-CG 4.2Å; W986-R1000 HydrophobicContact CE3-CB 4.4Å; W986-R1000 HydrophobicContact CE3-CG 3.62Å; W986-R1000 VanDerWaalsContact CG-CZ 3.49Å; W986-R1000 HydrophobicContact CZ3-CG 4.19Å; W986-Q1002 HydrophobicContact CE3-CB 4.29Å; W986-Q1002 HydrophobicContact CZ3-CB 4.14Å; W986-E1017 HydrophobicContact CE3-CB 4.46Å; W986-E1017 HydrophobicContact CH2-CB 3.81Å; W986-E1017 HydrophobicContact CZ2-CB 4.49Å; W986-E1017 HydrophobicContact CZ3-CB 3.79Å
987	S	70.9	Confident	58.1	Low	33 Å²	33	89.1 Å²	89.1	23%	0.231	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-56.6	159.7	168.5	76.7	0	0	0	0	110.3	W989 R1000 M1001	S987-W989 PolarHBondContact O-N 3.12Å; S987-R1000 WeakPolarHBondContact OG-CA 3.39Å; S987-R1000 WeakPolarHBondContact OG-CB 3.4Å; S987-M1001 WeakPolarHBondContact CB-O 3.03Å; S987-M1001 PolarHBondContact N-O 2.8Å; S987-M1001 PolarHBondContact OG-N 2.89Å
988	A	74.6	Confident	58.9	Low	91 Å²	91	88.3 Å²	88.3	75%	0.752	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-51	142.5	158.6	0	0	0	0	0	109.3
989	W	79.7	Confident	59.3	Low	67 Å²	67	85.3 Å²	85.3	25%	0.254	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-58.9	140.2	172	-72.8	106.5	0	0	0	110	S987 R998 R1000 E1017 Q1019	S987-W989 PolarHBondContact O-N 3.12Å; W989-R998 HydrophobicContact CB-CB 4.4Å; W989-R998 HydrophobicContact CB-CG 4.42Å; W989-R998 HydrophobicContact CD2-CG 3.89Å; W989-R998 HydrophobicContact CE3-CB 3.99Å; W989-R998 HydrophobicContact CE3-CG 3.52Å; W989-R998 HydrophobicContact CG-CG 4.31Å; W989-R998 HydrophobicContact CZ3-CG 4.05Å; W989-R998 WeakPolarHBondContact CZ3-O 3.45Å; W989-R1000 HydrophobicContact CD2-CB 4.1Å; W989-R1000 HydrophobicContact CD2-CG 4.04Å; W989-R1000 VanDerWaalsContact CE2-CD 3.49Å; W989-R1000 HydrophobicContact CE3-CB 3.79Å; W989-R1000 HydrophobicContact CE3-CG 3.72Å; W989-R1000 HydrophobicContact CH2-CG 3.76Å; W989-R1000 VanDerWaalsContact CZ2-CD 3.48Å; W989-R1000 HydrophobicContact CZ2-CG 4.09Å; W989-R1000 HydrophobicContact CZ3-CB 4.14Å; W989-R1000 HydrophobicContact CZ3-CG 3.59Å; W989-E1017 HydrophobicContact CH2-CB 4.31Å; W989-E1017 HydrophobicContact CH2-CG 3.93Å; W989-E1017 WeakPolarHBondContact CZ3-O 3.49Å; W989-Q1019 HydrophobicContact CH2-CB 3.38Å; W989-Q1019 HydrophobicContact CH2-CG 4.34Å; W989-Q1019 HydrophobicContact CZ2-CB 4.03Å; W989-Q1019 VanDerWaalsContact CZ2-OE1 3.27Å; W989-Q1019 HydrophobicContact CZ3-CB 3.71Å
990	S	72.4	Confident	60.8	Low	53 Å²	53	84.9 Å²	84.9	37%	0.371	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-57	159.3	164.4	78.8	0	0	0	0	109.9	R998 V999	S990-R998 WeakPolarHBondContact O-CB 3.3Å; S990-V999 WeakPolarHBondContact CB-O 3.48Å; S990-V999 PolarHBondContact N-O 3.01Å; S990-V999 PolarHBondContact OG-N 3.41Å; S990-V999 PolarHBondContact OG-O 3.11Å
991	K	74.8	Confident	62	Low	194 Å²	194	85.8 Å²	85.8	84%	0.843	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-56	149.1	160.6	-64.5	-167.4	175.4	-165.5	0	109.4	N993	K991-N993 PolarHBondContact O-N 3.36Å
992	C	71.2	Confident	63.3	Low	62 Å²	62	78.9 Å²	78.9	42%	0.419	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-56.9	127.6	170.5	-52.6	0	0	0	0	108.8	L997 C1021	C992-L997 WeakPolarHBondContact CA-O 3.48Å; C992-C1021 HydrophobicContact CB-CB 4.12Å; C992-C1021 WeakPolarHBondContact CB-SG 3.44Å; C992-C1021 WeakPolarHBondContact SG-CB 3.06Å; C992-C1021 CovalentContact SG-SG 2.03Å; C992-C1021 PolarHBondContact SG-SG 3.1Å
993	N	60.5	Low	64.4	Low	74 Å²	74	76 Å²	76	40%	0.396	41%	0.407	S	S	.	.			trans	-78.5	178.6	169.7	70.3	13.2	0	0	0	110.5	K991 L995 N996 L997	K991-N993 PolarHBondContact O-N 3.36Å; N993-L995 PolarHBondContact O-N 2.04Å; N993-L995 WeakPolarHBondContact OD1-CA 3.33Å; N993-L995 WeakPolarHBondContact OD1-CB 3.14Å; N993-L995 PolarHBondContact OD1-N 2.98Å; N993-N996 WeakPolarHBondContact O-CA 3.24Å; N993-N996 PolarHBondContact O-N 3.02Å; N993-L997 VanDerWaalsContact CG-O 3.25Å; N993-L997 PolarHBondContact N-O 3.31Å; N993-L997 WeakPolarHBondContact OD1-CB 3.41Å; N993-L997 PolarHBondContact OD1-N 3.4Å; N993-L997 PolarHBondContact OD1-O 3.25Å
994	E	56.9	Low	65.3	Low	202 Å²	202	73.2 Å²	73.2	94%	0.944	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-17.8	-179	-62.4	169.8	-150.3	0	0	113.6	N996	E994-N996 VanDerWaalsContact C-N 3.29Å
995	L	48.1	Very low	65.6	Low	43 Å²	43	74 Å²	74	23%	0.225	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	7.1	175.2	-53	-172.9	0	0	0	113.4	L353 N993 L997	L353-L995 HydrophobicContact CD1-CD1 3.86Å; N993-L995 PolarHBondContact O-N 2.04Å; N993-L995 WeakPolarHBondContact OD1-CA 3.33Å; N993-L995 WeakPolarHBondContact OD1-CB 3.14Å; N993-L995 PolarHBondContact OD1-N 2.98Å; L995-L997 HydrophobicContact CB-CD1 3.96Å; L995-L997 HydrophobicContact CB-CG 4.04Å; L995-L997 HydrophobicContact CD1-CD1 4.29Å; L995-L997 PolarHBondContact O-N 3.43Å
996	N	63.8	Low	65.9	Low	95 Å²	95	76 Å²	76	51%	0.508	40%	0.401	S	S	.	.	S	Bend	trans	58.7	32.4	-172.3	-131.5	-7.2	0	0	0	112.5	N993 E994 R1020 C1021	N993-N996 WeakPolarHBondContact O-CA 3.24Å; N993-N996 PolarHBondContact O-N 3.02Å; E994-N996 VanDerWaalsContact C-N 3.29Å; N996-R1020 CarbonylContact O-C 3.46Å; N996-R1020 WeakPolarHBondContact O-CA 3.03Å; N996-C1021 PolarHBondContact O-N 3.09Å
997	L	58.1	Low	65	Low	19 Å²	19	78.4 Å²	78.4	10%	0.099	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	137.1	176.5	-59.8	171.8	0	0	0	110.2	C992 N993 L995 I1018 Q1019 R1020	C992-L997 WeakPolarHBondContact CA-O 3.48Å; N993-L997 VanDerWaalsContact CG-O 3.25Å; N993-L997 PolarHBondContact N-O 3.31Å; N993-L997 WeakPolarHBondContact OD1-CB 3.41Å; N993-L997 PolarHBondContact OD1-N 3.4Å; N993-L997 PolarHBondContact OD1-O 3.25Å; L995-L997 HydrophobicContact CB-CD1 3.96Å; L995-L997 HydrophobicContact CB-CG 4.04Å; L995-L997 HydrophobicContact CD1-CD1 4.29Å; L995-L997 PolarHBondContact O-N 3.43Å; L997-I1018 HydrophobicContact CB-CG2 4.16Å; L997-I1018 HydrophobicContact CD1-CG2 4.28Å; L997-I1018 HydrophobicContact CD2-CG2 4.26Å; L997-I1018 HydrophobicContact CG-CG2 4.47Å; L997-Q1019 CarbonylContact C-O 3.53Å; L997-Q1019 WeakPolarHBondContact CA-O 3.36Å; L997-R1020 HydrophobicContact CD2-CB 4.47Å; L997-R1020 HydrophobicContact CD2-CG 3.6Å
998	R	75.3	Confident	64	Low	42 Å²	42	84.1 Å²	84.1	16%	0.158	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.6	168.7	56.6	-178.7	-165.1	-157.6	-3.2	109.9	W989 S990 I1018 Q1019 D1025	W989-R998 HydrophobicContact CB-CB 4.4Å; W989-R998 HydrophobicContact CB-CG 4.42Å; W989-R998 HydrophobicContact CD2-CG 3.89Å; W989-R998 HydrophobicContact CE3-CB 3.99Å; W989-R998 HydrophobicContact CE3-CG 3.52Å; W989-R998 HydrophobicContact CG-CG 4.31Å; W989-R998 HydrophobicContact CZ3-CG 4.05Å; W989-R998 WeakPolarHBondContact CZ3-O 3.45Å; S990-R998 WeakPolarHBondContact O-CB 3.3Å; R998-I1018 WeakPolarHBondContact O-CA 3.27Å; R998-Q1019 HydrophobicContact CG-CB 4.38Å; R998-Q1019 PolarHBondContact N-O 3.34Å; R998-Q1019 PolarHBondContact O-N 2.95Å; R998-D1025 IonicContact CZ-OD2 3.62Å; R998-D1025 IonicContact NH1-OD2 3.14Å; R998-D1025 PolarHBondContact NH1-OD2 2.72Å; R998-D1025 IonicContact NH2-OD2 2.8Å
999	V	66.5	Low	62.6	Low	49 Å²	49	85.1 Å²	85.1	30%	0.297	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	139.7	-178.2	-172.9	0	0	0	0	109.4	S990 F1016 E1017 I1018	S990-V999 WeakPolarHBondContact CB-O 3.48Å; S990-V999 PolarHBondContact N-O 3.01Å; S990-V999 PolarHBondContact OG-N 3.41Å; S990-V999 PolarHBondContact OG-O 3.11Å; V999-F1016 HydrophobicContact CG1-CB 4.39Å; V999-F1016 HydrophobicContact CG1-CD1 4.47Å; V999-E1017 CarbonylContact C-O 3.58Å; V999-E1017 VanDerWaalsContact CA-O 3.31Å; V999-E1017 WeakPolarHBondContact CA-O 3.49Å; V999-I1018 HydrophobicContact CG1-CG1 4.39Å; V999-I1018 HydrophobicContact CG2-CG1 4.18Å; V999-I1018 HydrophobicContact CG2-CG2 4.4Å
1000	R	78.2	Confident	61.3	Low	58 Å²	58	83.5 Å²	83.5	22%	0.219	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	153.4	165.8	63.4	-176.9	-170.6	171	-4.2	110.1	W986 S987 W989 F1016 E1017	W986-R1000 HydrophobicContact CD2-CG 4.2Å; W986-R1000 HydrophobicContact CE3-CB 4.4Å; W986-R1000 HydrophobicContact CE3-CG 3.62Å; W986-R1000 VanDerWaalsContact CG-CZ 3.49Å; W986-R1000 HydrophobicContact CZ3-CG 4.19Å; S987-R1000 WeakPolarHBondContact OG-CA 3.39Å; S987-R1000 WeakPolarHBondContact OG-CB 3.4Å; W989-R1000 HydrophobicContact CD2-CB 4.1Å; W989-R1000 HydrophobicContact CD2-CG 4.04Å; W989-R1000 VanDerWaalsContact CE2-CD 3.49Å; W989-R1000 HydrophobicContact CE3-CB 3.79Å; W989-R1000 HydrophobicContact CE3-CG 3.72Å; W989-R1000 HydrophobicContact CH2-CG 3.76Å; W989-R1000 VanDerWaalsContact CZ2-CD 3.48Å; W989-R1000 HydrophobicContact CZ2-CG 4.09Å; W989-R1000 HydrophobicContact CZ3-CB 4.14Å; W989-R1000 HydrophobicContact CZ3-CG 3.59Å; R1000-F1016 WeakPolarHBondContact O-CA 3.2Å; R1000-E1017 HydrophobicContact CG-CB 3.93Å; R1000-E1017 IonicContact CZ-OE2 2.75Å; R1000-E1017 PolarHBondContact N-O 3.35Å; R1000-E1017 IonicContact NE-OE2 3.62Å; R1000-E1017 PolarHBondContact NE-OE2 2.96Å; R1000-E1017 IonicContact NH2-OE1 3.16Å; R1000-E1017 IonicContact NH2-OE2 3.24Å; R1000-E1017 PolarHBondContact NH2-OE2 3.33Å; R1000-E1017 PolarHBondContact O-N 3.35Å
1001	M	66.1	Low	60	Low	91 Å²	91	83.5 Å²	83.5	45%	0.448	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	150.6	178	59.4	-178.1	62.2	0	0	110.1	S987 V1003 D1015 F1016	S987-M1001 WeakPolarHBondContact CB-O 3.03Å; S987-M1001 PolarHBondContact N-O 2.8Å; S987-M1001 PolarHBondContact OG-N 2.89Å; M1001-V1003 HydrophobicContact CG-CG2 4.18Å; M1001-V1003 PolarHBondContact O-N 3.29Å; M1001-D1015 WeakPolarHBondContact CA-O 3.13Å; M1001-F1016 HydrophobicContact CB-CD1 4.01Å; M1001-F1016 HydrophobicContact CB-CE1 4.27Å; M1001-F1016 HydrophobicContact CE-CE1 4.38Å
1002	Q	62.6	Low	58.8	Low	47 Å²	47	82.8 Å²	82.8	22%	0.22	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	122.6	173.4	-163.5	172.8	24.7	0	0	109.5	T984 W986 D1015	T984-Q1002 VanDerWaalsContact CB-NE2 3.27Å; T984-Q1002 HydrophobicContact CG2-CG 4.03Å; T984-Q1002 PolarHBondContact OG1-NE2 2.98Å; W986-Q1002 HydrophobicContact CE3-CB 4.29Å; W986-Q1002 HydrophobicContact CZ3-CB 4.14Å; Q1002-D1015 HydrophobicContact CB-CB 4.34Å; Q1002-D1015 PolarHBondContact N-O 3.08Å
1003	V	61	Low	57.5	Low	50 Å²	50	85.5 Å²	85.5	30%	0.303	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119	-176.8	-172.1	0	0	0	0	109.9	T985 M1001	T985-V1003 PolarHBondContact N-O 3.24Å; T985-V1003 WeakPolarHBondContact O-CA 3.47Å; T985-V1003 WeakPolarHBondContact O-CB 3.43Å; T985-V1003 PolarHBondContact O-N 3.49Å; M1001-V1003 HydrophobicContact CG-CG2 4.18Å; M1001-V1003 PolarHBondContact O-N 3.29Å
1004	C	60.9	Low	57.1	Low	33 Å²	33	84 Å²	84	22%	0.223	45%	0.45	C	S	.	.			trans	-77.2	145.6	171.8	-69.7	0	0	0	0	110.8	N1006 M1007 C1010	C1004-N1006 PolarHBondContact O-N 3.26Å; C1004-M1007 PolarHBondContact O-N 3.37Å; C1004-C1010 HydrophobicContact CB-CB 4.48Å; C1004-C1010 WeakPolarHBondContact CB-SG 3.47Å; C1004-C1010 PolarHBondContact N-SG 3.24Å; C1004-C1010 WeakPolarHBondContact SG-CB 3.43Å; C1004-C1010 CovalentContact SG-SG 2.04Å; C1004-C1010 PolarHBondContact SG-SG 3.26Å
1005	P	56.7	Low	57.1	Low	79 Å²	79	79 Å²	79	51%	0.513	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-17.5	-171.2	20.2	-32.3	0	0	0	115.6
1006	N	57.2	Low	57.7	Low	119 Å²	119	80.9 Å²	80.9	64%	0.636	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	5	-175.9	-63.5	-23.1	0	0	0	114.8	C1004 E1008	C1004-N1006 PolarHBondContact O-N 3.26Å; N1006-E1008 PolarHBondContact O-N 3.21Å
1007	M	49.8	Very low	57.9	Low	145 Å²	145	79.3 Å²	79.3	71%	0.714	43%	0.426	S	S	*	.	S	Bend	trans	58	5.5	-172.5	-70.4	-172	-75.6	0	0	115.9	C1004 M1036	C1004-M1007 PolarHBondContact O-N 3.37Å; M1007-M1036 HydrophobicContact CE-CE 3.95Å; M1007-M1036 HydrophobicContact CE-SD 4.07Å
1008	E	48.9	Very low	58.3	Low	154 Å²	154	81 Å²	81	72%	0.72	44%	0.435	S	S	*	.	S	Bend	trans	-85.8	153	168.6	-66.7	-174.2	143.9	0	0	110.8	N1006 C1010	N1006-E1008 PolarHBondContact O-N 3.21Å; E1008-C1010 PolarHBondContact O-N 3.21Å
1009	V	46.2	Very low	58	Low	111 Å²	111	82.7 Å²	82.7	67%	0.673	45%	0.445	S	S	*	.			trans	-69.2	126.8	-169.2	-165.2	0	0	0	0	110.7	G1011	V1009-G1011 VanDerWaalsContact C-N 3.31Å; V1009-G1011 VanDerWaalsContact CG1-O 3.25Å; V1009-G1011 WeakPolarHBondContact CG1-O 3.2Å; V1009-G1011 PolarHBondContact O-N 3.42Å
1010	C	51	Low	57.6	Low	34 Å²	34	85.2 Å²	85.2	23%	0.23	45%	0.449	C	S	.	.	S	Bend	trans	-71.2	81.3	175.3	-47.4	0	0	0	0	110.6	C1004 E1008	C1004-C1010 HydrophobicContact CB-CB 4.48Å; C1004-C1010 WeakPolarHBondContact CB-SG 3.47Å; C1004-C1010 PolarHBondContact N-SG 3.24Å; C1004-C1010 WeakPolarHBondContact SG-CB 3.43Å; C1004-C1010 CovalentContact SG-SG 2.04Å; C1004-C1010 PolarHBondContact SG-SG 3.26Å; E1008-C1010 PolarHBondContact O-N 3.21Å
1011	G	47.1	Very low	57.3	Low	52 Å²	52	83.2 Å²	83.2	54%	0.536	44%	0.443	S	S	.	.	S	Bend	trans	75.6	-178	-177.3	0	0	0	0	0	114.3	V1009 E1013	V1009-G1011 VanDerWaalsContact C-N 3.31Å; V1009-G1011 VanDerWaalsContact CG1-O 3.25Å; V1009-G1011 WeakPolarHBondContact CG1-O 3.2Å; V1009-G1011 PolarHBondContact O-N 3.42Å; G1011-E1013 VanDerWaalsContact C-N 3.3Å; G1011-E1013 PolarHBondContact O-N 2.96Å
1012	D	48.5	Very low	56.8	Low	180 Å²	180	80.9 Å²	80.9	96%	0.963	44%	0.443	S	S	*	.	S	Bend	trans	-73	-17	-173.9	-70.9	-43.9	0	0	0	114.1
1013	E	43.6	Very low	56.2	Low	119 Å²	119	87.4 Å²	87.4	56%	0.556	48%	0.478	S	S	*	.	S	Bend	trans	-133.7	122.4	166.5	-69.8	-163.6	147.9	0	0	109.6	R463 G1011	R463-E1013 IonicContact NH1-OE2 2.69Å; R463-E1013 PolarHBondContact NH1-OE2 3.41Å; G1011-E1013 VanDerWaalsContact C-N 3.3Å; G1011-E1013 PolarHBondContact O-N 2.96Å
1014	P	53.2	Low	55.7	Low	42 Å²	42	88.2 Å²	88.2	27%	0.273	50%	0.495	S	S	.	.			trans	-72.6	137.7	172.5	28.8	-32.7	0	0	0	111.1	F1016	P1014-F1016 HydrophobicContact CG-CE1 4.31Å; P1014-F1016 HydrophobicContact CG-CE2 4.18Å; P1014-F1016 HydrophobicContact CG-CZ 3.74Å; P1014-F1016 WeakPolarHBondContact O-CD2 3.37Å; P1014-F1016 WeakPolarHBondContact O-CE2 3.46Å
1015	D	55.4	Low	54.8	Low	98 Å²	98	91.7 Å²	91.7	52%	0.524	51%	0.512	S	S	.	.			trans	-69.5	133.8	176	-94.9	-37.5	0	0	0	111.7	M1001 Q1002	M1001-D1015 WeakPolarHBondContact CA-O 3.13Å; Q1002-D1015 HydrophobicContact CB-CB 4.34Å; Q1002-D1015 PolarHBondContact N-O 3.08Å
1016	F	61.7	Low	54.1	Low	81 Å²	81	96.4 Å²	96.4	36%	0.355	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	141	178.8	-53.5	-83.1	0	0	0	111.1	A349 V999 R1000 M1001 P1014	A349-F1016 WeakPolarHBondContact O-CD2 3.35Å; A349-F1016 WeakPolarHBondContact O-CE2 3.36Å; V999-F1016 HydrophobicContact CG1-CB 4.39Å; V999-F1016 HydrophobicContact CG1-CD1 4.47Å; R1000-F1016 WeakPolarHBondContact O-CA 3.2Å; M1001-F1016 HydrophobicContact CB-CD1 4.01Å; M1001-F1016 HydrophobicContact CB-CE1 4.27Å; M1001-F1016 HydrophobicContact CE-CE1 4.38Å; P1014-F1016 HydrophobicContact CG-CE1 4.31Å; P1014-F1016 HydrophobicContact CG-CE2 4.18Å; P1014-F1016 HydrophobicContact CG-CZ 3.74Å; P1014-F1016 WeakPolarHBondContact O-CD2 3.37Å; P1014-F1016 WeakPolarHBondContact O-CE2 3.46Å
1017	E	68.6	Low	53.1	Low	62 Å²	62	98.1 Å²	98.1	29%	0.29	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	132	169.5	-169.9	-173.4	156.9	0	0	110	W986 W989 V999 R1000	W986-E1017 HydrophobicContact CE3-CB 4.46Å; W986-E1017 HydrophobicContact CH2-CB 3.81Å; W986-E1017 HydrophobicContact CZ2-CB 4.49Å; W986-E1017 HydrophobicContact CZ3-CB 3.79Å; W989-E1017 HydrophobicContact CH2-CB 4.31Å; W989-E1017 HydrophobicContact CH2-CG 3.93Å; W989-E1017 WeakPolarHBondContact CZ3-O 3.49Å; V999-E1017 CarbonylContact C-O 3.58Å; V999-E1017 VanDerWaalsContact CA-O 3.31Å; V999-E1017 WeakPolarHBondContact CA-O 3.49Å; R1000-E1017 HydrophobicContact CG-CB 3.93Å; R1000-E1017 IonicContact CZ-OE2 2.75Å; R1000-E1017 PolarHBondContact N-O 3.35Å; R1000-E1017 IonicContact NE-OE2 3.62Å; R1000-E1017 PolarHBondContact NE-OE2 2.96Å; R1000-E1017 IonicContact NH2-OE1 3.16Å; R1000-E1017 IonicContact NH2-OE2 3.24Å; R1000-E1017 PolarHBondContact NH2-OE2 3.33Å; R1000-E1017 PolarHBondContact O-N 3.35Å
1018	I	65.7	Low	52.5	Low	55 Å²	55	98.2 Å²	98.2	28%	0.282	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.6	179	-50.9	-179.9	0	0	0	108.6	I347 L997 R998 V999	I347-I1018 HydrophobicContact CD1-CD1 4.3Å; L997-I1018 HydrophobicContact CB-CG2 4.16Å; L997-I1018 HydrophobicContact CD1-CG2 4.28Å; L997-I1018 HydrophobicContact CD2-CG2 4.26Å; L997-I1018 HydrophobicContact CG-CG2 4.47Å; R998-I1018 WeakPolarHBondContact O-CA 3.27Å; V999-I1018 HydrophobicContact CG1-CG1 4.39Å; V999-I1018 HydrophobicContact CG2-CG1 4.18Å; V999-I1018 HydrophobicContact CG2-CG2 4.4Å
1019	Q	69.6	Low	51.7	Low	78 Å²	78	100.4 Å²	100.4	36%	0.364	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128	145.8	-179.3	-164.9	-173.9	38.5	0	0	110.7	W989 L997 R998	W989-Q1019 HydrophobicContact CH2-CB 3.38Å; W989-Q1019 HydrophobicContact CH2-CG 4.34Å; W989-Q1019 HydrophobicContact CZ2-CB 4.03Å; W989-Q1019 VanDerWaalsContact CZ2-OE1 3.27Å; W989-Q1019 HydrophobicContact CZ3-CB 3.71Å; L997-Q1019 CarbonylContact C-O 3.53Å; L997-Q1019 WeakPolarHBondContact CA-O 3.36Å; R998-Q1019 HydrophobicContact CG-CB 4.38Å; R998-Q1019 PolarHBondContact N-O 3.34Å; R998-Q1019 PolarHBondContact O-N 2.95Å
1020	R	57.6	Low	50.9	Low	102 Å²	102	98.6 Å²	98.6	39%	0.385	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70	138.2	165.8	-81.2	-174.9	176.8	-139.3	-8.2	110.3	E454 N996 L997	E454-R1020 PolarHBondContact O-NH1 2.88Å; E454-R1020 PolarHBondContact O-NH2 2.93Å; N996-R1020 CarbonylContact O-C 3.46Å; N996-R1020 WeakPolarHBondContact O-CA 3.03Å; L997-R1020 HydrophobicContact CD2-CB 4.47Å; L997-R1020 HydrophobicContact CD2-CG 3.6Å
1021	C	71.7	Confident	50.1	Low	15 Å²	15	104.2 Å²	104.2	10%	0.101	59%	0.591	C	S	.	*	P	Polyproline II helix	trans	-67.4	137.2	171.8	-62.7	0	0	0	0	110.7	C992 N996	C992-C1021 HydrophobicContact CB-CB 4.12Å; C992-C1021 WeakPolarHBondContact CB-SG 3.44Å; C992-C1021 WeakPolarHBondContact SG-CB 3.06Å; C992-C1021 CovalentContact SG-SG 2.03Å; C992-C1021 PolarHBondContact SG-SG 3.1Å; N996-C1021 PolarHBondContact O-N 3.09Å
1022	G	56.4	Low	49.2	Very low	43 Å²	43	106.6 Å²	106.6	44%	0.443	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-75.5	150.5	176.8	0	0	0	0	0	111.5	G1024	G1022-G1024 VanDerWaalsContact C-N 3.35Å; G1022-G1024 PolarHBondContact O-N 3.33Å
1023	I	49.1	Very low	48.3	Very low	184 Å²	184	101.2 Å²	101.2	94%	0.944	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	92.6	169.4	-57.2	172.6	0	0	0	107
1024	G	51.4	Low	47.7	Very low	66 Å²	66	103.9 Å²	103.9	68%	0.68	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	147.5	-6.3	179	0	0	0	0	0	117.3	G1022 E1026	G1022-G1024 VanDerWaalsContact C-N 3.35Å; G1022-G1024 PolarHBondContact O-N 3.33Å; G1024-E1026 VanDerWaalsContact C-N 3.25Å; G1024-E1026 PolarHBondContact O-N 3.07Å; G1024-E1026 VanDerWaalsContact O-N 3.13Å
1025	D	42	Very low	46.5	Very low	106 Å²	106	106.6 Å²	106.6	57%	0.567	64%	0.637	S	S	*	*			trans	-84.3	34.9	-175.4	-74.8	-3.4	0	0	0	114.1	R998	R998-D1025 IonicContact CZ-OD2 3.62Å; R998-D1025 IonicContact NH1-OD2 3.14Å; R998-D1025 PolarHBondContact NH1-OD2 2.72Å; R998-D1025 IonicContact NH2-OD2 2.8Å
1026	E	42	Very low	45.4	Very low	178 Å²	178	109.7 Å²	109.7	83%	0.832	65%	0.651	S	S	*	*			trans	-100.5	140.6	170.2	-68.1	-172	148.5	0	0	110.7	G1024	G1024-E1026 VanDerWaalsContact C-N 3.25Å; G1024-E1026 PolarHBondContact O-N 3.07Å; G1024-E1026 VanDerWaalsContact O-N 3.13Å
1027	D	35.7	Very low	43.9	Very low	156 Å²	156	112 Å²	112	83%	0.834	66%	0.662	S	S	*	*			trans	69.2	81.5	170.7	-56.9	-21	0	0	0	120.6
1028	V	37.3	Very low	42.1	Very low	147 Å²	147	117.6 Å²	117.6	89%	0.891	69%	0.692	S	S	*	*			trans	-139.3	106.3	138.6	-174.6	0	0	0	0	110.4
1029	E	32.4	Very low	40.3	Very low	200 Å²	200	123.9 Å²	123.9	94%	0.935	71%	0.713	S	S	*	*			trans	-80.1	146.8	165.4	-72.7	-169.2	128.6	0	0	111.6
1030	G	30.1	Very low	38.5	Very low	72 Å²	72	128 Å²	128	74%	0.742	73%	0.732	S	S	*	*			trans	104.3	101.4	154.1	0	0	0	0	0	117.1
1031	V	32.4	Very low	37.2	Very low	152 Å²	152	128.1 Å²	128.1	92%	0.921	75%	0.748	S	S	*	*				-169.4	145.2	118.2	149.9	0	0	0	0	107.6
1032	A	29	Very low	35.3	Very low	103 Å²	103	138.8 Å²	138.8	85%	0.851	79%	0.786	S	S	*	*			trans	-82.7	153.4	-167.1	0	0	0	0	0	114.6
1033	G	29.6	Very low	34.4	Very low	67 Å²	67	144.9 Å²	144.9	69%	0.691	80%	0.803	S	S	*	*			trans	165.4	107.6	164.7	0	0	0	0	0	115.1
1034	N	30.3	Very low	33.7	Very low	174 Å²	174	141.9 Å²	141.9	93%	0.93	79%	0.789	S	S	*	*			trans	61.2	74.6	155.7	-54.9	-14.8	0	0	0	118.9
1035	A	29.7	Very low	33.1	Very low	99 Å²	99	143.6 Å²	143.6	82%	0.818	78%	0.783	S	S	*	*			trans	-94.7	115.2	156	0	0	0	0	0	110.2	H1037	A1035-H1037 PolarHBondContact O-N 2.69Å
1036	M	30.8	Very low	33.3	Very low	164 Å²	164	144.5 Å²	144.5	81%	0.808	79%	0.792	S	S	*	*			trans	-78.6	122.4	176.9	-164.2	175.6	-75.5	0	0	110.7	M1007	M1007-M1036 HydrophobicContact CE-CE 3.95Å; M1007-M1036 HydrophobicContact CE-SD 4.07Å
1037	H	29.7	Very low	33.5	Very low	128 Å²	128	142.3 Å²	142.3	59%	0.593	78%	0.784	S	S	*	*			trans	-76.4	125.1	-174.1	-109.1	-51.6	0	0	0	112.7	A1035 R1039	A1035-H1037 PolarHBondContact O-N 2.69Å; H1037-R1039 HydrophobicContact CB-CB 4.46Å; H1037-R1039 VanDerWaalsContact CE1-CD 3.42Å; H1037-R1039 WeakPolarHBondContact CE1-CD 3.31Å
1038	I	31.6	Very low	34.2	Very low	180 Å²	180	140.1 Å²	140.1	92%	0.923	77%	0.771	S	S	*	*			trans	-102.6	104.9	140.8	-62.1	-177.8	0	0	0	107
1039	R	28	Very low	34.6	Very low	188 Å²	188	139.6 Å²	139.6	71%	0.709	76%	0.762	S	S	*	*			trans	-125.3	140	-179.4	-147.2	-174.5	-164.7	169.2	0.4	108.2	H1037	H1037-R1039 HydrophobicContact CB-CB 4.46Å; H1037-R1039 VanDerWaalsContact CE1-CD 3.42Å; H1037-R1039 WeakPolarHBondContact CE1-CD 3.31Å
1040	Q	31.1	Very low	35.7	Very low	165 Å²	165	134.5 Å²	134.5	77%	0.771	74%	0.741	S	S	*	*			trans	122.9	133.5	164.2	-70.9	172.7	-26.4	0	0	112.4
1041	S	30.8	Very low	37.1	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	73%	0.732	S	S	*	*			cis	-136.4	136.3	-3.4	51.6	0	0	0	0	111.9
1042	R	31.9	Very low	38.4	Very low	239 Å²	239	131.9 Å²	131.9	90%	0.902	71%	0.714	S	S	*	*			trans	-78	122.5	160.6	175.9	-177.6	-175.6	162.3	1.9	106.8
1043	Q	37.4	Very low	40.4	Very low	171 Å²	171	131 Å²	131	80%	0.799	70%	0.697	S	S	*	*			trans	-137.1	143.6	162.7	-157.6	165.2	2.8	0	0	108.6
1044	D	35	Very low	42.6	Very low	122 Å²	122	131.9 Å²	131.9	65%	0.652	69%	0.686	S	S	*	*			trans	-70.9	142.9	-152.7	-54.1	-74.2	0	0	0	114.2
1045	N	39.2	Very low	44.7	Very low	102 Å²	102	125 Å²	125	55%	0.545	66%	0.655	S	S	.	*			trans	-147.7	42.1	170.8	-114	-34.4	0	0	0	114.1	M1047 L1048	N1045-M1047 PolarHBondContact O-N 2.91Å; N1045-L1048 HydrophobicContact CB-CB 4.28Å; N1045-L1048 PolarHBondContact O-N 2.91Å; N1045-L1048 VanDerWaalsContact O-N 3.12Å
1046	T	44.5	Very low	46.9	Very low	125 Å²	125	123.3 Å²	123.3	77%	0.767	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	1.1	167.4	-1.1	0	0	0	0	113.9
1047	M	48.1	Very low	49.3	Very low	132 Å²	132	120.3 Å²	120.3	65%	0.65	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-19.2	172.2	-81.1	-74.2	-80.9	0	0	114	N1045 I1050 V1051	N1045-M1047 PolarHBondContact O-N 2.91Å; M1047-I1050 PolarHBondContact O-N 3.05Å; M1047-V1051 PolarHBondContact O-N 2.89Å
1048	L	48.6	Very low	51.8	Low	109 Å²	109	118.5 Å²	118.5	57%	0.571	62%	0.618	S	S	*	*	H	α-helix	trans	-75.7	-29.2	-171.5	-137.4	78.3	0	0	0	113.7	N1045 V1051 S1052	N1045-L1048 HydrophobicContact CB-CB 4.28Å; N1045-L1048 PolarHBondContact O-N 2.91Å; N1045-L1048 VanDerWaalsContact O-N 3.12Å; L1048-V1051 PolarHBondContact O-N 2.93Å; L1048-S1052 PolarHBondContact O-N 2.79Å
1049	L	47	Very low	54.2	Low	136 Å²	136	114.9 Å²	114.9	71%	0.712	60%	0.599	S	S	*	*	H	α-helix	trans	-67.1	-35.8	174.8	-82.6	163.3	0	0	0	112.4	S1052 V1053	L1049-S1052 PolarHBondContact O-N 2.79Å; L1049-V1053 WeakPolarHBondContact O-CG2 3.32Å; L1049-V1053 PolarHBondContact O-N 2.81Å; L1049-V1053 VanDerWaalsContact O-N 3.12Å
1050	I	55.7	Low	56.8	Low	94 Å²	94	110.2 Å²	110.2	48%	0.482	59%	0.591	S	S	.	*	H	α-helix	trans	-67.9	-43.1	177.7	-61.5	175.1	0	0	0	109.9	M1047 S1052 V1053 I1054	M1047-I1050 PolarHBondContact O-N 3.05Å; I1050-S1052 PolarHBondContact O-N 3.23Å; I1050-V1053 PolarHBondContact O-N 3.13Å; I1050-I1054 HydrophobicContact CG2-CD1 3.69Å; I1050-I1054 HydrophobicContact CG2-CG1 4.4Å; I1050-I1054 WeakPolarHBondContact O-CB 3.48Å; I1050-I1054 VanDerWaalsContact O-CG1 3.29Å; I1050-I1054 WeakPolarHBondContact O-CG1 3.27Å; I1050-I1054 PolarHBondContact O-N 2.85Å
1051	V	58	Low	59.4	Low	93 Å²	93	106 Å²	106	56%	0.564	58%	0.576	S	S	*	*	H	α-helix	trans	-65.9	-38.1	177.9	179	0	0	0	0	112.1	M1047 L1048 G1055	M1047-V1051 PolarHBondContact O-N 2.89Å; L1048-V1051 PolarHBondContact O-N 2.93Å; V1051-G1055 PolarHBondContact O-N 2.97Å
1052	S	61.4	Low	62	Low	75 Å²	75	105.8 Å²	105.8	52%	0.524	57%	0.567	S	S	.	*	H	α-helix	trans	-65.7	-42.2	176.2	-177.1	0	0	0	0	112.8	L1048 L1049 I1050 S1056	L1048-S1052 PolarHBondContact O-N 2.79Å; L1049-S1052 PolarHBondContact O-N 2.79Å; I1050-S1052 PolarHBondContact O-N 3.23Å; S1052-S1056 WeakPolarHBondContact O-CB 3.38Å; S1052-S1056 PolarHBondContact O-N 2.81Å; S1052-S1056 PolarHBondContact O-OG 2.91Å
1053	V	69.4	Low	64.3	Low	84 Å²	84	99.4 Å²	99.4	51%	0.509	55%	0.55	S	S	.	*	H	α-helix	trans	-68.5	-44.2	177.5	172.6	0	0	0	0	111.2	L1049 I1050 S1056 I1057	L1049-V1053 WeakPolarHBondContact O-CG2 3.32Å; L1049-V1053 PolarHBondContact O-N 2.81Å; L1049-V1053 VanDerWaalsContact O-N 3.12Å; I1050-V1053 PolarHBondContact O-N 3.13Å; V1053-S1056 PolarHBondContact O-N 2.86Å; V1053-I1057 HydrophobicContact CG1-CD1 3.92Å; V1053-I1057 WeakPolarHBondContact O-CG1 3.44Å; V1053-I1057 PolarHBondContact O-N 2.75Å
1054	I	75.7	Confident	66.5	Low	87 Å²	87	95.3 Å²	95.3	45%	0.446	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-44.4	176.2	-68.4	172.7	0	0	0	110.8	I1050 S1056 I1057 I1058	I1050-I1054 HydrophobicContact CG2-CD1 3.69Å; I1050-I1054 HydrophobicContact CG2-CG1 4.4Å; I1050-I1054 WeakPolarHBondContact O-CB 3.48Å; I1050-I1054 VanDerWaalsContact O-CG1 3.29Å; I1050-I1054 WeakPolarHBondContact O-CG1 3.27Å; I1050-I1054 PolarHBondContact O-N 2.85Å; I1054-S1056 VanDerWaalsContact C-N 3.33Å; I1054-S1056 PolarHBondContact O-N 2.87Å; I1054-I1057 PolarHBondContact O-N 3.34Å; I1054-I1058 HydrophobicContact CG2-CD1 3.68Å; I1054-I1058 HydrophobicContact CG2-CG1 4.33Å; I1054-I1058 WeakPolarHBondContact O-CG1 3.38Å; I1054-I1058 PolarHBondContact O-N 3.23Å
1055	G	74.6	Confident	68.7	Low	28 Å²	28	94 Å²	94	29%	0.289	53%	0.529	S	S	.	.	H	α-helix	trans	-59.6	-41.3	176	0	0	0	0	0	112.9	V1051 I1058 I1059	V1051-G1055 PolarHBondContact O-N 2.97Å; G1055-I1058 PolarHBondContact O-N 2.03Å; G1055-I1059 WeakPolarHBondContact O-CG1 3.41Å; G1055-I1059 PolarHBondContact O-N 2.96Å
1056	S	75.7	Confident	70.5	Confident	65 Å²	65	94.2 Å²	94.2	46%	0.455	53%	0.53	S	S	.	.	H	α-helix	trans	-63.1	-43.1	175.8	-58.8	0	0	0	0	112.2	S1052 V1053 I1054 I1059 V1060	S1052-S1056 WeakPolarHBondContact O-CB 3.38Å; S1052-S1056 PolarHBondContact O-N 2.81Å; S1052-S1056 PolarHBondContact O-OG 2.91Å; V1053-S1056 PolarHBondContact O-N 2.86Å; I1054-S1056 VanDerWaalsContact C-N 3.33Å; I1054-S1056 PolarHBondContact O-N 2.87Å; S1056-I1059 PolarHBondContact O-N 2.95Å; S1056-V1060 WeakPolarHBondContact O-CG2 3.4Å; S1056-V1060 PolarHBondContact O-N 3.08Å; S1056-V1060 VanDerWaalsContact O-N 3.12Å
1057	I	81.9	Confident	71.8	Confident	101 Å²	101	96.3 Å²	96.3	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-65.4	-43.6	176.8	-67.2	166	0	0	0	110.8	V1053 I1054 I1059 V1060 V1061	V1053-I1057 HydrophobicContact CG1-CD1 3.92Å; V1053-I1057 WeakPolarHBondContact O-CG1 3.44Å; V1053-I1057 PolarHBondContact O-N 2.75Å; I1054-I1057 PolarHBondContact O-N 3.34Å; I1057-I1059 PolarHBondContact O-N 3.34Å; I1057-V1060 PolarHBondContact O-N 3.07Å; I1057-V1061 HydrophobicContact CG2-CG2 4.27Å; I1057-V1061 WeakPolarHBondContact O-CB 3.38Å; I1057-V1061 VanDerWaalsContact O-CG2 3.31Å; I1057-V1061 WeakPolarHBondContact O-CG2 3.39Å; I1057-V1061 PolarHBondContact O-N 3.31Å
1058	I	83.1	Confident	73	Confident	90 Å²	90	93 Å²	93	46%	0.462	52%	0.515	S	S	.	.	H	α-helix	trans	-61.3	-43.1	177.5	-69.9	169	0	0	0	111.1	I1054 G1055 V1061 L1062	I1054-I1058 HydrophobicContact CG2-CD1 3.68Å; I1054-I1058 HydrophobicContact CG2-CG1 4.33Å; I1054-I1058 WeakPolarHBondContact O-CG1 3.38Å; I1054-I1058 PolarHBondContact O-N 3.23Å; G1055-I1058 PolarHBondContact O-N 2.03Å; I1058-V1061 PolarHBondContact O-N 2.92Å; I1058-L1062 HydrophobicContact CG2-CD1 3.75Å; I1058-L1062 HydrophobicContact CG2-CG 4.24Å; I1058-L1062 WeakPolarHBondContact O-CB 3.34Å; I1058-L1062 VanDerWaalsContact O-CG 3.29Å; I1058-L1062 WeakPolarHBondContact O-CG 3.35Å; I1058-L1062 PolarHBondContact O-N 3.08Å
1059	I	81.4	Confident	73.8	Confident	104 Å²	104	91.4 Å²	91.4	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-44.5	177	-69.8	166.2	0	0	0	111.1	G1055 S1056 I1057 L1062 L1063	G1055-I1059 WeakPolarHBondContact O-CG1 3.41Å; G1055-I1059 PolarHBondContact O-N 2.96Å; S1056-I1059 PolarHBondContact O-N 2.95Å; I1057-I1059 PolarHBondContact O-N 3.34Å; I1059-L1062 PolarHBondContact O-N 2.87Å; I1059-L1063 HydrophobicContact CG2-CD1 3.95Å; I1059-L1063 HydrophobicContact CG2-CG 4.46Å; I1059-L1063 WeakPolarHBondContact O-CB 3.33Å; I1059-L1063 VanDerWaalsContact O-CG 3.32Å; I1059-L1063 WeakPolarHBondContact O-CG 3.4Å; I1059-L1063 PolarHBondContact O-N 3.34Å
1060	V	83.4	Confident	74.5	Confident	90 Å²	90	89 Å²	89	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-64.1	-43.5	177.4	173.1	0	0	0	0	111.3	S1056 I1057 L1063 V1064	S1056-V1060 WeakPolarHBondContact O-CG2 3.4Å; S1056-V1060 PolarHBondContact O-N 3.08Å; S1056-V1060 VanDerWaalsContact O-N 3.12Å; I1057-V1060 PolarHBondContact O-N 3.07Å; V1060-L1063 PolarHBondContact O-N 3.27Å; V1060-V1064 VanDerWaalsContact O-CG2 3.32Å; V1060-V1064 WeakPolarHBondContact O-CG2 3.02Å; V1060-V1064 PolarHBondContact O-N 3.08Å
1061	V	85.7	Confident	74.7	Confident	75 Å²	75	88.4 Å²	88.4	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-64	-42.2	176.9	171.2	0	0	0	0	111.3	I1057 I1058 V1064 L1065	I1057-V1061 HydrophobicContact CG2-CG2 4.27Å; I1057-V1061 WeakPolarHBondContact O-CB 3.38Å; I1057-V1061 VanDerWaalsContact O-CG2 3.31Å; I1057-V1061 WeakPolarHBondContact O-CG2 3.39Å; I1057-V1061 PolarHBondContact O-N 3.31Å; I1058-V1061 PolarHBondContact O-N 2.92Å; V1061-V1064 PolarHBondContact O-N 2.83Å; V1061-L1065 HydrophobicContact CG1-CD1 3.83Å; V1061-L1065 HydrophobicContact CG1-CG 4.34Å; V1061-L1065 WeakPolarHBondContact O-CB 3.46Å; V1061-L1065 VanDerWaalsContact O-CG 3.27Å; V1061-L1065 WeakPolarHBondContact O-CG 3.32Å; V1061-L1065 PolarHBondContact O-N 3.42Å
1062	L	83.9	Confident	74.8	Confident	99 Å²	99	93.7 Å²	93.7	52%	0.518	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-40.4	175.7	-75.8	171.7	0	0	0	112.4	I1058 I1059 L1065 L1066	I1058-L1062 HydrophobicContact CG2-CD1 3.75Å; I1058-L1062 HydrophobicContact CG2-CG 4.24Å; I1058-L1062 WeakPolarHBondContact O-CB 3.34Å; I1058-L1062 VanDerWaalsContact O-CG 3.29Å; I1058-L1062 WeakPolarHBondContact O-CG 3.35Å; I1058-L1062 PolarHBondContact O-N 3.08Å; I1059-L1062 PolarHBondContact O-N 2.87Å; L1062-L1065 PolarHBondContact O-N 2.89Å; L1062-L1066 WeakPolarHBondContact O-CB 3.47Å; L1062-L1066 PolarHBondContact O-N 3.22Å
1063	L	81.7	Confident	74.5	Confident	106 Å²	106	95 Å²	95	56%	0.555	53%	0.529	S	S	*	.	H	α-helix	trans	-66.3	-40.2	175.7	-74.2	171.4	0	0	0	112	I1059 V1060 L1066 F1067	I1059-L1063 HydrophobicContact CG2-CD1 3.95Å; I1059-L1063 HydrophobicContact CG2-CG 4.46Å; I1059-L1063 WeakPolarHBondContact O-CB 3.33Å; I1059-L1063 VanDerWaalsContact O-CG 3.32Å; I1059-L1063 WeakPolarHBondContact O-CG 3.4Å; I1059-L1063 PolarHBondContact O-N 3.34Å; V1060-L1063 PolarHBondContact O-N 3.27Å; L1063-L1066 PolarHBondContact O-N 2.99Å; L1063-F1067 PolarHBondContact O-N 2.82Å
1064	V	83	Confident	73.1	Confident	84 Å²	84	99.9 Å²	99.9	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-66	-43.3	174.3	171	0	0	0	0	111	V1060 V1061 F1067 V1068	V1060-V1064 VanDerWaalsContact O-CG2 3.32Å; V1060-V1064 WeakPolarHBondContact O-CG2 3.02Å; V1060-V1064 PolarHBondContact O-N 3.08Å; V1061-V1064 PolarHBondContact O-N 2.83Å; V1064-F1067 PolarHBondContact O-N 2.7Å; V1064-V1068 HydrophobicContact CG1-CG2 4.39Å; V1064-V1068 WeakPolarHBondContact O-CB 3.37Å; V1064-V1068 VanDerWaalsContact O-CG2 3.29Å; V1064-V1068 WeakPolarHBondContact O-CG2 3.45Å; V1064-V1068 PolarHBondContact O-N 2.77Å
1065	L	80.5	Confident	71.4	Confident	95 Å²	95	101.5 Å²	101.5	50%	0.497	56%	0.561	S	S	.	*	H	α-helix	trans	-63.9	-40	175.5	-74.1	170.8	0	0	0	112	V1061 L1062 V1068 C1069	V1061-L1065 HydrophobicContact CG1-CD1 3.83Å; V1061-L1065 HydrophobicContact CG1-CG 4.34Å; V1061-L1065 WeakPolarHBondContact O-CB 3.46Å; V1061-L1065 VanDerWaalsContact O-CG 3.27Å; V1061-L1065 WeakPolarHBondContact O-CG 3.32Å; V1061-L1065 PolarHBondContact O-N 3.42Å; L1062-L1065 PolarHBondContact O-N 2.89Å; L1065-V1068 PolarHBondContact O-N 2.66Å; L1065-C1069 WeakPolarHBondContact O-CB 3.47Å; L1065-C1069 PolarHBondContact O-N 3.09Å; L1065-C1069 PolarHBondContact O-SG 2.86Å
1066	L	77	Confident	69.8	Low	107 Å²	107	103.5 Å²	103.5	56%	0.56	58%	0.581	S	S	*	*	H	α-helix	trans	-60.1	-46.5	171.7	-98.1	160.7	0	0	0	111.5	L1062 L1063 V1068 C1069 C1070	L1062-L1066 WeakPolarHBondContact O-CB 3.47Å; L1062-L1066 PolarHBondContact O-N 3.22Å; L1063-L1066 PolarHBondContact O-N 2.99Å; L1066-V1068 VanDerWaalsContact C-N 3.35Å; L1066-V1068 PolarHBondContact O-N 3.21Å; L1066-C1069 PolarHBondContact O-N 2.95Å; L1066-C1070 WeakPolarHBondContact O-CB 3.39Å; L1066-C1070 PolarHBondContact O-N 2.86Å; L1066-C1070 PolarHBondContact O-SG 3.36Å; L1066-C1070 VanDerWaalsContact O-SG 3.34Å
1067	F	71.5	Confident	68.1	Low	169 Å²	169	107.6 Å²	107.6	74%	0.741	60%	0.603	S	S	*	*	H	α-helix	trans	-62.2	-41	176.9	-121.4	-88.3	0	0	0	112.3	L1063 V1064 A1071	L1063-F1067 PolarHBondContact O-N 2.82Å; V1064-F1067 PolarHBondContact O-N 2.7Å; F1067-A1071 VanDerWaalsContact O-CB 3.22Å; F1067-A1071 WeakPolarHBondContact O-CB 3.43Å; F1067-A1071 PolarHBondContact O-N 3.43Å
1068	V	74.4	Confident	65.8	Low	62 Å²	62	109.5 Å²	109.5	38%	0.376	62%	0.624	S	S	.	*	H	α-helix	trans	-70.3	-35.7	177.8	171.8	0	0	0	0	112	V1064 L1065 L1066 R1072	V1064-V1068 HydrophobicContact CG1-CG2 4.39Å; V1064-V1068 WeakPolarHBondContact O-CB 3.37Å; V1064-V1068 VanDerWaalsContact O-CG2 3.29Å; V1064-V1068 WeakPolarHBondContact O-CG2 3.45Å; V1064-V1068 PolarHBondContact O-N 2.77Å; L1065-V1068 PolarHBondContact O-N 2.66Å; L1066-V1068 VanDerWaalsContact C-N 3.35Å; L1066-V1068 PolarHBondContact O-N 3.21Å; V1068-R1072 WeakPolarHBondContact O-CB 3.31Å; V1068-R1072 WeakPolarHBondContact O-CG 3.15Å; V1068-R1072 PolarHBondContact O-N 2.95Å
1069	C	66	Low	63.6	Low	75 Å²	75	108.2 Å²	108.2	51%	0.507	63%	0.632	S	S	.	*	H	α-helix	trans	-68.8	-46.9	173	-78.8	0	0	0	0	111.7	L1065 L1066 A1071 R1072 V1073	L1065-C1069 WeakPolarHBondContact O-CB 3.47Å; L1065-C1069 PolarHBondContact O-N 3.09Å; L1065-C1069 PolarHBondContact O-SG 2.86Å; L1066-C1069 PolarHBondContact O-N 2.95Å; C1069-A1071 VanDerWaalsContact C-N 3.27Å; C1069-A1071 PolarHBondContact O-N 3.34Å; C1069-R1072 PolarHBondContact O-N 3.5Å; C1069-V1073 WeakPolarHBondContact O-CG2 3.37Å; C1069-V1073 PolarHBondContact O-N 2.86Å; C1069-V1073 VanDerWaalsContact O-N 3.16Å
1070	C	60.9	Low	61.4	Low	86 Å²	86	115 Å²	115	58%	0.581	65%	0.651	S	S	*	*	H	α-helix	trans	-59.8	-37.6	174.3	-70.5	0	0	0	0	112	L1066 R1072	L1066-C1070 WeakPolarHBondContact O-CB 3.39Å; L1066-C1070 PolarHBondContact O-N 2.86Å; L1066-C1070 PolarHBondContact O-SG 3.36Å; L1066-C1070 VanDerWaalsContact O-SG 3.34Å; C1070-R1072 VanDerWaalsContact C-N 3.25Å; C1070-R1072 PolarHBondContact O-N 3.09Å
1071	A	60	Low	58.9	Low	81 Å²	81	117.3 Å²	117.3	67%	0.669	67%	0.669	S	S	*	*	H	α-helix	trans	-71.1	-12.2	175.1	0	0	0	0	0	114.7	F1067 C1069	F1067-A1071 VanDerWaalsContact O-CB 3.22Å; F1067-A1071 WeakPolarHBondContact O-CB 3.43Å; F1067-A1071 PolarHBondContact O-N 3.43Å; C1069-A1071 VanDerWaalsContact C-N 3.27Å; C1069-A1071 PolarHBondContact O-N 3.34Å
1072	R	59.1	Low	56.5	Low	204 Å²	204	119.5 Å²	119.5	77%	0.77	69%	0.687	S	S	*	*	H	α-helix	trans	-107.1	-12.7	179.8	-78.1	-177.7	172.6	171.4	-0.9	114.9	V1068 C1069 C1070	V1068-R1072 WeakPolarHBondContact O-CB 3.31Å; V1068-R1072 WeakPolarHBondContact O-CG 3.15Å; V1068-R1072 PolarHBondContact O-N 2.95Å; C1069-R1072 PolarHBondContact O-N 3.5Å; C1070-R1072 VanDerWaalsContact C-N 3.25Å; C1070-R1072 PolarHBondContact O-N 3.09Å
1073	V	55.4	Low	54	Low	102 Å²	102	123 Å²	123	62%	0.618	71%	0.705	S	S	*	*	H	α-helix	trans	-100.3	-12.7	-174.4	175.7	0	0	0	0	113.6	C1069	C1069-V1073 WeakPolarHBondContact O-CG2 3.37Å; C1069-V1073 PolarHBondContact O-N 2.86Å; C1069-V1073 VanDerWaalsContact O-N 3.16Å
1074	F	40.4	Very low	51.6	Low	187 Å²	187	124.3 Å²	124.3	82%	0.82	72%	0.718	S	S	*	*			trans	-127.3	75.9	175.6	-78.1	-84.2	0	0	0	114.3
1075	P	39.8	Very low	49.1	Very low	122 Å²	122	131.6 Å²	131.6	79%	0.792	74%	0.736	S	S	*	*			trans	-89.7	98	168.9	34.1	-28.9	0	0	0	110.6
1076	G	42	Very low	46.6	Very low	70 Å²	70	136.9 Å²	136.9	72%	0.722	76%	0.755	S	S	*	*			trans	154.3	55.7	167.3	0	0	0	0	0	120.4
1077	V	39.6	Very low	44.4	Very low	151 Å²	151	143 Å²	143	92%	0.915	77%	0.77	S	S	*	*			trans	-142	89	143.7	-172.9	0	0	0	0	108.6
1078	C	33.2	Very low	42.3	Very low	141 Å²	141	137.8 Å²	137.8	95%	0.953	76%	0.764	S	S	*	*			trans	-120.4	95.6	174.6	-165.8	0	0	0	0	109.1
1079	G	37.5	Very low	40	Very low	62 Å²	62	142.9 Å²	142.9	64%	0.639	79%	0.79	S	S	*	*			trans	-171	104.5	-177	0	0	0	0	0	113
1080	R	34	Very low	38.2	Very low	248 Å²	248	146.3 Å²	146.3	94%	0.936	80%	0.801	S	S	*	*			trans	61.8	98.2	168.3	-56.6	176.9	177	-172.1	-2	116.9
1081	C	32.3	Very low	36.5	Very low	137 Å²	137	147.9 Å²	147.9	93%	0.926	81%	0.81	S	S	*	*			trans	-163.2	120.2	131.6	-102.1	0	0	0	0	110.8
1082	C	35.3	Very low	34.8	Very low	121 Å²	121	153 Å²	153	82%	0.818	82%	0.82	S	S	*	*			trans	-82.2	127.7	174.6	-64.8	0	0	0	0	110.9
1083	L	29.8	Very low	33.3	Very low	172 Å²	172	151.4 Å²	151.4	90%	0.901	81%	0.814	S	S	*	*			trans	44.1	75.8	141.5	-61.8	170.2	0	0	0	118.5
1084	V	32.6	Very low	31.8	Very low	135 Å²	135	150.9 Å²	150.9	82%	0.818	81%	0.813	S	S	*	*			trans	-132.5	111.8	143.3	-177.2	0	0	0	0	109.5	K1086	V1084-K1086 PolarHBondContact O-N 3.32Å; V1084-K1086 VanDerWaalsContact O-N 3.11Å
1085	R	29.9	Very low	31.2	Very low	237 Å²	237	145.7 Å²	145.7	89%	0.894	80%	0.8	S	S	*	*			trans	-85.7	78.6	-172.8	-163.1	179.4	-165.8	173.5	4.8	110.7	R1087	R1085-R1087 PolarHBondContact O-N 2.82Å
1086	K	27	Very low	30.6	Very low	205 Å²	205	141.4 Å²	141.4	89%	0.891	77%	0.772	S	S	*	*			trans	-60.3	108.9	168.1	-85.1	-169.3	173.5	-174.3	0	109.3	V1084	V1084-K1086 PolarHBondContact O-N 3.32Å; V1084-K1086 VanDerWaalsContact O-N 3.11Å
1087	R	31.9	Very low	29.9	Very low	235 Å²	235	139.5 Å²	139.5	89%	0.887	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-84.1	133.5	171.1	-134.7	173.6	-173.7	170.9	-0.4	107.5	R1085	R1085-R1087 PolarHBondContact O-N 2.82Å
1088	G	28.1	Very low	29.3	Very low	60 Å²	60	132.3 Å²	132.3	62%	0.619	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-66.4	162.7	-170.7	0	0	0	0	0	114.4	I1090	G1088-I1090 PolarHBondContact O-N 2.73Å
1089	D	25.6	Very low	29.1	Very low	170 Å²	170	125.9 Å²	125.9	91%	0.909	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-54.3	116.1	-177.9	-59.8	-76.1	0	0	0	112.4
1090	I	27.9	Very low	28.7	Very low	147 Å²	147	124 Å²	124	75%	0.754	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-87.2	128.3	166.6	-60.4	173.5	0	0	0	106.3	G1088 Q1092	G1088-I1090 PolarHBondContact O-N 2.73Å; I1090-Q1092 PolarHBondContact O-N 2.88Å
1091	P	24.4	Very low	28.7	Very low	118 Å²	118	112.7 Å²	112.7	77%	0.766	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-61.4	123.1	177.7	25.1	-33.5	0	0	0	109.8	R1093	P1091-R1093 PolarHBondContact O-N 3.47Å
1092	Q	25.5	Very low	28.7	Very low	188 Å²	188	108.2 Å²	108.2	88%	0.879	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-54.7	126.6	178.8	-69.8	180	-22.1	0	0	110.1	I1090	I1090-Q1092 PolarHBondContact O-N 2.88Å
1093	R	26.4	Very low	28.5	Very low	171 Å²	171	105.2 Å²	105.2	65%	0.645	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-59.6	138	161.8	-85.3	-173.9	179.1	-179.4	1.3	106.8	D272 P1091 S1095	D272-R1093 IonicContact OD2-NH2 3.6Å; P1091-R1093 PolarHBondContact O-N 3.47Å; R1093-S1095 PolarHBondContact O-N 2.96Å; R1093-S1095 VanDerWaalsContact O-N 3.09Å
1094	P	25	Very low	28.4	Very low	92 Å²	92	101.1 Å²	101.1	60%	0.597	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-58.2	117.6	165.6	-17.3	29.8	0	0	0	107.9	T1096	P1094-T1096 PolarHBondContact O-N 3.49Å
1095	S	28.1	Very low	28.2	Very low	78 Å²	78	97.6 Å²	97.6	55%	0.545	49%	0.485	S	S	.	.			trans	-76.1	93.5	175	37.6	0	0	0	0	108.9	R1093 P1097	R1093-S1095 PolarHBondContact O-N 2.96Å; R1093-S1095 VanDerWaalsContact O-N 3.09Å; S1095-P1097 WeakPolarHBondContact O-CD 3.41Å
1096	T	26.7	Very low	28	Very low	32 Å²	32	90.1 Å²	90.1	20%	0.196	47%	0.467	C	S	.	.			trans	-71.6	121.2	166.9	51.4	0	0	0	0	108.4	N204 Q358 V474 P1094 S1098	N204-T1096 PolarHBondContact ND2-O 2.88Å; Q358-T1096 PolarHBondContact OE1-OG1 3.44Å; V474-T1096 HydrophobicContact CG1-CG2 3.9Å; P1094-T1096 PolarHBondContact O-N 3.49Å; T1096-S1098 PolarHBondContact O-N 3.44Å
1097	P	27.5	Very low	27.9	Very low	29 Å²	29	85.4 Å²	85.4	19%	0.188	46%	0.458	C	S	.	.			trans	-87.4	108.4	-171.6	29.4	-26	0	0	0	109.6	K475 I530 F531 S1095	K475-P1097 WeakPolarHBondContact CE-O 3.5Å; K475-P1097 PolarHBondContact NZ-O 2.86Å; I530-P1097 WeakPolarHBondContact O-CG 3.12Å; F531-P1097 WeakPolarHBondContact O-CB 3.26Å; S1095-P1097 WeakPolarHBondContact O-CD 3.41Å
1098	S	27.3	Very low	27.6	Very low	1 Å²	1	79.2 Å²	79.2	1%	0.007	45%	0.448	C	S	.	.			trans	-117	28.8	-170.8	72.7	0	0	0	0	115.6	N204 F275 T1096 K1100	N204-S1098 WeakPolarHBondContact CB-OG 3.37Å; N204-S1098 PolarHBondContact ND2-OG 2.88Å; N204-S1098 PolarHBondContact OD1-N 3.41Å; N204-S1098 PolarHBondContact OD1-OG 2.91Å; F275-S1098 PolarHBondContact O-OG 3.12Å; T1096-S1098 PolarHBondContact O-N 3.44Å; S1098-K1100 PolarHBondContact O-N 3.36Å
1099	T	29.1	Very low	27.4	Very low	5 Å²	5	81.4 Å²	81.4	3%	0.031	45%	0.454	C	S	.	.			trans	-80.7	96.5	167.1	40.8	0	0	0	0	111	F205 K475 N532	F205-T1099 HydrophobicContact CD1-CG2 3.66Å; F205-T1099 HydrophobicContact CE1-CG2 3.49Å; F205-T1099 VanDerWaalsContact CE1-CG2 3.49Å; F205-T1099 HydrophobicContact CZ-CG2 4.35Å; F205-T1099 WeakPolarHBondContact O-CG2 3.06Å; K475-T1099 PolarHBondContact NZ-O 2.94Å; N532-T1099 PolarHBondContact ND2-O 3.49Å; N532-T1099 PolarHBondContact OD1-O 3.14Å
1100	K	28	Very low	27.4	Very low	23 Å²	23	81.5 Å²	81.5	10%	0.1	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-87.1	126.4	163.9	-161.6	175.7	-173.9	-179.8	0	109.1	Y279 V360 D361 S1098	Y279-K1100 PolarHBondContact OH-NZ 3.49Å; V360-K1100 PolarHBondContact O-NZ 2.9Å; D361-K1100 IonicContact OD1-NZ 2.72Å; D361-K1100 PolarHBondContact OD1-NZ 3.06Å; S1098-K1100 PolarHBondContact O-N 3.36Å
1101	F	34.5	Very low	27.4	Very low	10 Å²	10	85.1 Å²	85.1	4%	0.044	46%	0.458	C	S	.	.	B	Isolated β-bridge	trans	-87.1	126.1	173.7	-70.1	-104.9	0	0	0	107.2	K92 A93 R152 Y207 N532 I1103	K92-F1101 WeakPolarHBondContact O-CE2 3.03Å; K92-F1101 WeakPolarHBondContact O-CZ 3.42Å; A93-F1101 HydrophobicContact CB-CE1 3.68Å; A93-F1101 HydrophobicContact CB-CZ 3.57Å; R152-F1101 WeakPolarHBondContact O-CE1 3.44Å; R152-F1101 VanDerWaalsContact O-CZ 3.26Å; R152-F1101 WeakPolarHBondContact O-CZ 3.45Å; Y207-F1101 AromaticContact CE1-CD1 3.95Å; Y207-F1101 HydrophobicContact CE1-CD1 3.95Å; Y207-F1101 AromaticContact CE1-CE1 3.85Å; Y207-F1101 HydrophobicContact CE1-CE1 3.85Å; Y207-F1101 AromaticContact CZ-CD1 3.81Å; Y207-F1101 AromaticContact CZ-CE1 3.98Å; Y207-F1101 WeakPolarHBondContact OH-CD1 3.44Å; Y207-F1101 VanDerWaalsContact OH-CE1 3.23Å; Y207-F1101 WeakPolarHBondContact OH-CE1 3.02Å; N532-F1101 WeakPolarHBondContact ND2-CD2 3.36Å; F1101-I1103 PolarHBondContact O-N 2.85Å
1102	N	31.5	Very low	27.6	Very low	43 Å²	43	87.1 Å²	87.1	23%	0.23	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-80	116.5	174.5	-79.6	-60	0	0	0	109.8	Y207 V208 A278	Y207-N1102 PolarHBondContact O-ND2 3.17Å; V208-N1102 HydrophobicContact CG2-CB 4.47Å; V208-N1102 WeakPolarHBondContact CG2-ND2 3.44Å; A278-N1102 VanDerWaalsContact O-CG 3.24Å; A278-N1102 PolarHBondContact O-ND2 3.3Å; A278-N1102 PolarHBondContact O-OD1 2.82Å
1103	I	32.5	Very low	27.6	Very low	58 Å²	58	81.7 Å²	81.7	30%	0.297	46%	0.457	S	S	.	.			trans	-88.7	114.2	177.2	-57.1	164.4	0	0	0	107.5	F96 F1101 T1105	F96-I1103 HydrophobicContact CD2-CD1 3.49Å; F96-I1103 VanDerWaalsContact CD2-CD1 3.49Å; F96-I1103 HydrophobicContact CD2-CG1 4.01Å; F96-I1103 HydrophobicContact CE2-CD1 3.63Å; F96-I1103 HydrophobicContact CE2-CG1 4.49Å; F1101-I1103 PolarHBondContact O-N 2.85Å; I1103-T1105 VanDerWaalsContact C-N 3.33Å; I1103-T1105 HydrophobicContact CG2-CG2 3.85Å; I1103-T1105 PolarHBondContact O-N 2.79Å
1104	Y	27.9	Very low	27.7	Very low	87 Å²	87	85.4 Å²	85.4	34%	0.341	47%	0.471	S	S	.	.			trans	-83.2	83.3	161.1	-147.1	-73	0	0	0	108.1	I211 E280 P1106	I211-Y1104 HydrophobicContact CB-CE1 4.19Å; I211-Y1104 HydrophobicContact CB-CE2 4.02Å; I211-Y1104 HydrophobicContact CD1-CE1 3.96Å; I211-Y1104 HydrophobicContact CG1-CE1 4.34Å; E280-Y1104 WeakPolarHBondContact OE2-CE2 3.49Å; Y1104-P1106 VanDerWaalsContact O-CD 3.22Å; Y1104-P1106 WeakPolarHBondContact O-CD 3.43Å
1105	T	28.4	Very low	27.9	Very low	60 Å²	60	85.8 Å²	85.8	37%	0.368	48%	0.475	S	S	.	.			trans	-84.3	106.1	160.1	26.1	0	0	0	0	107	I1103	I1103-T1105 VanDerWaalsContact C-N 3.33Å; I1103-T1105 HydrophobicContact CG2-CG2 3.85Å; I1103-T1105 PolarHBondContact O-N 2.79Å
1106	P	25.1	Very low	27.9	Very low	80 Å²	80	91.4 Å²	91.4	52%	0.519	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-62.7	139	166.8	28.9	-33	0	0	0	107.9	Y1104	Y1104-P1106 VanDerWaalsContact O-CD 3.22Å; Y1104-P1106 WeakPolarHBondContact O-CD 3.43Å
1107	P	24.8	Very low	28	Very low	107 Å²	107	95.5 Å²	95.5	70%	0.695	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-60.1	150.3	174.1	26.6	-34.2	0	0	0	110	S1109	P1107-S1109 PolarHBondContact O-N 3.25Å
1108	P	25.3	Very low	28.2	Very low	104 Å²	104	99.7 Å²	99.7	68%	0.675	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-54.3	130.1	169.8	23.6	-33.3	0	0	0	109.1	L1110	P1108-L1110 PolarHBondContact O-N 3.41Å
1109	S	24.3	Very low	28.1	Very low	107 Å²	107	106.4 Å²	106.4	75%	0.748	58%	0.581	S	S	*	*			trans	-69.9	95.1	-176.3	52.4	0	0	0	0	111.1	P1107 R1111	P1107-S1109 PolarHBondContact O-N 3.25Å; S1109-R1111 PolarHBondContact O-N 3.08Å
1110	L	25.6	Very low	28.2	Very low	172 Å²	172	113.9 Å²	113.9	90%	0.901	62%	0.62	S	S	*	*			trans	-68.4	69.6	158	-84	170.3	0	0	0	109.7	P1108 N1112	P1108-L1110 PolarHBondContact O-N 3.41Å; L1110-N1112 VanDerWaalsContact C-N 3.26Å; L1110-N1112 PolarHBondContact O-N 3.05Å
1111	R	26.7	Very low	28.1	Very low	222 Å²	222	119.9 Å²	119.9	84%	0.838	65%	0.652	S	S	*	*			trans	-71.7	87.6	157.1	-88.8	-169.1	172.1	-160.8	0.6	108.2	S1109	S1109-R1111 PolarHBondContact O-N 3.08Å
1112	N	28.8	Very low	28	Very low	161 Å²	161	127.9 Å²	127.9	86%	0.861	69%	0.691	S	S	*	*			trans	166.7	139	135.8	-84.9	-23.1	0	0	0	110.5	L1110	L1110-N1112 VanDerWaalsContact C-N 3.26Å; L1110-N1112 PolarHBondContact O-N 3.05Å
1113	G	27.2	Very low	27.9	Very low	74 Å²	74	133.4 Å²	133.4	76%	0.763	72%	0.721	S	S	*	*			trans	129.7	47.4	156.5	0	0	0	0	0	120.4
1114	R	28.4	Very low	28	Very low	249 Å²	249	134.9 Å²	134.9	94%	0.94	73%	0.734	S	S	*	*			trans	61.3	106.7	153.7	-67.7	179.1	170.4	166.2	-2.8	119.4
1115	S	28.1	Very low	27.9	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	76%	0.76	S	S	*	*			trans	-59	140.2	148.3	162.7	0	0	0	0	111.3
1116	Q	28.9	Very low	28.2	Very low	197 Å²	197	140.7 Å²	140.7	92%	0.921	78%	0.776	S	S	*	*			trans	-81.2	122.2	156.7	-70.2	-174.8	2.4	0	0	109.2
1117	T	29	Very low	28.4	Very low	117 Å²	117	147.9 Å²	147.9	72%	0.718	79%	0.793	S	S	*	*			trans	-123.4	142	164.4	48	0	0	0	0	108.8	N1119	T1117-N1119 PolarHBondContact O-N 3.43Å
1118	P	30.1	Very low	28.5	Very low	117 Å²	117	152.8 Å²	152.8	76%	0.76	80%	0.804	S	S	*	*			trans	-79.8	112.4	170.1	30.2	-30.2	0	0	0	110.5
1119	N	27.2	Very low	28.7	Very low	142 Å²	142	153.7 Å²	153.7	76%	0.759	81%	0.812	S	S	*	*			trans	62.6	108.6	145	-55.3	-32.5	0	0	0	119.8	T1117	T1117-N1119 PolarHBondContact O-N 3.43Å
1120	L	30.5	Very low	28.9	Very low	162 Å²	162	152.9 Å²	152.9	85%	0.848	81%	0.812	S	S	*	*				-164.4	87	119.7	-103.2	155.1	0	0	0	113.1
1121	I	26.5	Very low	29	Very low	150 Å²	150	154 Å²	154	77%	0.769	81%	0.81	S	S	*	*			trans	52	134.8	137.3	-45.9	177.7	0	0	0	120.7
1122	M	30.6	Very low	29.4	Very low	177 Å²	177	150.7 Å²	150.7	87%	0.872	81%	0.809	S	S	*	*			trans	103.6	59.1	165.4	-52.3	-153.1	112.1	0	0	120.4
1123	N	30.2	Very low	29.8	Very low	159 Å²	159	152.3 Å²	152.3	85%	0.85	81%	0.811	S	S	*	*				26.7	158.4	107.1	-119.2	21.5	0	0	0	121.7
1124	P	34.1	Very low	30.2	Very low	90 Å²	90	156 Å²	156	58%	0.584	81%	0.812	S	S	*	*				-140.1	-163.3	-75.5	39.4	-18.8	0	0	0	114.8
1125	L	27.3	Very low	30.5	Very low	168 Å²	168	153.9 Å²	153.9	88%	0.88	81%	0.813	S	S	*	*			trans	82.8	144.3	170.3	-48.3	169.5	0	0	0	115.4
1126	S	34.1	Very low	31.3	Very low	100 Å²	100	153 Å²	153	70%	0.699	82%	0.819	S	S	*	*			cis	-155	147.2	13.9	57.6	0	0	0	0	115.7
1127	R	28.8	Very low	32.3	Very low	231 Å²	231	147.9 Å²	147.9	87%	0.872	80%	0.798	S	S	*	*			trans	50.6	120.9	142	-67.5	-178.3	176.8	173.9	-0.6	123.6
1128	F	26.1	Very low	34.1	Very low	211 Å²	211	146.1 Å²	146.1	93%	0.925	79%	0.787	S	S	*	*				26.1	126.6	129	-71	-89.2	0	0	0	121.4
1129	S	29.8	Very low	35.3	Very low	122 Å²	122	149.2 Å²	149.2	85%	0.853	79%	0.791	S	S	*	*				-165.5	156.5	107.5	-165.7	0	0	0	0	111
1130	A	28.4	Very low	36.9	Very low	91 Å²	91	149.8 Å²	149.8	75%	0.752	79%	0.789	S	S	*	*			trans	-110.8	131.5	175.9	0	0	0	0	0	111.2
1131	K	28.5	Very low	38	Very low	195 Å²	195	146.2 Å²	146.2	85%	0.848	77%	0.768	S	S	*	*			trans	-171.4	168.1	157.5	-113.3	179	177.5	-171.5	0	108.5
1132	D	36	Very low	39.1	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	75%	0.747	S	S	*	*			trans	77.7	77.2	172.8	-46.1	-19.4	0	0	0	116.4
1133	E	36.2	Very low	40.2	Very low	196 Å²	196	135.9 Å²	135.9	92%	0.916	73%	0.728	S	S	*	*			trans	-170.9	64	143.8	-112.1	178.7	-168.8	0	0	111.1
1134	L	35.3	Very low	41.3	Very low	150 Å²	150	133 Å²	133	79%	0.785	71%	0.713	S	S	*	*			trans	-158.4	55.9	166.8	-146.1	86.3	0	0	0	113.8
1135	E	34.7	Very low	42	Very low	206 Å²	206	132.1 Å²	132.1	96%	0.963	71%	0.705	S	S	*	*			trans	-106.1	127.3	165.1	-68.7	-168.6	153.8	0	0	109.7
1136	G	46	Very low	42.7	Very low	79 Å²	79	128.7 Å²	128.7	81%	0.814	69%	0.687	S	S	*	*	S	Bend	trans	127.3	2.6	169.4	0	0	0	0	0	118.3
1137	L	48.2	Very low	43.2	Very low	91 Å²	91	131.3 Å²	131.3	48%	0.476	69%	0.686	S	S	.	*			trans	-99.6	140.7	176	-67.9	171.3	0	0	0	111.9	E1141	L1137-E1141 HydrophobicContact CB-CB 4.27Å; L1137-E1141 HydrophobicContact CD2-CB 4.17Å
1138	T	68.4	Low	44	Very low	79 Å²	79	129.4 Å²	129.4	49%	0.485	68%	0.679	S	S	.	*			trans	-72.4	163.4	178.4	60.1	0	0	0	0	112.3	E1140 E1141 T1142	T1138-E1140 PolarHBondContact O-N 3.1Å; T1138-E1141 WeakPolarHBondContact CB-OE2 3.41Å; T1138-E1141 WeakPolarHBondContact CG2-OE2 3.46Å; T1138-E1141 PolarHBondContact N-OE2 2.88Å; T1138-E1141 PolarHBondContact O-N 3.17Å; T1138-E1141 VanDerWaalsContact OG1-CD 3.3Å; T1138-E1141 WeakPolarHBondContact OG1-CG 3.42Å; T1138-E1141 PolarHBondContact OG1-N 3.48Å; T1138-E1141 PolarHBondContact OG1-OE2 2.6Å; T1138-T1142 WeakPolarHBondContact O-CB 3.49Å; T1138-T1142 PolarHBondContact O-N 3.17Å; T1138-T1142 PolarHBondContact O-OG1 3.47Å
1139	E	55.2	Low	44.6	Very low	183 Å²	183	124.8 Å²	124.8	86%	0.855	66%	0.664	S	S	*	*	H	α-helix	trans	-56.1	-34.8	176	-81	-171.3	126.5	0	0	112.5	T1142 A1143	E1139-T1142 PolarHBondContact O-N 2.81Å; E1139-A1143 VanDerWaalsContact O-CB 3.31Å; E1139-A1143 WeakPolarHBondContact O-CB 3.4Å; E1139-A1143 PolarHBondContact O-N 3.1Å
1140	E	59.4	Low	44.8	Very low	153 Å²	153	125.9 Å²	125.9	72%	0.715	66%	0.657	S	S	*	*	H	α-helix	trans	-72	-40.9	-179.2	-154.8	170.9	-159.7	0	0	111.8	T1138 A1143 L1144	T1138-E1140 PolarHBondContact O-N 3.1Å; E1140-A1143 PolarHBondContact O-N 2.75Å; E1140-L1144 WeakPolarHBondContact O-CB 3.49Å; E1140-L1144 PolarHBondContact O-N 3.24Å
1141	E	53.8	Low	45.2	Very low	87 Å²	87	128.5 Å²	128.5	41%	0.407	66%	0.658	S	S	.	*	H	α-helix	trans	-68.7	-35.1	173.3	-68.8	165.9	131.1	0	0	112.1	L1137 T1138 L1144 T1145	L1137-E1141 HydrophobicContact CB-CB 4.27Å; L1137-E1141 HydrophobicContact CD2-CB 4.17Å; T1138-E1141 WeakPolarHBondContact CB-OE2 3.41Å; T1138-E1141 WeakPolarHBondContact CG2-OE2 3.46Å; T1138-E1141 PolarHBondContact N-OE2 2.88Å; T1138-E1141 PolarHBondContact O-N 3.17Å; T1138-E1141 VanDerWaalsContact OG1-CD 3.3Å; T1138-E1141 WeakPolarHBondContact OG1-CG 3.42Å; T1138-E1141 PolarHBondContact OG1-N 3.48Å; T1138-E1141 PolarHBondContact OG1-OE2 2.6Å; E1141-L1144 PolarHBondContact O-N 2.85Å; E1141-T1145 WeakPolarHBondContact O-CB 3.32Å; E1141-T1145 PolarHBondContact O-N 3.22Å; E1141-T1145 PolarHBondContact O-OG1 2.66Å
1142	T	50.5	Low	45.4	Very low	54 Å²	54	125.2 Å²	125.2	33%	0.331	65%	0.654	S	S	.	*	H	α-helix	trans	-66.6	-44.6	175.3	-53.6	0	0	0	0	110.1	T1138 E1139 T1145 L1146	T1138-T1142 WeakPolarHBondContact O-CB 3.49Å; T1138-T1142 PolarHBondContact O-N 3.17Å; T1138-T1142 PolarHBondContact O-OG1 3.47Å; E1139-T1142 PolarHBondContact O-N 2.81Å; T1142-T1145 PolarHBondContact O-N 2.87Å; T1142-L1146 HydrophobicContact CG2-CD1 4.13Å; T1142-L1146 WeakPolarHBondContact O-CB 3.48Å; T1142-L1146 PolarHBondContact O-N 2.96Å
1143	A	54.1	Low	45.2	Very low	57 Å²	57	122 Å²	122	47%	0.471	64%	0.643	S	S	.	*	H	α-helix	trans	-64.2	-41.4	175.3	0	0	0	0	0	112.6	E1139 E1140 K1147	E1139-A1143 VanDerWaalsContact O-CB 3.31Å; E1139-A1143 WeakPolarHBondContact O-CB 3.4Å; E1139-A1143 PolarHBondContact O-N 3.1Å; E1140-A1143 PolarHBondContact O-N 2.75Å; A1143-K1147 WeakPolarHBondContact O-CB 3.35Å; A1143-K1147 PolarHBondContact O-N 3.46Å
1144	L	51.9	Low	45	Very low	99 Å²	99	120 Å²	120	52%	0.518	64%	0.638	S	S	.	*	H	α-helix	trans	-66.5	-34.8	175.7	-93.2	155	0	0	0	113.1	E1140 E1141 R1148	E1140-L1144 WeakPolarHBondContact O-CB 3.49Å; E1140-L1144 PolarHBondContact O-N 3.24Å; E1141-L1144 PolarHBondContact O-N 2.85Å; L1144-R1148 PolarHBondContact O-N 3Å; L1144-R1148 VanDerWaalsContact O-N 3.1Å
1145	T	49.3	Very low	44.9	Very low	71 Å²	71	120.7 Å²	120.7	44%	0.436	64%	0.643	S	S	.	*	H	α-helix	trans	-74.9	-42.7	178.7	-55.3	0	0	0	0	111.7	E1141 T1142 R1148 N1149	E1141-T1145 WeakPolarHBondContact O-CB 3.32Å; E1141-T1145 PolarHBondContact O-N 3.22Å; E1141-T1145 PolarHBondContact O-OG1 2.66Å; T1142-T1145 PolarHBondContact O-N 2.87Å; T1145-R1148 PolarHBondContact O-N 3.27Å; T1145-N1149 PolarHBondContact O-N 3.21Å; T1145-N1149 VanDerWaalsContact O-N 3.13Å
1146	L	43	Very low	44.6	Very low	95 Å²	95	116.4 Å²	116.4	50%	0.497	63%	0.631	S	S	.	*	H	α-helix	trans	-62	-41.8	171	-87.5	152.8	0	0	0	112	T1142 R1148 N1149 M1150	T1142-L1146 HydrophobicContact CG2-CD1 4.13Å; T1142-L1146 WeakPolarHBondContact O-CB 3.48Å; T1142-L1146 PolarHBondContact O-N 2.96Å; L1146-R1148 VanDerWaalsContact C-N 3.33Å; L1146-R1148 PolarHBondContact O-N 3.26Å; L1146-N1149 PolarHBondContact O-N 3.48Å; L1146-M1150 HydrophobicContact CD2-CE 3.97Å; L1146-M1150 WeakPolarHBondContact O-CB 3.38Å; L1146-M1150 WeakPolarHBondContact O-CG 3.29Å; L1146-M1150 PolarHBondContact O-N 2.65Å
1147	K	44.4	Very low	43.8	Very low	156 Å²	156	121.2 Å²	121.2	68%	0.678	63%	0.63	S	S	*	*	H	α-helix	trans	-72.1	-22.4	-178.8	-159.6	170.8	-169.6	174.8	0	113.7	A1143	A1143-K1147 WeakPolarHBondContact O-CB 3.35Å; A1143-K1147 PolarHBondContact O-N 3.46Å
1148	R	44.7	Very low	43.3	Very low	191 Å²	191	124.1 Å²	124.1	72%	0.721	65%	0.645	S	S	*	*	H	α-helix	trans	-77.2	-40.2	167.8	-97.4	-175.6	178.4	123	1.5	112.8	L1144 T1145 L1146	L1144-R1148 PolarHBondContact O-N 3Å; L1144-R1148 VanDerWaalsContact O-N 3.1Å; T1145-R1148 PolarHBondContact O-N 3.27Å; L1146-R1148 VanDerWaalsContact C-N 3.33Å; L1146-R1148 PolarHBondContact O-N 3.26Å
1149	N	38.3	Very low	41.3	Very low	114 Å²	114	130.6 Å²	130.6	61%	0.61	66%	0.663	S	S	*	*	H	α-helix	trans	-83.4	-15.2	-174.7	-66.7	-13.8	0	0	0	113.7	T1145 L1146	T1145-N1149 PolarHBondContact O-N 3.21Å; T1145-N1149 VanDerWaalsContact O-N 3.13Å; L1146-N1149 PolarHBondContact O-N 3.48Å
1150	M	35.2	Very low	40.2	Very low	144 Å²	144	134.5 Å²	134.5	71%	0.709	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	0.5	175.9	-75.9	-175.8	164	0	0	115.4	L1146	L1146-M1150 HydrophobicContact CD2-CE 3.97Å; L1146-M1150 WeakPolarHBondContact O-CB 3.38Å; L1146-M1150 WeakPolarHBondContact O-CG 3.29Å; L1146-M1150 PolarHBondContact O-N 2.65Å
1151	L	35.6	Very low	39.2	Very low	146 Å²	146	133.6 Å²	133.6	76%	0.764	68%	0.682	S	S	*	*	S	Bend	trans	-102.6	6.7	-175.9	-87	169.5	0	0	0	115.3
1152	T	33.8	Very low	38.5	Very low	127 Å²	127	136 Å²	136	78%	0.779	70%	0.697	S	S	*	*	S	Bend	trans	-133.6	16	-174.1	44.8	0	0	0	0	115.4
1153	S	30.6	Very low	37.8	Very low	83 Å²	83	140.6 Å²	140.6	58%	0.58	72%	0.717	S	S	*	*	S	Bend	trans	-145.4	136.9	169	72.5	0	0	0	0	113.4
1154	L	31.8	Very low	36.8	Very low	155 Å²	155	145.5 Å²	145.5	81%	0.812	73%	0.732	S	S	*	*			trans	70.5	103.5	163.2	-56.1	163	0	0	0	117
1155	N	34.8	Very low	35.9	Very low	164 Å²	164	148.4 Å²	148.4	88%	0.877	75%	0.745	S	S	*	*				-147.5	92.6	115.7	-145.6	4.2	0	0	0	112.5
1156	T	27.4	Very low	35	Very low	117 Å²	117	153.5 Å²	153.5	72%	0.718	77%	0.766	S	S	*	*			trans	-101	111.4	160.1	46	0	0	0	0	108.4
1157	K	28.7	Very low	34.4	Very low	180 Å²	180	157.7 Å²	157.7	78%	0.783	79%	0.785	S	S	*	*			trans	177.7	107.3	152.1	-104.9	167.5	-176.2	-176.7	0	110.9
1158	D	37.5	Very low	33.6	Very low	151 Å²	151	157.8 Å²	157.8	81%	0.807	79%	0.793	S	S	*	*			trans	-173.8	100.8	134.2	-89.3	-21.7	0	0	0	106.6
1159	Y	27.7	Very low	32.7	Very low	216 Å²	216	155.1 Å²	155.1	85%	0.847	80%	0.799	S	S	*	*				83.1	60.8	86.2	-101.7	-77.8	0	0	0	115.2
1160	M	31.3	Very low	32.2	Very low	264 Å²	264	158.8 Å²	158.8	100%	1.3	82%	0.816	S	S	*	*				-163.7	0	120.2	-98.3	-168.7	-166.5	0	0	110.4

Retrieved 1,160 of 1,160 residues in 5636.5 ms (Link to these results)

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