A0A087XP05_POEFO Loading...

Solute carrier family 12 member 9

AlphaFold DB , UniProt , Accession A0A087XP05, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 912 aa.

						>A0A087XP05_POEFO|A0A087XP05
MKLSAMPNERSPLITSGVCGLTLTAATCGTASDSPQDSSSGKAAQDPRRLNTFFGVMVPTILSMFSIILFLRTGFVVGHAGLLQGLLMVVVAYTIISLTVLSICAISTNGAIQGGGAYYMISRSLGPEFGGSIGLMFFLAKVFACGEYVLGLVEAVLDVFGADPESSVSGGLRVLPQGYWYTVLYSSVVLLLCLLVCLVGAHIYSRTAFAILLVVTVSLLSVFISTVAVKPKDFVITRVGPGNQTIRYNASYTGFSATTLRNNLGSGYSLDYSTNSVMSFATVFAVMFTSCTGIMAGANMSGELKTPSISIPKGTIIAVFYTFTVYVLLFILVSATCDRTLLIQDYGFLQRINIWPPFVTIGIYCASLSAAMCAMIGASRILHALALDHLFGLPLAPATVTSNSGNPWVAVLYTWGLAQCVVFAGQLNAVASLVTVFYLLAYAAVDLACLALEWASAPNFRPTFQLFSWHTCLLGILSCLVMMFVINPVYSSGSIVLLLLLLLFLHYRSPTSSWGYISQALIFHQVRKYLLMLDVRKDHVKFWRPQVLLMVSNPRSSCQLILFVNQLKKGGLYVLGHVQLGDLDSLPSDPVQTQYNFWLSLVDKLGVKAFVDLTLSPSVRQGTQHLLRITGLGGMKPNTLILGFYDSCTPDDFFLQDSAFCHSSVGEGSEEEYNFGVDLPSLQAHFPPVRHVESPRWLSPDEYVGIISDAIKMKKNVCLGRYFFQLQGEGKDSKVDGSERTIDVWPLNLLQPGNQDYQDVCSLFLLQMACVLNMSSKWRHARMRIFLNVETGSSDQGWVVNEESFRELLRKLRIRASIKIVPWDSVVQHYALPEGERCEEPTPGLSDDFLSSVNRMLMEHSSQAAVRFLYLPRPPAARNQSQHYLSQLEAVTRGLGPTLLIHGVTPVTYTDL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.5	Very low	39.1	Very low	250 Å²	250	143.4 Å²	143.4	100%	1.232	74%	0.74	S	S	*	*				0	115.9	0	-141.3	162.2	176.9	0	0	106.7
2	K	32.5	Very low	39.7	Very low	206 Å²	206	142.2 Å²	142.2	90%	0.896	75%	0.748	S	S	*	*			trans	0.3	120.9	-176	-70.6	172.9	174.8	177.7	0	120.3	S4	K2-S4 PolarHBondContact O-N 2.76Å
3	L	35.4	Very low	40	Very low	176 Å²	176	143.2 Å²	143.2	92%	0.921	75%	0.754	S	S	*	*			trans	-54.7	117	153.7	-91.7	84.4	0	0	0	109.4
4	S	36.4	Very low	40.2	Very low	112 Å²	112	143.4 Å²	143.4	78%	0.783	75%	0.753	S	S	*	*			trans	-113.3	161.2	155.3	81.5	0	0	0	0	108.6	K2	K2-S4 PolarHBondContact O-N 2.76Å
5	A	38	Very low	40.4	Very low	36 Å²	36	143.6 Å²	143.6	30%	0.298	76%	0.763	S	S	.	*				-159.6	140.5	-126.6	0	0	0	0	0	103.3	T24 A25 A26	A5-T24 CarbonylContact C-O 3.55Å; A5-T24 VanDerWaalsContact CA-O 3.27Å; A5-T24 WeakPolarHBondContact CA-O 3.48Å; A5-A25 CarbonylContact C-O 3.5Å; A5-A25 WeakPolarHBondContact CA-O 3.38Å; A5-A25 WeakPolarHBondContact CB-O 3.29Å; A5-A26 VanDerWaalsContact CA-CA 3.43Å; A5-A26 HydrophobicContact CB-CB 2.99Å; A5-A26 VanDerWaalsContact CB-N 3.31Å; A5-A26 WeakPolarHBondContact O-CB 3.46Å
6	M	39.5	Very low	40.4	Very low	90 Å²	90	141.6 Å²	141.6	44%	0.443	76%	0.764	S	S	.	*			trans	-99.9	142.2	173.2	-63.8	-163.8	-177.4	0	0	116.1	N8 L23 T24 A25 A26	M6-N8 PolarHBondContact O-N 3.06Å; M6-L23 VanDerWaalsContact CE-C 3.44Å; M6-L23 HydrophobicContact CE-CB 3.76Å; M6-L23 WeakPolarHBondContact CE-O 3.36Å; M6-T24 WeakPolarHBondContact CB-O 3.34Å; M6-T24 VanDerWaalsContact CG-N 3.31Å; M6-T24 VanDerWaalsContact CG-O 3.31Å; M6-T24 WeakPolarHBondContact CG-O 3.31Å; M6-T24 PolarHBondContact N-O 3.32Å; M6-T24 PolarHBondContact SD-N 3.04Å; M6-A25 VanDerWaalsContact N-N 3.18Å; M6-A25 PolarHBondContact N-O 3.42Å; M6-A25 CarbonylContact O-C 3.57Å; M6-A25 WeakPolarHBondContact O-CA 3.5Å; M6-A25 PolarHBondContact O-N 3.21Å; M6-A26 PolarHBondContact O-N 2.92Å
7	P	42.9	Very low	40.2	Very low	109 Å²	109	137.5 Å²	137.5	71%	0.708	76%	0.762	S	S	*	*			trans	-63.8	136.1	-179.9	26.8	-33.1	0	0	0	113.1	E9	P7-E9 PolarHBondContact O-N 3.29Å
8	N	41.1	Very low	40	Very low	121 Å²	121	137.8 Å²	137.8	65%	0.647	77%	0.768	S	S	*	*			trans	-61.4	110.6	167.3	-88.3	-35.8	0	0	0	109.8	M6 R10	M6-N8 PolarHBondContact O-N 3.06Å; N8-R10 HydrophobicContact CB-CG 4.3Å; N8-R10 PolarHBondContact O-N 2.92Å
9	E	47.1	Very low	39.5	Very low	183 Å²	183	137.4 Å²	137.4	86%	0.855	77%	0.774	S	S	*	*			trans	-72.1	93.3	162.3	-78.1	-174	159	0	0	109.3	P7	P7-E9 PolarHBondContact O-N 3.29Å
10	R	41.3	Very low	39.2	Very low	216 Å²	216	133.8 Å²	133.8	82%	0.815	77%	0.769	S	S	*	*			trans	-109.3	28.5	170	-74.2	-176.4	179.4	-170.6	0.3	111.6	N8	N8-R10 HydrophobicContact CB-CG 4.3Å; N8-R10 PolarHBondContact O-N 2.92Å
11	S	42.5	Very low	38.7	Very low	78 Å²	78	135.9 Å²	135.9	55%	0.545	78%	0.777	S	S	.	*			trans	-99.6	110.8	175.5	43.5	0	0	0	0	109.8	L13	S11-L13 PolarHBondContact O-N 3.4Å
12	P	45.6	Very low	38.7	Very low	129 Å²	129	129.5 Å²	129.5	84%	0.838	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	26.5	-176.2	34.1	-36.8	0	0	0	113.3
13	L	44.8	Very low	38.6	Very low	156 Å²	156	125.7 Å²	125.7	82%	0.817	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-11.7	-169.7	-72.1	169.8	0	0	0	113.8	S11	S11-L13 PolarHBondContact O-N 3.4Å
14	I	42.2	Very low	38.4	Very low	146 Å²	146	121.4 Å²	121.4	75%	0.749	72%	0.722	S	S	*	*			trans	-146.2	120.6	180	-51.1	178.4	0	0	0	109.6
15	T	42.5	Very low	38.4	Very low	146 Å²	146	119.5 Å²	119.5	90%	0.896	71%	0.713	S	S	*	*			trans	-113.1	106.2	162.4	48.5	0	0	0	0	108.4
16	S	40.8	Very low	37.9	Very low	112 Å²	112	119.5 Å²	119.5	78%	0.783	71%	0.713	S	S	*	*			trans	-88.8	145.2	169.4	55.1	0	0	0	0	110.6
17	G	37	Very low	37.8	Very low	71 Å²	71	121.6 Å²	121.6	73%	0.732	73%	0.731	S	S	*	*			trans	-78.7	142.5	175.2	0	0	0	0	0	113.2
18	V	36.2	Very low	37	Very low	144 Å²	144	122.5 Å²	122.5	87%	0.873	74%	0.738	S	S	*	*			trans	43.1	102.3	150.1	-166	0	0	0	0	118.3
19	C	30.7	Very low	36.3	Very low	129 Å²	129	120.7 Å²	120.7	87%	0.872	75%	0.748	S	S	*	*				161.6	124.4	106.7	-153	0	0	0	0	112.4
20	G	34.7	Very low	35.4	Very low	66 Å²	66	118.1 Å²	118.1	68%	0.68	75%	0.746	S	S	*	*			trans	26.1	119.3	156.7	0	0	0	0	0	123.6
21	L	28.4	Very low	35	Very low	178 Å²	178	112.8 Å²	112.8	93%	0.932	75%	0.747	S	S	*	*				168.6	151.8	115	-96.3	146.6	0	0	0	112
22	T	33.2	Very low	34.3	Very low	115 Å²	115	114.7 Å²	114.7	71%	0.706	76%	0.761	S	S	*	*			trans	-82.1	160.9	-166.1	39.4	0	0	0	0	117
23	L	30	Very low	33.3	Very low	127 Å²	127	116.5 Å²	116.5	67%	0.665	76%	0.763	S	S	*	*			trans	119.1	170.5	159.9	-84.4	96.2	0	0	0	113.2	M6	M6-L23 VanDerWaalsContact CE-C 3.44Å; M6-L23 HydrophobicContact CE-CB 3.76Å; M6-L23 WeakPolarHBondContact CE-O 3.36Å
24	T	31.1	Very low	32.6	Very low	86 Å²	86	113.9 Å²	113.9	53%	0.528	76%	0.758	S	S	.	*				-154.6	111.1	-77.9	28.2	0	0	0	0	111.9	A5 M6	A5-T24 CarbonylContact C-O 3.55Å; A5-T24 VanDerWaalsContact CA-O 3.27Å; A5-T24 WeakPolarHBondContact CA-O 3.48Å; M6-T24 WeakPolarHBondContact CB-O 3.34Å; M6-T24 VanDerWaalsContact CG-N 3.31Å; M6-T24 VanDerWaalsContact CG-O 3.31Å; M6-T24 WeakPolarHBondContact CG-O 3.31Å; M6-T24 PolarHBondContact N-O 3.32Å; M6-T24 PolarHBondContact SD-N 3.04Å
25	A	37	Very low	32	Very low	71 Å²	71	113 Å²	113	59%	0.587	76%	0.762	S	S	*	*			trans	18	108.9	151.8	0	0	0	0	0	127	A5 M6	A5-A25 CarbonylContact C-O 3.5Å; A5-A25 WeakPolarHBondContact CA-O 3.38Å; A5-A25 WeakPolarHBondContact CB-O 3.29Å; M6-A25 VanDerWaalsContact N-N 3.18Å; M6-A25 PolarHBondContact N-O 3.42Å; M6-A25 CarbonylContact O-C 3.57Å; M6-A25 WeakPolarHBondContact O-CA 3.5Å; M6-A25 PolarHBondContact O-N 3.21Å
26	A	28	Very low	31.2	Very low	37 Å²	37	115 Å²	115	31%	0.306	76%	0.761	S	S	.	*			trans	-149.7	135.6	171.1	0	0	0	0	0	114.3	A5 M6	A5-A26 VanDerWaalsContact CA-CA 3.43Å; A5-A26 HydrophobicContact CB-CB 2.99Å; A5-A26 VanDerWaalsContact CB-N 3.31Å; A5-A26 WeakPolarHBondContact O-CB 3.46Å; M6-A26 PolarHBondContact O-N 2.92Å
27	T	37.6	Very low	30.6	Very low	133 Å²	133	117.5 Å²	117.5	82%	0.816	77%	0.766	S	S	*	*			trans	-89.1	142.8	153.6	45.2	0	0	0	0	113.1
28	C	25	Very low	30.2	Very low	128 Å²	128	119.6 Å²	119.6	87%	0.865	77%	0.769	S	S	*	*			trans	-156.9	107.6	138	-118.5	0	0	0	0	109.1
29	G	27.7	Very low	29.8	Very low	83 Å²	83	118.1 Å²	118.1	86%	0.856	77%	0.765	S	S	*	*			trans	-94.4	114.3	165.2	0	0	0	0	0	108.4
30	T	26.2	Very low	30	Very low	130 Å²	130	117.9 Å²	117.9	80%	0.798	77%	0.765	S	S	*	*			trans	-102.8	128.8	165.2	40.9	0	0	0	0	108.5
31	A	33	Very low	29.7	Very low	103 Å²	103	118 Å²	118	85%	0.851	77%	0.766	S	S	*	*			trans	-54.1	142.7	171.2	0	0	0	0	0	111.7
32	S	28.2	Very low	29.7	Very low	118 Å²	118	119.3 Å²	119.3	83%	0.825	76%	0.764	S	S	*	*			trans	-131.9	111.1	159.3	57.3	0	0	0	0	108.1
33	D	25.9	Very low	29.6	Very low	167 Å²	167	118.5 Å²	118.5	89%	0.893	77%	0.769	S	S	*	*			trans	-53	137.5	170.6	-77.1	-46.3	0	0	0	112
34	S	28.3	Very low	29.7	Very low	102 Å²	102	117 Å²	117	71%	0.713	78%	0.775	S	S	*	*			trans	-112.2	130.4	155.9	58.8	0	0	0	0	108.1	Q36	S34-Q36 PolarHBondContact O-N 2.94Å
35	P	29.7	Very low	30	Very low	127 Å²	127	121 Å²	121	83%	0.825	79%	0.788	S	S	*	*			trans	-71.6	125.2	-173.2	27.7	-30.8	0	0	0	110.8
36	Q	27.1	Very low	30.4	Very low	188 Å²	188	123 Å²	123	88%	0.879	79%	0.788	S	S	*	*			trans	-77.5	116.3	164.2	-82	179.8	-22.4	0	0	108.9	S34 S38	S34-Q36 PolarHBondContact O-N 2.94Å; Q36-S38 PolarHBondContact O-N 3.34Å
37	D	27.3	Very low	31.7	Very low	165 Å²	165	126.3 Å²	126.3	88%	0.882	81%	0.807	S	S	*	*			trans	-63.2	98.9	162.1	-89.1	-32.9	0	0	0	109.6	S39	D37-S39 VanDerWaalsContact C-N 3.35Å; D37-S39 PolarHBondContact O-N 3.25Å; D37-S39 VanDerWaalsContact O-N 3.12Å
38	S	28.7	Very low	32.8	Very low	114 Å²	114	124.1 Å²	124.1	80%	0.797	78%	0.783	S	S	*	*			trans	-78.6	83.1	168.5	59.6	0	0	0	0	109.7	Q36	Q36-S38 PolarHBondContact O-N 3.34Å
39	S	28.6	Very low	34.9	Very low	114 Å²	114	126.6 Å²	126.6	80%	0.797	78%	0.775	S	S	*	*			trans	-87	106.9	155.2	60.8	0	0	0	0	108.4	D37 G41	D37-S39 VanDerWaalsContact C-N 3.35Å; D37-S39 PolarHBondContact O-N 3.25Å; D37-S39 VanDerWaalsContact O-N 3.12Å; S39-G41 PolarHBondContact O-N 3.04Å
40	S	35.1	Very low	37.4	Very low	124 Å²	124	123.4 Å²	123.4	87%	0.867	74%	0.738	S	S	*	*			trans	-67.7	75.4	177.9	47.1	0	0	0	0	111.3	K42	S40-K42 PolarHBondContact O-N 3.1Å
41	G	28	Very low	40.3	Very low	68 Å²	68	121.7 Å²	121.7	70%	0.701	72%	0.724	S	S	*	*			trans	-71.4	112.1	160.6	0	0	0	0	0	109.3	S39 A43	S39-G41 PolarHBondContact O-N 3.04Å; G41-A43 PolarHBondContact O-N 3.44Å; G41-A43 VanDerWaalsContact O-N 3.1Å
42	K	28.2	Very low	43	Very low	206 Å²	206	118.8 Å²	118.8	90%	0.896	70%	0.696	S	S	*	*			trans	-42.3	116.7	172.7	-74.3	172	175.3	172	0	110.5	S40 A44	S40-K42 PolarHBondContact O-N 3.1Å; K42-A44 PolarHBondContact O-N 3.24Å
43	A	30.8	Very low	45.9	Very low	97 Å²	97	117.1 Å²	117.1	80%	0.802	67%	0.674	S	S	*	*			trans	-56.5	112.3	165.6	0	0	0	0	0	108.3	G41 Q45	G41-A43 PolarHBondContact O-N 3.44Å; G41-A43 VanDerWaalsContact O-N 3.1Å; A43-Q45 PolarHBondContact O-N 3.13Å
44	A	32.7	Very low	48.7	Very low	95 Å²	95	112.9 Å²	112.9	79%	0.785	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-57	127.1	171	0	0	0	0	0	108.3	K42 D46	K42-A44 PolarHBondContact O-N 3.24Å; A44-D46 PolarHBondContact O-N 3.19Å
45	Q	36.6	Very low	51.3	Low	172 Å²	172	108 Å²	108	80%	0.804	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-54.9	127.6	178	-74.1	178.4	-15	0	0	110.6	A43	A43-Q45 PolarHBondContact O-N 3.13Å
46	D	46.2	Very low	54.2	Low	112 Å²	112	102 Å²	102	60%	0.599	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-59	125.6	-174.9	-137.7	-18.7	0	0	0	111.8	A44 R48	A44-D46 PolarHBondContact O-N 3.19Å; D46-R48 PolarHBondContact O-N 2.97Å
47	P	54.9	Low	57.3	Low	107 Å²	107	94.9 Å²	94.9	70%	0.695	54%	0.541	S	S	*	.			trans	-77.4	-2.4	179.6	29.1	-33.1	0	0	0	114
48	R	60.6	Low	60.3	Low	86 Å²	86	87 Å²	87	33%	0.325	50%	0.499	S	S	.	.			trans	-89	110.1	-175	-60.6	-178.3	-173.4	-178.8	3.7	111.9	D46	D46-R48 PolarHBondContact O-N 2.97Å
49	R	69.7	Low	63.1	Low	181 Å²	181	81.6 Å²	81.6	68%	0.683	46%	0.462	S	S	*	.			trans	-130.3	-11	-167.7	-62.4	-175.3	-179.1	-174.3	0.2	115.6	E303	R49-E303 PolarHBondContact N-O 3.08Å
50	L	79.3	Confident	66.1	Low	15 Å²	15	76.2 Å²	76.2	8%	0.079	42%	0.424	C	S	.	.	B	Isolated β-bridge	trans	-86.9	135.1	-175.6	-62.9	179.7	0	0	0	112.2	M300 E303 L304 K305	L50-M300 HydrophobicContact CD1-CE 4.24Å; L50-E303 WeakPolarHBondContact CB-O 3.25Å; L50-E303 HydrophobicContact CD1-CB 3.77Å; L50-E303 WeakPolarHBondContact CD1-OE2 3.41Å; L50-E303 HydrophobicContact CG-CB 4.21Å; L50-E303 PolarHBondContact N-O 3.39Å; L50-L304 HydrophobicContact CB-CD2 4.1Å; L50-L304 WeakPolarHBondContact O-CA 3.08Å; L50-K305 PolarHBondContact O-N 3.39Å
51	N	87.1	Confident	68.8	Low	95 Å²	95	70.4 Å²	70.4	51%	0.508	38%	0.383	S	S	.	.			trans	-86.5	166.3	174.3	-68.5	-28.4	0	0	0	111.3	F53 F54 G55	N51-F53 VanDerWaalsContact C-N 3.26Å; N51-F53 PolarHBondContact O-N 3.21Å; N51-F53 VanDerWaalsContact O-N 3.17Å; N51-F54 PolarHBondContact O-N 3.42Å; N51-G55 PolarHBondContact O-N 3.23Å
52	T	89.8	Confident	71.6	Confident	42 Å²	42	67.2 Å²	67.2	26%	0.258	35%	0.35	S	S	.	.	H	α-helix	trans	-50.8	-41.3	179.3	-47.7	0	0	0	0	113.8	V56 M57 S310 K313	T52-V56 WeakPolarHBondContact O-CB 3.32Å; T52-V56 PolarHBondContact O-N 3.48Å; T52-V56 VanDerWaalsContact O-N 3.11Å; T52-M57 PolarHBondContact O-N 3.38Å; T52-S310 WeakPolarHBondContact CG2-O 3.41Å; T52-S310 WeakPolarHBondContact OG1-CB 3.45Å; T52-S310 PolarHBondContact OG1-OG 2.96Å; T52-K313 HydrophobicContact CG2-CB 4.32Å
53	F	89.4	Confident	74.5	Confident	83 Å²	83	57.4 Å²	57.4	36%	0.364	31%	0.307	S	S	.	.	I	π-helix	trans	-66.9	-57.4	-178.7	-175.6	-103.8	0	0	0	112.2	N51 M57 V58 F209	N51-F53 VanDerWaalsContact C-N 3.26Å; N51-F53 PolarHBondContact O-N 3.21Å; N51-F53 VanDerWaalsContact O-N 3.17Å; F53-M57 HydrophobicContact CD2-CB 4.44Å; F53-M57 HydrophobicContact CD2-CG 4.48Å; F53-M57 HydrophobicContact CD2-SD 3.65Å; F53-M57 HydrophobicContact CE2-CE 4.39Å; F53-M57 HydrophobicContact CE2-SD 3.85Å; F53-M57 PolarHBondContact O-N 3.02Å; F53-V58 HydrophobicContact CD1-CG2 4.02Å; F53-V58 HydrophobicContact CE1-CG2 3.7Å; F53-V58 HydrophobicContact CE2-CG2 4.24Å; F53-V58 HydrophobicContact CG-CG2 4.43Å; F53-V58 HydrophobicContact CZ-CG2 3.81Å; F53-V58 WeakPolarHBondContact O-CG2 3.19Å; F53-V58 PolarHBondContact O-N 2.97Å; F53-F209 AromaticContact CE1-CD2 3.73Å; F53-F209 HydrophobicContact CE1-CD2 3.73Å; F53-F209 AromaticContact CE1-CE2 3.57Å; F53-F209 HydrophobicContact CE1-CE2 3.57Å; F53-F209 HydrophobicContact CZ-CD2 4.24Å; F53-F209 AromaticContact CZ-CE2 3.89Å; F53-F209 HydrophobicContact CZ-CE2 3.89Å
54	F	85.6	Confident	77.2	Confident	78 Å²	78	52.8 Å²	52.8	34%	0.342	27%	0.269	S	S	.	.	I	π-helix	trans	-72.8	-33.8	-176.9	-72	-72	0	0	0	113.9	N51 P59 F209	N51-F54 PolarHBondContact O-N 3.42Å; F54-P59 WeakPolarHBondContact O-CD 3.31Å; F54-F209 HydrophobicContact CD1-CB 4.15Å; F54-F209 HydrophobicContact CD1-CG 4.43Å; F54-F209 HydrophobicContact CE1-CB 3.83Å; F54-F209 HydrophobicContact CE1-CD1 4.07Å; F54-F209 HydrophobicContact CE1-CD2 4.07Å; F54-F209 AromaticContact CE1-CG 3.71Å; F54-F209 HydrophobicContact CE1-CG 3.71Å
55	G	82.9	Confident	79.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-93.7	-19.2	-174	0	0	0	0	0	115	N51	N51-G55 PolarHBondContact O-N 3.23Å
56	V	89.6	Confident	81.8	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-126.2	-58.8	-177.5	-173.7	0	0	0	0	111.8	T52 P59 T60 L304 I311	T52-V56 WeakPolarHBondContact O-CB 3.32Å; T52-V56 PolarHBondContact O-N 3.48Å; T52-V56 VanDerWaalsContact O-N 3.11Å; V56-P59 WeakPolarHBondContact O-CD 3.29Å; V56-T60 VanDerWaalsContact O-CB 3.22Å; V56-T60 WeakPolarHBondContact O-CB 3.4Å; V56-T60 PolarHBondContact O-N 3.31Å; V56-T60 VanDerWaalsContact O-N 3.09Å; V56-T60 PolarHBondContact O-OG1 3.25Å; V56-L304 HydrophobicContact CG2-CD1 3.5Å; V56-L304 VanDerWaalsContact CG2-CD1 3.5Å; V56-L304 HydrophobicContact CG2-CD2 3.77Å; V56-L304 HydrophobicContact CG2-CG 4.3Å; V56-I311 HydrophobicContact CG2-CG1 4.39Å
57	M	91.9	Very high	83.3	Confident	38 Å²	38	35.3 Å²	35.3	19%	0.187	17%	0.168	C	C	.	.	I	π-helix	trans	-64.3	-52.9	-172.4	-176.7	179.8	173.2	0	0	112.3	T52 F53 T60 I61 I317	T52-M57 PolarHBondContact O-N 3.38Å; F53-M57 HydrophobicContact CD2-CB 4.44Å; F53-M57 HydrophobicContact CD2-CG 4.48Å; F53-M57 HydrophobicContact CD2-SD 3.65Å; F53-M57 HydrophobicContact CE2-CE 4.39Å; F53-M57 HydrophobicContact CE2-SD 3.85Å; F53-M57 PolarHBondContact O-N 3.02Å; M57-T60 PolarHBondContact O-N 2.9Å; M57-I61 HydrophobicContact CE-CD1 3.65Å; M57-I61 HydrophobicContact CG-CD1 3.68Å; M57-I61 HydrophobicContact CG-CG1 4.41Å; M57-I61 WeakPolarHBondContact O-CG1 3.32Å; M57-I61 PolarHBondContact O-N 2.81Å; M57-I317 HydrophobicContact CE-CG2 3.68Å; M57-I317 HydrophobicContact SD-CG2 3.94Å
58	V	89.7	Confident	84.6	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-50.5	-177.8	171.1	0	0	0	0	112.1	F53 T60 I61 L62 A208 F209 L212	F53-V58 HydrophobicContact CD1-CG2 4.02Å; F53-V58 HydrophobicContact CE1-CG2 3.7Å; F53-V58 HydrophobicContact CE2-CG2 4.24Å; F53-V58 HydrophobicContact CG-CG2 4.43Å; F53-V58 HydrophobicContact CZ-CG2 3.81Å; F53-V58 WeakPolarHBondContact O-CG2 3.19Å; F53-V58 PolarHBondContact O-N 2.97Å; V58-T60 VanDerWaalsContact C-N 3.3Å; V58-T60 PolarHBondContact O-N 2.85Å; V58-I61 PolarHBondContact O-N 3.26Å; V58-L62 HydrophobicContact CG1-CD1 3.81Å; V58-L62 WeakPolarHBondContact O-CB 3.48Å; V58-L62 WeakPolarHBondContact O-CG 3.2Å; V58-L62 PolarHBondContact O-N 2.56Å; V58-A208 HydrophobicContact CG1-CB 4.19Å; V58-F209 HydrophobicContact CG1-CB 4.48Å; V58-F209 HydrophobicContact CG2-CD2 4.22Å; V58-L212 HydrophobicContact CB-CD2 4.27Å; V58-L212 HydrophobicContact CG1-CB 4.29Å; V58-L212 HydrophobicContact CG1-CD2 4.06Å; V58-L212 HydrophobicContact CG2-CD2 3.76Å
59	P	88.3	Confident	85.8	Confident	1 Å²	1	26.5 Å²	26.5	1%	0.006	12%	0.121	C	C	.	.	H	α-helix	trans	-61.5	-36.4	176.9	-24.2	34.9	0	0	0	113.3	F54 V56 S63 A296 M300	F54-P59 WeakPolarHBondContact O-CD 3.31Å; V56-P59 WeakPolarHBondContact O-CD 3.29Å; P59-S63 VanDerWaalsContact O-CB 3.32Å; P59-S63 WeakPolarHBondContact O-CB 3.3Å; P59-S63 PolarHBondContact O-N 2.8Å; P59-A296 HydrophobicContact CB-CB 4.3Å; P59-M300 HydrophobicContact CB-SD 4.29Å; P59-M300 HydrophobicContact CG-SD 3.84Å
60	T	91	Very high	86.6	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-70.1	-45	180	-54.4	0	0	0	0	111.4	V56 M57 V58 L62 S63 M64 G297 T315 A318	V56-T60 VanDerWaalsContact O-CB 3.22Å; V56-T60 WeakPolarHBondContact O-CB 3.4Å; V56-T60 PolarHBondContact O-N 3.31Å; V56-T60 VanDerWaalsContact O-N 3.09Å; V56-T60 PolarHBondContact O-OG1 3.25Å; M57-T60 PolarHBondContact O-N 2.9Å; V58-T60 VanDerWaalsContact C-N 3.3Å; V58-T60 PolarHBondContact O-N 2.85Å; T60-L62 PolarHBondContact O-N 2.89Å; T60-S63 PolarHBondContact O-N 3.3Å; T60-M64 HydrophobicContact CG2-SD 4.3Å; T60-M64 WeakPolarHBondContact O-CG 3.4Å; T60-M64 PolarHBondContact O-N 2.84Å; T60-M64 VanDerWaalsContact O-N 3.1Å; T60-G297 PolarHBondContact OG1-N 2.95Å; T60-T315 HydrophobicContact CG2-CG2 4.5Å; T60-A318 HydrophobicContact CG2-CB 3.72Å
61	I	91.8	Very high	86.8	Confident	3 Å²	3	17.8 Å²	17.8	2%	0.015	9%	0.088	C	C	.	.	H	α-helix	trans	-60.4	-47.5	175.8	-68.3	170.5	0	0	0	110.5	M57 V58 S63 M64 F65 L212 A318 Y321 T322	M57-I61 HydrophobicContact CE-CD1 3.65Å; M57-I61 HydrophobicContact CG-CD1 3.68Å; M57-I61 HydrophobicContact CG-CG1 4.41Å; M57-I61 WeakPolarHBondContact O-CG1 3.32Å; M57-I61 PolarHBondContact O-N 2.81Å; V58-I61 PolarHBondContact O-N 3.26Å; I61-S63 VanDerWaalsContact C-N 3.29Å; I61-S63 PolarHBondContact O-N 2.91Å; I61-M64 CarbonylContact O-C 3.6Å; I61-M64 PolarHBondContact O-N 3.13Å; I61-M64 VanDerWaalsContact O-N 3.16Å; I61-F65 HydrophobicContact CG2-CD2 3.41Å; I61-F65 VanDerWaalsContact CG2-CD2 3.41Å; I61-F65 HydrophobicContact CG2-CE2 3.45Å; I61-F65 VanDerWaalsContact CG2-CE2 3.45Å; I61-F65 HydrophobicContact CG2-CG 4.1Å; I61-F65 HydrophobicContact CG2-CZ 4.13Å; I61-F65 WeakPolarHBondContact O-CB 3.48Å; I61-F65 WeakPolarHBondContact O-CG 3.42Å; I61-F65 PolarHBondContact O-N 2.93Å; I61-L212 HydrophobicContact CB-CD1 4.4Å; I61-L212 HydrophobicContact CG2-CD1 3.64Å; I61-A318 HydrophobicContact CD1-CB 4.45Å; I61-A318 HydrophobicContact CG1-CB 3.68Å; I61-Y321 HydrophobicContact CD1-CD1 3.7Å; I61-Y321 HydrophobicContact CD1-CE1 4.16Å; I61-Y321 HydrophobicContact CD1-CG 4.48Å; I61-Y321 HydrophobicContact CG1-CD1 4.07Å; I61-Y321 HydrophobicContact CG2-CD1 4.15Å; I61-Y321 HydrophobicContact CG2-CE1 4.04Å; I61-T322 HydrophobicContact CG1-CG2 4.5Å; I61-T322 HydrophobicContact CG2-CG2 4.37Å
62	L	88.6	Confident	86.8	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-67.5	-28.9	-179.9	-71.8	170.2	0	0	0	113.5	V58 T60 M64 A208 I211 L212	V58-L62 HydrophobicContact CG1-CD1 3.81Å; V58-L62 WeakPolarHBondContact O-CB 3.48Å; V58-L62 WeakPolarHBondContact O-CG 3.2Å; V58-L62 PolarHBondContact O-N 2.56Å; T60-L62 PolarHBondContact O-N 2.89Å; L62-M64 VanDerWaalsContact C-N 3.34Å; L62-A208 HydrophobicContact CD1-CB 3.77Å; L62-A208 WeakPolarHBondContact CD1-O 3.48Å; L62-I211 HydrophobicContact CD2-CG2 4Å; L62-L212 HydrophobicContact CD1-CB 4.18Å; L62-L212 HydrophobicContact CD2-CB 4.02Å; L62-L212 HydrophobicContact CD2-CD1 3.96Å; L62-L212 HydrophobicContact CG-CB 4.22Å; L62-L212 HydrophobicContact CG-CD1 4.22Å
63	S	87.3	Confident	86.8	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-73.4	-28.4	174	-170.7	0	0	0	0	112.4	P59 T60 I61 G293	P59-S63 VanDerWaalsContact O-CB 3.32Å; P59-S63 WeakPolarHBondContact O-CB 3.3Å; P59-S63 PolarHBondContact O-N 2.8Å; T60-S63 PolarHBondContact O-N 3.3Å; I61-S63 VanDerWaalsContact C-N 3.29Å; I61-S63 PolarHBondContact O-N 2.91Å; S63-G293 VanDerWaalsContact OG-CA 3.25Å; S63-G293 WeakPolarHBondContact OG-CA 3.49Å
64	M	88.4	Confident	86.8	Confident	0 Å²	0	8 Å²	8	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-88.3	-27.7	175.3	-65.7	178.4	87.3	0	0	112.3	T60 I61 L62 S66 Y93 S290 C291 T292 I294 V319 T322 Y326	T60-M64 HydrophobicContact CG2-SD 4.3Å; T60-M64 WeakPolarHBondContact O-CG 3.4Å; T60-M64 PolarHBondContact O-N 2.84Å; T60-M64 VanDerWaalsContact O-N 3.1Å; I61-M64 CarbonylContact O-C 3.6Å; I61-M64 PolarHBondContact O-N 3.13Å; I61-M64 VanDerWaalsContact O-N 3.16Å; L62-M64 VanDerWaalsContact C-N 3.34Å; M64-S66 PolarHBondContact O-N 3Å; M64-Y93 HydrophobicContact CE-CE1 3.81Å; M64-S290 CarbonylContact C-O 3.46Å; M64-S290 WeakPolarHBondContact CA-O 3.23Å; M64-C291 VanDerWaalsContact CE-O 3.29Å; M64-C291 WeakPolarHBondContact CE-O 3.47Å; M64-T292 VanDerWaalsContact CG-O 3.29Å; M64-T292 WeakPolarHBondContact CG-O 3.35Å; M64-I294 HydrophobicContact CE-CG2 4.33Å; M64-I294 HydrophobicContact SD-CG2 4.26Å; M64-V319 HydrophobicContact CE-CG2 4.14Å; M64-V319 HydrophobicContact SD-CG2 4.04Å; M64-T322 HydrophobicContact CB-CG2 3.89Å; M64-T322 VanDerWaalsContact CE-OG1 3.28Å; M64-T322 WeakPolarHBondContact CE-OG1 3.49Å; M64-T322 HydrophobicContact SD-CG2 4.05Å; M64-T322 PolarHBondContact SD-OG1 3.23Å; M64-Y326 PolarHBondContact O-OH 3.43Å; M64-Y326 VanDerWaalsContact O-OH 3.11Å
65	F	86.3	Confident	86.9	Confident	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.021	C	C	.	.	S	Bend	trans	-84.5	73.9	169.9	-70.5	-12	0	0	0	109	I61 L69 V215 L219 Y321 T322 V325	I61-F65 HydrophobicContact CG2-CD2 3.41Å; I61-F65 VanDerWaalsContact CG2-CD2 3.41Å; I61-F65 HydrophobicContact CG2-CE2 3.45Å; I61-F65 VanDerWaalsContact CG2-CE2 3.45Å; I61-F65 HydrophobicContact CG2-CG 4.1Å; I61-F65 HydrophobicContact CG2-CZ 4.13Å; I61-F65 WeakPolarHBondContact O-CB 3.48Å; I61-F65 WeakPolarHBondContact O-CG 3.42Å; I61-F65 PolarHBondContact O-N 2.93Å; F65-L69 HydrophobicContact CB-CD2 4.22Å; F65-L69 HydrophobicContact CD1-CD2 3.71Å; F65-L69 HydrophobicContact CE1-CD2 4.15Å; F65-L69 HydrophobicContact CG-CD2 3.92Å; F65-V215 HydrophobicContact CD2-CG1 4.17Å; F65-L219 HydrophobicContact CD2-CD1 4.14Å; F65-L219 HydrophobicContact CE2-CD1 3.8Å; F65-L219 HydrophobicContact CZ-CD1 4.22Å; F65-Y321 HydrophobicContact CE2-CD1 4.31Å; F65-Y321 AromaticContact CE2-CE1 3.57Å; F65-Y321 HydrophobicContact CE2-CE1 3.57Å; F65-Y321 HydrophobicContact CZ-CD1 4.02Å; F65-Y321 AromaticContact CZ-CE1 3.58Å; F65-Y321 HydrophobicContact CZ-CE1 3.58Å; F65-T322 HydrophobicContact CD1-CG2 3.85Å; F65-T322 HydrophobicContact CE1-CG2 3.4Å; F65-T322 VanDerWaalsContact CE1-CG2 3.4Å; F65-T322 HydrophobicContact CZ-CG2 3.85Å; F65-V325 HydrophobicContact CE1-CB 4.29Å; F65-V325 HydrophobicContact CE1-CG1 4.14Å; F65-V325 HydrophobicContact CZ-CB 4.1Å; F65-V325 HydrophobicContact CZ-CG1 4.03Å; F65-V325 HydrophobicContact CZ-CG2 4.06Å
66	S	78.8	Confident	87.4	Confident	0 Å²	0	4.3 Å²	4.3	0%	0	2%	0.021	C	C	.	.			trans	-88	179.1	172.8	74.3	0	0	0	0	111.3	M64 I68 L69	M64-S66 PolarHBondContact O-N 3Å; S66-I68 PolarHBondContact O-N 3.2Å; S66-I68 PolarHBondContact OG-N 2.85Å; S66-L69 WeakPolarHBondContact O-CB 3.39Å; S66-L69 PolarHBondContact O-N 2.94Å; S66-L69 VanDerWaalsContact O-N 3.15Å
67	I	79.3	Confident	87.6	Confident	12 Å²	12	4.3 Å²	4.3	6%	0.062	2%	0.021	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-27.8	175.3	-169.5	162.5	0	0	0	114.2	L69 F70 L71 G151 A155 I363	I67-L69 VanDerWaalsContact C-N 3.25Å; I67-L69 PolarHBondContact O-N 3.25Å; I67-F70 PolarHBondContact O-N 3.5Å; I67-F70 VanDerWaalsContact O-N 3.17Å; I67-L71 HydrophobicContact CD1-CD1 3.71Å; I67-L71 HydrophobicContact CG1-CB 4.45Å; I67-L71 HydrophobicContact CG1-CD1 3.69Å; I67-L71 HydrophobicContact CG1-CG 4.1Å; I67-L71 PolarHBondContact O-N 3.09Å; I67-G151 WeakPolarHBondContact CD1-O 3.3Å; I67-A155 HydrophobicContact CD1-CB 4.19Å; I67-I363 HydrophobicContact CD1-CG2 4.09Å; I67-I363 HydrophobicContact CG1-CG2 4.07Å
68	I	80.5	Confident	87.6	Confident	8 Å²	8	2.5 Å²	2.5	4%	0.041	1%	0.012	C	C	.	.	H	α-helix	trans	-62.6	-32.9	-178	-71.3	150.7	0	0	0	111.9	S66 F70 R72 T73 V286 T289 S290	S66-I68 PolarHBondContact O-N 3.2Å; S66-I68 PolarHBondContact OG-N 2.85Å; I68-F70 PolarHBondContact O-N 3.3Å; I68-R72 HydrophobicContact CB-CB 4.11Å; I68-R72 HydrophobicContact CB-CG 4.42Å; I68-R72 HydrophobicContact CG1-CB 4.22Å; I68-R72 HydrophobicContact CG1-CG 4.06Å; I68-R72 HydrophobicContact CG2-CB 3.79Å; I68-R72 CarbonylContact O-C 3.57Å; I68-R72 WeakPolarHBondContact O-CA 3.34Å; I68-R72 PolarHBondContact O-N 3.06Å; I68-T73 PolarHBondContact O-N 3.28Å; I68-T73 VanDerWaalsContact O-N 3.08Å; I68-V286 WeakPolarHBondContact CD1-O 3.42Å; I68-T289 WeakPolarHBondContact CD1-OG1 3.39Å; I68-S290 VanDerWaalsContact CB-CB 3.5Å
69	L	86.8	Confident	87.8	Confident	0 Å²	0	2.5 Å²	2.5	0%	0	1%	0.012	C	C	.	.	H	α-helix	trans	-56.1	-39.8	177.1	-179.1	65.4	0	0	0	111.8	F65 S66 I67 T73 L219 V325 Y326 L329	F65-L69 HydrophobicContact CB-CD2 4.22Å; F65-L69 HydrophobicContact CD1-CD2 3.71Å; F65-L69 HydrophobicContact CE1-CD2 4.15Å; F65-L69 HydrophobicContact CG-CD2 3.92Å; S66-L69 WeakPolarHBondContact O-CB 3.39Å; S66-L69 PolarHBondContact O-N 2.94Å; S66-L69 VanDerWaalsContact O-N 3.15Å; I67-L69 VanDerWaalsContact C-N 3.25Å; I67-L69 PolarHBondContact O-N 3.25Å; L69-T73 WeakPolarHBondContact O-CB 3.46Å; L69-T73 PolarHBondContact O-OG1 3.16Å; L69-L219 HydrophobicContact CD2-CD1 3.9Å; L69-L219 HydrophobicContact CD2-CD2 3.57Å; L69-L219 HydrophobicContact CD2-CG 4.26Å; L69-L219 HydrophobicContact CG-CD2 4.09Å; L69-V325 HydrophobicContact CD1-CG1 4.42Å; L69-Y326 HydrophobicContact CB-CE1 4.34Å; L69-Y326 HydrophobicContact CD1-CD1 3.8Å; L69-Y326 HydrophobicContact CD1-CE1 3.42Å; L69-Y326 VanDerWaalsContact CD1-CE1 3.42Å; L69-Y326 HydrophobicContact CD1-CE2 4.44Å; L69-Y326 HydrophobicContact CD1-CG 4.45Å; L69-Y326 HydrophobicContact CG-CE1 4.49Å; L69-L329 HydrophobicContact CD1-CD2 3.76Å; L69-L329 HydrophobicContact CG-CD2 4.44Å
70	F	86.4	Confident	88	Confident	2 Å²	2	2.4 Å²	2.4	1%	0.009	1%	0.012	C	C	.	.	H	α-helix	trans	-93.8	-42.9	-176.8	-67.3	-75	0	0	0	113.2	I67 I68 V215 L219 V222 L349 V359 I363 A366	I67-F70 PolarHBondContact O-N 3.5Å; I67-F70 VanDerWaalsContact O-N 3.17Å; I68-F70 PolarHBondContact O-N 3.3Å; F70-V215 HydrophobicContact CE2-CG1 4.32Å; F70-V215 HydrophobicContact CZ-CG1 4.37Å; F70-L219 HydrophobicContact CE1-CD2 3.71Å; F70-L219 HydrophobicContact CE1-CG 4.22Å; F70-L219 HydrophobicContact CZ-CD2 3.72Å; F70-L219 HydrophobicContact CZ-CG 3.87Å; F70-V222 HydrophobicContact CE1-CG2 4.46Å; F70-L349 HydrophobicContact CD1-CD1 4.36Å; F70-L349 WeakPolarHBondContact O-CD1 3.4Å; F70-V359 HydrophobicContact CD1-CG1 4.1Å; F70-I363 HydrophobicContact CB-CD1 4.06Å; F70-I363 HydrophobicContact CB-CG1 3.41Å; F70-I363 VanDerWaalsContact CB-CG1 3.41Å; F70-I363 HydrophobicContact CD2-CG1 4.11Å; F70-I363 HydrophobicContact CG-CG1 3.82Å; F70-A366 HydrophobicContact CE2-CB 4.25Å
71	L	83.7	Confident	88.2	Confident	12 Å²	12	2.4 Å²	2.4	6%	0.063	1%	0.012	C	C	.	.	H	α-helix	trans	-93.8	-27.1	-173.2	-69.8	-174.7	0	0	0	114.4	I67 A155 Y346 I363	I67-L71 HydrophobicContact CD1-CD1 3.71Å; I67-L71 HydrophobicContact CG1-CB 4.45Å; I67-L71 HydrophobicContact CG1-CD1 3.69Å; I67-L71 HydrophobicContact CG1-CG 4.1Å; I67-L71 PolarHBondContact O-N 3.09Å; L71-A155 HydrophobicContact CD1-CB 3.87Å; L71-Y346 WeakPolarHBondContact O-CB 3.42Å; L71-I363 HydrophobicContact CD1-CG2 4.42Å; L71-I363 HydrophobicContact CD2-CD1 3.82Å; L71-I363 HydrophobicContact CG-CD1 4.23Å
72	R	86.6	Confident	88.3	Confident	11 Å²	11	3 Å²	3	4%	0.042	2%	0.015	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-7.2	-168.4	-60.4	-66.5	-179.4	162.2	-7.1	113.2	I68 G74 F75 V76 E154 V286 Y346	I68-R72 HydrophobicContact CB-CB 4.11Å; I68-R72 HydrophobicContact CB-CG 4.42Å; I68-R72 HydrophobicContact CG1-CB 4.22Å; I68-R72 HydrophobicContact CG1-CG 4.06Å; I68-R72 HydrophobicContact CG2-CB 3.79Å; I68-R72 CarbonylContact O-C 3.57Å; I68-R72 WeakPolarHBondContact O-CA 3.34Å; I68-R72 PolarHBondContact O-N 3.06Å; R72-G74 VanDerWaalsContact C-N 3.3Å; R72-G74 PolarHBondContact O-N 3.38Å; R72-F75 WeakPolarHBondContact O-CB 3.36Å; R72-F75 PolarHBondContact O-N 3.41Å; R72-V76 WeakPolarHBondContact O-CG2 3.44Å; R72-V76 PolarHBondContact O-N 3.43Å; R72-E154 IonicContact NH2-OE1 3.28Å; R72-E154 PolarHBondContact NH2-OE1 3.29Å; R72-E154 IonicContact NH2-OE2 3.68Å; R72-E154 PolarHBondContact NH2-OE2 3.49Å; R72-E154 VanDerWaalsContact NH2-OE2 3.08Å; R72-V286 HydrophobicContact CB-CG1 4.29Å; R72-V286 HydrophobicContact CG-CG1 4.22Å; R72-Y346 PolarHBondContact NH1-OH 2.83Å
73	T	89.2	Confident	88.6	Confident	2 Å²	2	8.2 Å²	8.2	1%	0.012	4%	0.042	C	C	.	.	H	α-helix	trans	-57.7	-42.4	170.1	-63.9	0	0	0	0	112.1	I68 L69 V76 V77 L329 F330	I68-T73 PolarHBondContact O-N 3.28Å; I68-T73 VanDerWaalsContact O-N 3.08Å; L69-T73 WeakPolarHBondContact O-CB 3.46Å; L69-T73 PolarHBondContact O-OG1 3.16Å; T73-V76 PolarHBondContact O-N 3.05Å; T73-V77 HydrophobicContact CG2-CG2 4.5Å; T73-V77 WeakPolarHBondContact O-CG2 3.34Å; T73-V77 PolarHBondContact O-N 3.26Å; T73-V77 VanDerWaalsContact O-N 3.07Å; T73-L329 HydrophobicContact CG2-CD2 3.73Å; T73-L329 HydrophobicContact CG2-CG 3.91Å; T73-F330 HydrophobicContact CG2-CD1 3.71Å; T73-F330 HydrophobicContact CG2-CE1 3.66Å
74	G	89.4	Confident	89	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-63	-44.7	175.6	0	0	0	0	0	112.2	R72 V76 V77 G78 L342 F348	R72-G74 VanDerWaalsContact C-N 3.3Å; R72-G74 PolarHBondContact O-N 3.38Å; G74-V76 PolarHBondContact O-N 2.93Å; G74-V77 PolarHBondContact O-N 2.71Å; G74-G78 WeakPolarHBondContact O-CA 3.45Å; G74-G78 PolarHBondContact O-N 3.02Å; G74-L342 CarbonylContact C-O 3.35Å; G74-F348 VanDerWaalsContact CA-CE1 3.43Å
75	F	89.6	Confident	89.3	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-56.2	-46.2	175.3	167.9	-95.9	0	0	0	112.6	R72 H79 D271 M278 V283 V286 Y346	R72-F75 WeakPolarHBondContact O-CB 3.36Å; R72-F75 PolarHBondContact O-N 3.41Å; F75-H79 AromaticContact CD2-CD2 3.4Å; F75-H79 VanDerWaalsContact CD2-CD2 3.4Å; F75-H79 WeakPolarHBondContact CD2-CD2 3.46Å; F75-H79 AromaticContact CD2-NE2 3.56Å; F75-H79 AromaticContact CE2-CD2 3.38Å; F75-H79 WeakPolarHBondContact CE2-CD2 3.28Å; F75-H79 AromaticContact CE2-NE2 3.46Å; F75-H79 WeakPolarHBondContact CE2-NE2 3.37Å; F75-H79 PolarHBondContact O-CD2 3.18Å; F75-H79 VanDerWaalsContact O-CD2 3.27Å; F75-H79 PolarHBondContact O-N 2.84Å; F75-H79 VanDerWaalsContact O-N 3.16Å; F75-D271 HydrophobicContact CE2-CB 4.39Å; F75-M278 HydrophobicContact CE2-CG 3.86Å; F75-M278 HydrophobicContact CE2-SD 3.89Å; F75-M278 HydrophobicContact CZ-CG 3.93Å; F75-M278 HydrophobicContact CZ-SD 3.55Å; F75-M278 VanDerWaalsContact CZ-SD 3.55Å; F75-V283 HydrophobicContact CE1-CB 4.36Å; F75-V283 HydrophobicContact CE1-CG1 4.21Å; F75-V283 HydrophobicContact CE1-CG2 3.96Å; F75-V283 HydrophobicContact CZ-CG2 3.98Å; F75-V286 HydrophobicContact CD1-CG1 4.38Å; F75-V286 HydrophobicContact CE1-CB 4.24Å; F75-V286 HydrophobicContact CE1-CG1 4.21Å; F75-V286 HydrophobicContact CE1-CG2 4.43Å; F75-Y346 HydrophobicContact CB-CD1 4.18Å; F75-Y346 HydrophobicContact CB-CE1 3.84Å; F75-Y346 AromaticContact CD2-CE1 3.77Å; F75-Y346 HydrophobicContact CD2-CE1 3.77Å; F75-Y346 HydrophobicContact CG-CE1 4.17Å
76	V	91.8	Very high	89.7	Confident	1 Å²	1	12.6 Å²	12.6	1%	0.006	6%	0.064	C	C	.	.	H	α-helix	trans	-64.1	-51.4	179.2	176.4	0	0	0	0	110.9	R72 T73 G74 G78 A80 M88 V283 M287 F330	R72-V76 WeakPolarHBondContact O-CG2 3.44Å; R72-V76 PolarHBondContact O-N 3.43Å; T73-V76 PolarHBondContact O-N 3.05Å; G74-V76 PolarHBondContact O-N 2.93Å; V76-G78 PolarHBondContact O-N 3.3Å; V76-A80 WeakPolarHBondContact O-CB 3.3Å; V76-A80 PolarHBondContact O-N 3.08Å; V76-M88 HydrophobicContact CG1-SD 4.35Å; V76-V283 HydrophobicContact CB-CG1 4.22Å; V76-V283 HydrophobicContact CG1-CG1 4.08Å; V76-V283 HydrophobicContact CG2-CG1 4.06Å; V76-M287 HydrophobicContact CG1-CG 4.39Å; V76-M287 HydrophobicContact CG2-CB 3.84Å; V76-M287 HydrophobicContact CG2-CG 4.16Å; V76-F330 HydrophobicContact CB-CZ 4.24Å; V76-F330 HydrophobicContact CG1-CE2 3.82Å; V76-F330 HydrophobicContact CG1-CZ 3.79Å
77	V	93.9	Very high	90.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-66.2	-38.3	-178.8	175.2	0	0	0	0	111.5	T73 G74 G81 F330 S334 L342	T73-V77 HydrophobicContact CG2-CG2 4.5Å; T73-V77 WeakPolarHBondContact O-CG2 3.34Å; T73-V77 PolarHBondContact O-N 3.26Å; T73-V77 VanDerWaalsContact O-N 3.07Å; G74-V77 PolarHBondContact O-N 2.71Å; V77-G81 WeakPolarHBondContact O-CA 3.27Å; V77-G81 PolarHBondContact O-N 3.47Å; V77-F330 HydrophobicContact CG2-CB 4.31Å; V77-F330 HydrophobicContact CG2-CD1 4.18Å; V77-F330 HydrophobicContact CG2-CD2 4.02Å; V77-F330 HydrophobicContact CG2-CE2 4.38Å; V77-F330 HydrophobicContact CG2-CG 3.91Å; V77-S334 WeakPolarHBondContact CG1-OG 3.39Å; V77-L342 HydrophobicContact CB-CD1 4.26Å; V77-L342 HydrophobicContact CG1-CD1 3.75Å
78	G	92.4	Very high	91.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.6	-42.3	-179	0	0	0	0	0	113.3	G74 V76 R339	G74-G78 WeakPolarHBondContact O-CA 3.45Å; G74-G78 PolarHBondContact O-N 3.02Å; V76-G78 PolarHBondContact O-N 3.3Å; G78-R339 VanDerWaalsContact O-CZ 3.24Å; G78-R339 PolarHBondContact O-NE 3.36Å; G78-R339 PolarHBondContact O-NH2 3.07Å
79	H	92.9	Very high	91.8	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-85.2	-49.1	179	-70.3	-63.2	0	0	0	113.1	F75 G267 Y268 S269 V283 R339	F75-H79 AromaticContact CD2-CD2 3.4Å; F75-H79 VanDerWaalsContact CD2-CD2 3.4Å; F75-H79 WeakPolarHBondContact CD2-CD2 3.46Å; F75-H79 AromaticContact CD2-NE2 3.56Å; F75-H79 AromaticContact CE2-CD2 3.38Å; F75-H79 WeakPolarHBondContact CE2-CD2 3.28Å; F75-H79 AromaticContact CE2-NE2 3.46Å; F75-H79 WeakPolarHBondContact CE2-NE2 3.37Å; F75-H79 PolarHBondContact O-CD2 3.18Å; F75-H79 VanDerWaalsContact O-CD2 3.27Å; F75-H79 PolarHBondContact O-N 2.84Å; F75-H79 VanDerWaalsContact O-N 3.16Å; H79-G267 CarbonylContact O-C 3.5Å; H79-G267 PolarHBondContact O-N 3.22Å; H79-Y268 HydrophobicContact CB-CD1 3.97Å; H79-Y268 HydrophobicContact CB-CE1 4.3Å; H79-S269 PolarHBondContact CE1-O 3.17Å; H79-S269 PolarHBondContact CE1-OG 2.76Å; H79-S269 PolarHBondContact ND1-N 3.02Å; H79-S269 PolarHBondContact ND1-OG 3.19Å; H79-V283 HydrophobicContact CB-CG2 4.17Å; H79-R339 PolarHBondContact O-NH2 3.04Å
80	A	93.6	Very high	92.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-79.8	-24.5	-176.4	0	0	0	0	0	112.6	V76 Q84 M88 S266 V283	V76-A80 WeakPolarHBondContact O-CB 3.3Å; V76-A80 PolarHBondContact O-N 3.08Å; A80-Q84 HydrophobicContact CB-CB 4.14Å; A80-Q84 HydrophobicContact CB-CG 4.46Å; A80-Q84 VanDerWaalsContact O-CB 3.26Å; A80-Q84 WeakPolarHBondContact O-CB 3.21Å; A80-M88 HydrophobicContact CB-CE 3.81Å; A80-M88 HydrophobicContact CB-SD 4.21Å; A80-S266 VanDerWaalsContact O-CA 3.25Å; A80-S266 WeakPolarHBondContact O-CA 3.27Å; A80-S266 VanDerWaalsContact O-CB 3.28Å; A80-S266 WeakPolarHBondContact O-CB 3.37Å; A80-V283 HydrophobicContact CB-CG1 4.49Å
81	G	94.6	Very high	92.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	74.8	171.8	-167	0	0	0	0	0	112.2	V77 G85 N263 G265	V77-G81 WeakPolarHBondContact O-CA 3.27Å; V77-G81 PolarHBondContact O-N 3.47Å; G81-G85 WeakPolarHBondContact O-CA 3.35Å; G81-G85 PolarHBondContact O-N 3.09Å; G81-N263 CarbonylContact C-O 3.45Å; G81-N263 WeakPolarHBondContact CA-O 3.34Å; G81-G265 WeakPolarHBondContact CA-O 3.31Å
82	L	95.1	Very high	93.1	Very high	16 Å²	16	21.2 Å²	21.2	8%	0.084	11%	0.114	C	C	.	.	H	α-helix	trans	-64.3	-45.4	-176.8	179.3	60.8	0	0	0	112.4	G85 L86 L260 N263 F330 I331 S334	L82-G85 PolarHBondContact O-N 3.04Å; L82-L86 HydrophobicContact CD1-CD1 3.83Å; L82-L86 HydrophobicContact CD1-CG 3.91Å; L82-L86 HydrophobicContact CG-CD1 4.04Å; L82-L86 HydrophobicContact CG-CG 4.45Å; L82-L86 WeakPolarHBondContact O-CB 3.46Å; L82-L86 VanDerWaalsContact O-CG 3.3Å; L82-L86 WeakPolarHBondContact O-CG 3.4Å; L82-L86 PolarHBondContact O-N 3.24Å; L82-L260 HydrophobicContact CD2-CD1 3.74Å; L82-N263 PolarHBondContact N-O 3.33Å; L82-F330 HydrophobicContact CD1-CB 4.21Å; L82-I331 HydrophobicContact CD1-CG1 4.24Å; L82-S334 WeakPolarHBondContact CD1-OG 3.36Å
83	L	94.9	Very high	93.5	Very high	109 Å²	109	21.1 Å²	21.1	57%	0.571	11%	0.113	S	C	*	.	H	α-helix	trans	-67.1	-48.9	-174.3	-68.1	175.7	0	0	0	111.9	L86 L87 L264	L83-L86 PolarHBondContact O-N 3.44Å; L83-L87 WeakPolarHBondContact O-CB 3.44Å; L83-L87 PolarHBondContact O-N 3.45Å; L83-L264 HydrophobicContact CD1-CD2 4.37Å; L83-L264 HydrophobicContact CD1-CG 4.42Å; L83-L264 HydrophobicContact CG-CG 4.41Å; L83-L264 PolarHBondContact N-O 3.05Å
84	Q	94.4	Very high	93.8	Very high	47 Å²	47	24 Å²	24	22%	0.22	13%	0.131	C	C	.	.	H	α-helix	trans	-72.2	-33.2	178.6	-161.6	169.3	10.3	0	0	111	A80 L87 M88 S266 Y268 F280	A80-Q84 HydrophobicContact CB-CB 4.14Å; A80-Q84 HydrophobicContact CB-CG 4.46Å; A80-Q84 VanDerWaalsContact O-CB 3.26Å; A80-Q84 WeakPolarHBondContact O-CB 3.21Å; Q84-L87 WeakPolarHBondContact O-CB 3.45Å; Q84-L87 PolarHBondContact O-N 2.94Å; Q84-M88 HydrophobicContact CG-CE 4.4Å; Q84-M88 VanDerWaalsContact O-CG 3.26Å; Q84-M88 WeakPolarHBondContact O-CG 3.34Å; Q84-M88 PolarHBondContact O-N 2.78Å; Q84-S266 PolarHBondContact OE1-OG 3.45Å; Q84-Y268 PolarHBondContact NE2-OH 3.35Å; Q84-Y268 PolarHBondContact OE1-OH 3.11Å; Q84-Y268 VanDerWaalsContact OE1-OH 3.11Å; Q84-F280 HydrophobicContact CG-CD2 3.93Å; Q84-F280 HydrophobicContact CG-CE2 3.99Å
85	G	94.4	Very high	94.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.1	-46.8	172	0	0	0	0	0	112.8	G81 L82 L87 M88 V89	G81-G85 WeakPolarHBondContact O-CA 3.35Å; G81-G85 PolarHBondContact O-N 3.09Å; L82-G85 PolarHBondContact O-N 3.04Å; G85-L87 VanDerWaalsContact C-N 3.35Å; G85-L87 PolarHBondContact O-N 3.39Å; G85-M88 WeakPolarHBondContact O-CB 3.41Å; G85-M88 PolarHBondContact O-N 3.09Å; G85-V89 WeakPolarHBondContact O-CG2 3.3Å; G85-V89 PolarHBondContact O-N 2.84Å
86	L	95.1	Very high	94.3	Very high	45 Å²	45	24.1 Å²	24.1	24%	0.236	13%	0.132	C	C	.	.	H	α-helix	trans	-63.3	-40.1	174.2	-73.7	174.9	0	0	0	111.8	L82 L83 M88 V89 V90 V327 F330	L82-L86 HydrophobicContact CD1-CD1 3.83Å; L82-L86 HydrophobicContact CD1-CG 3.91Å; L82-L86 HydrophobicContact CG-CD1 4.04Å; L82-L86 HydrophobicContact CG-CG 4.45Å; L82-L86 WeakPolarHBondContact O-CB 3.46Å; L82-L86 VanDerWaalsContact O-CG 3.3Å; L82-L86 WeakPolarHBondContact O-CG 3.4Å; L82-L86 PolarHBondContact O-N 3.24Å; L83-L86 PolarHBondContact O-N 3.44Å; L86-M88 VanDerWaalsContact C-N 3.35Å; L86-M88 PolarHBondContact O-N 3.01Å; L86-V89 PolarHBondContact O-N 2.87Å; L86-V90 WeakPolarHBondContact O-CG2 3.36Å; L86-V90 PolarHBondContact O-N 3.15Å; L86-V327 HydrophobicContact CD2-CG1 4.12Å; L86-V327 HydrophobicContact CD2-CG2 4.31Å; L86-F330 HydrophobicContact CD2-CB 4.39Å
87	L	94.8	Very high	94.4	Very high	96 Å²	96	26.6 Å²	26.6	50%	0.503	15%	0.149	S	C	.	.	H	α-helix	trans	-58.9	-45.7	173.5	177.9	65.5	0	0	0	111.4	L83 Q84 G85 V89 V90 V91	L83-L87 WeakPolarHBondContact O-CB 3.44Å; L83-L87 PolarHBondContact O-N 3.45Å; Q84-L87 WeakPolarHBondContact O-CB 3.45Å; Q84-L87 PolarHBondContact O-N 2.94Å; G85-L87 VanDerWaalsContact C-N 3.35Å; G85-L87 PolarHBondContact O-N 3.39Å; L87-V89 VanDerWaalsContact C-N 3.35Å; L87-V89 PolarHBondContact O-N 2.74Å; L87-V90 PolarHBondContact O-N 3.45Å; L87-V91 HydrophobicContact CD1-CG2 4.26Å; L87-V91 VanDerWaalsContact O-CG2 3.32Å; L87-V91 WeakPolarHBondContact O-CG2 3.39Å; L87-V91 PolarHBondContact O-N 3.28Å
88	M	94.6	Very high	94.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.1	-45.7	176.7	-69.6	175.5	179.1	0	0	111.2	V76 A80 Q84 G85 L86 V91 A92 Y268 F280 V283 F284 M287	V76-M88 HydrophobicContact CG1-SD 4.35Å; A80-M88 HydrophobicContact CB-CE 3.81Å; A80-M88 HydrophobicContact CB-SD 4.21Å; Q84-M88 HydrophobicContact CG-CE 4.4Å; Q84-M88 VanDerWaalsContact O-CG 3.26Å; Q84-M88 WeakPolarHBondContact O-CG 3.34Å; Q84-M88 PolarHBondContact O-N 2.78Å; G85-M88 WeakPolarHBondContact O-CB 3.41Å; G85-M88 PolarHBondContact O-N 3.09Å; L86-M88 VanDerWaalsContact C-N 3.35Å; L86-M88 PolarHBondContact O-N 3.01Å; M88-V91 PolarHBondContact O-N 2.94Å; M88-A92 WeakPolarHBondContact O-CB 3.15Å; M88-A92 PolarHBondContact O-N 3.23Å; M88-Y268 WeakPolarHBondContact CE-OH 3.26Å; M88-F280 HydrophobicContact CE-CD2 3.2Å; M88-F280 HydrophobicContact CE-CE2 3.52Å; M88-F280 HydrophobicContact CE-CG 4.04Å; M88-F280 HydrophobicContact CG-CD2 4.24Å; M88-F280 HydrophobicContact CG-CE2 3.51Å; M88-F280 HydrophobicContact CG-CZ 4.07Å; M88-F280 HydrophobicContact SD-CE2 4.37Å; M88-V283 HydrophobicContact CE-CB 4.1Å; M88-V283 HydrophobicContact CE-CG1 4.01Å; M88-V283 HydrophobicContact SD-CG1 4.07Å; M88-F284 HydrophobicContact CB-CD2 3.94Å; M88-F284 HydrophobicContact CG-CD2 4.02Å; M88-F284 HydrophobicContact SD-CB 4.4Å; M88-M287 HydrophobicContact CB-CE 3.52Å; M88-M287 VanDerWaalsContact O-CE 3.31Å; M88-M287 WeakPolarHBondContact O-CE 3.44Å
89	V	93.7	Very high	94.6	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-46.4	177.3	173.3	0	0	0	0	110.5	G85 L86 L87 V91 A92 Y93 M287 F323 V327 F330	G85-V89 WeakPolarHBondContact O-CG2 3.3Å; G85-V89 PolarHBondContact O-N 2.84Å; L86-V89 PolarHBondContact O-N 2.87Å; L87-V89 VanDerWaalsContact C-N 3.35Å; L87-V89 PolarHBondContact O-N 2.74Å; V89-V91 PolarHBondContact O-N 3.03Å; V89-A92 PolarHBondContact O-N 2.98Å; V89-Y93 HydrophobicContact CG1-CD2 3.71Å; V89-Y93 HydrophobicContact CG1-CE2 3.93Å; V89-Y93 WeakPolarHBondContact O-CB 3.38Å; V89-Y93 VanDerWaalsContact O-CD2 3.3Å; V89-Y93 WeakPolarHBondContact O-CD2 3.34Å; V89-Y93 PolarHBondContact O-N 3.08Å; V89-M287 HydrophobicContact CG2-CE 4.34Å; V89-M287 HydrophobicContact CG2-SD 4.26Å; V89-F323 HydrophobicContact CG1-CD2 3.97Å; V89-F323 HydrophobicContact CG1-CE2 3.92Å; V89-V327 HydrophobicContact CG1-CG2 4.27Å; V89-F330 HydrophobicContact CG2-CD2 4.12Å; V89-F330 HydrophobicContact CG2-CE2 3.54Å; V89-F330 HydrophobicContact CG2-CZ 3.83Å
90	V	95.1	Very high	94.7	Very high	72 Å²	72	27.5 Å²	27.5	44%	0.436	15%	0.154	S	C	.	.	H	α-helix	trans	-60.3	-44.9	177.6	169.8	0	0	0	0	111.4	L86 L87 T94	L86-V90 WeakPolarHBondContact O-CG2 3.36Å; L86-V90 PolarHBondContact O-N 3.15Å; L87-V90 PolarHBondContact O-N 3.45Å; V90-T94 VanDerWaalsContact O-CB 3.32Å; V90-T94 WeakPolarHBondContact O-CB 3.49Å; V90-T94 PolarHBondContact O-N 3.19Å; V90-T94 PolarHBondContact O-OG1 3.09Å
91	V	94.8	Very high	94.7	Very high	45 Å²	45	29 Å²	29	27%	0.273	16%	0.162	S	C	.	.	H	α-helix	trans	-62.2	-47.7	177.2	170.3	0	0	0	0	111	L87 M88 V89 T94 I95 F284 M482	L87-V91 HydrophobicContact CD1-CG2 4.26Å; L87-V91 VanDerWaalsContact O-CG2 3.32Å; L87-V91 WeakPolarHBondContact O-CG2 3.39Å; L87-V91 PolarHBondContact O-N 3.28Å; M88-V91 PolarHBondContact O-N 2.94Å; V89-V91 PolarHBondContact O-N 3.03Å; V91-T94 PolarHBondContact O-N 2.98Å; V91-I95 HydrophobicContact CG1-CD1 4.13Å; V91-I95 WeakPolarHBondContact O-CG1 3.45Å; V91-I95 PolarHBondContact O-N 3.1Å; V91-F284 HydrophobicContact CB-CE2 4.45Å; V91-F284 HydrophobicContact CG1-CE2 4.16Å; V91-F284 HydrophobicContact CG1-CZ 4.39Å; V91-M482 HydrophobicContact CG1-CG 4.26Å; V91-M482 HydrophobicContact CG1-SD 4.22Å
92	A	94.1	Very high	94.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.4	-48.2	179.3	0	0	0	0	0	112.1	M88 V89 T94 I95 I96 F284 M287 F288	M88-A92 WeakPolarHBondContact O-CB 3.15Å; M88-A92 PolarHBondContact O-N 3.23Å; V89-A92 PolarHBondContact O-N 2.98Å; A92-T94 VanDerWaalsContact C-N 3.31Å; A92-T94 PolarHBondContact O-N 3.41Å; A92-I95 PolarHBondContact O-N 3.02Å; A92-I96 WeakPolarHBondContact O-CB 3.43Å; A92-I96 WeakPolarHBondContact O-CD1 3.45Å; A92-I96 WeakPolarHBondContact O-CG1 3.46Å; A92-I96 PolarHBondContact O-N 3.37Å; A92-F284 HydrophobicContact CB-CE2 4.13Å; A92-F284 HydrophobicContact CB-CZ 4.26Å; A92-M287 HydrophobicContact CB-CE 3.85Å; A92-M287 HydrophobicContact CB-SD 4.41Å; A92-F288 HydrophobicContact CB-CD2 3.72Å; A92-F288 HydrophobicContact CB-CE2 4.14Å
93	Y	95.1	Very high	94.4	Very high	9 Å²	9	28.7 Å²	28.7	4%	0.035	16%	0.16	C	C	.	.	H	α-helix	trans	-71.1	-25.1	179.1	-83.5	-93.9	0	0	0	113.2	M64 V89 S97 C291 V319 T322 F323 Y326	M64-Y93 HydrophobicContact CE-CE1 3.81Å; V89-Y93 HydrophobicContact CG1-CD2 3.71Å; V89-Y93 HydrophobicContact CG1-CE2 3.93Å; V89-Y93 WeakPolarHBondContact O-CB 3.38Å; V89-Y93 VanDerWaalsContact O-CD2 3.3Å; V89-Y93 WeakPolarHBondContact O-CD2 3.34Å; V89-Y93 PolarHBondContact O-N 3.08Å; Y93-S97 WeakPolarHBondContact O-CB 3.17Å; Y93-S97 PolarHBondContact O-N 3.41Å; Y93-S97 PolarHBondContact O-OG 3.3Å; Y93-C291 HydrophobicContact CE2-CB 4.21Å; Y93-C291 VanDerWaalsContact CE2-SG 3.5Å; Y93-V319 HydrophobicContact CD1-CG1 3.72Å; Y93-V319 HydrophobicContact CE1-CG1 3.92Å; Y93-V319 WeakPolarHBondContact CE1-O 3.39Å; Y93-T322 WeakPolarHBondContact OH-CB 3.36Å; Y93-T322 PolarHBondContact OH-OG1 3.22Å; Y93-F323 HydrophobicContact CD1-CB 3.65Å; Y93-F323 AromaticContact CD1-CD2 3.9Å; Y93-F323 HydrophobicContact CD1-CD2 3.9Å; Y93-F323 HydrophobicContact CD1-CG 4.17Å; Y93-F323 AromaticContact CD2-CD2 3.73Å; Y93-F323 HydrophobicContact CD2-CD2 3.73Å; Y93-F323 HydrophobicContact CE1-CB 3.52Å; Y93-F323 HydrophobicContact CE1-CD2 4.36Å; Y93-F323 HydrophobicContact CE1-CG 4.43Å; Y93-F323 HydrophobicContact CE2-CB 4.49Å; Y93-F323 HydrophobicContact CE2-CD2 4.2Å; Y93-F323 HydrophobicContact CG-CB 4.21Å; Y93-F323 AromaticContact CG-CD2 3.55Å; Y93-F323 HydrophobicContact CG-CD2 3.55Å; Y93-F323 HydrophobicContact CG-CE2 4.4Å; Y93-F323 HydrophobicContact CG-CG 4.29Å; Y93-F323 PolarHBondContact OH-N 3.18Å; Y93-Y326 HydrophobicContact CE2-CD2 4.34Å; Y93-Y326 WeakPolarHBondContact OH-CD2 3.26Å; Y93-Y326 WeakPolarHBondContact OH-CE2 3.4Å
94	T	95.3	Very high	94.2	Very high	62 Å²	62	23.5 Å²	23.5	38%	0.38	13%	0.133	S	C	.	.	H	α-helix	trans	-66.1	-49.7	170	-58.8	0	0	0	0	110.3	V90 V91 A92 I96 S97 L98	V90-T94 VanDerWaalsContact O-CB 3.32Å; V90-T94 WeakPolarHBondContact O-CB 3.49Å; V90-T94 PolarHBondContact O-N 3.19Å; V90-T94 PolarHBondContact O-OG1 3.09Å; V91-T94 PolarHBondContact O-N 2.98Å; A92-T94 VanDerWaalsContact C-N 3.31Å; A92-T94 PolarHBondContact O-N 3.41Å; T94-I96 VanDerWaalsContact C-N 3.33Å; T94-I96 PolarHBondContact O-N 3.42Å; T94-S97 PolarHBondContact O-N 2.97Å; T94-L98 HydrophobicContact CG2-CD1 4.19Å; T94-L98 VanDerWaalsContact O-CG 3.27Å; T94-L98 WeakPolarHBondContact O-CG 3.49Å; T94-L98 PolarHBondContact O-N 3.46Å
95	I	95.4	Very high	94	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.015	12%	0.123	C	C	.	.	H	α-helix	trans	-55.3	-51.6	175.6	-69.9	166.4	0	0	0	110.2	V91 A92 S97 L98 T99 F288 L439 C479 M482	V91-I95 HydrophobicContact CG1-CD1 4.13Å; V91-I95 WeakPolarHBondContact O-CG1 3.45Å; V91-I95 PolarHBondContact O-N 3.1Å; A92-I95 PolarHBondContact O-N 3.02Å; I95-S97 PolarHBondContact O-N 2.92Å; I95-L98 PolarHBondContact O-N 3.3Å; I95-T99 PolarHBondContact O-N 3.47Å; I95-T99 VanDerWaalsContact O-N 3.15Å; I95-T99 PolarHBondContact O-OG1 3.32Å; I95-F288 HydrophobicContact CG2-CE2 4.36Å; I95-F288 HydrophobicContact CG2-CZ 4.34Å; I95-L439 HydrophobicContact CG2-CD2 4.12Å; I95-C479 VanDerWaalsContact CG2-SG 3.53Å; I95-M482 HydrophobicContact CD1-CB 4.09Å; I95-M482 HydrophobicContact CD1-CG 3.57Å
96	I	94.4	Very high	93.7	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.3	-45.6	179.4	-74.9	159.9	0	0	0	111.6	A92 T94 L98 T99 V100 C291 I294 V319	A92-I96 WeakPolarHBondContact O-CB 3.43Å; A92-I96 WeakPolarHBondContact O-CD1 3.45Å; A92-I96 WeakPolarHBondContact O-CG1 3.46Å; A92-I96 PolarHBondContact O-N 3.37Å; T94-I96 VanDerWaalsContact C-N 3.33Å; T94-I96 PolarHBondContact O-N 3.42Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-L98 PolarHBondContact O-N 3.34Å; I96-T99 PolarHBondContact O-N 3.4Å; I96-V100 HydrophobicContact CG2-CG2 4.17Å; I96-V100 VanDerWaalsContact O-CG2 3.27Å; I96-V100 WeakPolarHBondContact O-CG2 3.49Å; I96-V100 PolarHBondContact O-N 2.91Å; I96-C291 HydrophobicContact CD1-CB 3.4Å; I96-C291 VanDerWaalsContact CD1-CB 3.4Å; I96-C291 WeakPolarHBondContact CD1-O 3.4Å; I96-I294 HydrophobicContact CG2-CD1 4.32Å; I96-I294 HydrophobicContact CG2-CG2 3.59Å; I96-V319 HydrophobicContact CG2-CG1 4.03Å; I96-V319 HydrophobicContact CG2-CG2 4.12Å
97	S	94.6	Very high	93.3	Very high	53 Å²	53	19.6 Å²	19.6	37%	0.371	11%	0.114	S	C	.	.	H	α-helix	trans	-61.4	-42.2	-178.9	-64	0	0	0	0	111.2	Y93 T94 I95 T99 V100 L101	Y93-S97 WeakPolarHBondContact O-CB 3.17Å; Y93-S97 PolarHBondContact O-N 3.41Å; Y93-S97 PolarHBondContact O-OG 3.3Å; T94-S97 PolarHBondContact O-N 2.97Å; I95-S97 PolarHBondContact O-N 2.92Å; S97-T99 PolarHBondContact O-N 3.27Å; S97-V100 PolarHBondContact O-N 3.41Å; S97-L101 WeakPolarHBondContact O-CG 3.22Å; S97-L101 PolarHBondContact O-N 3.38Å
98	L	95.6	Very high	93	Very high	14 Å²	14	15.6 Å²	15.6	7%	0.073	9%	0.094	C	C	.	.	H	α-helix	trans	-60.1	-46.2	176.9	-64.5	164.3	0	0	0	111.4	T94 I95 I96 V100 L101 S102 T471 L474	T94-L98 HydrophobicContact CG2-CD1 4.19Å; T94-L98 VanDerWaalsContact O-CG 3.27Å; T94-L98 WeakPolarHBondContact O-CG 3.49Å; T94-L98 PolarHBondContact O-N 3.46Å; I95-L98 PolarHBondContact O-N 3.3Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-L98 PolarHBondContact O-N 3.34Å; L98-V100 VanDerWaalsContact C-N 3.34Å; L98-V100 PolarHBondContact O-N 3.43Å; L98-L101 WeakPolarHBondContact O-CB 3.38Å; L98-L101 PolarHBondContact O-N 2.94Å; L98-S102 PolarHBondContact O-N 3.32Å; L98-T471 HydrophobicContact CD2-CG2 4.24Å; L98-L474 HydrophobicContact CD1-CB 4.26Å; L98-L474 HydrophobicContact CD1-CD2 3.55Å; L98-L474 HydrophobicContact CD1-CG 3.95Å; L98-L474 HydrophobicContact CD2-CB 4.49Å; L98-L474 HydrophobicContact CD2-CD2 3.77Å; L98-L474 HydrophobicContact CG-CD2 4.28Å
99	T	94.3	Very high	92.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-67.3	-34.3	176.6	-50	0	0	0	0	112.3	I95 I96 S97 L101 S102 I103 I294 Y442 V445 D446	I95-T99 PolarHBondContact O-N 3.47Å; I95-T99 VanDerWaalsContact O-N 3.15Å; I95-T99 PolarHBondContact O-OG1 3.32Å; I96-T99 PolarHBondContact O-N 3.4Å; S97-T99 PolarHBondContact O-N 3.27Å; T99-L101 VanDerWaalsContact C-N 3.33Å; T99-L101 PolarHBondContact O-N 3.11Å; T99-S102 WeakPolarHBondContact O-CB 3.26Å; T99-S102 PolarHBondContact O-N 2.91Å; T99-I103 HydrophobicContact CG2-CD1 4.18Å; T99-I103 WeakPolarHBondContact O-CG1 3.28Å; T99-I103 PolarHBondContact O-N 3.33Å; T99-I294 HydrophobicContact CG2-CD1 4.21Å; T99-Y442 HydrophobicContact CG2-CD1 3.88Å; T99-Y442 HydrophobicContact CG2-CG 3.9Å; T99-V445 HydrophobicContact CG2-CG1 4.46Å; T99-D446 WeakPolarHBondContact CA-OD1 3.38Å; T99-D446 PolarHBondContact OG1-OD2 2.98Å
100	V	94.1	Very high	91.5	Very high	6 Å²	6	19.4 Å²	19.4	4%	0.036	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-40	173.2	169.2	0	0	0	0	110.9	I96 S97 L98 S102 I103 C104 I294 T315 I316 V319	I96-V100 HydrophobicContact CG2-CG2 4.17Å; I96-V100 VanDerWaalsContact O-CG2 3.27Å; I96-V100 WeakPolarHBondContact O-CG2 3.49Å; I96-V100 PolarHBondContact O-N 2.91Å; S97-V100 PolarHBondContact O-N 3.41Å; L98-V100 VanDerWaalsContact C-N 3.34Å; L98-V100 PolarHBondContact O-N 3.43Å; V100-S102 VanDerWaalsContact C-N 3.3Å; V100-S102 PolarHBondContact O-N 2.8Å; V100-I103 PolarHBondContact O-N 2.95Å; V100-C104 WeakPolarHBondContact O-CB 3.48Å; V100-C104 PolarHBondContact O-N 3.49Å; V100-C104 PolarHBondContact O-SG 3.47Å; V100-I294 HydrophobicContact CG2-CB 4.24Å; V100-I294 HydrophobicContact CG2-CD1 3.78Å; V100-I294 HydrophobicContact CG2-CG2 4.28Å; V100-T315 HydrophobicContact CG1-CG2 4.06Å; V100-T315 HydrophobicContact CG2-CG2 3.89Å; V100-I316 HydrophobicContact CG1-CG1 3.92Å; V100-V319 HydrophobicContact CG2-CG2 4.24Å
101	L	94.4	Very high	90.2	Very high	31 Å²	31	20.6 Å²	20.6	16%	0.162	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-41.5	174.8	-61.6	174.2	0	0	0	111.3	S97 L98 T99 C104 A105 F464 L466 T471	S97-L101 WeakPolarHBondContact O-CG 3.22Å; S97-L101 PolarHBondContact O-N 3.38Å; L98-L101 WeakPolarHBondContact O-CB 3.38Å; L98-L101 PolarHBondContact O-N 2.94Å; T99-L101 VanDerWaalsContact C-N 3.33Å; T99-L101 PolarHBondContact O-N 3.11Å; L101-C104 WeakPolarHBondContact O-CB 3.37Å; L101-C104 PolarHBondContact O-N 2.93Å; L101-A105 PolarHBondContact O-N 2.85Å; L101-F464 HydrophobicContact CB-CE1 4.46Å; L101-F464 HydrophobicContact CD2-CE1 3.58Å; L101-F464 HydrophobicContact CD2-CZ 3.95Å; L101-L466 HydrophobicContact CD2-CB 3.82Å; L101-T471 HydrophobicContact CD1-CG2 3.97Å
102	S	92.9	Very high	88.8	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.3	-44.5	174.7	-64.4	0	0	0	0	112.5	L98 T99 V100 C104 A105 I106 D446 C472	L98-S102 PolarHBondContact O-N 3.32Å; T99-S102 WeakPolarHBondContact O-CB 3.26Å; T99-S102 PolarHBondContact O-N 2.91Å; V100-S102 VanDerWaalsContact C-N 3.3Å; V100-S102 PolarHBondContact O-N 2.8Å; S102-C104 VanDerWaalsContact C-N 3.32Å; S102-C104 PolarHBondContact O-N 2.98Å; S102-A105 WeakPolarHBondContact O-CB 3.45Å; S102-A105 PolarHBondContact O-N 3.01Å; S102-I106 WeakPolarHBondContact O-CG1 3.24Å; S102-I106 PolarHBondContact O-N 3.47Å; S102-D446 WeakPolarHBondContact CB-OD1 3.41Å; S102-D446 PolarHBondContact OG-OD1 2.94Å; S102-C472 PolarHBondContact OG-SG 2.92Å; S102-C472 VanDerWaalsContact OG-SG 3.37Å
103	I	90.7	Very high	87.4	Confident	9 Å²	9	24.8 Å²	24.8	5%	0.046	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-41.4	175.7	-66.8	164.8	0	0	0	110.6	T99 V100 A105 I106 S107 I294 M295 A298 I311 V445	T99-I103 HydrophobicContact CG2-CD1 4.18Å; T99-I103 WeakPolarHBondContact O-CG1 3.28Å; T99-I103 PolarHBondContact O-N 3.33Å; V100-I103 PolarHBondContact O-N 2.95Å; I103-A105 VanDerWaalsContact C-N 3.33Å; I103-A105 PolarHBondContact O-N 3.11Å; I103-I106 PolarHBondContact O-N 3.42Å; I103-S107 VanDerWaalsContact O-CB 3.29Å; I103-S107 WeakPolarHBondContact O-CB 3.5Å; I103-S107 PolarHBondContact O-N 3.46Å; I103-S107 PolarHBondContact O-OG 3.21Å; I103-S107 VanDerWaalsContact O-OG 3.14Å; I103-I294 HydrophobicContact CD1-CD1 3.87Å; I103-I294 HydrophobicContact CD1-CG1 4.27Å; I103-M295 HydrophobicContact CD1-CE 3.7Å; I103-M295 HydrophobicContact CD1-CG 3.84Å; I103-M295 HydrophobicContact CG1-CE 4.01Å; I103-A298 HydrophobicContact CG2-CB 4.47Å; I103-I311 HydrophobicContact CG2-CG2 4.18Å; I103-V445 HydrophobicContact CG1-CG1 4.17Å
104	C	90.8	Very high	85.6	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-43.4	175.5	-70.8	0	0	0	0	111.2	V100 L101 S102 S107 T108 P312 F464	V100-C104 WeakPolarHBondContact O-CB 3.48Å; V100-C104 PolarHBondContact O-N 3.49Å; V100-C104 PolarHBondContact O-SG 3.47Å; L101-C104 WeakPolarHBondContact O-CB 3.37Å; L101-C104 PolarHBondContact O-N 2.93Å; S102-C104 VanDerWaalsContact C-N 3.32Å; S102-C104 PolarHBondContact O-N 2.98Å; C104-S107 WeakPolarHBondContact CA-OG 3.42Å; C104-S107 PolarHBondContact O-N 3.33Å; C104-S107 PolarHBondContact O-OG 3.46Å; C104-T108 WeakPolarHBondContact O-CB 3.44Å; C104-T108 WeakPolarHBondContact O-CG2 3.32Å; C104-T108 PolarHBondContact O-N 2.87Å; C104-T108 PolarHBondContact O-OG1 3.4Å; C104-P312 HydrophobicContact CB-CB 4.2Å; C104-P312 HydrophobicContact CB-CG 4.24Å; C104-P312 VanDerWaalsContact SG-CA 3.55Å; C104-F464 HydrophobicContact CB-CB 4.47Å; C104-F464 HydrophobicContact CB-CD1 3.58Å; C104-F464 HydrophobicContact CB-CD2 4Å; C104-F464 HydrophobicContact CB-CE1 3.63Å; C104-F464 HydrophobicContact CB-CE2 4.07Å; C104-F464 HydrophobicContact CB-CG 3.76Å; C104-F464 HydrophobicContact CB-CZ 3.89Å
105	A	90.4	Very high	84.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-48.7	176.8	0	0	0	0	0	112.3	L101 S102 I103 S107 T108 N109 P462 F467	L101-A105 PolarHBondContact O-N 2.85Å; S102-A105 WeakPolarHBondContact O-CB 3.45Å; S102-A105 PolarHBondContact O-N 3.01Å; I103-A105 VanDerWaalsContact C-N 3.33Å; I103-A105 PolarHBondContact O-N 3.11Å; A105-S107 VanDerWaalsContact C-N 3.32Å; A105-S107 PolarHBondContact O-N 3.29Å; A105-T108 PolarHBondContact O-N 3.08Å; A105-T108 PolarHBondContact O-OG1 2.89Å; A105-T108 VanDerWaalsContact O-OG1 3.07Å; A105-N109 PolarHBondContact O-N 3.33Å; A105-P462 HydrophobicContact CB-CB 3.92Å; A105-F467 HydrophobicContact CB-CB 3.87Å; A105-F467 HydrophobicContact CB-CD1 3.97Å; A105-F467 HydrophobicContact CB-CD2 3.22Å; A105-F467 HydrophobicContact CB-CE1 4.32Å; A105-F467 HydrophobicContact CB-CE2 3.58Å; A105-F467 HydrophobicContact CB-CG 3.41Å; A105-F467 VanDerWaalsContact CB-CG 3.41Å; A105-F467 HydrophobicContact CB-CZ 4.14Å
106	I	87.9	Confident	83.2	Confident	10 Å²	10	24.7 Å²	24.7	5%	0.051	18%	0.176	C	C	.	.	H	α-helix	trans	-60.6	-44.6	176.4	-62.6	169.2	0	0	0	110.2	S102 I103 T108 N109 M120 I121 V445 C449	S102-I106 WeakPolarHBondContact O-CG1 3.24Å; S102-I106 PolarHBondContact O-N 3.47Å; I103-I106 PolarHBondContact O-N 3.42Å; I106-T108 PolarHBondContact O-N 2.93Å; I106-N109 WeakPolarHBondContact O-CB 3.42Å; I106-N109 PolarHBondContact O-N 3.4Å; I106-N109 VanDerWaalsContact O-N 3.1Å; I106-M120 HydrophobicContact CG2-CB 3.87Å; I106-I121 HydrophobicContact CD1-CG1 4.28Å; I106-V445 HydrophobicContact CD1-CG1 3.95Å; I106-C449 VanDerWaalsContact CD1-SG 3.52Å; I106-C449 WeakPolarHBondContact CG1-SG 3.36Å
107	S	87.2	Confident	82.2	Confident	0 Å²	0	25 Å²	25	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-70.2	-17.9	-177.8	72.2	0	0	0	0	113.9	I103 C104 A105 I112 S308	I103-S107 VanDerWaalsContact O-CB 3.29Å; I103-S107 WeakPolarHBondContact O-CB 3.5Å; I103-S107 PolarHBondContact O-N 3.46Å; I103-S107 PolarHBondContact O-OG 3.21Å; I103-S107 VanDerWaalsContact O-OG 3.14Å; C104-S107 WeakPolarHBondContact CA-OG 3.42Å; C104-S107 PolarHBondContact O-N 3.33Å; C104-S107 PolarHBondContact O-OG 3.46Å; A105-S107 VanDerWaalsContact C-N 3.32Å; A105-S107 PolarHBondContact O-N 3.29Å; S107-I112 WeakPolarHBondContact O-CD1 3.37Å; S107-S308 VanDerWaalsContact O-CA 3.29Å; S107-S308 WeakPolarHBondContact O-CA 3.43Å; S107-S308 WeakPolarHBondContact O-CB 3.26Å
108	T	88.3	Confident	81.6	Confident	13 Å²	13	22.7 Å²	22.7	8%	0.08	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	3.1	175.6	53.9	0	0	0	0	112.6	C104 A105 I106 S308 P312 T463 F464	C104-T108 WeakPolarHBondContact O-CB 3.44Å; C104-T108 WeakPolarHBondContact O-CG2 3.32Å; C104-T108 PolarHBondContact O-N 2.87Å; C104-T108 PolarHBondContact O-OG1 3.4Å; A105-T108 PolarHBondContact O-N 3.08Å; A105-T108 PolarHBondContact O-OG1 2.89Å; A105-T108 VanDerWaalsContact O-OG1 3.07Å; I106-T108 PolarHBondContact O-N 2.93Å; T108-S308 WeakPolarHBondContact CG2-O 3.47Å; T108-P312 HydrophobicContact CG2-CG 3.98Å; T108-T463 WeakPolarHBondContact CB-OG1 3.41Å; T108-F464 HydrophobicContact CG2-CB 4.1Å; T108-F464 WeakPolarHBondContact OG1-CB 3.34Å; T108-F464 PolarHBondContact OG1-N 3.47Å
109	N	83.5	Confident	80.9	Confident	24 Å²	24	24.3 Å²	24.3	13%	0.128	17%	0.167	C	C	.	.	S	Bend	trans	-91.8	105.8	177.9	-172.2	41	0	0	0	111.2	A105 I106 N459 F460 R461	A105-N109 PolarHBondContact O-N 3.33Å; I106-N109 WeakPolarHBondContact O-CB 3.42Å; I106-N109 PolarHBondContact O-N 3.4Å; I106-N109 VanDerWaalsContact O-N 3.1Å; N109-N459 PolarHBondContact OD1-O 2.89Å; N109-F460 HydrophobicContact CB-CD2 4.36Å; N109-F460 HydrophobicContact CB-CE2 4.42Å; N109-F460 WeakPolarHBondContact ND2-CD2 3.47Å; N109-F460 WeakPolarHBondContact OD1-CA 3.4Å; N109-R461 PolarHBondContact OD1-N 3.11Å
110	G	73.3	Confident	80	Confident	57 Å²	57	25 Å²	25	59%	0.588	17%	0.171	S	C	*	.	S	Bend	trans	69.1	-166.7	175.6	0	0	0	0	0	115.1	I112	G110-I112 PolarHBondContact O-N 3.17Å
111	A	67.3	Low	79.3	Confident	96 Å²	96	25 Å²	25	79%	0.793	17%	0.171	S	C	*	.			trans	-86.8	103.7	178.6	0	0	0	0	0	110.4	Q113	A111-Q113 PolarHBondContact O-N 3.09Å
112	I	66.1	Low	78.6	Confident	19 Å²	19	23.8 Å²	23.8	10%	0.097	17%	0.165	C	C	.	.			trans	-67	117.2	174.5	-58	160.1	0	0	0	109.6	S107 G110 M120 P307 I311	S107-I112 WeakPolarHBondContact O-CD1 3.37Å; G110-I112 PolarHBondContact O-N 3.17Å; I112-M120 HydrophobicContact CD1-SD 3.68Å; I112-M120 HydrophobicContact CG1-CG 4.24Å; I112-M120 HydrophobicContact CG1-SD 3.99Å; I112-M120 HydrophobicContact CG2-CG 3.65Å; I112-M120 HydrophobicContact CG2-SD 3.81Å; I112-P307 HydrophobicContact CB-CB 4.44Å; I112-P307 HydrophobicContact CB-CG 3.91Å; I112-P307 HydrophobicContact CD1-CB 3.87Å; I112-P307 HydrophobicContact CD1-CG 4.01Å; I112-P307 HydrophobicContact CG2-CB 4.45Å; I112-P307 HydrophobicContact CG2-CG 4.25Å; I112-I311 HydrophobicContact CD1-CD1 4.47Å
113	Q	62.9	Low	77.9	Confident	115 Å²	115	28.1 Å²	28.1	54%	0.537	18%	0.181	S	C	.	.			trans	-86.8	165.8	167.1	-53.2	-173.6	-4.3	0	0	111.1	A111 G115 Y119	A111-Q113 PolarHBondContact O-N 3.09Å; Q113-G115 PolarHBondContact O-N 3.03Å; Q113-G115 VanDerWaalsContact O-N 3.08Å; Q113-Y119 HydrophobicContact CB-CE1 3.62Å; Q113-Y119 HydrophobicContact CG-CE1 4.39Å; Q113-Y119 PolarHBondContact OE1-OH 2.92Å
114	G	59	Low	77	Confident	48 Å²	48	28.9 Å²	28.9	50%	0.495	19%	0.187	S	C	.	.	S	Bend	trans	-79	93.4	-170.4	0	0	0	0	0	114
115	G	63	Low	76.1	Confident	19 Å²	19	29.2 Å²	29.2	20%	0.196	19%	0.189	C	C	.	.	S	Bend	trans	-153.1	13	176.1	0	0	0	0	0	116	Q113 Y119	Q113-G115 PolarHBondContact O-N 3.03Å; Q113-G115 VanDerWaalsContact O-N 3.08Å; G115-Y119 VanDerWaalsContact CA-CB 3.46Å; G115-Y119 VanDerWaalsContact O-CB 3.27Å; G115-Y119 WeakPolarHBondContact O-CB 3.27Å
116	G	76	Confident	75.4	Confident	5 Å²	5	29.4 Å²	29.4	5%	0.052	19%	0.191	C	C	.	.	H	α-helix	trans	78.4	-166.9	177.3	0	0	0	0	0	114.4	Y119 M120 A298 S301	G116-Y119 PolarHBondContact O-N 3Å; G116-M120 WeakPolarHBondContact O-CG 3.49Å; G116-M120 PolarHBondContact O-N 3.28Å; G116-A298 CarbonylContact C-O 3.6Å; G116-A298 WeakPolarHBondContact CA-O 3.19Å; G116-S301 WeakPolarHBondContact CA-OG 3.26Å; G116-S301 PolarHBondContact N-OG 3.39Å; G116-S301 VanDerWaalsContact N-OG 3.08Å
117	A	73.2	Confident	74.9	Confident	6 Å²	6	29.9 Å²	29.9	5%	0.05	20%	0.195	C	C	.	.	H	α-helix	trans	-64.8	-39.5	-178.2	0	0	0	0	0	112.8	Y119 M120 I121 M295 A298 N299	A117-Y119 PolarHBondContact O-N 2.87Å; A117-M120 HydrophobicContact CB-CE 4.35Å; A117-M120 PolarHBondContact O-N 3.36Å; A117-I121 WeakPolarHBondContact O-CD1 3.4Å; A117-I121 VanDerWaalsContact O-CG1 3.29Å; A117-I121 WeakPolarHBondContact O-CG1 3.5Å; A117-I121 PolarHBondContact O-N 3.19Å; A117-I121 VanDerWaalsContact O-N 3.15Å; A117-M295 HydrophobicContact CB-SD 4.35Å; A117-A298 HydrophobicContact CB-CB 3.98Å; A117-A298 PolarHBondContact N-O 3.22Å; A117-N299 WeakPolarHBondContact CB-OD1 3.37Å
118	Y	83.6	Confident	74.7	Confident	5 Å²	5	31.1 Å²	31.1	2%	0.02	20%	0.201	C	C	.	.	H	α-helix	trans	-58	-49.9	176	164.8	-99.3	0	0	0	112	M120 I121 S122 G130 A384 L385 D388 L390	Y118-M120 VanDerWaalsContact C-N 3.28Å; Y118-M120 PolarHBondContact O-N 2.91Å; Y118-I121 CarbonylContact O-C 3.36Å; Y118-I121 PolarHBondContact O-N 3.31Å; Y118-S122 PolarHBondContact O-N 3.24Å; Y118-S122 PolarHBondContact O-OG 3Å; Y118-G130 WeakPolarHBondContact CE2-O 3.31Å; Y118-A384 HydrophobicContact CD1-CB 3.47Å; Y118-A384 VanDerWaalsContact CD1-CB 3.47Å; Y118-A384 HydrophobicContact CE1-CB 4Å; Y118-L385 HydrophobicContact CD1-CG 4.45Å; Y118-L385 HydrophobicContact CD2-CD2 3.92Å; Y118-L385 HydrophobicContact CD2-CG 4.13Å; Y118-L385 HydrophobicContact CE1-CD2 4.25Å; Y118-L385 HydrophobicContact CE1-CG 4.23Å; Y118-L385 HydrophobicContact CE2-CD2 3.25Å; Y118-L385 HydrophobicContact CE2-CG 3.85Å; Y118-L385 HydrophobicContact CG-CG 4.39Å; Y118-L385 VanDerWaalsContact CZ-CD2 3.45Å; Y118-D388 WeakPolarHBondContact CE1-OD2 3.48Å; Y118-D388 VanDerWaalsContact CZ-OD2 3.26Å; Y118-D388 PolarHBondContact OH-OD2 3.27Å; Y118-L390 VanDerWaalsContact OH-CD1 3.25Å; Y118-L390 WeakPolarHBondContact OH-CD1 3.46Å
119	Y	79.5	Confident	74.3	Confident	47 Å²	47	34.2 Å²	34.2	18%	0.184	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-38.9	-178.8	-177.3	-86.4	0	0	0	112.2	Q113 G115 G116 A117 I121 S122 R123	Q113-Y119 HydrophobicContact CB-CE1 3.62Å; Q113-Y119 HydrophobicContact CG-CE1 4.39Å; Q113-Y119 PolarHBondContact OE1-OH 2.92Å; G115-Y119 VanDerWaalsContact CA-CB 3.46Å; G115-Y119 VanDerWaalsContact O-CB 3.27Å; G115-Y119 WeakPolarHBondContact O-CB 3.27Å; G116-Y119 PolarHBondContact O-N 3Å; A117-Y119 PolarHBondContact O-N 2.87Å; Y119-I121 VanDerWaalsContact C-N 3.3Å; Y119-I121 PolarHBondContact O-N 3.07Å; Y119-S122 PolarHBondContact O-OG 2.81Å; Y119-R123 HydrophobicContact CD1-CG 4.08Å; Y119-R123 HydrophobicContact CD2-CG 4.25Å; Y119-R123 HydrophobicContact CE1-CG 3.74Å; Y119-R123 HydrophobicContact CE2-CG 3.97Å; Y119-R123 HydrophobicContact CG-CG 4.3Å; Y119-R123 WeakPolarHBondContact O-CB 3.46Å; Y119-R123 WeakPolarHBondContact O-CG 3.44Å; Y119-R123 PolarHBondContact O-N 3.47Å; Y119-R123 VanDerWaalsContact O-N 3.13Å
120	M	77	Confident	74.4	Confident	14 Å²	14	33.1 Å²	33.1	7%	0.069	21%	0.207	C	C	.	.	H	α-helix	trans	-61.8	-38.8	175.2	-68.5	-172	-68.6	0	0	112.2	I106 I112 G116 A117 Y118 S124 A298 I311	I106-M120 HydrophobicContact CG2-CB 3.87Å; I112-M120 HydrophobicContact CD1-SD 3.68Å; I112-M120 HydrophobicContact CG1-CG 4.24Å; I112-M120 HydrophobicContact CG1-SD 3.99Å; I112-M120 HydrophobicContact CG2-CG 3.65Å; I112-M120 HydrophobicContact CG2-SD 3.81Å; G116-M120 WeakPolarHBondContact O-CG 3.49Å; G116-M120 PolarHBondContact O-N 3.28Å; A117-M120 HydrophobicContact CB-CE 4.35Å; A117-M120 PolarHBondContact O-N 3.36Å; Y118-M120 VanDerWaalsContact C-N 3.28Å; Y118-M120 PolarHBondContact O-N 2.91Å; M120-S124 PolarHBondContact O-OG 3.31Å; M120-A298 HydrophobicContact CE-CB 3.81Å; M120-I311 HydrophobicContact CE-CD1 4.02Å; M120-I311 HydrophobicContact SD-CD1 4.01Å
121	I	78.6	Confident	75.1	Confident	7 Å²	7	30.4 Å²	30.4	4%	0.036	18%	0.179	C	C	.	.	H	α-helix	trans	-75.2	-49.4	179.5	-64.1	165.1	0	0	0	110.9	I106 A117 Y118 Y119 R123 S124 L125 I133 F137 V445	I106-I121 HydrophobicContact CD1-CG1 4.28Å; A117-I121 WeakPolarHBondContact O-CD1 3.4Å; A117-I121 VanDerWaalsContact O-CG1 3.29Å; A117-I121 WeakPolarHBondContact O-CG1 3.5Å; A117-I121 PolarHBondContact O-N 3.19Å; A117-I121 VanDerWaalsContact O-N 3.15Å; Y118-I121 CarbonylContact O-C 3.36Å; Y118-I121 PolarHBondContact O-N 3.31Å; Y119-I121 VanDerWaalsContact C-N 3.3Å; Y119-I121 PolarHBondContact O-N 3.07Å; I121-R123 VanDerWaalsContact C-N 3.33Å; I121-R123 PolarHBondContact O-N 3.48Å; I121-S124 PolarHBondContact O-N 3.34Å; I121-S124 VanDerWaalsContact O-N 3.11Å; I121-L125 HydrophobicContact CG2-CD1 3.58Å; I121-L125 HydrophobicContact CG2-CG 4.34Å; I121-L125 PolarHBondContact O-N 2.84Å; I121-I133 HydrophobicContact CD1-CG2 4.44Å; I121-I133 HydrophobicContact CG2-CD1 4.47Å; I121-I133 HydrophobicContact CG2-CG2 4.43Å; I121-F137 HydrophobicContact CD1-CE2 4.31Å; I121-V445 HydrophobicContact CD1-CG2 3.92Å
122	S	79.9	Confident	76.1	Confident	5 Å²	5	25.8 Å²	25.8	4%	0.035	14%	0.141	C	C	.	.	H	α-helix	trans	-65.4	-35	-174.9	70.8	0	0	0	0	112.7	Y118 Y119 S124 G126	Y118-S122 PolarHBondContact O-N 3.24Å; Y118-S122 PolarHBondContact O-OG 3Å; Y119-S122 PolarHBondContact O-OG 2.81Å; S122-S124 VanDerWaalsContact C-N 3.29Å; S122-S124 PolarHBondContact O-N 2.96Å; S122-G126 CarbonylContact O-C 3.58Å; S122-G126 WeakPolarHBondContact O-CA 3.15Å; S122-G126 PolarHBondContact O-N 3.13Å
123	R	77.8	Confident	77.1	Confident	91 Å²	91	25.3 Å²	25.3	34%	0.343	14%	0.139	S	C	.	.	H	α-helix	trans	-74.3	-21.6	176.3	-63.3	-68.7	147.1	175.3	-2.2	113.4	Y119 I121 D388 W514	Y119-R123 HydrophobicContact CD1-CG 4.08Å; Y119-R123 HydrophobicContact CD2-CG 4.25Å; Y119-R123 HydrophobicContact CE1-CG 3.74Å; Y119-R123 HydrophobicContact CE2-CG 3.97Å; Y119-R123 HydrophobicContact CG-CG 4.3Å; Y119-R123 WeakPolarHBondContact O-CB 3.46Å; Y119-R123 WeakPolarHBondContact O-CG 3.44Å; Y119-R123 PolarHBondContact O-N 3.47Å; Y119-R123 VanDerWaalsContact O-N 3.13Å; I121-R123 VanDerWaalsContact C-N 3.33Å; I121-R123 PolarHBondContact O-N 3.48Å; R123-D388 IonicContact CZ-OD1 3.03Å; R123-D388 IonicContact NH2-OD1 3.59Å; R123-D388 PolarHBondContact NH2-OD1 2.84Å; R123-W514 VanDerWaalsContact NH1-CG 3.25Å
124	S	71.8	Confident	78.3	Confident	26 Å²	26	20 Å²	20	18%	0.182	11%	0.114	C	C	.	.	H	α-helix	trans	-86.5	-41.3	175.7	-56.5	0	0	0	0	111.6	M120 I121 S122 L452	M120-S124 PolarHBondContact O-OG 3.31Å; I121-S124 PolarHBondContact O-N 3.34Å; I121-S124 VanDerWaalsContact O-N 3.11Å; S122-S124 VanDerWaalsContact C-N 3.29Å; S122-S124 PolarHBondContact O-N 2.96Å; S124-L452 WeakPolarHBondContact O-CD2 3.46Å
125	L	72	Confident	79.8	Confident	6 Å²	6	19 Å²	19	3%	0.031	10%	0.098	C	C	.	.	H	α-helix	trans	-98	-16.7	-174.5	-59.6	175.5	0	0	0	115	I121 F129 I133 A448 L452 I517	I121-L125 HydrophobicContact CG2-CD1 3.58Å; I121-L125 HydrophobicContact CG2-CG 4.34Å; I121-L125 PolarHBondContact O-N 2.84Å; L125-F129 HydrophobicContact CB-CB 3.81Å; L125-F129 HydrophobicContact CD1-CB 3.98Å; L125-I133 HydrophobicContact CD1-CD1 3.88Å; L125-A448 HydrophobicContact CD1-CB 3.18Å; L125-A448 HydrophobicContact CD2-CB 3.63Å; L125-A448 HydrophobicContact CG-CB 3.84Å; L125-L452 HydrophobicContact CD2-CD1 3.78Å; L125-L452 HydrophobicContact CD2-CG 3.9Å; L125-I517 HydrophobicContact CD2-CD1 3.75Å; L125-I517 WeakPolarHBondContact O-CB 3.38Å; L125-I517 WeakPolarHBondContact O-CG2 3.27Å
126	G	75.8	Confident	81	Confident	5 Å²	5	18.3 Å²	18.3	5%	0.052	9%	0.089	C	C	.	.			trans	90.8	171.8	-168.7	0	0	0	0	0	113.5	S122 E128 G130	S122-G126 CarbonylContact O-C 3.58Å; S122-G126 WeakPolarHBondContact O-CA 3.15Å; S122-G126 PolarHBondContact O-N 3.13Å; G126-E128 PolarHBondContact O-N 3.13Å; G126-G130 WeakPolarHBondContact O-CA 3.41Å; G126-G130 PolarHBondContact O-N 3.4Å
127	P	77.8	Confident	81.6	Confident	19 Å²	19	18.5 Å²	18.5	12%	0.123	9%	0.089	C	C	.	.	H	α-helix	trans	-66.7	-36.7	-169.4	23.5	-33.1	0	0	0	114.2	G131 L390 Y516	P127-G131 WeakPolarHBondContact O-CA 3.43Å; P127-G131 PolarHBondContact O-N 3.25Å; P127-L390 HydrophobicContact CB-CD2 3.86Å; P127-L390 WeakPolarHBondContact O-CD2 3.27Å; P127-Y516 HydrophobicContact CG-CD1 4.28Å; P127-Y516 HydrophobicContact CG-CE1 3.77Å
128	E	82.6	Confident	82.4	Confident	27 Å²	27	18.5 Å²	18.5	13%	0.126	9%	0.088	C	C	.	.	H	α-helix	trans	-64.7	-55.8	-176.5	-58.8	174.2	179.1	0	0	112.1	G126 S132 H506	G126-E128 PolarHBondContact O-N 3.13Å; E128-S132 WeakPolarHBondContact O-CB 3.36Å; E128-S132 PolarHBondContact O-N 3.1Å; E128-S132 PolarHBondContact O-OG 3.02Å; E128-H506 IonicContact OE1-CE1 3.79Å; E128-H506 IonicContact OE1-CG 2.66Å; E128-H506 IonicContact OE1-ND1 2.71Å; E128-H506 PolarHBondContact OE1-ND1 3Å; E128-H506 IonicContact OE2-ND1 3.78Å; E128-H506 PolarHBondContact OE2-ND1 3.38Å
129	F	80.3	Confident	82.7	Confident	78 Å²	78	20.1 Å²	20.1	34%	0.342	10%	0.097	S	C	.	.	H	α-helix	trans	-69.6	-45.4	178	-73	-82.9	0	0	0	111	L125 G131 I133 L502 I517	L125-F129 HydrophobicContact CB-CB 3.81Å; L125-F129 HydrophobicContact CD1-CB 3.98Å; F129-G131 PolarHBondContact O-N 3.34Å; F129-I133 WeakPolarHBondContact O-CB 3.46Å; F129-I133 WeakPolarHBondContact O-CD1 3.48Å; F129-I133 WeakPolarHBondContact O-CG1 3.18Å; F129-I133 PolarHBondContact O-N 3.36Å; F129-I133 VanDerWaalsContact O-N 3.08Å; F129-L502 HydrophobicContact CD1-CD2 3.8Å; F129-L502 HydrophobicContact CE1-CD2 4.16Å; F129-L502 HydrophobicContact CG-CD2 4.24Å; F129-I517 HydrophobicContact CD2-CG2 4.22Å; F129-I517 HydrophobicContact CE2-CG2 4.41Å
130	G	85.3	Confident	83.3	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-56.3	-52.3	176.9	0	0	0	0	0	112.2	Y118 G126 S132 I133 G134	Y118-G130 WeakPolarHBondContact CE2-O 3.31Å; G126-G130 WeakPolarHBondContact O-CA 3.41Å; G126-G130 PolarHBondContact O-N 3.4Å; G130-S132 PolarHBondContact O-N 2.92Å; G130-I133 PolarHBondContact O-N 2.94Å; G130-G134 PolarHBondContact O-N 3.39Å
131	G	87.3	Confident	84	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.7	-46.1	-177.9	0	0	0	0	0	113.1	P127 F129 G134 L135	P127-G131 WeakPolarHBondContact O-CA 3.43Å; P127-G131 PolarHBondContact O-N 3.25Å; F129-G131 PolarHBondContact O-N 3.34Å; G131-G134 PolarHBondContact O-N 2.92Å; G131-L135 WeakPolarHBondContact O-CB 3.33Å; G131-L135 PolarHBondContact O-N 3.08Å
132	S	88.3	Confident	84.7	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.5	-45.9	-180	-55.5	0	0	0	0	112	E128 G130 L135 M136 L501 L502	E128-S132 WeakPolarHBondContact O-CB 3.36Å; E128-S132 PolarHBondContact O-N 3.1Å; E128-S132 PolarHBondContact O-OG 3.02Å; G130-S132 PolarHBondContact O-N 2.92Å; S132-L135 PolarHBondContact O-N 3.17Å; S132-M136 PolarHBondContact O-N 3.19Å; S132-M136 VanDerWaalsContact O-N 3.16Å; S132-L501 PolarHBondContact OG-O 3.12Å; S132-L502 VanDerWaalsContact OG-CA 3.27Å; S132-L502 WeakPolarHBondContact OG-CA 3.21Å; S132-L502 WeakPolarHBondContact OG-CD2 3.46Å; S132-L502 PolarHBondContact OG-N 3.03Å
133	I	87.8	Confident	85.3	Confident	9 Å²	9	19.4 Å²	19.4	5%	0.046	9%	0.094	C	C	.	.	H	α-helix	trans	-66	-42.5	177.8	-64.9	174.3	0	0	0	110.3	I121 L125 F129 G130 L135 M136 F137 A444	I121-I133 HydrophobicContact CD1-CG2 4.44Å; I121-I133 HydrophobicContact CG2-CD1 4.47Å; I121-I133 HydrophobicContact CG2-CG2 4.43Å; L125-I133 HydrophobicContact CD1-CD1 3.88Å; F129-I133 WeakPolarHBondContact O-CB 3.46Å; F129-I133 WeakPolarHBondContact O-CD1 3.48Å; F129-I133 WeakPolarHBondContact O-CG1 3.18Å; F129-I133 PolarHBondContact O-N 3.36Å; F129-I133 VanDerWaalsContact O-N 3.08Å; G130-I133 PolarHBondContact O-N 2.94Å; I133-L135 PolarHBondContact O-N 3.31Å; I133-M136 PolarHBondContact O-N 2.98Å; I133-F137 HydrophobicContact CG2-CD2 3.7Å; I133-F137 HydrophobicContact CG2-CE2 3.55Å; I133-F137 VanDerWaalsContact O-CD2 3.28Å; I133-F137 WeakPolarHBondContact O-CD2 3.4Å; I133-F137 PolarHBondContact O-N 3.34Å; I133-A444 HydrophobicContact CD1-CB 3.86Å; I133-A444 HydrophobicContact CG1-CB 3.74Å; I133-A444 HydrophobicContact CG2-CB 4.21Å
134	G	88.9	Confident	85.9	Confident	2 Å²	2	15 Å²	15	2%	0.021	8%	0.077	C	C	.	.	H	α-helix	trans	-57.7	-46.5	176.1	0	0	0	0	0	112.8	G130 G131 M136 F137 F138 I381	G130-G134 PolarHBondContact O-N 3.39Å; G131-G134 PolarHBondContact O-N 2.92Å; G134-M136 VanDerWaalsContact C-N 3.34Å; G134-M136 PolarHBondContact O-N 3.45Å; G134-F137 PolarHBondContact O-N 3.19Å; G134-F138 WeakPolarHBondContact O-CB 3.41Å; G134-F138 PolarHBondContact O-N 2.9Å; G134-I381 WeakPolarHBondContact O-CG2 3.27Å
135	L	89.1	Confident	86.9	Confident	29 Å²	29	13.9 Å²	13.9	15%	0.152	7%	0.069	C	C	.	.	H	α-helix	trans	-66.3	-36.8	179.2	-168.6	68.9	0	0	0	111.8	G131 S132 I133 F138 L139 L385 F391 L501	G131-L135 WeakPolarHBondContact O-CB 3.33Å; G131-L135 PolarHBondContact O-N 3.08Å; S132-L135 PolarHBondContact O-N 3.17Å; I133-L135 PolarHBondContact O-N 3.31Å; L135-F138 HydrophobicContact CD1-CD1 4.01Å; L135-F138 WeakPolarHBondContact O-CB 3.41Å; L135-F138 PolarHBondContact O-N 3.44Å; L135-L139 WeakPolarHBondContact O-CG 3.22Å; L135-L139 PolarHBondContact O-N 3.47Å; L135-L385 HydrophobicContact CD1-CD1 4.49Å; L135-F391 HydrophobicContact CD2-CE1 4.36Å; L135-F391 HydrophobicContact CD2-CZ 3.93Å; L135-L501 HydrophobicContact CB-CD1 4.5Å; L135-L501 HydrophobicContact CD2-CD1 3.8Å; L135-L501 HydrophobicContact CD2-CD2 3.54Å; L135-L501 HydrophobicContact CD2-CG 4.32Å; L135-L501 HydrophobicContact CG-CD1 4.5Å
136	M	89	Confident	87.9	Confident	3 Å²	3	13.6 Å²	13.6	2%	0.015	7%	0.068	C	C	.	.	H	α-helix	trans	-62.9	-44.4	173.2	-78.2	-66.1	172.1	0	0	112.4	S132 I133 G134 F138 L139 A140 L440 L497 L498 L501	S132-M136 PolarHBondContact O-N 3.19Å; S132-M136 VanDerWaalsContact O-N 3.16Å; I133-M136 PolarHBondContact O-N 2.98Å; G134-M136 VanDerWaalsContact C-N 3.34Å; G134-M136 PolarHBondContact O-N 3.45Å; M136-F138 VanDerWaalsContact C-N 3.3Å; M136-F138 PolarHBondContact O-N 2.85Å; M136-L139 PolarHBondContact O-N 3.33Å; M136-A140 WeakPolarHBondContact O-CB 3.38Å; M136-A140 PolarHBondContact O-N 2.93Å; M136-L440 HydrophobicContact SD-CD2 4.25Å; M136-L497 HydrophobicContact CE-CB 3.77Å; M136-L497 HydrophobicContact CE-CD2 3.55Å; M136-L497 HydrophobicContact CE-CG 3.45Å; M136-L497 VanDerWaalsContact CE-CG 3.45Å; M136-L497 HydrophobicContact SD-CD2 4.41Å; M136-L498 HydrophobicContact CE-CB 3.84Å; M136-L498 VanDerWaalsContact CE-N 3.32Å; M136-L498 HydrophobicContact CG-CD1 3.99Å; M136-L501 HydrophobicContact CE-CD1 3.74Å
137	F	87.3	Confident	88.6	Confident	9 Å²	9	13.8 Å²	13.8	4%	0.039	7%	0.067	C	C	.	.	H	α-helix	trans	-62.8	-38.7	174.4	-86.3	-65	0	0	0	112.6	I121 I133 G134 A140 K141 M295 I381 A441 Y442 V445	I121-F137 HydrophobicContact CD1-CE2 4.31Å; I133-F137 HydrophobicContact CG2-CD2 3.7Å; I133-F137 HydrophobicContact CG2-CE2 3.55Å; I133-F137 VanDerWaalsContact O-CD2 3.28Å; I133-F137 WeakPolarHBondContact O-CD2 3.4Å; I133-F137 PolarHBondContact O-N 3.34Å; G134-F137 PolarHBondContact O-N 3.19Å; F137-A140 PolarHBondContact O-N 3.47Å; F137-K141 WeakPolarHBondContact O-CB 3.47Å; F137-K141 VanDerWaalsContact O-CG 3.31Å; F137-K141 WeakPolarHBondContact O-CG 3.39Å; F137-K141 PolarHBondContact O-N 2.96Å; F137-M295 HydrophobicContact CD1-SD 3.75Å; F137-M295 HydrophobicContact CE1-CE 3.63Å; F137-M295 HydrophobicContact CE1-SD 3.23Å; F137-M295 WeakPolarHBondContact CE1-SD 3.06Å; F137-M295 HydrophobicContact CE2-CE 3.86Å; F137-M295 HydrophobicContact CE2-SD 4.1Å; F137-M295 HydrophobicContact CG-SD 4.38Å; F137-M295 HydrophobicContact CZ-CE 3.2Å; F137-M295 HydrophobicContact CZ-SD 3.44Å; F137-M295 WeakPolarHBondContact CZ-SD 3.26Å; F137-I381 HydrophobicContact CB-CD1 4.09Å; F137-A441 HydrophobicContact CD1-CB 3.5Å; F137-A441 VanDerWaalsContact CD1-CB 3.5Å; F137-A441 HydrophobicContact CD2-CB 3.97Å; F137-A441 HydrophobicContact CE1-CB 3.19Å; F137-A441 HydrophobicContact CE2-CB 3.71Å; F137-A441 HydrophobicContact CG-CB 3.86Å; F137-A441 HydrophobicContact CZ-CB 3.3Å; F137-A441 WeakPolarHBondContact CZ-O 3.02Å; F137-Y442 HydrophobicContact CE1-CD1 4.1Å; F137-Y442 HydrophobicContact CE1-CE1 4.14Å; F137-Y442 HydrophobicContact CZ-CD1 4.29Å; F137-V445 HydrophobicContact CE2-CG2 3.53Å; F137-V445 HydrophobicContact CZ-CG2 3.55Å
138	F	91	Very high	89.2	Confident	7 Å²	7	13 Å²	13	3%	0.031	6%	0.062	C	C	.	.	H	α-helix	trans	-59	-51.2	174.5	167.8	-102.4	0	0	0	111.3	G134 L135 M136 A140 K141 V142 A378 I381 L382 T414 L417	G134-F138 WeakPolarHBondContact O-CB 3.41Å; G134-F138 PolarHBondContact O-N 2.9Å; L135-F138 HydrophobicContact CD1-CD1 4.01Å; L135-F138 WeakPolarHBondContact O-CB 3.41Å; L135-F138 PolarHBondContact O-N 3.44Å; M136-F138 VanDerWaalsContact C-N 3.3Å; M136-F138 PolarHBondContact O-N 2.85Å; F138-A140 PolarHBondContact O-N 3.15Å; F138-K141 PolarHBondContact O-N 3.38Å; F138-V142 HydrophobicContact CD2-CG2 4.36Å; F138-V142 HydrophobicContact CE1-CG2 4.18Å; F138-V142 HydrophobicContact CE2-CG2 4Å; F138-V142 HydrophobicContact CZ-CG2 3.9Å; F138-V142 WeakPolarHBondContact O-CG2 3.42Å; F138-V142 PolarHBondContact O-N 2.88Å; F138-A378 HydrophobicContact CD2-CB 4.01Å; F138-A378 WeakPolarHBondContact CD2-O 3.32Å; F138-A378 HydrophobicContact CE2-CB 4.23Å; F138-I381 HydrophobicContact CB-CG2 4.01Å; F138-L382 HydrophobicContact CD2-CB 3.81Å; F138-L382 HydrophobicContact CD2-CD1 4.35Å; F138-L382 HydrophobicContact CE1-CD1 4.34Å; F138-L382 HydrophobicContact CE2-CB 3.6Å; F138-L382 HydrophobicContact CE2-CD1 3.96Å; F138-L382 HydrophobicContact CE2-CD2 3.73Å; F138-L382 HydrophobicContact CE2-CG 3.96Å; F138-L382 HydrophobicContact CZ-CB 4.4Å; F138-L382 HydrophobicContact CZ-CD1 3.95Å; F138-L382 HydrophobicContact CZ-CD2 3.86Å; F138-L382 HydrophobicContact CZ-CG 4.29Å; F138-T414 HydrophobicContact CD2-CG2 4.35Å; F138-T414 HydrophobicContact CE2-CG2 3.44Å; F138-T414 VanDerWaalsContact CE2-CG2 3.44Å; F138-T414 HydrophobicContact CZ-CG2 4.16Å; F138-L417 HydrophobicContact CE1-CD1 3.61Å; F138-L417 HydrophobicContact CZ-CD1 3.59Å
139	L	90.8	Very high	89.6	Confident	39 Å²	39	11.7 Å²	11.7	20%	0.204	6%	0.056	C	C	.	.	H	α-helix	trans	-59.6	-48.2	177.2	-69.4	173.8	0	0	0	111.1	L135 M136 K141 V142 F143 L497	L135-L139 WeakPolarHBondContact O-CG 3.22Å; L135-L139 PolarHBondContact O-N 3.47Å; M136-L139 PolarHBondContact O-N 3.33Å; L139-K141 PolarHBondContact O-N 3.24Å; L139-V142 PolarHBondContact O-N 3.01Å; L139-F143 VanDerWaalsContact O-CD2 3.3Å; L139-F143 WeakPolarHBondContact O-CD2 3.43Å; L139-F143 PolarHBondContact O-N 3.46Å; L139-L497 HydrophobicContact CD1-CD2 4.35Å
140	A	90.8	Very high	90.1	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-52.3	-43.1	177	0	0	0	0	0	112.2	M136 F137 F138 A144 F437 Y438	M136-A140 WeakPolarHBondContact O-CB 3.38Å; M136-A140 PolarHBondContact O-N 2.93Å; F137-A140 PolarHBondContact O-N 3.47Å; F138-A140 PolarHBondContact O-N 3.15Å; A140-A144 VanDerWaalsContact O-CB 3.25Å; A140-A144 WeakPolarHBondContact O-CB 3.48Å; A140-A144 PolarHBondContact O-N 3.43Å; A140-F437 HydrophobicContact CB-CB 3.75Å; A140-Y438 HydrophobicContact CB-CD1 4.21Å; A140-Y438 HydrophobicContact CB-CD2 4.48Å; A140-Y438 HydrophobicContact CB-CE1 4.23Å; A140-Y438 HydrophobicContact CB-CG 4.33Å
141	K	91.3	Very high	90.2	Very high	3 Å²	3	8.5 Å²	8.5	1%	0.013	4%	0.043	C	C	.	.	H	α-helix	trans	-71.1	-37	179.2	-72.8	-77.8	172.6	-161.5	0	113.1	F137 F138 L139 A144 C145 A374 A378 Y438	F137-K141 WeakPolarHBondContact O-CB 3.47Å; F137-K141 VanDerWaalsContact O-CG 3.31Å; F137-K141 WeakPolarHBondContact O-CG 3.39Å; F137-K141 PolarHBondContact O-N 2.96Å; F138-K141 PolarHBondContact O-N 3.38Å; L139-K141 PolarHBondContact O-N 3.24Å; K141-A144 PolarHBondContact O-N 3.26Å; K141-C145 WeakPolarHBondContact O-CB 3.32Å; K141-C145 PolarHBondContact O-N 3.38Å; K141-A374 HydrophobicContact CD-CB 4.35Å; K141-A378 HydrophobicContact CB-CB 3.73Å; K141-Y438 WeakPolarHBondContact CD-OH 3.25Å; K141-Y438 VanDerWaalsContact CE-OH 3.29Å; K141-Y438 WeakPolarHBondContact CE-OH 3.49Å; K141-Y438 PolarHBondContact NZ-OH 3.44Å
142	V	93.8	Very high	90.3	Very high	4 Å²	4	9.1 Å²	9.1	2%	0.024	5%	0.046	C	C	.	.	H	α-helix	trans	-63.2	-49	175.5	168.3	0	0	0	0	110.8	F138 L139 A144 C145 G146 A378 T414 L417 A418 V421	F138-V142 HydrophobicContact CD2-CG2 4.36Å; F138-V142 HydrophobicContact CE1-CG2 4.18Å; F138-V142 HydrophobicContact CE2-CG2 4Å; F138-V142 HydrophobicContact CZ-CG2 3.9Å; F138-V142 WeakPolarHBondContact O-CG2 3.42Å; F138-V142 PolarHBondContact O-N 2.88Å; L139-V142 PolarHBondContact O-N 3.01Å; V142-A144 PolarHBondContact O-N 3.46Å; V142-C145 WeakPolarHBondContact O-CB 3.41Å; V142-C145 PolarHBondContact O-N 3.37Å; V142-G146 PolarHBondContact O-N 2.93Å; V142-A378 HydrophobicContact CG2-CB 4.24Å; V142-T414 HydrophobicContact CG2-CG2 4.46Å; V142-L417 HydrophobicContact CG1-CB 3.61Å; V142-L417 HydrophobicContact CG2-CB 4.45Å; V142-A418 HydrophobicContact CG1-CB 4.44Å; V142-V421 HydrophobicContact CG1-CG2 4.33Å
143	F	92.2	Very high	90.4	Very high	50 Å²	50	9.2 Å²	9.2	22%	0.219	5%	0.046	C	C	.	.	H	α-helix	trans	-65.1	-39.5	177.9	-78.3	-90.5	0	0	0	111.9	L139 C145 G146 E147 V421 L433 V434 F437	L139-F143 VanDerWaalsContact O-CD2 3.3Å; L139-F143 WeakPolarHBondContact O-CD2 3.43Å; L139-F143 PolarHBondContact O-N 3.46Å; F143-C145 VanDerWaalsContact C-N 3.33Å; F143-C145 PolarHBondContact O-N 2.95Å; F143-G146 PolarHBondContact O-N 3.3Å; F143-E147 PolarHBondContact O-N 2.71Å; F143-V421 HydrophobicContact CD1-CB 4.45Å; F143-V421 HydrophobicContact CD1-CG1 3.94Å; F143-V421 HydrophobicContact CD1-CG2 3.61Å; F143-V421 HydrophobicContact CE1-CG2 3.81Å; F143-V421 HydrophobicContact CG-CG2 4.02Å; F143-V421 HydrophobicContact CZ-CG2 4.35Å; F143-L433 HydrophobicContact CD1-CD2 3.94Å; F143-L433 HydrophobicContact CE1-CD2 3.62Å; F143-L433 HydrophobicContact CZ-CD2 4.03Å; F143-V434 VanDerWaalsContact C-CG2 3.49Å; F143-V434 HydrophobicContact CB-CG2 3.44Å; F143-V434 VanDerWaalsContact CB-CG2 3.44Å; F143-F437 HydrophobicContact CD2-CD2 4.11Å; F143-F437 AromaticContact CD2-CE2 3.73Å; F143-F437 HydrophobicContact CD2-CE2 3.73Å; F143-F437 AromaticContact CE2-CE2 3.75Å; F143-F437 HydrophobicContact CE2-CE2 3.75Å; F143-F437 HydrophobicContact CG-CE2 4.35Å; F143-F437 HydrophobicContact CZ-CE2 4.37Å
144	A	91.3	Very high	90.2	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-63.1	-37.6	175.4	0	0	0	0	0	112.7	A140 K141 V142 G146 E147 Y148 V434 Y438	A140-A144 VanDerWaalsContact O-CB 3.25Å; A140-A144 WeakPolarHBondContact O-CB 3.48Å; A140-A144 PolarHBondContact O-N 3.43Å; K141-A144 PolarHBondContact O-N 3.26Å; V142-A144 PolarHBondContact O-N 3.46Å; A144-G146 VanDerWaalsContact C-N 3.33Å; A144-G146 PolarHBondContact O-N 3.38Å; A144-E147 PolarHBondContact O-N 2.81Å; A144-Y148 HydrophobicContact CB-CE2 4.16Å; A144-Y148 WeakPolarHBondContact O-CD2 3.12Å; A144-Y148 VanDerWaalsContact O-CG 3.26Å; A144-Y148 PolarHBondContact O-N 3.2Å; A144-V434 HydrophobicContact CB-CG1 3.94Å; A144-Y438 HydrophobicContact CB-CE2 3.91Å
145	C	92.9	Very high	90	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.014	6%	0.059	C	C	.	.	H	α-helix	trans	-59.3	-46.4	174	-173.9	0	0	0	0	111	K141 V142 F143 Y148 V149 A374 A418	K141-C145 WeakPolarHBondContact O-CB 3.32Å; K141-C145 PolarHBondContact O-N 3.38Å; V142-C145 WeakPolarHBondContact O-CB 3.41Å; V142-C145 PolarHBondContact O-N 3.37Å; F143-C145 VanDerWaalsContact C-N 3.33Å; F143-C145 PolarHBondContact O-N 2.95Å; C145-Y148 PolarHBondContact O-N 3.4Å; C145-V149 WeakPolarHBondContact O-CG2 3.46Å; C145-V149 PolarHBondContact O-N 2.6Å; C145-V149 VanDerWaalsContact O-N 3.1Å; C145-A374 HydrophobicContact CB-CB 3.96Å; C145-A418 HydrophobicContact CB-CB 4.36Å
146	G	92.3	Very high	89.9	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.3	-44.9	175.1	0	0	0	0	0	112.8	V142 F143 A144 Y148 V149 L150	V142-G146 PolarHBondContact O-N 2.93Å; F143-G146 PolarHBondContact O-N 3.3Å; A144-G146 VanDerWaalsContact C-N 3.33Å; A144-G146 PolarHBondContact O-N 3.38Å; G146-Y148 PolarHBondContact O-N 3.09Å; G146-V149 PolarHBondContact O-N 2.72Å; G146-L150 WeakPolarHBondContact O-CB 3.35Å; G146-L150 VanDerWaalsContact O-CG 3.29Å; G146-L150 WeakPolarHBondContact O-CG 3.37Å; G146-L150 PolarHBondContact O-N 2.93Å
147	E	89.9	Confident	89.6	Confident	9 Å²	9	12.9 Å²	12.9	4%	0.042	7%	0.066	C	C	.	.	H	α-helix	trans	-56.7	-48.5	176.1	-173.9	-173.6	160.5	0	0	112	F143 A144 V149 L150 G151 T289 V430 A431 V434	F143-E147 PolarHBondContact O-N 2.71Å; A144-E147 PolarHBondContact O-N 2.81Å; E147-V149 PolarHBondContact O-N 2.91Å; E147-L150 PolarHBondContact O-N 2.78Å; E147-G151 PolarHBondContact O-N 2.96Å; E147-T289 PolarHBondContact OE1-OG1 3.16Å; E147-V430 HydrophobicContact CB-CG1 4.09Å; E147-A431 HydrophobicContact CG-CB 4.44Å; E147-V434 WeakPolarHBondContact OE2-CB 3.37Å; E147-V434 WeakPolarHBondContact OE2-CG1 3.18Å; E147-V434 WeakPolarHBondContact OE2-CG2 3.41Å
148	Y	90.7	Very high	89.1	Confident	2 Å²	2	16.2 Å²	16.2	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-67.3	-34.2	-179.2	-61.6	-36.2	0	0	0	113.3	A144 C145 G146 L152 S367 A370 A374	A144-Y148 HydrophobicContact CB-CE2 4.16Å; A144-Y148 WeakPolarHBondContact O-CD2 3.12Å; A144-Y148 VanDerWaalsContact O-CG 3.26Å; A144-Y148 PolarHBondContact O-N 3.2Å; C145-Y148 PolarHBondContact O-N 3.4Å; G146-Y148 PolarHBondContact O-N 3.09Å; Y148-L152 WeakPolarHBondContact O-CB 3.23Å; Y148-L152 PolarHBondContact O-N 2.82Å; Y148-S367 PolarHBondContact O-OG 3.06Å; Y148-A370 HydrophobicContact CD1-CB 4.28Å; Y148-A370 VanDerWaalsContact CD2-C 3.45Å; Y148-A370 HydrophobicContact CD2-CB 3.59Å; Y148-A370 HydrophobicContact CE1-CB 4.41Å; Y148-A370 HydrophobicContact CE2-CB 3.73Å; Y148-A370 HydrophobicContact CG-CB 3.88Å; Y148-A374 HydrophobicContact CD2-CB 4.44Å; Y148-A374 HydrophobicContact CE2-CB 4.42Å
149	V	92.4	Very high	88.5	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-70.7	-45.8	175.1	171.3	0	0	0	0	111	C145 G146 E147 G151 L152 V153 S186 V189 L190 A371 V422	C145-V149 WeakPolarHBondContact O-CG2 3.46Å; C145-V149 PolarHBondContact O-N 2.6Å; C145-V149 VanDerWaalsContact O-N 3.1Å; G146-V149 PolarHBondContact O-N 2.72Å; E147-V149 PolarHBondContact O-N 2.91Å; V149-G151 VanDerWaalsContact C-N 3.31Å; V149-G151 PolarHBondContact O-N 2.66Å; V149-L152 WeakPolarHBondContact O-CB 3.42Å; V149-L152 PolarHBondContact O-N 3.18Å; V149-V153 PolarHBondContact O-N 3.42Å; V149-S186 VanDerWaalsContact CG1-O 3.25Å; V149-S186 WeakPolarHBondContact CG1-O 3.31Å; V149-V189 HydrophobicContact CG1-CB 4.13Å; V149-V189 HydrophobicContact CG1-CG1 3.98Å; V149-V189 HydrophobicContact CG2-CG1 4.28Å; V149-L190 HydrophobicContact CG1-CB 4.35Å; V149-L190 HydrophobicContact CG2-CB 4.48Å; V149-L190 HydrophobicContact CG2-CD1 4.12Å; V149-A371 HydrophobicContact CG2-CB 3.88Å; V149-V422 HydrophobicContact CG1-CG2 4.46Å
150	L	89.3	Confident	88	Confident	8 Å²	8	18.9 Å²	18.9	4%	0.042	10%	0.097	C	C	.	.	H	α-helix	trans	-60.2	-43.5	176.8	-72.6	169.4	0	0	0	111	G146 E147 L152 V153 E154 V422 L427	G146-L150 WeakPolarHBondContact O-CB 3.35Å; G146-L150 VanDerWaalsContact O-CG 3.29Å; G146-L150 WeakPolarHBondContact O-CG 3.37Å; G146-L150 PolarHBondContact O-N 2.93Å; E147-L150 PolarHBondContact O-N 2.78Å; L150-L152 PolarHBondContact O-N 2.71Å; L150-V153 PolarHBondContact O-N 2.9Å; L150-E154 PolarHBondContact O-N 2.82Å; L150-V422 HydrophobicContact CD2-CG1 4.38Å; L150-L427 HydrophobicContact CB-CD1 4Å
151	G	87.1	Confident	87.2	Confident	3 Å²	3	19 Å²	19	3%	0.031	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-40.7	175.3	0	0	0	0	0	112.7	I67 E147 V149 V153 E154 A155	I67-G151 WeakPolarHBondContact CD1-O 3.3Å; E147-G151 PolarHBondContact O-N 2.96Å; V149-G151 VanDerWaalsContact C-N 3.31Å; V149-G151 PolarHBondContact O-N 2.66Å; G151-V153 VanDerWaalsContact C-N 3.31Å; G151-V153 PolarHBondContact O-N 3.34Å; G151-E154 WeakPolarHBondContact O-CB 3.29Å; G151-E154 PolarHBondContact O-N 3.03Å; G151-A155 PolarHBondContact O-N 2.95Å
152	L	90	Very high	85.8	Confident	12 Å²	12	20.5 Å²	20.5	6%	0.063	11%	0.111	C	C	.	.	H	α-helix	trans	-60.7	-42.6	176.3	179	51.5	0	0	0	111.4	Y148 V149 L150 A155 V156 V189 Y364 L368	Y148-L152 WeakPolarHBondContact O-CB 3.23Å; Y148-L152 PolarHBondContact O-N 2.82Å; V149-L152 WeakPolarHBondContact O-CB 3.42Å; V149-L152 PolarHBondContact O-N 3.18Å; L150-L152 PolarHBondContact O-N 2.71Å; L152-A155 WeakPolarHBondContact O-CB 3.46Å; L152-A155 PolarHBondContact O-N 3.25Å; L152-V156 HydrophobicContact CD1-CG2 4.42Å; L152-V156 WeakPolarHBondContact O-CG2 3.42Å; L152-V156 PolarHBondContact O-N 3.42Å; L152-V189 HydrophobicContact CD2-CG1 3.74Å; L152-Y364 HydrophobicContact CD1-CD1 3.44Å; L152-Y364 VanDerWaalsContact CD1-CD1 3.44Å; L152-Y364 HydrophobicContact CD1-CE1 4.24Å; L152-Y364 HydrophobicContact CD1-CG 4.03Å; L152-L368 HydrophobicContact CD2-CB 4.16Å; L152-L368 HydrophobicContact CD2-CD1 4.33Å
153	V	89.8	Confident	84.2	Confident	2 Å²	2	23.5 Å²	23.5	1%	0.012	13%	0.127	C	C	.	.	H	α-helix	trans	-69.3	-37.1	178.2	174.2	0	0	0	0	111.8	V149 L150 G151 A155 V156 L157 T182 Y185 S186 V189	V149-V153 PolarHBondContact O-N 3.42Å; L150-V153 PolarHBondContact O-N 2.9Å; G151-V153 VanDerWaalsContact C-N 3.31Å; G151-V153 PolarHBondContact O-N 3.34Å; V153-A155 VanDerWaalsContact C-N 3.29Å; V153-A155 PolarHBondContact O-N 3.5Å; V153-V156 PolarHBondContact O-N 3.45Å; V153-L157 HydrophobicContact CG1-CD1 3.9Å; V153-L157 HydrophobicContact CG1-CG 4.18Å; V153-L157 WeakPolarHBondContact O-CB 3.49Å; V153-L157 WeakPolarHBondContact O-CG 3.47Å; V153-L157 PolarHBondContact O-N 2.94Å; V153-T182 HydrophobicContact CG1-CG2 3.95Å; V153-Y185 HydrophobicContact CG1-CD2 4.39Å; V153-S186 WeakPolarHBondContact CG2-OG 3.46Å; V153-V189 HydrophobicContact CG2-CG2 4.23Å
154	E	84.3	Confident	82.3	Confident	60 Å²	60	27.2 Å²	27.2	28%	0.28	16%	0.156	S	C	.	.	H	α-helix	trans	-54.9	-46.6	170.7	-172.1	-175.8	-178.4	0	0	110.6	R72 L150 G151 V156 L157 D158	R72-E154 IonicContact NH2-OE1 3.28Å; R72-E154 PolarHBondContact NH2-OE1 3.29Å; R72-E154 IonicContact NH2-OE2 3.68Å; R72-E154 PolarHBondContact NH2-OE2 3.49Å; R72-E154 VanDerWaalsContact NH2-OE2 3.08Å; L150-E154 PolarHBondContact O-N 2.82Å; G151-E154 WeakPolarHBondContact O-CB 3.29Å; G151-E154 PolarHBondContact O-N 3.03Å; E154-V156 PolarHBondContact O-N 3.36Å; E154-L157 PolarHBondContact O-N 2.95Å; E154-D158 PolarHBondContact O-N 3.13Å
155	A	83.9	Confident	80.3	Confident	6 Å²	6	35.7 Å²	35.7	5%	0.05	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-38.4	177.2	0	0	0	0	0	113.5	I67 L71 G151 L152 V153 V159 I363 Y364	I67-A155 HydrophobicContact CD1-CB 4.19Å; L71-A155 HydrophobicContact CD1-CB 3.87Å; G151-A155 PolarHBondContact O-N 2.95Å; L152-A155 WeakPolarHBondContact O-CB 3.46Å; L152-A155 PolarHBondContact O-N 3.25Å; V153-A155 VanDerWaalsContact C-N 3.29Å; V153-A155 PolarHBondContact O-N 3.5Å; A155-V159 PolarHBondContact O-N 3.48Å; A155-I363 HydrophobicContact CB-CG2 3.67Å; A155-Y364 HydrophobicContact CB-CE1 4Å
156	V	86.9	Confident	78	Confident	34 Å²	34	38 Å²	38	21%	0.206	21%	0.212	C	C	.	.	H	α-helix	trans	-66.3	-42.2	176.9	169.1	0	0	0	0	110.8	L152 V153 E154 V159 F160 L175 Y364	L152-V156 HydrophobicContact CD1-CG2 4.42Å; L152-V156 WeakPolarHBondContact O-CG2 3.42Å; L152-V156 PolarHBondContact O-N 3.42Å; V153-V156 PolarHBondContact O-N 3.45Å; E154-V156 PolarHBondContact O-N 3.36Å; V156-V159 PolarHBondContact O-N 3.36Å; V156-F160 HydrophobicContact CG1-CD2 4.1Å; V156-F160 WeakPolarHBondContact O-CB 3.43Å; V156-F160 WeakPolarHBondContact O-CD2 3.31Å; V156-F160 PolarHBondContact O-N 3.22Å; V156-L175 HydrophobicContact CG1-CD1 4.04Å; V156-Y364 HydrophobicContact CG2-CD1 4.29Å; V156-Y364 HydrophobicContact CG2-CE1 3.66Å; V156-Y364 HydrophobicContact CG2-CE2 4.49Å
157	L	84	Confident	75.4	Confident	21 Å²	21	43.9 Å²	43.9	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-70.6	-31.2	179.3	-70.3	176	0	0	0	112.5	V153 E154 V159 G161 L175 T182 Y185	V153-L157 HydrophobicContact CG1-CD1 3.9Å; V153-L157 HydrophobicContact CG1-CG 4.18Å; V153-L157 WeakPolarHBondContact O-CB 3.49Å; V153-L157 WeakPolarHBondContact O-CG 3.47Å; V153-L157 PolarHBondContact O-N 2.94Å; E154-L157 PolarHBondContact O-N 2.95Å; L157-V159 VanDerWaalsContact C-N 3.28Å; L157-V159 PolarHBondContact O-N 2.84Å; L157-G161 WeakPolarHBondContact O-CA 3.33Å; L157-G161 PolarHBondContact O-N 2.91Å; L157-L175 HydrophobicContact CD2-CB 4.41Å; L157-T182 HydrophobicContact CD1-CG2 4.29Å; L157-Y185 HydrophobicContact CD2-CD2 3.91Å; L157-Y185 HydrophobicContact CD2-CE2 3.78Å; L157-Y185 HydrophobicContact CG-CD2 4.5Å
158	D	77.1	Confident	73	Confident	78 Å²	78	49.3 Å²	49.3	42%	0.417	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-34.8	174.4	-169.5	55.2	0	0	0	112.3	E154	E154-D158 PolarHBondContact O-N 3.13Å
159	V	77.1	Confident	70.9	Confident	38 Å²	38	55.2 Å²	55.2	23%	0.23	33%	0.328	C	S	.	.	H	α-helix	trans	-86.7	-45	179.5	179.7	0	0	0	0	112.7	A155 V156 L157 T360	A155-V159 PolarHBondContact O-N 3.48Å; V156-V159 PolarHBondContact O-N 3.36Å; L157-V159 VanDerWaalsContact C-N 3.28Å; L157-V159 PolarHBondContact O-N 2.84Å; V159-T360 HydrophobicContact CG2-CG2 4.24Å
160	F	80.6	Confident	68.5	Low	65 Å²	65	58.7 Å²	58.7	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-111.5	-4	-168.5	-60.7	-67.8	0	0	0	114.5	V156 L172 R173 V174 L175 Y364	V156-F160 HydrophobicContact CG1-CD2 4.1Å; V156-F160 WeakPolarHBondContact O-CB 3.43Å; V156-F160 WeakPolarHBondContact O-CD2 3.31Å; V156-F160 PolarHBondContact O-N 3.22Å; F160-L172 HydrophobicContact CD1-CB 4.22Å; F160-L172 HydrophobicContact CD1-CD2 3.95Å; F160-L172 WeakPolarHBondContact CD1-O 3.42Å; F160-L172 HydrophobicContact CE1-CB 4.37Å; F160-L172 HydrophobicContact CE1-CD2 3.68Å; F160-R173 CarbonylContact O-C 3.54Å; F160-R173 WeakPolarHBondContact O-CA 2.67Å; F160-V174 PolarHBondContact O-N 2.83Å; F160-L175 HydrophobicContact CB-CD1 3.67Å; F160-L175 HydrophobicContact CB-CG 4.14Å; F160-L175 PolarHBondContact O-N 3.32Å; F160-Y364 HydrophobicContact CE2-CE2 4.38Å
161	G	74.1	Confident	66.6	Low	1 Å²	1	61.5 Å²	61.5	1%	0.01	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	137.6	-178.3	0	0	0	0	0	112.7	L157 R173	L157-G161 WeakPolarHBondContact O-CA 3.33Å; L157-G161 PolarHBondContact O-N 2.91Å; G161-R173 WeakPolarHBondContact O-CB 3.35Å; G161-R173 WeakPolarHBondContact O-CG 3.23Å
162	A	62.9	Low	65	Low	35 Å²	35	67.5 Å²	67.5	29%	0.289	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	114.2	172.6	0	0	0	0	0	109.9	L175	A162-L175 PolarHBondContact N-O 3.15Å
163	D	59.6	Low	63.7	Low	67 Å²	67	72.8 Å²	72.8	36%	0.358	45%	0.445	S	S	.	.			trans	-78.6	127.7	168.9	-61.1	-36.5	0	0	0	108.6	E165 R173 Q177	D163-E165 PolarHBondContact O-N 3.42Å; D163-E165 VanDerWaalsContact O-N 3.12Å; D163-R173 IonicContact OD2-CZ 3.46Å; D163-R173 IonicContact OD2-NH1 3.74Å; D163-R173 PolarHBondContact OD2-NH1 2.98Å; D163-Q177 PolarHBondContact OD1-NE2 3.46Å
164	P	52.4	Low	62.8	Low	129 Å²	129	78.3 Å²	78.3	84%	0.838	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-11.1	-178.2	21.4	-29.7	0	0	0	114.9
165	E	49.8	Very low	62.6	Low	177 Å²	177	77.9 Å²	77.9	83%	0.827	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.8	3.9	-176.4	-64.2	-164.9	165.7	0	0	115.8	D163 S167	D163-E165 PolarHBondContact O-N 3.42Å; D163-E165 VanDerWaalsContact O-N 3.12Å; E165-S167 PolarHBondContact O-N 3.05Å
166	S	44.2	Very low	62.5	Low	50 Å²	50	80.1 Å²	80.1	35%	0.35	49%	0.492	S	S	.	.			trans	-92.3	95.7	175.3	75.9	0	0	0	0	111.2	V168 R173	S166-V168 PolarHBondContact O-N 3.29Å; S166-R173 PolarHBondContact OG-NH1 3.49Å
167	S	38	Very low	61.9	Low	124 Å²	124	82.6 Å²	82.6	87%	0.867	50%	0.501	S	S	*	.			trans	-75.7	50.9	173.3	54	0	0	0	0	113.2	E165	E165-S167 PolarHBondContact O-N 3.05Å
168	V	39.8	Very low	61.9	Low	124 Å²	124	83.2 Å²	83.2	75%	0.752	51%	0.512	S	S	*	.			trans	-107.6	97.7	168.8	-174.5	0	0	0	0	108.9	S166 G170	S166-V168 PolarHBondContact O-N 3.29Å; V168-G170 PolarHBondContact O-N 2.77Å
169	S	45.2	Very low	62.2	Low	125 Å²	125	84.9 Å²	84.9	87%	0.874	51%	0.514	S	S	*	.			trans	-61.6	110.8	167.4	53	0	0	0	0	110.1
170	G	42.9	Very low	62.8	Low	73 Å²	73	92 Å²	92	75%	0.753	54%	0.537	S	S	*	.			trans	179.4	39.7	179.4	0	0	0	0	0	117	V168	V168-G170 PolarHBondContact O-N 2.77Å
171	G	49.1	Very low	63.2	Low	68 Å²	68	94.3 Å²	94.3	70%	0.701	54%	0.544	S	S	*	.	S	Bend	trans	83.8	137.3	160.2	0	0	0	0	0	118.9	R173	G171-R173 PolarHBondContact O-N 3.31Å
172	L	53.7	Low	63.8	Low	129 Å²	129	96.1 Å²	96.1	68%	0.675	56%	0.555	S	S	*	*			trans	68.8	6.5	170	-84.2	140.1	0	0	0	120.5	F160 V174	F160-L172 HydrophobicContact CD1-CB 4.22Å; F160-L172 HydrophobicContact CD1-CD2 3.95Å; F160-L172 WeakPolarHBondContact CD1-O 3.42Å; F160-L172 HydrophobicContact CE1-CB 4.37Å; F160-L172 HydrophobicContact CE1-CD2 3.68Å; L172-V174 PolarHBondContact O-N 2.83Å
173	R	62.7	Low	65.1	Low	122 Å²	122	94.8 Å²	94.8	46%	0.46	54%	0.544	S	S	.	.			trans	-90.6	84	170.5	-69.8	-175.9	173.9	-156.3	-13.8	112.3	F160 G161 D163 S166 G171	F160-R173 CarbonylContact O-C 3.54Å; F160-R173 WeakPolarHBondContact O-CA 2.67Å; G161-R173 WeakPolarHBondContact O-CB 3.35Å; G161-R173 WeakPolarHBondContact O-CG 3.23Å; D163-R173 IonicContact OD2-CZ 3.46Å; D163-R173 IonicContact OD2-NH1 3.74Å; D163-R173 PolarHBondContact OD2-NH1 2.98Å; S166-R173 PolarHBondContact OG-NH1 3.49Å; G171-R173 PolarHBondContact O-N 3.31Å
174	V	71.4	Confident	66.7	Low	119 Å²	119	96.1 Å²	96.1	72%	0.721	55%	0.55	S	S	*	.			trans	-116.5	-21.5	-171.8	-177.1	0	0	0	0	112.8	F160 L172	F160-V174 PolarHBondContact O-N 2.83Å; L172-V174 PolarHBondContact O-N 2.83Å
175	L	79.8	Confident	68.6	Low	51 Å²	51	92.2 Å²	92.2	27%	0.267	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	125.6	-171.9	-65.6	175.5	0	0	0	111.7	V156 L157 F160 A162 Q177 Y185	V156-L175 HydrophobicContact CG1-CD1 4.04Å; L157-L175 HydrophobicContact CD2-CB 4.41Å; F160-L175 HydrophobicContact CB-CD1 3.67Å; F160-L175 HydrophobicContact CB-CG 4.14Å; F160-L175 PolarHBondContact O-N 3.32Å; A162-L175 PolarHBondContact N-O 3.15Å; L175-Q177 PolarHBondContact O-N 3.32Å; L175-Y185 HydrophobicContact CB-CE2 4.46Å; L175-Y185 HydrophobicContact CD2-CE1 4.41Å
176	P	81.4	Confident	70.7	Confident	53 Å²	53	83.8 Å²	83.8	34%	0.344	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	135.7	174.3	25.2	-34.1	0	0	0	111.3	Y181 Y185	P176-Y181 HydrophobicContact CB-CD1 4.37Å; P176-Y181 HydrophobicContact CB-CD2 4.09Å; P176-Y181 HydrophobicContact CB-CE1 4.24Å; P176-Y181 HydrophobicContact CB-CE2 3.96Å; P176-Y181 HydrophobicContact CB-CG 4.3Å; P176-Y181 HydrophobicContact CG-CD1 3.76Å; P176-Y181 HydrophobicContact CG-CD2 4.38Å; P176-Y181 HydrophobicContact CG-CE1 3.66Å; P176-Y181 HydrophobicContact CG-CE2 4.29Å; P176-Y181 HydrophobicContact CG-CG 4.13Å; P176-Y181 WeakPolarHBondContact O-CB 2.79Å; P176-Y185 WeakPolarHBondContact CD-OH 2.78Å
177	Q	75.2	Confident	73.1	Confident	86 Å²	86	82.6 Å²	82.6	40%	0.402	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-95.5	143.2	176.3	-64.7	-179.4	6	0	0	110.8	D163 L175	D163-Q177 PolarHBondContact OD1-NE2 3.46Å; L175-Q177 PolarHBondContact O-N 3.32Å
178	G	82.3	Confident	75.8	Confident	33 Å²	33	80.9 Å²	80.9	34%	0.34	46%	0.456	S	S	.	.	S	Bend	trans	163	163.4	177	0	0	0	0	0	111.5	W180 Y181 T182	G178-W180 PolarHBondContact O-N 3Å; G178-Y181 PolarHBondContact O-N 2.9Å; G178-T182 WeakPolarHBondContact O-CB 3.3Å; G178-T182 PolarHBondContact O-N 3.33Å; G178-T182 PolarHBondContact O-OG1 3.04Å
179	Y	84.9	Confident	78.4	Confident	113 Å²	113	76.5 Å²	76.5	44%	0.443	43%	0.429	S	S	.	.	H	α-helix	trans	-56.7	-53.1	-179.2	177.5	-100.1	0	0	0	112.1	Y181 T182 V183 F423	Y179-Y181 VanDerWaalsContact C-N 3.32Å; Y179-Y181 PolarHBondContact O-N 2.87Å; Y179-T182 WeakPolarHBondContact O-CB 3.48Å; Y179-T182 PolarHBondContact O-N 2.94Å; Y179-V183 HydrophobicContact CD1-CG2 4.42Å; Y179-V183 HydrophobicContact CE1-CG2 4.02Å; Y179-V183 HydrophobicContact CE2-CG2 4.33Å; Y179-V183 WeakPolarHBondContact O-CG2 3.43Å; Y179-V183 PolarHBondContact O-N 2.82Å; Y179-F423 PolarHBondContact OH-O 2.63Å
180	W	88.6	Confident	80.7	Confident	189 Å²	189	70.5 Å²	70.5	72%	0.716	39%	0.387	S	S	*	.	H	α-helix	trans	-66.2	-31.9	-179.2	-66.7	111.4	0	0	0	113.4	G178 L184	G178-W180 PolarHBondContact O-N 3Å; W180-L184 VanDerWaalsContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CB 2.79Å; W180-L184 PolarHBondContact O-N 3.38Å
181	Y	88.6	Confident	83.2	Confident	112 Å²	112	71 Å²	71	44%	0.439	37%	0.372	S	S	.	.	H	α-helix	trans	-69.3	-41.6	173.2	-70.4	-68.8	0	0	0	111.6	P176 G178 Y179 V183 L184 Y185	P176-Y181 HydrophobicContact CB-CD1 4.37Å; P176-Y181 HydrophobicContact CB-CD2 4.09Å; P176-Y181 HydrophobicContact CB-CE1 4.24Å; P176-Y181 HydrophobicContact CB-CE2 3.96Å; P176-Y181 HydrophobicContact CB-CG 4.3Å; P176-Y181 HydrophobicContact CG-CD1 3.76Å; P176-Y181 HydrophobicContact CG-CD2 4.38Å; P176-Y181 HydrophobicContact CG-CE1 3.66Å; P176-Y181 HydrophobicContact CG-CE2 4.29Å; P176-Y181 HydrophobicContact CG-CG 4.13Å; P176-Y181 WeakPolarHBondContact O-CB 2.79Å; G178-Y181 PolarHBondContact O-N 2.9Å; Y179-Y181 VanDerWaalsContact C-N 3.32Å; Y179-Y181 PolarHBondContact O-N 2.87Å; Y181-V183 VanDerWaalsContact C-N 3.34Å; Y181-V183 PolarHBondContact O-N 2.92Å; Y181-L184 WeakPolarHBondContact O-CB 3.31Å; Y181-L184 PolarHBondContact O-N 3.16Å; Y181-Y185 WeakPolarHBondContact O-CD2 3.26Å; Y181-Y185 VanDerWaalsContact O-CG 3.22Å; Y181-Y185 PolarHBondContact O-N 3.11Å
182	T	87.6	Confident	85.2	Confident	39 Å²	39	71.9 Å²	71.9	24%	0.239	36%	0.36	C	S	.	.	H	α-helix	trans	-61.1	-44.1	175.1	-53.3	0	0	0	0	111.1	V153 L157 G178 Y179 S186	V153-T182 HydrophobicContact CG1-CG2 3.95Å; L157-T182 HydrophobicContact CD1-CG2 4.29Å; G178-T182 WeakPolarHBondContact O-CB 3.3Å; G178-T182 PolarHBondContact O-N 3.33Å; G178-T182 PolarHBondContact O-OG1 3.04Å; Y179-T182 WeakPolarHBondContact O-CB 3.48Å; Y179-T182 PolarHBondContact O-N 2.94Å; T182-S186 VanDerWaalsContact O-CB 3.27Å; T182-S186 WeakPolarHBondContact O-CB 3.49Å; T182-S186 PolarHBondContact O-N 2.86Å; T182-S186 PolarHBondContact O-OG 3.28Å
183	V	91	Very high	87	Confident	8 Å²	8	65.8 Å²	65.8	5%	0.048	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-43.1	174.1	171.2	0	0	0	0	111.1	Y179 Y181 S186 S187 V422 F423	Y179-V183 HydrophobicContact CD1-CG2 4.42Å; Y179-V183 HydrophobicContact CE1-CG2 4.02Å; Y179-V183 HydrophobicContact CE2-CG2 4.33Å; Y179-V183 WeakPolarHBondContact O-CG2 3.43Å; Y179-V183 PolarHBondContact O-N 2.82Å; Y181-V183 VanDerWaalsContact C-N 3.34Å; Y181-V183 PolarHBondContact O-N 2.92Å; V183-S186 PolarHBondContact O-N 3.01Å; V183-S187 WeakPolarHBondContact O-CB 3.39Å; V183-S187 PolarHBondContact O-N 3.01Å; V183-S187 PolarHBondContact O-OG 2.72Å; V183-V422 HydrophobicContact CG1-CG1 4.47Å; V183-F423 HydrophobicContact CG1-CD1 3.63Å; V183-F423 HydrophobicContact CG1-CE1 3.59Å
184	L	92.4	Very high	88.4	Confident	94 Å²	94	60.5 Å²	60.5	49%	0.492	31%	0.309	S	S	.	.	H	α-helix	trans	-60.2	-52	177.7	178.8	68.6	0	0	0	111.4	W180 Y181 S186 S187 V188	W180-L184 VanDerWaalsContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CB 2.79Å; W180-L184 PolarHBondContact O-N 3.38Å; Y181-L184 WeakPolarHBondContact O-CB 3.31Å; Y181-L184 PolarHBondContact O-N 3.16Å; L184-S186 VanDerWaalsContact C-N 3.3Å; L184-S186 PolarHBondContact O-N 3.38Å; L184-S187 WeakPolarHBondContact O-CB 3.09Å; L184-S187 PolarHBondContact O-N 3.39Å; L184-V188 WeakPolarHBondContact O-CG2 3.39Å; L184-V188 PolarHBondContact O-N 2.68Å
185	Y	92.6	Very high	89.3	Confident	47 Å²	47	59.8 Å²	59.8	18%	0.184	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-40.7	178.5	-58.8	-36.7	0	0	0	111.6	V153 L157 L175 P176 Y181 S187 V188 V189	V153-Y185 HydrophobicContact CG1-CD2 4.39Å; L157-Y185 HydrophobicContact CD2-CD2 3.91Å; L157-Y185 HydrophobicContact CD2-CE2 3.78Å; L157-Y185 HydrophobicContact CG-CD2 4.5Å; L175-Y185 HydrophobicContact CB-CE2 4.46Å; L175-Y185 HydrophobicContact CD2-CE1 4.41Å; P176-Y185 WeakPolarHBondContact CD-OH 2.78Å; Y181-Y185 WeakPolarHBondContact O-CD2 3.26Å; Y181-Y185 VanDerWaalsContact O-CG 3.22Å; Y181-Y185 PolarHBondContact O-N 3.11Å; Y185-S187 VanDerWaalsContact C-N 3.33Å; Y185-S187 PolarHBondContact O-N 3.38Å; Y185-V188 PolarHBondContact O-N 2.72Å; Y185-V189 WeakPolarHBondContact O-CG2 3.46Å; Y185-V189 PolarHBondContact O-N 3.43Å
186	S	92.9	Very high	89.6	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-40.6	176.8	-61.1	0	0	0	0	111.4	V149 V153 T182 V183 L184 V188 V189 L190	V149-S186 VanDerWaalsContact CG1-O 3.25Å; V149-S186 WeakPolarHBondContact CG1-O 3.31Å; V153-S186 WeakPolarHBondContact CG2-OG 3.46Å; T182-S186 VanDerWaalsContact O-CB 3.27Å; T182-S186 WeakPolarHBondContact O-CB 3.49Å; T182-S186 PolarHBondContact O-N 2.86Å; T182-S186 PolarHBondContact O-OG 3.28Å; V183-S186 PolarHBondContact O-N 3.01Å; L184-S186 VanDerWaalsContact C-N 3.3Å; L184-S186 PolarHBondContact O-N 3.38Å; S186-V188 PolarHBondContact O-N 2.84Å; S186-V189 PolarHBondContact O-N 3.06Å; S186-L190 VanDerWaalsContact O-CB 3.26Å; S186-L190 WeakPolarHBondContact O-CB 3.36Å; S186-L190 PolarHBondContact O-N 2.82Å
187	S	94.8	Very high	89.9	Confident	26 Å²	26	57.1 Å²	57.1	18%	0.182	29%	0.285	C	S	.	.	H	α-helix	trans	-65.7	-38.3	177.1	-53.4	0	0	0	0	111.7	V183 L184 Y185 L190 L191 Q419	V183-S187 WeakPolarHBondContact O-CB 3.39Å; V183-S187 PolarHBondContact O-N 3.01Å; V183-S187 PolarHBondContact O-OG 2.72Å; L184-S187 WeakPolarHBondContact O-CB 3.09Å; L184-S187 PolarHBondContact O-N 3.39Å; Y185-S187 VanDerWaalsContact C-N 3.33Å; Y185-S187 PolarHBondContact O-N 3.38Å; S187-L190 PolarHBondContact O-N 2.77Å; S187-L191 VanDerWaalsContact O-CB 3.28Å; S187-L191 WeakPolarHBondContact O-CB 3.43Å; S187-L191 PolarHBondContact O-N 2.95Å; S187-Q419 PolarHBondContact OG-NE2 3.21Å
188	V	95	Very high	90.4	Very high	88 Å²	88	56 Å²	56	53%	0.533	28%	0.282	S	S	.	.	H	α-helix	trans	-65.8	-44.7	175.4	171.9	0	0	0	0	111.2	L184 Y185 S186 L191 L192	L184-V188 WeakPolarHBondContact O-CG2 3.39Å; L184-V188 PolarHBondContact O-N 2.68Å; Y185-V188 PolarHBondContact O-N 2.72Å; S186-V188 PolarHBondContact O-N 2.84Å; V188-L191 WeakPolarHBondContact O-CB 3.42Å; V188-L191 PolarHBondContact O-N 3.35Å; V188-L192 PolarHBondContact O-N 3.31Å
189	V	93.9	Very high	90.4	Very high	31 Å²	31	58.5 Å²	58.5	19%	0.188	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-43.1	175.8	169.7	0	0	0	0	111	V149 L152 V153 Y185 S186 L191 L192 C193 L368	V149-V189 HydrophobicContact CG1-CB 4.13Å; V149-V189 HydrophobicContact CG1-CG1 3.98Å; V149-V189 HydrophobicContact CG2-CG1 4.28Å; L152-V189 HydrophobicContact CD2-CG1 3.74Å; V153-V189 HydrophobicContact CG2-CG2 4.23Å; Y185-V189 WeakPolarHBondContact O-CG2 3.46Å; Y185-V189 PolarHBondContact O-N 3.43Å; S186-V189 PolarHBondContact O-N 3.06Å; V189-L191 VanDerWaalsContact C-N 3.35Å; V189-L192 WeakPolarHBondContact O-CB 3.48Å; V189-L192 PolarHBondContact O-N 3Å; V189-C193 PolarHBondContact O-N 3.41Å; V189-C193 PolarHBondContact O-SG 2.93Å; V189-L368 HydrophobicContact CG1-CD1 4.37Å
190	L	94.6	Very high	89.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-37.4	178.1	-173.8	63.2	0	0	0	111.6	V149 S186 S187 C193 L194 A418 Q419 V422	V149-L190 HydrophobicContact CG1-CB 4.35Å; V149-L190 HydrophobicContact CG2-CB 4.48Å; V149-L190 HydrophobicContact CG2-CD1 4.12Å; S186-L190 VanDerWaalsContact O-CB 3.26Å; S186-L190 WeakPolarHBondContact O-CB 3.36Å; S186-L190 PolarHBondContact O-N 2.82Å; S187-L190 PolarHBondContact O-N 2.77Å; L190-C193 WeakPolarHBondContact O-CB 3.48Å; L190-C193 PolarHBondContact O-N 2.8Å; L190-L194 PolarHBondContact O-N 2.82Å; L190-A418 HydrophobicContact CD1-CB 4.15Å; L190-A418 HydrophobicContact CD2-CB 4.05Å; L190-Q419 HydrophobicContact CD2-CB 4.03Å; L190-V422 HydrophobicContact CD2-CG2 4.25Å
191	L	94.7	Very high	89	Confident	83 Å²	83	44.9 Å²	44.9	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-61.8	-41.9	171.6	-176.9	72.1	0	0	0	111.5	S187 V188 V189 C193 L194 L195	S187-L191 VanDerWaalsContact O-CB 3.28Å; S187-L191 WeakPolarHBondContact O-CB 3.43Å; S187-L191 PolarHBondContact O-N 2.95Å; V188-L191 WeakPolarHBondContact O-CB 3.42Å; V188-L191 PolarHBondContact O-N 3.35Å; V189-L191 VanDerWaalsContact C-N 3.35Å; L191-C193 VanDerWaalsContact C-N 3.33Å; L191-C193 PolarHBondContact O-N 3.18Å; L191-L194 HydrophobicContact CD1-CD2 4.3Å; L191-L194 WeakPolarHBondContact O-CB 3.35Å; L191-L194 PolarHBondContact O-N 2.93Å; L191-L195 WeakPolarHBondContact O-CG 3.48Å; L191-L195 PolarHBondContact O-N 3.05Å
192	L	91.6	Very high	88.2	Confident	87 Å²	87	44.2 Å²	44.2	46%	0.455	24%	0.243	S	C	.	.	H	α-helix	trans	-62.3	-42.4	174.6	-179.2	139.8	0	0	0	111.3	V188 V189 L194 L195 V196 L368	V188-L192 PolarHBondContact O-N 3.31Å; V189-L192 WeakPolarHBondContact O-CB 3.48Å; V189-L192 PolarHBondContact O-N 3Å; L192-L194 VanDerWaalsContact C-N 3.29Å; L192-L194 PolarHBondContact O-N 3.29Å; L192-L195 PolarHBondContact O-N 3.34Å; L192-V196 WeakPolarHBondContact O-CG2 3.36Å; L192-V196 PolarHBondContact O-N 3.01Å; L192-L368 HydrophobicContact CD2-CD1 3.84Å; L192-L368 HydrophobicContact CD2-CD2 4.19Å
193	C	90.8	Very high	87.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.9	-42.7	173.7	-63.4	0	0	0	0	111.1	V189 L190 L191 V196 C197 L368 M372 M375	V189-C193 PolarHBondContact O-N 3.41Å; V189-C193 PolarHBondContact O-SG 2.93Å; L190-C193 WeakPolarHBondContact O-CB 3.48Å; L190-C193 PolarHBondContact O-N 2.8Å; L191-C193 VanDerWaalsContact C-N 3.33Å; L191-C193 PolarHBondContact O-N 3.18Å; C193-V196 PolarHBondContact O-N 3.32Å; C193-C197 WeakPolarHBondContact O-CB 3.41Å; C193-C197 PolarHBondContact O-N 3.16Å; C193-C197 PolarHBondContact O-SG 2.99Å; C193-L368 VanDerWaalsContact SG-CD1 3.53Å; C193-M372 HydrophobicContact CB-CG 4.18Å; C193-M375 HydrophobicContact CB-CE 3.48Å; C193-M375 VanDerWaalsContact CB-CE 3.48Å; C193-M375 VanDerWaalsContact O-CE 3.24Å; C193-M375 WeakPolarHBondContact O-CE 3.27Å
194	L	92	Very high	87.2	Confident	12 Å²	12	46 Å²	46	6%	0.063	25%	0.25	C	C	.	.	H	α-helix	trans	-59.4	-50.3	179.1	170.5	64.9	0	0	0	110.9	L190 L191 L192 V196 C197 L198 V411 L412 W415	L190-L194 PolarHBondContact O-N 2.82Å; L191-L194 HydrophobicContact CD1-CD2 4.3Å; L191-L194 WeakPolarHBondContact O-CB 3.35Å; L191-L194 PolarHBondContact O-N 2.93Å; L192-L194 VanDerWaalsContact C-N 3.29Å; L192-L194 PolarHBondContact O-N 3.29Å; L194-V196 VanDerWaalsContact C-N 3.29Å; L194-V196 PolarHBondContact O-N 3.34Å; L194-C197 PolarHBondContact O-N 3.25Å; L194-C197 VanDerWaalsContact O-N 3.1Å; L194-L198 HydrophobicContact CD1-CD1 4.04Å; L194-L198 HydrophobicContact CD1-CD2 4.37Å; L194-L198 HydrophobicContact CD1-CG 3.99Å; L194-L198 HydrophobicContact CG-CD1 4.03Å; L194-L198 HydrophobicContact CG-CG 4.38Å; L194-L198 WeakPolarHBondContact O-CG 3.34Å; L194-L198 PolarHBondContact O-N 2.91Å; L194-V411 HydrophobicContact CD1-CG1 3.69Å; L194-L412 HydrophobicContact CD2-CD1 4.33Å; L194-W415 HydrophobicContact CB-CG 4.18Å; L194-W415 HydrophobicContact CD1-CB 4.02Å; L194-W415 HydrophobicContact CD1-CG 4.24Å; L194-W415 HydrophobicContact CD2-CB 4.44Å; L194-W415 HydrophobicContact CD2-CD2 3.9Å; L194-W415 HydrophobicContact CD2-CE3 4.48Å; L194-W415 HydrophobicContact CD2-CG 3.83Å; L194-W415 HydrophobicContact CG-CG 4.3Å
195	L	89.9	Confident	86.3	Confident	103 Å²	103	41.7 Å²	41.7	54%	0.539	23%	0.228	S	C	.	.	H	α-helix	trans	-57.6	-43	-179.3	-67.8	174.7	0	0	0	111.6	L191 L192 L198 V199	L191-L195 WeakPolarHBondContact O-CG 3.48Å; L191-L195 PolarHBondContact O-N 3.05Å; L192-L195 PolarHBondContact O-N 3.34Å; L195-L198 PolarHBondContact O-N 3.18Å; L195-V199 WeakPolarHBondContact O-CG2 3.4Å
196	V	86.9	Confident	85.7	Confident	46 Å²	46	47.5 Å²	47.5	28%	0.279	25%	0.249	S	C	.	.	H	α-helix	trans	-66.7	-40.2	177.3	178.1	0	0	0	0	111.5	L192 C193 L194 L198 V199 M372	L192-V196 WeakPolarHBondContact O-CG2 3.36Å; L192-V196 PolarHBondContact O-N 3.01Å; C193-V196 PolarHBondContact O-N 3.32Å; L194-V196 VanDerWaalsContact C-N 3.29Å; L194-V196 PolarHBondContact O-N 3.34Å; V196-L198 VanDerWaalsContact C-N 3.35Å; V196-L198 PolarHBondContact O-N 3.25Å; V196-V199 PolarHBondContact O-N 2.94Å; V196-M372 HydrophobicContact CB-SD 4.04Å; V196-M372 HydrophobicContact CG1-SD 3.69Å; V196-M372 HydrophobicContact CG2-SD 4.46Å
197	C	86.5	Confident	85.2	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.014	27%	0.267	C	S	.	.	H	α-helix	trans	-71.8	-27	-179	-64.5	0	0	0	0	113.2	C193 L194 V199 G200 M375 I376 N406 V411	C193-C197 WeakPolarHBondContact O-CB 3.41Å; C193-C197 PolarHBondContact O-N 3.16Å; C193-C197 PolarHBondContact O-SG 2.99Å; L194-C197 PolarHBondContact O-N 3.25Å; L194-C197 VanDerWaalsContact O-N 3.1Å; C197-V199 VanDerWaalsContact C-N 3.32Å; C197-G200 PolarHBondContact O-N 3.37Å; C197-M375 HydrophobicContact CB-CE 3.91Å; C197-M375 WeakPolarHBondContact SG-CE 3.09Å; C197-I376 HydrophobicContact CB-CG1 4.05Å; C197-I376 VanDerWaalsContact SG-CG1 3.52Å; C197-N406 PolarHBondContact O-ND2 3.46Å; C197-N406 VanDerWaalsContact O-ND2 3.09Å; C197-V411 HydrophobicContact CB-CG1 3.91Å
198	L	86.9	Confident	84.7	Confident	62 Å²	62	49.1 Å²	49.1	33%	0.325	26%	0.258	S	S	.	.	H	α-helix	trans	-68	-31.5	174.3	-72.7	173.3	0	0	0	112.7	L194 L195 V196 G200 N406 W408 V411	L194-L198 HydrophobicContact CD1-CD1 4.04Å; L194-L198 HydrophobicContact CD1-CD2 4.37Å; L194-L198 HydrophobicContact CD1-CG 3.99Å; L194-L198 HydrophobicContact CG-CD1 4.03Å; L194-L198 HydrophobicContact CG-CG 4.38Å; L194-L198 WeakPolarHBondContact O-CG 3.34Å; L194-L198 PolarHBondContact O-N 2.91Å; L195-L198 PolarHBondContact O-N 3.18Å; V196-L198 VanDerWaalsContact C-N 3.35Å; V196-L198 PolarHBondContact O-N 3.25Å; L198-G200 VanDerWaalsContact C-N 3.3Å; L198-G200 PolarHBondContact O-N 3.33Å; L198-N406 PolarHBondContact O-ND2 3.43Å; L198-W408 HydrophobicContact CD2-CB 3.82Å; L198-V411 HydrophobicContact CD2-CB 4.39Å; L198-V411 HydrophobicContact CD2-CG1 4.34Å
199	V	81.8	Confident	84.3	Confident	87 Å²	87	48.1 Å²	48.1	53%	0.527	25%	0.247	S	C	.	.	H	α-helix	trans	-68	-28	179.8	171.7	0	0	0	0	112.3	L195 V196 C197 I203	L195-V199 WeakPolarHBondContact O-CG2 3.4Å; V196-V199 PolarHBondContact O-N 2.94Å; C197-V199 VanDerWaalsContact C-N 3.32Å; V199-I203 HydrophobicContact CG1-CB 4.21Å; V199-I203 HydrophobicContact CG1-CD1 3.25Å; V199-I203 HydrophobicContact CG1-CG1 4.29Å; V199-I203 HydrophobicContact CG1-CG2 4.21Å
200	G	73	Confident	84.1	Confident	9 Å²	9	49 Å²	49	9%	0.093	26%	0.258	C	S	.	.			trans	117	168.1	167.2	0	0	0	0	0	116.3	C197 L198 H202 Y204	C197-G200 PolarHBondContact O-N 3.37Å; L198-G200 VanDerWaalsContact C-N 3.3Å; L198-G200 PolarHBondContact O-N 3.33Å; G200-H202 PolarHBondContact O-N 3.01Å; G200-Y204 PolarHBondContact O-N 2.65Å
201	A	70.6	Confident	83.9	Confident	7 Å²	7	49.9 Å²	49.9	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-70.3	-30.7	-167.9	0	0	0	0	0	115	Y204 S205 M300 E303	A201-Y204 WeakPolarHBondContact O-CB 3.49Å; A201-Y204 PolarHBondContact O-N 3.25Å; A201-S205 PolarHBondContact O-N 3.32Å; A201-M300 HydrophobicContact CB-CE 4.18Å; A201-E303 WeakPolarHBondContact CB-OE1 3.24Å; A201-E303 WeakPolarHBondContact CB-OE2 3.41Å
202	H	73.4	Confident	83.6	Confident	97 Å²	97	46.7 Å²	46.7	45%	0.449	25%	0.245	S	C	.	.	H	α-helix	trans	-65.6	-43.7	179.3	175.1	-94.3	0	0	0	112.1	G200 Y204 S205 R206	G200-H202 PolarHBondContact O-N 3.01Å; H202-Y204 VanDerWaalsContact C-N 3.34Å; H202-S205 PolarHBondContact O-N 3.35Å; H202-S205 PolarHBondContact O-OG 2.87Å; H202-R206 PolarHBondContact CE1-NE 3.23Å; H202-R206 VanDerWaalsContact CE1-NE 3.33Å; H202-R206 PolarHBondContact O-N 2.98Å
203	I	76.7	Confident	83.7	Confident	81 Å²	81	47 Å²	47	42%	0.415	25%	0.247	S	C	.	.	H	α-helix	trans	-66.3	-42.7	176.4	-73.5	159.1	0	0	0	109.3	V199 S205 R206 T207	V199-I203 HydrophobicContact CG1-CB 4.21Å; V199-I203 HydrophobicContact CG1-CD1 3.25Å; V199-I203 HydrophobicContact CG1-CG1 4.29Å; V199-I203 HydrophobicContact CG1-CG2 4.21Å; I203-S205 PolarHBondContact O-N 2.93Å; I203-R206 PolarHBondContact O-N 3.4Å; I203-T207 PolarHBondContact O-N 2.99Å; I203-T207 PolarHBondContact O-OG1 3.03Å
204	Y	79.1	Confident	83.7	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-53.1	-48.9	171.5	166.9	-97.2	0	0	0	112.8	G200 A201 H202 R206 T207 A208 M300 M372 C373 I376	G200-Y204 PolarHBondContact O-N 2.65Å; A201-Y204 WeakPolarHBondContact O-CB 3.49Å; A201-Y204 PolarHBondContact O-N 3.25Å; H202-Y204 VanDerWaalsContact C-N 3.34Å; Y204-R206 VanDerWaalsContact C-N 3.27Å; Y204-R206 PolarHBondContact O-N 3.45Å; Y204-T207 PolarHBondContact O-N 3.1Å; Y204-A208 HydrophobicContact CE1-CB 4.48Å; Y204-A208 HydrophobicContact CE2-CB 4.45Å; Y204-A208 WeakPolarHBondContact O-CB 3.32Å; Y204-A208 PolarHBondContact O-N 3.02Å; Y204-M300 HydrophobicContact CD1-CE 3.97Å; Y204-M300 HydrophobicContact CE1-CE 4.15Å; Y204-M300 HydrophobicContact CE1-SD 4.28Å; Y204-M372 HydrophobicContact CD2-CB 4.43Å; Y204-M372 HydrophobicContact CE2-CB 4.13Å; Y204-C373 VanDerWaalsContact OH-CB 3.27Å; Y204-C373 WeakPolarHBondContact OH-CB 3.45Å; Y204-I376 HydrophobicContact CD1-CD1 3.91Å; Y204-I376 HydrophobicContact CD2-CD1 3.5Å; Y204-I376 VanDerWaalsContact CD2-CD1 3.5Å; Y204-I376 HydrophobicContact CE1-CD1 4.37Å; Y204-I376 HydrophobicContact CE2-CD1 3.99Å; Y204-I376 HydrophobicContact CG-CD1 3.45Å; Y204-I376 VanDerWaalsContact CG-CD1 3.45Å
205	S	74.3	Confident	83.7	Confident	4 Å²	4	49.2 Å²	49.2	3%	0.028	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-32	-177.4	69.7	0	0	0	0	113.7	A201 H202 I203 F209	A201-S205 PolarHBondContact O-N 3.32Å; H202-S205 PolarHBondContact O-N 3.35Å; H202-S205 PolarHBondContact O-OG 2.87Å; I203-S205 PolarHBondContact O-N 2.93Å; S205-F209 PolarHBondContact O-N 2.71Å
206	R	80	Confident	83.8	Confident	169 Å²	169	46.6 Å²	46.6	64%	0.638	25%	0.249	S	C	*	.	H	α-helix	trans	-75.2	-44.7	176.7	-70.2	-172.9	179.1	-167.2	-1.3	111	H202 I203 Y204 A208 F209 A210	H202-R206 PolarHBondContact CE1-NE 3.23Å; H202-R206 VanDerWaalsContact CE1-NE 3.33Å; H202-R206 PolarHBondContact O-N 2.98Å; I203-R206 PolarHBondContact O-N 3.4Å; Y204-R206 VanDerWaalsContact C-N 3.27Å; Y204-R206 PolarHBondContact O-N 3.45Å; R206-A208 VanDerWaalsContact C-N 3.33Å; R206-F209 PolarHBondContact O-N 2.77Å; R206-A210 PolarHBondContact O-N 3.23Å
207	T	82.7	Confident	84.1	Confident	59 Å²	59	48 Å²	48	36%	0.362	26%	0.258	S	S	.	.	H	α-helix	trans	-63.9	-40	176.6	-55.1	0	0	0	0	111.3	I203 Y204 F209 A210 I211	I203-T207 PolarHBondContact O-N 2.99Å; I203-T207 PolarHBondContact O-OG1 3.03Å; Y204-T207 PolarHBondContact O-N 3.1Å; T207-F209 VanDerWaalsContact C-N 3.33Å; T207-F209 PolarHBondContact O-N 3.43Å; T207-A210 WeakPolarHBondContact O-CB 3.45Å; T207-A210 PolarHBondContact O-N 3.03Å; T207-A210 VanDerWaalsContact O-N 3.17Å; T207-I211 HydrophobicContact CG2-CD1 3.96Å; T207-I211 HydrophobicContact CG2-CG1 4.47Å; T207-I211 WeakPolarHBondContact O-CG1 3.43Å; T207-I211 PolarHBondContact O-N 3.43Å
208	A	84.6	Confident	84.4	Confident	1 Å²	1	48 Å²	48	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-57.8	-44.2	176.3	0	0	0	0	0	111.4	V58 L62 Y204 R206 A210 I211 L212	V58-A208 HydrophobicContact CG1-CB 4.19Å; L62-A208 HydrophobicContact CD1-CB 3.77Å; L62-A208 WeakPolarHBondContact CD1-O 3.48Å; Y204-A208 HydrophobicContact CE1-CB 4.48Å; Y204-A208 HydrophobicContact CE2-CB 4.45Å; Y204-A208 WeakPolarHBondContact O-CB 3.32Å; Y204-A208 PolarHBondContact O-N 3.02Å; R206-A208 VanDerWaalsContact C-N 3.33Å; A208-A210 PolarHBondContact O-N 3.12Å; A208-I211 PolarHBondContact O-N 3.19Å; A208-L212 PolarHBondContact O-N 2.99Å
209	F	86.6	Confident	84.6	Confident	66 Å²	66	45.3 Å²	45.3	29%	0.289	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-41.9	176	177.2	-110	0	0	0	113	F53 F54 V58 S205 R206 T207 I211 L212 L213	F53-F209 AromaticContact CE1-CD2 3.73Å; F53-F209 HydrophobicContact CE1-CD2 3.73Å; F53-F209 AromaticContact CE1-CE2 3.57Å; F53-F209 HydrophobicContact CE1-CE2 3.57Å; F53-F209 HydrophobicContact CZ-CD2 4.24Å; F53-F209 AromaticContact CZ-CE2 3.89Å; F53-F209 HydrophobicContact CZ-CE2 3.89Å; F54-F209 HydrophobicContact CD1-CB 4.15Å; F54-F209 HydrophobicContact CD1-CG 4.43Å; F54-F209 HydrophobicContact CE1-CB 3.83Å; F54-F209 HydrophobicContact CE1-CD1 4.07Å; F54-F209 HydrophobicContact CE1-CD2 4.07Å; F54-F209 AromaticContact CE1-CG 3.71Å; F54-F209 HydrophobicContact CE1-CG 3.71Å; V58-F209 HydrophobicContact CG1-CB 4.48Å; V58-F209 HydrophobicContact CG2-CD2 4.22Å; S205-F209 PolarHBondContact O-N 2.71Å; R206-F209 PolarHBondContact O-N 2.77Å; T207-F209 VanDerWaalsContact C-N 3.33Å; T207-F209 PolarHBondContact O-N 3.43Å; F209-I211 VanDerWaalsContact C-N 3.31Å; F209-I211 PolarHBondContact O-N 3.34Å; F209-L212 PolarHBondContact O-N 3.38Å; F209-L213 HydrophobicContact CD1-CD1 4.43Å; F209-L213 HydrophobicContact CE1-CD1 3.78Å; F209-L213 HydrophobicContact CE1-CG 4.43Å; F209-L213 HydrophobicContact CZ-CD1 3.93Å; F209-L213 HydrophobicContact CZ-CG 4.18Å; F209-L213 PolarHBondContact O-N 3.05Å
210	A	89	Confident	85.1	Confident	51 Å²	51	46 Å²	46	42%	0.421	24%	0.244	S	C	.	.	H	α-helix	trans	-61.5	-41.5	174.6	0	0	0	0	0	111.5	R206 T207 A208 L213 V214	R206-A210 PolarHBondContact O-N 3.23Å; T207-A210 WeakPolarHBondContact O-CB 3.45Å; T207-A210 PolarHBondContact O-N 3.03Å; T207-A210 VanDerWaalsContact O-N 3.17Å; A208-A210 PolarHBondContact O-N 3.12Å; A210-L213 PolarHBondContact O-N 3.09Å; A210-V214 WeakPolarHBondContact O-CG2 3.34Å; A210-V214 PolarHBondContact O-N 3.13Å; A210-V214 VanDerWaalsContact O-N 3.15Å
211	I	89.8	Confident	86.1	Confident	18 Å²	18	46.2 Å²	46.2	9%	0.092	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-42.7	174.5	-68.4	165.4	0	0	0	111.1	L62 T207 A208 F209 L213 V214 V215 C365 M372	L62-I211 HydrophobicContact CD2-CG2 4Å; T207-I211 HydrophobicContact CG2-CD1 3.96Å; T207-I211 HydrophobicContact CG2-CG1 4.47Å; T207-I211 WeakPolarHBondContact O-CG1 3.43Å; T207-I211 PolarHBondContact O-N 3.43Å; A208-I211 PolarHBondContact O-N 3.19Å; F209-I211 VanDerWaalsContact C-N 3.31Å; F209-I211 PolarHBondContact O-N 3.34Å; I211-L213 VanDerWaalsContact C-N 3.3Å; I211-L213 PolarHBondContact O-N 3.3Å; I211-V214 PolarHBondContact O-N 3.12Å; I211-V214 VanDerWaalsContact O-N 3.13Å; I211-V215 HydrophobicContact CG2-CG2 4.11Å; I211-V215 WeakPolarHBondContact O-CG2 3.25Å; I211-V215 PolarHBondContact O-N 2.89Å; I211-C365 HydrophobicContact CG2-CB 3.91Å; I211-C365 WeakPolarHBondContact CG2-O 3.31Å; I211-M372 HydrophobicContact CD1-CE 3.96Å
212	L	90.3	Very high	87.1	Confident	15 Å²	15	46 Å²	46	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-59.6	-41.3	177	-179.1	65.7	0	0	0	111.8	V58 I61 L62 A208 F209 V214 V215 T216	V58-L212 HydrophobicContact CB-CD2 4.27Å; V58-L212 HydrophobicContact CG1-CB 4.29Å; V58-L212 HydrophobicContact CG1-CD2 4.06Å; V58-L212 HydrophobicContact CG2-CD2 3.76Å; I61-L212 HydrophobicContact CB-CD1 4.4Å; I61-L212 HydrophobicContact CG2-CD1 3.64Å; L62-L212 HydrophobicContact CD1-CB 4.18Å; L62-L212 HydrophobicContact CD2-CB 4.02Å; L62-L212 HydrophobicContact CD2-CD1 3.96Å; L62-L212 HydrophobicContact CG-CB 4.22Å; L62-L212 HydrophobicContact CG-CD1 4.22Å; A208-L212 PolarHBondContact O-N 2.99Å; F209-L212 PolarHBondContact O-N 3.38Å; L212-V214 VanDerWaalsContact C-N 3.35Å; L212-V215 PolarHBondContact O-N 3.31Å; L212-T216 VanDerWaalsContact O-CB 3.29Å; L212-T216 WeakPolarHBondContact O-CB 3.05Å; L212-T216 PolarHBondContact O-N 3.05Å; L212-T216 PolarHBondContact O-OG1 2.87Å
213	L	92	Very high	88	Confident	95 Å²	95	43.2 Å²	43.2	50%	0.497	23%	0.229	S	C	.	.	H	α-helix	trans	-59.5	-46.7	174.5	-81.8	172.1	0	0	0	111.3	F209 A210 I211 T216 V217	F209-L213 HydrophobicContact CD1-CD1 4.43Å; F209-L213 HydrophobicContact CE1-CD1 3.78Å; F209-L213 HydrophobicContact CE1-CG 4.43Å; F209-L213 HydrophobicContact CZ-CD1 3.93Å; F209-L213 HydrophobicContact CZ-CG 4.18Å; F209-L213 PolarHBondContact O-N 3.05Å; A210-L213 PolarHBondContact O-N 3.09Å; I211-L213 VanDerWaalsContact C-N 3.3Å; I211-L213 PolarHBondContact O-N 3.3Å; L213-T216 PolarHBondContact O-N 3.38Å; L213-V217 VanDerWaalsContact O-CG2 3.31Å; L213-V217 WeakPolarHBondContact O-CG2 3.22Å; L213-V217 PolarHBondContact O-N 3Å
214	V	92.6	Very high	88.8	Confident	57 Å²	57	43.5 Å²	43.5	35%	0.345	23%	0.23	S	C	.	.	H	α-helix	trans	-61.5	-46.1	178.2	174.1	0	0	0	0	111.5	A210 I211 L212 T216 V217 S218 I361 C365	A210-V214 WeakPolarHBondContact O-CG2 3.34Å; A210-V214 PolarHBondContact O-N 3.13Å; A210-V214 VanDerWaalsContact O-N 3.15Å; I211-V214 PolarHBondContact O-N 3.12Å; I211-V214 VanDerWaalsContact O-N 3.13Å; L212-V214 VanDerWaalsContact C-N 3.35Å; V214-T216 VanDerWaalsContact C-N 3.34Å; V214-T216 PolarHBondContact O-N 2.81Å; V214-V217 PolarHBondContact O-N 3.06Å; V214-S218 WeakPolarHBondContact O-CB 3.08Å; V214-S218 PolarHBondContact O-N 2.78Å; V214-I361 HydrophobicContact CG1-CG2 3.55Å; V214-C365 HydrophobicContact CG1-CB 4.36Å
215	V	91.4	Very high	89.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-40.5	177.5	172.6	0	0	0	0	111	F65 F70 I211 L212 S218 L219 C365 A366	F65-V215 HydrophobicContact CD2-CG1 4.17Å; F70-V215 HydrophobicContact CE2-CG1 4.32Å; F70-V215 HydrophobicContact CZ-CG1 4.37Å; I211-V215 HydrophobicContact CG2-CG2 4.11Å; I211-V215 WeakPolarHBondContact O-CG2 3.25Å; I211-V215 PolarHBondContact O-N 2.89Å; L212-V215 PolarHBondContact O-N 3.31Å; V215-S218 WeakPolarHBondContact O-CB 3.16Å; V215-S218 PolarHBondContact O-N 2.83Å; V215-L219 HydrophobicContact CG1-CD1 4.11Å; V215-L219 HydrophobicContact CG1-CG 4.5Å; V215-L219 WeakPolarHBondContact O-CG 3.22Å; V215-L219 PolarHBondContact O-N 3.48Å; V215-C365 HydrophobicContact CG2-CB 4.28Å; V215-A366 HydrophobicContact CG2-CB 4.01Å
216	T	91.7	Very high	90	Very high	49 Å²	49	43.3 Å²	43.3	30%	0.301	23%	0.229	S	C	.	.	H	α-helix	trans	-65.8	-41.7	178	-54.6	0	0	0	0	111.5	L212 L213 V214 S218 L219 L220	L212-T216 VanDerWaalsContact O-CB 3.29Å; L212-T216 WeakPolarHBondContact O-CB 3.05Å; L212-T216 PolarHBondContact O-N 3.05Å; L212-T216 PolarHBondContact O-OG1 2.87Å; L213-T216 PolarHBondContact O-N 3.38Å; V214-T216 VanDerWaalsContact C-N 3.34Å; V214-T216 PolarHBondContact O-N 2.81Å; T216-S218 VanDerWaalsContact C-N 3.33Å; T216-L219 PolarHBondContact O-N 3.45Å; T216-L220 WeakPolarHBondContact O-CB 3.46Å; T216-L220 PolarHBondContact O-N 3.31Å
217	V	92.9	Very high	90.4	Very high	75 Å²	75	40.3 Å²	40.3	46%	0.455	23%	0.23	S	C	.	.	H	α-helix	trans	-63	-41.6	174.3	169.9	0	0	0	0	110.9	L213 V214 L220 S221	L213-V217 VanDerWaalsContact O-CG2 3.31Å; L213-V217 WeakPolarHBondContact O-CG2 3.22Å; L213-V217 PolarHBondContact O-N 3Å; V214-V217 PolarHBondContact O-N 3.06Å; V217-L220 PolarHBondContact O-N 3.03Å; V217-S221 WeakPolarHBondContact O-CB 3.46Å; V217-S221 PolarHBondContact O-N 2.87Å
218	S	92.8	Very high	90.7	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.014	24%	0.237	C	C	.	.	H	α-helix	trans	-60.9	-46.1	174.9	-172.7	0	0	0	0	111.9	V214 V215 T216 S221 V222 F358 V359	V214-S218 WeakPolarHBondContact O-CB 3.08Å; V214-S218 PolarHBondContact O-N 2.78Å; V215-S218 WeakPolarHBondContact O-CB 3.16Å; V215-S218 PolarHBondContact O-N 2.83Å; T216-S218 VanDerWaalsContact C-N 3.33Å; S218-S221 WeakPolarHBondContact O-CB 3.27Å; S218-S221 PolarHBondContact O-N 3.46Å; S218-V222 WeakPolarHBondContact O-CG2 3.14Å; S218-V222 PolarHBondContact O-N 3.33Å; S218-F358 WeakPolarHBondContact CB-O 3.47Å; S218-F358 PolarHBondContact OG-O 3.05Å; S218-V359 WeakPolarHBondContact OG-CA 3.32Å
219	L	91.2	Very high	90.9	Very high	6 Å²	6	41.5 Å²	41.5	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-41.9	176.4	-72.9	170.1	0	0	0	112.6	F65 L69 F70 V215 T216 S221 V222 F223 V325	F65-L219 HydrophobicContact CD2-CD1 4.14Å; F65-L219 HydrophobicContact CE2-CD1 3.8Å; F65-L219 HydrophobicContact CZ-CD1 4.22Å; L69-L219 HydrophobicContact CD2-CD1 3.9Å; L69-L219 HydrophobicContact CD2-CD2 3.57Å; L69-L219 HydrophobicContact CD2-CG 4.26Å; L69-L219 HydrophobicContact CG-CD2 4.09Å; F70-L219 HydrophobicContact CE1-CD2 3.71Å; F70-L219 HydrophobicContact CE1-CG 4.22Å; F70-L219 HydrophobicContact CZ-CD2 3.72Å; F70-L219 HydrophobicContact CZ-CG 3.87Å; V215-L219 HydrophobicContact CG1-CD1 4.11Å; V215-L219 HydrophobicContact CG1-CG 4.5Å; V215-L219 WeakPolarHBondContact O-CG 3.22Å; V215-L219 PolarHBondContact O-N 3.48Å; T216-L219 PolarHBondContact O-N 3.45Å; L219-S221 VanDerWaalsContact C-N 3.29Å; L219-S221 PolarHBondContact O-N 3.22Å; L219-V222 WeakPolarHBondContact O-CB 3.49Å; L219-V222 PolarHBondContact O-N 2.82Å; L219-V222 VanDerWaalsContact O-N 3.15Å; L219-F223 WeakPolarHBondContact O-CD2 3.42Å; L219-F223 PolarHBondContact O-N 3.12Å; L219-V325 HydrophobicContact CD1-CG1 4.37Å
220	L	92.9	Very high	91	Very high	101 Å²	101	46.7 Å²	46.7	53%	0.529	27%	0.265	S	S	.	.	H	α-helix	trans	-62.9	-39.8	176.1	-171.1	65.9	0	0	0	111	T216 V217 V222 F223 I224	T216-L220 WeakPolarHBondContact O-CB 3.46Å; T216-L220 PolarHBondContact O-N 3.31Å; V217-L220 PolarHBondContact O-N 3.03Å; L220-V222 VanDerWaalsContact C-N 3.32Å; L220-V222 PolarHBondContact O-N 3.31Å; L220-F223 PolarHBondContact O-N 2.89Å; L220-I224 HydrophobicContact CD1-CD1 4.4Å; L220-I224 HydrophobicContact CD2-CD1 4.42Å; L220-I224 HydrophobicContact CG-CD1 3.87Å; L220-I224 HydrophobicContact CG-CG1 4.46Å; L220-I224 WeakPolarHBondContact O-CB 3.42Å; L220-I224 VanDerWaalsContact O-CG1 3.26Å; L220-I224 WeakPolarHBondContact O-CG1 3.35Å; L220-I224 PolarHBondContact O-N 2.85Å
221	S	93.8	Very high	91	Very high	14 Å²	14	48.6 Å²	48.6	10%	0.098	27%	0.273	C	S	.	.	H	α-helix	trans	-59.6	-42	172.9	-178	0	0	0	0	111.8	V217 S218 L219 S225 N353	V217-S221 WeakPolarHBondContact O-CB 3.46Å; V217-S221 PolarHBondContact O-N 2.87Å; S218-S221 WeakPolarHBondContact O-CB 3.27Å; S218-S221 PolarHBondContact O-N 3.46Å; L219-S221 VanDerWaalsContact C-N 3.29Å; L219-S221 PolarHBondContact O-N 3.22Å; S221-S225 VanDerWaalsContact O-CB 3.23Å; S221-S225 WeakPolarHBondContact O-CB 3.48Å; S221-S225 PolarHBondContact O-N 3.01Å; S221-S225 PolarHBondContact O-OG 2.99Å; S221-N353 VanDerWaalsContact C-OD1 3.3Å; S221-N353 PolarHBondContact O-OD1 3.49Å; S221-N353 VanDerWaalsContact O-OD1 3.12Å; S221-N353 VanDerWaalsContact OG-CG 3.29Å; S221-N353 PolarHBondContact OG-ND2 3.47Å; S221-N353 PolarHBondContact OG-OD1 3.38Å
222	V	91.9	Very high	90.8	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.018	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-50.4	175.9	170.9	0	0	0	0	110.3	F70 S218 L219 L220 I224 S225 T226 L329 L349 V359	F70-V222 HydrophobicContact CE1-CG2 4.46Å; S218-V222 WeakPolarHBondContact O-CG2 3.14Å; S218-V222 PolarHBondContact O-N 3.33Å; L219-V222 WeakPolarHBondContact O-CB 3.49Å; L219-V222 PolarHBondContact O-N 2.82Å; L219-V222 VanDerWaalsContact O-N 3.15Å; L220-V222 VanDerWaalsContact C-N 3.32Å; L220-V222 PolarHBondContact O-N 3.31Å; V222-I224 PolarHBondContact O-N 2.94Å; V222-S225 PolarHBondContact O-N 2.73Å; V222-S225 VanDerWaalsContact O-N 3.15Å; V222-T226 WeakPolarHBondContact O-CG2 3.3Å; V222-T226 PolarHBondContact O-N 3.48Å; V222-L329 HydrophobicContact CG1-CD1 3.93Å; V222-L349 HydrophobicContact CG1-CD2 3.9Å; V222-V359 HydrophobicContact CG2-CG2 3.75Å
223	F	92.7	Very high	90.6	Very high	38 Å²	38	58 Å²	58	17%	0.167	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-46	179.6	-66.6	-42.5	0	0	0	112.7	L219 L220 S225 T226 V325 L328 L329 L332	L219-F223 WeakPolarHBondContact O-CD2 3.42Å; L219-F223 PolarHBondContact O-N 3.12Å; L220-F223 PolarHBondContact O-N 2.89Å; F223-S225 VanDerWaalsContact C-N 3.28Å; F223-S225 PolarHBondContact O-N 3.43Å; F223-T226 PolarHBondContact O-N 2.94Å; F223-T226 PolarHBondContact O-OG1 3.4Å; F223-V325 HydrophobicContact CZ-CG1 4.22Å; F223-L328 HydrophobicContact CD1-CD2 4.2Å; F223-L328 HydrophobicContact CD1-CG 4.48Å; F223-L328 HydrophobicContact CD2-CD2 4.46Å; F223-L328 HydrophobicContact CE1-CB 4.43Å; F223-L328 HydrophobicContact CE1-CD2 3.78Å; F223-L328 HydrophobicContact CE1-CG 3.92Å; F223-L328 HydrophobicContact CE2-CD2 4.07Å; F223-L328 HydrophobicContact CZ-CB 4.47Å; F223-L328 HydrophobicContact CZ-CD2 3.71Å; F223-L328 HydrophobicContact CZ-CG 4.21Å; F223-L329 HydrophobicContact CE1-CB 4.27Å; F223-L329 HydrophobicContact CE1-CD1 4.03Å; F223-L332 HydrophobicContact CD1-CD1 3.38Å; F223-L332 HydrophobicContact CE1-CD1 3.81Å; F223-L332 HydrophobicContact CG-CD1 4.41Å
224	I	92.2	Very high	90.3	Very high	87 Å²	87	55.2 Å²	55.2	45%	0.446	30%	0.304	S	S	.	.	H	α-helix	trans	-62.4	-39.6	176.7	-65.3	168.1	0	0	0	110.5	L220 V222 T226 V227 A228 I354	L220-I224 HydrophobicContact CD1-CD1 4.4Å; L220-I224 HydrophobicContact CD2-CD1 4.42Å; L220-I224 HydrophobicContact CG-CD1 3.87Å; L220-I224 HydrophobicContact CG-CG1 4.46Å; L220-I224 WeakPolarHBondContact O-CB 3.42Å; L220-I224 VanDerWaalsContact O-CG1 3.26Å; L220-I224 WeakPolarHBondContact O-CG1 3.35Å; L220-I224 PolarHBondContact O-N 2.85Å; V222-I224 PolarHBondContact O-N 2.94Å; I224-T226 VanDerWaalsContact C-N 3.34Å; I224-T226 PolarHBondContact O-N 3Å; I224-V227 PolarHBondContact O-N 2.9Å; I224-V227 VanDerWaalsContact O-N 3.11Å; I224-A228 HydrophobicContact CG2-CB 4.36Å; I224-A228 VanDerWaalsContact O-CB 3.32Å; I224-A228 WeakPolarHBondContact O-CB 3.17Å; I224-A228 PolarHBondContact O-N 3.3Å; I224-I354 HydrophobicContact CG2-CD1 3.82Å
225	S	90.9	Very high	89.8	Confident	1 Å²	1	57 Å²	57	1%	0.007	32%	0.315	C	S	.	.	H	α-helix	trans	-65.2	-34.8	-179.1	-61.6	0	0	0	0	113.1	S221 V222 F223 V227 A228 V229 Y252 N353 I354	S221-S225 VanDerWaalsContact O-CB 3.23Å; S221-S225 WeakPolarHBondContact O-CB 3.48Å; S221-S225 PolarHBondContact O-N 3.01Å; S221-S225 PolarHBondContact O-OG 2.99Å; V222-S225 PolarHBondContact O-N 2.73Å; V222-S225 VanDerWaalsContact O-N 3.15Å; F223-S225 VanDerWaalsContact C-N 3.28Å; F223-S225 PolarHBondContact O-N 3.43Å; S225-V227 PolarHBondContact O-N 3.3Å; S225-V227 VanDerWaalsContact O-N 3.16Å; S225-A228 PolarHBondContact O-N 2.8Å; S225-V229 WeakPolarHBondContact O-CB 3.46Å; S225-V229 WeakPolarHBondContact O-CG2 3.09Å; S225-V229 PolarHBondContact O-N 2.96Å; S225-Y252 PolarHBondContact O-OH 3.09Å; S225-N353 PolarHBondContact OG-OD1 2.96Å; S225-I354 WeakPolarHBondContact OG-CG1 3.46Å; S225-I354 PolarHBondContact OG-N 3.41Å
226	T	87.9	Confident	89.3	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.012	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-23.4	174.8	64.5	0	0	0	0	113.4	V222 F223 I224 Y252 F255 L332	V222-T226 WeakPolarHBondContact O-CG2 3.3Å; V222-T226 PolarHBondContact O-N 3.48Å; F223-T226 PolarHBondContact O-N 2.94Å; F223-T226 PolarHBondContact O-OG1 3.4Å; I224-T226 VanDerWaalsContact C-N 3.34Å; I224-T226 PolarHBondContact O-N 3Å; T226-Y252 WeakPolarHBondContact CA-OH 3.37Å; T226-Y252 PolarHBondContact O-OH 3.21Å; T226-F255 VanDerWaalsContact O-CE2 3.28Å; T226-F255 WeakPolarHBondContact O-CE2 3.48Å; T226-L332 HydrophobicContact CG2-CB 4.39Å
227	V	88.4	Confident	88.6	Confident	107 Å²	107	59.6 Å²	59.6	65%	0.648	33%	0.33	S	S	*	.	H	α-helix	trans	-98.8	-39.5	178.4	-174.2	0	0	0	0	111.9	I224 S225 F255	I224-V227 PolarHBondContact O-N 2.9Å; I224-V227 VanDerWaalsContact O-N 3.11Å; S225-V227 PolarHBondContact O-N 3.3Å; S225-V227 VanDerWaalsContact O-N 3.16Å; V227-F255 HydrophobicContact CB-CE2 4.34Å; V227-F255 HydrophobicContact CG2-CE2 3.83Å; V227-F255 HydrophobicContact CG2-CZ 4.21Å
228	A	88.9	Confident	87.5	Confident	63 Å²	63	60 Å²	60	52%	0.521	32%	0.323	S	S	.	.	H	α-helix	trans	-88.2	-26.2	-169	0	0	0	0	0	114.5	I224 S225 I354	I224-A228 HydrophobicContact CG2-CB 4.36Å; I224-A228 VanDerWaalsContact O-CB 3.32Å; I224-A228 WeakPolarHBondContact O-CB 3.17Å; I224-A228 PolarHBondContact O-N 3.3Å; S225-A228 PolarHBondContact O-N 2.8Å; A228-I354 HydrophobicContact CB-CD1 4.02Å
229	V	89.4	Confident	86.3	Confident	21 Å²	21	64.5 Å²	64.5	13%	0.127	35%	0.35	C	S	.	.	S	Bend	trans	-81.5	132.9	-175.5	177.1	0	0	0	0	110.3	S225 K232 Y252 I352 I354	S225-V229 WeakPolarHBondContact O-CB 3.46Å; S225-V229 WeakPolarHBondContact O-CG2 3.09Å; S225-V229 PolarHBondContact O-N 2.96Å; V229-K232 HydrophobicContact CG1-CD 4.34Å; V229-Y252 HydrophobicContact CB-CE1 4.12Å; V229-Y252 HydrophobicContact CG1-CD1 4.37Å; V229-Y252 HydrophobicContact CG1-CE1 3.99Å; V229-Y252 WeakPolarHBondContact O-CE1 3.32Å; V229-I352 WeakPolarHBondContact CG2-O 3.35Å; V229-I354 HydrophobicContact CG2-CG1 3.8Å
230	K	88.1	Confident	84.9	Confident	175 Å²	175	64.8 Å²	64.8	76%	0.761	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-71.3	156.8	175.3	-65.4	-175.6	-179	-178.8	0	111.1	K232	K230-K232 PolarHBondContact O-N 2.92Å
231	P	88.8	Confident	83.2	Confident	91 Å²	91	66.3 Å²	66.3	59%	0.591	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-53.4	138.5	177	-25.6	34.7	0	0	0	112.3	Y252 T253	P231-Y252 CarbonylContact C-O 3.04Å; P231-Y252 WeakPolarHBondContact CA-O 3.32Å; P231-Y252 WeakPolarHBondContact CB-O 3.24Å; P231-T253 WeakPolarHBondContact CG-O 3.27Å
232	K	86.6	Confident	81.6	Confident	92 Å²	92	68.9 Å²	68.9	40%	0.4	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	135.7	-177.4	-72.9	180	-177.2	175.6	0	110.2	V229 K230 F234 S251 Y252	V229-K232 HydrophobicContact CG1-CD 4.34Å; K230-K232 PolarHBondContact O-N 2.92Å; K232-F234 HydrophobicContact CB-CE1 4.35Å; K232-F234 HydrophobicContact CB-CE2 4.14Å; K232-F234 HydrophobicContact CB-CZ 3.8Å; K232-F234 HydrophobicContact CD-CZ 4.2Å; K232-S251 CarbonylContact O-C 3.43Å; K232-Y252 PolarHBondContact N-O 3.03Å; K232-Y252 PolarHBondContact O-N 2.98Å
233	D	86.5	Confident	80.4	Confident	140 Å²	140	75.8 Å²	75.8	75%	0.749	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	141.2	174.5	-59.1	-37.3	0	0	0	110.9	S251	D233-S251 WeakPolarHBondContact OD1-CB 3.48Å
234	F	84.1	Confident	79.6	Confident	36 Å²	36	80.7 Å²	80.7	16%	0.158	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	142.1	-179.1	-51.9	-74.7	0	0	0	109.5	K232 A250 L341 R351 I352	K232-F234 HydrophobicContact CB-CE1 4.35Å; K232-F234 HydrophobicContact CB-CE2 4.14Å; K232-F234 HydrophobicContact CB-CZ 3.8Å; K232-F234 HydrophobicContact CD-CZ 4.2Å; F234-A250 CarbonylContact C-O 3.57Å; F234-A250 WeakPolarHBondContact CA-O 3.44Å; F234-A250 WeakPolarHBondContact CB-O 3.43Å; F234-A250 PolarHBondContact N-O 3.48Å; F234-A250 PolarHBondContact O-N 2.85Å; F234-L341 HydrophobicContact CD2-CD1 4.02Å; F234-L341 HydrophobicContact CD2-CD2 4.28Å; F234-L341 HydrophobicContact CE2-CD2 4.23Å; F234-R351 HydrophobicContact CE1-CB 4.32Å; F234-R351 HydrophobicContact CZ-CB 4.28Å; F234-I352 HydrophobicContact CE2-CG2 4.36Å; F234-I352 HydrophobicContact CZ-CG2 4.41Å
235	V	82.5	Confident	78.8	Confident	95 Å²	95	81.3 Å²	81.3	58%	0.576	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	113.7	170.3	-178.1	0	0	0	0	107.4	T237	V235-T237 HydrophobicContact CG1-CG2 4.5Å
236	I	80.2	Confident	78.1	Confident	16 Å²	16	84.2 Å²	84.2	8%	0.082	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	122.8	-179.8	-58.8	168.2	0	0	0	108.1	R238 Y248 A250 L341 Q344 D345	I236-R238 HydrophobicContact CG2-CG 4.33Å; I236-Y248 PolarHBondContact N-O 2.74Å; I236-Y248 PolarHBondContact O-N 3.19Å; I236-A250 HydrophobicContact CD1-CB 3.91Å; I236-L341 HydrophobicContact CD1-CD1 4.09Å; I236-Q344 HydrophobicContact CD1-CB 4.05Å; I236-Q344 HydrophobicContact CG2-CB 4.38Å; I236-D345 HydrophobicContact CD1-CB 4Å
237	T	78.1	Confident	77.8	Confident	87 Å²	87	92.9 Å²	92.9	53%	0.534	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.2	178.5	57.7	0	0	0	0	110.5	V235 I246 R247	V235-T237 HydrophobicContact CG1-CG2 4.5Å; T237-I246 WeakPolarHBondContact CA-O 3.38Å; T237-R247 HydrophobicContact CG2-CG 4.03Å
238	R	69.1	Low	77.4	Confident	82 Å²	82	91.4 Å²	91.4	31%	0.309	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151	177.8	-64.7	-66.4	-170.7	-173.8	-1.7	110.7	I236 T245 I246 Y248 Y272 Q344	I236-R238 HydrophobicContact CG2-CG 4.33Å; R238-T245 CarbonylContact O-C 3.52Å; R238-T245 WeakPolarHBondContact O-CA 3.43Å; R238-I246 PolarHBondContact N-O 2.85Å; R238-I246 PolarHBondContact O-N 3.44Å; R238-Y248 HydrophobicContact CB-CE2 4.36Å; R238-Y248 HydrophobicContact CG-CE2 4.36Å; R238-Y272 VanDerWaalsContact NH2-CE2 3.3Å; R238-Q344 PolarHBondContact NH2-O 3.3Å
239	V	67.8	Low	77.3	Confident	97 Å²	97	94.5 Å²	94.5	59%	0.588	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	115.5	171.3	-173.6	0	0	0	0	108
240	G	62.8	Low	77.1	Confident	13 Å²	13	93.7 Å²	93.7	13%	0.134	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	174.9	176.4	0	0	0	0	0	112.9	G242 N243 Q244	G240-G242 PolarHBondContact O-N 3.39Å; G240-G242 VanDerWaalsContact O-N 3.12Å; G240-N243 PolarHBondContact O-N 3.49Å; G240-Q244 PolarHBondContact N-O 3.2Å
241	P	57.5	Low	77.2	Confident	132 Å²	132	86.6 Å²	86.6	86%	0.857	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	117.6	177	18.2	-24.1	0	0	0	110.5
242	G	59.7	Low	77.3	Confident	68 Å²	68	82.2 Å²	82.2	70%	0.701	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.6	25.3	-177.4	0	0	0	0	0	116.4	G240 Q244	G240-G242 PolarHBondContact O-N 3.39Å; G240-G242 VanDerWaalsContact O-N 3.12Å; G242-Q244 PolarHBondContact O-N 2.99Å; G242-Q244 VanDerWaalsContact O-N 3.16Å
243	N	67.4	Low	77.4	Confident	149 Å²	149	79.9 Å²	79.9	80%	0.797	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	21.4	-179.3	-74.3	0.2	0	0	0	114.8	G240	G240-N243 PolarHBondContact O-N 3.49Å
244	Q	74	Confident	77.5	Confident	140 Å²	140	73.6 Å²	73.6	65%	0.654	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	133	174.4	-65.7	-174.7	-1.1	0	0	110.3	G240 G242 I246	G240-Q244 PolarHBondContact N-O 3.2Å; G242-Q244 PolarHBondContact O-N 2.99Å; G242-Q244 VanDerWaalsContact O-N 3.16Å; Q244-I246 PolarHBondContact O-N 3.41Å
245	T	75.4	Confident	77.7	Confident	100 Å²	100	77.5 Å²	77.5	61%	0.613	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	108.3	176	49.5	0	0	0	0	110.4	R238	R238-T245 CarbonylContact O-C 3.52Å; R238-T245 WeakPolarHBondContact O-CA 3.43Å
246	I	77.7	Confident	78.2	Confident	63 Å²	63	74.7 Å²	74.7	32%	0.323	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	130.4	175.9	-55.6	175.7	0	0	0	108.5	T237 R238 Q244 Y248	T237-I246 WeakPolarHBondContact CA-O 3.38Å; R238-I246 PolarHBondContact N-O 2.85Å; R238-I246 PolarHBondContact O-N 3.44Å; Q244-I246 PolarHBondContact O-N 3.41Å; I246-Y248 HydrophobicContact CB-CE2 4.16Å; I246-Y248 HydrophobicContact CG2-CD2 4.27Å; I246-Y248 HydrophobicContact CG2-CE1 4.1Å; I246-Y248 HydrophobicContact CG2-CE2 3.65Å
247	R	80.3	Confident	78.8	Confident	184 Å²	184	78 Å²	78	69%	0.694	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	124.4	177.7	-55.3	-166.2	176.6	-178.1	-2.1	110.2	T237	T237-R247 HydrophobicContact CG2-CG 4.03Å
248	Y	81	Confident	79.4	Confident	76 Å²	76	78.2 Å²	78.2	30%	0.298	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.9	174.2	-61	-82.1	0	0	0	109.4	I236 R238 I246 Q344	I236-Y248 PolarHBondContact N-O 2.74Å; I236-Y248 PolarHBondContact O-N 3.19Å; R238-Y248 HydrophobicContact CB-CE2 4.36Å; R238-Y248 HydrophobicContact CG-CE2 4.36Å; I246-Y248 HydrophobicContact CB-CE2 4.16Å; I246-Y248 HydrophobicContact CG2-CD2 4.27Å; I246-Y248 HydrophobicContact CG2-CE1 4.1Å; I246-Y248 HydrophobicContact CG2-CE2 3.65Å; Y248-Q344 HydrophobicContact CD1-CG 4.45Å; Y248-Q344 HydrophobicContact CD2-CG 4.19Å; Y248-Q344 HydrophobicContact CG-CG 4.14Å
249	N	85.6	Confident	80.5	Confident	128 Å²	128	74.5 Å²	74.5	68%	0.684	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	118.6	170.1	-67.8	-13.9	0	0	0	107.9	T340	N249-T340 PolarHBondContact O-OG1 3.41Å
250	A	86.2	Confident	81.7	Confident	3 Å²	3	72.6 Å²	72.6	3%	0.025	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	134.2	-175.5	0	0	0	0	0	109.4	F234 I236 T340 L341	F234-A250 CarbonylContact C-O 3.57Å; F234-A250 WeakPolarHBondContact CA-O 3.44Å; F234-A250 WeakPolarHBondContact CB-O 3.43Å; F234-A250 PolarHBondContact N-O 3.48Å; F234-A250 PolarHBondContact O-N 2.85Å; I236-A250 HydrophobicContact CD1-CB 3.91Å; A250-T340 WeakPolarHBondContact CA-OG1 3.32Å; A250-L341 HydrophobicContact CB-CB 3.95Å; A250-L341 HydrophobicContact CB-CD1 4.06Å
251	S	89.4	Confident	83.2	Confident	26 Å²	26	81.6 Å²	81.6	18%	0.182	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138	-175.4	59.6	0	0	0	0	112.1	K232 D233 D338	K232-S251 CarbonylContact O-C 3.43Å; D233-S251 WeakPolarHBondContact OD1-CB 3.48Å; S251-D338 VanDerWaalsContact O-CB 3.26Å; S251-D338 WeakPolarHBondContact O-CB 3.41Å; S251-D338 PolarHBondContact O-N 3.24Å; S251-D338 VanDerWaalsContact O-N 3.08Å
252	Y	90.8	Very high	84.9	Confident	0 Å²	0	80 Å²	80	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	110.3	158.2	174.1	-101.4	0	0	0	108	S225 T226 V229 P231 K232 T336 I352	S225-Y252 PolarHBondContact O-OH 3.09Å; T226-Y252 WeakPolarHBondContact CA-OH 3.37Å; T226-Y252 PolarHBondContact O-OH 3.21Å; V229-Y252 HydrophobicContact CB-CE1 4.12Å; V229-Y252 HydrophobicContact CG1-CD1 4.37Å; V229-Y252 HydrophobicContact CG1-CE1 3.99Å; V229-Y252 WeakPolarHBondContact O-CE1 3.32Å; P231-Y252 CarbonylContact C-O 3.04Å; P231-Y252 WeakPolarHBondContact CA-O 3.32Å; P231-Y252 WeakPolarHBondContact CB-O 3.24Å; K232-Y252 PolarHBondContact N-O 3.03Å; K232-Y252 PolarHBondContact O-N 2.98Å; Y252-T336 WeakPolarHBondContact CD2-O 3.46Å; Y252-I352 HydrophobicContact CD2-CB 4.18Å; Y252-I352 HydrophobicContact CD2-CD1 4.3Å; Y252-I352 HydrophobicContact CD2-CG2 3.77Å; Y252-I352 HydrophobicContact CE2-CB 4.38Å; Y252-I352 HydrophobicContact CE2-CD1 4.18Å; Y252-I352 HydrophobicContact CE2-CG2 4.45Å; Y252-I352 HydrophobicContact CG-CG2 3.97Å
253	T	88.7	Confident	86.5	Confident	42 Å²	42	76.8 Å²	76.8	26%	0.258	39%	0.394	S	S	.	.			trans	-90.8	-8.4	-171.6	57.6	0	0	0	0	113.5	P231 T259 T336	P231-T253 WeakPolarHBondContact CG-O 3.27Å; T253-T259 PolarHBondContact OG1-OG1 3.11Å; T253-T336 PolarHBondContact N-O 2.88Å; T253-T336 PolarHBondContact OG1-O 3.18Å
254	G	88.4	Confident	87.8	Confident	9 Å²	9	72.8 Å²	72.8	9%	0.093	37%	0.372	C	S	.	.			trans	63.1	-171.9	-159.4	0	0	0	0	0	111.1	S256 T336	G254-S256 PolarHBondContact O-N 3.45Å; G254-T336 PolarHBondContact N-O 3.16Å; G254-T336 WeakPolarHBondContact O-CA 3.34Å
255	F	90.2	Very high	88.7	Confident	118 Å²	118	68 Å²	68	52%	0.518	36%	0.36	S	S	.	.	S	Bend	trans	-59.7	108.5	-179.9	-75.5	-83.7	0	0	0	111.4	T226 V227 L332 A335 T336	T226-F255 VanDerWaalsContact O-CE2 3.28Å; T226-F255 WeakPolarHBondContact O-CE2 3.48Å; V227-F255 HydrophobicContact CB-CE2 4.34Å; V227-F255 HydrophobicContact CG2-CE2 3.83Å; V227-F255 HydrophobicContact CG2-CZ 4.21Å; F255-L332 HydrophobicContact CE1-CD2 3.83Å; F255-L332 HydrophobicContact CZ-CD2 3.63Å; F255-A335 HydrophobicContact CD1-CB 4.18Å; F255-A335 HydrophobicContact CE1-CB 4.45Å; F255-T336 HydrophobicContact CD1-CG2 4.14Å; F255-T336 HydrophobicContact CD2-CG2 4.2Å; F255-T336 HydrophobicContact CE1-CG2 4.19Å; F255-T336 HydrophobicContact CE2-CG2 4.22Å; F255-T336 HydrophobicContact CG-CG2 4.16Å; F255-T336 HydrophobicContact CZ-CG2 4.23Å
256	S	92.1	Very high	89.5	Confident	36 Å²	36	66.6 Å²	66.6	25%	0.252	35%	0.354	S	S	.	.			trans	-136.7	129.5	178.6	179.9	0	0	0	0	111.5	G254 T258 T259 L260 A335	G254-S256 PolarHBondContact O-N 3.45Å; S256-T258 PolarHBondContact O-N 2.82Å; S256-T258 PolarHBondContact OG-N 2.84Å; S256-T258 PolarHBondContact OG-OG1 2.76Å; S256-T259 WeakPolarHBondContact CB-OG1 3.37Å; S256-T259 PolarHBondContact O-N 3.42Å; S256-L260 PolarHBondContact O-N 3.06Å; S256-A335 PolarHBondContact N-O 3.06Å; S256-A335 VanDerWaalsContact N-O 3.1Å
257	A	92.1	Very high	90.1	Very high	84 Å²	84	64.9 Å²	64.9	69%	0.694	35%	0.352	S	S	*	.	H	α-helix	trans	-64.9	-28.8	175.9	0	0	0	0	0	112.4	R261	A257-R261 WeakPolarHBondContact O-CB 3.26Å; A257-R261 PolarHBondContact O-N 3.13Å
258	T	92.1	Very high	90.6	Very high	92 Å²	92	59.1 Å²	59.1	56%	0.564	33%	0.331	S	S	*	.	H	α-helix	trans	-71.4	-45.1	177.6	59.4	0	0	0	0	111	S256 R261 N262	S256-T258 PolarHBondContact O-N 2.82Å; S256-T258 PolarHBondContact OG-N 2.84Å; S256-T258 PolarHBondContact OG-OG1 2.76Å; T258-R261 PolarHBondContact O-N 3.03Å; T258-N262 VanDerWaalsContact O-CG 3.25Å; T258-N262 PolarHBondContact O-N 2.89Å; T258-N262 PolarHBondContact O-OD1 2.9Å
259	T	91.9	Very high	90.9	Very high	5 Å²	5	57.3 Å²	57.3	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-60.6	-46.1	175.5	-52.9	0	0	0	0	110.7	T253 S256 R261 N262 N263 C337	T253-T259 PolarHBondContact OG1-OG1 3.11Å; S256-T259 WeakPolarHBondContact CB-OG1 3.37Å; S256-T259 PolarHBondContact O-N 3.42Å; T259-R261 PolarHBondContact O-N 3.21Å; T259-N262 PolarHBondContact O-N 2.88Å; T259-N263 PolarHBondContact O-N 3.34Å; T259-N263 VanDerWaalsContact O-N 3.08Å; T259-N263 PolarHBondContact O-ND2 2.87Å; T259-C337 WeakPolarHBondContact CG2-O 3.47Å
260	L	93.4	Very high	90.9	Very high	57 Å²	57	55.3 Å²	55.3	30%	0.298	32%	0.318	S	S	.	.	H	α-helix	trans	-56.9	-49.2	174.8	-177	60.3	0	0	0	111.3	L82 S256 N262 N263 L264 S334 A335	L82-L260 HydrophobicContact CD2-CD1 3.74Å; S256-L260 PolarHBondContact O-N 3.06Å; L260-N262 VanDerWaalsContact C-N 3.29Å; L260-N262 PolarHBondContact O-N 2.73Å; L260-N263 CarbonylContact O-C 3.53Å; L260-N263 PolarHBondContact O-N 3.32Å; L260-N263 VanDerWaalsContact O-N 3.08Å; L260-L264 HydrophobicContact CD1-CD1 4.1Å; L260-L264 HydrophobicContact CG-CD1 3.87Å; L260-L264 WeakPolarHBondContact O-CD1 3.44Å; L260-L264 PolarHBondContact O-N 2.98Å; L260-L264 VanDerWaalsContact O-N 3.14Å; L260-S334 WeakPolarHBondContact CA-O 3.42Å; L260-A335 HydrophobicContact CD1-CB 4.24Å
261	R	93.8	Very high	90.8	Very high	201 Å²	201	55.1 Å²	55.1	76%	0.758	32%	0.317	S	S	*	.	H	α-helix	trans	-58.8	-38.3	178.8	-170.6	175.9	179.3	178.7	-0.8	112.7	A257 T258 T259 N263 L264	A257-R261 WeakPolarHBondContact O-CB 3.26Å; A257-R261 PolarHBondContact O-N 3.13Å; T258-R261 PolarHBondContact O-N 3.03Å; T259-R261 PolarHBondContact O-N 3.21Å; R261-N263 VanDerWaalsContact C-N 3.3Å; R261-N263 PolarHBondContact O-N 3.47Å; R261-L264 PolarHBondContact O-N 2.78Å
262	N	92.2	Very high	90.1	Very high	99 Å²	99	56.2 Å²	56.2	53%	0.529	32%	0.318	S	S	.	.	H	α-helix	trans	-70.6	-27.7	178.1	-67.9	-11.6	0	0	0	112.8	T258 T259 L260 R339	T258-N262 VanDerWaalsContact O-CG 3.25Å; T258-N262 PolarHBondContact O-N 2.89Å; T258-N262 PolarHBondContact O-OD1 2.9Å; T259-N262 PolarHBondContact O-N 2.88Å; L260-N262 VanDerWaalsContact C-N 3.29Å; L260-N262 PolarHBondContact O-N 2.73Å; N262-R339 PolarHBondContact O-NH1 3.41Å
263	N	94.6	Very high	89.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-91.5	-2	178.9	-72.1	-32.5	0	0	0	114.1	G81 L82 T259 L260 R261 S334 C337 R339	G81-N263 CarbonylContact C-O 3.45Å; G81-N263 WeakPolarHBondContact CA-O 3.34Å; L82-N263 PolarHBondContact N-O 3.33Å; T259-N263 PolarHBondContact O-N 3.34Å; T259-N263 VanDerWaalsContact O-N 3.08Å; T259-N263 PolarHBondContact O-ND2 2.87Å; L260-N263 CarbonylContact O-C 3.53Å; L260-N263 PolarHBondContact O-N 3.32Å; L260-N263 VanDerWaalsContact O-N 3.08Å; R261-N263 VanDerWaalsContact C-N 3.3Å; R261-N263 PolarHBondContact O-N 3.47Å; N263-S334 PolarHBondContact ND2-O 3.39Å; N263-C337 PolarHBondContact ND2-O 3.38Å; N263-R339 WeakPolarHBondContact OD1-CA 3.03Å; N263-R339 VanDerWaalsContact OD1-CB 3.29Å; N263-R339 WeakPolarHBondContact OD1-CB 3.41Å
264	L	93.6	Very high	88.4	Confident	65 Å²	65	59.2 Å²	59.2	34%	0.34	34%	0.338	S	S	.	.	S	Bend	trans	-65.6	-45	-176.7	-111.6	76.1	0	0	0	113	L83 L260 R261	L83-L264 HydrophobicContact CD1-CD2 4.37Å; L83-L264 HydrophobicContact CD1-CG 4.42Å; L83-L264 HydrophobicContact CG-CG 4.41Å; L83-L264 PolarHBondContact N-O 3.05Å; L260-L264 HydrophobicContact CD1-CD1 4.1Å; L260-L264 HydrophobicContact CG-CD1 3.87Å; L260-L264 WeakPolarHBondContact O-CD1 3.44Å; L260-L264 PolarHBondContact O-N 2.98Å; L260-L264 VanDerWaalsContact O-N 3.14Å; R261-L264 PolarHBondContact O-N 2.78Å
265	G	92.7	Very high	87.8	Confident	39 Å²	39	64.6 Å²	64.6	40%	0.402	37%	0.365	S	S	.	.	S	Bend	trans	-92.3	164	-174.3	0	0	0	0	0	114	G81 R339	G81-G265 WeakPolarHBondContact CA-O 3.31Å; G265-R339 PolarHBondContact O-NH1 3.12Å; G265-R339 PolarHBondContact O-NH2 3Å; G265-R339 VanDerWaalsContact O-NH2 3.16Å
266	S	92.7	Very high	87.4	Confident	71 Å²	71	61.4 Å²	61.4	50%	0.497	36%	0.357	S	S	.	.			trans	-77.9	157.2	176.2	62.6	0	0	0	0	112.8	A80 Q84	A80-S266 VanDerWaalsContact O-CA 3.25Å; A80-S266 WeakPolarHBondContact O-CA 3.27Å; A80-S266 VanDerWaalsContact O-CB 3.28Å; A80-S266 WeakPolarHBondContact O-CB 3.37Å; Q84-S266 PolarHBondContact OE1-OG 3.45Å
267	G	89.8	Confident	87.1	Confident	27 Å²	27	64.8 Å²	64.8	28%	0.278	38%	0.376	S	S	.	.			trans	-169.5	61.4	-170	0	0	0	0	0	108.4	H79 S269	H79-G267 CarbonylContact O-C 3.5Å; H79-G267 PolarHBondContact O-N 3.22Å; G267-S269 PolarHBondContact O-N 2.94Å
268	Y	91.1	Very high	87	Confident	63 Å²	63	61.3 Å²	61.3	25%	0.247	35%	0.345	C	S	.	.			trans	-62.7	127	178.4	-66.3	-75.7	0	0	0	109.8	H79 Q84 M88 M278 S279 F280 V283	H79-Y268 HydrophobicContact CB-CD1 3.97Å; H79-Y268 HydrophobicContact CB-CE1 4.3Å; Q84-Y268 PolarHBondContact NE2-OH 3.35Å; Q84-Y268 PolarHBondContact OE1-OH 3.11Å; Q84-Y268 VanDerWaalsContact OE1-OH 3.11Å; M88-Y268 WeakPolarHBondContact CE-OH 3.26Å; Y268-M278 WeakPolarHBondContact CB-O 3.39Å; Y268-M278 HydrophobicContact CD1-CB 4.18Å; Y268-S279 VanDerWaalsContact CE1-C 3.44Å; Y268-F280 WeakPolarHBondContact OH-CA 3.39Å; Y268-V283 HydrophobicContact CD1-CG2 4.27Å; Y268-V283 HydrophobicContact CE1-CB 4.39Å; Y268-V283 HydrophobicContact CE1-CG2 3.93Å
269	S	88	Confident	86.9	Confident	38 Å²	38	59.1 Å²	59.1	27%	0.266	33%	0.334	S	S	.	.			trans	-135.8	175.2	-176.2	67.6	0	0	0	0	109.9	H79 G267 D271 M278	H79-S269 PolarHBondContact CE1-O 3.17Å; H79-S269 PolarHBondContact CE1-OG 2.76Å; H79-S269 PolarHBondContact ND1-N 3.02Å; H79-S269 PolarHBondContact ND1-OG 3.19Å; G267-S269 PolarHBondContact O-N 2.94Å; S269-D271 PolarHBondContact O-N 3.2Å; S269-M278 PolarHBondContact O-N 3.26Å; S269-M278 VanDerWaalsContact O-N 3.15Å
270	L	85.6	Confident	86.9	Confident	86 Å²	86	61.6 Å²	61.6	45%	0.45	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-66.3	127.5	174.6	-172.6	137.2	0	0	0	109.6
271	D	83.3	Confident	86.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.336	C	S	.	.			trans	-78.6	134.3	175.4	175	47.9	0	0	0	110.6	F75 S269 S273 T274 N275 S276 M278 Y346	F75-D271 HydrophobicContact CE2-CB 4.39Å; S269-D271 PolarHBondContact O-N 3.2Å; D271-S273 VanDerWaalsContact C-N 3.32Å; D271-S273 PolarHBondContact O-N 2.83Å; D271-S273 PolarHBondContact OD2-N 3.45Å; D271-S273 PolarHBondContact OD2-OG 2.87Å; D271-T274 PolarHBondContact OD2-N 3.23Å; D271-T274 VanDerWaalsContact OD2-N 3.08Å; D271-T274 PolarHBondContact OD2-OG1 3.32Å; D271-N275 VanDerWaalsContact O-CA 3.27Å; D271-N275 WeakPolarHBondContact O-CA 3.39Å; D271-N275 PolarHBondContact O-N 3.42Å; D271-S276 PolarHBondContact N-O 2.89Å; D271-M278 HydrophobicContact CB-CE 3.75Å; D271-M278 HydrophobicContact CB-CG 3.95Å; D271-M278 HydrophobicContact CB-SD 4.17Å; D271-Y346 PolarHBondContact OD1-OH 3.11Å; D271-Y346 PolarHBondContact OD2-OH 2.92Å
272	Y	74.9	Confident	86.4	Confident	49 Å²	49	52.4 Å²	52.4	19%	0.192	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-20.8	-175.5	71.4	-96.6	0	0	0	113.3	R238 I343 Q344 Y346	R238-Y272 VanDerWaalsContact NH2-CE2 3.3Å; Y272-I343 WeakPolarHBondContact CD1-O 3.27Å; Y272-I343 WeakPolarHBondContact CE1-O 3.47Å; Y272-Q344 VanDerWaalsContact CE1-C 3.46Å; Y272-Q344 WeakPolarHBondContact CE1-O 3.33Å; Y272-Y346 HydrophobicContact CD1-CE1 4.4Å; Y272-Y346 AromaticContact CE1-CD1 3.72Å; Y272-Y346 HydrophobicContact CE1-CD1 3.72Å; Y272-Y346 HydrophobicContact CE1-CD2 4.49Å; Y272-Y346 AromaticContact CE1-CE1 3.51Å; Y272-Y346 HydrophobicContact CE1-CE1 3.51Å; Y272-Y346 HydrophobicContact CE1-CE2 4.31Å; Y272-Y346 HydrophobicContact CE1-CG 4.23Å; Y272-Y346 AromaticContact CE1-CZ 3.86Å; Y272-Y346 HydrophobicContact CE2-CE2 4.38Å; Y272-Y346 AromaticContact CZ-CD1 3.8Å; Y272-Y346 AromaticContact CZ-CD2 3.83Å; Y272-Y346 AromaticContact CZ-CE1 3.84Å; Y272-Y346 AromaticContact CZ-CE2 3.86Å; Y272-Y346 AromaticContact CZ-CG 3.8Å; Y272-Y346 AromaticContact CZ-CZ 3.9Å; Y272-Y346 WeakPolarHBondContact OH-CB 3.31Å; Y272-Y346 VanDerWaalsContact OH-CD1 3.26Å; Y272-Y346 WeakPolarHBondContact OH-CD1 3.39Å; Y272-Y346 WeakPolarHBondContact OH-CD2 3.22Å; Y272-Y346 PolarHBondContact OH-N 3.48Å
273	S	73.1	Confident	86.2	Confident	51 Å²	51	47.7 Å²	47.7	36%	0.357	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-33	179.6	78	0	0	0	0	112.4	D271 Y346	D271-S273 VanDerWaalsContact C-N 3.32Å; D271-S273 PolarHBondContact O-N 2.83Å; D271-S273 PolarHBondContact OD2-N 3.45Å; D271-S273 PolarHBondContact OD2-OG 2.87Å; S273-Y346 PolarHBondContact OG-OH 3.07Å
274	T	70.6	Confident	86	Confident	53 Å²	53	47.7 Å²	47.7	33%	0.325	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.3	-6.4	-174.7	56.7	0	0	0	0	115.3	D271 S276 N428	D271-T274 PolarHBondContact OD2-N 3.23Å; D271-T274 VanDerWaalsContact OD2-N 3.08Å; D271-T274 PolarHBondContact OD2-OG1 3.32Å; T274-S276 PolarHBondContact O-N 2.8Å; T274-S276 VanDerWaalsContact O-N 3.08Å; T274-S276 PolarHBondContact OG1-OG 2.85Å; T274-N428 HydrophobicContact CG2-CB 4.44Å; T274-N428 WeakPolarHBondContact CG2-ND2 3.48Å
275	N	76.8	Confident	85.7	Confident	123 Å²	123	44.6 Å²	44.6	66%	0.658	27%	0.273	S	S	*	.			trans	51.6	28.5	-174.6	-71	-37.8	0	0	0	113.7	D271	D271-N275 VanDerWaalsContact O-CA 3.27Å; D271-N275 WeakPolarHBondContact O-CA 3.39Å; D271-N275 PolarHBondContact O-N 3.42Å
276	S	80.9	Confident	85.4	Confident	50 Å²	50	43.4 Å²	43.4	35%	0.35	26%	0.258	S	S	.	.			trans	-115.5	146.9	179.4	66.1	0	0	0	0	110.7	D271 T274 M278	D271-S276 PolarHBondContact N-O 2.89Å; T274-S276 PolarHBondContact O-N 2.8Å; T274-S276 VanDerWaalsContact O-N 3.08Å; T274-S276 PolarHBondContact OG1-OG 2.85Å; S276-M278 WeakPolarHBondContact O-CE 3.44Å; S276-M278 PolarHBondContact O-N 2.85Å; S276-M278 WeakPolarHBondContact OG-CE 2.96Å
277	V	86.8	Confident	85.2	Confident	107 Å²	107	40.1 Å²	40.1	65%	0.648	24%	0.235	S	C	*	.	B	Isolated β-bridge	trans	-75.5	124.5	177.8	-178.8	0	0	0	0	108.7
278	M	88.7	Confident	85.1	Confident	11 Å²	11	38.8 Å²	38.8	5%	0.054	22%	0.221	C	C	.	.			trans	-74.1	153.5	-179.5	-66.5	-58.8	104.8	0	0	111.9	F75 Y268 S269 D271 S276 V283	F75-M278 HydrophobicContact CE2-CG 3.86Å; F75-M278 HydrophobicContact CE2-SD 3.89Å; F75-M278 HydrophobicContact CZ-CG 3.93Å; F75-M278 HydrophobicContact CZ-SD 3.55Å; F75-M278 VanDerWaalsContact CZ-SD 3.55Å; Y268-M278 WeakPolarHBondContact CB-O 3.39Å; Y268-M278 HydrophobicContact CD1-CB 4.18Å; S269-M278 PolarHBondContact O-N 3.26Å; S269-M278 VanDerWaalsContact O-N 3.15Å; D271-M278 HydrophobicContact CB-CE 3.75Å; D271-M278 HydrophobicContact CB-CG 3.95Å; D271-M278 HydrophobicContact CB-SD 4.17Å; S276-M278 WeakPolarHBondContact O-CE 3.44Å; S276-M278 PolarHBondContact O-N 2.85Å; S276-M278 WeakPolarHBondContact OG-CE 2.96Å; M278-V283 HydrophobicContact CB-CG2 3.96Å; M278-V283 HydrophobicContact CG-CG2 4.44Å
279	S	91.5	Very high	84.9	Confident	47 Å²	47	35.8 Å²	35.8	33%	0.329	21%	0.21	S	C	.	.			trans	-133.3	170.6	175.4	68.6	0	0	0	0	110	Y268 A281 T282 V283	Y268-S279 VanDerWaalsContact CE1-C 3.44Å; S279-A281 PolarHBondContact O-N 3.14Å; S279-A281 PolarHBondContact OG-N 3.38Å; S279-T282 PolarHBondContact N-OG1 2.83Å; S279-T282 PolarHBondContact O-N 2.62Å; S279-T282 PolarHBondContact O-OG1 3.13Å; S279-T282 PolarHBondContact OG-N 3Å; S279-T282 PolarHBondContact OG-OG1 2.97Å; S279-V283 WeakPolarHBondContact O-CB 3.38Å; S279-V283 VanDerWaalsContact O-CG2 3.32Å; S279-V283 WeakPolarHBondContact O-CG2 3.44Å; S279-V283 PolarHBondContact O-N 3.42Å
280	F	91.3	Very high	84.7	Confident	56 Å²	56	34 Å²	34	25%	0.246	20%	0.197	C	C	.	.	H	α-helix	trans	-53.5	-44.9	172.3	176.2	-97.9	0	0	0	112.1	Q84 M88 Y268 F284 M482	Q84-F280 HydrophobicContact CG-CD2 3.93Å; Q84-F280 HydrophobicContact CG-CE2 3.99Å; M88-F280 HydrophobicContact CE-CD2 3.2Å; M88-F280 HydrophobicContact CE-CE2 3.52Å; M88-F280 HydrophobicContact CE-CG 4.04Å; M88-F280 HydrophobicContact CG-CD2 4.24Å; M88-F280 HydrophobicContact CG-CE2 3.51Å; M88-F280 HydrophobicContact CG-CZ 4.07Å; M88-F280 HydrophobicContact SD-CE2 4.37Å; Y268-F280 WeakPolarHBondContact OH-CA 3.39Å; F280-F284 WeakPolarHBondContact O-CB 3.22Å; F280-F284 PolarHBondContact O-N 2.88Å; F280-M482 HydrophobicContact CE1-CE 4.32Å
281	A	89.1	Confident	84.8	Confident	16 Å²	16	29.9 Å²	29.9	13%	0.132	18%	0.176	C	C	.	.	H	α-helix	trans	-64.7	-45.5	-177.4	0	0	0	0	0	112.7	S279 F284 A285 V485	S279-A281 PolarHBondContact O-N 3.14Å; S279-A281 PolarHBondContact OG-N 3.38Å; A281-F284 PolarHBondContact O-N 3.46Å; A281-A285 WeakPolarHBondContact O-CB 3.2Å; A281-A285 PolarHBondContact O-N 3.05Å; A281-V485 HydrophobicContact CB-CG1 4.31Å; A281-V485 WeakPolarHBondContact CB-O 3.09Å
282	T	86.4	Confident	85	Confident	50 Å²	50	29.9 Å²	29.9	31%	0.307	18%	0.176	S	C	.	.	H	α-helix	trans	-70.1	-40.9	-178.9	58	0	0	0	0	111.8	S279 A285 V286	S279-T282 PolarHBondContact N-OG1 2.83Å; S279-T282 PolarHBondContact O-N 2.62Å; S279-T282 PolarHBondContact O-OG1 3.13Å; S279-T282 PolarHBondContact OG-N 3Å; S279-T282 PolarHBondContact OG-OG1 2.97Å; T282-A285 PolarHBondContact O-N 2.7Å; T282-V286 WeakPolarHBondContact O-CG2 3.47Å; T282-V286 PolarHBondContact O-N 2.87Å
283	V	89.4	Confident	85.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-68.5	-39.5	176.7	177.7	0	0	0	0	111.1	F75 V76 H79 A80 M88 Y268 M278 S279 V286 M287	F75-V283 HydrophobicContact CE1-CB 4.36Å; F75-V283 HydrophobicContact CE1-CG1 4.21Å; F75-V283 HydrophobicContact CE1-CG2 3.96Å; F75-V283 HydrophobicContact CZ-CG2 3.98Å; V76-V283 HydrophobicContact CB-CG1 4.22Å; V76-V283 HydrophobicContact CG1-CG1 4.08Å; V76-V283 HydrophobicContact CG2-CG1 4.06Å; H79-V283 HydrophobicContact CB-CG2 4.17Å; A80-V283 HydrophobicContact CB-CG1 4.49Å; M88-V283 HydrophobicContact CE-CB 4.1Å; M88-V283 HydrophobicContact CE-CG1 4.01Å; M88-V283 HydrophobicContact SD-CG1 4.07Å; Y268-V283 HydrophobicContact CD1-CG2 4.27Å; Y268-V283 HydrophobicContact CE1-CB 4.39Å; Y268-V283 HydrophobicContact CE1-CG2 3.93Å; M278-V283 HydrophobicContact CB-CG2 3.96Å; M278-V283 HydrophobicContact CG-CG2 4.44Å; S279-V283 WeakPolarHBondContact O-CB 3.38Å; S279-V283 VanDerWaalsContact O-CG2 3.32Å; S279-V283 WeakPolarHBondContact O-CG2 3.44Å; S279-V283 PolarHBondContact O-N 3.42Å; V283-V286 PolarHBondContact O-N 3.38Å; V283-M287 WeakPolarHBondContact O-CB 3.29Å; V283-M287 PolarHBondContact O-N 2.63Å
284	F	90.2	Very high	86.2	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.9	-43.3	173.7	179.2	-89.5	0	0	0	111.5	M88 V91 A92 F280 A281 V286 M287 F288 M482 I486	M88-F284 HydrophobicContact CB-CD2 3.94Å; M88-F284 HydrophobicContact CG-CD2 4.02Å; M88-F284 HydrophobicContact SD-CB 4.4Å; V91-F284 HydrophobicContact CB-CE2 4.45Å; V91-F284 HydrophobicContact CG1-CE2 4.16Å; V91-F284 HydrophobicContact CG1-CZ 4.39Å; A92-F284 HydrophobicContact CB-CE2 4.13Å; A92-F284 HydrophobicContact CB-CZ 4.26Å; F280-F284 WeakPolarHBondContact O-CB 3.22Å; F280-F284 PolarHBondContact O-N 2.88Å; A281-F284 PolarHBondContact O-N 3.46Å; F284-V286 PolarHBondContact O-N 3.24Å; F284-M287 HydrophobicContact CD2-CE 4.1Å; F284-M287 HydrophobicContact CE2-CE 4.14Å; F284-M287 PolarHBondContact O-N 3.44Å; F284-F288 HydrophobicContact CD1-CB 4.29Å; F284-F288 HydrophobicContact CE1-CB 3.9Å; F284-F288 AromaticContact CE1-CD2 3.85Å; F284-F288 HydrophobicContact CE1-CD2 3.85Å; F284-F288 HydrophobicContact CE1-CG 4.06Å; F284-F288 HydrophobicContact CZ-CB 4.25Å; F284-F288 AromaticContact CZ-CD2 3.61Å; F284-F288 HydrophobicContact CZ-CD2 3.61Å; F284-F288 HydrophobicContact CZ-CE2 4.37Å; F284-F288 HydrophobicContact CZ-CG 4.25Å; F284-F288 VanDerWaalsContact O-CB 3.27Å; F284-F288 WeakPolarHBondContact O-CB 3.2Å; F284-F288 PolarHBondContact O-N 2.67Å; F284-M482 HydrophobicContact CD1-CE 3.44Å; F284-M482 VanDerWaalsContact CD1-CE 3.44Å; F284-M482 HydrophobicContact CD2-CE 4.03Å; F284-M482 HydrophobicContact CE1-CB 4.42Å; F284-M482 HydrophobicContact CE1-CE 3.37Å; F284-M482 HydrophobicContact CE1-CG 4.48Å; F284-M482 HydrophobicContact CE2-CE 3.97Å; F284-M482 HydrophobicContact CG-CE 3.79Å; F284-M482 HydrophobicContact CZ-CE 3.64Å; F284-M482 HydrophobicContact CZ-CG 4.42Å; F284-I486 HydrophobicContact CD1-CD1 3.98Å; F284-I486 HydrophobicContact CD1-CG1 4.1Å; F284-I486 HydrophobicContact CE1-CD1 4.1Å
285	A	87.3	Confident	87	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59	-47.8	179	0	0	0	0	0	111.9	A281 T282 M287 F288 T289 T435 I486	A281-A285 WeakPolarHBondContact O-CB 3.2Å; A281-A285 PolarHBondContact O-N 3.05Å; T282-A285 PolarHBondContact O-N 2.7Å; A285-M287 VanDerWaalsContact C-N 3.33Å; A285-M287 PolarHBondContact O-N 3.25Å; A285-F288 PolarHBondContact O-N 3.09Å; A285-T289 PolarHBondContact O-N 3.42Å; A285-T435 HydrophobicContact CB-CG2 4.46Å; A285-T435 PolarHBondContact O-OG1 2.83Å; A285-I486 HydrophobicContact CB-CG1 4.26Å; A285-I486 HydrophobicContact CB-CG2 3.76Å
286	V	85.6	Confident	87.3	Confident	13 Å²	13	17.3 Å²	17.3	8%	0.079	11%	0.106	C	C	.	.	H	α-helix	trans	-63.8	-37.1	177.4	175.6	0	0	0	0	112	I68 R72 F75 T282 V283 F284 T289	I68-V286 WeakPolarHBondContact CD1-O 3.42Å; R72-V286 HydrophobicContact CB-CG1 4.29Å; R72-V286 HydrophobicContact CG-CG1 4.22Å; F75-V286 HydrophobicContact CD1-CG1 4.38Å; F75-V286 HydrophobicContact CE1-CB 4.24Å; F75-V286 HydrophobicContact CE1-CG1 4.21Å; F75-V286 HydrophobicContact CE1-CG2 4.43Å; T282-V286 WeakPolarHBondContact O-CG2 3.47Å; T282-V286 PolarHBondContact O-N 2.87Å; V283-V286 PolarHBondContact O-N 3.38Å; F284-V286 PolarHBondContact O-N 3.24Å; V286-T289 PolarHBondContact O-OG1 3.36Å; V286-T289 VanDerWaalsContact O-OG1 3.07Å
287	M	88.7	Confident	87.3	Confident	2 Å²	2	15 Å²	15	1%	0.01	9%	0.089	C	C	.	.	H	α-helix	trans	-71.2	-41.6	175.8	-172.9	-80	-69.5	0	0	111.5	V76 M88 V89 A92 V283 F284 A285 T289 S290	V76-M287 HydrophobicContact CG1-CG 4.39Å; V76-M287 HydrophobicContact CG2-CB 3.84Å; V76-M287 HydrophobicContact CG2-CG 4.16Å; M88-M287 HydrophobicContact CB-CE 3.52Å; M88-M287 VanDerWaalsContact O-CE 3.31Å; M88-M287 WeakPolarHBondContact O-CE 3.44Å; V89-M287 HydrophobicContact CG2-CE 4.34Å; V89-M287 HydrophobicContact CG2-SD 4.26Å; A92-M287 HydrophobicContact CB-CE 3.85Å; A92-M287 HydrophobicContact CB-SD 4.41Å; V283-M287 WeakPolarHBondContact O-CB 3.29Å; V283-M287 PolarHBondContact O-N 2.63Å; F284-M287 HydrophobicContact CD2-CE 4.1Å; F284-M287 HydrophobicContact CE2-CE 4.14Å; F284-M287 PolarHBondContact O-N 3.44Å; A285-M287 VanDerWaalsContact C-N 3.33Å; A285-M287 PolarHBondContact O-N 3.25Å; M287-T289 VanDerWaalsContact C-N 3.3Å; M287-T289 PolarHBondContact O-N 3.43Å; M287-S290 PolarHBondContact O-N 2.79Å; M287-S290 VanDerWaalsContact O-N 3.1Å; M287-S290 PolarHBondContact O-OG 3.22Å
288	F	89	Confident	87.1	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63	-36.8	-175	-172	-92	0	0	0	111.6	A92 I95 F284 A285 S290 C291 T292 T435 L439 Y442	A92-F288 HydrophobicContact CB-CD2 3.72Å; A92-F288 HydrophobicContact CB-CE2 4.14Å; I95-F288 HydrophobicContact CG2-CE2 4.36Å; I95-F288 HydrophobicContact CG2-CZ 4.34Å; F284-F288 HydrophobicContact CD1-CB 4.29Å; F284-F288 HydrophobicContact CE1-CB 3.9Å; F284-F288 AromaticContact CE1-CD2 3.85Å; F284-F288 HydrophobicContact CE1-CD2 3.85Å; F284-F288 HydrophobicContact CE1-CG 4.06Å; F284-F288 HydrophobicContact CZ-CB 4.25Å; F284-F288 AromaticContact CZ-CD2 3.61Å; F284-F288 HydrophobicContact CZ-CD2 3.61Å; F284-F288 HydrophobicContact CZ-CE2 4.37Å; F284-F288 HydrophobicContact CZ-CG 4.25Å; F284-F288 VanDerWaalsContact O-CB 3.27Å; F284-F288 WeakPolarHBondContact O-CB 3.2Å; F284-F288 PolarHBondContact O-N 2.67Å; A285-F288 PolarHBondContact O-N 3.09Å; F288-S290 PolarHBondContact O-N 3.36Å; F288-S290 VanDerWaalsContact O-N 3.11Å; F288-C291 WeakPolarHBondContact O-CA 3.35Å; F288-C291 PolarHBondContact O-N 3Å; F288-T292 HydrophobicContact CD1-CG2 3.73Å; F288-T292 HydrophobicContact CE1-CG2 3.66Å; F288-T292 WeakPolarHBondContact O-CG2 3.43Å; F288-T292 PolarHBondContact O-N 2.91Å; F288-T292 VanDerWaalsContact O-N 3.15Å; F288-T435 HydrophobicContact CB-CG2 4.11Å; F288-T435 HydrophobicContact CD1-CG2 3.65Å; F288-T435 HydrophobicContact CE1-CG2 4.43Å; F288-T435 HydrophobicContact CG-CG2 4.16Å; F288-L439 HydrophobicContact CE1-CD2 3.71Å; F288-L439 HydrophobicContact CE1-CG 3.84Å; F288-L439 HydrophobicContact CE2-CD2 4.04Å; F288-L439 HydrophobicContact CZ-CD2 3.38Å; F288-L439 HydrophobicContact CZ-CG 4.06Å; F288-Y442 HydrophobicContact CE1-CE2 4.4Å; F288-Y442 HydrophobicContact CZ-CD2 4.38Å; F288-Y442 HydrophobicContact CZ-CE2 4.21Å
289	T	85.1	Confident	86.8	Confident	0 Å²	0	10 Å²	10	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-57	-28.4	177.5	56.2	0	0	0	0	112.7	I68 E147 A285 V286 M287 T292 A431 V434 T435	I68-T289 WeakPolarHBondContact CD1-OG1 3.39Å; E147-T289 PolarHBondContact OE1-OG1 3.16Å; A285-T289 PolarHBondContact O-N 3.42Å; V286-T289 PolarHBondContact O-OG1 3.36Å; V286-T289 VanDerWaalsContact O-OG1 3.07Å; M287-T289 VanDerWaalsContact C-N 3.3Å; M287-T289 PolarHBondContact O-N 3.43Å; T289-T292 PolarHBondContact O-N 2.97Å; T289-T292 PolarHBondContact O-OG1 3.14Å; T289-A431 HydrophobicContact CG2-CB 4.46Å; T289-A431 WeakPolarHBondContact CG2-O 3.26Å; T289-V434 HydrophobicContact CG2-CG1 4.24Å; T289-T435 WeakPolarHBondContact CG2-OG1 3.37Å
290	S	84.5	Confident	86.2	Confident	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-78.5	-21.7	174.6	85.9	0	0	0	0	114.3	M64 I68 M287 F288 T292 Y326	M64-S290 CarbonylContact C-O 3.46Å; M64-S290 WeakPolarHBondContact CA-O 3.23Å; I68-S290 VanDerWaalsContact CB-CB 3.5Å; M287-S290 PolarHBondContact O-N 2.79Å; M287-S290 VanDerWaalsContact O-N 3.1Å; M287-S290 PolarHBondContact O-OG 3.22Å; F288-S290 PolarHBondContact O-N 3.36Å; F288-S290 VanDerWaalsContact O-N 3.11Å; S290-T292 VanDerWaalsContact C-N 3.34Å; S290-Y326 WeakPolarHBondContact CB-OH 3.25Å; S290-Y326 PolarHBondContact OG-OH 3.34Å
291	C	87.7	Confident	85.6	Confident	0 Å²	0	5.9 Å²	5.9	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-88.4	-9.6	175.4	-57.4	0	0	0	0	111.4	M64 Y93 I96 F288	M64-C291 VanDerWaalsContact CE-O 3.29Å; M64-C291 WeakPolarHBondContact CE-O 3.47Å; Y93-C291 HydrophobicContact CE2-CB 4.21Å; Y93-C291 VanDerWaalsContact CE2-SG 3.5Å; I96-C291 HydrophobicContact CD1-CB 3.4Å; I96-C291 VanDerWaalsContact CD1-CB 3.4Å; I96-C291 WeakPolarHBondContact CD1-O 3.4Å; F288-C291 WeakPolarHBondContact O-CA 3.35Å; F288-C291 PolarHBondContact O-N 3Å
292	T	87.1	Confident	85	Confident	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.042	C	C	.	.			trans	-70.6	173.4	174.7	72.7	0	0	0	0	112.3	M64 F288 T289 S290 Y438	M64-T292 VanDerWaalsContact CG-O 3.29Å; M64-T292 WeakPolarHBondContact CG-O 3.35Å; F288-T292 HydrophobicContact CD1-CG2 3.73Å; F288-T292 HydrophobicContact CE1-CG2 3.66Å; F288-T292 WeakPolarHBondContact O-CG2 3.43Å; F288-T292 PolarHBondContact O-N 2.91Å; F288-T292 VanDerWaalsContact O-N 3.15Å; T289-T292 PolarHBondContact O-N 2.97Å; T289-T292 PolarHBondContact O-OG1 3.14Å; S290-T292 VanDerWaalsContact C-N 3.34Å; T292-Y438 HydrophobicContact CG2-CD2 3.74Å; T292-Y438 HydrophobicContact CG2-CE2 4.31Å; T292-Y438 HydrophobicContact CG2-CG 3.87Å
293	G	84.9	Confident	84.7	Confident	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.039	C	C	.	.			trans	103.7	5.6	174.1	0	0	0	0	0	115.5	S63 M295 A296 Y442	S63-G293 VanDerWaalsContact OG-CA 3.25Å; S63-G293 WeakPolarHBondContact OG-CA 3.49Å; G293-M295 PolarHBondContact O-N 2.93Å; G293-A296 VanDerWaalsContact O-CB 3.25Å; G293-A296 WeakPolarHBondContact O-CB 3.37Å; G293-A296 PolarHBondContact O-N 3.37Å; G293-Y442 PolarHBondContact N-OH 3.28Å
294	I	89.7	Confident	84.4	Confident	1 Å²	1	6.4 Å²	6.4	1%	0.005	4%	0.039	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-24.9	178.6	60.5	171.9	0	0	0	114.8	M64 I96 T99 V100 I103 A296 T315 V319 Y442	M64-I294 HydrophobicContact CE-CG2 4.33Å; M64-I294 HydrophobicContact SD-CG2 4.26Å; I96-I294 HydrophobicContact CG2-CD1 4.32Å; I96-I294 HydrophobicContact CG2-CG2 3.59Å; T99-I294 HydrophobicContact CG2-CD1 4.21Å; V100-I294 HydrophobicContact CG2-CB 4.24Å; V100-I294 HydrophobicContact CG2-CD1 3.78Å; V100-I294 HydrophobicContact CG2-CG2 4.28Å; I103-I294 HydrophobicContact CD1-CD1 3.87Å; I103-I294 HydrophobicContact CD1-CG1 4.27Å; I294-A296 VanDerWaalsContact C-N 3.32Å; I294-A296 PolarHBondContact O-N 3.28Å; I294-T315 HydrophobicContact CB-CG2 4.34Å; I294-V319 HydrophobicContact CG2-CG2 3.82Å; I294-Y442 HydrophobicContact CD1-CE1 4.12Å; I294-Y442 HydrophobicContact CG1-CE1 4.09Å
295	M	85.6	Confident	83.9	Confident	7 Å²	7	13.2 Å²	13.2	3%	0.034	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-2.8	178.7	-71	-168.4	168.2	0	0	114.4	I103 A117 F137 G293 G297 A298 N299 V445	I103-M295 HydrophobicContact CD1-CE 3.7Å; I103-M295 HydrophobicContact CD1-CG 3.84Å; I103-M295 HydrophobicContact CG1-CE 4.01Å; A117-M295 HydrophobicContact CB-SD 4.35Å; F137-M295 HydrophobicContact CD1-SD 3.75Å; F137-M295 HydrophobicContact CE1-CE 3.63Å; F137-M295 HydrophobicContact CE1-SD 3.23Å; F137-M295 WeakPolarHBondContact CE1-SD 3.06Å; F137-M295 HydrophobicContact CE2-CE 3.86Å; F137-M295 HydrophobicContact CE2-SD 4.1Å; F137-M295 HydrophobicContact CG-SD 4.38Å; F137-M295 HydrophobicContact CZ-CE 3.2Å; F137-M295 HydrophobicContact CZ-SD 3.44Å; F137-M295 WeakPolarHBondContact CZ-SD 3.26Å; G293-M295 PolarHBondContact O-N 2.93Å; M295-G297 VanDerWaalsContact C-N 3.26Å; M295-G297 PolarHBondContact O-N 3.09Å; M295-A298 PolarHBondContact O-N 3.45Å; M295-A298 VanDerWaalsContact O-N 3.12Å; M295-N299 VanDerWaalsContact O-CG 3.26Å; M295-N299 PolarHBondContact O-N 3.06Å; M295-N299 PolarHBondContact O-ND2 3.39Å; M295-V445 HydrophobicContact CE-CG2 3.59Å
296	A	84.1	Confident	83.8	Confident	4 Å²	4	16.3 Å²	16.3	3%	0.033	9%	0.088	C	C	.	.	H	α-helix	trans	-55.2	-43.5	178	0	0	0	0	0	111.7	P59 G293 I294 C373	P59-A296 HydrophobicContact CB-CB 4.3Å; G293-A296 VanDerWaalsContact O-CB 3.25Å; G293-A296 WeakPolarHBondContact O-CB 3.37Å; G293-A296 PolarHBondContact O-N 3.37Å; I294-A296 VanDerWaalsContact C-N 3.32Å; I294-A296 PolarHBondContact O-N 3.28Å; A296-C373 VanDerWaalsContact CB-SG 3.57Å
297	G	80.3	Confident	83.8	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-70.4	-34.5	175.8	0	0	0	0	0	114.4	T60 M295 N299 M300	T60-G297 PolarHBondContact OG1-N 2.95Å; M295-G297 VanDerWaalsContact C-N 3.26Å; M295-G297 PolarHBondContact O-N 3.09Å; G297-N299 VanDerWaalsContact C-N 3.34Å; G297-M300 PolarHBondContact O-N 2.77Å
298	A	83.5	Confident	83.7	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-69.6	-30.8	176.5	0	0	0	0	0	112.6	I103 G116 A117 M120 M295 M300 S301 I311	I103-A298 HydrophobicContact CG2-CB 4.47Å; G116-A298 CarbonylContact C-O 3.6Å; G116-A298 WeakPolarHBondContact CA-O 3.19Å; A117-A298 HydrophobicContact CB-CB 3.98Å; A117-A298 PolarHBondContact N-O 3.22Å; M120-A298 HydrophobicContact CE-CB 3.81Å; M295-A298 PolarHBondContact O-N 3.45Å; M295-A298 VanDerWaalsContact O-N 3.12Å; A298-M300 PolarHBondContact O-N 2.92Å; A298-S301 VanDerWaalsContact O-CB 3.24Å; A298-S301 WeakPolarHBondContact O-CB 3.36Å; A298-S301 PolarHBondContact O-N 3.41Å; A298-S301 PolarHBondContact O-OG 3.46Å; A298-I311 HydrophobicContact CB-CG2 4.41Å
299	N	82.9	Confident	83.7	Confident	13 Å²	13	22.5 Å²	22.5	7%	0.07	12%	0.124	C	C	.	.	H	α-helix	trans	-68.3	-21.6	177.7	-73.3	-16.4	0	0	0	113.4	A117 M295 G297 S301	A117-N299 WeakPolarHBondContact CB-OD1 3.37Å; M295-N299 VanDerWaalsContact O-CG 3.26Å; M295-N299 PolarHBondContact O-N 3.06Å; M295-N299 PolarHBondContact O-ND2 3.39Å; G297-N299 VanDerWaalsContact C-N 3.34Å; N299-S301 VanDerWaalsContact C-N 3.34Å
300	M	77.9	Confident	83.9	Confident	16 Å²	16	22.6 Å²	22.6	8%	0.079	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	14.2	175.7	-55.4	-172.9	91.4	0	0	112.6	L50 P59 A201 Y204 G297 A298 G302 E303	L50-M300 HydrophobicContact CD1-CE 4.24Å; P59-M300 HydrophobicContact CB-SD 4.29Å; P59-M300 HydrophobicContact CG-SD 3.84Å; A201-M300 HydrophobicContact CB-CE 4.18Å; Y204-M300 HydrophobicContact CD1-CE 3.97Å; Y204-M300 HydrophobicContact CE1-CE 4.15Å; Y204-M300 HydrophobicContact CE1-SD 4.28Å; G297-M300 PolarHBondContact O-N 2.77Å; A298-M300 PolarHBondContact O-N 2.92Å; M300-G302 PolarHBondContact O-N 3.01Å; M300-G302 VanDerWaalsContact O-N 3.08Å; M300-E303 PolarHBondContact O-N 3.5Å
301	S	79	Confident	84.3	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.007	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-55.8	-30.5	-174.1	64.7	0	0	0	0	114.4	G116 A298 N299 E303 L304	G116-S301 WeakPolarHBondContact CA-OG 3.26Å; G116-S301 PolarHBondContact N-OG 3.39Å; G116-S301 VanDerWaalsContact N-OG 3.08Å; A298-S301 VanDerWaalsContact O-CB 3.24Å; A298-S301 WeakPolarHBondContact O-CB 3.36Å; A298-S301 PolarHBondContact O-N 3.41Å; A298-S301 PolarHBondContact O-OG 3.46Å; N299-S301 VanDerWaalsContact C-N 3.34Å; S301-E303 VanDerWaalsContact C-N 3.28Å; S301-E303 PolarHBondContact O-N 3.07Å; S301-L304 PolarHBondContact O-N 3.4Å
302	G	75.7	Confident	84.5	Confident	25 Å²	25	23.1 Å²	23.1	26%	0.258	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-73.1	-14.8	178.2	0	0	0	0	0	115.6	M300	M300-G302 PolarHBondContact O-N 3.01Å; M300-G302 VanDerWaalsContact O-N 3.08Å
303	E	79.6	Confident	84.7	Confident	52 Å²	52	29.2 Å²	29.2	24%	0.243	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-102.8	-8.5	178.6	-62.1	-176	-179	0	0	112.3	R49 L50 A201 M300 S301 R380	R49-E303 PolarHBondContact N-O 3.08Å; L50-E303 WeakPolarHBondContact CB-O 3.25Å; L50-E303 HydrophobicContact CD1-CB 3.77Å; L50-E303 WeakPolarHBondContact CD1-OE2 3.41Å; L50-E303 HydrophobicContact CG-CB 4.21Å; L50-E303 PolarHBondContact N-O 3.39Å; A201-E303 WeakPolarHBondContact CB-OE1 3.24Å; A201-E303 WeakPolarHBondContact CB-OE2 3.41Å; M300-E303 PolarHBondContact O-N 3.5Å; S301-E303 VanDerWaalsContact C-N 3.28Å; S301-E303 PolarHBondContact O-N 3.07Å; E303-R380 IonicContact OE1-NH2 3.77Å
304	L	83.1	Confident	85.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-77.4	138.4	-179.5	-65.6	175.6	0	0	0	112	L50 V56 S301 T306 P307 I311	L50-L304 HydrophobicContact CB-CD2 4.1Å; L50-L304 WeakPolarHBondContact O-CA 3.08Å; V56-L304 HydrophobicContact CG2-CD1 3.5Å; V56-L304 VanDerWaalsContact CG2-CD1 3.5Å; V56-L304 HydrophobicContact CG2-CD2 3.77Å; V56-L304 HydrophobicContact CG2-CG 4.3Å; S301-L304 PolarHBondContact O-N 3.4Å; L304-T306 PolarHBondContact O-N 3.32Å; L304-P307 HydrophobicContact CB-CB 4.24Å; L304-P307 HydrophobicContact CD1-CB 4.18Å; L304-I311 HydrophobicContact CD1-CD1 4.29Å; L304-I311 HydrophobicContact CD1-CG1 3.77Å
305	K	81.3	Confident	85.3	Confident	142 Å²	142	29.2 Å²	29.2	62%	0.617	15%	0.154	S	C	*	.	S	Bend	trans	-59.9	-45.5	174.4	-171.4	179.1	-179.7	179.3	0	112.1	L50	L50-K305 PolarHBondContact O-N 3.39Å
306	T	84.4	Confident	85.7	Confident	65 Å²	65	32.3 Å²	32.3	40%	0.399	17%	0.17	S	C	.	.	S	Bend	trans	-139.3	87.1	179.7	48.1	0	0	0	0	110.5	L304 S308 I309 S310	L304-T306 PolarHBondContact O-N 3.32Å; T306-S308 PolarHBondContact O-N 2.97Å; T306-I309 PolarHBondContact O-N 3.36Å; T306-S310 WeakPolarHBondContact O-CB 3.34Å; T306-S310 PolarHBondContact O-N 3.25Å; T306-S310 PolarHBondContact O-OG 3.25Å
307	P	86.1	Confident	86.2	Confident	10 Å²	10	36.3 Å²	36.3	7%	0.065	19%	0.19	C	C	.	.	H	α-helix	trans	-66.4	-37.3	-172.1	26.4	-35.5	0	0	0	113.1	I112 L304 I309 S310 I311	I112-P307 HydrophobicContact CB-CB 4.44Å; I112-P307 HydrophobicContact CB-CG 3.91Å; I112-P307 HydrophobicContact CD1-CB 3.87Å; I112-P307 HydrophobicContact CD1-CG 4.01Å; I112-P307 HydrophobicContact CG2-CB 4.45Å; I112-P307 HydrophobicContact CG2-CG 4.25Å; L304-P307 HydrophobicContact CB-CB 4.24Å; L304-P307 HydrophobicContact CD1-CB 4.18Å; P307-I309 PolarHBondContact O-N 3.46Å; P307-S310 PolarHBondContact O-N 3.22Å; P307-I311 HydrophobicContact CB-CD1 3.95Å; P307-I311 WeakPolarHBondContact O-CB 3.39Å; P307-I311 VanDerWaalsContact O-CG1 3.3Å; P307-I311 WeakPolarHBondContact O-CG1 3.41Å; P307-I311 PolarHBondContact O-N 3.37Å
308	S	86.7	Confident	86.9	Confident	47 Å²	47	36.3 Å²	36.3	33%	0.329	19%	0.19	S	C	.	.	H	α-helix	trans	-63.7	-23.7	-178.4	56.4	0	0	0	0	114.7	S107 T108 T306 P312	S107-S308 VanDerWaalsContact O-CA 3.29Å; S107-S308 WeakPolarHBondContact O-CA 3.43Å; S107-S308 WeakPolarHBondContact O-CB 3.26Å; T108-S308 WeakPolarHBondContact CG2-O 3.47Å; T306-S308 PolarHBondContact O-N 2.97Å; S308-P312 WeakPolarHBondContact O-CD 3.47Å; S308-P312 WeakPolarHBondContact O-CG 3.41Å
309	I	87.9	Confident	87.4	Confident	89 Å²	89	36.7 Å²	36.7	46%	0.456	19%	0.193	S	C	.	.	H	α-helix	trans	-100.8	-39.2	175.5	-61.1	173.8	0	0	0	110.8	T306 P307 K313	T306-I309 PolarHBondContact O-N 3.36Å; P307-I309 PolarHBondContact O-N 3.46Å; I309-K313 HydrophobicContact CG2-CD 3.96Å; I309-K313 WeakPolarHBondContact O-CG 3.38Å; I309-K313 PolarHBondContact O-N 2.91Å
310	S	90.8	Very high	87.9	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.007	22%	0.219	C	C	.	.	H	α-helix	trans	-69.8	-40.2	-174.9	-65.2	0	0	0	0	112.6	T52 T306 P307 G314	T52-S310 WeakPolarHBondContact CG2-O 3.41Å; T52-S310 WeakPolarHBondContact OG1-CB 3.45Å; T52-S310 PolarHBondContact OG1-OG 2.96Å; T306-S310 WeakPolarHBondContact O-CB 3.34Å; T306-S310 PolarHBondContact O-N 3.25Å; T306-S310 PolarHBondContact O-OG 3.25Å; P307-S310 PolarHBondContact O-N 3.22Å; S310-G314 PolarHBondContact O-N 2.87Å
311	I	91.3	Very high	88.7	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-52.6	-177.5	-64.3	166.4	0	0	0	110.8	V56 I103 I112 M120 A298 L304 P307 K313 T315	V56-I311 HydrophobicContact CG2-CG1 4.39Å; I103-I311 HydrophobicContact CG2-CG2 4.18Å; I112-I311 HydrophobicContact CD1-CD1 4.47Å; M120-I311 HydrophobicContact CE-CD1 4.02Å; M120-I311 HydrophobicContact SD-CD1 4.01Å; A298-I311 HydrophobicContact CB-CG2 4.41Å; L304-I311 HydrophobicContact CD1-CD1 4.29Å; L304-I311 HydrophobicContact CD1-CG1 3.77Å; P307-I311 HydrophobicContact CB-CD1 3.95Å; P307-I311 WeakPolarHBondContact O-CB 3.39Å; P307-I311 VanDerWaalsContact O-CG1 3.3Å; P307-I311 WeakPolarHBondContact O-CG1 3.41Å; P307-I311 PolarHBondContact O-N 3.37Å; I311-K313 PolarHBondContact O-N 2.81Å; I311-T315 VanDerWaalsContact O-CB 3.28Å; I311-T315 WeakPolarHBondContact O-CB 3.39Å; I311-T315 PolarHBondContact O-N 3.21Å; I311-T315 PolarHBondContact O-OG1 2.7Å
312	P	92.4	Very high	89.4	Confident	11 Å²	11	45.8 Å²	45.8	7%	0.071	23%	0.229	C	C	.	.	H	α-helix	trans	-59.8	-50	179.1	-26	35.4	0	0	0	113.2	C104 T108 S308 I316 F464	C104-P312 HydrophobicContact CB-CB 4.2Å; C104-P312 HydrophobicContact CB-CG 4.24Å; C104-P312 VanDerWaalsContact SG-CA 3.55Å; T108-P312 HydrophobicContact CG2-CG 3.98Å; S308-P312 WeakPolarHBondContact O-CD 3.47Å; S308-P312 WeakPolarHBondContact O-CG 3.41Å; P312-I316 WeakPolarHBondContact O-CB 3.45Å; P312-I316 WeakPolarHBondContact O-CD1 3.38Å; P312-I316 VanDerWaalsContact O-CG1 3.25Å; P312-I316 WeakPolarHBondContact O-CG1 3.43Å; P312-I316 PolarHBondContact O-N 3.12Å; P312-I316 VanDerWaalsContact O-N 3.12Å; P312-F464 HydrophobicContact CB-CD2 4.48Å; P312-F464 HydrophobicContact CB-CE2 4.46Å
313	K	92.3	Very high	90.3	Very high	129 Å²	129	47.6 Å²	47.6	56%	0.561	23%	0.23	S	C	*	.	H	α-helix	trans	-64.1	-48.2	-177.7	-70.5	-174.3	178.2	-177.7	0	111.9	T52 I309 I311 I317	T52-K313 HydrophobicContact CG2-CB 4.32Å; I309-K313 HydrophobicContact CG2-CD 3.96Å; I309-K313 WeakPolarHBondContact O-CG 3.38Å; I309-K313 PolarHBondContact O-N 2.91Å; I311-K313 PolarHBondContact O-N 2.81Å; K313-I317 WeakPolarHBondContact O-CB 3.2Å; K313-I317 WeakPolarHBondContact O-CD1 3.42Å; K313-I317 WeakPolarHBondContact O-CG1 3.14Å; K313-I317 PolarHBondContact O-N 3.11Å
314	G	93.3	Very high	91	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-40.7	-176.9	0	0	0	0	0	112.8	S310 A318	S310-G314 PolarHBondContact O-N 2.87Å; G314-A318 VanDerWaalsContact O-CB 3.27Å; G314-A318 WeakPolarHBondContact O-CB 3.39Å; G314-A318 PolarHBondContact O-N 3.33Å
315	T	93.8	Very high	91.5	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-71.7	-45	-177.8	-47.9	0	0	0	0	111.6	T60 V100 I294 I311 I317 A318 V319	T60-T315 HydrophobicContact CG2-CG2 4.5Å; V100-T315 HydrophobicContact CG1-CG2 4.06Å; V100-T315 HydrophobicContact CG2-CG2 3.89Å; I294-T315 HydrophobicContact CB-CG2 4.34Å; I311-T315 VanDerWaalsContact O-CB 3.28Å; I311-T315 WeakPolarHBondContact O-CB 3.39Å; I311-T315 PolarHBondContact O-N 3.21Å; I311-T315 PolarHBondContact O-OG1 2.7Å; T315-I317 PolarHBondContact O-N 3.43Å; T315-A318 PolarHBondContact O-N 2.86Å; T315-V319 HydrophobicContact CG2-CG2 4.46Å; T315-V319 WeakPolarHBondContact O-CG2 3.18Å; T315-V319 PolarHBondContact O-N 2.67Å
316	I	94.2	Very high	92	Very high	71 Å²	71	42.1 Å²	42.1	36%	0.364	21%	0.212	S	C	.	.	H	α-helix	trans	-62.4	-45.1	179.1	-67.7	169.2	0	0	0	111	V100 P312 A318 V319 F320 F464	V100-I316 HydrophobicContact CG1-CG1 3.92Å; P312-I316 WeakPolarHBondContact O-CB 3.45Å; P312-I316 WeakPolarHBondContact O-CD1 3.38Å; P312-I316 VanDerWaalsContact O-CG1 3.25Å; P312-I316 WeakPolarHBondContact O-CG1 3.43Å; P312-I316 PolarHBondContact O-N 3.12Å; P312-I316 VanDerWaalsContact O-N 3.12Å; I316-A318 PolarHBondContact O-N 3.18Å; I316-V319 PolarHBondContact O-N 3.12Å; I316-F320 WeakPolarHBondContact O-CB 3.35Å; I316-F320 PolarHBondContact O-N 3.06Å; I316-F464 HydrophobicContact CD1-CE2 4.09Å; I316-F464 HydrophobicContact CD1-CZ 3.95Å
317	I	94.4	Very high	92.5	Very high	89 Å²	89	40.7 Å²	40.7	46%	0.456	20%	0.203	S	C	.	.	H	α-helix	trans	-63.5	-42.8	178	-66.1	169	0	0	0	110.7	M57 K313 T315 F320 Y321	M57-I317 HydrophobicContact CE-CG2 3.68Å; M57-I317 HydrophobicContact SD-CG2 3.94Å; K313-I317 WeakPolarHBondContact O-CB 3.2Å; K313-I317 WeakPolarHBondContact O-CD1 3.42Å; K313-I317 WeakPolarHBondContact O-CG1 3.14Å; K313-I317 PolarHBondContact O-N 3.11Å; T315-I317 PolarHBondContact O-N 3.43Å; I317-F320 PolarHBondContact O-N 3.39Å; I317-Y321 VanDerWaalsContact O-CB 3.29Å; I317-Y321 WeakPolarHBondContact O-CB 3.5Å; I317-Y321 PolarHBondContact O-N 3.03Å
318	A	93.5	Very high	92.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61	-48	178.3	0	0	0	0	0	112.1	T60 I61 G314 T315 I316 Y321 T322	T60-A318 HydrophobicContact CG2-CB 3.72Å; I61-A318 HydrophobicContact CD1-CB 4.45Å; I61-A318 HydrophobicContact CG1-CB 3.68Å; G314-A318 VanDerWaalsContact O-CB 3.27Å; G314-A318 WeakPolarHBondContact O-CB 3.39Å; G314-A318 PolarHBondContact O-N 3.33Å; T315-A318 PolarHBondContact O-N 2.86Å; I316-A318 PolarHBondContact O-N 3.18Å; A318-Y321 PolarHBondContact O-N 3.2Å; A318-T322 WeakPolarHBondContact O-CG2 3.48Å; A318-T322 PolarHBondContact O-N 3.31Å; A318-T322 PolarHBondContact O-OG1 3.09Å; A318-T322 VanDerWaalsContact O-OG1 3.14Å
319	V	93.9	Very high	93.2	Very high	9 Å²	9	41.7 Å²	41.7	6%	0.055	20%	0.204	C	C	.	.	H	α-helix	trans	-64.2	-41.7	179.4	171.3	0	0	0	0	111.6	M64 Y93 I96 V100 I294 T315 I316 T322 F323	M64-V319 HydrophobicContact CE-CG2 4.14Å; M64-V319 HydrophobicContact SD-CG2 4.04Å; Y93-V319 HydrophobicContact CD1-CG1 3.72Å; Y93-V319 HydrophobicContact CE1-CG1 3.92Å; Y93-V319 WeakPolarHBondContact CE1-O 3.39Å; I96-V319 HydrophobicContact CG2-CG1 4.03Å; I96-V319 HydrophobicContact CG2-CG2 4.12Å; V100-V319 HydrophobicContact CG2-CG2 4.24Å; I294-V319 HydrophobicContact CG2-CG2 3.82Å; T315-V319 HydrophobicContact CG2-CG2 4.46Å; T315-V319 WeakPolarHBondContact O-CG2 3.18Å; T315-V319 PolarHBondContact O-N 2.67Å; I316-V319 PolarHBondContact O-N 3.12Å; V319-T322 PolarHBondContact O-OG1 2.81Å; V319-T322 VanDerWaalsContact O-OG1 3.09Å; V319-F323 VanDerWaalsContact O-CB 3.29Å; V319-F323 WeakPolarHBondContact O-CB 3.5Å; V319-F323 PolarHBondContact O-N 2.88Å
320	F	94.3	Very high	93.5	Very high	143 Å²	143	37.5 Å²	37.5	63%	0.627	18%	0.183	S	C	*	.	H	α-helix	trans	-64.7	-41.3	176.5	-178.8	-101	0	0	0	112.2	I316 I317 T324	I316-F320 WeakPolarHBondContact O-CB 3.35Å; I316-F320 PolarHBondContact O-N 3.06Å; I317-F320 PolarHBondContact O-N 3.39Å; F320-T324 PolarHBondContact O-N 3.43Å; F320-T324 VanDerWaalsContact O-N 3.12Å; F320-T324 PolarHBondContact O-OG1 3.02Å
321	Y	94	Very high	93.6	Very high	77 Å²	77	41.1 Å²	41.1	30%	0.302	20%	0.201	S	C	.	.	H	α-helix	trans	-63.3	-48.4	177.4	175.1	-107.6	0	0	0	111.7	I61 F65 I317 A318 T324 V325	I61-Y321 HydrophobicContact CD1-CD1 3.7Å; I61-Y321 HydrophobicContact CD1-CE1 4.16Å; I61-Y321 HydrophobicContact CD1-CG 4.48Å; I61-Y321 HydrophobicContact CG1-CD1 4.07Å; I61-Y321 HydrophobicContact CG2-CD1 4.15Å; I61-Y321 HydrophobicContact CG2-CE1 4.04Å; F65-Y321 HydrophobicContact CE2-CD1 4.31Å; F65-Y321 AromaticContact CE2-CE1 3.57Å; F65-Y321 HydrophobicContact CE2-CE1 3.57Å; F65-Y321 HydrophobicContact CZ-CD1 4.02Å; F65-Y321 AromaticContact CZ-CE1 3.58Å; F65-Y321 HydrophobicContact CZ-CE1 3.58Å; I317-Y321 VanDerWaalsContact O-CB 3.29Å; I317-Y321 WeakPolarHBondContact O-CB 3.5Å; I317-Y321 PolarHBondContact O-N 3.03Å; A318-Y321 PolarHBondContact O-N 3.2Å; Y321-T324 PolarHBondContact O-N 3.47Å; Y321-V325 HydrophobicContact CE1-CG2 4.45Å; Y321-V325 HydrophobicContact CE2-CG2 4.21Å; Y321-V325 WeakPolarHBondContact O-CG2 3.35Å; Y321-V325 PolarHBondContact O-N 3.46Å; Y321-V325 VanDerWaalsContact O-N 3.13Å
322	T	93.7	Very high	93.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.9	-41.4	179.7	55.6	0	0	0	0	112	I61 M64 F65 Y93 A318 V319 T324 V325 Y326	I61-T322 HydrophobicContact CG1-CG2 4.5Å; I61-T322 HydrophobicContact CG2-CG2 4.37Å; M64-T322 HydrophobicContact CB-CG2 3.89Å; M64-T322 VanDerWaalsContact CE-OG1 3.28Å; M64-T322 WeakPolarHBondContact CE-OG1 3.49Å; M64-T322 HydrophobicContact SD-CG2 4.05Å; M64-T322 PolarHBondContact SD-OG1 3.23Å; F65-T322 HydrophobicContact CD1-CG2 3.85Å; F65-T322 HydrophobicContact CE1-CG2 3.4Å; F65-T322 VanDerWaalsContact CE1-CG2 3.4Å; F65-T322 HydrophobicContact CZ-CG2 3.85Å; Y93-T322 WeakPolarHBondContact OH-CB 3.36Å; Y93-T322 PolarHBondContact OH-OG1 3.22Å; A318-T322 WeakPolarHBondContact O-CG2 3.48Å; A318-T322 PolarHBondContact O-N 3.31Å; A318-T322 PolarHBondContact O-OG1 3.09Å; A318-T322 VanDerWaalsContact O-OG1 3.14Å; V319-T322 PolarHBondContact O-OG1 2.81Å; V319-T322 VanDerWaalsContact O-OG1 3.09Å; T322-T324 VanDerWaalsContact C-N 3.31Å; T322-T324 PolarHBondContact O-N 3.08Å; T322-V325 PolarHBondContact O-N 2.92Å; T322-Y326 VanDerWaalsContact O-CD2 3.24Å; T322-Y326 WeakPolarHBondContact O-CD2 3.24Å; T322-Y326 PolarHBondContact O-N 3.39Å
323	F	94.4	Very high	93.7	Very high	63 Å²	63	41.7 Å²	41.7	28%	0.276	20%	0.203	S	C	.	.	H	α-helix	trans	-52.9	-49.6	173.4	175.8	-108.1	0	0	0	111.8	V89 Y93 V319 V325 Y326 V327	V89-F323 HydrophobicContact CG1-CD2 3.97Å; V89-F323 HydrophobicContact CG1-CE2 3.92Å; Y93-F323 HydrophobicContact CD1-CB 3.65Å; Y93-F323 AromaticContact CD1-CD2 3.9Å; Y93-F323 HydrophobicContact CD1-CD2 3.9Å; Y93-F323 HydrophobicContact CD1-CG 4.17Å; Y93-F323 AromaticContact CD2-CD2 3.73Å; Y93-F323 HydrophobicContact CD2-CD2 3.73Å; Y93-F323 HydrophobicContact CE1-CB 3.52Å; Y93-F323 HydrophobicContact CE1-CD2 4.36Å; Y93-F323 HydrophobicContact CE1-CG 4.43Å; Y93-F323 HydrophobicContact CE2-CB 4.49Å; Y93-F323 HydrophobicContact CE2-CD2 4.2Å; Y93-F323 HydrophobicContact CG-CB 4.21Å; Y93-F323 AromaticContact CG-CD2 3.55Å; Y93-F323 HydrophobicContact CG-CD2 3.55Å; Y93-F323 HydrophobicContact CG-CE2 4.4Å; Y93-F323 HydrophobicContact CG-CG 4.29Å; Y93-F323 PolarHBondContact OH-N 3.18Å; V319-F323 VanDerWaalsContact O-CB 3.29Å; V319-F323 WeakPolarHBondContact O-CB 3.5Å; V319-F323 PolarHBondContact O-N 2.88Å; F323-V325 VanDerWaalsContact C-N 3.32Å; F323-V325 PolarHBondContact O-N 3.38Å; F323-Y326 PolarHBondContact O-N 3.14Å; F323-V327 HydrophobicContact CD2-CG2 4.19Å; F323-V327 HydrophobicContact CE1-CG2 4.15Å; F323-V327 HydrophobicContact CE2-CG2 3.8Å; F323-V327 HydrophobicContact CZ-CG2 3.77Å; F323-V327 WeakPolarHBondContact O-CG2 3.26Å; F323-V327 PolarHBondContact O-N 2.99Å
324	T	94.5	Very high	93.8	Very high	66 Å²	66	35.5 Å²	35.5	41%	0.405	18%	0.176	S	C	.	.	H	α-helix	trans	-61.3	-42	-179	-55.9	0	0	0	0	111.3	F320 Y321 T322 L328	F320-T324 PolarHBondContact O-N 3.43Å; F320-T324 VanDerWaalsContact O-N 3.12Å; F320-T324 PolarHBondContact O-OG1 3.02Å; Y321-T324 PolarHBondContact O-N 3.47Å; T322-T324 VanDerWaalsContact C-N 3.31Å; T322-T324 PolarHBondContact O-N 3.08Å; T324-L328 VanDerWaalsContact O-CB 3.32Å; T324-L328 WeakPolarHBondContact O-CB 3.43Å; T324-L328 PolarHBondContact O-N 3.3Å
325	V	93.7	Very high	93.8	Very high	11 Å²	11	36 Å²	36	7%	0.067	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-44.7	178.1	170.3	0	0	0	0	111.8	F65 L69 L219 F223 Y321 T322 F323 L328 L329	F65-V325 HydrophobicContact CE1-CB 4.29Å; F65-V325 HydrophobicContact CE1-CG1 4.14Å; F65-V325 HydrophobicContact CZ-CB 4.1Å; F65-V325 HydrophobicContact CZ-CG1 4.03Å; F65-V325 HydrophobicContact CZ-CG2 4.06Å; L69-V325 HydrophobicContact CD1-CG1 4.42Å; L219-V325 HydrophobicContact CD1-CG1 4.37Å; F223-V325 HydrophobicContact CZ-CG1 4.22Å; Y321-V325 HydrophobicContact CE1-CG2 4.45Å; Y321-V325 HydrophobicContact CE2-CG2 4.21Å; Y321-V325 WeakPolarHBondContact O-CG2 3.35Å; Y321-V325 PolarHBondContact O-N 3.46Å; Y321-V325 VanDerWaalsContact O-N 3.13Å; T322-V325 PolarHBondContact O-N 2.92Å; F323-V325 VanDerWaalsContact C-N 3.32Å; F323-V325 PolarHBondContact O-N 3.38Å; V325-L328 PolarHBondContact O-N 2.99Å; V325-L329 VanDerWaalsContact O-CB 3.31Å; V325-L329 WeakPolarHBondContact O-CB 3.42Å; V325-L329 PolarHBondContact O-N 3.33Å
326	Y	92.8	Very high	93.8	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-64.1	-46	178	-83	-72.2	0	0	0	112.4	M64 L69 Y93 S290 T322 F323 L328 L329 F330	M64-Y326 PolarHBondContact O-OH 3.43Å; M64-Y326 VanDerWaalsContact O-OH 3.11Å; L69-Y326 HydrophobicContact CB-CE1 4.34Å; L69-Y326 HydrophobicContact CD1-CD1 3.8Å; L69-Y326 HydrophobicContact CD1-CE1 3.42Å; L69-Y326 VanDerWaalsContact CD1-CE1 3.42Å; L69-Y326 HydrophobicContact CD1-CE2 4.44Å; L69-Y326 HydrophobicContact CD1-CG 4.45Å; L69-Y326 HydrophobicContact CG-CE1 4.49Å; Y93-Y326 HydrophobicContact CE2-CD2 4.34Å; Y93-Y326 WeakPolarHBondContact OH-CD2 3.26Å; Y93-Y326 WeakPolarHBondContact OH-CE2 3.4Å; S290-Y326 WeakPolarHBondContact CB-OH 3.25Å; S290-Y326 PolarHBondContact OG-OH 3.34Å; T322-Y326 VanDerWaalsContact O-CD2 3.24Å; T322-Y326 WeakPolarHBondContact O-CD2 3.24Å; T322-Y326 PolarHBondContact O-N 3.39Å; F323-Y326 PolarHBondContact O-N 3.14Å; Y326-L328 VanDerWaalsContact C-N 3.34Å; Y326-L328 PolarHBondContact O-N 2.86Å; Y326-L329 PolarHBondContact O-N 3.4Å; Y326-F330 HydrophobicContact CD1-CE1 4.16Å; Y326-F330 WeakPolarHBondContact O-CB 3.49Å; Y326-F330 WeakPolarHBondContact O-CD1 3.47Å; Y326-F330 PolarHBondContact O-N 3.1Å
327	V	94.4	Very high	93.7	Very high	35 Å²	35	32.5 Å²	32.5	21%	0.212	16%	0.162	C	C	.	.	H	α-helix	trans	-60.1	-45.9	178.3	170.9	0	0	0	0	110.7	L86 V89 F323 L329 F330 I331	L86-V327 HydrophobicContact CD2-CG1 4.12Å; L86-V327 HydrophobicContact CD2-CG2 4.31Å; V89-V327 HydrophobicContact CG1-CG2 4.27Å; F323-V327 HydrophobicContact CD2-CG2 4.19Å; F323-V327 HydrophobicContact CE1-CG2 4.15Å; F323-V327 HydrophobicContact CE2-CG2 3.8Å; F323-V327 HydrophobicContact CZ-CG2 3.77Å; F323-V327 WeakPolarHBondContact O-CG2 3.26Å; F323-V327 PolarHBondContact O-N 2.99Å; V327-L329 PolarHBondContact O-N 3.5Å; V327-F330 PolarHBondContact O-N 3.09Å; V327-I331 HydrophobicContact CG1-CD1 3.93Å; V327-I331 WeakPolarHBondContact O-CG1 3.3Å; V327-I331 PolarHBondContact O-N 3.02Å; V327-I331 VanDerWaalsContact O-N 3.14Å
328	L	94	Very high	93.6	Very high	78 Å²	78	29.9 Å²	29.9	41%	0.408	15%	0.149	S	C	.	.	H	α-helix	trans	-61.5	-46.1	177.8	-175.8	65.7	0	0	0	111.2	F223 T324 V325 Y326 F330 I331 L332	F223-L328 HydrophobicContact CD1-CD2 4.2Å; F223-L328 HydrophobicContact CD1-CG 4.48Å; F223-L328 HydrophobicContact CD2-CD2 4.46Å; F223-L328 HydrophobicContact CE1-CB 4.43Å; F223-L328 HydrophobicContact CE1-CD2 3.78Å; F223-L328 HydrophobicContact CE1-CG 3.92Å; F223-L328 HydrophobicContact CE2-CD2 4.07Å; F223-L328 HydrophobicContact CZ-CB 4.47Å; F223-L328 HydrophobicContact CZ-CD2 3.71Å; F223-L328 HydrophobicContact CZ-CG 4.21Å; T324-L328 VanDerWaalsContact O-CB 3.32Å; T324-L328 WeakPolarHBondContact O-CB 3.43Å; T324-L328 PolarHBondContact O-N 3.3Å; V325-L328 PolarHBondContact O-N 2.99Å; Y326-L328 VanDerWaalsContact C-N 3.34Å; Y326-L328 PolarHBondContact O-N 2.86Å; L328-F330 PolarHBondContact O-N 3.19Å; L328-I331 PolarHBondContact O-N 3.09Å; L328-L332 HydrophobicContact CD1-CD1 4.1Å; L328-L332 HydrophobicContact CD1-CG 4.35Å; L328-L332 HydrophobicContact CD2-CD1 4.49Å; L328-L332 HydrophobicContact CG-CD1 3.84Å; L328-L332 HydrophobicContact CG-CG 4.45Å; L328-L332 WeakPolarHBondContact O-CB 3.32Å; L328-L332 VanDerWaalsContact O-CG 3.25Å; L328-L332 WeakPolarHBondContact O-CG 3.37Å; L328-L332 PolarHBondContact O-N 2.68Å
329	L	93	Very high	93.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-63.2	-41.9	179.8	-169.9	66	0	0	0	111.8	L69 T73 V222 F223 V325 Y326 V327 I331 L332 V333	L69-L329 HydrophobicContact CD1-CD2 3.76Å; L69-L329 HydrophobicContact CG-CD2 4.44Å; T73-L329 HydrophobicContact CG2-CD2 3.73Å; T73-L329 HydrophobicContact CG2-CG 3.91Å; V222-L329 HydrophobicContact CG1-CD1 3.93Å; F223-L329 HydrophobicContact CE1-CB 4.27Å; F223-L329 HydrophobicContact CE1-CD1 4.03Å; V325-L329 VanDerWaalsContact O-CB 3.31Å; V325-L329 WeakPolarHBondContact O-CB 3.42Å; V325-L329 PolarHBondContact O-N 3.33Å; Y326-L329 PolarHBondContact O-N 3.4Å; V327-L329 PolarHBondContact O-N 3.5Å; L329-I331 PolarHBondContact O-N 3.08Å; L329-L332 PolarHBondContact O-N 3.21Å; L329-V333 HydrophobicContact CD1-CG2 4.09Å; L329-V333 HydrophobicContact CG-CG2 4.21Å; L329-V333 VanDerWaalsContact O-CB 3.32Å; L329-V333 WeakPolarHBondContact O-CB 3.28Å; L329-V333 VanDerWaalsContact O-CG2 3.23Å; L329-V333 WeakPolarHBondContact O-CG2 3.5Å; L329-V333 PolarHBondContact O-N 3.24Å
330	F	94.2	Very high	93.3	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-62.3	-43.9	178.9	-83.4	35	0	0	0	111.5	T73 V76 V77 L82 L86 V89 Y326 V327 L328 S334	T73-F330 HydrophobicContact CG2-CD1 3.71Å; T73-F330 HydrophobicContact CG2-CE1 3.66Å; V76-F330 HydrophobicContact CB-CZ 4.24Å; V76-F330 HydrophobicContact CG1-CE2 3.82Å; V76-F330 HydrophobicContact CG1-CZ 3.79Å; V77-F330 HydrophobicContact CG2-CB 4.31Å; V77-F330 HydrophobicContact CG2-CD1 4.18Å; V77-F330 HydrophobicContact CG2-CD2 4.02Å; V77-F330 HydrophobicContact CG2-CE2 4.38Å; V77-F330 HydrophobicContact CG2-CG 3.91Å; L82-F330 HydrophobicContact CD1-CB 4.21Å; L86-F330 HydrophobicContact CD2-CB 4.39Å; V89-F330 HydrophobicContact CG2-CD2 4.12Å; V89-F330 HydrophobicContact CG2-CE2 3.54Å; V89-F330 HydrophobicContact CG2-CZ 3.83Å; Y326-F330 HydrophobicContact CD1-CE1 4.16Å; Y326-F330 WeakPolarHBondContact O-CB 3.49Å; Y326-F330 WeakPolarHBondContact O-CD1 3.47Å; Y326-F330 PolarHBondContact O-N 3.1Å; V327-F330 PolarHBondContact O-N 3.09Å; L328-F330 PolarHBondContact O-N 3.19Å; F330-S334 VanDerWaalsContact O-CB 3.27Å; F330-S334 WeakPolarHBondContact O-CB 3.14Å; F330-S334 PolarHBondContact O-N 3.27Å; F330-S334 PolarHBondContact O-OG 3.5Å
331	I	93.9	Very high	93.1	Very high	76 Å²	76	27 Å²	27	39%	0.39	14%	0.139	S	C	.	.	H	α-helix	trans	-64.1	-47.9	177.8	-67.5	167.8	0	0	0	110.5	L82 V327 L328 L329 S334 A335	L82-I331 HydrophobicContact CD1-CG1 4.24Å; V327-I331 HydrophobicContact CG1-CD1 3.93Å; V327-I331 WeakPolarHBondContact O-CG1 3.3Å; V327-I331 PolarHBondContact O-N 3.02Å; V327-I331 VanDerWaalsContact O-N 3.14Å; L328-I331 PolarHBondContact O-N 3.09Å; L329-I331 PolarHBondContact O-N 3.08Å; I331-S334 PolarHBondContact O-N 3.39Å; I331-A335 WeakPolarHBondContact O-CB 3.23Å; I331-A335 PolarHBondContact O-N 2.96Å; I331-A335 VanDerWaalsContact O-N 3.07Å
332	L	93.4	Very high	92.9	Very high	23 Å²	23	23.4 Å²	23.4	12%	0.12	12%	0.124	C	C	.	.	H	α-helix	trans	-65.3	-45.5	-177.5	-69.9	173.7	0	0	0	112.3	F223 T226 F255 L328 L329 S334 A335 T336	F223-L332 HydrophobicContact CD1-CD1 3.38Å; F223-L332 HydrophobicContact CE1-CD1 3.81Å; F223-L332 HydrophobicContact CG-CD1 4.41Å; T226-L332 HydrophobicContact CG2-CB 4.39Å; F255-L332 HydrophobicContact CE1-CD2 3.83Å; F255-L332 HydrophobicContact CZ-CD2 3.63Å; L328-L332 HydrophobicContact CD1-CD1 4.1Å; L328-L332 HydrophobicContact CD1-CG 4.35Å; L328-L332 HydrophobicContact CD2-CD1 4.49Å; L328-L332 HydrophobicContact CG-CD1 3.84Å; L328-L332 HydrophobicContact CG-CG 4.45Å; L328-L332 WeakPolarHBondContact O-CB 3.32Å; L328-L332 VanDerWaalsContact O-CG 3.25Å; L328-L332 WeakPolarHBondContact O-CG 3.37Å; L328-L332 PolarHBondContact O-N 2.68Å; L329-L332 PolarHBondContact O-N 3.21Å; L332-S334 PolarHBondContact O-N 3.33Å; L332-A335 PolarHBondContact O-N 3.44Å; L332-T336 WeakPolarHBondContact O-CB 3.42Å; L332-T336 WeakPolarHBondContact O-CG2 3.27Å; L332-T336 PolarHBondContact O-N 3.38Å; L332-T336 PolarHBondContact O-OG1 3.47Å
333	V	92.9	Very high	92.7	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-43.5	178.2	171	0	0	0	0	110.7	L329 A335 T336 C337 L342 F348 L349	L329-V333 HydrophobicContact CD1-CG2 4.09Å; L329-V333 HydrophobicContact CG-CG2 4.21Å; L329-V333 VanDerWaalsContact O-CB 3.32Å; L329-V333 WeakPolarHBondContact O-CB 3.28Å; L329-V333 VanDerWaalsContact O-CG2 3.23Å; L329-V333 WeakPolarHBondContact O-CG2 3.5Å; L329-V333 PolarHBondContact O-N 3.24Å; V333-A335 VanDerWaalsContact C-N 3.29Å; V333-A335 PolarHBondContact O-N 2.9Å; V333-T336 PolarHBondContact O-N 3.45Å; V333-C337 WeakPolarHBondContact O-CB 3.31Å; V333-C337 PolarHBondContact O-N 3.02Å; V333-L342 HydrophobicContact CG1-CD1 4.02Å; V333-L342 HydrophobicContact CG1-CD2 3.36Å; V333-L342 HydrophobicContact CG1-CG 4.35Å; V333-F348 HydrophobicContact CG1-CE2 3.84Å; V333-F348 HydrophobicContact CG1-CZ 3.67Å; V333-F348 HydrophobicContact CG2-CE2 4.18Å; V333-F348 HydrophobicContact CG2-CZ 3.99Å; V333-L349 HydrophobicContact CG2-CD2 4.39Å
334	S	93.7	Very high	92.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64	-32.3	178.4	-57.9	0	0	0	0	113.3	V77 L82 L260 N263 F330 I331 L332	V77-S334 WeakPolarHBondContact CG1-OG 3.39Å; L82-S334 WeakPolarHBondContact CD1-OG 3.36Å; L260-S334 WeakPolarHBondContact CA-O 3.42Å; N263-S334 PolarHBondContact ND2-O 3.39Å; F330-S334 VanDerWaalsContact O-CB 3.27Å; F330-S334 WeakPolarHBondContact O-CB 3.14Å; F330-S334 PolarHBondContact O-N 3.27Å; F330-S334 PolarHBondContact O-OG 3.5Å; I331-S334 PolarHBondContact O-N 3.39Å; L332-S334 PolarHBondContact O-N 3.33Å
335	A	93.4	Very high	91.8	Very high	9 Å²	9	19.1 Å²	19.1	7%	0.074	10%	0.101	C	C	.	.	H	α-helix	trans	-83.7	-17.5	-178.5	0	0	0	0	0	114.1	F255 S256 L260 I331 L332 V333	F255-A335 HydrophobicContact CD1-CB 4.18Å; F255-A335 HydrophobicContact CE1-CB 4.45Å; S256-A335 PolarHBondContact N-O 3.06Å; S256-A335 VanDerWaalsContact N-O 3.1Å; L260-A335 HydrophobicContact CD1-CB 4.24Å; I331-A335 WeakPolarHBondContact O-CB 3.23Å; I331-A335 PolarHBondContact O-N 2.96Å; I331-A335 VanDerWaalsContact O-N 3.07Å; L332-A335 PolarHBondContact O-N 3.44Å; V333-A335 VanDerWaalsContact C-N 3.29Å; V333-A335 PolarHBondContact O-N 2.9Å
336	T	92.9	Very high	91.3	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-117.3	-25.8	-169	58.2	0	0	0	0	115.2	Y252 T253 G254 F255 L332 V333	Y252-T336 WeakPolarHBondContact CD2-O 3.46Å; T253-T336 PolarHBondContact N-O 2.88Å; T253-T336 PolarHBondContact OG1-O 3.18Å; G254-T336 PolarHBondContact N-O 3.16Å; G254-T336 WeakPolarHBondContact O-CA 3.34Å; F255-T336 HydrophobicContact CD1-CG2 4.14Å; F255-T336 HydrophobicContact CD2-CG2 4.2Å; F255-T336 HydrophobicContact CE1-CG2 4.19Å; F255-T336 HydrophobicContact CE2-CG2 4.22Å; F255-T336 HydrophobicContact CG-CG2 4.16Å; F255-T336 HydrophobicContact CZ-CG2 4.23Å; L332-T336 WeakPolarHBondContact O-CB 3.42Å; L332-T336 WeakPolarHBondContact O-CG2 3.27Å; L332-T336 PolarHBondContact O-N 3.38Å; L332-T336 PolarHBondContact O-OG1 3.47Å; V333-T336 PolarHBondContact O-N 3.45Å
337	C	92.6	Very high	90.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.102	C	C	.	.	B	Isolated β-bridge	trans	-113	135.2	-173.6	-61.9	0	0	0	0	111.5	T259 N263 V333 L341 L342	T259-C337 WeakPolarHBondContact CG2-O 3.47Å; N263-C337 PolarHBondContact ND2-O 3.38Å; V333-C337 WeakPolarHBondContact O-CB 3.31Å; V333-C337 PolarHBondContact O-N 3.02Å; C337-L341 HydrophobicContact CB-CD2 4.3Å; C337-L342 HydrophobicContact CB-CD1 4.46Å; C337-L342 HydrophobicContact CB-CD2 3.66Å; C337-L342 HydrophobicContact CB-CG 4.06Å
338	D	92.8	Very high	90.6	Very high	34 Å²	34	17.5 Å²	17.5	18%	0.182	9%	0.092	C	C	.	.			trans	-66.7	150.1	173.4	-174.1	37.9	0	0	0	112	S251 T340 L341 L342	S251-D338 VanDerWaalsContact O-CB 3.26Å; S251-D338 WeakPolarHBondContact O-CB 3.41Å; S251-D338 PolarHBondContact O-N 3.24Å; S251-D338 VanDerWaalsContact O-N 3.08Å; D338-T340 PolarHBondContact O-N 3.25Å; D338-T340 PolarHBondContact OD2-OG1 2.79Å; D338-L341 VanDerWaalsContact O-CB 3.31Å; D338-L341 WeakPolarHBondContact O-CB 3.45Å; D338-L341 PolarHBondContact O-N 3.41Å; D338-L341 VanDerWaalsContact O-N 3.09Å; D338-L342 PolarHBondContact O-N 3.21Å
339	R	91.1	Very high	90.3	Very high	43 Å²	43	14 Å²	14	16%	0.162	7%	0.073	C	C	.	.	H	α-helix	trans	-59	-37.5	-175	-165	-179.8	-170.4	119.1	15.1	112.5	G78 H79 N262 N263 G265 L341 L342 I343	G78-R339 VanDerWaalsContact O-CZ 3.24Å; G78-R339 PolarHBondContact O-NE 3.36Å; G78-R339 PolarHBondContact O-NH2 3.07Å; H79-R339 PolarHBondContact O-NH2 3.04Å; N262-R339 PolarHBondContact O-NH1 3.41Å; N263-R339 WeakPolarHBondContact OD1-CA 3.03Å; N263-R339 VanDerWaalsContact OD1-CB 3.29Å; N263-R339 WeakPolarHBondContact OD1-CB 3.41Å; G265-R339 PolarHBondContact O-NH1 3.12Å; G265-R339 PolarHBondContact O-NH2 3Å; G265-R339 VanDerWaalsContact O-NH2 3.16Å; R339-L341 VanDerWaalsContact C-N 3.31Å; R339-L341 PolarHBondContact O-N 3.29Å; R339-L342 PolarHBondContact O-N 3.02Å; R339-I343 HydrophobicContact CG-CD1 3.98Å; R339-I343 WeakPolarHBondContact O-CG1 3.42Å; R339-I343 PolarHBondContact O-N 2.89Å; R339-I343 VanDerWaalsContact O-N 3.15Å
340	T	89.6	Confident	90.1	Very high	48 Å²	48	15.9 Å²	15.9	29%	0.294	8%	0.082	S	C	.	.	H	α-helix	trans	-62.2	-39.4	179.2	59	0	0	0	0	111.6	N249 A250 D338 I343 Q344	N249-T340 PolarHBondContact O-OG1 3.41Å; A250-T340 WeakPolarHBondContact CA-OG1 3.32Å; D338-T340 PolarHBondContact O-N 3.25Å; D338-T340 PolarHBondContact OD2-OG1 2.79Å; T340-I343 PolarHBondContact O-N 3.26Å; T340-Q344 VanDerWaalsContact O-CB 3.29Å; T340-Q344 WeakPolarHBondContact O-CB 3.27Å; T340-Q344 VanDerWaalsContact O-CG 3.31Å; T340-Q344 WeakPolarHBondContact O-CG 3.46Å; T340-Q344 PolarHBondContact O-N 2.77Å
341	L	89.8	Confident	89.5	Confident	1 Å²	1	22 Å²	22	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-62.7	-44.6	176.1	-173.4	59.3	0	0	0	111.1	F234 I236 A250 C337 D338 R339 I343 D345 F348	F234-L341 HydrophobicContact CD2-CD1 4.02Å; F234-L341 HydrophobicContact CD2-CD2 4.28Å; F234-L341 HydrophobicContact CE2-CD2 4.23Å; I236-L341 HydrophobicContact CD1-CD1 4.09Å; A250-L341 HydrophobicContact CB-CB 3.95Å; A250-L341 HydrophobicContact CB-CD1 4.06Å; C337-L341 HydrophobicContact CB-CD2 4.3Å; D338-L341 VanDerWaalsContact O-CB 3.31Å; D338-L341 WeakPolarHBondContact O-CB 3.45Å; D338-L341 PolarHBondContact O-N 3.41Å; D338-L341 VanDerWaalsContact O-N 3.09Å; R339-L341 VanDerWaalsContact C-N 3.31Å; R339-L341 PolarHBondContact O-N 3.29Å; L341-I343 VanDerWaalsContact C-N 3.34Å; L341-I343 PolarHBondContact O-N 3.45Å; L341-D345 HydrophobicContact CD1-CB 4.48Å; L341-D345 PolarHBondContact O-N 3.49Å; L341-F348 HydrophobicContact CD1-CB 4.22Å; L341-F348 HydrophobicContact CD2-CB 4.44Å; L341-F348 HydrophobicContact CG-CB 4Å
342	L	90.6	Very high	89.2	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-66.6	-33.6	-177.5	-62.1	-177.6	0	0	0	113.5	G74 V77 V333 C337 D338 R339 F348	G74-L342 CarbonylContact C-O 3.35Å; V77-L342 HydrophobicContact CB-CD1 4.26Å; V77-L342 HydrophobicContact CG1-CD1 3.75Å; V333-L342 HydrophobicContact CG1-CD1 4.02Å; V333-L342 HydrophobicContact CG1-CD2 3.36Å; V333-L342 HydrophobicContact CG1-CG 4.35Å; C337-L342 HydrophobicContact CB-CD1 4.46Å; C337-L342 HydrophobicContact CB-CD2 3.66Å; C337-L342 HydrophobicContact CB-CG 4.06Å; D338-L342 PolarHBondContact O-N 3.21Å; R339-L342 PolarHBondContact O-N 3.02Å; L342-F348 HydrophobicContact CD2-CD1 4.42Å; L342-F348 HydrophobicContact CD2-CD2 4.02Å; L342-F348 HydrophobicContact CD2-CE1 4.14Å; L342-F348 HydrophobicContact CD2-CE2 3.69Å; L342-F348 HydrophobicContact CD2-CG 4.37Å; L342-F348 HydrophobicContact CD2-CZ 3.75Å
343	I	89.1	Confident	89.1	Confident	14 Å²	14	17.5 Å²	17.5	7%	0.072	8%	0.082	C	C	.	.	H	α-helix	trans	-82.4	-39	179.8	-65.9	170.1	0	0	0	111.2	Y272 R339 T340 L341	Y272-I343 WeakPolarHBondContact CD1-O 3.27Å; Y272-I343 WeakPolarHBondContact CE1-O 3.47Å; R339-I343 HydrophobicContact CG-CD1 3.98Å; R339-I343 WeakPolarHBondContact O-CG1 3.42Å; R339-I343 PolarHBondContact O-N 2.89Å; R339-I343 VanDerWaalsContact O-N 3.15Å; T340-I343 PolarHBondContact O-N 3.26Å; L341-I343 VanDerWaalsContact C-N 3.34Å; L341-I343 PolarHBondContact O-N 3.45Å
344	Q	85.2	Confident	88.9	Confident	22 Å²	22	22.3 Å²	22.3	10%	0.103	11%	0.107	C	C	.	.	H	α-helix	trans	-95	-10.5	-167.1	-63.3	-64.1	-28.3	0	0	114.6	I236 R238 Y248 Y272 T340	I236-Q344 HydrophobicContact CD1-CB 4.05Å; I236-Q344 HydrophobicContact CG2-CB 4.38Å; R238-Q344 PolarHBondContact NH2-O 3.3Å; Y248-Q344 HydrophobicContact CD1-CG 4.45Å; Y248-Q344 HydrophobicContact CD2-CG 4.19Å; Y248-Q344 HydrophobicContact CG-CG 4.14Å; Y272-Q344 VanDerWaalsContact CE1-C 3.46Å; Y272-Q344 WeakPolarHBondContact CE1-O 3.33Å; T340-Q344 VanDerWaalsContact O-CB 3.29Å; T340-Q344 WeakPolarHBondContact O-CB 3.27Å; T340-Q344 VanDerWaalsContact O-CG 3.31Å; T340-Q344 WeakPolarHBondContact O-CG 3.46Å; T340-Q344 PolarHBondContact O-N 2.77Å
345	D	84.5	Confident	88.6	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.021	13%	0.13	C	C	.	.			trans	-142.4	104	-179.1	-171.7	6.2	0	0	0	112.8	I236 L341 G347 F348 R351	I236-D345 HydrophobicContact CD1-CB 4Å; L341-D345 HydrophobicContact CD1-CB 4.48Å; L341-D345 PolarHBondContact O-N 3.49Å; D345-G347 PolarHBondContact O-N 3.29Å; D345-G347 WeakPolarHBondContact OD1-CA 3.44Å; D345-G347 PolarHBondContact OD1-N 2.97Å; D345-F348 HydrophobicContact CB-CB 4.47Å; D345-F348 WeakPolarHBondContact O-CB 3.49Å; D345-F348 WeakPolarHBondContact O-CD1 3.4Å; D345-F348 PolarHBondContact O-N 2.93Å; D345-R351 WeakPolarHBondContact OD2-CD 3.46Å; D345-R351 IonicContact OD2-CZ 2.69Å; D345-R351 IonicContact OD2-NE 2.79Å; D345-R351 PolarHBondContact OD2-NE 3.31Å; D345-R351 IonicContact OD2-NH2 3.71Å
346	Y	83.6	Confident	88.2	Confident	9 Å²	9	30.5 Å²	30.5	4%	0.035	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.8	172.7	-64.1	-14.7	0	0	0	112.8	L71 R72 F75 D271 Y272 S273 F348	L71-Y346 WeakPolarHBondContact O-CB 3.42Å; R72-Y346 PolarHBondContact NH1-OH 2.83Å; F75-Y346 HydrophobicContact CB-CD1 4.18Å; F75-Y346 HydrophobicContact CB-CE1 3.84Å; F75-Y346 AromaticContact CD2-CE1 3.77Å; F75-Y346 HydrophobicContact CD2-CE1 3.77Å; F75-Y346 HydrophobicContact CG-CE1 4.17Å; D271-Y346 PolarHBondContact OD1-OH 3.11Å; D271-Y346 PolarHBondContact OD2-OH 2.92Å; Y272-Y346 HydrophobicContact CD1-CE1 4.4Å; Y272-Y346 AromaticContact CE1-CD1 3.72Å; Y272-Y346 HydrophobicContact CE1-CD1 3.72Å; Y272-Y346 HydrophobicContact CE1-CD2 4.49Å; Y272-Y346 AromaticContact CE1-CE1 3.51Å; Y272-Y346 HydrophobicContact CE1-CE1 3.51Å; Y272-Y346 HydrophobicContact CE1-CE2 4.31Å; Y272-Y346 HydrophobicContact CE1-CG 4.23Å; Y272-Y346 AromaticContact CE1-CZ 3.86Å; Y272-Y346 HydrophobicContact CE2-CE2 4.38Å; Y272-Y346 AromaticContact CZ-CD1 3.8Å; Y272-Y346 AromaticContact CZ-CD2 3.83Å; Y272-Y346 AromaticContact CZ-CE1 3.84Å; Y272-Y346 AromaticContact CZ-CE2 3.86Å; Y272-Y346 AromaticContact CZ-CG 3.8Å; Y272-Y346 AromaticContact CZ-CZ 3.9Å; Y272-Y346 WeakPolarHBondContact OH-CB 3.31Å; Y272-Y346 VanDerWaalsContact OH-CD1 3.26Å; Y272-Y346 WeakPolarHBondContact OH-CD1 3.39Å; Y272-Y346 WeakPolarHBondContact OH-CD2 3.22Å; Y272-Y346 PolarHBondContact OH-N 3.48Å; S273-Y346 PolarHBondContact OG-OH 3.07Å; Y346-F348 VanDerWaalsContact C-N 3.26Å; Y346-F348 PolarHBondContact O-N 2.89Å
347	G	84.4	Confident	87.9	Confident	5 Å²	5	32.8 Å²	32.8	5%	0.052	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	9.7	178.2	0	0	0	0	0	113.9	D345 L349 Q350	D345-G347 PolarHBondContact O-N 3.29Å; D345-G347 WeakPolarHBondContact OD1-CA 3.44Å; D345-G347 PolarHBondContact OD1-N 2.97Å; G347-L349 PolarHBondContact O-N 3.02Å; G347-L349 VanDerWaalsContact O-N 3.11Å; G347-Q350 VanDerWaalsContact O-CB 3.32Å; G347-Q350 WeakPolarHBondContact O-CB 3.39Å; G347-Q350 PolarHBondContact O-N 3.35Å
348	F	87.7	Confident	87.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.8	-35.7	-172.3	80.9	-76.8	0	0	0	113.3	G74 V333 L341 L342 D345 Y346 Q350 R351 I352	G74-F348 VanDerWaalsContact CA-CE1 3.43Å; V333-F348 HydrophobicContact CG1-CE2 3.84Å; V333-F348 HydrophobicContact CG1-CZ 3.67Å; V333-F348 HydrophobicContact CG2-CE2 4.18Å; V333-F348 HydrophobicContact CG2-CZ 3.99Å; L341-F348 HydrophobicContact CD1-CB 4.22Å; L341-F348 HydrophobicContact CD2-CB 4.44Å; L341-F348 HydrophobicContact CG-CB 4Å; L342-F348 HydrophobicContact CD2-CD1 4.42Å; L342-F348 HydrophobicContact CD2-CD2 4.02Å; L342-F348 HydrophobicContact CD2-CE1 4.14Å; L342-F348 HydrophobicContact CD2-CE2 3.69Å; L342-F348 HydrophobicContact CD2-CG 4.37Å; L342-F348 HydrophobicContact CD2-CZ 3.75Å; D345-F348 HydrophobicContact CB-CB 4.47Å; D345-F348 WeakPolarHBondContact O-CB 3.49Å; D345-F348 WeakPolarHBondContact O-CD1 3.4Å; D345-F348 PolarHBondContact O-N 2.93Å; Y346-F348 VanDerWaalsContact C-N 3.26Å; Y346-F348 PolarHBondContact O-N 2.89Å; F348-Q350 PolarHBondContact O-N 2.88Å; F348-R351 PolarHBondContact O-N 3.41Å; F348-I352 HydrophobicContact CD2-CD1 4.03Å; F348-I352 HydrophobicContact CE2-CD1 4.09Å; F348-I352 WeakPolarHBondContact O-CG1 3.34Å; F348-I352 PolarHBondContact O-N 3.5Å; F348-I352 VanDerWaalsContact O-N 3.09Å
349	L	88.8	Confident	87.6	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-59.5	-34.2	177.1	-72.8	-174.7	0	0	0	112.4	F70 V222 V333 G347 I352 N353 V359	F70-L349 HydrophobicContact CD1-CD1 4.36Å; F70-L349 WeakPolarHBondContact O-CD1 3.4Å; V222-L349 HydrophobicContact CG1-CD2 3.9Å; V333-L349 HydrophobicContact CG2-CD2 4.39Å; G347-L349 PolarHBondContact O-N 3.02Å; G347-L349 VanDerWaalsContact O-N 3.11Å; L349-I352 HydrophobicContact CD2-CD1 3.99Å; L349-N353 WeakPolarHBondContact O-CB 3.28Å; L349-N353 PolarHBondContact O-N 3.01Å; L349-V359 HydrophobicContact CB-CG1 4.1Å
350	Q	87.4	Confident	87.4	Confident	42 Å²	42	33.6 Å²	33.6	20%	0.196	16%	0.162	C	C	.	.	H	α-helix	trans	-68.2	-38.9	176.1	-179.6	-179.3	-3.9	0	0	111.3	G347 F348 P356 V359 T360	G347-Q350 VanDerWaalsContact O-CB 3.32Å; G347-Q350 WeakPolarHBondContact O-CB 3.39Å; G347-Q350 PolarHBondContact O-N 3.35Å; F348-Q350 PolarHBondContact O-N 2.88Å; Q350-P356 HydrophobicContact CG-CB 3.84Å; Q350-P356 WeakPolarHBondContact O-CB 3.44Å; Q350-V359 HydrophobicContact CB-CB 4.38Å; Q350-V359 HydrophobicContact CB-CG1 4.32Å; Q350-T360 VanDerWaalsContact CD-OG1 3.23Å; Q350-T360 PolarHBondContact NE2-OG1 3.46Å
351	R	83	Confident	87.5	Confident	128 Å²	128	34.9 Å²	34.9	48%	0.483	17%	0.166	S	C	.	.	H	α-helix	trans	-72.9	-33.1	-177.9	-62	-172.6	-172.6	-115.1	-2	113.4	F234 D345 F348	F234-R351 HydrophobicContact CE1-CB 4.32Å; F234-R351 HydrophobicContact CZ-CB 4.28Å; D345-R351 WeakPolarHBondContact OD2-CD 3.46Å; D345-R351 IonicContact OD2-CZ 2.69Å; D345-R351 IonicContact OD2-NE 2.79Å; D345-R351 PolarHBondContact OD2-NE 3.31Å; D345-R351 IonicContact OD2-NH2 3.71Å; F348-R351 PolarHBondContact O-N 3.41Å
352	I	87.3	Confident	87.5	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-89.4	-7.1	-179	70.4	175.1	0	0	0	113.1	V229 F234 Y252 F348 L349	V229-I352 WeakPolarHBondContact CG2-O 3.35Å; F234-I352 HydrophobicContact CE2-CG2 4.36Å; F234-I352 HydrophobicContact CZ-CG2 4.41Å; Y252-I352 HydrophobicContact CD2-CB 4.18Å; Y252-I352 HydrophobicContact CD2-CD1 4.3Å; Y252-I352 HydrophobicContact CD2-CG2 3.77Å; Y252-I352 HydrophobicContact CE2-CB 4.38Å; Y252-I352 HydrophobicContact CE2-CD1 4.18Å; Y252-I352 HydrophobicContact CE2-CG2 4.45Å; Y252-I352 HydrophobicContact CG-CG2 3.97Å; F348-I352 HydrophobicContact CD2-CD1 4.03Å; F348-I352 HydrophobicContact CE2-CD1 4.09Å; F348-I352 WeakPolarHBondContact O-CG1 3.34Å; F348-I352 PolarHBondContact O-N 3.5Å; F348-I352 VanDerWaalsContact O-N 3.09Å; L349-I352 HydrophobicContact CD2-CD1 3.99Å
353	N	89.8	Confident	87.5	Confident	3 Å²	3	35.1 Å²	35.1	2%	0.016	17%	0.168	C	C	.	.	S	Bend	trans	-73.6	148.9	-179.9	-160	48.2	0	0	0	112	S221 S225 L349 W355 V359	S221-N353 VanDerWaalsContact C-OD1 3.3Å; S221-N353 PolarHBondContact O-OD1 3.49Å; S221-N353 VanDerWaalsContact O-OD1 3.12Å; S221-N353 VanDerWaalsContact OG-CG 3.29Å; S221-N353 PolarHBondContact OG-ND2 3.47Å; S221-N353 PolarHBondContact OG-OD1 3.38Å; S225-N353 PolarHBondContact OG-OD1 2.96Å; L349-N353 WeakPolarHBondContact O-CB 3.28Å; L349-N353 PolarHBondContact O-N 3.01Å; N353-W355 PolarHBondContact ND2-O 2.95Å; N353-W355 PolarHBondContact O-N 3.46Å; N353-V359 HydrophobicContact CB-CG2 3.77Å
354	I	88.9	Confident	87.5	Confident	100 Å²	100	37 Å²	37	51%	0.513	17%	0.174	S	C	.	.	S	Bend	trans	-56.5	-42.4	174.6	-67.9	158.3	0	0	0	110.8	I224 S225 A228 V229	I224-I354 HydrophobicContact CG2-CD1 3.82Å; S225-I354 WeakPolarHBondContact OG-CG1 3.46Å; S225-I354 PolarHBondContact OG-N 3.41Å; A228-I354 HydrophobicContact CB-CD1 4.02Å; V229-I354 HydrophobicContact CG2-CG1 3.8Å
355	W	88.1	Confident	87.8	Confident	129 Å²	129	37.5 Å²	37.5	49%	0.489	18%	0.18	S	C	.	.	S	Bend	trans	-130	98.3	175	-168.3	52.3	0	0	0	110.3	N353 P357 F358	N353-W355 PolarHBondContact ND2-O 2.95Å; N353-W355 PolarHBondContact O-N 3.46Å; W355-P357 VanDerWaalsContact C-N 3.29Å; W355-P357 HydrophobicContact CD2-CB 4.11Å; W355-P357 HydrophobicContact CD2-CG 4.05Å; W355-P357 HydrophobicContact CE3-CB 4.16Å; W355-P357 HydrophobicContact CG-CG 4.46Å; W355-P357 HydrophobicContact CH2-CB 4Å; W355-P357 HydrophobicContact CH2-CG 4.46Å; W355-P357 HydrophobicContact CZ2-CB 3.91Å; W355-P357 HydrophobicContact CZ2-CG 3.86Å; W355-P357 HydrophobicContact CZ3-CB 4.12Å; W355-P357 VanDerWaalsContact O-N 3.08Å; W355-F358 HydrophobicContact CB-CD2 4.02Å; W355-F358 HydrophobicContact CB-CE2 4.28Å; W355-F358 HydrophobicContact CD2-CD2 4.43Å; W355-F358 HydrophobicContact CD2-CE2 4.44Å; W355-F358 HydrophobicContact CE3-CB 4.41Å; W355-F358 AromaticContact CE3-CD1 3.54Å; W355-F358 HydrophobicContact CE3-CD1 3.54Å; W355-F358 AromaticContact CE3-CD2 3.59Å; W355-F358 HydrophobicContact CE3-CD2 3.59Å; W355-F358 AromaticContact CE3-CE1 3.52Å; W355-F358 HydrophobicContact CE3-CE1 3.52Å; W355-F358 AromaticContact CE3-CE2 3.56Å; W355-F358 HydrophobicContact CE3-CE2 3.56Å; W355-F358 AromaticContact CE3-CG 3.55Å; W355-F358 HydrophobicContact CE3-CG 3.55Å; W355-F358 AromaticContact CE3-CZ 3.52Å; W355-F358 HydrophobicContact CE3-CZ 3.52Å; W355-F358 AromaticContact CZ3-CD1 3.61Å; W355-F358 HydrophobicContact CZ3-CD1 3.61Å; W355-F358 HydrophobicContact CZ3-CD2 4.46Å; W355-F358 AromaticContact CZ3-CE1 3.42Å; W355-F358 HydrophobicContact CZ3-CE1 3.42Å; W355-F358 VanDerWaalsContact CZ3-CE1 3.42Å; W355-F358 HydrophobicContact CZ3-CE2 4.3Å; W355-F358 HydrophobicContact CZ3-CG 4.12Å; W355-F358 AromaticContact CZ3-CZ 3.79Å; W355-F358 HydrophobicContact CZ3-CZ 3.79Å; W355-F358 PolarHBondContact O-N 2.97Å
356	P	84.3	Confident	88.1	Confident	53 Å²	53	37.3 Å²	37.3	34%	0.344	18%	0.179	S	C	.	.	H	α-helix	trans	-47	-39.2	-174.3	-29.9	35.1	0	0	0	115.9	Q350 F358 V359 T360	Q350-P356 HydrophobicContact CG-CB 3.84Å; Q350-P356 WeakPolarHBondContact O-CB 3.44Å; P356-F358 PolarHBondContact O-N 2.96Å; P356-F358 VanDerWaalsContact O-N 3.15Å; P356-V359 PolarHBondContact O-N 3.48Å; P356-V359 VanDerWaalsContact O-N 3.16Å; P356-T360 PolarHBondContact O-N 3.1Å; P356-T360 PolarHBondContact O-OG1 3.48Å
357	P	88.3	Confident	88.4	Confident	47 Å²	47	36.9 Å²	36.9	31%	0.305	18%	0.177	S	C	.	.	H	α-helix	trans	-57.6	-28.3	179.1	-28.2	37.6	0	0	0	115.4	W355 V359 T360 I361	W355-P357 VanDerWaalsContact C-N 3.29Å; W355-P357 HydrophobicContact CD2-CB 4.11Å; W355-P357 HydrophobicContact CD2-CG 4.05Å; W355-P357 HydrophobicContact CE3-CB 4.16Å; W355-P357 HydrophobicContact CG-CG 4.46Å; W355-P357 HydrophobicContact CH2-CB 4Å; W355-P357 HydrophobicContact CH2-CG 4.46Å; W355-P357 HydrophobicContact CZ2-CB 3.91Å; W355-P357 HydrophobicContact CZ2-CG 3.86Å; W355-P357 HydrophobicContact CZ3-CB 4.12Å; W355-P357 VanDerWaalsContact O-N 3.08Å; P357-V359 VanDerWaalsContact C-N 3.31Å; P357-V359 PolarHBondContact O-N 3.07Å; P357-T360 PolarHBondContact O-N 3.46Å; P357-I361 WeakPolarHBondContact O-CB 3.42Å; P357-I361 WeakPolarHBondContact O-CD1 3.36Å; P357-I361 VanDerWaalsContact O-CG1 3.22Å; P357-I361 WeakPolarHBondContact O-CG1 3.49Å; P357-I361 PolarHBondContact O-N 2.92Å
358	F	89.4	Confident	88.6	Confident	78 Å²	78	38.7 Å²	38.7	34%	0.342	19%	0.185	S	C	.	.	H	α-helix	trans	-61.5	-39	177.9	-80.5	-38	0	0	0	112.6	S218 W355 P356 G362	S218-F358 WeakPolarHBondContact CB-O 3.47Å; S218-F358 PolarHBondContact OG-O 3.05Å; W355-F358 HydrophobicContact CB-CD2 4.02Å; W355-F358 HydrophobicContact CB-CE2 4.28Å; W355-F358 HydrophobicContact CD2-CD2 4.43Å; W355-F358 HydrophobicContact CD2-CE2 4.44Å; W355-F358 HydrophobicContact CE3-CB 4.41Å; W355-F358 AromaticContact CE3-CD1 3.54Å; W355-F358 HydrophobicContact CE3-CD1 3.54Å; W355-F358 AromaticContact CE3-CD2 3.59Å; W355-F358 HydrophobicContact CE3-CD2 3.59Å; W355-F358 AromaticContact CE3-CE1 3.52Å; W355-F358 HydrophobicContact CE3-CE1 3.52Å; W355-F358 AromaticContact CE3-CE2 3.56Å; W355-F358 HydrophobicContact CE3-CE2 3.56Å; W355-F358 AromaticContact CE3-CG 3.55Å; W355-F358 HydrophobicContact CE3-CG 3.55Å; W355-F358 AromaticContact CE3-CZ 3.52Å; W355-F358 HydrophobicContact CE3-CZ 3.52Å; W355-F358 AromaticContact CZ3-CD1 3.61Å; W355-F358 HydrophobicContact CZ3-CD1 3.61Å; W355-F358 HydrophobicContact CZ3-CD2 4.46Å; W355-F358 AromaticContact CZ3-CE1 3.42Å; W355-F358 HydrophobicContact CZ3-CE1 3.42Å; W355-F358 VanDerWaalsContact CZ3-CE1 3.42Å; W355-F358 HydrophobicContact CZ3-CE2 4.3Å; W355-F358 HydrophobicContact CZ3-CG 4.12Å; W355-F358 AromaticContact CZ3-CZ 3.79Å; W355-F358 HydrophobicContact CZ3-CZ 3.79Å; W355-F358 PolarHBondContact O-N 2.97Å; P356-F358 PolarHBondContact O-N 2.96Å; P356-F358 VanDerWaalsContact O-N 3.15Å; F358-G362 PolarHBondContact O-N 3.24Å
359	V	88.2	Confident	88.7	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-72.1	-42.5	179.3	178.7	0	0	0	0	109.9	F70 S218 V222 L349 Q350 N353 P356 P357 I361 G362 I363	F70-V359 HydrophobicContact CD1-CG1 4.1Å; S218-V359 WeakPolarHBondContact OG-CA 3.32Å; V222-V359 HydrophobicContact CG2-CG2 3.75Å; L349-V359 HydrophobicContact CB-CG1 4.1Å; Q350-V359 HydrophobicContact CB-CB 4.38Å; Q350-V359 HydrophobicContact CB-CG1 4.32Å; N353-V359 HydrophobicContact CB-CG2 3.77Å; P356-V359 PolarHBondContact O-N 3.48Å; P356-V359 VanDerWaalsContact O-N 3.16Å; P357-V359 VanDerWaalsContact C-N 3.31Å; P357-V359 PolarHBondContact O-N 3.07Å; V359-I361 PolarHBondContact O-N 3.49Å; V359-G362 WeakPolarHBondContact O-CA 3.49Å; V359-G362 PolarHBondContact O-N 2.69Å; V359-G362 VanDerWaalsContact O-N 3.15Å; V359-I363 HydrophobicContact CG1-CD1 3.86Å; V359-I363 HydrophobicContact CG1-CG1 4.38Å; V359-I363 VanDerWaalsContact O-CG1 3.29Å; V359-I363 WeakPolarHBondContact O-CG1 3.41Å; V359-I363 PolarHBondContact O-N 2.94Å
360	T	88	Confident	88.8	Confident	16 Å²	16	38.5 Å²	38.5	10%	0.098	18%	0.184	C	C	.	.	H	α-helix	trans	-60.6	-45.5	176.6	-45.7	0	0	0	0	112.2	V159 Q350 P356 P357 G362 I363 Y364	V159-T360 HydrophobicContact CG2-CG2 4.24Å; Q350-T360 VanDerWaalsContact CD-OG1 3.23Å; Q350-T360 PolarHBondContact NE2-OG1 3.46Å; P356-T360 PolarHBondContact O-N 3.1Å; P356-T360 PolarHBondContact O-OG1 3.48Å; P357-T360 PolarHBondContact O-N 3.46Å; T360-G362 VanDerWaalsContact C-N 3.32Å; T360-G362 PolarHBondContact O-N 2.91Å; T360-I363 PolarHBondContact O-N 2.89Å; T360-Y364 HydrophobicContact CG2-CD2 4.27Å; T360-Y364 HydrophobicContact CG2-CE1 4.12Å; T360-Y364 HydrophobicContact CG2-CE2 3.6Å; T360-Y364 VanDerWaalsContact O-CG 3.31Å; T360-Y364 PolarHBondContact O-N 2.87Å
361	I	90.6	Very high	89	Confident	74 Å²	74	36.6 Å²	36.6	38%	0.379	18%	0.175	S	C	.	.	H	α-helix	trans	-62.4	-42.5	174.9	-66.7	165.2	0	0	0	110.2	V214 P357 V359 Y364 C365	V214-I361 HydrophobicContact CG1-CG2 3.55Å; P357-I361 WeakPolarHBondContact O-CB 3.42Å; P357-I361 WeakPolarHBondContact O-CD1 3.36Å; P357-I361 VanDerWaalsContact O-CG1 3.22Å; P357-I361 WeakPolarHBondContact O-CG1 3.49Å; P357-I361 PolarHBondContact O-N 2.92Å; V359-I361 PolarHBondContact O-N 3.49Å; I361-Y364 PolarHBondContact O-N 2.96Å; I361-C365 WeakPolarHBondContact O-CB 3.39Å; I361-C365 PolarHBondContact O-N 3.38Å; I361-C365 PolarHBondContact O-SG 3.41Å; I361-C365 VanDerWaalsContact O-SG 3.35Å
362	G	90.9	Very high	89.3	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.7	-47.1	175.9	0	0	0	0	0	112.8	F358 V359 T360 A366	F358-G362 PolarHBondContact O-N 3.24Å; V359-G362 WeakPolarHBondContact O-CA 3.49Å; V359-G362 PolarHBondContact O-N 2.69Å; V359-G362 VanDerWaalsContact O-N 3.15Å; T360-G362 VanDerWaalsContact C-N 3.32Å; T360-G362 PolarHBondContact O-N 2.91Å; G362-A366 WeakPolarHBondContact O-CB 3.32Å; G362-A366 PolarHBondContact O-N 3.35Å
363	I	89.3	Confident	89.3	Confident	7 Å²	7	30.9 Å²	30.9	4%	0.036	16%	0.155	C	C	.	.	H	α-helix	trans	-57.4	-50.6	175.9	-70.9	161.3	0	0	0	110.5	I67 F70 L71 A155 V359 T360 S367	I67-I363 HydrophobicContact CD1-CG2 4.09Å; I67-I363 HydrophobicContact CG1-CG2 4.07Å; F70-I363 HydrophobicContact CB-CD1 4.06Å; F70-I363 HydrophobicContact CB-CG1 3.41Å; F70-I363 VanDerWaalsContact CB-CG1 3.41Å; F70-I363 HydrophobicContact CD2-CG1 4.11Å; F70-I363 HydrophobicContact CG-CG1 3.82Å; L71-I363 HydrophobicContact CD1-CG2 4.42Å; L71-I363 HydrophobicContact CD2-CD1 3.82Å; L71-I363 HydrophobicContact CG-CD1 4.23Å; A155-I363 HydrophobicContact CB-CG2 3.67Å; V359-I363 HydrophobicContact CG1-CD1 3.86Å; V359-I363 HydrophobicContact CG1-CG1 4.38Å; V359-I363 VanDerWaalsContact O-CG1 3.29Å; V359-I363 WeakPolarHBondContact O-CG1 3.41Å; V359-I363 PolarHBondContact O-N 2.94Å; T360-I363 PolarHBondContact O-N 2.89Å; I363-S367 WeakPolarHBondContact O-CB 3.26Å; I363-S367 PolarHBondContact O-N 3.44Å
364	Y	90.9	Very high	89.3	Confident	54 Å²	54	30.8 Å²	30.8	21%	0.212	15%	0.154	C	C	.	.	H	α-helix	trans	-65.1	-45.9	-177.2	-63.8	-13	0	0	0	112.2	L152 A155 V156 F160 T360 I361 L368	L152-Y364 HydrophobicContact CD1-CD1 3.44Å; L152-Y364 VanDerWaalsContact CD1-CD1 3.44Å; L152-Y364 HydrophobicContact CD1-CE1 4.24Å; L152-Y364 HydrophobicContact CD1-CG 4.03Å; A155-Y364 HydrophobicContact CB-CE1 4Å; V156-Y364 HydrophobicContact CG2-CD1 4.29Å; V156-Y364 HydrophobicContact CG2-CE1 3.66Å; V156-Y364 HydrophobicContact CG2-CE2 4.49Å; F160-Y364 HydrophobicContact CE2-CE2 4.38Å; T360-Y364 HydrophobicContact CG2-CD2 4.27Å; T360-Y364 HydrophobicContact CG2-CE1 4.12Å; T360-Y364 HydrophobicContact CG2-CE2 3.6Å; T360-Y364 VanDerWaalsContact O-CG 3.31Å; T360-Y364 PolarHBondContact O-N 2.87Å; I361-Y364 PolarHBondContact O-N 2.96Å; Y364-L368 WeakPolarHBondContact O-CB 3.27Å; Y364-L368 PolarHBondContact O-N 3.37Å
365	C	91	Very high	89.4	Confident	32 Å²	32	26.1 Å²	26.1	22%	0.216	13%	0.131	C	C	.	.	H	α-helix	trans	-65.7	-43	178.6	-71.6	0	0	0	0	112.3	I211 V214 V215 I361 S369	I211-C365 HydrophobicContact CG2-CB 3.91Å; I211-C365 WeakPolarHBondContact CG2-O 3.31Å; V214-C365 HydrophobicContact CG1-CB 4.36Å; V215-C365 HydrophobicContact CG2-CB 4.28Å; I361-C365 WeakPolarHBondContact O-CB 3.39Å; I361-C365 PolarHBondContact O-N 3.38Å; I361-C365 PolarHBondContact O-SG 3.41Å; I361-C365 VanDerWaalsContact O-SG 3.35Å; C365-S369 VanDerWaalsContact O-CB 3.25Å; C365-S369 WeakPolarHBondContact O-CB 3.34Å; C365-S369 PolarHBondContact O-N 3.42Å
366	A	89.7	Confident	89.5	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63	-49.3	178.5	0	0	0	0	0	111.7	F70 V215 G362 S369 A370	F70-A366 HydrophobicContact CE2-CB 4.25Å; V215-A366 HydrophobicContact CG2-CB 4.01Å; G362-A366 WeakPolarHBondContact O-CB 3.32Å; G362-A366 PolarHBondContact O-N 3.35Å; A366-S369 PolarHBondContact O-N 2.94Å; A366-A370 WeakPolarHBondContact O-CB 3.44Å; A366-A370 PolarHBondContact O-N 3.42Å
367	S	89.8	Confident	89.6	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-65.9	-43.8	-178.7	-148.5	0	0	0	0	112.2	Y148 I363 S369 A370 A371	Y148-S367 PolarHBondContact O-OG 3.06Å; I363-S367 WeakPolarHBondContact O-CB 3.26Å; I363-S367 PolarHBondContact O-N 3.44Å; S367-S369 VanDerWaalsContact C-N 3.34Å; S367-S369 PolarHBondContact O-N 2.7Å; S367-A370 PolarHBondContact O-N 3.5Å; S367-A371 WeakPolarHBondContact O-CB 3.33Å; S367-A371 PolarHBondContact O-N 3.13Å
368	L	90.2	Very high	89.8	Confident	42 Å²	42	16.2 Å²	16.2	22%	0.22	8%	0.083	C	C	.	.	H	α-helix	trans	-62.2	-42.7	177.3	-173.7	69.1	0	0	0	111.2	L152 V189 L192 C193 Y364 A371 M372	L152-L368 HydrophobicContact CD2-CB 4.16Å; L152-L368 HydrophobicContact CD2-CD1 4.33Å; V189-L368 HydrophobicContact CG1-CD1 4.37Å; L192-L368 HydrophobicContact CD2-CD1 3.84Å; L192-L368 HydrophobicContact CD2-CD2 4.19Å; C193-L368 VanDerWaalsContact SG-CD1 3.53Å; Y364-L368 WeakPolarHBondContact O-CB 3.27Å; Y364-L368 PolarHBondContact O-N 3.37Å; L368-A371 PolarHBondContact O-N 3.08Å; L368-M372 HydrophobicContact CD2-CE 4.48Å; L368-M372 HydrophobicContact CG-CE 4.05Å; L368-M372 WeakPolarHBondContact O-CG 3.46Å; L368-M372 PolarHBondContact O-N 2.98Å
369	S	89.7	Confident	89.8	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-64.2	-42.8	177.3	-171.6	0	0	0	0	112.5	C365 A366 S367 M372 C373	C365-S369 VanDerWaalsContact O-CB 3.25Å; C365-S369 WeakPolarHBondContact O-CB 3.34Å; C365-S369 PolarHBondContact O-N 3.42Å; A366-S369 PolarHBondContact O-N 2.94Å; S367-S369 VanDerWaalsContact C-N 3.34Å; S367-S369 PolarHBondContact O-N 2.7Å; S369-M372 PolarHBondContact O-N 3.37Å; S369-C373 VanDerWaalsContact O-CB 3.3Å; S369-C373 WeakPolarHBondContact O-CB 3.32Å; S369-C373 PolarHBondContact O-N 2.55Å
370	A	89.5	Confident	89.8	Confident	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-64	-41.5	178.5	0	0	0	0	0	111.6	Y148 A366 S367 C373 A374	Y148-A370 HydrophobicContact CD1-CB 4.28Å; Y148-A370 VanDerWaalsContact CD2-C 3.45Å; Y148-A370 HydrophobicContact CD2-CB 3.59Å; Y148-A370 HydrophobicContact CE1-CB 4.41Å; Y148-A370 HydrophobicContact CE2-CB 3.73Å; Y148-A370 HydrophobicContact CG-CB 3.88Å; A366-A370 WeakPolarHBondContact O-CB 3.44Å; A366-A370 PolarHBondContact O-N 3.42Å; S367-A370 PolarHBondContact O-N 3.5Å; A370-C373 PolarHBondContact O-N 3.32Å; A370-A374 WeakPolarHBondContact O-CB 3.34Å; A370-A374 PolarHBondContact O-N 3.47Å
371	A	91.3	Very high	89.8	Confident	1 Å²	1	14.3 Å²	14.3	1%	0.008	7%	0.072	C	C	.	.	H	α-helix	trans	-61.6	-48.8	174.5	0	0	0	0	0	112.2	V149 S367 L368 C373 A374 M375	V149-A371 HydrophobicContact CG2-CB 3.88Å; S367-A371 WeakPolarHBondContact O-CB 3.33Å; S367-A371 PolarHBondContact O-N 3.13Å; L368-A371 PolarHBondContact O-N 3.08Å; A371-C373 VanDerWaalsContact C-N 3.34Å; A371-C373 PolarHBondContact O-N 3.22Å; A371-A374 PolarHBondContact O-N 3Å; A371-M375 PolarHBondContact O-N 3.43Å
372	M	89.9	Confident	89.8	Confident	4 Å²	4	11.1 Å²	11.1	2%	0.02	6%	0.056	C	C	.	.	H	α-helix	trans	-60.5	-42.8	176.3	-70.5	-175	-62.9	0	0	111.9	C193 V196 Y204 I211 L368 S369 A374 M375 I376	C193-M372 HydrophobicContact CB-CG 4.18Å; V196-M372 HydrophobicContact CB-SD 4.04Å; V196-M372 HydrophobicContact CG1-SD 3.69Å; V196-M372 HydrophobicContact CG2-SD 4.46Å; Y204-M372 HydrophobicContact CD2-CB 4.43Å; Y204-M372 HydrophobicContact CE2-CB 4.13Å; I211-M372 HydrophobicContact CD1-CE 3.96Å; L368-M372 HydrophobicContact CD2-CE 4.48Å; L368-M372 HydrophobicContact CG-CE 4.05Å; L368-M372 WeakPolarHBondContact O-CG 3.46Å; L368-M372 PolarHBondContact O-N 2.98Å; S369-M372 PolarHBondContact O-N 3.37Å; M372-A374 PolarHBondContact O-N 3.5Å; M372-M375 PolarHBondContact O-N 3.46Å; M372-I376 WeakPolarHBondContact O-CB 3.43Å; M372-I376 WeakPolarHBondContact O-CG1 3.19Å; M372-I376 PolarHBondContact O-N 3.33Å
373	C	88.4	Confident	89.7	Confident	8 Å²	8	12.4 Å²	12.4	5%	0.054	6%	0.062	C	C	.	.	H	α-helix	trans	-62.4	-42.9	177.5	-172.5	0	0	0	0	112	Y204 A296 S369 A370 A371 G377	Y204-C373 VanDerWaalsContact OH-CB 3.27Å; Y204-C373 WeakPolarHBondContact OH-CB 3.45Å; A296-C373 VanDerWaalsContact CB-SG 3.57Å; S369-C373 VanDerWaalsContact O-CB 3.3Å; S369-C373 WeakPolarHBondContact O-CB 3.32Å; S369-C373 PolarHBondContact O-N 2.55Å; A370-C373 PolarHBondContact O-N 3.32Å; A371-C373 VanDerWaalsContact C-N 3.34Å; A371-C373 PolarHBondContact O-N 3.22Å; C373-G377 PolarHBondContact O-N 3.35Å
374	A	90.1	Very high	89.5	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-63.1	-43.7	177.8	0	0	0	0	0	111.7	K141 C145 Y148 A370 A371 M372 G377 A378	K141-A374 HydrophobicContact CD-CB 4.35Å; C145-A374 HydrophobicContact CB-CB 3.96Å; Y148-A374 HydrophobicContact CD2-CB 4.44Å; Y148-A374 HydrophobicContact CE2-CB 4.42Å; A370-A374 WeakPolarHBondContact O-CB 3.34Å; A370-A374 PolarHBondContact O-N 3.47Å; A371-A374 PolarHBondContact O-N 3Å; M372-A374 PolarHBondContact O-N 3.5Å; A374-G377 PolarHBondContact O-N 3.41Å; A374-A378 WeakPolarHBondContact O-CB 3.33Å; A374-A378 PolarHBondContact O-N 2.99Å
375	M	90.9	Very high	89.2	Confident	3 Å²	3	9.9 Å²	9.9	2%	0.015	5%	0.053	C	C	.	.	H	α-helix	trans	-68.9	-44	179	-172.3	160.9	59.6	0	0	113.2	C193 C197 A371 M372 G377 A378 S379 W415	C193-M375 HydrophobicContact CB-CE 3.48Å; C193-M375 VanDerWaalsContact CB-CE 3.48Å; C193-M375 VanDerWaalsContact O-CE 3.24Å; C193-M375 WeakPolarHBondContact O-CE 3.27Å; C197-M375 HydrophobicContact CB-CE 3.91Å; C197-M375 WeakPolarHBondContact SG-CE 3.09Å; A371-M375 PolarHBondContact O-N 3.43Å; M372-M375 PolarHBondContact O-N 3.46Å; M375-G377 VanDerWaalsContact C-N 3.33Å; M375-G377 PolarHBondContact O-N 3.3Å; M375-A378 PolarHBondContact O-N 3.39Å; M375-S379 WeakPolarHBondContact O-CB 3.35Å; M375-S379 PolarHBondContact O-N 2.94Å; M375-S379 PolarHBondContact O-OG 2.67Å; M375-W415 HydrophobicContact SD-CB 4.27Å
376	I	88.6	Confident	89.1	Confident	15 Å²	15	8.5 Å²	8.5	8%	0.077	4%	0.044	C	C	.	.	H	α-helix	trans	-62.2	-44.1	173.7	-66.9	170	0	0	0	109.9	C197 Y204 M372 S379 R380	C197-I376 HydrophobicContact CB-CG1 4.05Å; C197-I376 VanDerWaalsContact SG-CG1 3.52Å; Y204-I376 HydrophobicContact CD1-CD1 3.91Å; Y204-I376 HydrophobicContact CD2-CD1 3.5Å; Y204-I376 VanDerWaalsContact CD2-CD1 3.5Å; Y204-I376 HydrophobicContact CE1-CD1 4.37Å; Y204-I376 HydrophobicContact CE2-CD1 3.99Å; Y204-I376 HydrophobicContact CG-CD1 3.45Å; Y204-I376 VanDerWaalsContact CG-CD1 3.45Å; M372-I376 WeakPolarHBondContact O-CB 3.43Å; M372-I376 WeakPolarHBondContact O-CG1 3.19Å; M372-I376 PolarHBondContact O-N 3.33Å; I376-S379 WeakPolarHBondContact CA-OG 3.19Å; I376-S379 PolarHBondContact O-N 3.47Å; I376-S379 PolarHBondContact O-OG 3.4Å; I376-R380 HydrophobicContact CG2-CG 4.45Å; I376-R380 VanDerWaalsContact O-CG 3.25Å; I376-R380 WeakPolarHBondContact O-CG 3.44Å; I376-R380 PolarHBondContact O-N 3.29Å; I376-R380 VanDerWaalsContact O-N 3.16Å
377	G	88.1	Confident	88.8	Confident	5 Å²	5	12.8 Å²	12.8	5%	0.052	7%	0.066	C	C	.	.	H	α-helix	trans	-59.3	-48	176.3	0	0	0	0	0	112.8	C373 A374 M375 I381	C373-G377 PolarHBondContact O-N 3.35Å; A374-G377 PolarHBondContact O-N 3.41Å; M375-G377 VanDerWaalsContact C-N 3.33Å; M375-G377 PolarHBondContact O-N 3.3Å; G377-I381 VanDerWaalsContact O-CG1 3.32Å; G377-I381 WeakPolarHBondContact O-CG1 3.44Å; G377-I381 PolarHBondContact O-N 3.36Å
378	A	90.4	Very high	88.3	Confident	1 Å²	1	14.5 Å²	14.5	1%	0.008	8%	0.076	C	C	.	.	H	α-helix	trans	-61.1	-46.5	178.7	0	0	0	0	0	111.8	F138 K141 V142 A374 M375 R380 I381 L382 T414	F138-A378 HydrophobicContact CD2-CB 4.01Å; F138-A378 WeakPolarHBondContact CD2-O 3.32Å; F138-A378 HydrophobicContact CE2-CB 4.23Å; K141-A378 HydrophobicContact CB-CB 3.73Å; V142-A378 HydrophobicContact CG2-CB 4.24Å; A374-A378 WeakPolarHBondContact O-CB 3.33Å; A374-A378 PolarHBondContact O-N 2.99Å; M375-A378 PolarHBondContact O-N 3.39Å; A378-R380 VanDerWaalsContact C-N 3.33Å; A378-R380 PolarHBondContact O-N 3.02Å; A378-I381 PolarHBondContact O-N 2.81Å; A378-L382 WeakPolarHBondContact O-CB 3.37Å; A378-L382 PolarHBondContact O-N 2.87Å; A378-T414 HydrophobicContact CB-CG2 3.51Å
379	S	90.4	Very high	87.8	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.007	9%	0.093	C	C	.	.	H	α-helix	trans	-65.6	-36	-176	55.8	0	0	0	0	112.4	M375 I376 L382 H383 A410	M375-S379 WeakPolarHBondContact O-CB 3.35Å; M375-S379 PolarHBondContact O-N 2.94Å; M375-S379 PolarHBondContact O-OG 2.67Å; I376-S379 WeakPolarHBondContact CA-OG 3.19Å; I376-S379 PolarHBondContact O-N 3.47Å; I376-S379 PolarHBondContact O-OG 3.4Å; S379-L382 PolarHBondContact O-N 2.96Å; S379-H383 VanDerWaalsContact O-CB 3.29Å; S379-H383 WeakPolarHBondContact O-CB 3.35Å; S379-H383 PolarHBondContact O-N 3.47Å; S379-A410 WeakPolarHBondContact O-CB 3.45Å
380	R	87.4	Confident	87.1	Confident	47 Å²	47	18.7 Å²	18.7	18%	0.177	9%	0.094	C	C	.	.	H	α-helix	trans	-69.2	-38.5	175.2	-63.6	-64.9	177.1	163.4	2.9	112.4	E303 I376 A378 A384 G405 N406	E303-R380 IonicContact OE1-NH2 3.77Å; I376-R380 HydrophobicContact CG2-CG 4.45Å; I376-R380 VanDerWaalsContact O-CG 3.25Å; I376-R380 WeakPolarHBondContact O-CG 3.44Å; I376-R380 PolarHBondContact O-N 3.29Å; I376-R380 VanDerWaalsContact O-N 3.16Å; A378-R380 VanDerWaalsContact C-N 3.33Å; A378-R380 PolarHBondContact O-N 3.02Å; R380-A384 WeakPolarHBondContact O-CB 2.91Å; R380-A384 PolarHBondContact O-N 3.36Å; R380-G405 PolarHBondContact NH1-O 3.07Å; R380-N406 PolarHBondContact NH2-OD1 3.36Å
381	I	88.9	Confident	86.5	Confident	7 Å²	7	19.9 Å²	19.9	4%	0.036	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-47.1	173.2	-67.1	165.7	0	0	0	110	G134 F137 F138 G377 A378 H383 A384 L385	G134-I381 WeakPolarHBondContact O-CG2 3.27Å; F137-I381 HydrophobicContact CB-CD1 4.09Å; F138-I381 HydrophobicContact CB-CG2 4.01Å; G377-I381 VanDerWaalsContact O-CG1 3.32Å; G377-I381 WeakPolarHBondContact O-CG1 3.44Å; G377-I381 PolarHBondContact O-N 3.36Å; A378-I381 PolarHBondContact O-N 2.81Å; I381-H383 PolarHBondContact O-N 3.2Å; I381-A384 PolarHBondContact O-N 3.2Å; I381-L385 HydrophobicContact CG2-CD1 3.88Å; I381-L385 HydrophobicContact CG2-CG 4.5Å; I381-L385 WeakPolarHBondContact O-CG 3.43Å; I381-L385 PolarHBondContact O-N 3.42Å
382	L	89.8	Confident	85.8	Confident	6 Å²	6	21.1 Å²	21.1	3%	0.031	11%	0.112	C	C	.	.	H	α-helix	trans	-62.3	-42.4	179.2	-173.5	65.3	0	0	0	112.4	F138 A378 S379 L385 A386 L395 A398 A410 Y413	F138-L382 HydrophobicContact CD2-CB 3.81Å; F138-L382 HydrophobicContact CD2-CD1 4.35Å; F138-L382 HydrophobicContact CE1-CD1 4.34Å; F138-L382 HydrophobicContact CE2-CB 3.6Å; F138-L382 HydrophobicContact CE2-CD1 3.96Å; F138-L382 HydrophobicContact CE2-CD2 3.73Å; F138-L382 HydrophobicContact CE2-CG 3.96Å; F138-L382 HydrophobicContact CZ-CB 4.4Å; F138-L382 HydrophobicContact CZ-CD1 3.95Å; F138-L382 HydrophobicContact CZ-CD2 3.86Å; F138-L382 HydrophobicContact CZ-CG 4.29Å; A378-L382 WeakPolarHBondContact O-CB 3.37Å; A378-L382 PolarHBondContact O-N 2.87Å; S379-L382 PolarHBondContact O-N 2.96Å; L382-L385 PolarHBondContact O-N 2.91Å; L382-A386 WeakPolarHBondContact O-CB 3.24Å; L382-A386 PolarHBondContact O-N 3.41Å; L382-L395 HydrophobicContact CD1-CD2 3.66Å; L382-L395 HydrophobicContact CD1-CG 4.03Å; L382-A398 HydrophobicContact CD2-CB 4.4Å; L382-A398 HydrophobicContact CG-CB 4.3Å; L382-A410 HydrophobicContact CB-CB 4.47Å; L382-A410 HydrophobicContact CD2-CB 4.32Å; L382-Y413 HydrophobicContact CD2-CG 4.29Å
383	H	88.9	Confident	85	Confident	28 Å²	28	28.4 Å²	28.4	13%	0.13	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-45.1	176	178.1	63.2	0	0	0	111.5	S379 I381 A386 L387 A398 T399 P407 A410	S379-H383 VanDerWaalsContact O-CB 3.29Å; S379-H383 WeakPolarHBondContact O-CB 3.35Å; S379-H383 PolarHBondContact O-N 3.47Å; I381-H383 PolarHBondContact O-N 3.2Å; H383-A386 PolarHBondContact O-N 3.12Å; H383-L387 WeakPolarHBondContact O-CG 2.76Å; H383-L387 PolarHBondContact O-N 3.29Å; H383-A398 PolarHBondContact ND1-O 3.1Å; H383-T399 PolarHBondContact CE1-O 3.01Å; H383-T399 VanDerWaalsContact CE1-O 3.31Å; H383-P407 HydrophobicContact CB-CB 3.8Å; H383-P407 HydrophobicContact CB-CG 3.99Å; H383-A410 HydrophobicContact CB-CB 4.09Å
384	A	84.9	Confident	84.6	Confident	7 Å²	7	31.9 Å²	31.9	6%	0.058	17%	0.173	C	C	.	.	H	α-helix	trans	-67.2	-37.3	178.4	0	0	0	0	0	112.5	Y118 R380 I381 A386 L387 D388	Y118-A384 HydrophobicContact CD1-CB 3.47Å; Y118-A384 VanDerWaalsContact CD1-CB 3.47Å; Y118-A384 HydrophobicContact CE1-CB 4Å; R380-A384 WeakPolarHBondContact O-CB 2.91Å; R380-A384 PolarHBondContact O-N 3.36Å; I381-A384 PolarHBondContact O-N 3.2Å; A384-A386 VanDerWaalsContact C-N 3.32Å; A384-A386 PolarHBondContact O-N 3.17Å; A384-L387 PolarHBondContact O-N 3.39Å; A384-D388 PolarHBondContact O-N 3.38Å
385	L	86.3	Confident	84.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-39.3	170.7	-79	163.4	0	0	0	112.2	Y118 L135 I381 L382 D388 L390 F391 L395	Y118-L385 HydrophobicContact CD1-CG 4.45Å; Y118-L385 HydrophobicContact CD2-CD2 3.92Å; Y118-L385 HydrophobicContact CD2-CG 4.13Å; Y118-L385 HydrophobicContact CE1-CD2 4.25Å; Y118-L385 HydrophobicContact CE1-CG 4.23Å; Y118-L385 HydrophobicContact CE2-CD2 3.25Å; Y118-L385 HydrophobicContact CE2-CG 3.85Å; Y118-L385 HydrophobicContact CG-CG 4.39Å; Y118-L385 VanDerWaalsContact CZ-CD2 3.45Å; L135-L385 HydrophobicContact CD1-CD1 4.49Å; I381-L385 HydrophobicContact CG2-CD1 3.88Å; I381-L385 HydrophobicContact CG2-CG 4.5Å; I381-L385 WeakPolarHBondContact O-CG 3.43Å; I381-L385 PolarHBondContact O-N 3.42Å; L382-L385 PolarHBondContact O-N 2.91Å; L385-D388 PolarHBondContact O-N 2.94Å; L385-L390 HydrophobicContact CD2-CD1 4.37Å; L385-F391 HydrophobicContact CD2-CE2 4.5Å; L385-L395 HydrophobicContact CB-CD2 4.38Å
386	A	87.1	Confident	83.8	Confident	3 Å²	3	35.1 Å²	35.1	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-70	-35.4	179.8	0	0	0	0	0	112.7	L382 H383 A384 D388 H389 L395 A398 T399	L382-A386 WeakPolarHBondContact O-CB 3.24Å; L382-A386 PolarHBondContact O-N 3.41Å; H383-A386 PolarHBondContact O-N 3.12Å; A384-A386 VanDerWaalsContact C-N 3.32Å; A384-A386 PolarHBondContact O-N 3.17Å; A386-D388 VanDerWaalsContact C-N 3.26Å; A386-D388 PolarHBondContact O-N 3.05Å; A386-H389 PolarHBondContact O-N 3.5Å; A386-H389 VanDerWaalsContact O-N 3.12Å; A386-L395 HydrophobicContact CB-CB 4.26Å; A386-L395 WeakPolarHBondContact CB-O 3.37Å; A386-A398 HydrophobicContact CB-CB 3.91Å; A386-T399 HydrophobicContact CB-CG2 3.75Å
387	L	83.6	Confident	83.7	Confident	91 Å²	91	37.1 Å²	37.1	48%	0.476	21%	0.209	S	C	.	.	H	α-helix	trans	-65.3	-28.6	175.2	-72.8	174.3	0	0	0	113.1	H383 A384 H389 T399	H383-L387 WeakPolarHBondContact O-CG 2.76Å; H383-L387 PolarHBondContact O-N 3.29Å; A384-L387 PolarHBondContact O-N 3.39Å; L387-H389 PolarHBondContact O-CD2 3Å; L387-H389 PolarHBondContact O-N 3.29Å; L387-T399 HydrophobicContact CD2-CG2 4.25Å
388	D	79.1	Confident	83.5	Confident	36 Å²	36	36.9 Å²	36.9	19%	0.193	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	1.2	175.8	-74.9	-21.5	0	0	0	112.4	Y118 R123 A384 L385 A386 L390	Y118-D388 WeakPolarHBondContact CE1-OD2 3.48Å; Y118-D388 VanDerWaalsContact CZ-OD2 3.26Å; Y118-D388 PolarHBondContact OH-OD2 3.27Å; R123-D388 IonicContact CZ-OD1 3.03Å; R123-D388 IonicContact NH2-OD1 3.59Å; R123-D388 PolarHBondContact NH2-OD1 2.84Å; A384-D388 PolarHBondContact O-N 3.38Å; L385-D388 PolarHBondContact O-N 2.94Å; A386-D388 VanDerWaalsContact C-N 3.26Å; A386-D388 PolarHBondContact O-N 3.05Å; D388-L390 HydrophobicContact CB-CD1 3.48Å; D388-L390 VanDerWaalsContact CB-CD1 3.48Å; D388-L390 HydrophobicContact CB-CG 4.17Å; D388-L390 PolarHBondContact O-N 3.3Å
389	H	80.3	Confident	83.3	Confident	126 Å²	126	38.9 Å²	38.9	58%	0.583	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	13.9	176.8	-63.6	-64.4	0	0	0	116.5	A386 L387 F391 G392	A386-H389 PolarHBondContact O-N 3.5Å; A386-H389 VanDerWaalsContact O-N 3.12Å; L387-H389 PolarHBondContact O-CD2 3Å; L387-H389 PolarHBondContact O-N 3.29Å; H389-F391 VanDerWaalsContact C-N 3.29Å; H389-F391 PolarHBondContact O-N 3.46Å; H389-G392 PolarHBondContact O-N 3.49Å
390	L	75.1	Confident	83.1	Confident	3 Å²	3	42 Å²	42	2%	0.016	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-38.2	-175.8	-75.9	137.3	0	0	0	114.4	Y118 P127 L385 D388 L505	Y118-L390 VanDerWaalsContact OH-CD1 3.25Å; Y118-L390 WeakPolarHBondContact OH-CD1 3.46Å; P127-L390 HydrophobicContact CB-CD2 3.86Å; P127-L390 WeakPolarHBondContact O-CD2 3.27Å; L385-L390 HydrophobicContact CD2-CD1 4.37Å; D388-L390 HydrophobicContact CB-CD1 3.48Å; D388-L390 VanDerWaalsContact CB-CD1 3.48Å; D388-L390 HydrophobicContact CB-CG 4.17Å; D388-L390 PolarHBondContact O-N 3.3Å; L390-L505 HydrophobicContact CB-CD2 4.04Å; L390-L505 HydrophobicContact CD2-CD1 4.19Å; L390-L505 HydrophobicContact CD2-CD2 3.85Å
391	F	76.4	Confident	83.1	Confident	25 Å²	25	43 Å²	43	11%	0.11	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	0.8	-174.5	-67.1	-84.4	0	0	0	113.4	L135 L385 H389 P394 L395 F504 L505	L135-F391 HydrophobicContact CD2-CE1 4.36Å; L135-F391 HydrophobicContact CD2-CZ 3.93Å; L385-F391 HydrophobicContact CD2-CE2 4.5Å; H389-F391 VanDerWaalsContact C-N 3.29Å; H389-F391 PolarHBondContact O-N 3.46Å; F391-P394 WeakPolarHBondContact O-CD 3.33Å; F391-P394 VanDerWaalsContact O-CG 3.25Å; F391-P394 WeakPolarHBondContact O-CG 3.39Å; F391-L395 HydrophobicContact CB-CB 4.25Å; F391-L395 HydrophobicContact CB-CD1 4.27Å; F391-L395 HydrophobicContact CB-CD2 4.27Å; F391-L395 HydrophobicContact CD2-CD2 3.98Å; F391-L395 HydrophobicContact CG-CD2 4.37Å; F391-F504 AromaticContact CD1-CE1 3.85Å; F391-F504 HydrophobicContact CD1-CE1 3.85Å; F391-F504 HydrophobicContact CE1-CD1 4.17Å; F391-F504 AromaticContact CE1-CE1 3.85Å; F391-F504 HydrophobicContact CE1-CE1 3.85Å; F391-L505 HydrophobicContact CE1-CD2 3.99Å; F391-L505 HydrophobicContact CE2-CD1 4.42Å; F391-L505 HydrophobicContact CE2-CD2 4.16Å; F391-L505 HydrophobicContact CZ-CD1 4.03Å; F391-L505 HydrophobicContact CZ-CD2 3.79Å; F391-L505 HydrophobicContact CZ-CG 4.18Å
392	G	76.2	Confident	82.9	Confident	27 Å²	27	45.1 Å²	45.1	28%	0.278	27%	0.265	S	S	.	.			trans	61.7	-140.3	179	0	0	0	0	0	115.1	H389 P394 L395 A396	H389-G392 PolarHBondContact O-N 3.49Å; G392-P394 VanDerWaalsContact C-CD 3.5Å; G392-L395 PolarHBondContact O-N 2.91Å; G392-A396 PolarHBondContact O-N 2.92Å; G392-A396 VanDerWaalsContact O-N 3.15Å
393	L	73.4	Confident	82.2	Confident	158 Å²	158	53.3 Å²	53.3	83%	0.827	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46	-45.9	-176.1	-86.3	140.1	0	0	0	116.9	L395 A396 P397	L393-L395 VanDerWaalsContact C-N 3.33Å; L393-L395 PolarHBondContact O-N 3.25Å; L393-A396 PolarHBondContact O-N 2.84Å; L393-P397 WeakPolarHBondContact O-CD 3.46Å
394	P	80.3	Confident	81.3	Confident	81 Å²	81	56.4 Å²	56.4	53%	0.526	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-32	-176.5	22.1	-34.9	0	0	0	114.3	F391 G392	F391-P394 WeakPolarHBondContact O-CD 3.33Å; F391-P394 VanDerWaalsContact O-CG 3.25Å; F391-P394 WeakPolarHBondContact O-CG 3.39Å; G392-P394 VanDerWaalsContact C-CD 3.5Å
395	L	82.1	Confident	80.8	Confident	32 Å²	32	58 Å²	58	17%	0.168	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-10	178.6	-98.6	69.6	0	0	0	113.1	L382 L385 A386 F391 G392 L393 P397 A398	L382-L395 HydrophobicContact CD1-CD2 3.66Å; L382-L395 HydrophobicContact CD1-CG 4.03Å; L385-L395 HydrophobicContact CB-CD2 4.38Å; A386-L395 HydrophobicContact CB-CB 4.26Å; A386-L395 WeakPolarHBondContact CB-O 3.37Å; F391-L395 HydrophobicContact CB-CB 4.25Å; F391-L395 HydrophobicContact CB-CD1 4.27Å; F391-L395 HydrophobicContact CB-CD2 4.27Å; F391-L395 HydrophobicContact CD2-CD2 3.98Å; F391-L395 HydrophobicContact CG-CD2 4.37Å; G392-L395 PolarHBondContact O-N 2.91Å; L393-L395 VanDerWaalsContact C-N 3.33Å; L393-L395 PolarHBondContact O-N 3.25Å; L395-P397 VanDerWaalsContact C-CD 3.45Å; L395-P397 VanDerWaalsContact C-N 3.35Å; L395-A398 VanDerWaalsContact O-CB 3.3Å; L395-A398 WeakPolarHBondContact O-CB 3.41Å; L395-A398 PolarHBondContact O-N 2.79Å
396	A	81.3	Confident	80.7	Confident	39 Å²	39	58.3 Å²	58.3	32%	0.322	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-53.1	-41	-177.3	0	0	0	0	0	114.2	G392 L393 A398 T399	G392-A396 PolarHBondContact O-N 2.92Å; G392-A396 VanDerWaalsContact O-N 3.15Å; L393-A396 PolarHBondContact O-N 2.84Å; A396-A398 PolarHBondContact O-N 2.82Å; A396-T399 WeakPolarHBondContact O-CB 3.29Å; A396-T399 WeakPolarHBondContact O-CG2 3.25Å; A396-T399 PolarHBondContact O-N 2.85Å; A396-T399 VanDerWaalsContact O-N 3.16Å; A396-T399 PolarHBondContact O-OG1 3.21Å
397	P	86.8	Confident	80.8	Confident	56 Å²	56	58.1 Å²	58.1	36%	0.364	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-62.3	-24.9	177	-24.1	35.4	0	0	0	114	L393 L395 T399 V400 V409 Y413	L393-P397 WeakPolarHBondContact O-CD 3.46Å; L395-P397 VanDerWaalsContact C-CD 3.45Å; L395-P397 VanDerWaalsContact C-N 3.35Å; P397-T399 PolarHBondContact O-N 2.93Å; P397-V400 WeakPolarHBondContact O-CG2 3.42Å; P397-V400 PolarHBondContact O-N 3.49Å; P397-V409 HydrophobicContact CB-CG1 4.03Å; P397-V409 WeakPolarHBondContact O-CB 3.41Å; P397-V409 WeakPolarHBondContact O-CG1 3.41Å; P397-Y413 HydrophobicContact CB-CE2 4.38Å
398	A	85.6	Confident	81	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.008	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-70.7	-7	179.4	0	0	0	0	0	113.5	L382 H383 A386 L395 A396 V400 A410	L382-A398 HydrophobicContact CD2-CB 4.4Å; L382-A398 HydrophobicContact CG-CB 4.3Å; H383-A398 PolarHBondContact ND1-O 3.1Å; A386-A398 HydrophobicContact CB-CB 3.91Å; L395-A398 VanDerWaalsContact O-CB 3.3Å; L395-A398 WeakPolarHBondContact O-CB 3.41Å; L395-A398 PolarHBondContact O-N 2.79Å; A396-A398 PolarHBondContact O-N 2.82Å; A398-V400 VanDerWaalsContact C-N 3.3Å; A398-A410 HydrophobicContact CB-CB 4.19Å
399	T	84.9	Confident	81.6	Confident	42 Å²	42	58.3 Å²	58.3	26%	0.258	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-74.9	-18.4	171.9	62.3	0	0	0	0	113.1	H383 A386 L387 A396 P397 T401	H383-T399 PolarHBondContact CE1-O 3.01Å; H383-T399 VanDerWaalsContact CE1-O 3.31Å; A386-T399 HydrophobicContact CB-CG2 3.75Å; L387-T399 HydrophobicContact CD2-CG2 4.25Å; A396-T399 WeakPolarHBondContact O-CB 3.29Å; A396-T399 WeakPolarHBondContact O-CG2 3.25Å; A396-T399 PolarHBondContact O-N 2.85Å; A396-T399 VanDerWaalsContact O-N 3.16Å; A396-T399 PolarHBondContact O-OG1 3.21Å; P397-T399 PolarHBondContact O-N 2.93Å; T399-T401 PolarHBondContact O-N 3.33Å
400	V	87.1	Confident	82.2	Confident	67 Å²	67	52.3 Å²	52.3	41%	0.406	32%	0.316	S	S	.	.			trans	-71	123.5	-174.6	-179.7	0	0	0	0	111.1	P397 A398 V409	P397-V400 WeakPolarHBondContact O-CG2 3.42Å; P397-V400 PolarHBondContact O-N 3.49Å; A398-V400 VanDerWaalsContact C-N 3.3Å; V400-V409 HydrophobicContact CB-CG2 3.84Å; V400-V409 HydrophobicContact CG1-CG2 4.25Å
401	T	86.9	Confident	83	Confident	67 Å²	67	52.2 Å²	52.2	41%	0.411	32%	0.316	S	S	.	.			trans	-109.1	152.3	176.4	59.1	0	0	0	0	112.1	T399 P407	T399-T401 PolarHBondContact O-N 3.33Å; T401-P407 HydrophobicContact CG2-CB 4.35Å
402	S	84.4	Confident	83.8	Confident	53 Å²	53	54.8 Å²	54.8	37%	0.371	33%	0.33	S	S	.	.			trans	-71.9	167.1	167.3	-173.5	0	0	0	0	111.1	S404 G405 N406	S402-S404 PolarHBondContact O-N 3.44Å; S402-G405 PolarHBondContact O-N 3.49Å; S402-N406 PolarHBondContact N-O 2.68Å
403	N	75.6	Confident	84.6	Confident	178 Å²	178	58.2 Å²	58.2	95%	0.952	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-22.4	176.3	-66.4	-10.8	0	0	0	113.4
404	S	69.4	Low	85.6	Confident	92 Å²	92	50.8 Å²	50.8	64%	0.643	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	1.8	175.7	58.9	0	0	0	0	114.4	S402	S402-S404 PolarHBondContact O-N 3.44Å
405	G	75.4	Confident	86.3	Confident	41 Å²	41	50.1 Å²	50.1	42%	0.423	28%	0.284	S	S	.	.	S	Bend	trans	80.3	14.2	-176.6	0	0	0	0	0	114.9	R380 S402	R380-G405 PolarHBondContact NH1-O 3.07Å; S402-G405 PolarHBondContact O-N 3.49Å
406	N	83.7	Confident	86.9	Confident	6 Å²	6	49.9 Å²	49.9	3%	0.032	29%	0.29	C	S	.	.			trans	-87.9	122.9	175.6	-165.7	30.4	0	0	0	111.3	C197 L198 R380 S402 W408	C197-N406 PolarHBondContact O-ND2 3.46Å; C197-N406 VanDerWaalsContact O-ND2 3.09Å; L198-N406 PolarHBondContact O-ND2 3.43Å; R380-N406 PolarHBondContact NH2-OD1 3.36Å; S402-N406 PolarHBondContact N-O 2.68Å; N406-W408 VanDerWaalsContact C-N 3.31Å; N406-W408 PolarHBondContact O-N 2.89Å
407	P	88.4	Confident	87.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.292	C	S	.	.			trans	-78.4	76.9	-180	32.9	-36.8	0	0	0	111.3	H383 T401 V409 A410 V411	H383-P407 HydrophobicContact CB-CB 3.8Å; H383-P407 HydrophobicContact CB-CG 3.99Å; T401-P407 HydrophobicContact CG2-CB 4.35Å; P407-V409 VanDerWaalsContact C-N 3.31Å; P407-V409 PolarHBondContact O-N 3.04Å; P407-A410 HydrophobicContact CB-CB 4.08Å; P407-A410 PolarHBondContact O-N 3.3Å; P407-V411 WeakPolarHBondContact O-CG2 3.46Å; P407-V411 PolarHBondContact O-N 3.21Å
408	W	89	Confident	87.9	Confident	114 Å²	114	48.9 Å²	48.9	43%	0.432	28%	0.276	S	S	.	.	H	α-helix	trans	-63.7	-33.4	-172.8	71.8	-87	0	0	0	113.3	L198 N406 V411 L412	L198-W408 HydrophobicContact CD2-CB 3.82Å; N406-W408 VanDerWaalsContact C-N 3.31Å; N406-W408 PolarHBondContact O-N 2.89Å; W408-V411 WeakPolarHBondContact O-CB 3.43Å; W408-V411 PolarHBondContact O-N 3.26Å; W408-L412 PolarHBondContact O-N 3.29Å
409	V	92.2	Very high	88.4	Confident	16 Å²	16	49.7 Å²	49.7	10%	0.097	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-42.9	176.6	-178.6	0	0	0	0	110.7	P397 V400 P407 V411 L412 Y413	P397-V409 HydrophobicContact CB-CG1 4.03Å; P397-V409 WeakPolarHBondContact O-CB 3.41Å; P397-V409 WeakPolarHBondContact O-CG1 3.41Å; V400-V409 HydrophobicContact CB-CG2 3.84Å; V400-V409 HydrophobicContact CG1-CG2 4.25Å; P407-V409 VanDerWaalsContact C-N 3.31Å; P407-V409 PolarHBondContact O-N 3.04Å; V409-V411 VanDerWaalsContact C-N 3.27Å; V409-V411 PolarHBondContact O-N 3.15Å; V409-L412 WeakPolarHBondContact O-CB 3.34Å; V409-L412 PolarHBondContact O-N 3.42Å; V409-L412 VanDerWaalsContact O-N 3.09Å; V409-Y413 HydrophobicContact CG1-CD2 3.82Å; V409-Y413 HydrophobicContact CG1-CE2 3.76Å; V409-Y413 WeakPolarHBondContact O-CD2 3.37Å; V409-Y413 PolarHBondContact O-N 3.15Å
410	A	91.6	Very high	88.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-62.1	-36.4	176.3	0	0	0	0	0	112.1	S379 L382 H383 A398 P407 Y413 T414	S379-A410 WeakPolarHBondContact O-CB 3.45Å; L382-A410 HydrophobicContact CB-CB 4.47Å; L382-A410 HydrophobicContact CD2-CB 4.32Å; H383-A410 HydrophobicContact CB-CB 4.09Å; A398-A410 HydrophobicContact CB-CB 4.19Å; P407-A410 HydrophobicContact CB-CB 4.08Å; P407-A410 PolarHBondContact O-N 3.3Å; A410-Y413 PolarHBondContact O-N 3.01Å; A410-T414 WeakPolarHBondContact O-CG2 2.92Å; A410-T414 PolarHBondContact O-N 3.15Å; A410-T414 PolarHBondContact O-OG1 3.27Å
411	V	92.1	Very high	89.1	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.006	28%	0.275	C	S	.	.	H	α-helix	trans	-62.6	-42.4	172.9	-179.6	0	0	0	0	110.9	L194 C197 L198 P407 W408 V409 T414 W415	L194-V411 HydrophobicContact CD1-CG1 3.69Å; C197-V411 HydrophobicContact CB-CG1 3.91Å; L198-V411 HydrophobicContact CD2-CB 4.39Å; L198-V411 HydrophobicContact CD2-CG1 4.34Å; P407-V411 WeakPolarHBondContact O-CG2 3.46Å; P407-V411 PolarHBondContact O-N 3.21Å; W408-V411 WeakPolarHBondContact O-CB 3.43Å; W408-V411 PolarHBondContact O-N 3.26Å; V409-V411 VanDerWaalsContact C-N 3.27Å; V409-V411 PolarHBondContact O-N 3.15Å; V411-T414 VanDerWaalsContact C-OG1 3.31Å; V411-T414 WeakPolarHBondContact CA-OG1 3.29Å; V411-T414 PolarHBondContact O-N 3.28Å; V411-T414 PolarHBondContact O-OG1 3.11Å; V411-W415 WeakPolarHBondContact O-CB 3.34Å; V411-W415 PolarHBondContact O-N 3.35Å
412	L	93.6	Very high	89.3	Confident	79 Å²	79	45.4 Å²	45.4	41%	0.414	26%	0.255	S	S	.	.	H	α-helix	trans	-64.8	-42	177.8	-170	67.2	0	0	0	112.3	L194 W408 V409 T414 W415 G416	L194-L412 HydrophobicContact CD2-CD1 4.33Å; W408-L412 PolarHBondContact O-N 3.29Å; V409-L412 WeakPolarHBondContact O-CB 3.34Å; V409-L412 PolarHBondContact O-N 3.42Å; V409-L412 VanDerWaalsContact O-N 3.09Å; L412-T414 PolarHBondContact O-N 3.39Å; L412-W415 HydrophobicContact CD1-CE3 4.08Å; L412-W415 PolarHBondContact O-N 2.86Å; L412-G416 PolarHBondContact O-N 2.67Å
413	Y	93.1	Very high	89.6	Confident	100 Å²	100	47.8 Å²	47.8	39%	0.392	26%	0.259	S	S	.	.	H	α-helix	trans	-58.7	-45.8	173.1	-91.5	-87.8	0	0	0	111.7	L382 P397 V409 A410 W415 G416 L417	L382-Y413 HydrophobicContact CD2-CG 4.29Å; P397-Y413 HydrophobicContact CB-CE2 4.38Å; V409-Y413 HydrophobicContact CG1-CD2 3.82Å; V409-Y413 HydrophobicContact CG1-CE2 3.76Å; V409-Y413 WeakPolarHBondContact O-CD2 3.37Å; V409-Y413 PolarHBondContact O-N 3.15Å; A410-Y413 PolarHBondContact O-N 3.01Å; Y413-W415 VanDerWaalsContact C-N 3.33Å; Y413-W415 PolarHBondContact O-N 2.88Å; Y413-G416 PolarHBondContact O-N 3.24Å; Y413-L417 PolarHBondContact O-N 2.84Å; Y413-L417 VanDerWaalsContact O-N 3.08Å
414	T	94	Very high	90	Very high	2 Å²	2	42 Å²	42	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-39.8	177.3	47.6	0	0	0	0	112.9	F138 V142 A378 A410 V411 L412 L417 A418	F138-T414 HydrophobicContact CD2-CG2 4.35Å; F138-T414 HydrophobicContact CE2-CG2 3.44Å; F138-T414 VanDerWaalsContact CE2-CG2 3.44Å; F138-T414 HydrophobicContact CZ-CG2 4.16Å; V142-T414 HydrophobicContact CG2-CG2 4.46Å; A378-T414 HydrophobicContact CB-CG2 3.51Å; A410-T414 WeakPolarHBondContact O-CG2 2.92Å; A410-T414 PolarHBondContact O-N 3.15Å; A410-T414 PolarHBondContact O-OG1 3.27Å; V411-T414 VanDerWaalsContact C-OG1 3.31Å; V411-T414 WeakPolarHBondContact CA-OG1 3.29Å; V411-T414 PolarHBondContact O-N 3.28Å; V411-T414 PolarHBondContact O-OG1 3.11Å; L412-T414 PolarHBondContact O-N 3.39Å; T414-L417 PolarHBondContact O-N 3.05Å; T414-A418 VanDerWaalsContact O-CB 3.29Å; T414-A418 WeakPolarHBondContact O-CB 3.5Å; T414-A418 PolarHBondContact O-N 3.46Å
415	W	95.3	Very high	90.1	Very high	66 Å²	66	39 Å²	39	25%	0.25	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-45.5	176.9	171.6	84.9	0	0	0	111.2	L194 M375 V411 L412 Y413 L417 A418 Q419	L194-W415 HydrophobicContact CB-CG 4.18Å; L194-W415 HydrophobicContact CD1-CB 4.02Å; L194-W415 HydrophobicContact CD1-CG 4.24Å; L194-W415 HydrophobicContact CD2-CB 4.44Å; L194-W415 HydrophobicContact CD2-CD2 3.9Å; L194-W415 HydrophobicContact CD2-CE3 4.48Å; L194-W415 HydrophobicContact CD2-CG 3.83Å; L194-W415 HydrophobicContact CG-CG 4.3Å; M375-W415 HydrophobicContact SD-CB 4.27Å; V411-W415 WeakPolarHBondContact O-CB 3.34Å; V411-W415 PolarHBondContact O-N 3.35Å; L412-W415 HydrophobicContact CD1-CE3 4.08Å; L412-W415 PolarHBondContact O-N 2.86Å; Y413-W415 VanDerWaalsContact C-N 3.33Å; Y413-W415 PolarHBondContact O-N 2.88Å; W415-L417 VanDerWaalsContact C-N 3.35Å; W415-L417 PolarHBondContact O-N 3.42Å; W415-A418 PolarHBondContact O-N 3.2Å; W415-Q419 WeakPolarHBondContact O-CB 3.22Å; W415-Q419 PolarHBondContact O-N 2.82Å
416	G	95.1	Very high	90	Very high	28 Å²	28	43.6 Å²	43.6	29%	0.289	23%	0.23	S	C	.	.	H	α-helix	trans	-59.7	-43.2	177.5	0	0	0	0	0	112.6	L412 Y413 Q419 C420	L412-G416 PolarHBondContact O-N 2.67Å; Y413-G416 PolarHBondContact O-N 3.24Å; G416-Q419 WeakPolarHBondContact O-CB 3.44Å; G416-Q419 PolarHBondContact O-N 3.47Å; G416-C420 PolarHBondContact O-N 3.23Å; G416-C420 PolarHBondContact O-SG 2.89Å; G416-C420 VanDerWaalsContact O-SG 3.41Å
417	L	94.6	Very high	89.4	Confident	73 Å²	73	45 Å²	45	38%	0.382	24%	0.237	S	C	.	.	H	α-helix	trans	-71.2	-37.7	176.6	-64.5	175.3	0	0	0	112.8	F138 V142 Y413 T414 W415 Q419 C420 V421	F138-L417 HydrophobicContact CE1-CD1 3.61Å; F138-L417 HydrophobicContact CZ-CD1 3.59Å; V142-L417 HydrophobicContact CG1-CB 3.61Å; V142-L417 HydrophobicContact CG2-CB 4.45Å; Y413-L417 PolarHBondContact O-N 2.84Å; Y413-L417 VanDerWaalsContact O-N 3.08Å; T414-L417 PolarHBondContact O-N 3.05Å; W415-L417 VanDerWaalsContact C-N 3.35Å; W415-L417 PolarHBondContact O-N 3.42Å; L417-Q419 VanDerWaalsContact C-N 3.27Å; L417-Q419 PolarHBondContact O-N 3.26Å; L417-C420 WeakPolarHBondContact O-CB 3.39Å; L417-C420 PolarHBondContact O-N 3.41Å; L417-V421 PolarHBondContact O-N 3.23Å
418	A	94.6	Very high	88.6	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-34.4	174.9	0	0	0	0	0	111.4	V142 C145 L190 T414 W415 C420 V421 V422	V142-A418 HydrophobicContact CG1-CB 4.44Å; C145-A418 HydrophobicContact CB-CB 4.36Å; L190-A418 HydrophobicContact CD1-CB 4.15Å; L190-A418 HydrophobicContact CD2-CB 4.05Å; T414-A418 VanDerWaalsContact O-CB 3.29Å; T414-A418 WeakPolarHBondContact O-CB 3.5Å; T414-A418 PolarHBondContact O-N 3.46Å; W415-A418 PolarHBondContact O-N 3.2Å; A418-C420 VanDerWaalsContact C-N 3.32Å; A418-C420 PolarHBondContact O-N 2.97Å; A418-V421 WeakPolarHBondContact O-CB 3.37Å; A418-V421 PolarHBondContact O-N 3.48Å; A418-V421 VanDerWaalsContact O-N 3.1Å; A418-V422 PolarHBondContact O-N 3.11Å
419	Q	95.3	Very high	88.1	Confident	17 Å²	17	42.9 Å²	42.9	8%	0.079	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-37.4	173.8	-174.6	64	48.6	0	0	111.7	S187 L190 W415 G416 L417 V421 V422 F423	S187-Q419 PolarHBondContact OG-NE2 3.21Å; L190-Q419 HydrophobicContact CD2-CB 4.03Å; W415-Q419 WeakPolarHBondContact O-CB 3.22Å; W415-Q419 PolarHBondContact O-N 2.82Å; G416-Q419 WeakPolarHBondContact O-CB 3.44Å; G416-Q419 PolarHBondContact O-N 3.47Å; L417-Q419 VanDerWaalsContact C-N 3.27Å; L417-Q419 PolarHBondContact O-N 3.26Å; Q419-V421 VanDerWaalsContact C-N 3.28Å; Q419-V421 PolarHBondContact O-N 3.38Å; Q419-V422 WeakPolarHBondContact O-CB 3.43Å; Q419-V422 PolarHBondContact O-N 2.93Å; Q419-F423 HydrophobicContact CG-CD2 4.12Å; Q419-F423 HydrophobicContact CG-CE2 3.6Å; Q419-F423 HydrophobicContact CG-CZ 4.22Å; Q419-F423 WeakPolarHBondContact O-CD2 3.24Å; Q419-F423 PolarHBondContact O-N 2.82Å
420	C	93.6	Very high	87.6	Confident	80 Å²	80	42.6 Å²	42.6	54%	0.541	24%	0.237	S	C	.	.	H	α-helix	trans	-60.9	-36.6	171.6	-63.7	0	0	0	0	112.4	G416 L417 A418 F423 A424	G416-C420 PolarHBondContact O-N 3.23Å; G416-C420 PolarHBondContact O-SG 2.89Å; G416-C420 VanDerWaalsContact O-SG 3.41Å; L417-C420 WeakPolarHBondContact O-CB 3.39Å; L417-C420 PolarHBondContact O-N 3.41Å; A418-C420 VanDerWaalsContact C-N 3.32Å; A418-C420 PolarHBondContact O-N 2.97Å; C420-F423 PolarHBondContact O-N 3.47Å; C420-A424 PolarHBondContact O-N 3.44Å
421	V	92.2	Very high	87.1	Confident	6 Å²	6	42.7 Å²	42.7	4%	0.036	24%	0.238	C	C	.	.	H	α-helix	trans	-68.3	-40.8	175.5	-178.6	0	0	0	0	110.9	V142 F143 L417 A418 Q419 F423 A424 V430	V142-V421 HydrophobicContact CG1-CG2 4.33Å; F143-V421 HydrophobicContact CD1-CB 4.45Å; F143-V421 HydrophobicContact CD1-CG1 3.94Å; F143-V421 HydrophobicContact CD1-CG2 3.61Å; F143-V421 HydrophobicContact CE1-CG2 3.81Å; F143-V421 HydrophobicContact CG-CG2 4.02Å; F143-V421 HydrophobicContact CZ-CG2 4.35Å; L417-V421 PolarHBondContact O-N 3.23Å; A418-V421 WeakPolarHBondContact O-CB 3.37Å; A418-V421 PolarHBondContact O-N 3.48Å; A418-V421 VanDerWaalsContact O-N 3.1Å; Q419-V421 VanDerWaalsContact C-N 3.28Å; Q419-V421 PolarHBondContact O-N 3.38Å; V421-F423 VanDerWaalsContact C-N 3.28Å; V421-F423 PolarHBondContact O-N 2.82Å; V421-A424 WeakPolarHBondContact O-CB 3.34Å; V421-A424 PolarHBondContact O-N 3.04Å; V421-V430 HydrophobicContact CG1-CG1 3.85Å; V421-V430 HydrophobicContact CG1-CG2 4.11Å
422	V	91.5	Very high	86.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-39.9	173.9	170.7	0	0	0	0	111.2	V149 L150 V183 L190 A418 Q419 A424 G425	V149-V422 HydrophobicContact CG1-CG2 4.46Å; L150-V422 HydrophobicContact CD2-CG1 4.38Å; V183-V422 HydrophobicContact CG1-CG1 4.47Å; L190-V422 HydrophobicContact CD2-CG2 4.25Å; A418-V422 PolarHBondContact O-N 3.11Å; Q419-V422 WeakPolarHBondContact O-CB 3.43Å; Q419-V422 PolarHBondContact O-N 2.93Å; V422-A424 PolarHBondContact O-N 2.93Å; V422-G425 PolarHBondContact O-N 2.82Å; V422-G425 VanDerWaalsContact O-N 3.15Å
423	F	90.6	Very high	86.4	Confident	104 Å²	104	41.7 Å²	41.7	46%	0.456	24%	0.235	S	C	.	.	H	α-helix	trans	-67.3	-16.2	174.8	-73	-53.8	0	0	0	114.5	Y179 V183 Q419 C420 V421	Y179-F423 PolarHBondContact OH-O 2.63Å; V183-F423 HydrophobicContact CG1-CD1 3.63Å; V183-F423 HydrophobicContact CG1-CE1 3.59Å; Q419-F423 HydrophobicContact CG-CD2 4.12Å; Q419-F423 HydrophobicContact CG-CE2 3.6Å; Q419-F423 HydrophobicContact CG-CZ 4.22Å; Q419-F423 WeakPolarHBondContact O-CD2 3.24Å; Q419-F423 PolarHBondContact O-N 2.82Å; C420-F423 PolarHBondContact O-N 3.47Å; V421-F423 VanDerWaalsContact C-N 3.28Å; V421-F423 PolarHBondContact O-N 2.82Å
424	A	83.8	Confident	86.2	Confident	56 Å²	56	37 Å²	37	46%	0.463	22%	0.216	S	C	.	.	H	α-helix	trans	-76.5	-26.9	172.5	0	0	0	0	0	112	C420 V421 V422 Q426	C420-A424 PolarHBondContact O-N 3.44Å; V421-A424 WeakPolarHBondContact O-CB 3.34Å; V421-A424 PolarHBondContact O-N 3.04Å; V422-A424 PolarHBondContact O-N 2.93Å; A424-Q426 PolarHBondContact O-N 2.94Å
425	G	71.9	Confident	86.1	Confident	29 Å²	29	36.9 Å²	36.9	30%	0.299	22%	0.216	S	C	.	.			trans	64	-8.8	168.2	0	0	0	0	0	118	V422 L427	V422-G425 PolarHBondContact O-N 2.82Å; V422-G425 VanDerWaalsContact O-N 3.15Å; G425-L427 PolarHBondContact O-N 2.88Å
426	Q	74.3	Confident	85.9	Confident	138 Å²	138	33.7 Å²	33.7	65%	0.645	20%	0.204	S	C	*	.			trans	-95.4	91	-176.4	-67	-174.1	-1.7	0	0	112.3	A424 N428 A429 V430	A424-Q426 PolarHBondContact O-N 2.94Å; Q426-N428 PolarHBondContact O-N 3.05Å; Q426-A429 HydrophobicContact CB-CB 4.05Å; Q426-A429 PolarHBondContact O-N 2.87Å; Q426-V430 VanDerWaalsContact O-CG2 3.3Å; Q426-V430 WeakPolarHBondContact O-CG2 3.46Å; Q426-V430 PolarHBondContact O-N 3.44Å
427	L	70.7	Confident	85.8	Confident	34 Å²	34	33 Å²	33	18%	0.178	19%	0.193	C	C	.	.	H	α-helix	trans	-55.7	-45.1	-172.6	-168.1	146	0	0	0	114	L150 G425 V430 A431	L150-L427 HydrophobicContact CB-CD1 4Å; G425-L427 PolarHBondContact O-N 2.88Å; L427-V430 PolarHBondContact O-N 3.37Å; L427-A431 WeakPolarHBondContact O-CB 3.43Å; L427-A431 PolarHBondContact O-N 3.34Å
428	N	71.3	Confident	85.6	Confident	39 Å²	39	29.6 Å²	29.6	21%	0.209	18%	0.175	C	C	.	.	H	α-helix	trans	-72.3	-35	-177.1	-75	8.1	0	0	0	113.9	T274 Q426 S432	T274-N428 HydrophobicContact CG2-CB 4.44Å; T274-N428 WeakPolarHBondContact CG2-ND2 3.48Å; Q426-N428 PolarHBondContact O-N 3.05Å; N428-S432 PolarHBondContact O-N 3.47Å; N428-S432 PolarHBondContact O-OG 3.28Å
429	A	78	Confident	85.5	Confident	32 Å²	32	29.6 Å²	29.6	26%	0.264	17%	0.174	S	C	.	.	H	α-helix	trans	-66.9	-42.2	174.4	0	0	0	0	0	110.2	Q426 S432 L433	Q426-A429 HydrophobicContact CB-CB 4.05Å; Q426-A429 PolarHBondContact O-N 2.87Å; A429-S432 PolarHBondContact O-N 3.21Å; A429-L433 WeakPolarHBondContact O-CB 3.33Å; A429-L433 PolarHBondContact O-N 3.42Å; A429-L433 VanDerWaalsContact O-N 3.08Å
430	V	83.3	Confident	85.4	Confident	10 Å²	10	29.1 Å²	29.1	6%	0.061	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-48.3	174.1	174.5	0	0	0	0	110.8	E147 V421 Q426 L427 S432 L433 V434	E147-V430 HydrophobicContact CB-CG1 4.09Å; V421-V430 HydrophobicContact CG1-CG1 3.85Å; V421-V430 HydrophobicContact CG1-CG2 4.11Å; Q426-V430 VanDerWaalsContact O-CG2 3.3Å; Q426-V430 WeakPolarHBondContact O-CG2 3.46Å; Q426-V430 PolarHBondContact O-N 3.44Å; L427-V430 PolarHBondContact O-N 3.37Å; V430-S432 VanDerWaalsContact C-N 3.33Å; V430-S432 PolarHBondContact O-N 2.84Å; V430-L433 PolarHBondContact O-N 3.1Å; V430-L433 VanDerWaalsContact O-N 3.13Å; V430-V434 HydrophobicContact CG1-CG2 4.07Å; V430-V434 WeakPolarHBondContact O-CB 3.28Å; V430-V434 VanDerWaalsContact O-CG2 3.25Å; V430-V434 WeakPolarHBondContact O-CG2 3.25Å; V430-V434 PolarHBondContact O-N 3.02Å
431	A	80.6	Confident	85.2	Confident	2 Å²	2	25.3 Å²	25.3	2%	0.017	15%	0.147	C	C	.	.	H	α-helix	trans	-59.9	-40.8	179.6	0	0	0	0	0	112.8	E147 T289 L427 V434 T435	E147-A431 HydrophobicContact CG-CB 4.44Å; T289-A431 HydrophobicContact CG2-CB 4.46Å; T289-A431 WeakPolarHBondContact CG2-O 3.26Å; L427-A431 WeakPolarHBondContact O-CB 3.43Å; L427-A431 PolarHBondContact O-N 3.34Å; A431-V434 PolarHBondContact O-N 3.47Å; A431-T435 WeakPolarHBondContact O-CB 3.28Å; A431-T435 PolarHBondContact O-N 2.85Å; A431-T435 PolarHBondContact O-OG1 2.96Å
432	S	83.4	Confident	85.2	Confident	24 Å²	24	25.1 Å²	25.1	17%	0.168	15%	0.146	C	C	.	.	H	α-helix	trans	-63.9	-42	175.6	-59.1	0	0	0	0	111.7	N428 A429 V430 V436	N428-S432 PolarHBondContact O-N 3.47Å; N428-S432 PolarHBondContact O-OG 3.28Å; A429-S432 PolarHBondContact O-N 3.21Å; V430-S432 VanDerWaalsContact C-N 3.33Å; V430-S432 PolarHBondContact O-N 2.84Å; S432-V436 WeakPolarHBondContact O-CG2 3.37Å; S432-V436 PolarHBondContact O-N 3.44Å; S432-V436 VanDerWaalsContact O-N 3.17Å
433	L	87.8	Confident	85.3	Confident	35 Å²	35	25.4 Å²	25.4	18%	0.183	15%	0.148	C	C	.	.	H	α-helix	trans	-67.9	-43.4	177.4	-175.3	65.7	0	0	0	112.1	F143 A429 V430 T435 V436 F437 Y490	F143-L433 HydrophobicContact CD1-CD2 3.94Å; F143-L433 HydrophobicContact CE1-CD2 3.62Å; F143-L433 HydrophobicContact CZ-CD2 4.03Å; A429-L433 WeakPolarHBondContact O-CB 3.33Å; A429-L433 PolarHBondContact O-N 3.42Å; A429-L433 VanDerWaalsContact O-N 3.08Å; V430-L433 PolarHBondContact O-N 3.1Å; V430-L433 VanDerWaalsContact O-N 3.13Å; L433-T435 VanDerWaalsContact C-N 3.3Å; L433-T435 PolarHBondContact O-N 3.41Å; L433-V436 PolarHBondContact O-N 2.99Å; L433-F437 HydrophobicContact CD1-CD2 4.49Å; L433-F437 HydrophobicContact CD1-CE1 4.13Å; L433-F437 HydrophobicContact CD1-CE2 3.91Å; L433-F437 HydrophobicContact CD1-CZ 3.7Å; L433-F437 HydrophobicContact CD2-CE2 3.91Å; L433-F437 HydrophobicContact CD2-CZ 4.28Å; L433-F437 HydrophobicContact CG-CD2 4.08Å; L433-F437 HydrophobicContact CG-CE2 3.61Å; L433-F437 HydrophobicContact CG-CZ 3.96Å; L433-F437 PolarHBondContact O-N 3.14Å; L433-Y490 HydrophobicContact CD1-CG 4.33Å
434	V	89.3	Confident	85.3	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.2	-45.3	175.3	170.1	0	0	0	0	110.7	F143 A144 E147 T289 V430 A431 V436 F437 Y438	F143-V434 VanDerWaalsContact C-CG2 3.49Å; F143-V434 HydrophobicContact CB-CG2 3.44Å; F143-V434 VanDerWaalsContact CB-CG2 3.44Å; A144-V434 HydrophobicContact CB-CG1 3.94Å; E147-V434 WeakPolarHBondContact OE2-CB 3.37Å; E147-V434 WeakPolarHBondContact OE2-CG1 3.18Å; E147-V434 WeakPolarHBondContact OE2-CG2 3.41Å; T289-V434 HydrophobicContact CG2-CG1 4.24Å; V430-V434 HydrophobicContact CG1-CG2 4.07Å; V430-V434 WeakPolarHBondContact O-CB 3.28Å; V430-V434 VanDerWaalsContact O-CG2 3.25Å; V430-V434 WeakPolarHBondContact O-CG2 3.25Å; V430-V434 PolarHBondContact O-N 3.02Å; A431-V434 PolarHBondContact O-N 3.47Å; V434-V436 PolarHBondContact O-N 3.37Å; V434-F437 PolarHBondContact O-N 3.1Å; V434-Y438 HydrophobicContact CG1-CD2 3.59Å; V434-Y438 HydrophobicContact CG1-CE2 3.56Å; V434-Y438 WeakPolarHBondContact O-CD2 3.48Å; V434-Y438 PolarHBondContact O-N 3.25Å
435	T	90.1	Very high	85.5	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.6	-48.3	177.2	-58.1	0	0	0	0	111.5	A285 F288 T289 A431 L433 F437 Y438 L439 I486	A285-T435 HydrophobicContact CB-CG2 4.46Å; A285-T435 PolarHBondContact O-OG1 2.83Å; F288-T435 HydrophobicContact CB-CG2 4.11Å; F288-T435 HydrophobicContact CD1-CG2 3.65Å; F288-T435 HydrophobicContact CE1-CG2 4.43Å; F288-T435 HydrophobicContact CG-CG2 4.16Å; T289-T435 WeakPolarHBondContact CG2-OG1 3.37Å; A431-T435 WeakPolarHBondContact O-CB 3.28Å; A431-T435 PolarHBondContact O-N 2.85Å; A431-T435 PolarHBondContact O-OG1 2.96Å; L433-T435 VanDerWaalsContact C-N 3.3Å; L433-T435 PolarHBondContact O-N 3.41Å; T435-F437 PolarHBondContact O-N 2.88Å; T435-Y438 PolarHBondContact O-N 3Å; T435-L439 HydrophobicContact CG2-CD1 4.02Å; T435-L439 HydrophobicContact CG2-CG 4.5Å; T435-L439 WeakPolarHBondContact O-CB 3.47Å; T435-L439 WeakPolarHBondContact O-CG 3.21Å; T435-L439 PolarHBondContact O-N 3.36Å; T435-I486 HydrophobicContact CG2-CD1 3.41Å; T435-I486 VanDerWaalsContact CG2-CD1 3.41Å
436	V	92.7	Very high	86.5	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.1	-44.5	178.5	168.4	0	0	0	0	110.9	S432 L433 V434 L439 L440 M483 I486 S494	S432-V436 WeakPolarHBondContact O-CG2 3.37Å; S432-V436 PolarHBondContact O-N 3.44Å; S432-V436 VanDerWaalsContact O-N 3.17Å; L433-V436 PolarHBondContact O-N 2.99Å; V434-V436 PolarHBondContact O-N 3.37Å; V436-L439 PolarHBondContact O-N 3.44Å; V436-L440 WeakPolarHBondContact O-CB 3.23Å; V436-L440 PolarHBondContact O-N 3.27Å; V436-M483 HydrophobicContact CB-CG 4.34Å; V436-M483 HydrophobicContact CG1-CG 3.84Å; V436-M483 HydrophobicContact CG1-SD 4.09Å; V436-M483 HydrophobicContact CG2-CG 4.24Å; V436-I486 HydrophobicContact CG2-CG2 4.45Å; V436-S494 WeakPolarHBondContact CG1-OG 3.37Å
437	F	91.7	Very high	87.3	Confident	13 Å²	13	14.6 Å²	14.6	6%	0.057	9%	0.086	C	C	.	.	H	α-helix	trans	-64.5	-40.6	177.7	-70.3	-29.2	0	0	0	113	A140 F143 L433 V434 T435 A441 S494	A140-F437 HydrophobicContact CB-CB 3.75Å; F143-F437 HydrophobicContact CD2-CD2 4.11Å; F143-F437 AromaticContact CD2-CE2 3.73Å; F143-F437 HydrophobicContact CD2-CE2 3.73Å; F143-F437 AromaticContact CE2-CE2 3.75Å; F143-F437 HydrophobicContact CE2-CE2 3.75Å; F143-F437 HydrophobicContact CG-CE2 4.35Å; F143-F437 HydrophobicContact CZ-CE2 4.37Å; L433-F437 HydrophobicContact CD1-CD2 4.49Å; L433-F437 HydrophobicContact CD1-CE1 4.13Å; L433-F437 HydrophobicContact CD1-CE2 3.91Å; L433-F437 HydrophobicContact CD1-CZ 3.7Å; L433-F437 HydrophobicContact CD2-CE2 3.91Å; L433-F437 HydrophobicContact CD2-CZ 4.28Å; L433-F437 HydrophobicContact CG-CD2 4.08Å; L433-F437 HydrophobicContact CG-CE2 3.61Å; L433-F437 HydrophobicContact CG-CZ 3.96Å; L433-F437 PolarHBondContact O-N 3.14Å; V434-F437 PolarHBondContact O-N 3.1Å; T435-F437 PolarHBondContact O-N 2.88Å; F437-A441 VanDerWaalsContact O-CB 3.24Å; F437-A441 WeakPolarHBondContact O-CB 3.4Å; F437-A441 PolarHBondContact O-N 3.33Å; F437-S494 VanDerWaalsContact CE1-OG 3.28Å; F437-S494 WeakPolarHBondContact CE1-OG 3.48Å
438	Y	90.4	Very high	88	Confident	2 Å²	2	13.3 Å²	13.3	1%	0.008	8%	0.079	C	C	.	.	H	α-helix	trans	-65.9	-43.6	174.9	-85.2	-63.9	0	0	0	112.5	A140 K141 A144 T292 V434 T435 L440 A441 Y442	A140-Y438 HydrophobicContact CB-CD1 4.21Å; A140-Y438 HydrophobicContact CB-CD2 4.48Å; A140-Y438 HydrophobicContact CB-CE1 4.23Å; A140-Y438 HydrophobicContact CB-CG 4.33Å; K141-Y438 WeakPolarHBondContact CD-OH 3.25Å; K141-Y438 VanDerWaalsContact CE-OH 3.29Å; K141-Y438 WeakPolarHBondContact CE-OH 3.49Å; K141-Y438 PolarHBondContact NZ-OH 3.44Å; A144-Y438 HydrophobicContact CB-CE2 3.91Å; T292-Y438 HydrophobicContact CG2-CD2 3.74Å; T292-Y438 HydrophobicContact CG2-CE2 4.31Å; T292-Y438 HydrophobicContact CG2-CG 3.87Å; V434-Y438 HydrophobicContact CG1-CD2 3.59Å; V434-Y438 HydrophobicContact CG1-CE2 3.56Å; V434-Y438 WeakPolarHBondContact O-CD2 3.48Å; V434-Y438 PolarHBondContact O-N 3.25Å; T435-Y438 PolarHBondContact O-N 3Å; Y438-L440 VanDerWaalsContact C-N 3.35Å; Y438-L440 PolarHBondContact O-N 3.23Å; Y438-A441 PolarHBondContact O-N 3.09Å; Y438-Y442 HydrophobicContact CD1-CE1 4.21Å; Y438-Y442 WeakPolarHBondContact O-CB 3.39Å; Y438-Y442 WeakPolarHBondContact O-CD1 3.44Å; Y438-Y442 WeakPolarHBondContact O-CD2 3.26Å; Y438-Y442 PolarHBondContact O-N 2.86Å
439	L	93.3	Very high	88.8	Confident	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.2	-42	177	-75.3	172.9	0	0	0	111.8	I95 F288 T435 V436 A441 Y442 A443 C479 M482 M483 I486	I95-L439 HydrophobicContact CG2-CD2 4.12Å; F288-L439 HydrophobicContact CE1-CD2 3.71Å; F288-L439 HydrophobicContact CE1-CG 3.84Å; F288-L439 HydrophobicContact CE2-CD2 4.04Å; F288-L439 HydrophobicContact CZ-CD2 3.38Å; F288-L439 HydrophobicContact CZ-CG 4.06Å; T435-L439 HydrophobicContact CG2-CD1 4.02Å; T435-L439 HydrophobicContact CG2-CG 4.5Å; T435-L439 WeakPolarHBondContact O-CB 3.47Å; T435-L439 WeakPolarHBondContact O-CG 3.21Å; T435-L439 PolarHBondContact O-N 3.36Å; V436-L439 PolarHBondContact O-N 3.44Å; L439-A441 VanDerWaalsContact C-N 3.35Å; L439-Y442 PolarHBondContact O-N 2.61Å; L439-A443 WeakPolarHBondContact O-CB 3.31Å; L439-A443 PolarHBondContact O-N 3.04Å; L439-C479 HydrophobicContact CD2-CB 4.45Å; L439-M482 HydrophobicContact CD1-CB 4.24Å; L439-M483 HydrophobicContact CB-CB 4.3Å; L439-M483 HydrophobicContact CB-CG 4.39Å; L439-M483 HydrophobicContact CD1-CB 4.17Å; L439-I486 HydrophobicContact CD1-CD1 3.56Å
440	L	92.8	Very high	89.3	Confident	7 Å²	7	10.2 Å²	10.2	4%	0.037	6%	0.059	C	C	.	.	H	α-helix	trans	-63.6	-42.7	175.6	-178	59.7	0	0	0	111.4	M136 V436 Y438 A443 A444 M483 S494 I495 L498	M136-L440 HydrophobicContact SD-CD2 4.25Å; V436-L440 WeakPolarHBondContact O-CB 3.23Å; V436-L440 PolarHBondContact O-N 3.27Å; Y438-L440 VanDerWaalsContact C-N 3.35Å; Y438-L440 PolarHBondContact O-N 3.23Å; L440-A443 PolarHBondContact O-N 3.39Å; L440-A444 WeakPolarHBondContact O-CB 3.36Å; L440-A444 PolarHBondContact O-N 2.97Å; L440-M483 HydrophobicContact CB-SD 3.94Å; L440-M483 HydrophobicContact CD1-SD 4.36Å; L440-S494 WeakPolarHBondContact CD2-O 3.39Å; L440-I495 HydrophobicContact CD1-CG1 4.22Å; L440-L498 HydrophobicContact CD1-CD2 3.93Å; L440-L498 HydrophobicContact CD2-CB 4.27Å; L440-L498 HydrophobicContact CD2-CD2 4.39Å; L440-L498 HydrophobicContact CG-CD2 4.23Å
441	A	89.3	Confident	89.4	Confident	1 Å²	1	11.3 Å²	11.3	1%	0.008	7%	0.068	C	C	.	.	H	α-helix	trans	-68.3	-37.3	-179.8	0	0	0	0	0	111.7	F137 F437 Y438 L439 A444 V445	F137-A441 HydrophobicContact CD1-CB 3.5Å; F137-A441 VanDerWaalsContact CD1-CB 3.5Å; F137-A441 HydrophobicContact CD2-CB 3.97Å; F137-A441 HydrophobicContact CE1-CB 3.19Å; F137-A441 HydrophobicContact CE2-CB 3.71Å; F137-A441 HydrophobicContact CG-CB 3.86Å; F137-A441 HydrophobicContact CZ-CB 3.3Å; F137-A441 WeakPolarHBondContact CZ-O 3.02Å; F437-A441 VanDerWaalsContact O-CB 3.24Å; F437-A441 WeakPolarHBondContact O-CB 3.4Å; F437-A441 PolarHBondContact O-N 3.33Å; Y438-A441 PolarHBondContact O-N 3.09Å; L439-A441 VanDerWaalsContact C-N 3.35Å; A441-A444 PolarHBondContact O-N 2.96Å; A441-V445 WeakPolarHBondContact O-CG2 3.3Å; A441-V445 PolarHBondContact O-N 2.91Å; A441-V445 VanDerWaalsContact O-N 3.11Å
442	Y	91.9	Very high	89.4	Confident	1 Å²	1	11.5 Å²	11.5	0%	0.004	7%	0.069	C	C	.	.	H	α-helix	trans	-64.6	-46.1	171.7	-65.8	-13.9	0	0	0	112	T99 F137 F288 G293 I294 Y438 L439 A444 V445 D446	T99-Y442 HydrophobicContact CG2-CD1 3.88Å; T99-Y442 HydrophobicContact CG2-CG 3.9Å; F137-Y442 HydrophobicContact CE1-CD1 4.1Å; F137-Y442 HydrophobicContact CE1-CE1 4.14Å; F137-Y442 HydrophobicContact CZ-CD1 4.29Å; F288-Y442 HydrophobicContact CE1-CE2 4.4Å; F288-Y442 HydrophobicContact CZ-CD2 4.38Å; F288-Y442 HydrophobicContact CZ-CE2 4.21Å; G293-Y442 PolarHBondContact N-OH 3.28Å; I294-Y442 HydrophobicContact CD1-CE1 4.12Å; I294-Y442 HydrophobicContact CG1-CE1 4.09Å; Y438-Y442 HydrophobicContact CD1-CE1 4.21Å; Y438-Y442 WeakPolarHBondContact O-CB 3.39Å; Y438-Y442 WeakPolarHBondContact O-CD1 3.44Å; Y438-Y442 WeakPolarHBondContact O-CD2 3.26Å; Y438-Y442 PolarHBondContact O-N 2.86Å; L439-Y442 PolarHBondContact O-N 2.61Å; Y442-A444 PolarHBondContact O-N 2.94Å; Y442-V445 PolarHBondContact O-N 3.14Å; Y442-V445 VanDerWaalsContact O-N 3.15Å; Y442-D446 PolarHBondContact O-N 3.41Å
443	A	93.7	Very high	89.5	Confident	6 Å²	6	13.9 Å²	13.9	5%	0.05	8%	0.078	C	C	.	.	H	α-helix	trans	-57.2	-39	173.8	0	0	0	0	0	111.9	L439 L440 D446 L447 C479	L439-A443 WeakPolarHBondContact O-CB 3.31Å; L439-A443 PolarHBondContact O-N 3.04Å; L440-A443 PolarHBondContact O-N 3.39Å; A443-D446 PolarHBondContact O-N 3.44Å; A443-L447 VanDerWaalsContact O-CB 3.28Å; A443-L447 WeakPolarHBondContact O-CB 3.27Å; A443-L447 PolarHBondContact O-N 3.04Å; A443-C479 HydrophobicContact CB-CB 3.71Å
444	A	90.1	Very high	89.3	Confident	8 Å²	8	19.4 Å²	19.4	7%	0.066	10%	0.096	C	C	.	.	H	α-helix	trans	-69.8	-33.9	179.5	0	0	0	0	0	113	I133 L440 A441 Y442 A448	I133-A444 HydrophobicContact CD1-CB 3.86Å; I133-A444 HydrophobicContact CG1-CB 3.74Å; I133-A444 HydrophobicContact CG2-CB 4.21Å; L440-A444 WeakPolarHBondContact O-CB 3.36Å; L440-A444 PolarHBondContact O-N 2.97Å; A441-A444 PolarHBondContact O-N 2.96Å; Y442-A444 PolarHBondContact O-N 2.94Å; A444-A448 VanDerWaalsContact O-CB 3.26Å; A444-A448 WeakPolarHBondContact O-CB 3.47Å; A444-A448 PolarHBondContact O-N 3.11Å
445	V	89.3	Confident	88.7	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-68.2	-40.7	172.7	173.3	0	0	0	0	111.4	T99 I103 I106 I121 F137 M295 A441 Y442 A448 C449	T99-V445 HydrophobicContact CG2-CG1 4.46Å; I103-V445 HydrophobicContact CG1-CG1 4.17Å; I106-V445 HydrophobicContact CD1-CG1 3.95Å; I121-V445 HydrophobicContact CD1-CG2 3.92Å; F137-V445 HydrophobicContact CE2-CG2 3.53Å; F137-V445 HydrophobicContact CZ-CG2 3.55Å; M295-V445 HydrophobicContact CE-CG2 3.59Å; A441-V445 WeakPolarHBondContact O-CG2 3.3Å; A441-V445 PolarHBondContact O-N 2.91Å; A441-V445 VanDerWaalsContact O-N 3.11Å; Y442-V445 PolarHBondContact O-N 3.14Å; Y442-V445 VanDerWaalsContact O-N 3.15Å; V445-A448 WeakPolarHBondContact O-CB 3.4Å; V445-A448 PolarHBondContact O-N 3.18Å; V445-C449 PolarHBondContact O-N 3.23Å; V445-C449 VanDerWaalsContact O-N 3.13Å
446	D	93	Very high	88.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.9	-40	176.5	-67.9	-32	0	0	0	110.9	T99 S102 Y442 A443 A448 C449 L450 C472 G475 I476	T99-D446 WeakPolarHBondContact CA-OD1 3.38Å; T99-D446 PolarHBondContact OG1-OD2 2.98Å; S102-D446 WeakPolarHBondContact CB-OD1 3.41Å; S102-D446 PolarHBondContact OG-OD1 2.94Å; Y442-D446 PolarHBondContact O-N 3.41Å; A443-D446 PolarHBondContact O-N 3.44Å; D446-A448 VanDerWaalsContact C-N 3.34Å; D446-A448 PolarHBondContact O-N 2.87Å; D446-C449 PolarHBondContact O-N 3.47Å; D446-L450 WeakPolarHBondContact O-CB 3.49Å; D446-L450 PolarHBondContact O-N 3.36Å; D446-C472 WeakPolarHBondContact O-CB 3.48Å; D446-G475 WeakPolarHBondContact OD2-CA 3.21Å; D446-I476 HydrophobicContact CB-CD1 4.42Å; D446-I476 HydrophobicContact CB-CG1 3.58Å
447	L	89.9	Confident	86.9	Confident	93 Å²	93	24.3 Å²	24.3	49%	0.487	13%	0.131	S	C	.	.	H	α-helix	trans	-61.5	-41.6	173.8	179.9	64	0	0	0	112.2	A443 L450 A451 I476	A443-L447 VanDerWaalsContact O-CB 3.28Å; A443-L447 WeakPolarHBondContact O-CB 3.27Å; A443-L447 PolarHBondContact O-N 3.04Å; L447-L450 PolarHBondContact O-N 3.16Å; L447-A451 WeakPolarHBondContact O-CB 3.42Å; L447-A451 PolarHBondContact O-N 2.79Å; L447-I476 VanDerWaalsContact CA-CD1 3.46Å; L447-I476 HydrophobicContact CB-CD1 3.92Å; L447-I476 HydrophobicContact CB-CG1 4.25Å; L447-I476 HydrophobicContact CD1-CD1 4.09Å
448	A	85.6	Confident	85.9	Confident	6 Å²	6	28 Å²	28	5%	0.05	16%	0.156	C	C	.	.	H	α-helix	trans	-57.7	-50.9	175.4	0	0	0	0	0	112.5	L125 A444 V445 D446 L450 A451 L452	L125-A448 HydrophobicContact CD1-CB 3.18Å; L125-A448 HydrophobicContact CD2-CB 3.63Å; L125-A448 HydrophobicContact CG-CB 3.84Å; A444-A448 VanDerWaalsContact O-CB 3.26Å; A444-A448 WeakPolarHBondContact O-CB 3.47Å; A444-A448 PolarHBondContact O-N 3.11Å; V445-A448 WeakPolarHBondContact O-CB 3.4Å; V445-A448 PolarHBondContact O-N 3.18Å; D446-A448 VanDerWaalsContact C-N 3.34Å; D446-A448 PolarHBondContact O-N 2.87Å; A448-L450 VanDerWaalsContact C-N 3.35Å; A448-L450 PolarHBondContact O-N 2.95Å; A448-A451 PolarHBondContact O-N 2.93Å; A448-L452 WeakPolarHBondContact O-CG 3.37Å; A448-L452 PolarHBondContact O-N 3.36Å; A448-L452 VanDerWaalsContact O-N 3.08Å
449	C	87.8	Confident	85.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62	-42.6	176.6	-76.3	0	0	0	0	112.5	I106 V445 D446 A451 L452 E453 F467 C472	I106-C449 VanDerWaalsContact CD1-SG 3.52Å; I106-C449 WeakPolarHBondContact CG1-SG 3.36Å; V445-C449 PolarHBondContact O-N 3.23Å; V445-C449 VanDerWaalsContact O-N 3.13Å; D446-C449 PolarHBondContact O-N 3.47Å; C449-A451 VanDerWaalsContact C-N 3.33Å; C449-A451 PolarHBondContact O-N 3Å; C449-L452 PolarHBondContact O-N 2.83Å; C449-E453 PolarHBondContact O-N 3.16Å; C449-F467 HydrophobicContact CB-CE2 3.75Å; C449-F467 HydrophobicContact CB-CZ 3.99Å; C449-C472 VanDerWaalsContact CB-SG 3.59Å
450	L	90.1	Very high	84.5	Confident	7 Å²	7	35.4 Å²	35.4	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-43.8	177.4	-178.2	63.9	0	0	0	111.3	D446 L447 A448 L452 E453 W454 W469 C472 L473 I476	D446-L450 WeakPolarHBondContact O-CB 3.49Å; D446-L450 PolarHBondContact O-N 3.36Å; L447-L450 PolarHBondContact O-N 3.16Å; A448-L450 VanDerWaalsContact C-N 3.35Å; A448-L450 PolarHBondContact O-N 2.95Å; L450-L452 PolarHBondContact O-N 3.42Å; L450-E453 PolarHBondContact O-N 3.28Å; L450-W454 HydrophobicContact CD1-CD2 4.09Å; L450-W454 HydrophobicContact CD1-CG 4.41Å; L450-W454 HydrophobicContact CD1-CZ2 4.07Å; L450-W454 HydrophobicContact CD2-CH2 4.26Å; L450-W454 HydrophobicContact CD2-CZ2 4.43Å; L450-W454 HydrophobicContact CD2-CZ3 4.36Å; L450-W454 HydrophobicContact CG-CD2 4.19Å; L450-W454 HydrophobicContact CG-CE3 4.33Å; L450-W454 HydrophobicContact CG-CZ2 4.48Å; L450-W454 WeakPolarHBondContact O-CB 3.02Å; L450-W454 PolarHBondContact O-N 2.94Å; L450-W469 HydrophobicContact CD1-CB 3.86Å; L450-W469 HydrophobicContact CD1-CE3 4.08Å; L450-C472 HydrophobicContact CB-CB 4.01Å; L450-L473 HydrophobicContact CD2-CB 4.48Å; L450-L473 HydrophobicContact CD2-CD1 4.08Å; L450-I476 HydrophobicContact CB-CD1 4.3Å; L450-I476 HydrophobicContact CD2-CD1 3.68Å
451	A	83.9	Confident	84.2	Confident	32 Å²	32	43.6 Å²	43.6	26%	0.264	23%	0.226	S	C	.	.	H	α-helix	trans	-63	-41.3	178.3	0	0	0	0	0	112	L447 A448 C449 A455 I517	L447-A451 WeakPolarHBondContact O-CB 3.42Å; L447-A451 PolarHBondContact O-N 2.79Å; A448-A451 PolarHBondContact O-N 2.93Å; C449-A451 VanDerWaalsContact C-N 3.33Å; C449-A451 PolarHBondContact O-N 3Å; A451-A455 WeakPolarHBondContact O-CB 3.38Å; A451-A455 PolarHBondContact O-N 3.41Å; A451-I517 HydrophobicContact CB-CD1 4.43Å
452	L	81.8	Confident	84	Confident	6 Å²	6	45.1 Å²	45.1	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-64	-44	177.6	-77.2	162.6	0	0	0	112.7	S124 L125 A448 C449 L450 S456 A457 F460 I517	S124-L452 WeakPolarHBondContact O-CD2 3.46Å; L125-L452 HydrophobicContact CD2-CD1 3.78Å; L125-L452 HydrophobicContact CD2-CG 3.9Å; A448-L452 WeakPolarHBondContact O-CG 3.37Å; A448-L452 PolarHBondContact O-N 3.36Å; A448-L452 VanDerWaalsContact O-N 3.08Å; C449-L452 PolarHBondContact O-N 2.83Å; L450-L452 PolarHBondContact O-N 3.42Å; L452-S456 PolarHBondContact O-N 2.9Å; L452-A457 HydrophobicContact CD2-CB 4.34Å; L452-A457 PolarHBondContact O-N 3.45Å; L452-F460 HydrophobicContact CB-CB 4.29Å; L452-F460 HydrophobicContact CB-CD1 3.86Å; L452-F460 HydrophobicContact CB-CD2 3.82Å; L452-F460 HydrophobicContact CB-CE1 4.08Å; L452-F460 HydrophobicContact CB-CE2 4.07Å; L452-F460 HydrophobicContact CB-CG 3.72Å; L452-F460 HydrophobicContact CB-CZ 4.19Å; L452-F460 HydrophobicContact CD1-CD2 3.7Å; L452-F460 HydrophobicContact CD1-CE2 3.74Å; L452-F460 HydrophobicContact CD1-CG 4.45Å; L452-F460 HydrophobicContact CD1-CZ 4.49Å; L452-F460 HydrophobicContact CD2-CB 4.3Å; L452-F460 HydrophobicContact CD2-CD2 4.27Å; L452-F460 HydrophobicContact CD2-CG 4.39Å; L452-F460 HydrophobicContact CG-CD2 4.14Å; L452-F460 HydrophobicContact CG-CE2 4.46Å; L452-F460 HydrophobicContact CG-CG 4.41Å; L452-I517 HydrophobicContact CB-CD1 4.47Å; L452-I517 HydrophobicContact CD2-CD1 3.34Å; L452-I517 HydrophobicContact CD2-CG1 4.1Å; L452-I517 HydrophobicContact CG-CD1 3.58Å
453	E	85.3	Confident	83.7	Confident	75 Å²	75	50.3 Å²	50.3	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-67.5	-46.2	178.8	-171.2	65.9	-170.3	0	0	111.3	C449 L450 A455 S456 F460 W469	C449-E453 PolarHBondContact O-N 3.16Å; L450-E453 PolarHBondContact O-N 3.28Å; E453-A455 VanDerWaalsContact C-N 3.35Å; E453-A455 PolarHBondContact O-N 2.97Å; E453-S456 WeakPolarHBondContact O-CA 3.44Å; E453-S456 PolarHBondContact O-N 3.44Å; E453-F460 HydrophobicContact CB-CE1 4.44Å; E453-F460 WeakPolarHBondContact OE2-CE1 3.3Å; E453-W469 HydrophobicContact CG-CB 4.05Å
454	W	83.9	Confident	83.4	Confident	151 Å²	151	51.7 Å²	51.7	57%	0.572	27%	0.273	S	S	*	.	H	α-helix	trans	-67.2	-32.6	177.3	-82.2	0.4	0	0	0	113.6	L450 S456 W469	L450-W454 HydrophobicContact CD1-CD2 4.09Å; L450-W454 HydrophobicContact CD1-CG 4.41Å; L450-W454 HydrophobicContact CD1-CZ2 4.07Å; L450-W454 HydrophobicContact CD2-CH2 4.26Å; L450-W454 HydrophobicContact CD2-CZ2 4.43Å; L450-W454 HydrophobicContact CD2-CZ3 4.36Å; L450-W454 HydrophobicContact CG-CD2 4.19Å; L450-W454 HydrophobicContact CG-CE3 4.33Å; L450-W454 HydrophobicContact CG-CZ2 4.48Å; L450-W454 WeakPolarHBondContact O-CB 3.02Å; L450-W454 PolarHBondContact O-N 2.94Å; W454-S456 PolarHBondContact O-N 2.92Å; W454-W469 HydrophobicContact CZ2-CE3 4.11Å; W454-W469 HydrophobicContact CZ2-CZ3 4.05Å; W454-W469 AromaticContact NE1-CE3 3.74Å
455	A	76	Confident	83.2	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.033	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.9	171.3	0	0	0	0	0	112.4	A451 E453 A457 L521	A451-A455 WeakPolarHBondContact O-CB 3.38Å; A451-A455 PolarHBondContact O-N 3.41Å; E453-A455 VanDerWaalsContact C-N 3.35Å; E453-A455 PolarHBondContact O-N 2.97Å; A455-A457 HydrophobicContact CB-CB 4.41Å; A455-A457 PolarHBondContact O-N 3.43Å; A455-L521 HydrophobicContact CB-CD2 3.45Å; A455-L521 VanDerWaalsContact CB-CD2 3.45Å; A455-L521 HydrophobicContact CB-CG 3.98Å
456	S	77.1	Confident	83.2	Confident	84 Å²	84	65.9 Å²	65.9	59%	0.587	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	42.7	-169.3	-59.5	0	0	0	0	110.8	L452 E453 W454 P458	L452-S456 PolarHBondContact O-N 2.9Å; E453-S456 WeakPolarHBondContact O-CA 3.44Å; E453-S456 PolarHBondContact O-N 3.44Å; W454-S456 PolarHBondContact O-N 2.92Å; S456-P458 WeakPolarHBondContact O-CD 3.47Å
457	A	68.8	Low	83.1	Confident	14 Å²	14	67 Å²	67	12%	0.116	35%	0.346	C	S	.	.			trans	-60.9	120.6	-175.5	0	0	0	0	0	109.1	L452 A455 N459 F460	L452-A457 HydrophobicContact CD2-CB 4.34Å; L452-A457 PolarHBondContact O-N 3.45Å; A455-A457 HydrophobicContact CB-CB 4.41Å; A455-A457 PolarHBondContact O-N 3.43Å; A457-N459 PolarHBondContact O-N 2.84Å; A457-F460 HydrophobicContact CB-CB 4.1Å; A457-F460 WeakPolarHBondContact O-CB 3.36Å; A457-F460 PolarHBondContact O-N 3.36Å
458	P	70.8	Confident	83.2	Confident	90 Å²	90	64.4 Å²	64.4	58%	0.584	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24.3	-173.6	-26.5	34.3	0	0	0	114.5	S456 R461	S456-P458 WeakPolarHBondContact O-CD 3.47Å; P458-R461 PolarHBondContact O-NE 3.42Å; P458-R461 PolarHBondContact O-NH2 3.36Å
459	N	74.9	Confident	83.4	Confident	143 Å²	143	68.5 Å²	68.5	77%	0.765	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-11.1	179.2	-63.5	-13.7	0	0	0	112.8	N109 A457	N109-N459 PolarHBondContact OD1-O 2.89Å; A457-N459 PolarHBondContact O-N 2.84Å
460	F	79.8	Confident	83.7	Confident	15 Å²	15	73.9 Å²	73.9	7%	0.066	38%	0.375	C	S	.	.			trans	-91.1	100	173.8	-171	-107.8	0	0	0	109.1	N109 L452 E453 A457 P462 F467	N109-F460 HydrophobicContact CB-CD2 4.36Å; N109-F460 HydrophobicContact CB-CE2 4.42Å; N109-F460 WeakPolarHBondContact ND2-CD2 3.47Å; N109-F460 WeakPolarHBondContact OD1-CA 3.4Å; L452-F460 HydrophobicContact CB-CB 4.29Å; L452-F460 HydrophobicContact CB-CD1 3.86Å; L452-F460 HydrophobicContact CB-CD2 3.82Å; L452-F460 HydrophobicContact CB-CE1 4.08Å; L452-F460 HydrophobicContact CB-CE2 4.07Å; L452-F460 HydrophobicContact CB-CG 3.72Å; L452-F460 HydrophobicContact CB-CZ 4.19Å; L452-F460 HydrophobicContact CD1-CD2 3.7Å; L452-F460 HydrophobicContact CD1-CE2 3.74Å; L452-F460 HydrophobicContact CD1-CG 4.45Å; L452-F460 HydrophobicContact CD1-CZ 4.49Å; L452-F460 HydrophobicContact CD2-CB 4.3Å; L452-F460 HydrophobicContact CD2-CD2 4.27Å; L452-F460 HydrophobicContact CD2-CG 4.39Å; L452-F460 HydrophobicContact CG-CD2 4.14Å; L452-F460 HydrophobicContact CG-CE2 4.46Å; L452-F460 HydrophobicContact CG-CG 4.41Å; E453-F460 HydrophobicContact CB-CE1 4.44Å; E453-F460 WeakPolarHBondContact OE2-CE1 3.3Å; A457-F460 HydrophobicContact CB-CB 4.1Å; A457-F460 WeakPolarHBondContact O-CB 3.36Å; A457-F460 PolarHBondContact O-N 3.36Å; F460-P462 HydrophobicContact CD1-CG 4.35Å; F460-P462 HydrophobicContact CE1-CG 3.82Å; F460-P462 HydrophobicContact CZ-CG 4.04Å; F460-F467 AromaticContact CE1-CE1 3.81Å; F460-F467 HydrophobicContact CE1-CE1 3.81Å; F460-F467 AromaticContact CE1-CZ 3.94Å; F460-F467 HydrophobicContact CE1-CZ 3.94Å; F460-F467 HydrophobicContact CZ-CE1 4.06Å; F460-F467 AromaticContact CZ-CZ 3.87Å; F460-F467 HydrophobicContact CZ-CZ 3.87Å
461	R	84.8	Confident	84	Confident	180 Å²	180	74.9 Å²	74.9	68%	0.679	38%	0.381	S	S	*	.			trans	-134.2	69.3	-178.9	-60.6	-176.3	-167.2	-176.3	3.3	109.9	N109 P458 T463	N109-R461 PolarHBondContact OD1-N 3.11Å; P458-R461 PolarHBondContact O-NE 3.42Å; P458-R461 PolarHBondContact O-NH2 3.36Å; R461-T463 PolarHBondContact O-N 3.49Å
462	P	86.2	Confident	84.4	Confident	33 Å²	33	73.4 Å²	73.4	21%	0.214	37%	0.368	C	S	.	.			trans	-61.2	128.1	179.8	26.7	-33.9	0	0	0	109.7	A105 F460 F464 F467	A105-P462 HydrophobicContact CB-CB 3.92Å; F460-P462 HydrophobicContact CD1-CG 4.35Å; F460-P462 HydrophobicContact CE1-CG 3.82Å; F460-P462 HydrophobicContact CZ-CG 4.04Å; P462-F464 VanDerWaalsContact C-N 3.29Å; P462-F467 HydrophobicContact CB-CD1 4.44Å; P462-F467 HydrophobicContact CG-CD1 3.85Å; P462-F467 HydrophobicContact CG-CE1 4Å
463	T	86.1	Confident	85.1	Confident	110 Å²	110	76.8 Å²	76.8	68%	0.675	39%	0.386	S	S	*	.			trans	-84.5	-8.9	175.1	55.2	0	0	0	0	112.5	T108 R461 Q465	T108-T463 WeakPolarHBondContact CB-OG1 3.41Å; R461-T463 PolarHBondContact O-N 3.49Å; T463-Q465 PolarHBondContact O-N 3.31Å
464	F	87.3	Confident	85.6	Confident	34 Å²	34	77.3 Å²	77.3	15%	0.149	39%	0.391	C	S	.	.			trans	-76.3	118	177.9	-172.9	-108.1	0	0	0	112.1	L101 C104 T108 P312 I316 P462 L466 F467	L101-F464 HydrophobicContact CB-CE1 4.46Å; L101-F464 HydrophobicContact CD2-CE1 3.58Å; L101-F464 HydrophobicContact CD2-CZ 3.95Å; C104-F464 HydrophobicContact CB-CB 4.47Å; C104-F464 HydrophobicContact CB-CD1 3.58Å; C104-F464 HydrophobicContact CB-CD2 4Å; C104-F464 HydrophobicContact CB-CE1 3.63Å; C104-F464 HydrophobicContact CB-CE2 4.07Å; C104-F464 HydrophobicContact CB-CG 3.76Å; C104-F464 HydrophobicContact CB-CZ 3.89Å; T108-F464 HydrophobicContact CG2-CB 4.1Å; T108-F464 WeakPolarHBondContact OG1-CB 3.34Å; T108-F464 PolarHBondContact OG1-N 3.47Å; P312-F464 HydrophobicContact CB-CD2 4.48Å; P312-F464 HydrophobicContact CB-CE2 4.46Å; I316-F464 HydrophobicContact CD1-CE2 4.09Å; I316-F464 HydrophobicContact CD1-CZ 3.95Å; P462-F464 VanDerWaalsContact C-N 3.29Å; F464-L466 HydrophobicContact CD1-CB 4.41Å; F464-L466 HydrophobicContact CE1-CB 3.67Å; F464-L466 HydrophobicContact CZ-CB 3.9Å; F464-L466 HydrophobicContact CZ-CD1 4.09Å; F464-L466 HydrophobicContact CZ-CG 4.36Å; F464-F467 HydrophobicContact CD1-CB 4.05Å
465	Q	84.7	Confident	86.1	Confident	187 Å²	187	70.1 Å²	70.1	87%	0.874	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-24.3	-167.9	-64.5	179.7	-8.2	0	0	115.5	T463 F467	T463-Q465 PolarHBondContact O-N 3.31Å; Q465-F467 PolarHBondContact O-N 3.14Å
466	L	88.9	Confident	87.1	Confident	120 Å²	120	71 Å²	71	63%	0.628	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	2.4	-177.7	-63.4	172.5	0	0	0	113	L101 F464	L101-L466 HydrophobicContact CD2-CB 3.82Å; F464-L466 HydrophobicContact CD1-CB 4.41Å; F464-L466 HydrophobicContact CE1-CB 3.67Å; F464-L466 HydrophobicContact CZ-CB 3.9Å; F464-L466 HydrophobicContact CZ-CD1 4.09Å; F464-L466 HydrophobicContact CZ-CG 4.36Å
467	F	91.6	Very high	88	Confident	23 Å²	23	72.1 Å²	72.1	10%	0.101	37%	0.366	C	S	.	.			trans	-85	136.5	177.6	170	-99	0	0	0	111.3	A105 C449 F460 P462 F464 Q465 C472	A105-F467 HydrophobicContact CB-CB 3.87Å; A105-F467 HydrophobicContact CB-CD1 3.97Å; A105-F467 HydrophobicContact CB-CD2 3.22Å; A105-F467 HydrophobicContact CB-CE1 4.32Å; A105-F467 HydrophobicContact CB-CE2 3.58Å; A105-F467 HydrophobicContact CB-CG 3.41Å; A105-F467 VanDerWaalsContact CB-CG 3.41Å; A105-F467 HydrophobicContact CB-CZ 4.14Å; C449-F467 HydrophobicContact CB-CE2 3.75Å; C449-F467 HydrophobicContact CB-CZ 3.99Å; F460-F467 AromaticContact CE1-CE1 3.81Å; F460-F467 HydrophobicContact CE1-CE1 3.81Å; F460-F467 AromaticContact CE1-CZ 3.94Å; F460-F467 HydrophobicContact CE1-CZ 3.94Å; F460-F467 HydrophobicContact CZ-CE1 4.06Å; F460-F467 AromaticContact CZ-CZ 3.87Å; F460-F467 HydrophobicContact CZ-CZ 3.87Å; P462-F467 HydrophobicContact CB-CD1 4.44Å; P462-F467 HydrophobicContact CG-CD1 3.85Å; P462-F467 HydrophobicContact CG-CE1 4Å; F464-F467 HydrophobicContact CD1-CB 4.05Å; Q465-F467 PolarHBondContact O-N 3.14Å; F467-C472 WeakPolarHBondContact CE2-SG 3.49Å
468	S	92.4	Very high	89.3	Confident	38 Å²	38	72.9 Å²	72.9	27%	0.266	37%	0.371	S	S	.	.			trans	-148.7	160	170.9	69.2	0	0	0	0	111.3	H470 T471 C472	S468-H470 PolarHBondContact O-N 2.84Å; S468-T471 PolarHBondContact N-OG1 3.34Å; S468-T471 VanDerWaalsContact N-OG1 3.08Å; S468-T471 PolarHBondContact O-N 3.48Å; S468-T471 PolarHBondContact O-OG1 2.97Å; S468-T471 WeakPolarHBondContact OG-CG2 3.46Å; S468-T471 PolarHBondContact OG-N 3.25Å; S468-T471 PolarHBondContact OG-OG1 3.27Å; S468-T471 VanDerWaalsContact OG-OG1 3.09Å; S468-C472 PolarHBondContact O-N 2.86Å
469	W	90.1	Very high	90.4	Very high	93 Å²	93	68.6 Å²	68.6	35%	0.352	34%	0.343	S	S	.	.	H	α-helix	trans	-61.4	-31.1	174	76.9	-90.6	0	0	0	112.5	L450 E453 W454 C472 L473	L450-W469 HydrophobicContact CD1-CB 3.86Å; L450-W469 HydrophobicContact CD1-CE3 4.08Å; E453-W469 HydrophobicContact CG-CB 4.05Å; W454-W469 HydrophobicContact CZ2-CE3 4.11Å; W454-W469 HydrophobicContact CZ2-CZ3 4.05Å; W454-W469 AromaticContact NE1-CE3 3.74Å; W469-C472 PolarHBondContact O-N 3.47Å; W469-L473 HydrophobicContact CZ3-CD2 3.93Å; W469-L473 PolarHBondContact O-N 3.49Å
470	H	94.3	Very high	91.4	Very high	113 Å²	113	64.6 Å²	64.6	52%	0.523	32%	0.322	S	S	.	.	H	α-helix	trans	-64	-44.1	176.7	-63.2	-71.8	0	0	0	112.1	S468 C472 L473 L474	S468-H470 PolarHBondContact O-N 2.84Å; H470-C472 VanDerWaalsContact C-N 3.29Å; H470-C472 PolarHBondContact O-N 2.9Å; H470-L473 PolarHBondContact O-N 2.89Å; H470-L474 WeakPolarHBondContact O-CB 3.43Å; H470-L474 PolarHBondContact O-N 3.44Å
471	T	94.8	Very high	92.2	Very high	28 Å²	28	67.6 Å²	67.6	17%	0.172	34%	0.341	C	S	.	.	H	α-helix	trans	-63.6	-37.1	178.4	44.7	0	0	0	0	111.6	L98 L101 S468 G475	L98-T471 HydrophobicContact CD2-CG2 4.24Å; L101-T471 HydrophobicContact CD1-CG2 3.97Å; S468-T471 PolarHBondContact N-OG1 3.34Å; S468-T471 VanDerWaalsContact N-OG1 3.08Å; S468-T471 PolarHBondContact O-N 3.48Å; S468-T471 PolarHBondContact O-OG1 2.97Å; S468-T471 WeakPolarHBondContact OG-CG2 3.46Å; S468-T471 PolarHBondContact OG-N 3.25Å; S468-T471 PolarHBondContact OG-OG1 3.27Å; S468-T471 VanDerWaalsContact OG-OG1 3.09Å; T471-G475 PolarHBondContact O-N 3.4Å
472	C	94.1	Very high	92.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.8	-46.7	174.2	-60.8	0	0	0	0	111.8	S102 D446 C449 L450 F467 S468 W469 H470 L474 G475 I476	S102-C472 PolarHBondContact OG-SG 2.92Å; S102-C472 VanDerWaalsContact OG-SG 3.37Å; D446-C472 WeakPolarHBondContact O-CB 3.48Å; C449-C472 VanDerWaalsContact CB-SG 3.59Å; L450-C472 HydrophobicContact CB-CB 4.01Å; F467-C472 WeakPolarHBondContact CE2-SG 3.49Å; S468-C472 PolarHBondContact O-N 2.86Å; W469-C472 PolarHBondContact O-N 3.47Å; H470-C472 VanDerWaalsContact C-N 3.29Å; H470-C472 PolarHBondContact O-N 2.9Å; C472-L474 VanDerWaalsContact C-N 3.31Å; C472-L474 PolarHBondContact O-N 2.9Å; C472-G475 PolarHBondContact O-N 2.94Å; C472-G475 VanDerWaalsContact O-N 3.1Å; C472-I476 VanDerWaalsContact O-CG1 3.3Å; C472-I476 WeakPolarHBondContact O-CG1 3.44Å; C472-I476 PolarHBondContact O-N 2.93Å
473	L	95.1	Very high	92.9	Very high	77 Å²	77	58.3 Å²	58.3	40%	0.403	30%	0.302	S	S	.	.	H	α-helix	trans	-60	-43	178.1	-176	68.2	0	0	0	111.8	L450 W469 H470 G475 I476 L477	L450-L473 HydrophobicContact CD2-CB 4.48Å; L450-L473 HydrophobicContact CD2-CD1 4.08Å; W469-L473 HydrophobicContact CZ3-CD2 3.93Å; W469-L473 PolarHBondContact O-N 3.49Å; H470-L473 PolarHBondContact O-N 2.89Å; L473-G475 VanDerWaalsContact C-N 3.32Å; L473-I476 PolarHBondContact O-N 3.38Å; L473-L477 WeakPolarHBondContact O-CB 3.28Å; L473-L477 PolarHBondContact O-N 3.24Å
474	L	95.9	Very high	93.3	Very high	87 Å²	87	57.4 Å²	57.4	46%	0.455	29%	0.289	S	S	.	.	H	α-helix	trans	-62.6	-40.2	175	-167.5	87.4	0	0	0	111.2	L98 H470 C472 L477 S478	L98-L474 HydrophobicContact CD1-CB 4.26Å; L98-L474 HydrophobicContact CD1-CD2 3.55Å; L98-L474 HydrophobicContact CD1-CG 3.95Å; L98-L474 HydrophobicContact CD2-CB 4.49Å; L98-L474 HydrophobicContact CD2-CD2 3.77Å; L98-L474 HydrophobicContact CG-CD2 4.28Å; H470-L474 WeakPolarHBondContact O-CB 3.43Å; H470-L474 PolarHBondContact O-N 3.44Å; C472-L474 VanDerWaalsContact C-N 3.31Å; C472-L474 PolarHBondContact O-N 2.9Å; L474-L477 PolarHBondContact O-N 3.49Å; L474-S478 VanDerWaalsContact O-CB 3.26Å; L474-S478 WeakPolarHBondContact O-CB 3.14Å; L474-S478 PolarHBondContact O-N 2.73Å; L474-S478 PolarHBondContact O-OG 3.01Å
475	G	95.8	Very high	93.6	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-49.4	176.2	0	0	0	0	0	112.4	D446 T471 C472 L473 L477 S478 C479	D446-G475 WeakPolarHBondContact OD2-CA 3.21Å; T471-G475 PolarHBondContact O-N 3.4Å; C472-G475 PolarHBondContact O-N 2.94Å; C472-G475 VanDerWaalsContact O-N 3.1Å; L473-G475 VanDerWaalsContact C-N 3.32Å; G475-L477 PolarHBondContact O-N 2.86Å; G475-S478 PolarHBondContact O-N 3.36Å; G475-C479 WeakPolarHBondContact O-CB 3.35Å; G475-C479 PolarHBondContact O-N 3.32Å; G475-C479 PolarHBondContact O-SG 3.26Å
476	I	95.9	Very high	93.9	Very high	22 Å²	22	50.8 Å²	50.8	11%	0.113	26%	0.264	C	S	.	.	H	α-helix	trans	-56.9	-51.6	175.4	-62.1	162.5	0	0	0	110.3	D446 L447 L450 C472 L473 S478 C479 L480	D446-I476 HydrophobicContact CB-CD1 4.42Å; D446-I476 HydrophobicContact CB-CG1 3.58Å; L447-I476 VanDerWaalsContact CA-CD1 3.46Å; L447-I476 HydrophobicContact CB-CD1 3.92Å; L447-I476 HydrophobicContact CB-CG1 4.25Å; L447-I476 HydrophobicContact CD1-CD1 4.09Å; L450-I476 HydrophobicContact CB-CD1 4.3Å; L450-I476 HydrophobicContact CD2-CD1 3.68Å; C472-I476 VanDerWaalsContact O-CG1 3.3Å; C472-I476 WeakPolarHBondContact O-CG1 3.44Å; C472-I476 PolarHBondContact O-N 2.93Å; L473-I476 PolarHBondContact O-N 3.38Å; I476-S478 PolarHBondContact O-N 3.4Å; I476-C479 PolarHBondContact O-N 3.16Å; I476-L480 HydrophobicContact CG2-CD1 3.82Å; I476-L480 HydrophobicContact CG2-CG 4.35Å; I476-L480 WeakPolarHBondContact O-CB 3.21Å; I476-L480 WeakPolarHBondContact O-CG 3.33Å; I476-L480 PolarHBondContact O-N 3.45Å
477	L	96.6	Very high	93.9	Very high	107 Å²	107	47 Å²	47	56%	0.56	24%	0.244	S	C	*	.	H	α-helix	trans	-62.1	-45.1	-177.5	-175.6	65.4	0	0	0	111.2	L473 L474 G475 C479 L480 V481	L473-L477 WeakPolarHBondContact O-CB 3.28Å; L473-L477 PolarHBondContact O-N 3.24Å; L474-L477 PolarHBondContact O-N 3.49Å; G475-L477 PolarHBondContact O-N 2.86Å; L477-C479 PolarHBondContact O-N 2.84Å; L477-L480 PolarHBondContact O-N 3Å; L477-V481 HydrophobicContact CD1-CG2 4.23Å; L477-V481 HydrophobicContact CG-CG2 4.41Å; L477-V481 WeakPolarHBondContact O-CB 3.37Å; L477-V481 VanDerWaalsContact O-CG2 3.24Å; L477-V481 WeakPolarHBondContact O-CG2 3.48Å; L477-V481 PolarHBondContact O-N 3.18Å
478	S	95.4	Very high	93.9	Very high	30 Å²	30	49.5 Å²	49.5	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-65.1	-40.7	-179.3	-55.6	0	0	0	0	111.8	L474 G475 I476 M482	L474-S478 VanDerWaalsContact O-CB 3.26Å; L474-S478 WeakPolarHBondContact O-CB 3.14Å; L474-S478 PolarHBondContact O-N 2.73Å; L474-S478 PolarHBondContact O-OG 3.01Å; G475-S478 PolarHBondContact O-N 3.36Å; I476-S478 PolarHBondContact O-N 3.4Å; S478-M482 WeakPolarHBondContact O-CB 3.34Å; S478-M482 PolarHBondContact O-N 2.88Å; S478-M482 VanDerWaalsContact O-N 3.12Å
479	C	95.1	Very high	93.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64	-49.3	175.3	-69.7	0	0	0	0	111.6	I95 L439 A443 G475 I476 L477 M482 M483	I95-C479 VanDerWaalsContact CG2-SG 3.53Å; L439-C479 HydrophobicContact CD2-CB 4.45Å; A443-C479 HydrophobicContact CB-CB 3.71Å; G475-C479 WeakPolarHBondContact O-CB 3.35Å; G475-C479 PolarHBondContact O-N 3.32Å; G475-C479 PolarHBondContact O-SG 3.26Å; I476-C479 PolarHBondContact O-N 3.16Å; L477-C479 PolarHBondContact O-N 2.84Å; C479-M482 PolarHBondContact O-N 3.28Å; C479-M483 VanDerWaalsContact O-CB 3.23Å; C479-M483 WeakPolarHBondContact O-CB 3.34Å; C479-M483 PolarHBondContact O-N 3.03Å
480	L	95.1	Very high	94	Very high	60 Å²	60	52.6 Å²	52.6	31%	0.314	28%	0.281	S	S	.	.	H	α-helix	trans	-63.5	-44.6	-178.4	-71	177.6	0	0	0	111.9	I476 L477 M483 F484	I476-L480 HydrophobicContact CG2-CD1 3.82Å; I476-L480 HydrophobicContact CG2-CG 4.35Å; I476-L480 WeakPolarHBondContact O-CB 3.21Å; I476-L480 WeakPolarHBondContact O-CG 3.33Å; I476-L480 PolarHBondContact O-N 3.45Å; L477-L480 PolarHBondContact O-N 3Å; L480-M483 HydrophobicContact CD2-CE 4.09Å; L480-M483 PolarHBondContact O-N 2.89Å; L480-F484 WeakPolarHBondContact O-CD2 3.39Å; L480-F484 PolarHBondContact O-N 3.44Å; L480-F484 VanDerWaalsContact O-N 3.17Å
481	V	95.4	Very high	93.9	Very high	77 Å²	77	47.2 Å²	47.2	47%	0.467	26%	0.256	S	S	.	.	H	α-helix	trans	-59.3	-51.2	177.1	169.4	0	0	0	0	110.4	L477 M483 F484 V485	L477-V481 HydrophobicContact CD1-CG2 4.23Å; L477-V481 HydrophobicContact CG-CG2 4.41Å; L477-V481 WeakPolarHBondContact O-CB 3.37Å; L477-V481 VanDerWaalsContact O-CG2 3.24Å; L477-V481 WeakPolarHBondContact O-CG2 3.48Å; L477-V481 PolarHBondContact O-N 3.18Å; V481-M483 VanDerWaalsContact C-N 3.32Å; V481-M483 PolarHBondContact O-N 3.31Å; V481-F484 PolarHBondContact O-N 2.95Å; V481-V485 HydrophobicContact CG1-CG2 4.38Å; V481-V485 VanDerWaalsContact O-CG2 3.28Å; V481-V485 WeakPolarHBondContact O-CG2 3.4Å; V481-V485 PolarHBondContact O-N 2.86Å
482	M	93.4	Very high	93.9	Very high	18 Å²	18	48.6 Å²	48.6	9%	0.089	27%	0.266	C	S	.	.	H	α-helix	trans	-66	-34.7	-178.7	-74.5	-48.3	-59.3	0	0	113.1	V91 I95 F280 F284 L439 S478 C479 V485 I486	V91-M482 HydrophobicContact CG1-CG 4.26Å; V91-M482 HydrophobicContact CG1-SD 4.22Å; I95-M482 HydrophobicContact CD1-CB 4.09Å; I95-M482 HydrophobicContact CD1-CG 3.57Å; F280-M482 HydrophobicContact CE1-CE 4.32Å; F284-M482 HydrophobicContact CD1-CE 3.44Å; F284-M482 VanDerWaalsContact CD1-CE 3.44Å; F284-M482 HydrophobicContact CD2-CE 4.03Å; F284-M482 HydrophobicContact CE1-CB 4.42Å; F284-M482 HydrophobicContact CE1-CE 3.37Å; F284-M482 HydrophobicContact CE1-CG 4.48Å; F284-M482 HydrophobicContact CE2-CE 3.97Å; F284-M482 HydrophobicContact CG-CE 3.79Å; F284-M482 HydrophobicContact CZ-CE 3.64Å; F284-M482 HydrophobicContact CZ-CG 4.42Å; L439-M482 HydrophobicContact CD1-CB 4.24Å; S478-M482 WeakPolarHBondContact O-CB 3.34Å; S478-M482 PolarHBondContact O-N 2.88Å; S478-M482 VanDerWaalsContact O-N 3.12Å; C479-M482 PolarHBondContact O-N 3.28Å; M482-V485 HydrophobicContact CE-CB 4.47Å; M482-V485 HydrophobicContact CE-CG1 4.24Å; M482-V485 PolarHBondContact O-N 3.44Å; M482-I486 WeakPolarHBondContact O-CD1 3.29Å; M482-I486 VanDerWaalsContact O-CG1 3.28Å; M482-I486 WeakPolarHBondContact O-CG1 3.48Å; M482-I486 PolarHBondContact O-N 2.8Å
483	M	93.8	Very high	93.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.6	-50.6	176.3	-164.9	-177.2	73.8	0	0	110.9	V436 L439 L440 C479 L480 V481 V485 I486 N487 S491 I495	V436-M483 HydrophobicContact CB-CG 4.34Å; V436-M483 HydrophobicContact CG1-CG 3.84Å; V436-M483 HydrophobicContact CG1-SD 4.09Å; V436-M483 HydrophobicContact CG2-CG 4.24Å; L439-M483 HydrophobicContact CB-CB 4.3Å; L439-M483 HydrophobicContact CB-CG 4.39Å; L439-M483 HydrophobicContact CD1-CB 4.17Å; L440-M483 HydrophobicContact CB-SD 3.94Å; L440-M483 HydrophobicContact CD1-SD 4.36Å; C479-M483 VanDerWaalsContact O-CB 3.23Å; C479-M483 WeakPolarHBondContact O-CB 3.34Å; C479-M483 PolarHBondContact O-N 3.03Å; L480-M483 HydrophobicContact CD2-CE 4.09Å; L480-M483 PolarHBondContact O-N 2.89Å; V481-M483 VanDerWaalsContact C-N 3.32Å; V481-M483 PolarHBondContact O-N 3.31Å; M483-V485 PolarHBondContact O-N 3.08Å; M483-I486 PolarHBondContact O-N 3.49Å; M483-N487 PolarHBondContact O-N 3.49Å; M483-S491 WeakPolarHBondContact CG-OG 3.2Å; M483-S491 PolarHBondContact O-OG 2.89Å; M483-I495 HydrophobicContact CE-CD1 3.49Å; M483-I495 VanDerWaalsContact CE-CD1 3.49Å; M483-I495 HydrophobicContact CE-CG1 3.73Å
484	F	94.3	Very high	93.7	Very high	91 Å²	91	47.2 Å²	47.2	40%	0.399	27%	0.27	S	S	.	.	H	α-helix	trans	-68.6	-30.8	177.2	-81.2	-76.2	0	0	0	113.7	L480 V481 I486 P488 I495	L480-F484 WeakPolarHBondContact O-CD2 3.39Å; L480-F484 PolarHBondContact O-N 3.44Å; L480-F484 VanDerWaalsContact O-N 3.17Å; V481-F484 PolarHBondContact O-N 2.95Å; F484-I486 VanDerWaalsContact C-N 3.32Å; F484-P488 HydrophobicContact CD1-CB 4.35Å; F484-P488 WeakPolarHBondContact O-CD 3.41Å; F484-P488 WeakPolarHBondContact O-CG 3.37Å; F484-I495 HydrophobicContact CE2-CD1 3.84Å; F484-I495 HydrophobicContact CZ-CD1 3.75Å
485	V	93.3	Very high	93.6	Very high	66 Å²	66	45.2 Å²	45.2	40%	0.4	26%	0.259	S	S	.	.	H	α-helix	trans	-64.3	-37.7	172.9	168.2	0	0	0	0	111.3	A281 V481 M482 M483	A281-V485 HydrophobicContact CB-CG1 4.31Å; A281-V485 WeakPolarHBondContact CB-O 3.09Å; V481-V485 HydrophobicContact CG1-CG2 4.38Å; V481-V485 VanDerWaalsContact O-CG2 3.28Å; V481-V485 WeakPolarHBondContact O-CG2 3.4Å; V481-V485 PolarHBondContact O-N 2.86Å; M482-V485 HydrophobicContact CE-CB 4.47Å; M482-V485 HydrophobicContact CE-CG1 4.24Å; M482-V485 PolarHBondContact O-N 3.44Å; M483-V485 PolarHBondContact O-N 3.08Å
486	I	90.1	Very high	93.6	Very high	17 Å²	17	49.1 Å²	49.1	9%	0.087	28%	0.283	C	S	.	.	H	α-helix	trans	-69.1	-59.7	-179.6	-70.2	157.3	0	0	0	111.2	F284 A285 T435 V436 L439 M482 M483 F484	F284-I486 HydrophobicContact CD1-CD1 3.98Å; F284-I486 HydrophobicContact CD1-CG1 4.1Å; F284-I486 HydrophobicContact CE1-CD1 4.1Å; A285-I486 HydrophobicContact CB-CG1 4.26Å; A285-I486 HydrophobicContact CB-CG2 3.76Å; T435-I486 HydrophobicContact CG2-CD1 3.41Å; T435-I486 VanDerWaalsContact CG2-CD1 3.41Å; V436-I486 HydrophobicContact CG2-CG2 4.45Å; L439-I486 HydrophobicContact CD1-CD1 3.56Å; M482-I486 WeakPolarHBondContact O-CD1 3.29Å; M482-I486 VanDerWaalsContact O-CG1 3.28Å; M482-I486 WeakPolarHBondContact O-CG1 3.48Å; M482-I486 PolarHBondContact O-N 2.8Å; M483-I486 PolarHBondContact O-N 3.49Å; F484-I486 VanDerWaalsContact C-N 3.32Å
487	N	89.2	Confident	93.4	Very high	40 Å²	40	51.3 Å²	51.3	21%	0.214	29%	0.294	C	S	.	.			trans	-157.1	106.4	-179.7	-170.1	-45.2	0	0	0	110.9	M483 V489 Y490 S491	M483-N487 PolarHBondContact O-N 3.49Å; N487-V489 VanDerWaalsContact C-N 3.27Å; N487-V489 PolarHBondContact O-N 3.24Å; N487-V489 WeakPolarHBondContact OD1-CA 3.29Å; N487-V489 WeakPolarHBondContact OD1-CB 3.44Å; N487-V489 PolarHBondContact OD1-N 3.02Å; N487-Y490 HydrophobicContact CB-CD2 3.93Å; N487-Y490 HydrophobicContact CB-CG 4.44Å; N487-Y490 VanDerWaalsContact ND2-CD2 3.31Å; N487-Y490 WeakPolarHBondContact ND2-CD2 3.34Å; N487-Y490 VanDerWaalsContact ND2-CE2 3.34Å; N487-Y490 WeakPolarHBondContact ND2-CE2 3.5Å; N487-Y490 PolarHBondContact OD1-N 3.48Å; N487-Y490 VanDerWaalsContact OD1-N 3.17Å; N487-S491 VanDerWaalsContact O-CB 3.24Å; N487-S491 WeakPolarHBondContact O-CB 3.29Å; N487-S491 PolarHBondContact O-N 2.79Å; N487-S491 PolarHBondContact O-OG 2.94Å
488	P	92.7	Very high	93.2	Very high	76 Å²	76	47.2 Å²	47.2	49%	0.494	27%	0.273	S	S	.	.	H	α-helix	trans	-59.9	-33.6	-180	-25.3	33.3	0	0	0	114.3	F484 S492	F484-P488 HydrophobicContact CD1-CB 4.35Å; F484-P488 WeakPolarHBondContact O-CD 3.41Å; F484-P488 WeakPolarHBondContact O-CG 3.37Å; P488-S492 WeakPolarHBondContact O-CB 3.19Å; P488-S492 PolarHBondContact O-N 3.38Å; P488-S492 PolarHBondContact O-OG 2.71Å
489	V	92.2	Very high	92.9	Very high	105 Å²	105	50.8 Å²	50.8	64%	0.636	29%	0.289	S	S	*	.	H	α-helix	trans	-69.5	-55.5	-176.7	-178.3	0	0	0	0	110.1	N487 S491 S492 G493	N487-V489 VanDerWaalsContact C-N 3.27Å; N487-V489 PolarHBondContact O-N 3.24Å; N487-V489 WeakPolarHBondContact OD1-CA 3.29Å; N487-V489 WeakPolarHBondContact OD1-CB 3.44Å; N487-V489 PolarHBondContact OD1-N 3.02Å; V489-S491 VanDerWaalsContact C-N 3.26Å; V489-S491 PolarHBondContact O-N 3.04Å; V489-S492 PolarHBondContact O-N 3.47Å; V489-S492 PolarHBondContact O-OG 3.31Å; V489-G493 PolarHBondContact O-N 3.4Å; V489-G493 VanDerWaalsContact O-N 3.09Å
490	Y	91.2	Very high	92.8	Very high	91 Å²	91	55.7 Å²	55.7	36%	0.357	32%	0.315	S	S	.	.	H	α-helix	trans	-63.2	-34	177.4	-59.4	-30.4	0	0	0	112.4	L433 N487 S494	L433-Y490 HydrophobicContact CD1-CG 4.33Å; N487-Y490 HydrophobicContact CB-CD2 3.93Å; N487-Y490 HydrophobicContact CB-CG 4.44Å; N487-Y490 VanDerWaalsContact ND2-CD2 3.31Å; N487-Y490 WeakPolarHBondContact ND2-CD2 3.34Å; N487-Y490 VanDerWaalsContact ND2-CE2 3.34Å; N487-Y490 WeakPolarHBondContact ND2-CE2 3.5Å; N487-Y490 PolarHBondContact OD1-N 3.48Å; N487-Y490 VanDerWaalsContact OD1-N 3.17Å; Y490-S494 WeakPolarHBondContact O-CB 3.28Å; Y490-S494 PolarHBondContact O-N 3.09Å; Y490-S494 PolarHBondContact O-OG 2.78Å
491	S	93.1	Very high	92.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-53.1	175.9	-61	0	0	0	0	112.7	M483 N487 V489 G493 S494 I495	M483-S491 WeakPolarHBondContact CG-OG 3.2Å; M483-S491 PolarHBondContact O-OG 2.89Å; N487-S491 VanDerWaalsContact O-CB 3.24Å; N487-S491 WeakPolarHBondContact O-CB 3.29Å; N487-S491 PolarHBondContact O-N 2.79Å; N487-S491 PolarHBondContact O-OG 2.94Å; V489-S491 VanDerWaalsContact C-N 3.26Å; V489-S491 PolarHBondContact O-N 3.04Å; S491-G493 PolarHBondContact O-N 3.36Å; S491-S494 PolarHBondContact O-N 3.47Å; S491-I495 WeakPolarHBondContact O-CG1 3.37Å; S491-I495 PolarHBondContact O-N 3.32Å
492	S	93.9	Very high	92.1	Very high	57 Å²	57	52 Å²	52	40%	0.399	29%	0.292	S	S	.	.	H	α-helix	trans	-60.1	-44.7	177.8	65.5	0	0	0	0	111.8	P488 V489 S494 I495 V496	P488-S492 WeakPolarHBondContact O-CB 3.19Å; P488-S492 PolarHBondContact O-N 3.38Å; P488-S492 PolarHBondContact O-OG 2.71Å; V489-S492 PolarHBondContact O-N 3.47Å; V489-S492 PolarHBondContact O-OG 3.31Å; S492-S494 VanDerWaalsContact C-N 3.34Å; S492-S494 PolarHBondContact O-N 2.99Å; S492-I495 PolarHBondContact O-N 2.84Å; S492-V496 WeakPolarHBondContact O-CG2 3.34Å; S492-V496 PolarHBondContact O-N 3.12Å
493	G	94.2	Very high	91.9	Very high	42 Å²	42	57 Å²	57	43%	0.433	32%	0.319	S	S	.	.	H	α-helix	trans	-60.3	-41.1	176.7	0	0	0	0	0	113.1	V489 S491 V496 L497	V489-G493 PolarHBondContact O-N 3.4Å; V489-G493 VanDerWaalsContact O-N 3.09Å; S491-G493 PolarHBondContact O-N 3.36Å; G493-V496 PolarHBondContact O-N 3.33Å; G493-L497 WeakPolarHBondContact O-CB 3.3Å; G493-L497 PolarHBondContact O-N 2.98Å
494	S	92.3	Very high	91.6	Very high	5 Å²	5	61 Å²	61	4%	0.035	34%	0.336	C	S	.	.	H	α-helix	trans	-70.3	-38.7	-179.8	-55.3	0	0	0	0	112.2	V436 F437 L440 Y490 S491 S492 L497 L498	V436-S494 WeakPolarHBondContact CG1-OG 3.37Å; F437-S494 VanDerWaalsContact CE1-OG 3.28Å; F437-S494 WeakPolarHBondContact CE1-OG 3.48Å; L440-S494 WeakPolarHBondContact CD2-O 3.39Å; Y490-S494 WeakPolarHBondContact O-CB 3.28Å; Y490-S494 PolarHBondContact O-N 3.09Å; Y490-S494 PolarHBondContact O-OG 2.78Å; S491-S494 PolarHBondContact O-N 3.47Å; S492-S494 VanDerWaalsContact C-N 3.34Å; S492-S494 PolarHBondContact O-N 2.99Å; S494-L497 PolarHBondContact O-N 3.46Å; S494-L498 PolarHBondContact O-N 2.96Å
495	I	93.7	Very high	91.1	Very high	46 Å²	46	56.7 Å²	56.7	24%	0.236	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-46.3	173.2	-68.1	167.2	0	0	0	110.5	L440 M483 F484 S491 S492 L497 L498 L499	L440-I495 HydrophobicContact CD1-CG1 4.22Å; M483-I495 HydrophobicContact CE-CD1 3.49Å; M483-I495 VanDerWaalsContact CE-CD1 3.49Å; M483-I495 HydrophobicContact CE-CG1 3.73Å; F484-I495 HydrophobicContact CE2-CD1 3.84Å; F484-I495 HydrophobicContact CZ-CD1 3.75Å; S491-I495 WeakPolarHBondContact O-CG1 3.37Å; S491-I495 PolarHBondContact O-N 3.32Å; S492-I495 PolarHBondContact O-N 2.84Å; I495-L497 VanDerWaalsContact C-N 3.3Å; I495-L497 PolarHBondContact O-N 3.48Å; I495-L498 PolarHBondContact O-N 3.34Å; I495-L498 VanDerWaalsContact O-N 3.16Å; I495-L499 HydrophobicContact CG2-CD1 4.07Å; I495-L499 HydrophobicContact CG2-CG 4.41Å; I495-L499 WeakPolarHBondContact O-CG 3.32Å; I495-L499 PolarHBondContact O-N 2.76Å
496	V	94.9	Very high	90.6	Very high	82 Å²	82	59.3 Å²	59.3	50%	0.497	33%	0.325	S	S	.	.	H	α-helix	trans	-60	-43.7	177.5	170.4	0	0	0	0	110.4	S492 G493 L498 L499 L500	S492-V496 WeakPolarHBondContact O-CG2 3.34Å; S492-V496 PolarHBondContact O-N 3.12Å; G493-V496 PolarHBondContact O-N 3.33Å; V496-L498 VanDerWaalsContact C-N 3.34Å; V496-L498 PolarHBondContact O-N 3.34Å; V496-L499 PolarHBondContact O-N 2.96Å; V496-L500 HydrophobicContact CG1-CD1 3.97Å; V496-L500 HydrophobicContact CG1-CG 4.33Å; V496-L500 WeakPolarHBondContact O-CB 3.34Å; V496-L500 WeakPolarHBondContact O-CG 3.34Å; V496-L500 PolarHBondContact O-N 3.29Å
497	L	92.4	Very high	90.1	Very high	67 Å²	67	68.5 Å²	68.5	35%	0.351	36%	0.36	S	S	.	.	H	α-helix	trans	-59.9	-43	175.2	-177.9	66.9	0	0	0	111.7	M136 L139 G493 S494 I495 L500 L501	M136-L497 HydrophobicContact CE-CB 3.77Å; M136-L497 HydrophobicContact CE-CD2 3.55Å; M136-L497 HydrophobicContact CE-CG 3.45Å; M136-L497 VanDerWaalsContact CE-CG 3.45Å; M136-L497 HydrophobicContact SD-CD2 4.41Å; L139-L497 HydrophobicContact CD1-CD2 4.35Å; G493-L497 WeakPolarHBondContact O-CB 3.3Å; G493-L497 PolarHBondContact O-N 2.98Å; S494-L497 PolarHBondContact O-N 3.46Å; I495-L497 VanDerWaalsContact C-N 3.3Å; I495-L497 PolarHBondContact O-N 3.48Å; L497-L500 PolarHBondContact O-N 3.15Å; L497-L501 HydrophobicContact CG-CD1 4.3Å; L497-L501 WeakPolarHBondContact O-CB 3.16Å; L497-L501 VanDerWaalsContact O-CG 3.25Å; L497-L501 WeakPolarHBondContact O-CG 3.39Å; L497-L501 PolarHBondContact O-N 3.43Å
498	L	91	Very high	89.6	Confident	22 Å²	22	71.7 Å²	71.7	12%	0.115	37%	0.369	C	S	.	.	H	α-helix	trans	-62.6	-43.4	176.5	178.4	62.5	0	0	0	112.1	M136 L440 S494 I495 V496 L501 L502	M136-L498 HydrophobicContact CE-CB 3.84Å; M136-L498 VanDerWaalsContact CE-N 3.32Å; M136-L498 HydrophobicContact CG-CD1 3.99Å; L440-L498 HydrophobicContact CD1-CD2 3.93Å; L440-L498 HydrophobicContact CD2-CB 4.27Å; L440-L498 HydrophobicContact CD2-CD2 4.39Å; L440-L498 HydrophobicContact CG-CD2 4.23Å; S494-L498 PolarHBondContact O-N 2.96Å; I495-L498 PolarHBondContact O-N 3.34Å; I495-L498 VanDerWaalsContact O-N 3.16Å; V496-L498 VanDerWaalsContact C-N 3.34Å; V496-L498 PolarHBondContact O-N 3.34Å; L498-L501 PolarHBondContact O-N 3.5Å; L498-L502 HydrophobicContact CD1-CD1 4.47Å; L498-L502 HydrophobicContact CG-CD1 4.22Å; L498-L502 WeakPolarHBondContact O-CG 3.34Å; L498-L502 PolarHBondContact O-N 3.13Å
499	L	90.8	Very high	88.3	Confident	104 Å²	104	68.9 Å²	68.9	55%	0.545	35%	0.351	S	S	.	.	H	α-helix	trans	-66	-40.5	178.1	-70.4	174.2	0	0	0	112.1	I495 V496 L501 L502 L503	I495-L499 HydrophobicContact CG2-CD1 4.07Å; I495-L499 HydrophobicContact CG2-CG 4.41Å; I495-L499 WeakPolarHBondContact O-CG 3.32Å; I495-L499 PolarHBondContact O-N 2.76Å; V496-L499 PolarHBondContact O-N 2.96Å; L499-L501 VanDerWaalsContact C-N 3.34Å; L499-L502 HydrophobicContact CD2-CD1 4.49Å; L499-L502 PolarHBondContact O-N 3.19Å; L499-L503 WeakPolarHBondContact O-CB 3.45Å; L499-L503 PolarHBondContact O-N 2.94Å
500	L	92.4	Very high	86.8	Confident	104 Å²	104	67.2 Å²	67.2	55%	0.545	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-40.3	174.8	-73.3	174.2	0	0	0	111.6	V496 L497 L503 F504	V496-L500 HydrophobicContact CG1-CD1 3.97Å; V496-L500 HydrophobicContact CG1-CG 4.33Å; V496-L500 WeakPolarHBondContact O-CB 3.34Å; V496-L500 WeakPolarHBondContact O-CG 3.34Å; V496-L500 PolarHBondContact O-N 3.29Å; L497-L500 PolarHBondContact O-N 3.15Å; L500-L503 PolarHBondContact O-N 2.91Å; L500-F504 WeakPolarHBondContact O-CB 3.48Å; L500-F504 PolarHBondContact O-N 3.5Å
501	L	89.3	Confident	85.2	Confident	22 Å²	22	66.1 Å²	66.1	12%	0.115	35%	0.346	C	S	.	.	H	α-helix	trans	-65	-42.7	174.9	-72	171	0	0	0	112	S132 L135 M136 L497 L498 L499 F504 L505	S132-L501 PolarHBondContact OG-O 3.12Å; L135-L501 HydrophobicContact CB-CD1 4.5Å; L135-L501 HydrophobicContact CD2-CD1 3.8Å; L135-L501 HydrophobicContact CD2-CD2 3.54Å; L135-L501 HydrophobicContact CD2-CG 4.32Å; L135-L501 HydrophobicContact CG-CD1 4.5Å; M136-L501 HydrophobicContact CE-CD1 3.74Å; L497-L501 HydrophobicContact CG-CD1 4.3Å; L497-L501 WeakPolarHBondContact O-CB 3.16Å; L497-L501 VanDerWaalsContact O-CG 3.25Å; L497-L501 WeakPolarHBondContact O-CG 3.39Å; L497-L501 PolarHBondContact O-N 3.43Å; L498-L501 PolarHBondContact O-N 3.5Å; L499-L501 VanDerWaalsContact C-N 3.34Å; L501-F504 PolarHBondContact O-N 3.35Å; L501-L505 WeakPolarHBondContact O-CB 3.31Å; L501-L505 WeakPolarHBondContact O-CG 3.34Å; L501-L505 PolarHBondContact O-N 2.69Å
502	L	87.2	Confident	83.3	Confident	37 Å²	37	68 Å²	68	19%	0.194	36%	0.359	C	S	.	.	H	α-helix	trans	-60.2	-46.1	175	-78	166.4	0	0	0	111.2	F129 S132 L498 L499 L505 H506	F129-L502 HydrophobicContact CD1-CD2 3.8Å; F129-L502 HydrophobicContact CE1-CD2 4.16Å; F129-L502 HydrophobicContact CG-CD2 4.24Å; S132-L502 VanDerWaalsContact OG-CA 3.27Å; S132-L502 WeakPolarHBondContact OG-CA 3.21Å; S132-L502 WeakPolarHBondContact OG-CD2 3.46Å; S132-L502 PolarHBondContact OG-N 3.03Å; L498-L502 HydrophobicContact CD1-CD1 4.47Å; L498-L502 HydrophobicContact CG-CD1 4.22Å; L498-L502 WeakPolarHBondContact O-CG 3.34Å; L498-L502 PolarHBondContact O-N 3.13Å; L499-L502 HydrophobicContact CD2-CD1 4.49Å; L499-L502 PolarHBondContact O-N 3.19Å; L502-L505 PolarHBondContact O-N 3.48Å; L502-H506 VanDerWaalsContact O-CB 3.27Å; L502-H506 WeakPolarHBondContact O-CB 3.5Å; L502-H506 PolarHBondContact O-N 3.22Å
503	L	87.7	Confident	81.3	Confident	122 Å²	122	70.4 Å²	70.4	64%	0.639	38%	0.376	S	S	*	.	H	α-helix	trans	-66.8	-42.7	179	-173.9	146.8	0	0	0	111.9	L499 L500 H506 Y507	L499-L503 WeakPolarHBondContact O-CB 3.45Å; L499-L503 PolarHBondContact O-N 2.94Å; L500-L503 PolarHBondContact O-N 2.91Å; L503-H506 PolarHBondContact O-N 3.38Å; L503-Y507 PolarHBondContact O-N 2.95Å; L503-Y507 VanDerWaalsContact O-N 3.11Å
504	F	87.3	Confident	79.3	Confident	85 Å²	85	76.8 Å²	76.8	37%	0.373	39%	0.387	S	S	.	.	H	α-helix	trans	-61.4	-46.8	176.3	173.5	-97.4	0	0	0	111.5	F391 L500 L501 Y507 R508	F391-F504 AromaticContact CD1-CE1 3.85Å; F391-F504 HydrophobicContact CD1-CE1 3.85Å; F391-F504 HydrophobicContact CE1-CD1 4.17Å; F391-F504 AromaticContact CE1-CE1 3.85Å; F391-F504 HydrophobicContact CE1-CE1 3.85Å; L500-F504 WeakPolarHBondContact O-CB 3.48Å; L500-F504 PolarHBondContact O-N 3.5Å; L501-F504 PolarHBondContact O-N 3.35Å; F504-Y507 PolarHBondContact O-N 2.97Å; F504-R508 VanDerWaalsContact CZ-CD 3.43Å; F504-R508 WeakPolarHBondContact O-CB 3.41Å; F504-R508 PolarHBondContact O-N 3.19Å
505	L	84.8	Confident	77.5	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-70.2	-32.7	177.9	-72.4	-177.5	0	0	0	112.1	L390 F391 L501 L502 Y507 R508 S509	L390-L505 HydrophobicContact CB-CD2 4.04Å; L390-L505 HydrophobicContact CD2-CD1 4.19Å; L390-L505 HydrophobicContact CD2-CD2 3.85Å; F391-L505 HydrophobicContact CE1-CD2 3.99Å; F391-L505 HydrophobicContact CE2-CD1 4.42Å; F391-L505 HydrophobicContact CE2-CD2 4.16Å; F391-L505 HydrophobicContact CZ-CD1 4.03Å; F391-L505 HydrophobicContact CZ-CD2 3.79Å; F391-L505 HydrophobicContact CZ-CG 4.18Å; L501-L505 WeakPolarHBondContact O-CB 3.31Å; L501-L505 WeakPolarHBondContact O-CG 3.34Å; L501-L505 PolarHBondContact O-N 2.69Å; L502-L505 PolarHBondContact O-N 3.48Å; L505-Y507 VanDerWaalsContact C-N 3.27Å; L505-Y507 PolarHBondContact O-N 3.45Å; L505-R508 PolarHBondContact O-N 3.45Å; L505-S509 WeakPolarHBondContact O-CA 3.45Å; L505-S509 WeakPolarHBondContact O-CB 3.28Å; L505-S509 PolarHBondContact O-N 2.88Å; L505-S509 PolarHBondContact O-OG 3.12Å
506	H	82.3	Confident	76.2	Confident	122 Å²	122	78.6 Å²	78.6	57%	0.565	41%	0.408	S	S	*	.	H	α-helix	trans	-61.9	-36.8	172.9	-176.8	62.7	0	0	0	112.3	E128 L502 L503	E128-H506 IonicContact OE1-CE1 3.79Å; E128-H506 IonicContact OE1-CG 2.66Å; E128-H506 IonicContact OE1-ND1 2.71Å; E128-H506 PolarHBondContact OE1-ND1 3Å; E128-H506 IonicContact OE2-ND1 3.78Å; E128-H506 PolarHBondContact OE2-ND1 3.38Å; L502-H506 VanDerWaalsContact O-CB 3.27Å; L502-H506 WeakPolarHBondContact O-CB 3.5Å; L502-H506 PolarHBondContact O-N 3.22Å; L503-H506 PolarHBondContact O-N 3.38Å
507	Y	80.2	Confident	74.9	Confident	209 Å²	209	75.2 Å²	75.2	82%	0.82	39%	0.387	S	S	*	.	H	α-helix	trans	-77.5	-33.4	177.6	-170.1	-95.9	0	0	0	113.2	L503 F504 L505	L503-Y507 PolarHBondContact O-N 2.95Å; L503-Y507 VanDerWaalsContact O-N 3.11Å; F504-Y507 PolarHBondContact O-N 2.97Å; L505-Y507 VanDerWaalsContact C-N 3.27Å; L505-Y507 PolarHBondContact O-N 3.45Å
508	R	77.7	Confident	73.7	Confident	107 Å²	107	73.8 Å²	73.8	40%	0.404	38%	0.382	S	S	.	.	H	α-helix	trans	-100.5	-20.4	-172.5	-169	176.1	-179.7	125.8	6.5	114.2	F504 L505 P510	F504-R508 VanDerWaalsContact CZ-CD 3.43Å; F504-R508 WeakPolarHBondContact O-CB 3.41Å; F504-R508 PolarHBondContact O-N 3.19Å; L505-R508 PolarHBondContact O-N 3.45Å; R508-P510 WeakPolarHBondContact O-CD 3.21Å; R508-P510 VanDerWaalsContact O-N 3.15Å
509	S	66.9	Low	72.8	Confident	17 Å²	17	78.4 Å²	78.4	12%	0.119	40%	0.403	C	S	.	.			trans	-66	120.7	-174	64.6	0	0	0	0	108.6	L505	L505-S509 WeakPolarHBondContact O-CA 3.45Å; L505-S509 WeakPolarHBondContact O-CB 3.28Å; L505-S509 PolarHBondContact O-N 2.88Å; L505-S509 PolarHBondContact O-OG 3.12Å
510	P	58.9	Low	71.8	Confident	70 Å²	70	75 Å²	75	46%	0.455	39%	0.391	S	S	.	.			trans	-61.2	152.8	173.2	27.1	-33.6	0	0	0	108	R508 S512	R508-P510 WeakPolarHBondContact O-CD 3.21Å; R508-P510 VanDerWaalsContact O-N 3.15Å; P510-S512 PolarHBondContact O-N 2.91Å
511	T	58.3	Low	70.8	Confident	69 Å²	69	73.6 Å²	73.6	42%	0.423	38%	0.383	S	S	.	.			trans	-70.5	83.3	173	56.5	0	0	0	0	109.6	Y516 Y673	T511-Y516 WeakPolarHBondContact CA-OH 3.09Å; T511-Y673 PolarHBondContact O-OH 3.42Å; T511-Y673 WeakPolarHBondContact OG1-CD2 3.43Å; T511-Y673 WeakPolarHBondContact OG1-CE1 3.32Å; T511-Y673 WeakPolarHBondContact OG1-CE2 3.34Å; T511-Y673 PolarHBondContact OG1-OH 2.92Å
512	S	53.8	Low	70.3	Confident	40 Å²	40	77.5 Å²	77.5	28%	0.28	40%	0.403	S	S	.	.			trans	-34.6	139.8	159.8	-158.2	0	0	0	0	114.2	P510 W514 Y516	P510-S512 PolarHBondContact O-N 2.91Å; S512-W514 PolarHBondContact O-N 3.29Å; S512-Y516 VanDerWaalsContact CA-OH 3.24Å; S512-Y516 WeakPolarHBondContact CA-OH 3.08Å; S512-Y516 WeakPolarHBondContact CB-OH 3.45Å; S512-Y516 PolarHBondContact N-OH 3.19Å; S512-Y516 PolarHBondContact O-OH 2.95Å
513	S	50.7	Low	69.9	Low	107 Å²	107	82.6 Å²	82.6	75%	0.748	42%	0.424	S	S	*	.	S	Bend	trans	-73.2	-13	174.3	51.1	0	0	0	0	114
514	W	53.4	Low	69.5	Low	175 Å²	175	79.2 Å²	79.2	66%	0.663	41%	0.405	S	S	*	.	S	Bend	trans	-98.9	112.3	177.7	-48.9	86.4	0	0	0	107.2	R123 S512	R123-W514 VanDerWaalsContact NH1-CG 3.25Å; S512-W514 PolarHBondContact O-N 3.29Å
515	G	54.4	Low	69.3	Low	57 Å²	57	78.6 Å²	78.6	59%	0.588	40%	0.403	S	S	*	.			trans	-51.2	157.7	-163.6	0	0	0	0	0	116.7
516	Y	65.4	Low	69.4	Low	32 Å²	32	82 Å²	82	13%	0.125	42%	0.423	C	S	.	.			trans	-92.3	144.2	-176.4	-51.3	-90.2	0	0	0	112.4	P127 T511 S512 S518 Q519 A520	P127-Y516 HydrophobicContact CG-CD1 4.28Å; P127-Y516 HydrophobicContact CG-CE1 3.77Å; T511-Y516 WeakPolarHBondContact CA-OH 3.09Å; S512-Y516 VanDerWaalsContact CA-OH 3.24Å; S512-Y516 WeakPolarHBondContact CA-OH 3.08Å; S512-Y516 WeakPolarHBondContact CB-OH 3.45Å; S512-Y516 PolarHBondContact N-OH 3.19Å; S512-Y516 PolarHBondContact O-OH 2.95Å; Y516-S518 WeakPolarHBondContact CB-OG 3.45Å; Y516-S518 PolarHBondContact O-N 3.41Å; Y516-Q519 HydrophobicContact CD2-CG 4.24Å; Y516-Q519 PolarHBondContact O-N 3.17Å; Y516-A520 PolarHBondContact O-N 2.7Å; Y516-A520 VanDerWaalsContact O-N 3.16Å
517	I	67.4	Low	69.6	Low	11 Å²	11	82 Å²	82	6%	0.056	42%	0.419	C	S	.	.	H	α-helix	trans	-61.9	-32.3	165.1	-155.5	172.5	0	0	0	111.4	L125 F129 A451 L452 Q519 A520 L521	L125-I517 HydrophobicContact CD2-CD1 3.75Å; L125-I517 WeakPolarHBondContact O-CB 3.38Å; L125-I517 WeakPolarHBondContact O-CG2 3.27Å; F129-I517 HydrophobicContact CD2-CG2 4.22Å; F129-I517 HydrophobicContact CE2-CG2 4.41Å; A451-I517 HydrophobicContact CB-CD1 4.43Å; L452-I517 HydrophobicContact CB-CD1 4.47Å; L452-I517 HydrophobicContact CD2-CD1 3.34Å; L452-I517 HydrophobicContact CD2-CG1 4.1Å; L452-I517 HydrophobicContact CG-CD1 3.58Å; I517-Q519 VanDerWaalsContact C-N 3.33Å; I517-Q519 PolarHBondContact O-N 3.27Å; I517-A520 PolarHBondContact O-N 3.48Å; I517-L521 WeakPolarHBondContact O-CB 3.24Å; I517-L521 WeakPolarHBondContact O-CG 3.35Å; I517-L521 PolarHBondContact O-N 3.07Å
518	S	67.1	Low	69.9	Low	37 Å²	37	77.5 Å²	77.5	26%	0.259	40%	0.403	S	S	.	.	H	α-helix	trans	-60.9	-42.4	176.1	58.5	0	0	0	0	111	Y516 L521 I522	Y516-S518 WeakPolarHBondContact CB-OG 3.45Å; Y516-S518 PolarHBondContact O-N 3.41Å; S518-L521 PolarHBondContact O-N 3.33Å; S518-I522 WeakPolarHBondContact O-CB 3.47Å; S518-I522 WeakPolarHBondContact O-CD1 3.07Å; S518-I522 WeakPolarHBondContact O-CG1 3.5Å; S518-I522 PolarHBondContact O-N 2.96Å
519	Q	73.4	Confident	70.4	Confident	119 Å²	119	79.2 Å²	79.2	56%	0.556	41%	0.411	S	S	*	.	H	α-helix	trans	-64.5	-40.5	173.2	-92	-173.5	-24.9	0	0	112.7	Y516 I517 I522 F523	Y516-Q519 HydrophobicContact CD2-CG 4.24Å; Y516-Q519 PolarHBondContact O-N 3.17Å; I517-Q519 VanDerWaalsContact C-N 3.33Å; I517-Q519 PolarHBondContact O-N 3.27Å; Q519-I522 PolarHBondContact O-N 3.24Å; Q519-F523 WeakPolarHBondContact O-CB 3.39Å; Q519-F523 PolarHBondContact O-N 2.85Å
520	A	69.8	Low	71.3	Confident	34 Å²	34	79.9 Å²	79.9	28%	0.281	41%	0.413	S	S	.	.	H	α-helix	trans	-63.2	-43.3	176.6	0	0	0	0	0	111.7	Y516 I517 F523 H524	Y516-A520 PolarHBondContact O-N 2.7Å; Y516-A520 VanDerWaalsContact O-N 3.16Å; I517-A520 PolarHBondContact O-N 3.48Å; A520-F523 PolarHBondContact O-N 3.16Å; A520-H524 WeakPolarHBondContact O-CB 3.27Å; A520-H524 PolarHBondContact O-N 2.93Å
521	L	71	Confident	72.5	Confident	74 Å²	74	83.1 Å²	83.1	39%	0.387	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-45.8	173.6	-75.7	168.8	0	0	0	111.5	A455 I517 S518 F523 H524 Q525	A455-L521 HydrophobicContact CB-CD2 3.45Å; A455-L521 VanDerWaalsContact CB-CD2 3.45Å; A455-L521 HydrophobicContact CB-CG 3.98Å; I517-L521 WeakPolarHBondContact O-CB 3.24Å; I517-L521 WeakPolarHBondContact O-CG 3.35Å; I517-L521 PolarHBondContact O-N 3.07Å; S518-L521 PolarHBondContact O-N 3.33Å; L521-F523 PolarHBondContact O-N 3.48Å; L521-H524 PolarHBondContact O-N 3.43Å; L521-Q525 VanDerWaalsContact O-CB 3.25Å; L521-Q525 WeakPolarHBondContact O-CB 3.48Å; L521-Q525 PolarHBondContact O-N 3.38Å
522	I	78.8	Confident	73.8	Confident	103 Å²	103	86.2 Å²	86.2	53%	0.528	44%	0.437	S	S	.	.	H	α-helix	trans	-59.9	-47.1	175.9	-70.2	162	0	0	0	110.2	S518 Q519 H524 Q525 V526	S518-I522 WeakPolarHBondContact O-CB 3.47Å; S518-I522 WeakPolarHBondContact O-CD1 3.07Å; S518-I522 WeakPolarHBondContact O-CG1 3.5Å; S518-I522 PolarHBondContact O-N 2.96Å; Q519-I522 PolarHBondContact O-N 3.24Å; I522-H524 PolarHBondContact O-N 2.81Å; I522-Q525 PolarHBondContact O-N 2.95Å; I522-V526 HydrophobicContact CG2-CG2 3.97Å; I522-V526 WeakPolarHBondContact O-CB 3.4Å; I522-V526 VanDerWaalsContact O-CG2 3.23Å; I522-V526 WeakPolarHBondContact O-CG2 3.37Å; I522-V526 PolarHBondContact O-N 3.23Å
523	F	79.8	Confident	75.2	Confident	144 Å²	144	88.1 Å²	88.1	63%	0.632	44%	0.444	S	S	*	.	H	α-helix	trans	-60.2	-47.3	179.3	-179.6	-92.8	0	0	0	111.6	Q519 A520 L521 Q525 V526 R527	Q519-F523 WeakPolarHBondContact O-CB 3.39Å; Q519-F523 PolarHBondContact O-N 2.85Å; A520-F523 PolarHBondContact O-N 3.16Å; L521-F523 PolarHBondContact O-N 3.48Å; F523-Q525 VanDerWaalsContact C-N 3.3Å; F523-Q525 PolarHBondContact O-N 3.17Å; F523-V526 PolarHBondContact O-N 3.42Å; F523-R527 VanDerWaalsContact O-CB 3.26Å; F523-R527 WeakPolarHBondContact O-CB 3.39Å; F523-R527 PolarHBondContact O-N 3.35Å
524	H	77.5	Confident	76.5	Confident	52 Å²	52	85.2 Å²	85.2	24%	0.241	42%	0.42	C	S	.	.	H	α-helix	trans	-59	-44.3	176.8	-176.4	-95.8	0	0	0	111.4	A520 L521 I522 R527 K528	A520-H524 WeakPolarHBondContact O-CB 3.27Å; A520-H524 PolarHBondContact O-N 2.93Å; L521-H524 PolarHBondContact O-N 3.43Å; I522-H524 PolarHBondContact O-N 2.81Å; H524-R527 PolarHBondContact CD2-NH2 3.49Å; H524-R527 VanDerWaalsContact CD2-NH2 3.25Å; H524-R527 PolarHBondContact NE2-NH2 3.2Å; H524-K528 WeakPolarHBondContact O-CB 3.23Å; H524-K528 PolarHBondContact O-N 3.36Å
525	Q	83.6	Confident	77.6	Confident	71 Å²	71	80.1 Å²	80.1	33%	0.332	41%	0.408	S	S	.	.	H	α-helix	trans	-67.1	-46.2	-179.7	-170	59.2	60.5	0	0	112.4	L521 I522 F523 K528 Y529	L521-Q525 VanDerWaalsContact O-CB 3.25Å; L521-Q525 WeakPolarHBondContact O-CB 3.48Å; L521-Q525 PolarHBondContact O-N 3.38Å; I522-Q525 PolarHBondContact O-N 2.95Å; F523-Q525 VanDerWaalsContact C-N 3.3Å; F523-Q525 PolarHBondContact O-N 3.17Å; Q525-K528 PolarHBondContact O-N 2.95Å; Q525-Y529 HydrophobicContact CG-CD2 3.85Å; Q525-Y529 HydrophobicContact CG-CE2 3.39Å; Q525-Y529 PolarHBondContact NE2-OH 3.01Å; Q525-Y529 VanDerWaalsContact O-CD2 3.26Å; Q525-Y529 WeakPolarHBondContact O-CD2 3.44Å; Q525-Y529 PolarHBondContact O-N 3.2Å
526	V	87.3	Confident	78.7	Confident	71 Å²	71	87.6 Å²	87.6	43%	0.43	42%	0.418	S	S	.	.	H	α-helix	trans	-62.6	-46.2	176.9	169.8	0	0	0	0	110.3	I522 F523 K528 Y529 L530	I522-V526 HydrophobicContact CG2-CG2 3.97Å; I522-V526 WeakPolarHBondContact O-CB 3.4Å; I522-V526 VanDerWaalsContact O-CG2 3.23Å; I522-V526 WeakPolarHBondContact O-CG2 3.37Å; I522-V526 PolarHBondContact O-N 3.23Å; F523-V526 PolarHBondContact O-N 3.42Å; V526-K528 VanDerWaalsContact C-N 3.34Å; V526-K528 PolarHBondContact O-N 2.86Å; V526-Y529 PolarHBondContact O-N 2.99Å; V526-L530 HydrophobicContact CG1-CD1 3.92Å; V526-L530 HydrophobicContact CG1-CG 4.29Å; V526-L530 WeakPolarHBondContact O-CB 3.19Å; V526-L530 WeakPolarHBondContact O-CG 3.49Å; V526-L530 PolarHBondContact O-N 3.08Å
527	R	86.6	Confident	79.1	Confident	124 Å²	124	93.4 Å²	93.4	47%	0.468	44%	0.444	S	S	.	.	H	α-helix	trans	-57.1	-47.5	175.3	-177.3	-172.3	70.4	171.9	0.7	111.3	F523 H524 Y529 L530 L531	F523-R527 VanDerWaalsContact O-CB 3.26Å; F523-R527 WeakPolarHBondContact O-CB 3.39Å; F523-R527 PolarHBondContact O-N 3.35Å; H524-R527 PolarHBondContact CD2-NH2 3.49Å; H524-R527 VanDerWaalsContact CD2-NH2 3.25Å; H524-R527 PolarHBondContact NE2-NH2 3.2Å; R527-Y529 VanDerWaalsContact C-N 3.35Å; R527-Y529 PolarHBondContact O-N 3.42Å; R527-L530 PolarHBondContact O-N 3.04Å; R527-L531 HydrophobicContact CG-CD1 4.25Å; R527-L531 WeakPolarHBondContact O-CG 3.35Å; R527-L531 PolarHBondContact O-N 3.33Å
528	K	85.6	Confident	79.3	Confident	114 Å²	114	99 Å²	99	50%	0.496	47%	0.474	S	S	.	.	H	α-helix	trans	-60.9	-44.3	178.3	-174.8	176.8	179.3	179.1	0	111.2	H524 Q525 V526 L531 M532	H524-K528 WeakPolarHBondContact O-CB 3.23Å; H524-K528 PolarHBondContact O-N 3.36Å; Q525-K528 PolarHBondContact O-N 2.95Å; V526-K528 VanDerWaalsContact C-N 3.34Å; V526-K528 PolarHBondContact O-N 2.86Å; K528-L531 PolarHBondContact O-N 3.33Å; K528-M532 WeakPolarHBondContact O-CG 3.25Å; K528-M532 PolarHBondContact O-N 3.08Å
529	Y	88.2	Confident	79.7	Confident	143 Å²	143	100.5 Å²	100.5	56%	0.561	48%	0.477	S	S	*	.	H	α-helix	trans	-65.5	-38.9	176.8	-71.1	-39.6	0	0	0	112.9	Q525 V526 R527 L531 M532 L533	Q525-Y529 HydrophobicContact CG-CD2 3.85Å; Q525-Y529 HydrophobicContact CG-CE2 3.39Å; Q525-Y529 PolarHBondContact NE2-OH 3.01Å; Q525-Y529 VanDerWaalsContact O-CD2 3.26Å; Q525-Y529 WeakPolarHBondContact O-CD2 3.44Å; Q525-Y529 PolarHBondContact O-N 3.2Å; V526-Y529 PolarHBondContact O-N 2.99Å; R527-Y529 VanDerWaalsContact C-N 3.35Å; R527-Y529 PolarHBondContact O-N 3.42Å; Y529-L531 VanDerWaalsContact C-N 3.34Å; Y529-L531 PolarHBondContact O-N 3.24Å; Y529-M532 HydrophobicContact CD1-SD 4.43Å; Y529-M532 PolarHBondContact O-N 3.39Å; Y529-L533 PolarHBondContact O-N 2.9Å
530	L	86.5	Confident	79.8	Confident	31 Å²	31	96.7 Å²	96.7	16%	0.162	46%	0.462	C	S	.	.	H	α-helix	trans	-63.9	-38.5	174.3	-75.3	173.9	0	0	0	112.2	V526 R527 M532 L533 L632 M635	V526-L530 HydrophobicContact CG1-CD1 3.92Å; V526-L530 HydrophobicContact CG1-CG 4.29Å; V526-L530 WeakPolarHBondContact O-CB 3.19Å; V526-L530 WeakPolarHBondContact O-CG 3.49Å; V526-L530 PolarHBondContact O-N 3.08Å; R527-L530 PolarHBondContact O-N 3.04Å; L530-M532 VanDerWaalsContact C-N 3.33Å; L530-L533 PolarHBondContact O-N 3.07Å; L530-L632 HydrophobicContact CD1-CD2 3.75Å; L530-L632 HydrophobicContact CD1-CG 4.28Å; L530-M635 HydrophobicContact CD2-CB 4.24Å; L530-M635 HydrophobicContact CD2-CG 3.81Å; L530-M635 HydrophobicContact CD2-SD 3.51Å; L530-M635 VanDerWaalsContact CD2-SD 3.51Å
531	L	84.7	Confident	80.1	Confident	137 Å²	137	102 Å²	102	72%	0.717	48%	0.479	S	S	*	.	H	α-helix	trans	-69.2	-31	174.6	-70.5	172	0	0	0	112.7	R527 K528 Y529 L533	R527-L531 HydrophobicContact CG-CD1 4.25Å; R527-L531 WeakPolarHBondContact O-CG 3.35Å; R527-L531 PolarHBondContact O-N 3.33Å; K528-L531 PolarHBondContact O-N 3.33Å; Y529-L531 VanDerWaalsContact C-N 3.34Å; Y529-L531 PolarHBondContact O-N 3.24Å; L531-L533 VanDerWaalsContact C-N 3.29Å
532	M	84.9	Confident	80.3	Confident	135 Å²	135	105.5 Å²	105.5	67%	0.665	49%	0.491	S	S	*	.	H	α-helix	trans	-73.3	-22.4	173.6	-73.1	-179.2	68.7	0	0	112.8	K528 Y529 L530 D534	K528-M532 WeakPolarHBondContact O-CG 3.25Å; K528-M532 PolarHBondContact O-N 3.08Å; Y529-M532 HydrophobicContact CD1-SD 4.43Å; Y529-M532 PolarHBondContact O-N 3.39Å; L530-M532 VanDerWaalsContact C-N 3.33Å; M532-D534 VanDerWaalsContact C-N 3.32Å; M532-D534 PolarHBondContact O-N 2.83Å
533	L	83.8	Confident	80.7	Confident	80 Å²	80	102 Å²	102	42%	0.419	47%	0.471	S	S	.	.	S	Bend	trans	-78.5	82.4	176	-160.1	148.6	0	0	0	109.5	Y529 L530 L531 V535 G634 M635	Y529-L533 PolarHBondContact O-N 2.9Å; L530-L533 PolarHBondContact O-N 3.07Å; L531-L533 VanDerWaalsContact C-N 3.29Å; L533-V535 PolarHBondContact O-N 3.02Å; L533-G634 VanDerWaalsContact CD2-C 3.5Å; L533-M635 HydrophobicContact CD1-CG 4.33Å
534	D	77.2	Confident	81.1	Confident	46 Å²	46	101.6 Å²	101.6	25%	0.246	47%	0.465	C	S	.	.			trans	-78.9	110.5	-175.8	-166.9	-9.9	0	0	0	111.9	M532 R536 K537	M532-D534 VanDerWaalsContact C-N 3.32Å; M532-D534 PolarHBondContact O-N 2.83Å; D534-R536 PolarHBondContact O-N 3.43Å; D534-R536 VanDerWaalsContact OD1-CB 3.32Å; D534-R536 WeakPolarHBondContact OD1-CB 3.25Å; D534-R536 IonicContact OD1-CZ 3.02Å; D534-R536 PolarHBondContact OD1-N 3.24Å; D534-R536 IonicContact OD1-NE 2.92Å; D534-R536 PolarHBondContact OD1-NE 3.48Å; D534-R536 IonicContact OD1-NH2 3.57Å; D534-R536 IonicContact OD2-CZ 2.79Å; D534-R536 IonicContact OD2-NE 3.81Å; D534-R536 PolarHBondContact OD2-NE 3.37Å; D534-R536 IonicContact OD2-NH2 2.67Å; D534-R536 PolarHBondContact OD2-NH2 3.49Å; D534-K537 HydrophobicContact CB-CD 4.36Å; D534-K537 HydrophobicContact CB-CG 4.37Å; D534-K537 PolarHBondContact O-N 3.26Å; D534-K537 VanDerWaalsContact O-N 3.1Å
535	V	75.9	Confident	81.8	Confident	68 Å²	68	99.3 Å²	99.3	41%	0.412	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-58.8	-26.8	176.8	-175.4	0	0	0	0	112.2	L533 K537 D538	L533-V535 PolarHBondContact O-N 3.02Å; V535-K537 PolarHBondContact O-N 3.32Å; V535-D538 PolarHBondContact O-N 2.75Å
536	R	77.8	Confident	82.2	Confident	214 Å²	214	97.8 Å²	97.8	81%	0.808	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-69.3	-14.4	-179.9	-61.8	171.2	-67.3	-178.4	3.7	112.9	D534	D534-R536 PolarHBondContact O-N 3.43Å; D534-R536 VanDerWaalsContact OD1-CB 3.32Å; D534-R536 WeakPolarHBondContact OD1-CB 3.25Å; D534-R536 IonicContact OD1-CZ 3.02Å; D534-R536 PolarHBondContact OD1-N 3.24Å; D534-R536 IonicContact OD1-NE 2.92Å; D534-R536 PolarHBondContact OD1-NE 3.48Å; D534-R536 IonicContact OD1-NH2 3.57Å; D534-R536 IonicContact OD2-CZ 2.79Å; D534-R536 IonicContact OD2-NE 3.81Å; D534-R536 PolarHBondContact OD2-NE 3.37Å; D534-R536 IonicContact OD2-NH2 2.67Å; D534-R536 PolarHBondContact OD2-NH2 3.49Å
537	K	75.4	Confident	82.6	Confident	153 Å²	153	94.4 Å²	94.4	67%	0.665	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-102.6	26.5	178.4	-59.7	-178.5	-176.4	176.3	0	112	D534 V535 H539	D534-K537 HydrophobicContact CB-CD 4.36Å; D534-K537 HydrophobicContact CB-CG 4.37Å; D534-K537 PolarHBondContact O-N 3.26Å; D534-K537 VanDerWaalsContact O-N 3.1Å; V535-K537 PolarHBondContact O-N 3.32Å; K537-H539 PolarHBondContact O-N 3.29Å
538	D	70.5	Confident	83.2	Confident	129 Å²	129	88.5 Å²	88.5	69%	0.69	41%	0.405	S	S	*	.			trans	-57	125.5	176.6	-82.3	-15.1	0	0	0	110.8	V535	V535-D538 PolarHBondContact O-N 2.75Å
539	H	75.6	Confident	83.7	Confident	69 Å²	69	83.1 Å²	83.1	32%	0.319	38%	0.382	S	S	.	.			trans	-146.4	143.2	-177.5	-174.3	-85.1	0	0	0	110.1	K537 K541 F542 Y909	K537-H539 PolarHBondContact O-N 3.29Å; H539-K541 PolarHBondContact ND1-N 3.47Å; H539-K541 PolarHBondContact O-N 3.48Å; H539-K541 VanDerWaalsContact O-N 3.09Å; H539-F542 HydrophobicContact CB-CD2 3.89Å; H539-F542 HydrophobicContact CB-CE2 4.18Å; H539-F542 PolarHBondContact O-N 2.78Å; H539-Y909 AromaticContact CE1-CE2 3.3Å; H539-Y909 WeakPolarHBondContact CE1-CE2 3.44Å; H539-Y909 AromaticContact CE1-CZ 3.97Å; H539-Y909 AromaticContact NE2-CE2 3.37Å; H539-Y909 WeakPolarHBondContact NE2-CE2 3.5Å; H539-Y909 AromaticContact NE2-CZ 3.65Å; H539-Y909 PolarHBondContact NE2-OH 3.44Å
540	V	74.4	Confident	84.1	Confident	39 Å²	39	77.5 Å²	77.5	24%	0.236	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-52.8	-37.8	-173.6	-177.8	0	0	0	0	112.9	F542 W543 V907	V540-F542 PolarHBondContact O-N 3.34Å; V540-W543 WeakPolarHBondContact O-CB 3.46Å; V540-W543 PolarHBondContact O-N 3.15Å; V540-V907 WeakPolarHBondContact CG1-O 3.33Å
541	K	76.8	Confident	84.5	Confident	146 Å²	146	76.2 Å²	76.2	64%	0.635	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-57.5	-29.2	176.3	-70.4	176.1	-177.7	173.5	0	114.3	H539 R544	H539-K541 PolarHBondContact ND1-N 3.47Å; H539-K541 PolarHBondContact O-N 3.48Å; H539-K541 VanDerWaalsContact O-N 3.09Å; K541-R544 PolarHBondContact O-NH1 2.94Å
542	F	76.6	Confident	84.6	Confident	147 Å²	147	74.3 Å²	74.3	65%	0.645	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-93.2	-2.9	-179.5	-55.3	-50.7	0	0	0	112.9	H539 V540 R544	H539-F542 HydrophobicContact CB-CD2 3.89Å; H539-F542 HydrophobicContact CB-CE2 4.18Å; H539-F542 PolarHBondContact O-N 2.78Å; V540-F542 PolarHBondContact O-N 3.34Å; F542-R544 PolarHBondContact O-N 3.48Å
543	W	86	Confident	84.8	Confident	30 Å²	30	68.6 Å²	68.6	11%	0.114	33%	0.325	C	S	.	.			trans	-59.3	134.8	178.2	-172.9	91.6	0	0	0	110.9	V540 P545 N638 F764 Q767 M768 V907	V540-W543 WeakPolarHBondContact O-CB 3.46Å; V540-W543 PolarHBondContact O-N 3.15Å; W543-P545 HydrophobicContact CH2-CB 3.92Å; W543-P545 HydrophobicContact CH2-CG 4.48Å; W543-P545 HydrophobicContact CZ2-CB 4.45Å; W543-N638 PolarHBondContact NE1-ND2 2.68Å; W543-N638 VanDerWaalsContact NE1-ND2 3.16Å; W543-F764 AromaticContact CH2-CE2 3.78Å; W543-F764 HydrophobicContact CH2-CE2 3.78Å; W543-F764 HydrophobicContact CH2-CZ 4.39Å; W543-F764 HydrophobicContact CZ2-CD2 4.37Å; W543-F764 AromaticContact CZ2-CE2 3.45Å; W543-F764 HydrophobicContact CZ2-CE2 3.45Å; W543-F764 VanDerWaalsContact CZ2-CE2 3.45Å; W543-F764 HydrophobicContact CZ2-CZ 4.19Å; W543-Q767 HydrophobicContact CE3-CG 4.49Å; W543-Q767 HydrophobicContact CZ3-CG 3.95Å; W543-M768 HydrophobicContact CH2-SD 3.93Å; W543-V907 HydrophobicContact CD2-CB 4.43Å; W543-V907 HydrophobicContact CD2-CG1 3.53Å; W543-V907 HydrophobicContact CE3-CB 4.35Å; W543-V907 HydrophobicContact CE3-CG1 3.77Å; W543-V907 HydrophobicContact CG-CG1 4Å; W543-V907 HydrophobicContact CH2-CG1 4.26Å; W543-V907 HydrophobicContact CZ2-CG1 4.08Å; W543-V907 HydrophobicContact CZ3-CG1 4.1Å
544	R	88.3	Confident	85	Confident	135 Å²	135	64.9 Å²	64.9	51%	0.509	31%	0.305	S	S	.	.			trans	-139.5	150.2	173.7	-63.6	-65.2	-177.5	-87.4	-1.1	107.7	K541 F542 Q546 N638	K541-R544 PolarHBondContact O-NH1 2.94Å; F542-R544 PolarHBondContact O-N 3.48Å; R544-Q546 PolarHBondContact O-N 2.99Å; R544-Q546 VanDerWaalsContact O-N 3.11Å; R544-N638 PolarHBondContact O-ND2 3.08Å
545	P	91.4	Very high	85.6	Confident	4 Å²	4	64.1 Å²	64.1	3%	0.026	30%	0.299	C	S	.	.			trans	-67.4	113.2	172.9	27.7	-32.8	0	0	0	109	W543 V547 K568 G571 M768 V771	W543-P545 HydrophobicContact CH2-CB 3.92Å; W543-P545 HydrophobicContact CH2-CG 4.48Å; W543-P545 HydrophobicContact CZ2-CB 4.45Å; P545-V547 HydrophobicContact CB-CG2 4.33Å; P545-K568 WeakPolarHBondContact CG-O 3.38Å; P545-G571 WeakPolarHBondContact O-CA 3.24Å; P545-M768 HydrophobicContact CB-CE 4.39Å; P545-M768 HydrophobicContact CB-SD 4.19Å; P545-V771 HydrophobicContact CG-CG1 4.25Å
546	Q	93.4	Very high	86.1	Confident	39 Å²	39	62.2 Å²	62.2	18%	0.182	29%	0.289	C	S	.	.			trans	-110	101.1	175.2	-59.8	-168.8	38.6	0	0	106.9	R544 L572 K636 P637 N638 T639	R544-Q546 PolarHBondContact O-N 2.99Å; R544-Q546 VanDerWaalsContact O-N 3.11Å; Q546-L572 CarbonylContact C-O 3.53Å; Q546-L572 WeakPolarHBondContact CA-O 3.31Å; Q546-L572 HydrophobicContact CB-CB 4.02Å; Q546-L572 HydrophobicContact CG-CB 4.06Å; Q546-K636 WeakPolarHBondContact CB-O 3.33Å; Q546-K636 VanDerWaalsContact OE1-C 3.26Å; Q546-K636 PolarHBondContact OE1-O 2.71Å; Q546-P637 CarbonylContact O-C 3.54Å; Q546-P637 WeakPolarHBondContact O-CA 3.43Å; Q546-N638 PolarHBondContact N-OD1 2.87Å; Q546-N638 PolarHBondContact O-N 2.9Å; Q546-N638 PolarHBondContact O-OD1 3.3Å; Q546-N638 VanDerWaalsContact O-OD1 3.04Å; Q546-T639 PolarHBondContact O-N 3.15Å
547	V	96	Very high	86.6	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.2	-163.1	179.8	0	0	0	0	111.3	P545 V564 L572 Y573 V574 T639 I641	P545-V547 HydrophobicContact CB-CG2 4.33Å; V547-V564 HydrophobicContact CB-CG1 4.18Å; V547-V564 HydrophobicContact CG1-CG1 3.58Å; V547-V564 HydrophobicContact CG2-CG1 4.43Å; V547-L572 PolarHBondContact N-O 3.4Å; V547-Y573 HydrophobicContact CB-CD2 4.14Å; V547-Y573 HydrophobicContact CG1-CD2 4.19Å; V547-Y573 HydrophobicContact CG1-CE2 4.37Å; V547-Y573 CarbonylContact O-C 3.5Å; V547-Y573 WeakPolarHBondContact O-CA 3.27Å; V547-V574 PolarHBondContact O-N 3.28Å; V547-T639 WeakPolarHBondContact CA-O 3.5Å; V547-I641 HydrophobicContact CG1-CB 4.31Å; V547-I641 HydrophobicContact CG1-CD1 3.53Å; V547-I641 HydrophobicContact CG1-CG1 3.67Å; V547-I641 HydrophobicContact CG2-CD1 4.37Å
548	L	97.5	Very high	87.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	111.2	161	175.7	64	0	0	0	107.8	M550 V574 L626 L627 P637 T639 L640 I641	L548-M550 HydrophobicContact CD1-SD 4.36Å; L548-M550 HydrophobicContact CD2-SD 4.18Å; L548-M550 HydrophobicContact CG-SD 4.09Å; L548-V574 WeakPolarHBondContact CA-O 3.2Å; L548-V574 HydrophobicContact CD1-CB 4Å; L548-V574 HydrophobicContact CD1-CG1 4.01Å; L548-L626 HydrophobicContact CD2-CB 3.99Å; L548-L627 HydrophobicContact CD2-CD2 3.93Å; L548-L627 HydrophobicContact CD2-CG 4.24Å; L548-P637 HydrophobicContact CB-CB 3.76Å; L548-P637 HydrophobicContact CB-CG 4.02Å; L548-T639 PolarHBondContact N-O 3.31Å; L548-L640 HydrophobicContact CD2-CD1 4.26Å; L548-L640 HydrophobicContact CG-CD1 4.34Å; L548-L640 WeakPolarHBondContact O-CA 3.32Å; L548-I641 PolarHBondContact O-N 3.47Å
549	L	97.5	Very high	88.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119.6	174.5	174.7	66.1	0	0	0	109	V551 L560 I561 V564 Y573 V574 L575 G576 I641	L549-V551 HydrophobicContact CD2-CG2 3.89Å; L549-V551 HydrophobicContact CG-CG2 3.81Å; L549-L560 HydrophobicContact CD1-CD2 3.82Å; L549-L560 HydrophobicContact CD1-CG 4.06Å; L549-L560 HydrophobicContact CD2-CG 4.37Å; L549-I561 HydrophobicContact CD2-CB 4.42Å; L549-I561 HydrophobicContact CD2-CG1 3.77Å; L549-V564 HydrophobicContact CD2-CG2 4.38Å; L549-Y573 HydrophobicContact CB-CE2 3.72Å; L549-Y573 HydrophobicContact CD2-CE2 4.26Å; L549-Y573 WeakPolarHBondContact CD2-OH 3.27Å; L549-V574 PolarHBondContact N-O 2.93Å; L549-L575 HydrophobicContact CB-CD2 4.29Å; L549-L575 HydrophobicContact CD2-CD2 4.01Å; L549-G576 PolarHBondContact O-N 3.45Å; L549-I641 HydrophobicContact CD1-CB 3.82Å; L549-I641 HydrophobicContact CD1-CG2 3.62Å
550	M	96.5	Very high	88.9	Confident	25 Å²	25	37.8 Å²	37.8	12%	0.123	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	121.7	174	-61.1	-56	-58.3	0	0	110.1	L548 G576 V578 T623 L626 L640 I641 L642	L548-M550 HydrophobicContact CD1-SD 4.36Å; L548-M550 HydrophobicContact CD2-SD 4.18Å; L548-M550 HydrophobicContact CG-SD 4.09Å; M550-G576 WeakPolarHBondContact CA-O 3.15Å; M550-V578 HydrophobicContact CE-CG2 3.73Å; M550-T623 HydrophobicContact CE-CG2 4.44Å; M550-T623 HydrophobicContact CG-CG2 4.17Å; M550-T623 HydrophobicContact SD-CG2 4.16Å; M550-L626 HydrophobicContact CE-CD1 3.64Å; M550-L626 HydrophobicContact SD-CD1 3.94Å; M550-L640 HydrophobicContact CG-CD1 3.7Å; M550-L640 HydrophobicContact SD-CD1 4.47Å; M550-I641 PolarHBondContact N-O 3.03Å; M550-L642 HydrophobicContact CB-CD2 3.6Å; M550-L642 HydrophobicContact CG-CD2 3.54Å
551	V	93.6	Very high	89.9	Confident	4 Å²	4	36 Å²	36	2%	0.024	17%	0.174	C	C	.	.			trans	-120.7	118.3	-179.4	-177.6	0	0	0	0	109	L549 P554 I561 L575 G576 H577 W598	L549-V551 HydrophobicContact CD2-CG2 3.89Å; L549-V551 HydrophobicContact CG-CG2 3.81Å; V551-P554 HydrophobicContact CG1-CG 4.12Å; V551-I561 HydrophobicContact CG1-CD1 4.38Å; V551-I561 HydrophobicContact CG2-CD1 4.18Å; V551-I561 HydrophobicContact CG2-CG1 4.12Å; V551-L575 HydrophobicContact CG2-CD2 4.27Å; V551-G576 PolarHBondContact N-O 3.47Å; V551-H577 PolarHBondContact O-ND1 2.92Å; V551-W598 HydrophobicContact CB-CH2 3.9Å; V551-W598 HydrophobicContact CB-CZ3 4.08Å; V551-W598 HydrophobicContact CG1-CH2 3.84Å; V551-W598 HydrophobicContact CG1-CZ3 4.11Å
552	S	87.6	Confident	90.6	Very high	97 Å²	97	31.1 Å²	31.1	68%	0.678	15%	0.154	S	C	*	.	S	Bend	trans	-81.2	-51.9	173.5	56.9	0	0	0	0	111.2	H577	S552-H577 PolarHBondContact O-CE1 3.45Å; S552-H577 PolarHBondContact O-ND1 3.33Å
553	N	89.1	Confident	91.3	Very high	16 Å²	16	24.2 Å²	24.2	9%	0.086	12%	0.124	C	C	.	.			trans	-131.5	117.4	176.3	-169.9	-18.3	0	0	0	109.5	R555 S556 S557 P687	N553-R555 VanDerWaalsContact C-N 3.25Å; N553-R555 PolarHBondContact O-N 3.48Å; N553-R555 WeakPolarHBondContact OD1-CB 3.24Å; N553-R555 PolarHBondContact OD1-N 3.3Å; N553-S556 PolarHBondContact O-N 3.28Å; N553-S556 PolarHBondContact O-OG 2.79Å; N553-S556 VanDerWaalsContact O-OG 3.08Å; N553-S557 PolarHBondContact O-N 2.75Å; N553-S557 PolarHBondContact O-OG 3.07Å; N553-S557 VanDerWaalsContact O-OG 3.07Å; N553-P687 PolarHBondContact ND2-O 3.08Å
554	P	88.9	Confident	91.7	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-56.5	-35.7	175.5	-31.2	39.7	0	0	0	114.4	V551 S556 S557 C558 W598 L601 F654 F686	V551-P554 HydrophobicContact CG1-CG 4.12Å; P554-S556 PolarHBondContact O-N 2.95Å; P554-S557 PolarHBondContact O-N 3.1Å; P554-C558 PolarHBondContact O-N 3.35Å; P554-C558 VanDerWaalsContact O-N 3.09Å; P554-C558 PolarHBondContact O-SG 3.31Å; P554-W598 HydrophobicContact CG-CE3 4.27Å; P554-W598 HydrophobicContact CG-CH2 3.52Å; P554-W598 HydrophobicContact CG-CZ2 3.99Å; P554-W598 HydrophobicContact CG-CZ3 3.68Å; P554-L601 HydrophobicContact CB-CD1 4.29Å; P554-L601 HydrophobicContact CB-CD2 3.48Å; P554-L601 VanDerWaalsContact CB-CD2 3.48Å; P554-L601 HydrophobicContact CG-CD2 3.62Å; P554-F654 HydrophobicContact CB-CZ 4.32Å; P554-F686 HydrophobicContact CG-CD1 3.78Å; P554-F686 HydrophobicContact CG-CE1 3.63Å; P554-F686 HydrophobicContact CG-CG 4.41Å; P554-F686 HydrophobicContact CG-CZ 4.13Å
555	R	88.2	Confident	92	Very high	30 Å²	30	18.2 Å²	18.2	11%	0.113	10%	0.104	C	C	.	.	H	α-helix	trans	-55.7	-37.4	-178	-70.1	-177.5	173.8	-121.3	1.5	113	N553 D652 F653 F654 Q683 F686 P687 V689	N553-R555 VanDerWaalsContact C-N 3.25Å; N553-R555 PolarHBondContact O-N 3.48Å; N553-R555 WeakPolarHBondContact OD1-CB 3.24Å; N553-R555 PolarHBondContact OD1-N 3.3Å; R555-D652 IonicContact CZ-OD2 3.08Å; R555-D652 IonicContact NH1-OD1 3.07Å; R555-D652 IonicContact NH1-OD2 3.89Å; R555-D652 PolarHBondContact NH1-OD2 3.11Å; R555-F653 WeakPolarHBondContact O-CB 3.39Å; R555-F653 PolarHBondContact O-N 3.06Å; R555-F654 HydrophobicContact CG-CD1 4.15Å; R555-F654 HydrophobicContact CG-CD2 3.67Å; R555-F654 HydrophobicContact CG-CE1 4.24Å; R555-F654 HydrophobicContact CG-CE2 3.78Å; R555-F654 HydrophobicContact CG-CG 3.86Å; R555-F654 HydrophobicContact CG-CZ 4.06Å; R555-Q683 PolarHBondContact NH2-O 2.9Å; R555-F686 HydrophobicContact CG-CB 4.23Å; R555-F686 PolarHBondContact NE-O 3.1Å; R555-F686 PolarHBondContact NH2-O 3.36Å; R555-P687 WeakPolarHBondContact CD-O 3.26Å; R555-V689 HydrophobicContact CB-CG2 3.82Å
556	S	87.2	Confident	91.9	Very high	29 Å²	29	19.2 Å²	19.2	20%	0.203	11%	0.109	C	C	.	.	H	α-helix	trans	-89.8	-17.5	178.4	61.4	0	0	0	0	113.9	N553 P554	N553-S556 PolarHBondContact O-N 3.28Å; N553-S556 PolarHBondContact O-OG 2.79Å; N553-S556 VanDerWaalsContact O-OG 3.08Å; P554-S556 PolarHBondContact O-N 2.95Å
557	S	88.6	Confident	91.9	Very high	21 Å²	21	17.4 Å²	17.4	15%	0.147	10%	0.1	C	C	.	.	H	α-helix	trans	-109.2	3.2	-168.1	-53.4	0	0	0	0	113.7	N553 P554 Q559 L560 I561	N553-S557 PolarHBondContact O-N 2.75Å; N553-S557 PolarHBondContact O-OG 3.07Å; N553-S557 VanDerWaalsContact O-OG 3.07Å; P554-S557 PolarHBondContact O-N 3.1Å; S557-Q559 VanDerWaalsContact C-N 3.35Å; S557-Q559 PolarHBondContact O-N 3.44Å; S557-L560 WeakPolarHBondContact O-CB 3.29Å; S557-L560 PolarHBondContact O-N 3.06Å; S557-I561 WeakPolarHBondContact O-CG1 3.45Å; S557-I561 PolarHBondContact O-N 3.11Å
558	C	88.9	Confident	91.6	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.007	10%	0.104	C	C	.	.	H	α-helix	trans	-50.9	-48.7	-177.2	-75.8	0	0	0	0	113.1	P554 L560 I561 L562 F653	P554-C558 PolarHBondContact O-N 3.35Å; P554-C558 VanDerWaalsContact O-N 3.09Å; P554-C558 PolarHBondContact O-SG 3.31Å; C558-L560 VanDerWaalsContact C-N 3.32Å; C558-L560 PolarHBondContact O-N 2.67Å; C558-I561 WeakPolarHBondContact O-CB 3.28Å; C558-I561 PolarHBondContact O-N 3.15Å; C558-I561 VanDerWaalsContact O-N 3.14Å; C558-L562 WeakPolarHBondContact O-CG 3.4Å; C558-L562 PolarHBondContact O-N 3.1Å; C558-F653 HydrophobicContact CB-CB 3.85Å; C558-F653 HydrophobicContact CB-CG 4.24Å
559	Q	89.1	Confident	91	Very high	19 Å²	19	23.2 Å²	23.2	9%	0.089	13%	0.126	C	C	.	.	H	α-helix	trans	-63.9	-37.3	-179.7	-63.5	-57.1	-19.4	0	0	112.7	S557 L562 F563 F653 F723	S557-Q559 VanDerWaalsContact C-N 3.35Å; S557-Q559 PolarHBondContact O-N 3.44Å; Q559-L562 PolarHBondContact O-N 3.5Å; Q559-F563 WeakPolarHBondContact O-CB 3.29Å; Q559-F563 PolarHBondContact O-N 3.42Å; Q559-F653 HydrophobicContact CG-CD1 3.92Å; Q559-F653 HydrophobicContact CG-CD2 4.43Å; Q559-F653 HydrophobicContact CG-CE1 3.44Å; Q559-F653 VanDerWaalsContact CG-CE1 3.44Å; Q559-F653 HydrophobicContact CG-CE2 3.99Å; Q559-F653 HydrophobicContact CG-CG 4.39Å; Q559-F653 HydrophobicContact CG-CZ 3.49Å; Q559-F653 VanDerWaalsContact CG-CZ 3.49Å; Q559-F723 WeakPolarHBondContact CB-O 3.45Å
560	L	92.4	Very high	90.2	Very high	11 Å²	11	26.7 Å²	26.7	6%	0.058	16%	0.161	C	C	.	.	H	α-helix	trans	-66.7	-40.6	175.1	-176.2	60.3	0	0	0	110.9	L549 S557 C558 L562 F563 V564 F723	L549-L560 HydrophobicContact CD1-CD2 3.82Å; L549-L560 HydrophobicContact CD1-CG 4.06Å; L549-L560 HydrophobicContact CD2-CG 4.37Å; S557-L560 WeakPolarHBondContact O-CB 3.29Å; S557-L560 PolarHBondContact O-N 3.06Å; C558-L560 VanDerWaalsContact C-N 3.32Å; C558-L560 PolarHBondContact O-N 2.67Å; L560-L562 VanDerWaalsContact C-N 3.34Å; L560-L562 PolarHBondContact O-N 2.87Å; L560-F563 PolarHBondContact O-N 2.74Å; L560-V564 HydrophobicContact CD1-CG2 4.12Å; L560-V564 HydrophobicContact CG-CG2 4.44Å; L560-V564 WeakPolarHBondContact O-CB 3.25Å; L560-V564 VanDerWaalsContact O-CG2 3.27Å; L560-V564 WeakPolarHBondContact O-CG2 3.25Å; L560-V564 PolarHBondContact O-N 3.29Å; L560-F723 HydrophobicContact CB-CB 4.29Å; L560-F723 HydrophobicContact CD1-CB 4.36Å; L560-F723 HydrophobicContact CD1-CD1 4.36Å; L560-F723 HydrophobicContact CD1-CD2 3.81Å; L560-F723 HydrophobicContact CD1-CE2 4.2Å; L560-F723 HydrophobicContact CD1-CG 3.89Å
561	I	93.8	Very high	89.9	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.4	-46	176.3	-67.4	166.4	0	0	0	110.6	L549 V551 S557 C558 N565 Y573 L575 L605 V607	L549-I561 HydrophobicContact CD2-CB 4.42Å; L549-I561 HydrophobicContact CD2-CG1 3.77Å; V551-I561 HydrophobicContact CG1-CD1 4.38Å; V551-I561 HydrophobicContact CG2-CD1 4.18Å; V551-I561 HydrophobicContact CG2-CG1 4.12Å; S557-I561 WeakPolarHBondContact O-CG1 3.45Å; S557-I561 PolarHBondContact O-N 3.11Å; C558-I561 WeakPolarHBondContact O-CB 3.28Å; C558-I561 PolarHBondContact O-N 3.15Å; C558-I561 VanDerWaalsContact O-N 3.14Å; I561-N565 PolarHBondContact O-N 2.99Å; I561-N565 VanDerWaalsContact O-N 3.11Å; I561-Y573 VanDerWaalsContact CA-OH 3.29Å; I561-Y573 WeakPolarHBondContact CA-OH 3.49Å; I561-Y573 PolarHBondContact O-OH 3.5Å; I561-L575 HydrophobicContact CG1-CD2 4.16Å; I561-L575 HydrophobicContact CG2-CD1 4.45Å; I561-L575 HydrophobicContact CG2-CD2 4.25Å; I561-L605 HydrophobicContact CD1-CD1 4.47Å; I561-L605 HydrophobicContact CG2-CD1 4.09Å; I561-V607 HydrophobicContact CG2-CG1 4.31Å; I561-V607 HydrophobicContact CG2-CG2 4.13Å
562	L	91.7	Very high	89.9	Confident	44 Å²	44	26.7 Å²	26.7	23%	0.23	16%	0.164	C	C	.	.	H	α-helix	trans	-66.6	-41.6	179	-70	174.3	0	0	0	112.2	C558 Q559 L560 N565 Q566 V607	C558-L562 WeakPolarHBondContact O-CG 3.4Å; C558-L562 PolarHBondContact O-N 3.1Å; Q559-L562 PolarHBondContact O-N 3.5Å; L560-L562 VanDerWaalsContact C-N 3.34Å; L560-L562 PolarHBondContact O-N 2.87Å; L562-N565 WeakPolarHBondContact O-CB 3.2Å; L562-N565 PolarHBondContact O-N 2.9Å; L562-Q566 WeakPolarHBondContact O-CG 3.44Å; L562-Q566 PolarHBondContact O-N 3.48Å; L562-V607 HydrophobicContact CD2-CG2 3.86Å
563	F	92.7	Very high	90.3	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.009	13%	0.132	C	C	.	.	H	α-helix	trans	-63.2	-47	176.9	174.3	-101.3	0	0	0	111.7	Q559 L560 N565 Q566 L567 F723 L726 L772 W778 V866 L899	Q559-F563 WeakPolarHBondContact O-CB 3.29Å; Q559-F563 PolarHBondContact O-N 3.42Å; L560-F563 PolarHBondContact O-N 2.74Å; F563-N565 VanDerWaalsContact C-N 3.28Å; F563-N565 PolarHBondContact O-N 3.45Å; F563-Q566 WeakPolarHBondContact O-CB 3.32Å; F563-Q566 PolarHBondContact O-N 2.95Å; F563-L567 HydrophobicContact CE1-CD2 4.18Å; F563-L567 PolarHBondContact O-N 3.44Å; F563-F723 HydrophobicContact CB-CD1 4.03Å; F563-F723 HydrophobicContact CB-CE1 4.09Å; F563-F723 AromaticContact CD1-CD1 3.96Å; F563-F723 HydrophobicContact CD1-CD1 3.96Å; F563-F723 AromaticContact CD1-CE1 3.26Å; F563-F723 HydrophobicContact CD1-CE1 3.26Å; F563-F723 AromaticContact CD1-CZ 3.71Å; F563-F723 HydrophobicContact CD1-CZ 3.71Å; F563-F723 HydrophobicContact CD2-CD1 4.35Å; F563-F723 AromaticContact CD2-CE1 3.7Å; F563-F723 HydrophobicContact CD2-CE1 3.7Å; F563-F723 AromaticContact CE1-CE1 3.46Å; F563-F723 HydrophobicContact CE1-CE1 3.46Å; F563-F723 VanDerWaalsContact CE1-CE1 3.46Å; F563-F723 AromaticContact CE1-CZ 3.53Å; F563-F723 HydrophobicContact CE1-CZ 3.53Å; F563-F723 AromaticContact CE2-CE1 3.88Å; F563-F723 HydrophobicContact CE2-CE1 3.88Å; F563-F723 AromaticContact CG-CD1 3.84Å; F563-F723 HydrophobicContact CG-CD1 3.84Å; F563-F723 AromaticContact CG-CE1 3.38Å; F563-F723 HydrophobicContact CG-CE1 3.38Å; F563-F723 HydrophobicContact CG-CZ 4.28Å; F563-F723 AromaticContact CZ-CE1 3.77Å; F563-F723 HydrophobicContact CZ-CE1 3.77Å; F563-F723 AromaticContact CZ-CZ 3.98Å; F563-F723 HydrophobicContact CZ-CZ 3.98Å; F563-L726 HydrophobicContact CB-CD2 4.31Å; F563-L726 HydrophobicContact CD2-CD2 4.04Å; F563-L772 HydrophobicContact CE2-CD1 3.9Å; F563-L772 HydrophobicContact CE2-CD2 3.84Å; F563-L772 HydrophobicContact CZ-CD1 4.34Å; F563-L772 HydrophobicContact CZ-CD2 4.04Å; F563-W778 HydrophobicContact CD2-CZ2 4.43Å; F563-W778 HydrophobicContact CE2-CZ2 4.31Å; F563-V866 HydrophobicContact CE2-CG1 4.22Å; F563-V866 HydrophobicContact CE2-CG2 3.91Å; F563-V866 HydrophobicContact CZ-CG1 4.02Å; F563-V866 HydrophobicContact CZ-CG2 4.48Å; F563-L899 HydrophobicContact CE1-CD2 4.26Å
564	V	94.4	Very high	90.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-65.2	-33.1	179.7	174.3	0	0	0	0	111.8	V547 L549 L560 Q566 L567 K568 Y573 I641	V547-V564 HydrophobicContact CB-CG1 4.18Å; V547-V564 HydrophobicContact CG1-CG1 3.58Å; V547-V564 HydrophobicContact CG2-CG1 4.43Å; L549-V564 HydrophobicContact CD2-CG2 4.38Å; L560-V564 HydrophobicContact CD1-CG2 4.12Å; L560-V564 HydrophobicContact CG-CG2 4.44Å; L560-V564 WeakPolarHBondContact O-CB 3.25Å; L560-V564 VanDerWaalsContact O-CG2 3.27Å; L560-V564 WeakPolarHBondContact O-CG2 3.25Å; L560-V564 PolarHBondContact O-N 3.29Å; V564-Q566 PolarHBondContact O-N 2.9Å; V564-L567 PolarHBondContact O-N 3.18Å; V564-L567 VanDerWaalsContact O-N 3.12Å; V564-K568 PolarHBondContact O-N 3.2Å; V564-Y573 HydrophobicContact CB-CE2 4.1Å; V564-Y573 HydrophobicContact CG1-CD2 3.85Å; V564-Y573 HydrophobicContact CG1-CE1 4.31Å; V564-Y573 HydrophobicContact CG1-CE2 3.34Å; V564-I641 HydrophobicContact CG1-CD1 4.06Å; V564-I641 HydrophobicContact CG2-CD1 3.8Å; V564-I641 HydrophobicContact CG2-CG2 4.37Å
565	N	93.1	Very high	91	Very high	39 Å²	39	21.5 Å²	21.5	21%	0.209	13%	0.128	C	C	.	.	H	α-helix	trans	-58.9	-29.9	172.5	-174.4	48.9	0	0	0	112.6	I561 L562 F563 K568 Y573 V607 K608	I561-N565 PolarHBondContact O-N 2.99Å; I561-N565 VanDerWaalsContact O-N 3.11Å; L562-N565 WeakPolarHBondContact O-CB 3.2Å; L562-N565 PolarHBondContact O-N 2.9Å; F563-N565 VanDerWaalsContact C-N 3.28Å; F563-N565 PolarHBondContact O-N 3.45Å; N565-K568 WeakPolarHBondContact O-CG 3.43Å; N565-K568 VanDerWaalsContact OD1-CE 3.32Å; N565-K568 WeakPolarHBondContact OD1-CE 3.22Å; N565-Y573 HydrophobicContact CB-CD1 4.41Å; N565-Y573 HydrophobicContact CB-CE1 4.01Å; N565-V607 HydrophobicContact CB-CG1 3.97Å; N565-V607 HydrophobicContact CB-CG2 4.31Å; N565-K608 PolarHBondContact OD1-N 2.83Å
566	Q	90.7	Very high	91.4	Very high	26 Å²	26	20 Å²	20	12%	0.121	12%	0.123	C	C	.	.	H	α-helix	trans	-81.5	-38.8	175.3	-58	174.6	17.7	0	0	111	L562 F563 V564 K568 K569 E729 L772	L562-Q566 WeakPolarHBondContact O-CG 3.44Å; L562-Q566 PolarHBondContact O-N 3.48Å; F563-Q566 WeakPolarHBondContact O-CB 3.32Å; F563-Q566 PolarHBondContact O-N 2.95Å; V564-Q566 PolarHBondContact O-N 2.9Å; Q566-K568 VanDerWaalsContact C-N 3.31Å; Q566-K568 PolarHBondContact O-N 3.37Å; Q566-K569 PolarHBondContact O-N 3.47Å; Q566-E729 PolarHBondContact NE2-OE2 3.01Å; Q566-L772 HydrophobicContact CB-CD1 4.44Å
567	L	92.2	Very high	91.8	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.8	-29.9	179.2	-168.3	63.6	0	0	0	113.4	F563 V564 K569 I641 M768 V771 L772 F868 L899	F563-L567 HydrophobicContact CE1-CD2 4.18Å; F563-L567 PolarHBondContact O-N 3.44Å; V564-L567 PolarHBondContact O-N 3.18Å; V564-L567 VanDerWaalsContact O-N 3.12Å; L567-K569 VanDerWaalsContact C-N 3.3Å; L567-K569 PolarHBondContact O-N 2.89Å; L567-I641 HydrophobicContact CD2-CD1 4.24Å; L567-M768 HydrophobicContact CD1-CE 3.81Å; L567-M768 HydrophobicContact CD2-CE 3.46Å; L567-M768 VanDerWaalsContact CD2-CE 3.46Å; L567-M768 HydrophobicContact CG-CE 3.49Å; L567-M768 VanDerWaalsContact CG-CE 3.49Å; L567-V771 WeakPolarHBondContact O-CG1 3.2Å; L567-L772 HydrophobicContact CD1-CB 3.97Å; L567-L772 HydrophobicContact CD1-CD1 4.42Å; L567-F868 HydrophobicContact CD1-CE1 4.46Å; L567-F868 HydrophobicContact CD1-CZ 4.3Å; L567-L899 HydrophobicContact CD2-CD2 3.94Å
568	K	90.6	Very high	92.1	Very high	19 Å²	19	19.5 Å²	19.5	8%	0.083	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-23.7	-179.2	82.1	-174.1	-173.1	119.1	0	113.9	P545 V564 N565 Q566 G570 G571 Y573 K608	P545-K568 WeakPolarHBondContact CG-O 3.38Å; V564-K568 PolarHBondContact O-N 3.2Å; N565-K568 WeakPolarHBondContact O-CG 3.43Å; N565-K568 VanDerWaalsContact OD1-CE 3.32Å; N565-K568 WeakPolarHBondContact OD1-CE 3.22Å; Q566-K568 VanDerWaalsContact C-N 3.31Å; Q566-K568 PolarHBondContact O-N 3.37Å; K568-G570 PolarHBondContact O-N 3.01Å; K568-G571 WeakPolarHBondContact CD-O 3.5Å; K568-G571 PolarHBondContact NZ-O 3.47Å; K568-G571 PolarHBondContact O-N 3.39Å; K568-Y573 HydrophobicContact CD-CD1 3.87Å; K568-Y573 HydrophobicContact CD-CG 3.93Å; K568-K608 WeakPolarHBondContact CE-O 3.17Å; K568-K608 PolarHBondContact NZ-O 3.14Å
569	K	83.9	Confident	92.2	Very high	104 Å²	104	22.3 Å²	22.3	45%	0.452	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	40	47.3	-178.5	-159.6	-168	174.3	-164.9	0	114.7	Q566 L567 V771 M774	Q566-K569 PolarHBondContact O-N 3.47Å; L567-K569 VanDerWaalsContact C-N 3.3Å; L567-K569 PolarHBondContact O-N 2.89Å; K569-V771 HydrophobicContact CB-CG1 3.49Å; K569-V771 VanDerWaalsContact CB-CG1 3.49Å; K569-V771 HydrophobicContact CD-CG1 4Å; K569-V771 HydrophobicContact CG-CG1 4.35Å; K569-M774 HydrophobicContact CD-CB 3.88Å; K569-M774 PolarHBondContact NZ-SD 2.81Å
570	G	82.1	Confident	92.3	Very high	73 Å²	73	24.5 Å²	24.5	75%	0.753	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.6	-2.6	179.7	0	0	0	0	0	115.9	K568	K568-G570 PolarHBondContact O-N 3.01Å
571	G	89.1	Confident	92.2	Very high	10 Å²	10	25.1 Å²	25.1	10%	0.103	15%	0.15	C	C	.	.	S	Bend	trans	-68.6	172.5	169	0	0	0	0	0	113.6	P545 K568	P545-G571 WeakPolarHBondContact O-CA 3.24Å; K568-G571 WeakPolarHBondContact CD-O 3.5Å; K568-G571 PolarHBondContact NZ-O 3.47Å; K568-G571 PolarHBondContact O-N 3.39Å
572	L	93.3	Very high	91.9	Very high	18 Å²	18	29.4 Å²	29.4	9%	0.094	17%	0.173	C	C	.	.			trans	-61.8	136.2	173.2	177.7	66.2	0	0	0	109.4	Q546 V547 V574 F610 M635 P637	Q546-L572 CarbonylContact C-O 3.53Å; Q546-L572 WeakPolarHBondContact CA-O 3.31Å; Q546-L572 HydrophobicContact CB-CB 4.02Å; Q546-L572 HydrophobicContact CG-CB 4.06Å; V547-L572 PolarHBondContact N-O 3.4Å; L572-V574 HydrophobicContact CD1-CG2 4.01Å; L572-V574 HydrophobicContact CD2-CG2 4.22Å; L572-V574 HydrophobicContact CG-CG2 3.95Å; L572-F610 HydrophobicContact CD1-CD2 3.5Å; L572-F610 HydrophobicContact CD1-CE2 3.63Å; L572-M635 HydrophobicContact CD1-CE 4.39Å; L572-P637 HydrophobicContact CD2-CG 4.37Å
573	Y	96.1	Very high	91.8	Very high	1 Å²	1	31.6 Å²	31.6	0%	0.004	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	123.8	174.2	176.4	-151.2	0	0	0	108.9	V547 L549 I561 V564 N565 K568 L575 V607 A609 F610	V547-Y573 HydrophobicContact CB-CD2 4.14Å; V547-Y573 HydrophobicContact CG1-CD2 4.19Å; V547-Y573 HydrophobicContact CG1-CE2 4.37Å; V547-Y573 CarbonylContact O-C 3.5Å; V547-Y573 WeakPolarHBondContact O-CA 3.27Å; L549-Y573 HydrophobicContact CB-CE2 3.72Å; L549-Y573 HydrophobicContact CD2-CE2 4.26Å; L549-Y573 WeakPolarHBondContact CD2-OH 3.27Å; I561-Y573 VanDerWaalsContact CA-OH 3.29Å; I561-Y573 WeakPolarHBondContact CA-OH 3.49Å; I561-Y573 PolarHBondContact O-OH 3.5Å; V564-Y573 HydrophobicContact CB-CE2 4.1Å; V564-Y573 HydrophobicContact CG1-CD2 3.85Å; V564-Y573 HydrophobicContact CG1-CE1 4.31Å; V564-Y573 HydrophobicContact CG1-CE2 3.34Å; N565-Y573 HydrophobicContact CB-CD1 4.41Å; N565-Y573 HydrophobicContact CB-CE1 4.01Å; K568-Y573 HydrophobicContact CD-CD1 3.87Å; K568-Y573 HydrophobicContact CD-CG 3.93Å; Y573-L575 HydrophobicContact CE1-CD2 4.4Å; Y573-L575 HydrophobicContact CE2-CD2 3.84Å; Y573-L575 WeakPolarHBondContact OH-CD2 3.38Å; Y573-V607 HydrophobicContact CD1-CG1 3.96Å; Y573-V607 HydrophobicContact CE1-CG1 3.57Å; Y573-A609 HydrophobicContact CD1-CB 3.57Å; Y573-A609 HydrophobicContact CE1-CB 3.95Å; Y573-A609 HydrophobicContact CG-CB 4Å; Y573-A609 CarbonylContact O-C 3.54Å; Y573-A609 VanDerWaalsContact O-CA 3.27Å; Y573-A609 WeakPolarHBondContact O-CA 3.16Å; Y573-F610 PolarHBondContact O-N 2.9Å
574	V	96.9	Very high	91.6	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.4	-177.9	-171.2	0	0	0	0	108.8	V547 L548 L549 L572 F610 D612 T630 P637	V547-V574 PolarHBondContact O-N 3.28Å; L548-V574 WeakPolarHBondContact CA-O 3.2Å; L548-V574 HydrophobicContact CD1-CB 4Å; L548-V574 HydrophobicContact CD1-CG1 4.01Å; L549-V574 PolarHBondContact N-O 2.93Å; L572-V574 HydrophobicContact CD1-CG2 4.01Å; L572-V574 HydrophobicContact CD2-CG2 4.22Å; L572-V574 HydrophobicContact CG-CG2 3.95Å; V574-F610 CarbonylContact C-O 3.35Å; V574-F610 VanDerWaalsContact CA-O 3.31Å; V574-F610 WeakPolarHBondContact CA-O 3.4Å; V574-F610 HydrophobicContact CG1-CB 4.49Å; V574-F610 HydrophobicContact CG2-CB 4.32Å; V574-D612 HydrophobicContact CG1-CB 3.84Å; V574-T630 HydrophobicContact CB-CG2 4.03Å; V574-T630 HydrophobicContact CG1-CG2 3.8Å; V574-T630 HydrophobicContact CG2-CG2 3.73Å; V574-P637 HydrophobicContact CG2-CG 4.43Å
575	L	96.8	Very high	91.3	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	115.2	168.1	-60.4	-177.9	0	0	0	108.1	L549 V551 I561 Y573 V602 A609 F610 D612	L549-L575 HydrophobicContact CB-CD2 4.29Å; L549-L575 HydrophobicContact CD2-CD2 4.01Å; V551-L575 HydrophobicContact CG2-CD2 4.27Å; I561-L575 HydrophobicContact CG1-CD2 4.16Å; I561-L575 HydrophobicContact CG2-CD1 4.45Å; I561-L575 HydrophobicContact CG2-CD2 4.25Å; Y573-L575 HydrophobicContact CE1-CD2 4.4Å; Y573-L575 HydrophobicContact CE2-CD2 3.84Å; Y573-L575 WeakPolarHBondContact OH-CD2 3.38Å; L575-V602 HydrophobicContact CD1-CG2 3.67Å; L575-A609 HydrophobicContact CD1-CB 4.36Å; L575-A609 HydrophobicContact CG-CB 4.01Å; L575-F610 PolarHBondContact N-O 3.03Å; L575-D612 PolarHBondContact O-N 3.46Å
576	G	96.1	Very high	91	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.4	178.6	0	0	0	0	0	111.3	L549 M550 V551 D612	L549-G576 PolarHBondContact O-N 3.45Å; M550-G576 WeakPolarHBondContact CA-O 3.15Å; V551-G576 PolarHBondContact N-O 3.47Å; G576-D612 WeakPolarHBondContact CA-O 3.44Å
577	H	95.3	Very high	90.8	Very high	25 Å²	25	49.4 Å²	49.4	12%	0.116	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.8	170.6	-179.3	72.3	0	0	0	110.6	V551 S552 W598 D612 L613 T614	V551-H577 PolarHBondContact O-ND1 2.92Å; S552-H577 PolarHBondContact O-CE1 3.45Å; S552-H577 PolarHBondContact O-ND1 3.33Å; H577-W598 HydrophobicContact CB-CH2 3.83Å; H577-W598 HydrophobicContact CB-CZ2 3.54Å; H577-W598 AromaticContact CG-CZ2 3.48Å; H577-W598 VanDerWaalsContact CG-CZ2 3.48Å; H577-W598 AromaticContact ND1-CZ2 3.72Å; H577-D612 PolarHBondContact N-O 3.12Å; H577-D612 VanDerWaalsContact N-O 3.13Å; H577-L613 HydrophobicContact CB-CD2 3.59Å; H577-L613 WeakPolarHBondContact O-CA 2.95Å; H577-T614 PolarHBondContact O-N 3.15Å
578	V	94.5	Very high	90.6	Very high	14 Å²	14	53.4 Å²	53.4	9%	0.085	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	111.1	175.5	-175.4	0	0	0	0	108.2	M550 T614 L626	M550-V578 HydrophobicContact CE-CG2 3.73Å; V578-T614 CarbonylContact C-O 3.59Å; V578-T614 WeakPolarHBondContact CA-O 3.45Å; V578-T614 HydrophobicContact CB-CG2 4.19Å; V578-T614 HydrophobicContact CG1-CG2 4.12Å; V578-T614 HydrophobicContact CG2-CG2 3.75Å; V578-L626 HydrophobicContact CG2-CD1 4.16Å
579	Q	91.5	Very high	90.4	Very high	60 Å²	60	55.2 Å²	55.2	28%	0.28	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	125.2	166.8	-178.6	63.3	47	0	0	108	P590 V591 T614 L615 S616	Q579-P590 HydrophobicContact CG-CG 4.4Å; Q579-V591 HydrophobicContact CB-CG2 4.47Å; Q579-T614 PolarHBondContact N-O 3.44Å; Q579-L615 HydrophobicContact CB-CD1 4.12Å; Q579-L615 HydrophobicContact CG-CD1 3.85Å; Q579-L615 WeakPolarHBondContact O-CA 3.49Å; Q579-S616 PolarHBondContact O-N 3.41Å
580	L	90.9	Very high	90.6	Very high	64 Å²	64	51.8 Å²	51.8	34%	0.335	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	128.7	174	-67	176.3	0	0	0	109.6	S616 V619 W697	L580-S616 WeakPolarHBondContact CA-O 3.29Å; L580-V619 HydrophobicContact CD1-CG2 4.38Å; L580-V619 HydrophobicContact CD2-CG2 3.82Å; L580-V619 HydrophobicContact CG-CG2 4.33Å; L580-W697 HydrophobicContact CD1-CE3 4.36Å
581	G	89.9	Confident	90.8	Very high	24 Å²	24	49 Å²	49	25%	0.247	29%	0.289	C	S	.	.			trans	163.4	168.2	177.5	0	0	0	0	0	112	S616	G581-S616 PolarHBondContact N-O 3.35Å; G581-S616 CarbonylContact O-C 3.36Å; G581-S616 VanDerWaalsContact O-C 3.31Å
582	D	89.4	Confident	90.6	Very high	90 Å²	90	55.4 Å²	55.4	48%	0.481	32%	0.317	S	S	.	.			trans	-116	128.5	173.7	-171.7	10.3	0	0	0	109	D584 S585	D582-D584 PolarHBondContact O-N 3.38Å; D582-S585 PolarHBondContact O-N 3.15Å; D582-S585 VanDerWaalsContact O-N 3.12Å; D582-S585 PolarHBondContact O-OG 2.95Å
583	L	87.9	Confident	90.1	Very high	91 Å²	91	58.9 Å²	58.9	48%	0.476	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-64.3	-33.8	-173.3	-172.5	62	0	0	0	111.4	S585 L586 D589 L615	L583-S585 PolarHBondContact O-N 2.99Å; L583-L586 PolarHBondContact O-N 3.02Å; L583-L586 VanDerWaalsContact O-N 3.11Å; L583-D589 HydrophobicContact CD1-CB 4.19Å; L583-L615 HydrophobicContact CB-CD2 3.89Å; L583-L615 HydrophobicContact CD1-CD2 3.9Å; L583-L615 HydrophobicContact CG-CD2 4.48Å
584	D	88.8	Confident	89.7	Confident	151 Å²	151	60 Å²	60	81%	0.807	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-64.1	-23.7	179.4	-68.3	-17.8	0	0	0	112.3	D582	D582-D584 PolarHBondContact O-N 3.38Å
585	S	89.2	Confident	89.3	Confident	88 Å²	88	64 Å²	64	62%	0.615	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-87.5	-9.2	178.9	72.8	0	0	0	0	114.1	D582 L583	D582-S585 PolarHBondContact O-N 3.15Å; D582-S585 VanDerWaalsContact O-N 3.12Å; D582-S585 PolarHBondContact O-OG 2.95Å; L583-S585 PolarHBondContact O-N 2.99Å
586	L	86.4	Confident	88.9	Confident	67 Å²	67	67.3 Å²	67.3	35%	0.351	38%	0.377	S	S	.	.	S	Bend	trans	-112.7	141.4	-171.3	-64	173	0	0	0	111.2	L583 S588 P590 L615	L583-L586 PolarHBondContact O-N 3.02Å; L583-L586 VanDerWaalsContact O-N 3.11Å; L586-S588 PolarHBondContact O-N 2.58Å; L586-P590 HydrophobicContact CD1-CG 3.83Å; L586-L615 HydrophobicContact CD1-CD1 4.45Å; L586-L615 HydrophobicContact CD1-CD2 4.27Å
587	P	86.9	Confident	88.6	Confident	135 Å²	135	69.3 Å²	69.3	88%	0.877	39%	0.386	S	S	*	.	S	Bend	trans	-69.1	-22.5	-178.9	28.6	-35.6	0	0	0	113.4
588	S	87.6	Confident	88.4	Confident	83 Å²	83	68.3 Å²	68.3	58%	0.58	38%	0.381	S	S	*	.	S	Bend	trans	-157.9	158.6	179.7	58.6	0	0	0	0	109.7	L586 P590	L586-S588 PolarHBondContact O-N 2.58Å; S588-P590 VanDerWaalsContact O-CD 3.26Å; S588-P590 WeakPolarHBondContact O-CD 3.48Å
589	D	86.9	Confident	88.2	Confident	58 Å²	58	69.5 Å²	69.5	31%	0.31	39%	0.387	S	S	.	.			trans	-64.7	113.4	176.6	-177.5	3.6	0	0	0	111	L583 V591	L583-D589 HydrophobicContact CD1-CB 4.19Å; D589-V591 PolarHBondContact O-N 3.43Å; D589-V591 VanDerWaalsContact OD1-CB 3.24Å; D589-V591 WeakPolarHBondContact OD1-CB 3.48Å; D589-V591 WeakPolarHBondContact OD1-CG2 3.46Å; D589-V591 PolarHBondContact OD1-N 3.4Å
590	P	86.2	Confident	88	Confident	31 Å²	31	66.7 Å²	66.7	20%	0.201	37%	0.374	C	S	.	.	H	α-helix	trans	-69	-18.5	180	31	-37.2	0	0	0	112.4	Q579 L586 S588 Q592 T593 Q594 L615	Q579-P590 HydrophobicContact CG-CG 4.4Å; L586-P590 HydrophobicContact CD1-CG 3.83Å; S588-P590 VanDerWaalsContact O-CD 3.26Å; S588-P590 WeakPolarHBondContact O-CD 3.48Å; P590-Q592 VanDerWaalsContact C-N 3.34Å; P590-Q592 PolarHBondContact O-N 3.37Å; P590-T593 PolarHBondContact O-OG1 3.49Å; P590-Q594 WeakPolarHBondContact O-CG 3.48Å; P590-Q594 PolarHBondContact O-N 3.42Å; P590-L615 HydrophobicContact CG-CD1 4.2Å
591	V	87.9	Confident	87.9	Confident	14 Å²	14	63.6 Å²	63.6	9%	0.085	36%	0.358	C	S	.	.	H	α-helix	trans	-69.6	-33.2	-174.3	176.2	0	0	0	0	111.9	Q579 D589 T593 Q594 Y595 L613 L615	Q579-V591 HydrophobicContact CB-CG2 4.47Å; D589-V591 PolarHBondContact O-N 3.43Å; D589-V591 VanDerWaalsContact OD1-CB 3.24Å; D589-V591 WeakPolarHBondContact OD1-CB 3.48Å; D589-V591 WeakPolarHBondContact OD1-CG2 3.46Å; D589-V591 PolarHBondContact OD1-N 3.4Å; V591-T593 VanDerWaalsContact C-N 3.34Å; V591-T593 PolarHBondContact O-N 3.42Å; V591-Q594 PolarHBondContact O-N 3.12Å; V591-Y595 PolarHBondContact O-N 2.95Å; V591-Y595 VanDerWaalsContact O-N 3.07Å; V591-L613 HydrophobicContact CG1-CB 3.27Å; V591-L613 HydrophobicContact CG1-CD1 3.98Å; V591-L613 HydrophobicContact CG1-CG 4.23Å; V591-L615 HydrophobicContact CG2-CB 4.08Å
592	Q	84.8	Confident	87.9	Confident	145 Å²	145	62.8 Å²	62.8	68%	0.678	35%	0.348	S	S	*	.	H	α-helix	trans	-62.4	-40.1	-178.6	-69.6	-169.4	-2.4	0	0	112.6	P590	P590-Q592 VanDerWaalsContact C-N 3.34Å; P590-Q592 PolarHBondContact O-N 3.37Å
593	T	82.9	Confident	87.7	Confident	92 Å²	92	62.7 Å²	62.7	56%	0.564	35%	0.348	S	S	*	.	H	α-helix	trans	-72.6	-37.4	179.1	55.1	0	0	0	0	111.3	P590 V591 Y595 F597	P590-T593 PolarHBondContact O-OG1 3.49Å; V591-T593 VanDerWaalsContact C-N 3.34Å; V591-T593 PolarHBondContact O-N 3.42Å; T593-Y595 VanDerWaalsContact C-N 3.29Å; T593-Y595 PolarHBondContact O-N 3.14Å; T593-F597 VanDerWaalsContact O-CD2 3.22Å; T593-F597 WeakPolarHBondContact O-CD2 3.38Å; T593-F597 WeakPolarHBondContact O-CE2 3.4Å
594	Q	86.9	Confident	87.5	Confident	25 Å²	25	61 Å²	61	12%	0.117	34%	0.336	C	S	.	.	H	α-helix	trans	-65.9	-30.4	177.7	-64.1	-175.3	3.4	0	0	112.8	P590 V591 N596 F597 W598 L613	P590-Q594 WeakPolarHBondContact O-CG 3.48Å; P590-Q594 PolarHBondContact O-N 3.42Å; V591-Q594 PolarHBondContact O-N 3.12Å; Q594-N596 VanDerWaalsContact C-N 3.32Å; Q594-N596 PolarHBondContact O-N 3.18Å; Q594-F597 WeakPolarHBondContact O-CB 3.4Å; Q594-F597 PolarHBondContact O-N 3.13Å; Q594-W598 PolarHBondContact O-N 3.32Å; Q594-L613 HydrophobicContact CB-CD1 3.99Å
595	Y	89.4	Confident	87.4	Confident	85 Å²	85	54.8 Å²	54.8	33%	0.333	30%	0.303	S	S	.	.	H	α-helix	trans	-54.9	-44	-173.2	-159.1	-99.7	0	0	0	113.3	V591 T593 F597 W598 L599 V611 L613	V591-Y595 PolarHBondContact O-N 2.95Å; V591-Y595 VanDerWaalsContact O-N 3.07Å; T593-Y595 VanDerWaalsContact C-N 3.29Å; T593-Y595 PolarHBondContact O-N 3.14Å; Y595-F597 VanDerWaalsContact C-N 3.31Å; Y595-F597 PolarHBondContact O-N 3.46Å; Y595-W598 PolarHBondContact O-N 2.64Å; Y595-L599 HydrophobicContact CD1-CD1 3.74Å; Y595-L599 HydrophobicContact CD1-CG 4.03Å; Y595-L599 HydrophobicContact CE1-CD1 3.67Å; Y595-L599 HydrophobicContact CE1-CD2 4.08Å; Y595-L599 HydrophobicContact CE1-CG 3.91Å; Y595-L599 PolarHBondContact O-N 3.33Å; Y595-V611 HydrophobicContact CE2-CB 4.23Å; Y595-V611 HydrophobicContact CE2-CG1 4.21Å; Y595-V611 WeakPolarHBondContact CE2-O 3.5Å; Y595-V611 PolarHBondContact OH-O 2.95Å; Y595-L613 HydrophobicContact CD2-CD1 3.93Å; Y595-L613 HydrophobicContact CD2-CG 4.08Å
596	N	87.3	Confident	87.2	Confident	71 Å²	71	53.3 Å²	53.3	38%	0.38	30%	0.302	S	S	.	.	H	α-helix	trans	-63.8	-34.5	179.6	-68	-19.2	0	0	0	112.6	Q594 L599 S600 F675 V677	Q594-N596 VanDerWaalsContact C-N 3.32Å; Q594-N596 PolarHBondContact O-N 3.18Å; N596-L599 PolarHBondContact O-N 3.12Å; N596-S600 WeakPolarHBondContact O-CB 3.48Å; N596-S600 PolarHBondContact O-N 3.49Å; N596-F675 HydrophobicContact CB-CB 4.39Å; N596-V677 HydrophobicContact CB-CG2 4.34Å
597	F	89.6	Confident	87.4	Confident	42 Å²	42	50.6 Å²	50.6	18%	0.184	29%	0.288	C	S	.	.	H	α-helix	trans	-67.5	-39.8	176.3	-64	-87.7	0	0	0	111.6	T593 Q594 Y595 S600 L601 V677 L682 H685 F686	T593-F597 VanDerWaalsContact O-CD2 3.22Å; T593-F597 WeakPolarHBondContact O-CD2 3.38Å; T593-F597 WeakPolarHBondContact O-CE2 3.4Å; Q594-F597 WeakPolarHBondContact O-CB 3.4Å; Q594-F597 PolarHBondContact O-N 3.13Å; Y595-F597 VanDerWaalsContact C-N 3.31Å; Y595-F597 PolarHBondContact O-N 3.46Å; F597-S600 PolarHBondContact O-N 2.92Å; F597-L601 WeakPolarHBondContact O-CB 3.31Å; F597-L601 PolarHBondContact O-N 3.3Å; F597-V677 HydrophobicContact CD1-CG1 3.53Å; F597-V677 HydrophobicContact CD1-CG2 4.23Å; F597-V677 HydrophobicContact CE1-CG1 3.58Å; F597-V677 HydrophobicContact CE1-CG2 4.28Å; F597-L682 HydrophobicContact CB-CD1 4.14Å; F597-L682 HydrophobicContact CD1-CD1 4.19Å; F597-L682 VanDerWaalsContact O-CD1 3.27Å; F597-L682 WeakPolarHBondContact O-CD1 3.29Å; F597-H685 HydrophobicContact CD1-CB 3.58Å; F597-H685 AromaticContact CD1-CD2 3.99Å; F597-H685 AromaticContact CD1-CG 3.65Å; F597-H685 AromaticContact CD2-CD2 3.49Å; F597-H685 VanDerWaalsContact CD2-CD2 3.49Å; F597-H685 WeakPolarHBondContact CD2-CD2 3.25Å; F597-H685 AromaticContact CD2-CG 3.87Å; F597-H685 AromaticContact CD2-NE2 3.61Å; F597-H685 HydrophobicContact CE1-CB 3.73Å; F597-H685 AromaticContact CE1-CG 3.97Å; F597-H685 AromaticContact CE2-CD2 3.52Å; F597-H685 AromaticContact CE2-NE2 3.95Å; F597-H685 HydrophobicContact CG-CB 4.07Å; F597-H685 AromaticContact CG-CD2 3.73Å; F597-H685 AromaticContact CG-CG 3.6Å; F597-H685 AromaticContact CG-ND1 3.83Å; F597-H685 HydrophobicContact CZ-CB 4.33Å; F597-H685 AromaticContact CZ-CD2 3.8Å; F597-F686 HydrophobicContact CB-CE2 4.48Å; F597-F686 HydrophobicContact CB-CZ 4.2Å
598	W	91.5	Very high	87.6	Confident	4 Å²	4	52 Å²	52	2%	0.015	28%	0.28	C	S	.	.	H	α-helix	trans	-69.8	-36.2	176.2	-76.5	89.5	0	0	0	112.7	V551 P554 H577 Q594 Y595 L601 V602 V611 L613 F686	V551-W598 HydrophobicContact CB-CH2 3.9Å; V551-W598 HydrophobicContact CB-CZ3 4.08Å; V551-W598 HydrophobicContact CG1-CH2 3.84Å; V551-W598 HydrophobicContact CG1-CZ3 4.11Å; P554-W598 HydrophobicContact CG-CE3 4.27Å; P554-W598 HydrophobicContact CG-CH2 3.52Å; P554-W598 HydrophobicContact CG-CZ2 3.99Å; P554-W598 HydrophobicContact CG-CZ3 3.68Å; H577-W598 HydrophobicContact CB-CH2 3.83Å; H577-W598 HydrophobicContact CB-CZ2 3.54Å; H577-W598 AromaticContact CG-CZ2 3.48Å; H577-W598 VanDerWaalsContact CG-CZ2 3.48Å; H577-W598 AromaticContact ND1-CZ2 3.72Å; Q594-W598 PolarHBondContact O-N 3.32Å; Y595-W598 PolarHBondContact O-N 2.64Å; W598-L601 HydrophobicContact CE3-CD2 4.1Å; W598-L601 HydrophobicContact CZ3-CD2 4.41Å; W598-L601 WeakPolarHBondContact O-CB 3.39Å; W598-L601 PolarHBondContact O-N 3.35Å; W598-V602 WeakPolarHBondContact O-CG2 3.41Å; W598-V602 PolarHBondContact O-N 3.19Å; W598-V602 VanDerWaalsContact O-N 3.09Å; W598-V611 HydrophobicContact CB-CB 4.33Å; W598-V611 HydrophobicContact CB-CG1 3.51Å; W598-V611 HydrophobicContact CB-CG2 4.03Å; W598-V611 HydrophobicContact CD2-CG1 4.34Å; W598-V611 HydrophobicContact CE3-CG1 4.47Å; W598-V611 HydrophobicContact CG-CG1 3.98Å; W598-L613 HydrophobicContact CD2-CD2 3.92Å; W598-L613 HydrophobicContact CG-CD1 4.27Å; W598-L613 HydrophobicContact CG-CD2 3.89Å; W598-L613 HydrophobicContact CZ2-CD2 4.43Å; W598-F686 HydrophobicContact CD2-CE1 4.27Å; W598-F686 HydrophobicContact CD2-CZ 4.46Å; W598-F686 AromaticContact CE2-CE1 3.88Å; W598-F686 HydrophobicContact CG-CZ 4.44Å; W598-F686 HydrophobicContact CZ2-CE1 4.23Å; W598-F686 AromaticContact NE1-CE1 3.91Å
599	L	90.6	Very high	87.9	Confident	39 Å²	39	48.9 Å²	48.9	20%	0.204	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-45.9	172.9	-69.3	178.4	0	0	0	111.5	Y595 N596 L601 V602 D603 V611 F675	Y595-L599 HydrophobicContact CD1-CD1 3.74Å; Y595-L599 HydrophobicContact CD1-CG 4.03Å; Y595-L599 HydrophobicContact CE1-CD1 3.67Å; Y595-L599 HydrophobicContact CE1-CD2 4.08Å; Y595-L599 HydrophobicContact CE1-CG 3.91Å; Y595-L599 PolarHBondContact O-N 3.33Å; N596-L599 PolarHBondContact O-N 3.12Å; L599-L601 VanDerWaalsContact C-N 3.29Å; L599-L601 PolarHBondContact O-N 3.31Å; L599-V602 PolarHBondContact O-N 3.3Å; L599-V602 VanDerWaalsContact O-N 3.1Å; L599-D603 PolarHBondContact O-N 3.05Å; L599-V611 HydrophobicContact CD2-CG2 4.24Å; L599-F675 HydrophobicContact CB-CD2 3.87Å; L599-F675 HydrophobicContact CB-CE2 3.66Å; L599-F675 HydrophobicContact CB-CG 4.47Å; L599-F675 HydrophobicContact CB-CZ 4.12Å; L599-F675 HydrophobicContact CD1-CD1 4.34Å; L599-F675 HydrophobicContact CD1-CE1 4.05Å; L599-F675 HydrophobicContact CD1-CE2 4.43Å; L599-F675 HydrophobicContact CD1-CZ 4.11Å
600	S	86.1	Confident	88.2	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.007	27%	0.271	C	S	.	.	H	α-helix	trans	-59.1	-39.7	175.5	-179.8	0	0	0	0	112.1	N596 F597 V602 D603 K604	N596-S600 WeakPolarHBondContact O-CB 3.48Å; N596-S600 PolarHBondContact O-N 3.49Å; F597-S600 PolarHBondContact O-N 2.92Å; S600-V602 PolarHBondContact O-N 3.45Å; S600-D603 PolarHBondContact O-N 3.36Å; S600-K604 WeakPolarHBondContact O-CB 3.47Å; S600-K604 WeakPolarHBondContact O-CG 3.19Å; S600-K604 PolarHBondContact O-N 3.41Å
601	L	88.9	Confident	88.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.6	-45.4	172.8	174.7	74.6	0	0	0	112.5	P554 F597 W598 L599 D603 K604 L605 F654 F660 F686	P554-L601 HydrophobicContact CB-CD1 4.29Å; P554-L601 HydrophobicContact CB-CD2 3.48Å; P554-L601 VanDerWaalsContact CB-CD2 3.48Å; P554-L601 HydrophobicContact CG-CD2 3.62Å; F597-L601 WeakPolarHBondContact O-CB 3.31Å; F597-L601 PolarHBondContact O-N 3.3Å; W598-L601 HydrophobicContact CE3-CD2 4.1Å; W598-L601 HydrophobicContact CZ3-CD2 4.41Å; W598-L601 WeakPolarHBondContact O-CB 3.39Å; W598-L601 PolarHBondContact O-N 3.35Å; L599-L601 VanDerWaalsContact C-N 3.29Å; L599-L601 PolarHBondContact O-N 3.31Å; L601-D603 VanDerWaalsContact C-N 3.35Å; L601-K604 PolarHBondContact O-N 3.08Å; L601-L605 HydrophobicContact CD1-CD1 3.92Å; L601-L605 HydrophobicContact CD1-CG 4.26Å; L601-L605 HydrophobicContact CG-CD1 3.99Å; L601-L605 WeakPolarHBondContact O-CB 3.47Å; L601-L605 WeakPolarHBondContact O-CG 3.46Å; L601-L605 PolarHBondContact O-N 3.08Å; L601-F654 HydrophobicContact CD1-CE1 3.96Å; L601-F654 HydrophobicContact CD1-CZ 3.71Å; L601-F660 HydrophobicContact CD1-CE1 4.37Å; L601-F660 HydrophobicContact CD1-CZ 4.02Å; L601-F686 HydrophobicContact CB-CE2 4.42Å; L601-F686 HydrophobicContact CB-CZ 4.46Å; L601-F686 HydrophobicContact CD2-CZ 4.26Å
602	V	90.4	Very high	89	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.042	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-43.2	-179.4	169.9	0	0	0	0	111.1	L575 W598 L599 S600 L605 G606 V607 A609 V611	L575-V602 HydrophobicContact CD1-CG2 3.67Å; W598-V602 WeakPolarHBondContact O-CG2 3.41Å; W598-V602 PolarHBondContact O-N 3.19Å; W598-V602 VanDerWaalsContact O-N 3.09Å; L599-V602 PolarHBondContact O-N 3.3Å; L599-V602 VanDerWaalsContact O-N 3.1Å; S600-V602 PolarHBondContact O-N 3.45Å; V602-L605 PolarHBondContact O-N 3.08Å; V602-G606 PolarHBondContact O-N 3.17Å; V602-G606 VanDerWaalsContact O-N 3.14Å; V602-V607 WeakPolarHBondContact CG1-O 3.46Å; V602-V607 PolarHBondContact O-N 3.47Å; V602-V607 VanDerWaalsContact O-N 3.09Å; V602-A609 HydrophobicContact CG1-CB 4.47Å; V602-V611 HydrophobicContact CG2-CG2 3.76Å
603	D	85.5	Confident	89.5	Confident	88 Å²	88	46.4 Å²	46.4	47%	0.471	24%	0.242	S	C	.	.	H	α-helix	trans	-65.7	-44.7	177.6	-76.2	-7	0	0	0	111.3	L599 S600 L601 L605 G606 F675	L599-D603 PolarHBondContact O-N 3.05Å; S600-D603 PolarHBondContact O-N 3.36Å; L601-D603 VanDerWaalsContact C-N 3.35Å; D603-L605 PolarHBondContact O-N 3.05Å; D603-G606 PolarHBondContact O-N 2.84Å; D603-F675 VanDerWaalsContact OD2-CE2 3.23Å; D603-F675 WeakPolarHBondContact OD2-CE2 2.93Å
604	K	84.2	Confident	90	Very high	55 Å²	55	43 Å²	43	24%	0.239	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-37.3	176.8	-74.4	-67.8	174.4	-158.5	0	113.5	S600 L601 G606 F660 E672 N674	S600-K604 WeakPolarHBondContact O-CB 3.47Å; S600-K604 WeakPolarHBondContact O-CG 3.19Å; S600-K604 PolarHBondContact O-N 3.41Å; L601-K604 PolarHBondContact O-N 3.08Å; K604-G606 PolarHBondContact O-N 3.48Å; K604-F660 HydrophobicContact CB-CE1 4.15Å; K604-F660 HydrophobicContact CB-CZ 4.06Å; K604-E672 IonicContact NZ-OE2 3.53Å; K604-E672 PolarHBondContact NZ-OE2 3.49Å; K604-N674 WeakPolarHBondContact CE-OD1 3.49Å
605	L	85.6	Confident	90.4	Very high	20 Å²	20	43.5 Å²	43.5	11%	0.105	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-10.1	174.6	-68.7	174.5	0	0	0	112.9	I561 L601 V602 D603 V607 F660	I561-L605 HydrophobicContact CD1-CD1 4.47Å; I561-L605 HydrophobicContact CG2-CD1 4.09Å; L601-L605 HydrophobicContact CD1-CD1 3.92Å; L601-L605 HydrophobicContact CD1-CG 4.26Å; L601-L605 HydrophobicContact CG-CD1 3.99Å; L601-L605 WeakPolarHBondContact O-CB 3.47Å; L601-L605 WeakPolarHBondContact O-CG 3.46Å; L601-L605 PolarHBondContact O-N 3.08Å; V602-L605 PolarHBondContact O-N 3.08Å; D603-L605 PolarHBondContact O-N 3.05Å; L605-V607 VanDerWaalsContact C-N 3.25Å; L605-V607 HydrophobicContact CB-CB 4.4Å; L605-V607 HydrophobicContact CB-CG2 3.74Å; L605-V607 PolarHBondContact O-N 3.41Å; L605-F660 HydrophobicContact CD2-CE2 3.76Å; L605-F660 HydrophobicContact CD2-CZ 4.02Å; L605-F660 HydrophobicContact CG-CE2 4.49Å; L605-F660 HydrophobicContact CG-CZ 4.26Å
606	G	86.3	Confident	90.6	Very high	58 Å²	58	39.6 Å²	39.6	60%	0.598	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	31	-175.7	0	0	0	0	0	113.1	V602 D603 K604	V602-G606 PolarHBondContact O-N 3.17Å; V602-G606 VanDerWaalsContact O-N 3.14Å; D603-G606 PolarHBondContact O-N 2.84Å; K604-G606 PolarHBondContact O-N 3.48Å
607	V	89.1	Confident	90.8	Very high	9 Å²	9	40.7 Å²	40.7	6%	0.055	22%	0.221	C	C	.	.			trans	-97.2	140.2	-173.7	171.5	0	0	0	0	110.3	I561 L562 N565 Y573 V602 L605 A609	I561-V607 HydrophobicContact CG2-CG1 4.31Å; I561-V607 HydrophobicContact CG2-CG2 4.13Å; L562-V607 HydrophobicContact CD2-CG2 3.86Å; N565-V607 HydrophobicContact CB-CG1 3.97Å; N565-V607 HydrophobicContact CB-CG2 4.31Å; Y573-V607 HydrophobicContact CD1-CG1 3.96Å; Y573-V607 HydrophobicContact CE1-CG1 3.57Å; V602-V607 WeakPolarHBondContact CG1-O 3.46Å; V602-V607 PolarHBondContact O-N 3.47Å; V602-V607 VanDerWaalsContact O-N 3.09Å; L605-V607 VanDerWaalsContact C-N 3.25Å; L605-V607 HydrophobicContact CB-CB 4.4Å; L605-V607 HydrophobicContact CB-CG2 3.74Å; L605-V607 PolarHBondContact O-N 3.41Å; V607-A609 HydrophobicContact CG1-CB 3.79Å; V607-A609 PolarHBondContact O-N 2.98Å
608	K	91.1	Very high	90.9	Very high	166 Å²	166	40.5 Å²	40.5	72%	0.722	23%	0.225	S	C	*	.			trans	-93.5	71.4	177.6	-64.4	-178.8	-177.9	-177.6	0	110.1	N565 K568	N565-K608 PolarHBondContact OD1-N 2.83Å; K568-K608 WeakPolarHBondContact CE-O 3.17Å; K568-K608 PolarHBondContact NZ-O 3.14Å
609	A	93.5	Very high	91	Very high	16 Å²	16	41.8 Å²	41.8	13%	0.132	23%	0.233	C	C	.	.			trans	-124.9	150.3	-179	0	0	0	0	0	112.2	Y573 L575 V602 V607	Y573-A609 HydrophobicContact CD1-CB 3.57Å; Y573-A609 HydrophobicContact CE1-CB 3.95Å; Y573-A609 HydrophobicContact CG-CB 4Å; Y573-A609 CarbonylContact O-C 3.54Å; Y573-A609 VanDerWaalsContact O-CA 3.27Å; Y573-A609 WeakPolarHBondContact O-CA 3.16Å; L575-A609 HydrophobicContact CD1-CB 4.36Å; L575-A609 HydrophobicContact CG-CB 4.01Å; V602-A609 HydrophobicContact CG1-CB 4.47Å; V607-A609 HydrophobicContact CG1-CB 3.79Å; V607-A609 PolarHBondContact O-N 2.98Å
610	F	94.9	Very high	91.2	Very high	127 Å²	127	42.5 Å²	42.5	56%	0.557	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	158.7	162.2	-61.4	-81.6	0	0	0	109.5	L572 Y573 V574 L575	L572-F610 HydrophobicContact CD1-CD2 3.5Å; L572-F610 HydrophobicContact CD1-CE2 3.63Å; Y573-F610 PolarHBondContact O-N 2.9Å; V574-F610 CarbonylContact C-O 3.35Å; V574-F610 VanDerWaalsContact CA-O 3.31Å; V574-F610 WeakPolarHBondContact CA-O 3.4Å; V574-F610 HydrophobicContact CG1-CB 4.49Å; V574-F610 HydrophobicContact CG2-CB 4.32Å; L575-F610 PolarHBondContact N-O 3.03Å
611	V	95.2	Very high	91.6	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	126.5	176.3	-179.5	0	0	0	0	108	Y595 W598 L599 V602 L613	Y595-V611 HydrophobicContact CE2-CB 4.23Å; Y595-V611 HydrophobicContact CE2-CG1 4.21Å; Y595-V611 WeakPolarHBondContact CE2-O 3.5Å; Y595-V611 PolarHBondContact OH-O 2.95Å; W598-V611 HydrophobicContact CB-CB 4.33Å; W598-V611 HydrophobicContact CB-CG1 3.51Å; W598-V611 HydrophobicContact CB-CG2 4.03Å; W598-V611 HydrophobicContact CD2-CG1 4.34Å; W598-V611 HydrophobicContact CE3-CG1 4.47Å; W598-V611 HydrophobicContact CG-CG1 3.98Å; L599-V611 HydrophobicContact CD2-CG2 4.24Å; V602-V611 HydrophobicContact CG2-CG2 3.76Å; V611-L613 HydrophobicContact CG1-CD1 4.48Å; V611-L613 HydrophobicContact CG1-CD2 3.6Å; V611-L613 HydrophobicContact CG1-CG 3.83Å
612	D	95.4	Very high	91.9	Very high	46 Å²	46	46 Å²	46	25%	0.246	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119	169.8	-81.8	-2.8	0	0	0	109.1	V574 L575 G576 H577 L626 T630	V574-D612 HydrophobicContact CG1-CB 3.84Å; L575-D612 PolarHBondContact O-N 3.46Å; G576-D612 WeakPolarHBondContact CA-O 3.44Å; H577-D612 PolarHBondContact N-O 3.12Å; H577-D612 VanDerWaalsContact N-O 3.13Å; D612-L626 HydrophobicContact CB-CD2 3.83Å; D612-T630 VanDerWaalsContact OD2-CB 3.22Å; D612-T630 WeakPolarHBondContact OD2-CB 3.31Å; D612-T630 WeakPolarHBondContact OD2-CG2 3.39Å; D612-T630 PolarHBondContact OD2-OG1 3.3Å
613	L	94.8	Very high	92.1	Very high	23 Å²	23	45.8 Å²	45.8	12%	0.12	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	140.8	179	-52.9	-177.5	0	0	0	108.6	H577 V591 Q594 Y595 W598 V611	H577-L613 HydrophobicContact CB-CD2 3.59Å; H577-L613 WeakPolarHBondContact O-CA 2.95Å; V591-L613 HydrophobicContact CG1-CB 3.27Å; V591-L613 HydrophobicContact CG1-CD1 3.98Å; V591-L613 HydrophobicContact CG1-CG 4.23Å; Q594-L613 HydrophobicContact CB-CD1 3.99Å; Y595-L613 HydrophobicContact CD2-CD1 3.93Å; Y595-L613 HydrophobicContact CD2-CG 4.08Å; W598-L613 HydrophobicContact CD2-CD2 3.92Å; W598-L613 HydrophobicContact CG-CD1 4.27Å; W598-L613 HydrophobicContact CG-CD2 3.89Å; W598-L613 HydrophobicContact CZ2-CD2 4.43Å; V611-L613 HydrophobicContact CG1-CD1 4.48Å; V611-L613 HydrophobicContact CG1-CD2 3.6Å; V611-L613 HydrophobicContact CG1-CG 3.83Å
614	T	94.1	Very high	92.6	Very high	21 Å²	21	43.6 Å²	43.6	13%	0.129	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	145.7	178.1	-166.9	0	0	0	0	111.5	H577 V578 Q579 L626	H577-T614 PolarHBondContact O-N 3.15Å; V578-T614 CarbonylContact C-O 3.59Å; V578-T614 WeakPolarHBondContact CA-O 3.45Å; V578-T614 HydrophobicContact CB-CG2 4.19Å; V578-T614 HydrophobicContact CG1-CG2 4.12Å; V578-T614 HydrophobicContact CG2-CG2 3.75Å; Q579-T614 PolarHBondContact N-O 3.44Å; T614-L626 HydrophobicContact CG2-CD1 3.83Å; T614-L626 HydrophobicContact CG2-CD2 4.18Å; T614-L626 HydrophobicContact CG2-CG 3.82Å
615	L	94.1	Very high	93.1	Very high	36 Å²	36	44 Å²	44	19%	0.188	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.5	172	-176.2	69.6	0	0	0	108.9	Q579 L583 L586 P590 V591	Q579-L615 HydrophobicContact CB-CD1 4.12Å; Q579-L615 HydrophobicContact CG-CD1 3.85Å; Q579-L615 WeakPolarHBondContact O-CA 3.49Å; L583-L615 HydrophobicContact CB-CD2 3.89Å; L583-L615 HydrophobicContact CD1-CD2 3.9Å; L583-L615 HydrophobicContact CG-CD2 4.48Å; L586-L615 HydrophobicContact CD1-CD1 4.45Å; L586-L615 HydrophobicContact CD1-CD2 4.27Å; P590-L615 HydrophobicContact CG-CD1 4.2Å; V591-L615 HydrophobicContact CG2-CB 4.08Å
616	S	94	Very high	93.6	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	149.6	-178.2	171.5	0	0	0	0	111.6	Q579 L580 G581 S618 G622	Q579-S616 PolarHBondContact O-N 3.41Å; L580-S616 WeakPolarHBondContact CA-O 3.29Å; G581-S616 PolarHBondContact N-O 3.35Å; G581-S616 CarbonylContact O-C 3.36Å; G581-S616 VanDerWaalsContact O-C 3.31Å; S616-S618 VanDerWaalsContact C-N 3.25Å; S616-S618 WeakPolarHBondContact CB-O 3.25Å; S616-S618 PolarHBondContact O-N 3.23Å; S616-S618 PolarHBondContact OG-N 2.97Å; S616-S618 PolarHBondContact OG-O 3.46Å; S616-G622 PolarHBondContact OG-N 3.47Å; S616-G622 VanDerWaalsContact OG-N 3.09Å
617	P	91.5	Very high	94	Very high	93 Å²	93	41 Å²	41	60%	0.604	21%	0.208	S	C	*	.	S	Bend	trans	-68.9	-22.5	177.7	28.2	-36.8	0	0	0	113.4	Q621	P617-Q621 VanDerWaalsContact CG-OE1 3.3Å
618	S	92.6	Very high	94.1	Very high	38 Å²	38	47.3 Å²	47.3	27%	0.266	23%	0.231	S	C	.	.	S	Bend	trans	-134.7	151.6	174	67	0	0	0	0	111.8	S616 R620 Q621 G622 E702	S616-S618 VanDerWaalsContact C-N 3.25Å; S616-S618 WeakPolarHBondContact CB-O 3.25Å; S616-S618 PolarHBondContact O-N 3.23Å; S616-S618 PolarHBondContact OG-N 2.97Å; S616-S618 PolarHBondContact OG-O 3.46Å; S618-R620 VanDerWaalsContact C-N 3.31Å; S618-Q621 PolarHBondContact O-N 2.93Å; S618-Q621 WeakPolarHBondContact OG-CB 3.39Å; S618-Q621 PolarHBondContact OG-N 3.35Å; S618-G622 PolarHBondContact O-N 3.06Å; S618-E702 WeakPolarHBondContact CB-OE1 3.3Å
619	V	93.4	Very high	94.2	Very high	32 Å²	32	44.8 Å²	44.8	19%	0.194	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-38.6	178.3	-176.9	0	0	0	0	110	L580 G622 T623 L698 E702 I706	L580-V619 HydrophobicContact CD1-CG2 4.38Å; L580-V619 HydrophobicContact CD2-CG2 3.82Å; L580-V619 HydrophobicContact CG-CG2 4.33Å; V619-G622 PolarHBondContact O-N 3.27Å; V619-T623 WeakPolarHBondContact O-CB 3.23Å; V619-T623 PolarHBondContact O-N 2.82Å; V619-T623 PolarHBondContact O-OG1 3.08Å; V619-L698 HydrophobicContact CB-CD1 3.66Å; V619-L698 HydrophobicContact CG1-CD1 4Å; V619-L698 HydrophobicContact CG2-CD1 3.93Å; V619-E702 WeakPolarHBondContact CA-OE1 3.21Å; V619-E702 WeakPolarHBondContact CB-OE1 3.48Å; V619-E702 PolarHBondContact N-OE1 3.15Å; V619-I706 HydrophobicContact CG1-CD1 4.19Å
620	R	94.1	Very high	94.2	Very high	53 Å²	53	44.1 Å²	44.1	20%	0.2	22%	0.218	C	C	.	.	H	α-helix	trans	-61.8	-48.3	177	177.4	176.5	-178.4	179.9	3.9	111.9	S618 T623 Q624 E702 I706 D709	S618-R620 VanDerWaalsContact C-N 3.31Å; R620-T623 PolarHBondContact O-N 3.13Å; R620-Q624 WeakPolarHBondContact O-CG 3.46Å; R620-Q624 PolarHBondContact O-N 3.08Å; R620-E702 HydrophobicContact CB-CG 3.49Å; R620-E702 VanDerWaalsContact CB-CG 3.49Å; R620-E702 PolarHBondContact N-OE1 3.27Å; R620-I706 HydrophobicContact CB-CD1 4.35Å; R620-I706 HydrophobicContact CB-CG1 3.84Å; R620-I706 HydrophobicContact CG-CG1 3.98Å; R620-D709 IonicContact CZ-OD1 3.81Å; R620-D709 IonicContact CZ-OD2 3.63Å; R620-D709 IonicContact NE-OD1 2.79Å; R620-D709 IonicContact NE-OD2 2.7Å; R620-D709 PolarHBondContact NE-OD2 3.21Å; R620-D709 VanDerWaalsContact NH2-CG 3.31Å; R620-D709 IonicContact NH2-OD1 3.25Å; R620-D709 PolarHBondContact NH2-OD1 2.95Å; R620-D709 IonicContact NH2-OD2 3.78Å; R620-D709 PolarHBondContact NH2-OD2 3.23Å; R620-D709 VanDerWaalsContact NH2-OD2 3.09Å
621	Q	94.9	Very high	94	Very high	75 Å²	75	39.7 Å²	39.7	35%	0.35	21%	0.208	S	C	.	.	H	α-helix	trans	-63.8	-42.8	177.6	-177.9	177.6	2.9	0	0	111.6	P617 S618 T623 Q624 H625	P617-Q621 VanDerWaalsContact CG-OE1 3.3Å; S618-Q621 PolarHBondContact O-N 2.93Å; S618-Q621 WeakPolarHBondContact OG-CB 3.39Å; S618-Q621 PolarHBondContact OG-N 3.35Å; Q621-T623 VanDerWaalsContact C-N 3.33Å; Q621-T623 PolarHBondContact O-N 2.81Å; Q621-Q624 WeakPolarHBondContact O-CB 3.32Å; Q621-Q624 PolarHBondContact O-N 2.76Å; Q621-H625 PolarHBondContact O-CD2 2.98Å; Q621-H625 PolarHBondContact O-N 3.4Å
622	G	95.1	Very high	93.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.6	-41.5	176.6	0	0	0	0	0	112.1	S616 S618 V619 Q624 H625 L626	S616-G622 PolarHBondContact OG-N 3.47Å; S616-G622 VanDerWaalsContact OG-N 3.09Å; S618-G622 PolarHBondContact O-N 3.06Å; V619-G622 PolarHBondContact O-N 3.27Å; G622-Q624 PolarHBondContact O-N 3.4Å; G622-H625 WeakPolarHBondContact O-CB 3.47Å; G622-H625 PolarHBondContact O-N 2.85Å; G622-L626 WeakPolarHBondContact O-CG 3.43Å; G622-L626 PolarHBondContact O-N 3.23Å
623	T	95.5	Very high	93.1	Very high	2 Å²	2	45 Å²	45	1%	0.012	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-38.8	176.2	-52.6	0	0	0	0	111.7	M550 V619 R620 Q621 H625 L626 L627 L640 I706	M550-T623 HydrophobicContact CE-CG2 4.44Å; M550-T623 HydrophobicContact CG-CG2 4.17Å; M550-T623 HydrophobicContact SD-CG2 4.16Å; V619-T623 WeakPolarHBondContact O-CB 3.23Å; V619-T623 PolarHBondContact O-N 2.82Å; V619-T623 PolarHBondContact O-OG1 3.08Å; R620-T623 PolarHBondContact O-N 3.13Å; Q621-T623 VanDerWaalsContact C-N 3.33Å; Q621-T623 PolarHBondContact O-N 2.81Å; T623-H625 VanDerWaalsContact C-N 3.3Å; T623-H625 PolarHBondContact O-N 3.31Å; T623-L626 PolarHBondContact O-N 3.4Å; T623-L627 HydrophobicContact CG2-CD1 4.15Å; T623-L627 HydrophobicContact CG2-CG 4.41Å; T623-L627 WeakPolarHBondContact O-CB 3.14Å; T623-L627 VanDerWaalsContact O-CG 3.29Å; T623-L627 WeakPolarHBondContact O-CG 3.29Å; T623-L627 PolarHBondContact O-N 3.07Å; T623-L640 HydrophobicContact CG2-CD1 4.36Å; T623-I706 HydrophobicContact CG2-CG2 3.73Å
624	Q	95.4	Very high	92.5	Very high	42 Å²	42	44.6 Å²	44.6	20%	0.196	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-38.8	172.9	-72.1	177.9	8.3	0	0	112.1	R620 Q621 G622 R628 D709 M713	R620-Q624 WeakPolarHBondContact O-CG 3.46Å; R620-Q624 PolarHBondContact O-N 3.08Å; Q621-Q624 WeakPolarHBondContact O-CB 3.32Å; Q621-Q624 PolarHBondContact O-N 2.76Å; G622-Q624 PolarHBondContact O-N 3.4Å; Q624-R628 VanDerWaalsContact O-CG 3.31Å; Q624-R628 WeakPolarHBondContact O-CG 3.34Å; Q624-R628 PolarHBondContact O-N 3.48Å; Q624-D709 HydrophobicContact CG-CB 4.46Å; Q624-D709 PolarHBondContact NE2-OD2 3.49Å; Q624-M713 HydrophobicContact CB-CE 4.03Å; Q624-M713 HydrophobicContact CG-CE 3.82Å
625	H	95.2	Very high	92.2	Very high	65 Å²	65	47 Å²	47	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-62.4	-54.8	175.2	-66.3	170.9	0	0	0	110	Q621 G622 T623 L627 R628 I629	Q621-H625 PolarHBondContact O-CD2 2.98Å; Q621-H625 PolarHBondContact O-N 3.4Å; G622-H625 WeakPolarHBondContact O-CB 3.47Å; G622-H625 PolarHBondContact O-N 2.85Å; T623-H625 VanDerWaalsContact C-N 3.3Å; T623-H625 PolarHBondContact O-N 3.31Å; H625-L627 VanDerWaalsContact C-N 3.33Å; H625-L627 PolarHBondContact O-N 3.16Å; H625-R628 PolarHBondContact O-N 3.49Å; H625-I629 HydrophobicContact CB-CD1 4.18Å; H625-I629 WeakPolarHBondContact O-CG1 3.25Å; H625-I629 PolarHBondContact O-N 3.07Å
626	L	95.6	Very high	92.1	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-55.1	-45.1	178.9	-68	171.6	0	0	0	112.2	L548 M550 V578 D612 T614 G622 T623 R628 I629 T630	L548-L626 HydrophobicContact CD2-CB 3.99Å; M550-L626 HydrophobicContact CE-CD1 3.64Å; M550-L626 HydrophobicContact SD-CD1 3.94Å; V578-L626 HydrophobicContact CG2-CD1 4.16Å; D612-L626 HydrophobicContact CB-CD2 3.83Å; T614-L626 HydrophobicContact CG2-CD1 3.83Å; T614-L626 HydrophobicContact CG2-CD2 4.18Å; T614-L626 HydrophobicContact CG2-CG 3.82Å; G622-L626 WeakPolarHBondContact O-CG 3.43Å; G622-L626 PolarHBondContact O-N 3.23Å; T623-L626 PolarHBondContact O-N 3.4Å; L626-R628 PolarHBondContact O-N 3.46Å; L626-R628 VanDerWaalsContact O-N 3.16Å; L626-I629 PolarHBondContact O-N 3.18Å; L626-T630 WeakPolarHBondContact O-CB 3.49Å; L626-T630 PolarHBondContact O-N 2.99Å; L626-T630 PolarHBondContact O-OG1 3.22Å
627	L	94.4	Very high	92.1	Very high	10 Å²	10	49.8 Å²	49.8	5%	0.052	27%	0.267	C	S	.	.	H	α-helix	trans	-60	-28.7	177.7	-76.2	169.9	0	0	0	114.4	L548 T623 H625 L640 A710 M713 K715	L548-L627 HydrophobicContact CD2-CD2 3.93Å; L548-L627 HydrophobicContact CD2-CG 4.24Å; T623-L627 HydrophobicContact CG2-CD1 4.15Å; T623-L627 HydrophobicContact CG2-CG 4.41Å; T623-L627 WeakPolarHBondContact O-CB 3.14Å; T623-L627 VanDerWaalsContact O-CG 3.29Å; T623-L627 WeakPolarHBondContact O-CG 3.29Å; T623-L627 PolarHBondContact O-N 3.07Å; H625-L627 VanDerWaalsContact C-N 3.33Å; H625-L627 PolarHBondContact O-N 3.16Å; L627-L640 HydrophobicContact CD1-CD2 4.26Å; L627-L640 HydrophobicContact CD2-CB 4.13Å; L627-L640 HydrophobicContact CD2-CD1 4.18Å; L627-L640 HydrophobicContact CD2-CD2 4.5Å; L627-A710 HydrophobicContact CD1-CB 4.1Å; L627-M713 HydrophobicContact CB-SD 4.11Å; L627-M713 HydrophobicContact CD1-SD 4.34Å; L627-K715 HydrophobicContact CD2-CG 4.31Å
628	R	91.3	Very high	92.2	Very high	142 Å²	142	46.4 Å²	46.4	54%	0.536	25%	0.245	S	C	.	.	H	α-helix	trans	-89.9	-40.1	-179.4	-70.6	174.9	-178.7	136.6	-2.3	112.4	Q624 H625 L626 M713	Q624-R628 VanDerWaalsContact O-CG 3.31Å; Q624-R628 WeakPolarHBondContact O-CG 3.34Å; Q624-R628 PolarHBondContact O-N 3.48Å; H625-R628 PolarHBondContact O-N 3.49Å; L626-R628 PolarHBondContact O-N 3.46Å; L626-R628 VanDerWaalsContact O-N 3.16Å; R628-M713 HydrophobicContact CG-SD 4.19Å; R628-M713 VanDerWaalsContact NH2-CE 3.35Å
629	I	93.5	Very high	92.3	Very high	112 Å²	112	44.7 Å²	44.7	57%	0.574	23%	0.232	S	C	*	.	H	α-helix	trans	-103.3	-23.3	-166.3	76	-167.5	0	0	0	113.8	H625 L626 G631	H625-I629 HydrophobicContact CB-CD1 4.18Å; H625-I629 WeakPolarHBondContact O-CG1 3.25Å; H625-I629 PolarHBondContact O-N 3.07Å; L626-I629 PolarHBondContact O-N 3.18Å; I629-G631 PolarHBondContact O-N 3.46Å
630	T	94.3	Very high	92.5	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.018	22%	0.223	C	C	.	.	S	Bend	trans	-63.1	135.9	-179	-70.6	0	0	0	0	111.4	V574 D612 L626 P637	V574-T630 HydrophobicContact CB-CG2 4.03Å; V574-T630 HydrophobicContact CG1-CG2 3.8Å; V574-T630 HydrophobicContact CG2-CG2 3.73Å; D612-T630 VanDerWaalsContact OD2-CB 3.22Å; D612-T630 WeakPolarHBondContact OD2-CB 3.31Å; D612-T630 WeakPolarHBondContact OD2-CG2 3.39Å; D612-T630 PolarHBondContact OD2-OG1 3.3Å; L626-T630 WeakPolarHBondContact O-CB 3.49Å; L626-T630 PolarHBondContact O-N 2.99Å; L626-T630 PolarHBondContact O-OG1 3.22Å; T630-P637 HydrophobicContact CG2-CG 3.43Å; T630-P637 VanDerWaalsContact CG2-CG 3.43Å; T630-P637 VanDerWaalsContact O-CD 3.25Å; T630-P637 WeakPolarHBondContact O-CD 3.35Å
631	G	89.8	Confident	92.6	Very high	33 Å²	33	40.6 Å²	40.6	34%	0.34	21%	0.213	S	C	.	.	S	Bend	trans	90.9	174.6	-179.3	0	0	0	0	0	114.2	I629 M635	I629-G631 PolarHBondContact O-N 3.46Å; G631-M635 CarbonylContact C-O 3.43Å; G631-M635 WeakPolarHBondContact CA-O 3.28Å
632	L	87.8	Confident	92.7	Very high	119 Å²	119	37.5 Å²	37.5	62%	0.623	20%	0.199	S	C	*	.	B	Isolated β-bridge	trans	-138.8	131.3	-174.6	-171.8	64.2	0	0	0	111	L530 G634 M635	L530-L632 HydrophobicContact CD1-CD2 3.75Å; L530-L632 HydrophobicContact CD1-CG 4.28Å; L632-G634 PolarHBondContact O-N 2.99Å; L632-M635 PolarHBondContact N-O 3.07Å; L632-M635 PolarHBondContact O-N 2.98Å; L632-M635 VanDerWaalsContact O-N 3.12Å
633	G	83.6	Confident	92.6	Very high	38 Å²	38	39.1 Å²	39.1	39%	0.392	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	-127	-176.8	0	0	0	0	0	111.7	K636	G633-K636 VanDerWaalsContact O-CE 3.23Å; G633-K636 WeakPolarHBondContact O-CE 3.44Å; G633-K636 WeakPolarHBondContact O-CG 3.38Å
634	G	82.2	Confident	92.5	Very high	15 Å²	15	40 Å²	40	16%	0.155	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	2.8	174.7	0	0	0	0	0	116	L533 L632 K636	L533-G634 VanDerWaalsContact CD2-C 3.5Å; L632-G634 PolarHBondContact O-N 2.99Å; G634-K636 PolarHBondContact O-N 3.1Å
635	M	88.5	Confident	92.2	Very high	73 Å²	73	39.9 Å²	39.9	36%	0.36	22%	0.217	S	C	.	.	B	Isolated β-bridge	trans	-89.6	86.5	167.1	-69.3	-173.2	65.7	0	0	109	L530 L533 L572 G631 L632	L530-M635 HydrophobicContact CD2-CB 4.24Å; L530-M635 HydrophobicContact CD2-CG 3.81Å; L530-M635 HydrophobicContact CD2-SD 3.51Å; L530-M635 VanDerWaalsContact CD2-SD 3.51Å; L533-M635 HydrophobicContact CD1-CG 4.33Å; L572-M635 HydrophobicContact CD1-CE 4.39Å; G631-M635 CarbonylContact C-O 3.43Å; G631-M635 WeakPolarHBondContact CA-O 3.28Å; L632-M635 PolarHBondContact N-O 3.07Å; L632-M635 PolarHBondContact O-N 2.98Å; L632-M635 VanDerWaalsContact O-N 3.12Å
636	K	90.9	Very high	91.7	Very high	94 Å²	94	38 Å²	38	41%	0.409	21%	0.209	S	C	.	.			trans	-138.4	140.6	-177.5	-69.6	-173.1	175.3	-170.9	0	112.1	Q546 G633 G634 N638	Q546-K636 WeakPolarHBondContact CB-O 3.33Å; Q546-K636 VanDerWaalsContact OE1-C 3.26Å; Q546-K636 PolarHBondContact OE1-O 2.71Å; G633-K636 VanDerWaalsContact O-CE 3.23Å; G633-K636 WeakPolarHBondContact O-CE 3.44Å; G633-K636 WeakPolarHBondContact O-CG 3.38Å; G634-K636 PolarHBondContact O-N 3.1Å; K636-N638 PolarHBondContact O-N 3.33Å
637	P	94.1	Very high	91	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.013	23%	0.231	C	C	.	.			trans	-55.2	132.6	178.1	-23.1	32.4	0	0	0	112.5	Q546 L548 L572 V574 T630 K715	Q546-P637 CarbonylContact O-C 3.54Å; Q546-P637 WeakPolarHBondContact O-CA 3.43Å; L548-P637 HydrophobicContact CB-CB 3.76Å; L548-P637 HydrophobicContact CB-CG 4.02Å; L572-P637 HydrophobicContact CD2-CG 4.37Å; V574-P637 HydrophobicContact CG2-CG 4.43Å; T630-P637 HydrophobicContact CG2-CG 3.43Å; T630-P637 VanDerWaalsContact CG2-CG 3.43Å; T630-P637 VanDerWaalsContact O-CD 3.25Å; T630-P637 WeakPolarHBondContact O-CD 3.35Å; P637-K715 PolarHBondContact O-NZ 3.19Å
638	N	93.3	Very high	90.3	Very high	23 Å²	23	42.7 Å²	42.7	12%	0.123	24%	0.243	C	C	.	.			trans	-111.8	-12.6	174	65.4	13.8	0	0	0	112.5	W543 R544 Q546 K636 N716	W543-N638 PolarHBondContact NE1-ND2 2.68Å; W543-N638 VanDerWaalsContact NE1-ND2 3.16Å; R544-N638 PolarHBondContact O-ND2 3.08Å; Q546-N638 PolarHBondContact N-OD1 2.87Å; Q546-N638 PolarHBondContact O-N 2.9Å; Q546-N638 PolarHBondContact O-OD1 3.3Å; Q546-N638 VanDerWaalsContact O-OD1 3.04Å; K636-N638 PolarHBondContact O-N 3.33Å; N638-N716 PolarHBondContact O-N 3.45Å; N638-N716 PolarHBondContact O-ND2 3.34Å
639	T	95.4	Very high	89.8	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	122.5	-176.5	-53.4	0	0	0	0	109.7	Q546 V547 L548 I641 N716	Q546-T639 PolarHBondContact O-N 3.15Å; V547-T639 WeakPolarHBondContact CA-O 3.5Å; L548-T639 PolarHBondContact N-O 3.31Å; T639-I641 HydrophobicContact CG2-CG1 4.3Å; T639-N716 CarbonylContact C-O 3.58Å; T639-N716 WeakPolarHBondContact CA-O 3.36Å; T639-N716 HydrophobicContact CG2-CB 4.09Å; T639-N716 PolarHBondContact OG1-ND2 3.07Å
640	L	97.4	Very high	89.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	128.3	172.2	177.3	65.2	0	0	0	109.1	L548 M550 T623 L627 L642 I706 A710 N716 V717 C718	L548-L640 HydrophobicContact CD2-CD1 4.26Å; L548-L640 HydrophobicContact CG-CD1 4.34Å; L548-L640 WeakPolarHBondContact O-CA 3.32Å; M550-L640 HydrophobicContact CG-CD1 3.7Å; M550-L640 HydrophobicContact SD-CD1 4.47Å; T623-L640 HydrophobicContact CG2-CD1 4.36Å; L627-L640 HydrophobicContact CD1-CD2 4.26Å; L627-L640 HydrophobicContact CD2-CB 4.13Å; L627-L640 HydrophobicContact CD2-CD1 4.18Å; L627-L640 HydrophobicContact CD2-CD2 4.5Å; L640-L642 HydrophobicContact CD1-CD2 3.99Å; L640-L642 HydrophobicContact CD2-CD1 4.35Å; L640-L642 HydrophobicContact CD2-CD2 4.18Å; L640-L642 HydrophobicContact CD2-CG 4.25Å; L640-L642 HydrophobicContact CG-CD2 4.07Å; L640-L642 HydrophobicContact CG-CG 4.19Å; L640-I706 HydrophobicContact CD2-CG2 3.91Å; L640-A710 HydrophobicContact CD2-CB 3.67Å; L640-N716 PolarHBondContact N-O 3.41Å; L640-V717 CarbonylContact O-C 3.53Å; L640-V717 WeakPolarHBondContact O-CA 3.32Å; L640-C718 PolarHBondContact O-N 3.25Å
641	I	97.3	Very high	88.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.7	171.1	-54.8	-170.8	0	0	0	109.1	V547 L548 L549 M550 V564 L567 T639 C718	V547-I641 HydrophobicContact CG1-CB 4.31Å; V547-I641 HydrophobicContact CG1-CD1 3.53Å; V547-I641 HydrophobicContact CG1-CG1 3.67Å; V547-I641 HydrophobicContact CG2-CD1 4.37Å; L548-I641 PolarHBondContact O-N 3.47Å; L549-I641 HydrophobicContact CD1-CB 3.82Å; L549-I641 HydrophobicContact CD1-CG2 3.62Å; M550-I641 PolarHBondContact N-O 3.03Å; V564-I641 HydrophobicContact CG1-CD1 4.06Å; V564-I641 HydrophobicContact CG2-CD1 3.8Å; V564-I641 HydrophobicContact CG2-CG2 4.37Å; L567-I641 HydrophobicContact CD2-CD1 4.24Å; T639-I641 HydrophobicContact CG2-CG1 4.3Å; I641-C718 WeakPolarHBondContact CA-O 3.38Å; I641-C718 HydrophobicContact CD1-CB 4.41Å; I641-C718 HydrophobicContact CG1-CB 3.96Å; I641-C718 HydrophobicContact CG2-CB 4.43Å
642	L	96.1	Very high	88.5	Confident	10 Å²	10	38.3 Å²	38.3	5%	0.052	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	148	175.2	-56.3	178.4	0	0	0	109.8	M550 L640 Y703 I706 I707 C718 L719 G720	M550-L642 HydrophobicContact CB-CD2 3.6Å; M550-L642 HydrophobicContact CG-CD2 3.54Å; L640-L642 HydrophobicContact CD1-CD2 3.99Å; L640-L642 HydrophobicContact CD2-CD1 4.35Å; L640-L642 HydrophobicContact CD2-CD2 4.18Å; L640-L642 HydrophobicContact CD2-CG 4.25Å; L640-L642 HydrophobicContact CG-CD2 4.07Å; L640-L642 HydrophobicContact CG-CG 4.19Å; L642-Y703 HydrophobicContact CB-CE2 4.25Å; L642-Y703 HydrophobicContact CD1-CE2 4.03Å; L642-I706 HydrophobicContact CD1-CG2 3.95Å; L642-I707 HydrophobicContact CD1-CG1 4.09Å; L642-C718 PolarHBondContact N-O 3.16Å; L642-L719 HydrophobicContact CB-CD2 3.96Å; L642-L719 HydrophobicContact CD1-CD2 4.15Å; L642-L719 HydrophobicContact CG-CD2 4.4Å; L642-L719 WeakPolarHBondContact O-CA 3.42Å; L642-G720 PolarHBondContact O-N 3.06Å
643	G	93.1	Very high	88.2	Confident	33 Å²	33	33 Å²	33	34%	0.34	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	145.5	159.8	0	0	0	0	0	110.3	Y703	G643-Y703 WeakPolarHBondContact O-CE2 3.49Å; G643-Y703 PolarHBondContact O-OH 3.07Å
644	F	92.9	Very high	88.1	Confident	20 Å²	20	31.3 Å²	31.3	9%	0.088	18%	0.181	C	C	.	.			trans	-66.7	139.2	177.7	-167.7	-92	0	0	0	111.1	D646 Y703 L719 G720 R721 L888 L900	F644-D646 HydrophobicContact CD1-CB 3.83Å; F644-D646 HydrophobicContact CE1-CB 4.1Å; F644-D646 PolarHBondContact O-N 3.22Å; F644-Y703 WeakPolarHBondContact CA-OH 3.36Å; F644-L719 HydrophobicContact CD2-CB 4.29Å; F644-G720 WeakPolarHBondContact CB-O 3.43Å; F644-G720 PolarHBondContact N-O 3.41Å; F644-R721 HydrophobicContact CB-CB 3.64Å; F644-R721 HydrophobicContact CB-CG 3.78Å; F644-R721 HydrophobicContact CD1-CB 4.41Å; F644-R721 HydrophobicContact CD1-CG 3.79Å; F644-R721 HydrophobicContact CD2-CB 4.14Å; F644-R721 HydrophobicContact CD2-CG 4.34Å; F644-R721 HydrophobicContact CE1-CG 4.49Å; F644-R721 HydrophobicContact CG-CB 3.82Å; F644-R721 HydrophobicContact CG-CG 3.7Å; F644-L888 HydrophobicContact CE2-CB 4.04Å; F644-L888 HydrophobicContact CZ-CB 4.01Å; F644-L900 HydrophobicContact CD2-CD1 4Å; F644-L900 HydrophobicContact CE2-CD1 3.74Å
645	Y	89.9	Confident	87.8	Confident	41 Å²	41	36.4 Å²	36.4	16%	0.161	21%	0.205	C	C	.	.			trans	-84.8	96.1	177.2	-170.7	-87.8	0	0	0	110.1	R696 L698 P700 Y703 L885	Y645-R696 VanDerWaalsContact OH-CD 3.31Å; Y645-R696 WeakPolarHBondContact OH-CD 3.26Å; Y645-L698 HydrophobicContact CD2-CD2 4.4Å; Y645-L698 HydrophobicContact CE2-CB 4.36Å; Y645-L698 VanDerWaalsContact CE2-O 3.27Å; Y645-L698 WeakPolarHBondContact CE2-O 3.43Å; Y645-L698 PolarHBondContact OH-O 3.31Å; Y645-P700 HydrophobicContact CE1-CG 4.21Å; Y645-Y703 HydrophobicContact CD2-CD2 4.24Å; Y645-Y703 HydrophobicContact CD2-CG 4.23Å; Y645-Y703 HydrophobicContact CG-CD1 4.48Å; Y645-Y703 HydrophobicContact CG-CG 4.36Å; Y645-Y703 PolarHBondContact N-OH 3.08Å; Y645-L885 HydrophobicContact CD1-CD1 3.86Å; Y645-L885 HydrophobicContact CE1-CD1 4.38Å; Y645-L885 HydrophobicContact CG-CD1 4.4Å
646	D	84.3	Confident	87.2	Confident	24 Å²	24	38.6 Å²	38.6	13%	0.128	21%	0.214	C	C	.	.			trans	-130.4	177.4	176.3	62.9	26.5	0	0	0	113.6	F644 C648 R690 R696 R721	F644-D646 HydrophobicContact CD1-CB 3.83Å; F644-D646 HydrophobicContact CE1-CB 4.1Å; F644-D646 PolarHBondContact O-N 3.22Å; D646-C648 PolarHBondContact OD1-N 2.99Å; D646-R690 PolarHBondContact O-NH2 2.87Å; D646-R690 VanDerWaalsContact O-NH2 3.14Å; D646-R696 PolarHBondContact O-NH1 3.04Å; D646-R721 IonicContact OD2-NE 3.09Å
647	S	80.6	Confident	86.3	Confident	70 Å²	70	36 Å²	36	49%	0.49	21%	0.205	S	C	.	.	S	Bend	trans	-90.8	-2.4	178.7	-53.9	0	0	0	0	113.7	R696	S647-R696 VanDerWaalsContact CA-NH2 3.27Å; S647-R696 VanDerWaalsContact CB-NH2 3.31Å; S647-R696 PolarHBondContact OG-NH2 3.15Å
648	C	80.3	Confident	85	Confident	43 Å²	43	39.8 Å²	39.8	29%	0.291	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-65.8	134.2	-175.3	-66.9	0	0	0	0	111.2	D646 R690	D646-C648 PolarHBondContact OD1-N 2.99Å; C648-R690 PolarHBondContact O-NH1 3.31Å; C648-R690 PolarHBondContact O-NH2 2.52Å
649	T	80.3	Confident	83.8	Confident	69 Å²	69	40.6 Å²	40.6	42%	0.423	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-66.5	125.6	171.9	45.4	0	0	0	0	109.2	V692	T649-V692 HydrophobicContact CG2-CG2 3.46Å; T649-V692 VanDerWaalsContact CG2-CG2 3.46Å
650	P	83	Confident	82.8	Confident	33 Å²	33	40.7 Å²	40.7	21%	0.214	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-76.7	149.3	179.5	7	7.9	0	0	0	110.6	V689 R690	P650-V689 HydrophobicContact CB-CG1 3.43Å; P650-V689 VanDerWaalsContact CB-CG1 3.43Å; P650-V689 HydrophobicContact CG-CG1 3.34Å; P650-V689 WeakPolarHBondContact O-CG1 3.43Å; P650-R690 VanDerWaalsContact CD-CG 3.49Å; P650-R690 HydrophobicContact CG-CG 3.65Å
651	D	82	Confident	81.2	Confident	69 Å²	69	43.7 Å²	43.7	37%	0.369	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-86	147.9	173.8	-62.1	-41.9	0	0	0	110.9	F653	D651-F653 HydrophobicContact CB-CE2 4.38Å; D651-F653 PolarHBondContact O-N 2.74Å
652	D	85.8	Confident	79.2	Confident	28 Å²	28	50.7 Å²	50.7	15%	0.15	29%	0.294	C	S	.	.			trans	-88.4	103.1	174.4	-165.3	-20.4	0	0	0	110.7	R555 F654 L655 V689	R555-D652 IonicContact CZ-OD2 3.08Å; R555-D652 IonicContact NH1-OD1 3.07Å; R555-D652 IonicContact NH1-OD2 3.89Å; R555-D652 PolarHBondContact NH1-OD2 3.11Å; D652-F654 VanDerWaalsContact C-N 3.32Å; D652-F654 PolarHBondContact O-N 3.16Å; D652-F654 WeakPolarHBondContact OD1-CB 3.34Å; D652-F654 PolarHBondContact OD1-N 3.1Å; D652-F654 VanDerWaalsContact OD1-N 3.07Å; D652-L655 HydrophobicContact CB-CD1 4.24Å; D652-L655 HydrophobicContact CB-CG 4.4Å; D652-L655 PolarHBondContact O-N 3.4Å; D652-V689 HydrophobicContact CB-CG2 3.73Å
653	F	80.6	Confident	76.8	Confident	8 Å²	8	54.4 Å²	54.4	4%	0.035	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-74.4	-20.6	-178.9	-79.3	-77.9	0	0	0	113.8	R555 C558 Q559 D651 L655 Q656 D657 F724	R555-F653 WeakPolarHBondContact O-CB 3.39Å; R555-F653 PolarHBondContact O-N 3.06Å; C558-F653 HydrophobicContact CB-CB 3.85Å; C558-F653 HydrophobicContact CB-CG 4.24Å; Q559-F653 HydrophobicContact CG-CD1 3.92Å; Q559-F653 HydrophobicContact CG-CD2 4.43Å; Q559-F653 HydrophobicContact CG-CE1 3.44Å; Q559-F653 VanDerWaalsContact CG-CE1 3.44Å; Q559-F653 HydrophobicContact CG-CE2 3.99Å; Q559-F653 HydrophobicContact CG-CG 4.39Å; Q559-F653 HydrophobicContact CG-CZ 3.49Å; Q559-F653 VanDerWaalsContact CG-CZ 3.49Å; D651-F653 HydrophobicContact CB-CE2 4.38Å; D651-F653 PolarHBondContact O-N 2.74Å; F653-L655 PolarHBondContact O-N 2.87Å; F653-Q656 PolarHBondContact O-N 3.19Å; F653-D657 WeakPolarHBondContact O-CB 3.49Å; F653-D657 PolarHBondContact O-N 3.48Å; F653-F724 HydrophobicContact CE2-CB 3.55Å; F653-F724 HydrophobicContact CZ-CB 3.54Å; F653-F724 WeakPolarHBondContact CZ-O 3.43Å
654	F	82.1	Confident	74.3	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-65.8	-24.2	177.7	-77.1	14.6	0	0	0	111.7	P554 R555 L601 D652 F660 C661 Q683 F686	P554-F654 HydrophobicContact CB-CZ 4.32Å; R555-F654 HydrophobicContact CG-CD1 4.15Å; R555-F654 HydrophobicContact CG-CD2 3.67Å; R555-F654 HydrophobicContact CG-CE1 4.24Å; R555-F654 HydrophobicContact CG-CE2 3.78Å; R555-F654 HydrophobicContact CG-CG 3.86Å; R555-F654 HydrophobicContact CG-CZ 4.06Å; L601-F654 HydrophobicContact CD1-CE1 3.96Å; L601-F654 HydrophobicContact CD1-CZ 3.71Å; D652-F654 VanDerWaalsContact C-N 3.32Å; D652-F654 PolarHBondContact O-N 3.16Å; D652-F654 WeakPolarHBondContact OD1-CB 3.34Å; D652-F654 PolarHBondContact OD1-N 3.1Å; D652-F654 VanDerWaalsContact OD1-N 3.07Å; F654-F660 HydrophobicContact CB-CB 4.36Å; F654-F660 HydrophobicContact CD1-CD1 4.48Å; F654-F660 HydrophobicContact CD1-CD2 4.26Å; F654-F660 HydrophobicContact CD1-CE2 4.34Å; F654-F660 HydrophobicContact CD1-CG 4.34Å; F654-F660 HydrophobicContact CD1-CZ 4.48Å; F654-F660 HydrophobicContact CE1-CE1 4.29Å; F654-F660 HydrophobicContact CE1-CE2 4.38Å; F654-F660 HydrophobicContact CE1-CZ 4.16Å; F654-F660 HydrophobicContact CG-CD1 4.43Å; F654-F660 HydrophobicContact CG-CG 4.34Å; F654-F660 HydrophobicContact CZ-CE1 4.34Å; F654-F660 VanDerWaalsContact O-CB 3.31Å; F654-F660 WeakPolarHBondContact O-CB 3.36Å; F654-C661 PolarHBondContact O-SG 3.38Å; F654-Q683 HydrophobicContact CD2-CG 4.13Å; F654-F686 HydrophobicContact CE2-CB 4.41Å; F654-F686 AromaticContact CE2-CD2 3.85Å; F654-F686 HydrophobicContact CE2-CD2 3.85Å; F654-F686 HydrophobicContact CE2-CG 4.49Å; F654-F686 HydrophobicContact CZ-CD2 4.02Å
655	L	76.8	Confident	71.9	Confident	123 Å²	123	63 Å²	63	64%	0.644	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-85.8	-11.1	176	-60.2	179.9	0	0	0	113.5	D652 F653 C661	D652-L655 HydrophobicContact CB-CD1 4.24Å; D652-L655 HydrophobicContact CB-CG 4.4Å; D652-L655 PolarHBondContact O-N 3.4Å; F653-L655 PolarHBondContact O-N 2.87Å; L655-C661 PolarHBondContact O-SG 3.05Å
656	Q	74.9	Confident	69.4	Low	118 Å²	118	64.5 Å²	64.5	55%	0.551	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-31.6	-176.1	-61.5	178.9	17.3	0	0	112	F653	F653-Q656 PolarHBondContact O-N 3.19Å
657	D	71.9	Confident	67.1	Low	40 Å²	40	71.5 Å²	71.5	21%	0.214	43%	0.432	C	S	.	.			trans	-83.5	124.1	-176	-169.7	-16.5	0	0	0	111.5	F653 A659 F660 C661	F653-D657 WeakPolarHBondContact O-CB 3.49Å; F653-D657 PolarHBondContact O-N 3.48Å; D657-A659 PolarHBondContact O-N 3.23Å; D657-A659 PolarHBondContact OD1-N 3.45Å; D657-F660 HydrophobicContact CB-CD2 4.06Å; D657-F660 PolarHBondContact O-N 3.39Å; D657-C661 PolarHBondContact O-N 2.93Å; D657-C661 VanDerWaalsContact O-N 3.1Å; D657-C661 PolarHBondContact O-SG 2.89Å; D657-C661 VanDerWaalsContact O-SG 3.33Å
658	S	66.4	Low	64.9	Low	81 Å²	81	72.3 Å²	72.3	57%	0.566	45%	0.451	S	S	*	.	H	α-helix	trans	-48.8	-31.8	175	58.6	0	0	0	0	114.1	F660 C661 H662	S658-F660 PolarHBondContact O-N 2.91Å; S658-C661 PolarHBondContact O-N 3.28Å; S658-H662 PolarHBondContact O-N 3.47Å
659	A	68.4	Low	62.8	Low	41 Å²	41	75.1 Å²	75.1	34%	0.339	47%	0.472	S	S	.	.	H	α-helix	trans	-64.9	-23.8	178.9	0	0	0	0	0	113.5	D657	D657-A659 PolarHBondContact O-N 3.23Å; D657-A659 PolarHBondContact OD1-N 3.45Å
660	F	74.4	Confident	61	Low	3 Å²	3	80.2 Å²	80.2	1%	0.013	49%	0.491	C	S	.	.	H	α-helix	trans	-111.9	-15.9	-179.1	-61.4	-83.2	0	0	0	112.9	L601 K604 L605 F654 D657 S658 L679 L682 Q683	L601-F660 HydrophobicContact CD1-CE1 4.37Å; L601-F660 HydrophobicContact CD1-CZ 4.02Å; K604-F660 HydrophobicContact CB-CE1 4.15Å; K604-F660 HydrophobicContact CB-CZ 4.06Å; L605-F660 HydrophobicContact CD2-CE2 3.76Å; L605-F660 HydrophobicContact CD2-CZ 4.02Å; L605-F660 HydrophobicContact CG-CE2 4.49Å; L605-F660 HydrophobicContact CG-CZ 4.26Å; F654-F660 HydrophobicContact CB-CB 4.36Å; F654-F660 HydrophobicContact CD1-CD1 4.48Å; F654-F660 HydrophobicContact CD1-CD2 4.26Å; F654-F660 HydrophobicContact CD1-CE2 4.34Å; F654-F660 HydrophobicContact CD1-CG 4.34Å; F654-F660 HydrophobicContact CD1-CZ 4.48Å; F654-F660 HydrophobicContact CE1-CE1 4.29Å; F654-F660 HydrophobicContact CE1-CE2 4.38Å; F654-F660 HydrophobicContact CE1-CZ 4.16Å; F654-F660 HydrophobicContact CG-CD1 4.43Å; F654-F660 HydrophobicContact CG-CG 4.34Å; F654-F660 HydrophobicContact CZ-CE1 4.34Å; F654-F660 VanDerWaalsContact O-CB 3.31Å; F654-F660 WeakPolarHBondContact O-CB 3.36Å; D657-F660 HydrophobicContact CB-CD2 4.06Å; D657-F660 PolarHBondContact O-N 3.39Å; S658-F660 PolarHBondContact O-N 2.91Å; F660-L679 HydrophobicContact CD1-CD1 4.09Å; F660-L682 HydrophobicContact CD1-CD2 4.5Å; F660-L682 HydrophobicContact CE1-CD2 3.97Å; F660-Q683 PolarHBondContact O-NE2 3.21Å
661	C	63.9	Low	59.2	Low	63 Å²	63	85.7 Å²	85.7	43%	0.426	51%	0.513	S	S	.	.	H	α-helix	trans	-91.4	-31.8	-179.8	-61.9	0	0	0	0	114.7	F654 L655 D657 S658 S663	F654-C661 PolarHBondContact O-SG 3.38Å; L655-C661 PolarHBondContact O-SG 3.05Å; D657-C661 PolarHBondContact O-N 2.93Å; D657-C661 VanDerWaalsContact O-N 3.1Å; D657-C661 PolarHBondContact O-SG 2.89Å; D657-C661 VanDerWaalsContact O-SG 3.33Å; S658-C661 PolarHBondContact O-N 3.28Å; C661-S663 PolarHBondContact O-N 2.89Å
662	H	55.3	Low	57.7	Low	146 Å²	146	88.8 Å²	88.8	68%	0.676	53%	0.526	S	S	*	.			trans	-85.2	99.8	-179.4	-81.8	-77.1	0	0	0	111.2	S658 S664	S658-H662 PolarHBondContact O-N 3.47Å; H662-S664 PolarHBondContact O-N 3.04Å
663	S	46.1	Very low	56	Low	88 Å²	88	94.4 Å²	94.4	62%	0.615	55%	0.546	S	S	*	.			trans	-68.2	102.7	152.8	50.1	0	0	0	0	107.4	C661 V665	C661-S663 PolarHBondContact O-N 2.89Å; S663-V665 PolarHBondContact O-N 2.7Å
664	S	41.1	Very low	55	Low	100 Å²	100	96 Å²	96	70%	0.699	56%	0.555	S	S	*	*			trans	-69	74.2	164.5	54.2	0	0	0	0	108.6	H662 G666	H662-S664 PolarHBondContact O-N 3.04Å; S664-G666 VanDerWaalsContact C-N 3.34Å; S664-G666 PolarHBondContact O-N 3.41Å; S664-G666 VanDerWaalsContact O-N 3.1Å
665	V	41.9	Very low	53.9	Low	135 Å²	135	99.9 Å²	99.9	82%	0.818	57%	0.572	S	S	*	*			trans	-69.5	96.5	161.6	179.3	0	0	0	0	105.6	S663	S663-V665 PolarHBondContact O-N 2.7Å
666	G	37.6	Very low	53.1	Low	71 Å²	71	97.9 Å²	97.9	73%	0.732	58%	0.581	S	S	*	*	S	Bend	trans	128.1	8.6	157	0	0	0	0	0	120.4	S664	S664-G666 VanDerWaalsContact C-N 3.34Å; S664-G666 PolarHBondContact O-N 3.41Å; S664-G666 VanDerWaalsContact O-N 3.1Å
667	E	34.8	Very low	52.7	Low	171 Å²	171	92.8 Å²	92.8	80%	0.799	56%	0.558	S	S	*	*			trans	-128.8	116.8	168	-76.1	-171.1	160.1	0	0	111.2	S669	E667-S669 VanDerWaalsContact C-N 3.29Å; E667-S669 PolarHBondContact O-N 3.03Å
668	G	35.6	Very low	52.8	Low	87 Å²	87	96.2 Å²	96.2	90%	0.897	58%	0.576	S	S	*	*			trans	-65.1	76.8	-174.6	0	0	0	0	0	114
669	S	36.6	Very low	53.2	Low	103 Å²	103	94.2 Å²	94.2	72%	0.72	56%	0.559	S	S	*	*			trans	-96	76.7	152.2	47.3	0	0	0	0	108	E667	E667-S669 VanDerWaalsContact C-N 3.29Å; E667-S669 PolarHBondContact O-N 3.03Å
670	E	42.3	Very low	53.6	Low	175 Å²	175	96.7 Å²	96.7	82%	0.818	57%	0.571	S	S	*	*			trans	-57.1	147.3	155.7	-66.6	-175.9	151.6	0	0	108.1
671	E	45.1	Very low	53.7	Low	149 Å²	149	99.3 Å²	99.3	70%	0.696	59%	0.59	S	S	*	*			trans	98.6	37.2	167	-50.4	178.8	170.6	0	0	119.5
672	E	49.5	Very low	54.5	Low	134 Å²	134	96.3 Å²	96.3	63%	0.626	57%	0.57	S	S	*	*			trans	-100.1	115.9	152.2	-132.6	177.5	-146.8	0	0	109.7	K604 N674	K604-E672 IonicContact NZ-OE2 3.53Å; K604-E672 PolarHBondContact NZ-OE2 3.49Å; E672-N674 VanDerWaalsContact C-N 3.32Å; E672-N674 PolarHBondContact O-N 3.29Å
673	Y	51.4	Low	55.7	Low	145 Å²	145	91.8 Å²	91.8	57%	0.569	55%	0.549	S	S	*	.			trans	-74	77.6	-171.4	-138.7	-100.6	0	0	0	111.5	T511 F675	T511-Y673 PolarHBondContact O-OH 3.42Å; T511-Y673 WeakPolarHBondContact OG1-CD2 3.43Å; T511-Y673 WeakPolarHBondContact OG1-CE1 3.32Å; T511-Y673 WeakPolarHBondContact OG1-CE2 3.34Å; T511-Y673 PolarHBondContact OG1-OH 2.92Å; Y673-F675 PolarHBondContact O-N 3.39Å
674	N	58.1	Low	57.3	Low	43 Å²	43	91.5 Å²	91.5	23%	0.23	55%	0.552	C	S	.	*			trans	-75.2	28.6	-177.9	-65.6	-31.3	0	0	0	114	K604 E672 G676 V677	K604-N674 WeakPolarHBondContact CE-OD1 3.49Å; E672-N674 VanDerWaalsContact C-N 3.32Å; E672-N674 PolarHBondContact O-N 3.29Å; N674-G676 PolarHBondContact O-N 2.96Å; N674-V677 WeakPolarHBondContact CB-O 3.38Å; N674-V677 WeakPolarHBondContact O-CB 3.27Å; N674-V677 PolarHBondContact O-N 3.36Å
675	F	60.5	Low	59.3	Low	81 Å²	81	89.5 Å²	89.5	36%	0.355	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	28.1	-176.8	-58.7	-85	0	0	0	114.6	N596 L599 D603 Y673	N596-F675 HydrophobicContact CB-CB 4.39Å; L599-F675 HydrophobicContact CB-CD2 3.87Å; L599-F675 HydrophobicContact CB-CE2 3.66Å; L599-F675 HydrophobicContact CB-CG 4.47Å; L599-F675 HydrophobicContact CB-CZ 4.12Å; L599-F675 HydrophobicContact CD1-CD1 4.34Å; L599-F675 HydrophobicContact CD1-CE1 4.05Å; L599-F675 HydrophobicContact CD1-CE2 4.43Å; L599-F675 HydrophobicContact CD1-CZ 4.11Å; D603-F675 VanDerWaalsContact OD2-CE2 3.23Å; D603-F675 WeakPolarHBondContact OD2-CE2 2.93Å; Y673-F675 PolarHBondContact O-N 3.39Å
676	G	59.9	Low	61.5	Low	81 Å²	81	83.4 Å²	83.4	84%	0.835	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	16.6	-176.2	0	0	0	0	0	115.4	N674	N674-G676 PolarHBondContact O-N 2.96Å
677	V	66.3	Low	63.6	Low	11 Å²	11	83.9 Å²	83.9	7%	0.067	48%	0.484	C	S	.	.			trans	-108.4	114.4	-179.8	-175.3	0	0	0	0	110.7	N596 F597 N674 L682	N596-V677 HydrophobicContact CB-CG2 4.34Å; F597-V677 HydrophobicContact CD1-CG1 3.53Å; F597-V677 HydrophobicContact CD1-CG2 4.23Å; F597-V677 HydrophobicContact CE1-CG1 3.58Å; F597-V677 HydrophobicContact CE1-CG2 4.28Å; N674-V677 WeakPolarHBondContact CB-O 3.38Å; N674-V677 WeakPolarHBondContact O-CB 3.27Å; N674-V677 PolarHBondContact O-N 3.36Å; V677-L682 HydrophobicContact CG1-CB 3.94Å; V677-L682 HydrophobicContact CG1-CD1 4.17Å
678	D	73.9	Confident	65.9	Low	112 Å²	112	80.3 Å²	80.3	60%	0.599	48%	0.476	S	S	*	.			trans	-73	151.5	173.7	-57.9	-31.2	0	0	0	111.6	P680 S681 L682	D678-P680 VanDerWaalsContact C-CD 3.49Å; D678-S681 WeakPolarHBondContact O-CB 3.31Å; D678-S681 PolarHBondContact O-N 3.29Å; D678-L682 PolarHBondContact O-N 3.09Å
679	L	73.5	Confident	68.2	Low	40 Å²	40	76.9 Å²	76.9	21%	0.209	44%	0.438	C	S	.	.	H	α-helix	trans	-54.8	-42.6	-178.7	-166	75.4	0	0	0	113.8	F660 S681 L682 Q683	F660-L679 HydrophobicContact CD1-CD1 4.09Å; L679-S681 VanDerWaalsContact C-N 3.34Å; L679-S681 PolarHBondContact O-N 2.97Å; L679-L682 HydrophobicContact CD1-CD2 4.49Å; L679-L682 WeakPolarHBondContact O-CB 3.46Å; L679-L682 PolarHBondContact O-N 3.11Å; L679-Q683 WeakPolarHBondContact O-CG 3.19Å; L679-Q683 PolarHBondContact O-N 3.36Å
680	P	77.2	Confident	70.4	Confident	92 Å²	92	75.8 Å²	75.8	60%	0.597	42%	0.418	S	S	*	.	H	α-helix	trans	-64.9	-38.4	176.2	-21.3	34.7	0	0	0	112.5	D678 Q683 A684	D678-P680 VanDerWaalsContact C-CD 3.49Å; P680-Q683 PolarHBondContact O-N 2.86Å; P680-A684 WeakPolarHBondContact O-CB 3.02Å; P680-A684 PolarHBondContact O-N 3.29Å
681	S	78	Confident	72	Confident	58 Å²	58	74.1 Å²	74.1	41%	0.406	41%	0.409	S	S	.	.	H	α-helix	trans	-66.3	-39.1	176.9	-57.2	0	0	0	0	111.5	D678 L679 A684 H685	D678-S681 WeakPolarHBondContact O-CB 3.31Å; D678-S681 PolarHBondContact O-N 3.29Å; L679-S681 VanDerWaalsContact C-N 3.34Å; L679-S681 PolarHBondContact O-N 2.97Å; S681-A684 PolarHBondContact O-N 3.3Å; S681-H685 WeakPolarHBondContact O-CB 3.15Å; S681-H685 PolarHBondContact O-N 3.02Å
682	L	80.6	Confident	73.4	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.005	41%	0.412	C	S	.	.	H	α-helix	trans	-60.8	-47.5	173.3	-173.1	73.5	0	0	0	111.4	F597 F660 V677 D678 L679 H685 F686	F597-L682 HydrophobicContact CB-CD1 4.14Å; F597-L682 HydrophobicContact CD1-CD1 4.19Å; F597-L682 VanDerWaalsContact O-CD1 3.27Å; F597-L682 WeakPolarHBondContact O-CD1 3.29Å; F660-L682 HydrophobicContact CD1-CD2 4.5Å; F660-L682 HydrophobicContact CE1-CD2 3.97Å; V677-L682 HydrophobicContact CG1-CB 3.94Å; V677-L682 HydrophobicContact CG1-CD1 4.17Å; D678-L682 PolarHBondContact O-N 3.09Å; L679-L682 HydrophobicContact CD1-CD2 4.49Å; L679-L682 WeakPolarHBondContact O-CB 3.46Å; L679-L682 PolarHBondContact O-N 3.11Å; L682-H685 PolarHBondContact O-N 2.97Å; L682-F686 HydrophobicContact CD1-CE2 3.78Å; L682-F686 HydrophobicContact CG-CE2 4.19Å; L682-F686 VanDerWaalsContact O-CD2 3.27Å; L682-F686 WeakPolarHBondContact O-CD2 3.15Å
683	Q	79.4	Confident	74.6	Confident	50 Å²	50	75.5 Å²	75.5	23%	0.234	42%	0.424	C	S	.	.	H	α-helix	trans	-63.8	-46	177.3	-70	179.3	2.1	0	0	111	R555 F654 F660 L679 P680 H685 F686	R555-Q683 PolarHBondContact NH2-O 2.9Å; F654-Q683 HydrophobicContact CD2-CG 4.13Å; F660-Q683 PolarHBondContact O-NE2 3.21Å; L679-Q683 WeakPolarHBondContact O-CG 3.19Å; L679-Q683 PolarHBondContact O-N 3.36Å; P680-Q683 PolarHBondContact O-N 2.86Å; Q683-H685 VanDerWaalsContact C-N 3.26Å; Q683-H685 PolarHBondContact O-N 3.01Å; Q683-F686 PolarHBondContact O-N 3.34Å
684	A	79.1	Confident	75.7	Confident	83 Å²	83	70.8 Å²	70.8	69%	0.686	41%	0.412	S	S	*	.	H	α-helix	trans	-62.1	-32.1	-179.9	0	0	0	0	0	113.2	P680 S681	P680-A684 WeakPolarHBondContact O-CB 3.02Å; P680-A684 PolarHBondContact O-N 3.29Å; S681-A684 PolarHBondContact O-N 3.3Å
685	H	84.8	Confident	76.3	Confident	57 Å²	57	73.4 Å²	73.4	26%	0.264	43%	0.432	S	S	.	.	H	α-helix	trans	-66.7	-43.1	-179.8	-179.4	-87.3	0	0	0	113	F597 S681 L682 Q683	F597-H685 HydrophobicContact CD1-CB 3.58Å; F597-H685 AromaticContact CD1-CD2 3.99Å; F597-H685 AromaticContact CD1-CG 3.65Å; F597-H685 AromaticContact CD2-CD2 3.49Å; F597-H685 VanDerWaalsContact CD2-CD2 3.49Å; F597-H685 WeakPolarHBondContact CD2-CD2 3.25Å; F597-H685 AromaticContact CD2-CG 3.87Å; F597-H685 AromaticContact CD2-NE2 3.61Å; F597-H685 HydrophobicContact CE1-CB 3.73Å; F597-H685 AromaticContact CE1-CG 3.97Å; F597-H685 AromaticContact CE2-CD2 3.52Å; F597-H685 AromaticContact CE2-NE2 3.95Å; F597-H685 HydrophobicContact CG-CB 4.07Å; F597-H685 AromaticContact CG-CD2 3.73Å; F597-H685 AromaticContact CG-CG 3.6Å; F597-H685 AromaticContact CG-ND1 3.83Å; F597-H685 HydrophobicContact CZ-CB 4.33Å; F597-H685 AromaticContact CZ-CD2 3.8Å; S681-H685 WeakPolarHBondContact O-CB 3.15Å; S681-H685 PolarHBondContact O-N 3.02Å; L682-H685 PolarHBondContact O-N 2.97Å; Q683-H685 VanDerWaalsContact C-N 3.26Å; Q683-H685 PolarHBondContact O-N 3.01Å
686	F	86.4	Confident	77	Confident	8 Å²	8	74.7 Å²	74.7	4%	0.035	43%	0.434	C	S	.	.	S	Bend	trans	-81.8	120.4	179.5	-64.2	-66.4	0	0	0	110.3	P554 R555 F597 W598 L601 F654 L682 Q683	P554-F686 HydrophobicContact CG-CD1 3.78Å; P554-F686 HydrophobicContact CG-CE1 3.63Å; P554-F686 HydrophobicContact CG-CG 4.41Å; P554-F686 HydrophobicContact CG-CZ 4.13Å; R555-F686 HydrophobicContact CG-CB 4.23Å; R555-F686 PolarHBondContact NE-O 3.1Å; R555-F686 PolarHBondContact NH2-O 3.36Å; F597-F686 HydrophobicContact CB-CE2 4.48Å; F597-F686 HydrophobicContact CB-CZ 4.2Å; W598-F686 HydrophobicContact CD2-CE1 4.27Å; W598-F686 HydrophobicContact CD2-CZ 4.46Å; W598-F686 AromaticContact CE2-CE1 3.88Å; W598-F686 HydrophobicContact CG-CZ 4.44Å; W598-F686 HydrophobicContact CZ2-CE1 4.23Å; W598-F686 AromaticContact NE1-CE1 3.91Å; L601-F686 HydrophobicContact CB-CE2 4.42Å; L601-F686 HydrophobicContact CB-CZ 4.46Å; L601-F686 HydrophobicContact CD2-CZ 4.26Å; F654-F686 HydrophobicContact CE2-CB 4.41Å; F654-F686 AromaticContact CE2-CD2 3.85Å; F654-F686 HydrophobicContact CE2-CD2 3.85Å; F654-F686 HydrophobicContact CE2-CG 4.49Å; F654-F686 HydrophobicContact CZ-CD2 4.02Å; L682-F686 HydrophobicContact CD1-CE2 3.78Å; L682-F686 HydrophobicContact CG-CE2 4.19Å; L682-F686 VanDerWaalsContact O-CD2 3.27Å; L682-F686 WeakPolarHBondContact O-CD2 3.15Å; Q683-F686 PolarHBondContact O-N 3.34Å
687	P	83.3	Confident	77.7	Confident	80 Å²	80	81.1 Å²	81.1	52%	0.519	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-61.6	152.1	-173.7	26.3	-34.6	0	0	0	111	N553 R555	N553-P687 PolarHBondContact ND2-O 3.08Å; R555-P687 WeakPolarHBondContact CD-O 3.26Å
688	P	81.9	Confident	78.7	Confident	96 Å²	96	82.2 Å²	82.2	62%	0.623	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-59.2	156.8	177	26.4	-34.2	0	0	0	111.3
689	V	84.3	Confident	79.5	Confident	16 Å²	16	79.3 Å²	79.3	10%	0.097	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-66.3	147.4	-178.5	-173.4	0	0	0	0	110.6	R555 P650 D652	R555-V689 HydrophobicContact CB-CG2 3.82Å; P650-V689 HydrophobicContact CB-CG1 3.43Å; P650-V689 VanDerWaalsContact CB-CG1 3.43Å; P650-V689 HydrophobicContact CG-CG1 3.34Å; P650-V689 WeakPolarHBondContact O-CG1 3.43Å; D652-V689 HydrophobicContact CB-CG2 3.73Å
690	R	82.3	Confident	80.3	Confident	80 Å²	80	79.1 Å²	79.1	30%	0.302	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-61.1	137.7	-174.8	73.4	171.3	175.3	82.1	-8.3	112.4	D646 C648 P650 S694	D646-R690 PolarHBondContact O-NH2 2.87Å; D646-R690 VanDerWaalsContact O-NH2 3.14Å; C648-R690 PolarHBondContact O-NH1 3.31Å; C648-R690 PolarHBondContact O-NH2 2.52Å; P650-R690 VanDerWaalsContact CD-CG 3.49Å; P650-R690 HydrophobicContact CG-CG 3.65Å; R690-S694 WeakPolarHBondContact CB-OG 3.3Å
691	H	77.7	Confident	80.9	Confident	139 Å²	139	78.4 Å²	78.4	64%	0.644	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-89.5	166.2	171.1	-62.7	-66.2	0	0	0	111.4	E693 S694	H691-E693 PolarHBondContact O-N 2.86Å; H691-S694 PolarHBondContact N-OG 3.43Å; H691-S694 PolarHBondContact O-N 3.08Å; H691-S694 VanDerWaalsContact O-N 3.12Å; H691-S694 PolarHBondContact O-OG 3.21Å
692	V	74.3	Confident	81.6	Confident	123 Å²	123	77.2 Å²	77.2	75%	0.745	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-38.4	-177.6	-179.2	0	0	0	0	112.4	T649	T649-V692 HydrophobicContact CG2-CG2 3.46Å; T649-V692 VanDerWaalsContact CG2-CG2 3.46Å
693	E	73.3	Confident	82.2	Confident	190 Å²	190	77.6 Å²	77.6	89%	0.888	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-5.2	-174.8	-61.3	178.4	177.2	0	0	114	H691	H691-E693 PolarHBondContact O-N 2.86Å
694	S	75.9	Confident	82.9	Confident	45 Å²	45	75.4 Å²	75.4	32%	0.315	40%	0.399	S	S	.	.	S	Bend	trans	-74.1	137.9	-177.3	62.3	0	0	0	0	111.9	R690 H691	R690-S694 WeakPolarHBondContact CB-OG 3.3Å; H691-S694 PolarHBondContact N-OG 3.43Å; H691-S694 PolarHBondContact O-N 3.08Å; H691-S694 VanDerWaalsContact O-N 3.12Å; H691-S694 PolarHBondContact O-OG 3.21Å
695	P	70.8	Confident	83.6	Confident	99 Å²	99	71.8 Å²	71.8	64%	0.643	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-66.5	141	-178.9	26.9	-34	0	0	0	111.1	W697	P695-W697 PolarHBondContact O-N 2.6Å
696	R	75.2	Confident	84.1	Confident	108 Å²	108	69.4 Å²	69.4	41%	0.408	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-79.2	119.9	171.5	-63.1	-175.8	-163	-177.5	9.4	108.9	Y645 D646 S647 L698	Y645-R696 VanDerWaalsContact OH-CD 3.31Å; Y645-R696 WeakPolarHBondContact OH-CD 3.26Å; D646-R696 PolarHBondContact O-NH1 3.04Å; S647-R696 VanDerWaalsContact CA-NH2 3.27Å; S647-R696 VanDerWaalsContact CB-NH2 3.31Å; S647-R696 PolarHBondContact OG-NH2 3.15Å; R696-L698 PolarHBondContact O-N 3.29Å
697	W	73.4	Confident	84.6	Confident	215 Å²	215	69 Å²	69	81%	0.814	36%	0.357	S	S	*	.	S	Bend	trans	-69.7	-21.5	177.2	-61.5	86.8	0	0	0	113.3	L580 P695	L580-W697 HydrophobicContact CD1-CE3 4.36Å; P695-W697 PolarHBondContact O-N 2.6Å
698	L	86.9	Confident	85.1	Confident	34 Å²	34	66.2 Å²	66.2	18%	0.178	34%	0.34	C	S	.	.	S	Bend	trans	-107	125.1	180	-168.6	74.3	0	0	0	111	V619 Y645 R696 E702 Y703 I706	V619-L698 HydrophobicContact CB-CD1 3.66Å; V619-L698 HydrophobicContact CG1-CD1 4Å; V619-L698 HydrophobicContact CG2-CD1 3.93Å; Y645-L698 HydrophobicContact CD2-CD2 4.4Å; Y645-L698 HydrophobicContact CE2-CB 4.36Å; Y645-L698 VanDerWaalsContact CE2-O 3.27Å; Y645-L698 WeakPolarHBondContact CE2-O 3.43Å; Y645-L698 PolarHBondContact OH-O 3.31Å; R696-L698 PolarHBondContact O-N 3.29Å; L698-E702 HydrophobicContact CD1-CB 3.95Å; L698-E702 VanDerWaalsContact CD1-CD 3.49Å; L698-E702 HydrophobicContact CD1-CG 3.72Å; L698-E702 WeakPolarHBondContact CD1-OE2 3.05Å; L698-Y703 HydrophobicContact CD2-CD2 3.63Å; L698-Y703 HydrophobicContact CD2-CG 4.18Å; L698-I706 HydrophobicContact CD1-CD1 4.47Å
699	S	90.8	Very high	85.7	Confident	52 Å²	52	62.4 Å²	62.4	36%	0.364	31%	0.314	S	S	.	.			trans	-79.3	153.4	175.4	68	0	0	0	0	112.1	D701 E702 Y703	S699-D701 VanDerWaalsContact C-N 3.27Å; S699-D701 PolarHBondContact O-N 2.7Å; S699-E702 PolarHBondContact O-N 3.36Å; S699-E702 VanDerWaalsContact OG-CB 3.23Å; S699-E702 WeakPolarHBondContact OG-CB 3.48Å; S699-E702 PolarHBondContact OG-N 3.09Å; S699-Y703 PolarHBondContact O-N 3.49Å
700	P	90.4	Very high	86.2	Confident	35 Å²	35	61.6 Å²	61.6	23%	0.227	31%	0.309	C	S	.	.	H	α-helix	trans	-53.2	-42.7	173.8	-30	38	0	0	0	113.5	Y645 E702 Y703 V704 L885	Y645-P700 HydrophobicContact CE1-CG 4.21Å; P700-E702 VanDerWaalsContact C-N 3.33Å; P700-E702 PolarHBondContact O-N 3.05Å; P700-Y703 PolarHBondContact O-N 3.45Å; P700-V704 WeakPolarHBondContact O-CG2 3.41Å; P700-V704 PolarHBondContact O-N 3.31Å; P700-L885 HydrophobicContact CB-CD1 3.91Å
701	D	90.9	Very high	86.7	Confident	77 Å²	77	59.1 Å²	59.1	41%	0.412	30%	0.302	S	S	.	.	H	α-helix	trans	-65.7	-36.4	-179.9	-65.3	-36.4	0	0	0	112.5	S699 G705 S881	S699-D701 VanDerWaalsContact C-N 3.27Å; S699-D701 PolarHBondContact O-N 2.7Å; D701-G705 WeakPolarHBondContact O-CA 3.39Å; D701-G705 PolarHBondContact O-N 3.45Å; D701-S881 WeakPolarHBondContact OD1-CB 3.45Å; D701-S881 PolarHBondContact OD1-OG 3.05Å
702	E	91.4	Very high	87.5	Confident	33 Å²	33	59.7 Å²	59.7	15%	0.154	30%	0.302	C	S	.	.	H	α-helix	trans	-69.9	-44.1	177.1	-166.9	176.7	-179.5	0	0	111.1	S618 V619 R620 L698 S699 P700 G705 I706	S618-E702 WeakPolarHBondContact CB-OE1 3.3Å; V619-E702 WeakPolarHBondContact CA-OE1 3.21Å; V619-E702 WeakPolarHBondContact CB-OE1 3.48Å; V619-E702 PolarHBondContact N-OE1 3.15Å; R620-E702 HydrophobicContact CB-CG 3.49Å; R620-E702 VanDerWaalsContact CB-CG 3.49Å; R620-E702 PolarHBondContact N-OE1 3.27Å; L698-E702 HydrophobicContact CD1-CB 3.95Å; L698-E702 VanDerWaalsContact CD1-CD 3.49Å; L698-E702 HydrophobicContact CD1-CG 3.72Å; L698-E702 WeakPolarHBondContact CD1-OE2 3.05Å; S699-E702 PolarHBondContact O-N 3.36Å; S699-E702 VanDerWaalsContact OG-CB 3.23Å; S699-E702 WeakPolarHBondContact OG-CB 3.48Å; S699-E702 PolarHBondContact OG-N 3.09Å; P700-E702 VanDerWaalsContact C-N 3.33Å; P700-E702 PolarHBondContact O-N 3.05Å; E702-G705 CarbonylContact O-C 3.58Å; E702-G705 WeakPolarHBondContact O-CA 3.42Å; E702-G705 PolarHBondContact O-N 2.76Å; E702-I706 WeakPolarHBondContact O-CG1 3.45Å; E702-I706 PolarHBondContact O-N 3.3Å
703	Y	93.8	Very high	88.3	Confident	9 Å²	9	56.1 Å²	56.1	4%	0.035	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-50.2	177.8	-177.1	-96.6	0	0	0	112.5	L642 G643 F644 Y645 L698 S699 P700 G705 I706 I707 L885	L642-Y703 HydrophobicContact CB-CE2 4.25Å; L642-Y703 HydrophobicContact CD1-CE2 4.03Å; G643-Y703 WeakPolarHBondContact O-CE2 3.49Å; G643-Y703 PolarHBondContact O-OH 3.07Å; F644-Y703 WeakPolarHBondContact CA-OH 3.36Å; Y645-Y703 HydrophobicContact CD2-CD2 4.24Å; Y645-Y703 HydrophobicContact CD2-CG 4.23Å; Y645-Y703 HydrophobicContact CG-CD1 4.48Å; Y645-Y703 HydrophobicContact CG-CG 4.36Å; Y645-Y703 PolarHBondContact N-OH 3.08Å; L698-Y703 HydrophobicContact CD2-CD2 3.63Å; L698-Y703 HydrophobicContact CD2-CG 4.18Å; S699-Y703 PolarHBondContact O-N 3.49Å; P700-Y703 PolarHBondContact O-N 3.45Å; Y703-G705 PolarHBondContact O-N 3.25Å; Y703-I706 WeakPolarHBondContact O-CB 3.44Å; Y703-I706 PolarHBondContact O-N 2.88Å; Y703-I707 HydrophobicContact CD1-CD1 4.06Å; Y703-I707 HydrophobicContact CE1-CD1 3.7Å; Y703-I707 PolarHBondContact O-N 2.93Å; Y703-L885 HydrophobicContact CD1-CD1 4.42Å; Y703-L885 HydrophobicContact CD1-CD2 3.85Å; Y703-L885 HydrophobicContact CE1-CD2 3.88Å
704	V	94.6	Very high	89.3	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.03	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-33.5	176.2	178.8	0	0	0	0	110.7	P700 I706 I707 S708 P874 Y884 L885	P700-V704 WeakPolarHBondContact O-CG2 3.41Å; P700-V704 PolarHBondContact O-N 3.31Å; V704-I706 VanDerWaalsContact C-N 3.35Å; V704-I706 PolarHBondContact O-N 3.39Å; V704-I707 PolarHBondContact O-N 3.04Å; V704-S708 PolarHBondContact O-N 3.46Å; V704-P874 HydrophobicContact CG1-CB 3.75Å; V704-Y884 HydrophobicContact CG1-CD1 4.13Å; V704-Y884 HydrophobicContact CG2-CD1 3.9Å; V704-L885 HydrophobicContact CG2-CD1 4.05Å; V704-L885 HydrophobicContact CG2-CD2 4.06Å; V704-L885 HydrophobicContact CG2-CG 3.81Å
705	G	94	Very high	90.1	Very high	7 Å²	7	54.8 Å²	54.8	7%	0.072	26%	0.264	C	S	.	.	H	α-helix	trans	-57.1	-43.2	171.1	0	0	0	0	0	113.2	D701 E702 Y703 S708 D709	D701-G705 WeakPolarHBondContact O-CA 3.39Å; D701-G705 PolarHBondContact O-N 3.45Å; E702-G705 CarbonylContact O-C 3.58Å; E702-G705 WeakPolarHBondContact O-CA 3.42Å; E702-G705 PolarHBondContact O-N 2.76Å; Y703-G705 PolarHBondContact O-N 3.25Å; G705-S708 PolarHBondContact O-N 2.9Å; G705-D709 WeakPolarHBondContact O-CB 3.1Å; G705-D709 PolarHBondContact O-N 3.32Å
706	I	95.2	Very high	91.3	Very high	6 Å²	6	50.1 Å²	50.1	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-44.7	176.2	-67.9	163.5	0	0	0	110.9	V619 R620 T623 L640 L642 L698 E702 Y703 V704 D709 A710	V619-I706 HydrophobicContact CG1-CD1 4.19Å; R620-I706 HydrophobicContact CB-CD1 4.35Å; R620-I706 HydrophobicContact CB-CG1 3.84Å; R620-I706 HydrophobicContact CG-CG1 3.98Å; T623-I706 HydrophobicContact CG2-CG2 3.73Å; L640-I706 HydrophobicContact CD2-CG2 3.91Å; L642-I706 HydrophobicContact CD1-CG2 3.95Å; L698-I706 HydrophobicContact CD1-CD1 4.47Å; E702-I706 WeakPolarHBondContact O-CG1 3.45Å; E702-I706 PolarHBondContact O-N 3.3Å; Y703-I706 WeakPolarHBondContact O-CB 3.44Å; Y703-I706 PolarHBondContact O-N 2.88Å; V704-I706 VanDerWaalsContact C-N 3.35Å; V704-I706 PolarHBondContact O-N 3.39Å; I706-D709 PolarHBondContact O-N 3.37Å; I706-A710 WeakPolarHBondContact O-CB 3.32Å; I706-A710 PolarHBondContact O-N 3.49Å
707	I	95.4	Very high	92.3	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-48.2	177.9	-62.2	170.6	0	0	0	110.2	L642 Y703 V704 D709 A710 I711 V717 L719 P874	L642-I707 HydrophobicContact CD1-CG1 4.09Å; Y703-I707 HydrophobicContact CD1-CD1 4.06Å; Y703-I707 HydrophobicContact CE1-CD1 3.7Å; Y703-I707 PolarHBondContact O-N 2.93Å; V704-I707 PolarHBondContact O-N 3.04Å; I707-D709 VanDerWaalsContact C-N 3.33Å; I707-D709 PolarHBondContact O-N 3.41Å; I707-A710 PolarHBondContact O-N 3.49Å; I707-I711 HydrophobicContact CG2-CD1 4.05Å; I707-I711 WeakPolarHBondContact O-CG1 3.35Å; I707-I711 PolarHBondContact O-N 2.99Å; I707-I711 VanDerWaalsContact O-N 3.15Å; I707-V717 HydrophobicContact CG1-CG1 4.46Å; I707-V717 HydrophobicContact CG2-CG1 4.24Å; I707-L719 HydrophobicContact CD1-CD1 3.95Å; I707-L719 HydrophobicContact CD1-CD2 3.89Å; I707-L719 HydrophobicContact CG1-CD2 4.21Å; I707-P874 HydrophobicContact CG2-CG 4.11Å
708	S	94.1	Very high	93.4	Very high	22 Å²	22	34.7 Å²	34.7	15%	0.154	18%	0.175	C	C	.	.	H	α-helix	trans	-59.7	-43.3	178	-171.3	0	0	0	0	111.9	V704 G705 I711 K712	V704-S708 PolarHBondContact O-N 3.46Å; G705-S708 PolarHBondContact O-N 2.9Å; S708-I711 PolarHBondContact O-N 3.44Å; S708-K712 VanDerWaalsContact O-CG 3.27Å; S708-K712 WeakPolarHBondContact O-CG 3.41Å; S708-K712 PolarHBondContact O-N 3.17Å; S708-K712 WeakPolarHBondContact OG-CE 3.5Å; S708-K712 PolarHBondContact OG-NZ 3.4Å
709	D	94.8	Very high	93.9	Very high	15 Å²	15	33.1 Å²	33.1	8%	0.08	17%	0.166	C	C	.	.	H	α-helix	trans	-66.5	-42.5	-179.7	-67.3	-15.3	0	0	0	111.8	R620 Q624 G705 I706 I707 I711 K712 M713	R620-D709 IonicContact CZ-OD1 3.81Å; R620-D709 IonicContact CZ-OD2 3.63Å; R620-D709 IonicContact NE-OD1 2.79Å; R620-D709 IonicContact NE-OD2 2.7Å; R620-D709 PolarHBondContact NE-OD2 3.21Å; R620-D709 VanDerWaalsContact NH2-CG 3.31Å; R620-D709 IonicContact NH2-OD1 3.25Å; R620-D709 PolarHBondContact NH2-OD1 2.95Å; R620-D709 IonicContact NH2-OD2 3.78Å; R620-D709 PolarHBondContact NH2-OD2 3.23Å; R620-D709 VanDerWaalsContact NH2-OD2 3.09Å; Q624-D709 HydrophobicContact CG-CB 4.46Å; Q624-D709 PolarHBondContact NE2-OD2 3.49Å; G705-D709 WeakPolarHBondContact O-CB 3.1Å; G705-D709 PolarHBondContact O-N 3.32Å; I706-D709 PolarHBondContact O-N 3.37Å; I707-D709 VanDerWaalsContact C-N 3.33Å; I707-D709 PolarHBondContact O-N 3.41Å; D709-I711 PolarHBondContact O-N 3.29Å; D709-K712 PolarHBondContact O-N 3.07Å; D709-M713 HydrophobicContact CB-CE 4.49Å; D709-M713 WeakPolarHBondContact O-CB 3.5Å; D709-M713 VanDerWaalsContact O-CG 3.26Å; D709-M713 WeakPolarHBondContact O-CG 3.47Å; D709-M713 PolarHBondContact O-N 2.96Å
710	A	94.9	Very high	94.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61	-43.7	177.4	0	0	0	0	0	112	L627 L640 I706 I707 M713 K714 K715 V717	L627-A710 HydrophobicContact CD1-CB 4.1Å; L640-A710 HydrophobicContact CD2-CB 3.67Å; I706-A710 WeakPolarHBondContact O-CB 3.32Å; I706-A710 PolarHBondContact O-N 3.49Å; I707-A710 PolarHBondContact O-N 3.49Å; A710-M713 CarbonylContact O-C 3.52Å; A710-M713 PolarHBondContact O-N 3.36Å; A710-K714 PolarHBondContact O-N 2.95Å; A710-K715 HydrophobicContact CB-CB 4.46Å; A710-K715 WeakPolarHBondContact O-CB 3.1Å; A710-K715 PolarHBondContact O-N 3.35Å; A710-V717 HydrophobicContact CB-CG2 3.6Å
711	I	93.9	Very high	94.2	Very high	28 Å²	28	29.3 Å²	29.3	14%	0.144	14%	0.142	C	C	.	.	H	α-helix	trans	-63.2	-43.6	175.7	-64.7	169.8	0	0	0	110.5	I707 S708 D709 M713 K714 V717 P874 V904	I707-I711 HydrophobicContact CG2-CD1 4.05Å; I707-I711 WeakPolarHBondContact O-CG1 3.35Å; I707-I711 PolarHBondContact O-N 2.99Å; I707-I711 VanDerWaalsContact O-N 3.15Å; S708-I711 PolarHBondContact O-N 3.44Å; D709-I711 PolarHBondContact O-N 3.29Å; I711-M713 VanDerWaalsContact C-N 3.25Å; I711-M713 PolarHBondContact O-N 2.86Å; I711-K714 WeakPolarHBondContact O-CA 3.47Å; I711-K714 PolarHBondContact O-N 2.99Å; I711-V717 HydrophobicContact CG1-CG2 3.94Å; I711-P874 HydrophobicContact CD1-CG 4.26Å; I711-V904 HydrophobicContact CG2-CG2 4.32Å
712	K	92.6	Very high	94.2	Very high	150 Å²	150	26.8 Å²	26.8	65%	0.652	13%	0.127	S	C	*	.	H	α-helix	trans	-61.8	-32.8	175.3	-73.4	169.6	-174.4	167.7	0	112.6	S708 D709 K714	S708-K712 VanDerWaalsContact O-CG 3.27Å; S708-K712 WeakPolarHBondContact O-CG 3.41Å; S708-K712 PolarHBondContact O-N 3.17Å; S708-K712 WeakPolarHBondContact OG-CE 3.5Å; S708-K712 PolarHBondContact OG-NZ 3.4Å; D709-K712 PolarHBondContact O-N 3.07Å; K712-K714 PolarHBondContact O-N 3Å
713	M	93.1	Very high	94.2	Very high	48 Å²	48	25.6 Å²	25.6	24%	0.236	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	9.1	173.5	-66.6	-175.9	-163.6	0	0	113.5	Q624 L627 R628 D709 A710 I711 K715	Q624-M713 HydrophobicContact CB-CE 4.03Å; Q624-M713 HydrophobicContact CG-CE 3.82Å; L627-M713 HydrophobicContact CB-SD 4.11Å; L627-M713 HydrophobicContact CD1-SD 4.34Å; R628-M713 HydrophobicContact CG-SD 4.19Å; R628-M713 VanDerWaalsContact NH2-CE 3.35Å; D709-M713 HydrophobicContact CB-CE 4.49Å; D709-M713 WeakPolarHBondContact O-CB 3.5Å; D709-M713 VanDerWaalsContact O-CG 3.26Å; D709-M713 WeakPolarHBondContact O-CG 3.47Å; D709-M713 PolarHBondContact O-N 2.96Å; A710-M713 CarbonylContact O-C 3.52Å; A710-M713 PolarHBondContact O-N 3.36Å; I711-M713 VanDerWaalsContact C-N 3.25Å; I711-M713 PolarHBondContact O-N 2.86Å; M713-K715 VanDerWaalsContact C-N 3.26Å; M713-K715 HydrophobicContact CB-CG 4.14Å; M713-K715 PolarHBondContact O-N 2.94Å
714	K	92.5	Very high	93.7	Very high	165 Å²	165	28 Å²	28	72%	0.717	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	38.7	-177.3	-58.1	-175.7	176.7	-176.4	0	112.8	A710 I711 K712	A710-K714 PolarHBondContact O-N 2.95Å; I711-K714 WeakPolarHBondContact O-CA 3.47Å; I711-K714 PolarHBondContact O-N 2.99Å; K712-K714 PolarHBondContact O-N 3Å
715	K	94	Very high	93.3	Very high	43 Å²	43	32.4 Å²	32.4	19%	0.187	15%	0.152	C	C	.	.			trans	-103	141.4	172.8	-55.6	-63.4	-176.1	173.9	0	109.3	L627 P637 A710 M713	L627-K715 HydrophobicContact CD2-CG 4.31Å; P637-K715 PolarHBondContact O-NZ 3.19Å; A710-K715 HydrophobicContact CB-CB 4.46Å; A710-K715 WeakPolarHBondContact O-CB 3.1Å; A710-K715 PolarHBondContact O-N 3.35Å; M713-K715 VanDerWaalsContact C-N 3.26Å; M713-K715 HydrophobicContact CB-CG 4.14Å; M713-K715 PolarHBondContact O-N 2.94Å
716	N	95.2	Very high	92.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	148.8	171.7	-48.7	-52.5	0	0	0	108.7	N638 T639 L640 F764 H902 V904 T905	N638-N716 PolarHBondContact O-N 3.45Å; N638-N716 PolarHBondContact O-ND2 3.34Å; T639-N716 CarbonylContact C-O 3.58Å; T639-N716 WeakPolarHBondContact CA-O 3.36Å; T639-N716 HydrophobicContact CG2-CB 4.09Å; T639-N716 PolarHBondContact OG1-ND2 3.07Å; L640-N716 PolarHBondContact N-O 3.41Å; N716-F764 HydrophobicContact CB-CE1 3.87Å; N716-F764 HydrophobicContact CB-CE2 4.09Å; N716-F764 HydrophobicContact CB-CZ 3.53Å; N716-F764 VanDerWaalsContact ND2-CE2 3.26Å; N716-F764 WeakPolarHBondContact ND2-CE2 3.48Å; N716-F764 WeakPolarHBondContact ND2-CZ 3.3Å; N716-H902 WeakPolarHBondContact CA-O 3.48Å; N716-V904 PolarHBondContact OD1-N 3.12Å; N716-T905 PolarHBondContact ND2-OG1 2.93Å; N716-T905 PolarHBondContact OD1-N 3.23Å; N716-T905 PolarHBondContact OD1-OG1 2.83Å
717	V	96.6	Very high	91.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134.6	-178	-177.2	0	0	0	0	110	L640 I707 A710 I711 L719 L871 H902	L640-V717 CarbonylContact O-C 3.53Å; L640-V717 WeakPolarHBondContact O-CA 3.32Å; I707-V717 HydrophobicContact CG1-CG1 4.46Å; I707-V717 HydrophobicContact CG2-CG1 4.24Å; A710-V717 HydrophobicContact CB-CG2 3.6Å; I711-V717 HydrophobicContact CG1-CG2 3.94Å; V717-L719 HydrophobicContact CG1-CD2 4.14Å; V717-L871 HydrophobicContact CG1-CD2 4.21Å; V717-H902 PolarHBondContact N-O 2.98Å; V717-H902 PolarHBondContact O-N 2.96Å
718	C	96.6	Very high	89.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	140	170.3	-44.3	0	0	0	0	111.6	L640 I641 L642 L899 L900 I901	L640-C718 PolarHBondContact O-N 3.25Å; I641-C718 WeakPolarHBondContact CA-O 3.38Å; I641-C718 HydrophobicContact CD1-CB 4.41Å; I641-C718 HydrophobicContact CG1-CB 3.96Å; I641-C718 HydrophobicContact CG2-CB 4.43Å; L642-C718 PolarHBondContact N-O 3.16Å; C718-L899 HydrophobicContact CB-CD1 3.82Å; C718-L899 HydrophobicContact CB-CD2 4.41Å; C718-L899 HydrophobicContact CB-CG 4.08Å; C718-L900 CarbonylContact C-O 3.2Å; C718-L900 WeakPolarHBondContact CA-O 3.35Å; C718-I901 HydrophobicContact CB-CG1 4.28Å
719	L	96.5	Very high	87.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.8	174.1	-45.3	179.7	0	0	0	109.7	L642 F644 I707 V717 L871 L888 L899 L900	L642-L719 HydrophobicContact CB-CD2 3.96Å; L642-L719 HydrophobicContact CD1-CD2 4.15Å; L642-L719 HydrophobicContact CG-CD2 4.4Å; L642-L719 WeakPolarHBondContact O-CA 3.42Å; F644-L719 HydrophobicContact CD2-CB 4.29Å; I707-L719 HydrophobicContact CD1-CD1 3.95Å; I707-L719 HydrophobicContact CD1-CD2 3.89Å; I707-L719 HydrophobicContact CG1-CD2 4.21Å; V717-L719 HydrophobicContact CG1-CD2 4.14Å; L719-L871 HydrophobicContact CD1-CD1 3.66Å; L719-L871 HydrophobicContact CD1-CD2 4.1Å; L719-L871 HydrophobicContact CG-CD1 4.3Å; L719-L871 HydrophobicContact CG-CD2 3.98Å; L719-L888 HydrophobicContact CD1-CD1 4.19Å; L719-L899 WeakPolarHBondContact O-CA 3.49Å; L719-L900 HydrophobicContact CB-CB 4.17Å; L719-L900 HydrophobicContact CB-CD1 4.31Å; L719-L900 HydrophobicContact CD1-CD1 4.37Å; L719-L900 PolarHBondContact N-O 2.84Å; L719-L900 PolarHBondContact O-N 3.38Å
720	G	94.6	Very high	85.6	Confident	6 Å²	6	46.3 Å²	46.3	6%	0.062	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	117.2	179.3	0	0	0	0	0	112.4	L642 F644	L642-G720 PolarHBondContact O-N 3.06Å; F644-G720 WeakPolarHBondContact CB-O 3.43Å; F644-G720 PolarHBondContact N-O 3.41Å
721	R	93.4	Very high	83.1	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.008	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	144.3	177	-162.7	176.7	-170.4	-174	3	111.3	F644 D646 F723 E889 T892 T898	F644-R721 HydrophobicContact CB-CB 3.64Å; F644-R721 HydrophobicContact CB-CG 3.78Å; F644-R721 HydrophobicContact CD1-CB 4.41Å; F644-R721 HydrophobicContact CD1-CG 3.79Å; F644-R721 HydrophobicContact CD2-CB 4.14Å; F644-R721 HydrophobicContact CD2-CG 4.34Å; F644-R721 HydrophobicContact CE1-CG 4.49Å; F644-R721 HydrophobicContact CG-CB 3.82Å; F644-R721 HydrophobicContact CG-CG 3.7Å; D646-R721 IonicContact OD2-NE 3.09Å; R721-F723 WeakPolarHBondContact O-CD2 3.34Å; R721-F723 PolarHBondContact O-N 3Å; R721-F723 VanDerWaalsContact O-N 3.11Å; R721-E889 PolarHBondContact NH1-O 3.4Å; R721-E889 IonicContact NH2-OE1 2.71Å; R721-E889 PolarHBondContact NH2-OE1 3.36Å; R721-T892 WeakPolarHBondContact CD-OG1 3.1Å; R721-T892 PolarHBondContact NH1-OG1 3.06Å; R721-T898 PolarHBondContact N-O 3.38Å; R721-T898 PolarHBondContact O-N 2.89Å
722	Y	91.6	Very high	80.3	Confident	24 Å²	24	62.9 Å²	62.9	9%	0.094	32%	0.317	C	S	.	.	S	Bend	trans	56.5	22.6	175.6	-57.2	-47.9	0	0	0	116.2	F724 Q725 T892 G896	Y722-F724 AromaticContact CD1-CE1 3.64Å; Y722-F724 HydrophobicContact CD1-CE1 3.64Å; Y722-F724 AromaticContact CD1-CZ 3.72Å; Y722-F724 HydrophobicContact CD1-CZ 3.72Å; Y722-F724 HydrophobicContact CE1-CE1 4.47Å; Y722-F724 HydrophobicContact CE1-CZ 4.39Å; Y722-F724 PolarHBondContact O-N 2.96Å; Y722-F724 VanDerWaalsContact O-N 3.17Å; Y722-Q725 WeakPolarHBondContact O-CB 3.5Å; Y722-Q725 PolarHBondContact O-N 3.45Å; Y722-T892 WeakPolarHBondContact CE2-O 3.44Å; Y722-G896 WeakPolarHBondContact CD2-O 3.15Å
723	F	89.9	Confident	77.9	Confident	7 Å²	7	58.6 Å²	58.6	3%	0.031	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-65.6	-16.6	177.6	-83.8	-85	0	0	0	113.9	Q559 L560 F563 R721 Q725 L726 T898 L899	Q559-F723 WeakPolarHBondContact CB-O 3.45Å; L560-F723 HydrophobicContact CB-CB 4.29Å; L560-F723 HydrophobicContact CD1-CB 4.36Å; L560-F723 HydrophobicContact CD1-CD1 4.36Å; L560-F723 HydrophobicContact CD1-CD2 3.81Å; L560-F723 HydrophobicContact CD1-CE2 4.2Å; L560-F723 HydrophobicContact CD1-CG 3.89Å; F563-F723 HydrophobicContact CB-CD1 4.03Å; F563-F723 HydrophobicContact CB-CE1 4.09Å; F563-F723 AromaticContact CD1-CD1 3.96Å; F563-F723 HydrophobicContact CD1-CD1 3.96Å; F563-F723 AromaticContact CD1-CE1 3.26Å; F563-F723 HydrophobicContact CD1-CE1 3.26Å; F563-F723 AromaticContact CD1-CZ 3.71Å; F563-F723 HydrophobicContact CD1-CZ 3.71Å; F563-F723 HydrophobicContact CD2-CD1 4.35Å; F563-F723 AromaticContact CD2-CE1 3.7Å; F563-F723 HydrophobicContact CD2-CE1 3.7Å; F563-F723 AromaticContact CE1-CE1 3.46Å; F563-F723 HydrophobicContact CE1-CE1 3.46Å; F563-F723 VanDerWaalsContact CE1-CE1 3.46Å; F563-F723 AromaticContact CE1-CZ 3.53Å; F563-F723 HydrophobicContact CE1-CZ 3.53Å; F563-F723 AromaticContact CE2-CE1 3.88Å; F563-F723 HydrophobicContact CE2-CE1 3.88Å; F563-F723 AromaticContact CG-CD1 3.84Å; F563-F723 HydrophobicContact CG-CD1 3.84Å; F563-F723 AromaticContact CG-CE1 3.38Å; F563-F723 HydrophobicContact CG-CE1 3.38Å; F563-F723 HydrophobicContact CG-CZ 4.28Å; F563-F723 AromaticContact CZ-CE1 3.77Å; F563-F723 HydrophobicContact CZ-CE1 3.77Å; F563-F723 AromaticContact CZ-CZ 3.98Å; F563-F723 HydrophobicContact CZ-CZ 3.98Å; R721-F723 WeakPolarHBondContact O-CD2 3.34Å; R721-F723 PolarHBondContact O-N 3Å; R721-F723 VanDerWaalsContact O-N 3.11Å; F723-Q725 PolarHBondContact O-N 2.93Å; F723-L726 HydrophobicContact CD1-CD2 4.22Å; F723-L726 VanDerWaalsContact O-CB 3.22Å; F723-L726 WeakPolarHBondContact O-CB 3.14Å; F723-L726 PolarHBondContact O-N 3.4Å; F723-L726 VanDerWaalsContact O-N 3.16Å; F723-T898 WeakPolarHBondContact CE2-O 3.49Å; F723-L899 HydrophobicContact CE2-CB 4.46Å; F723-L899 HydrophobicContact CE2-CD1 4.29Å; F723-L899 HydrophobicContact CZ-CB 4.26Å; F723-L899 HydrophobicContact CZ-CD1 4.43Å
724	F	84.1	Confident	75.4	Confident	59 Å²	59	66.4 Å²	66.4	26%	0.259	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-64.9	-23.8	170.8	64.2	-95.5	0	0	0	112.9	F653 Y722 L726	F653-F724 HydrophobicContact CE2-CB 3.55Å; F653-F724 HydrophobicContact CZ-CB 3.54Å; F653-F724 WeakPolarHBondContact CZ-O 3.43Å; Y722-F724 AromaticContact CD1-CE1 3.64Å; Y722-F724 HydrophobicContact CD1-CE1 3.64Å; Y722-F724 AromaticContact CD1-CZ 3.72Å; Y722-F724 HydrophobicContact CD1-CZ 3.72Å; Y722-F724 HydrophobicContact CE1-CE1 4.47Å; Y722-F724 HydrophobicContact CE1-CZ 4.39Å; Y722-F724 PolarHBondContact O-N 2.96Å; Y722-F724 VanDerWaalsContact O-N 3.17Å; F724-L726 VanDerWaalsContact C-N 3.29Å
725	Q	86.4	Confident	73.2	Confident	98 Å²	98	62 Å²	62	46%	0.458	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-81.4	-10.9	176	-58	178.3	-2.4	0	0	112.7	Y722 F723 Q727 P897	Y722-Q725 WeakPolarHBondContact O-CB 3.5Å; Y722-Q725 PolarHBondContact O-N 3.45Å; F723-Q725 PolarHBondContact O-N 2.93Å; Q725-Q727 PolarHBondContact O-N 3.34Å; Q725-Q727 VanDerWaalsContact O-N 3.09Å; Q725-P897 HydrophobicContact CB-CG 4.36Å
726	L	84.1	Confident	70.5	Confident	29 Å²	29	66.8 Å²	66.8	15%	0.152	35%	0.354	C	S	.	.	S	Bend	trans	-69	109.2	175	-167.8	72	0	0	0	107.3	F563 F723 F724 G728 W778 V866 P897	F563-L726 HydrophobicContact CB-CD2 4.31Å; F563-L726 HydrophobicContact CD2-CD2 4.04Å; F723-L726 HydrophobicContact CD1-CD2 4.22Å; F723-L726 VanDerWaalsContact O-CB 3.22Å; F723-L726 WeakPolarHBondContact O-CB 3.14Å; F723-L726 PolarHBondContact O-N 3.4Å; F723-L726 VanDerWaalsContact O-N 3.16Å; F724-L726 VanDerWaalsContact C-N 3.29Å; L726-G728 PolarHBondContact O-N 3.43Å; L726-W778 HydrophobicContact CD1-CH2 4.28Å; L726-W778 HydrophobicContact CD1-CZ2 4.47Å; L726-V866 HydrophobicContact CD1-CG2 4.02Å; L726-P897 HydrophobicContact CB-CG 4.16Å; L726-P897 HydrophobicContact CD1-CB 4.43Å; L726-P897 HydrophobicContact CD1-CG 4.24Å
727	Q	67.4	Low	68	Low	154 Å²	154	71 Å²	71	72%	0.72	40%	0.398	S	S	*	.			trans	-55.6	130.4	-174.9	-69.8	-177.6	-2.5	0	0	111.3	Q725 E729	Q725-Q727 PolarHBondContact O-N 3.34Å; Q725-Q727 VanDerWaalsContact O-N 3.09Å; Q727-E729 PolarHBondContact O-N 3.38Å
728	G	57.8	Low	65.9	Low	51 Å²	51	75.1 Å²	75.1	53%	0.526	43%	0.426	S	S	.	.			trans	-60.6	126.4	176.4	0	0	0	0	0	111.1	L726 G730	L726-G728 PolarHBondContact O-N 3.43Å; G728-G730 PolarHBondContact O-N 2.9Å
729	E	55.1	Low	64.5	Low	62 Å²	62	81.6 Å²	81.6	29%	0.29	46%	0.456	S	S	.	.			trans	-82.1	79.7	-174.1	-61.7	-178.5	134.8	0	0	111	Q566 Q727 R740 K777	Q566-E729 PolarHBondContact NE2-OE2 3.01Å; Q727-E729 PolarHBondContact O-N 3.38Å; E729-R740 IonicContact OE1-CZ 3.32Å; E729-R740 IonicContact OE1-NH1 3.93Å; E729-R740 PolarHBondContact OE1-NH1 3.44Å; E729-R740 IonicContact OE1-NH2 2.81Å; E729-K777 WeakPolarHBondContact OE2-CD 3.35Å; E729-K777 WeakPolarHBondContact OE2-CE 3.4Å; E729-K777 IonicContact OE2-NZ 2.76Å; E729-K777 PolarHBondContact OE2-NZ 3.49Å
730	G	48.2	Very low	63.9	Low	47 Å²	47	85.6 Å²	85.6	49%	0.485	47%	0.472	S	S	.	.			trans	-59	140.2	167.6	0	0	0	0	0	111.1	G728 D732 S733	G728-G730 PolarHBondContact O-N 2.9Å; G730-D732 PolarHBondContact O-N 3.27Å; G730-S733 PolarHBondContact O-N 2.89Å; G730-S733 PolarHBondContact O-OG 3.43Å; G730-S733 VanDerWaalsContact O-OG 3.06Å
731	K	40.7	Very low	63.7	Low	216 Å²	216	86.2 Å²	86.2	94%	0.939	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-16.5	-176.2	-96.3	175.8	175.8	171.5	0	115.3
732	D	36.4	Very low	63.8	Low	159 Å²	159	86.1 Å²	86.1	85%	0.85	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	13.5	-177.3	-74.6	-42.5	0	0	0	115.3	G730 K734	G730-D732 PolarHBondContact O-N 3.27Å; D732-K734 PolarHBondContact O-N 2.94Å
733	S	41.8	Very low	64	Low	61 Å²	61	85 Å²	85	43%	0.427	47%	0.469	S	S	.	.			trans	-78	77.3	176	61.7	0	0	0	0	111.2	G730 V735	G730-S733 PolarHBondContact O-N 2.89Å; G730-S733 PolarHBondContact O-OG 3.43Å; G730-S733 VanDerWaalsContact O-OG 3.06Å; S733-V735 PolarHBondContact O-N 3.43Å
734	K	39.8	Very low	64.2	Low	211 Å²	211	84.6 Å²	84.6	92%	0.917	47%	0.468	S	S	*	.			trans	-60.9	76.8	147.1	-75.9	-178.3	179.3	175.4	0	106.8	D732 D736	D732-K734 PolarHBondContact O-N 2.94Å; K734-D736 VanDerWaalsContact C-N 3.26Å; K734-D736 PolarHBondContact O-N 3.5Å
735	V	47	Very low	64.7	Low	74 Å²	74	81.8 Å²	81.8	45%	0.448	46%	0.455	S	S	.	.			trans	-70	95.4	171.5	-176.8	0	0	0	0	106.7	S733 G737	S733-V735 PolarHBondContact O-N 3.43Å; V735-G737 PolarHBondContact O-N 2.98Å
736	D	36.7	Very low	64.8	Low	142 Å²	142	77.1 Å²	77.1	76%	0.759	43%	0.434	S	S	*	.			trans	13.1	102.9	139.8	-127.5	3	0	0	0	114.9	K734 S738	K734-D736 VanDerWaalsContact C-N 3.26Å; K734-D736 PolarHBondContact O-N 3.5Å; D736-S738 PolarHBondContact O-N 2.96Å; D736-S738 PolarHBondContact O-OG 3.24Å
737	G	44	Very low	65	Low	90 Å²	90	76 Å²	76	93%	0.928	43%	0.428	S	S	*	.	S	Bend	trans	47.1	-6.5	145.7	0	0	0	0	0	122.6	V735	V735-G737 PolarHBondContact O-N 2.98Å
738	S	52	Low	65.9	Low	86 Å²	86	69.3 Å²	69.3	60%	0.601	40%	0.397	S	S	*	.			trans	-102.3	109.7	-177.5	58.4	0	0	0	0	109.1	D736 R740	D736-S738 PolarHBondContact O-N 2.96Å; D736-S738 PolarHBondContact O-OG 3.24Å; S738-R740 PolarHBondContact O-N 2.92Å
739	E	66.7	Low	67.3	Low	135 Å²	135	67.6 Å²	67.6	63%	0.631	38%	0.375	S	S	*	.			trans	-58.4	113.9	174.6	-68	-175	162.1	0	0	109.2	T741	E739-T741 PolarHBondContact O-N 3.16Å
740	R	84	Confident	68.7	Low	85 Å²	85	65.3 Å²	65.3	32%	0.321	37%	0.365	S	S	.	.			trans	-55.7	131.7	171.3	-69.6	-177.1	179.5	-177.2	-1.9	108.7	E729 S738 A781 R782 A865	E729-R740 IonicContact OE1-CZ 3.32Å; E729-R740 IonicContact OE1-NH1 3.93Å; E729-R740 PolarHBondContact OE1-NH1 3.44Å; E729-R740 IonicContact OE1-NH2 2.81Å; S738-R740 PolarHBondContact O-N 2.92Å; R740-A781 HydrophobicContact CB-CB 4.13Å; R740-A781 CarbonylContact O-C 3.31Å; R740-A781 WeakPolarHBondContact O-CA 3.38Å; R740-A781 VanDerWaalsContact O-CB 3.3Å; R740-A781 WeakPolarHBondContact O-CB 3.3Å; R740-R782 PolarHBondContact O-N 3.3Å; R740-A865 HydrophobicContact CB-CB 4.3Å
741	T	91	Very high	70.3	Confident	18 Å²	18	67.9 Å²	67.9	11%	0.11	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.3	179.7	46.1	0	0	0	0	111.6	E739 R782 A864 A865	E739-T741 PolarHBondContact O-N 3.16Å; T741-R782 VanDerWaalsContact CA-O 3.31Å; T741-R782 WeakPolarHBondContact CA-O 3.46Å; T741-R782 HydrophobicContact CG2-CB 4.29Å; T741-A864 WeakPolarHBondContact OG1-CA 3.34Å; T741-A865 WeakPolarHBondContact O-CB 3.33Å; T741-A865 PolarHBondContact O-N 2.92Å
742	I	94.4	Very high	71.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.4	172.5	-59	169.1	0	0	0	107.2	V744 A769 L772 N773 W778 A781 R782 M783 R784 F868	I742-V744 HydrophobicContact CG2-CG2 4.34Å; I742-A769 HydrophobicContact CG2-CB 4.42Å; I742-L772 HydrophobicContact CD1-CD2 4.11Å; I742-L772 HydrophobicContact CD1-CG 4.36Å; I742-L772 HydrophobicContact CG1-CD2 4.49Å; I742-N773 HydrophobicContact CD1-CB 4.02Å; I742-W778 HydrophobicContact CD1-CB 4.48Å; I742-W778 HydrophobicContact CD1-CE3 3.88Å; I742-W778 HydrophobicContact CG1-CE3 3.79Å; I742-W778 HydrophobicContact CG1-CZ3 4.09Å; I742-A781 HydrophobicContact CD1-CB 3.91Å; I742-A781 HydrophobicContact CG1-CB 4Å; I742-R782 PolarHBondContact N-O 3.04Å; I742-M783 CarbonylContact O-C 3.52Å; I742-M783 WeakPolarHBondContact O-CA 3.22Å; I742-R784 PolarHBondContact O-N 3.31Å; I742-F868 HydrophobicContact CG2-CD2 3.86Å; I742-F868 HydrophobicContact CG2-CE2 3.81Å
743	D	95.5	Very high	73	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.6	-177.5	-76.3	4.4	0	0	0	111.1	R784 F786 S861 A864 V866 R867 F868	D743-R784 WeakPolarHBondContact CA-O 3.43Å; D743-R784 IonicContact OD1-CZ 2.93Å; D743-R784 VanDerWaalsContact OD1-CZ 3.28Å; D743-R784 IonicContact OD1-NE 3.7Å; D743-R784 PolarHBondContact OD1-NE 3.37Å; D743-R784 IonicContact OD1-NH2 3.94Å; D743-R784 PolarHBondContact OD1-NH2 3.16Å; D743-R784 IonicContact OD2-CZ 3.56Å; D743-R784 IonicContact OD2-NE 3.39Å; D743-R784 IonicContact OD2-NH2 2.82Å; D743-R784 PolarHBondContact OD2-NH2 3.17Å; D743-F786 HydrophobicContact CB-CD2 4.49Å; D743-F786 HydrophobicContact CB-CE2 3.78Å; D743-F786 VanDerWaalsContact CG-CE2 3.48Å; D743-S861 WeakPolarHBondContact OD2-CA 3.44Å; D743-S861 WeakPolarHBondContact OD2-CB 3.48Å; D743-S861 PolarHBondContact OD2-OG 3.19Å; D743-A864 HydrophobicContact CB-CB 3.98Å; D743-A864 VanDerWaalsContact CG-CB 3.47Å; D743-A864 VanDerWaalsContact OD2-CB 3.27Å; D743-A864 WeakPolarHBondContact OD2-CB 3.29Å; D743-V866 PolarHBondContact N-O 2.69Å; D743-R867 HydrophobicContact CB-CG 4.12Å; D743-R867 CarbonylContact O-C 3.53Å; D743-R867 WeakPolarHBondContact O-CA 3.5Å; D743-F868 PolarHBondContact O-N 2.75Å
744	V	95.4	Very high	74.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	120.1	-172.2	-173.7	0	0	0	0	109.7	I742 P746 L765 L766 A769 M783 R784 I785 F786 F868	I742-V744 HydrophobicContact CG2-CG2 4.34Å; V744-P746 WeakPolarHBondContact O-CD 3.36Å; V744-L765 HydrophobicContact CB-CD2 4.45Å; V744-L765 HydrophobicContact CG1-CD2 3.18Å; V744-L766 HydrophobicContact CG1-CD2 4.06Å; V744-A769 HydrophobicContact CG2-CB 3.65Å; V744-M783 HydrophobicContact CG2-CG 4.23Å; V744-R784 PolarHBondContact N-O 3.4Å; V744-I785 HydrophobicContact CB-CG1 4.09Å; V744-I785 HydrophobicContact CG2-CG1 4.49Å; V744-I785 WeakPolarHBondContact O-CA 3.01Å; V744-F786 PolarHBondContact O-N 2.98Å; V744-F868 HydrophobicContact CG1-CB 4.5Å; V744-F868 HydrophobicContact CG2-CB 4.49Å
745	W	93.9	Very high	75.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	91.5	176.4	-65	80.9	0	0	0	109.1	L747 L749 F786 V821 M856 L857 H860 S861 F868 L869 Y870	W745-L747 VanDerWaalsContact C-N 3.32Å; W745-L747 PolarHBondContact O-N 3.15Å; W745-L749 HydrophobicContact CE3-CD1 4.33Å; W745-L749 HydrophobicContact CE3-CD2 4.36Å; W745-F786 HydrophobicContact CD2-CB 3.67Å; W745-F786 HydrophobicContact CD2-CD2 4.22Å; W745-F786 HydrophobicContact CD2-CG 4.08Å; W745-F786 AromaticContact CE2-CD2 3.63Å; W745-F786 AromaticContact CE2-CG 3.6Å; W745-F786 HydrophobicContact CE3-CB 3.59Å; W745-F786 HydrophobicContact CE3-CG 4.36Å; W745-F786 HydrophobicContact CG-CB 4.42Å; W745-F786 HydrophobicContact CH2-CB 3.76Å; W745-F786 AromaticContact CH2-CD1 3.91Å; W745-F786 HydrophobicContact CH2-CD1 3.91Å; W745-F786 AromaticContact CH2-CG 3.86Å; W745-F786 HydrophobicContact CH2-CG 3.86Å; W745-F786 HydrophobicContact CZ2-CB 3.79Å; W745-F786 AromaticContact CZ2-CD1 3.68Å; W745-F786 HydrophobicContact CZ2-CD1 3.68Å; W745-F786 AromaticContact CZ2-CD2 3.88Å; W745-F786 HydrophobicContact CZ2-CD2 3.88Å; W745-F786 HydrophobicContact CZ2-CE1 4.21Å; W745-F786 HydrophobicContact CZ2-CE2 4.4Å; W745-F786 AromaticContact CZ2-CG 3.49Å; W745-F786 HydrophobicContact CZ2-CG 3.49Å; W745-F786 VanDerWaalsContact CZ2-CG 3.49Å; W745-F786 HydrophobicContact CZ3-CB 3.63Å; W745-F786 HydrophobicContact CZ3-CG 4.26Å; W745-F786 AromaticContact NE1-CD2 3.59Å; W745-V821 HydrophobicContact CH2-CG1 4.42Å; W745-V821 HydrophobicContact CH2-CG2 3.96Å; W745-V821 HydrophobicContact CZ3-CG2 4.28Å; W745-M856 HydrophobicContact CH2-SD 3.62Å; W745-M856 HydrophobicContact CZ3-SD 3.55Å; W745-M856 VanDerWaalsContact CZ3-SD 3.55Å; W745-L857 HydrophobicContact CD2-CD2 3.57Å; W745-L857 VanDerWaalsContact CE2-CD2 3.43Å; W745-L857 HydrophobicContact CE3-CD2 3.99Å; W745-L857 HydrophobicContact CG-CD2 4.02Å; W745-L857 HydrophobicContact CH2-CD2 4.1Å; W745-L857 HydrophobicContact CZ2-CD2 3.73Å; W745-L857 HydrophobicContact CZ3-CD2 4.24Å; W745-H860 HydrophobicContact CH2-CB 4.39Å; W745-H860 HydrophobicContact CZ2-CB 4.11Å; W745-S861 WeakPolarHBondContact CZ2-OG 3.43Å; W745-S861 PolarHBondContact NE1-OG 3.34Å; W745-F868 PolarHBondContact N-O 2.88Å; W745-L869 HydrophobicContact CB-CD2 3.6Å; W745-L869 VanDerWaalsContact CD1-CD2 3.41Å; W745-L869 HydrophobicContact CG-CD2 3.6Å; W745-Y870 PolarHBondContact O-N 3.11Å
746	P	88.8	Confident	76.5	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	30%	0.298	C	S	.	.			trans	-77.6	-12.9	-171.3	30.3	-35.4	0	0	0	114.4	V744 Y757 S762 I785 F786	V744-P746 WeakPolarHBondContact O-CD 3.36Å; P746-Y757 HydrophobicContact CB-CD1 4.47Å; P746-Y757 HydrophobicContact CG-CD1 3.86Å; P746-Y757 HydrophobicContact CG-CE1 4.12Å; P746-S762 PolarHBondContact O-OG 3.4Å; P746-I785 HydrophobicContact CG-CG2 4.12Å; P746-F786 WeakPolarHBondContact CD-O 3.29Å
747	L	87.4	Confident	78.2	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.026	27%	0.266	C	S	.	.	S	Bend	trans	-91.9	146.5	-176.4	-170.7	138.6	0	0	0	111.7	W745 L749 Q755 Y757 W823 Y870	W745-L747 VanDerWaalsContact C-N 3.32Å; W745-L747 PolarHBondContact O-N 3.15Å; L747-L749 HydrophobicContact CD2-CD2 4.14Å; L747-L749 PolarHBondContact O-N 2.89Å; L747-Q755 HydrophobicContact CD1-CG 4.47Å; L747-Y757 HydrophobicContact CB-CE1 3.83Å; L747-Y757 HydrophobicContact CD1-CE1 3.82Å; L747-Y757 HydrophobicContact CD1-CE2 4.1Å; L747-Y757 WeakPolarHBondContact CD1-OH 3.5Å; L747-Y757 HydrophobicContact CG-CE1 4.45Å; L747-W823 HydrophobicContact CD2-CH2 3.5Å; L747-W823 VanDerWaalsContact CD2-CH2 3.5Å; L747-W823 HydrophobicContact CD2-CZ2 4.08Å; L747-W823 HydrophobicContact CD2-CZ3 4.2Å; L747-Y870 WeakPolarHBondContact O-CB 3.45Å
748	N	87.8	Confident	79.6	Confident	14 Å²	14	45.8 Å²	45.8	8%	0.075	25%	0.249	C	C	.	.			trans	-75.1	90.7	171.9	-175	5.8	0	0	0	110.7	L750 Q751 Y870	N748-L750 PolarHBondContact O-N 3.45Å; N748-L750 PolarHBondContact OD1-N 2.92Å; N748-Q751 PolarHBondContact ND2-OE1 3.01Å; N748-Q751 PolarHBondContact O-N 3.3Å; N748-Y870 HydrophobicContact CB-CD1 3.61Å; N748-Y870 HydrophobicContact CB-CD2 4.45Å; N748-Y870 HydrophobicContact CB-CE1 3.67Å; N748-Y870 HydrophobicContact CB-CE2 4.47Å; N748-Y870 HydrophobicContact CB-CG 4.05Å
749	L	85.7	Confident	81.2	Confident	14 Å²	14	44.8 Å²	44.8	7%	0.073	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.7	-174.7	-61.3	174.7	0	0	0	114.4	W745 L747 W823 F849 V853 L857	W745-L749 HydrophobicContact CE3-CD1 4.33Å; W745-L749 HydrophobicContact CE3-CD2 4.36Å; L747-L749 HydrophobicContact CD2-CD2 4.14Å; L747-L749 PolarHBondContact O-N 2.89Å; L749-W823 HydrophobicContact CB-CZ3 4.41Å; L749-W823 HydrophobicContact CD2-CE3 4.19Å; L749-W823 HydrophobicContact CD2-CH2 4.46Å; L749-W823 HydrophobicContact CD2-CZ3 3.7Å; L749-F849 WeakPolarHBondContact O-CZ 3.32Å; L749-V853 HydrophobicContact CB-CG1 4.03Å; L749-V853 HydrophobicContact CD1-CG1 4.07Å; L749-L857 HydrophobicContact CD1-CD1 4.09Å; L749-L857 HydrophobicContact CD1-CD2 3.82Å; L749-L857 HydrophobicContact CD1-CG 4.21Å
750	L	85.3	Confident	82.3	Confident	15 Å²	15	40.7 Å²	40.7	8%	0.079	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-5.6	179.2	-59.4	-170.9	0	0	0	114	N748 L845 F849 L850 P872 V891	N748-L750 PolarHBondContact O-N 3.45Å; N748-L750 PolarHBondContact OD1-N 2.92Å; L750-L845 HydrophobicContact CB-CD1 4.1Å; L750-L845 HydrophobicContact CD1-CD1 4.45Å; L750-L845 HydrophobicContact CD2-CD1 4.26Å; L750-F849 HydrophobicContact CD2-CE1 4.31Å; L750-L850 HydrophobicContact CD2-CD2 3.7Å; L750-P872 HydrophobicContact CD1-CB 4.28Å; L750-P872 HydrophobicContact CD1-CG 3.79Å; L750-V891 HydrophobicContact CD2-CG2 3.83Å
751	Q	82.3	Confident	82.5	Confident	101 Å²	101	36.7 Å²	36.7	47%	0.472	21%	0.206	S	C	.	.			trans	-131.6	79.6	179.1	-70.9	-178.6	-13.6	0	0	109.7	N748 G753 N754	N748-Q751 PolarHBondContact ND2-OE1 3.01Å; N748-Q751 PolarHBondContact O-N 3.3Å; Q751-G753 PolarHBondContact O-N 3.46Å; Q751-N754 PolarHBondContact O-N 3.15Å
752	P	68.9	Low	82.4	Confident	4 Å²	4	36 Å²	36	3%	0.026	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-9	-171.9	22.1	-30.8	0	0	0	115.5	W823 V827 Y830 F849	P752-W823 HydrophobicContact CB-CH2 3.84Å; P752-W823 HydrophobicContact CB-CZ2 3.87Å; P752-V827 HydrophobicContact CB-CG1 4.31Å; P752-V827 HydrophobicContact CB-CG2 3.97Å; P752-Y830 HydrophobicContact CG-CD1 3.54Å; P752-Y830 HydrophobicContact CG-CD2 3.6Å; P752-Y830 HydrophobicContact CG-CE1 3.81Å; P752-Y830 HydrophobicContact CG-CE2 3.85Å; P752-Y830 HydrophobicContact CG-CG 3.44Å; P752-Y830 VanDerWaalsContact CG-CG 3.44Å; P752-F849 HydrophobicContact CG-CZ 4.38Å
753	G	63.7	Low	82.2	Confident	77 Å²	77	37 Å²	37	79%	0.794	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-6.9	175.9	0	0	0	0	0	116.5	Q751	Q751-G753 PolarHBondContact O-N 3.46Å
754	N	66.8	Low	82	Confident	82 Å²	82	37 Å²	37	44%	0.439	21%	0.207	S	C	.	.			trans	-110.4	91.6	-176.4	-163.9	5.2	0	0	0	110.7	Q751 D756	Q751-N754 PolarHBondContact O-N 3.15Å; N754-D756 PolarHBondContact O-N 3.02Å
755	Q	65.6	Low	81.9	Confident	64 Å²	64	37 Å²	37	30%	0.299	21%	0.207	S	C	.	.			trans	-94.8	25.6	-174.2	-62.7	-174.2	9	0	0	113.9	L747 Y757 E790	L747-Q755 HydrophobicContact CD1-CG 4.47Å; Q755-Y757 VanDerWaalsContact O-CD2 3.29Å; Q755-Y757 WeakPolarHBondContact O-CD2 3.26Å; Q755-Y757 PolarHBondContact O-N 2.67Å; Q755-E790 VanDerWaalsContact NE2-CD 3.33Å; Q755-E790 PolarHBondContact NE2-OE1 3.29Å; Q755-E790 VanDerWaalsContact NE2-OE1 3.13Å
756	D	70.4	Confident	81.8	Confident	116 Å²	116	37.1 Å²	37.1	62%	0.62	21%	0.208	S	C	*	.			trans	-80.7	87.5	-179.1	-75.4	-18.2	0	0	0	112.4	N754 Q758 D759	N754-D756 PolarHBondContact O-N 3.02Å; D756-Q758 PolarHBondContact O-N 3.44Å; D756-Q758 VanDerWaalsContact O-N 3.09Å; D756-D759 PolarHBondContact O-N 3.12Å
757	Y	72.4	Confident	81.8	Confident	22 Å²	22	39.7 Å²	39.7	9%	0.086	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-7.1	173.3	-67.3	-78.4	0	0	0	114.6	P746 L747 Q755 S762 L787 N788	P746-Y757 HydrophobicContact CB-CD1 4.47Å; P746-Y757 HydrophobicContact CG-CD1 3.86Å; P746-Y757 HydrophobicContact CG-CE1 4.12Å; L747-Y757 HydrophobicContact CB-CE1 3.83Å; L747-Y757 HydrophobicContact CD1-CE1 3.82Å; L747-Y757 HydrophobicContact CD1-CE2 4.1Å; L747-Y757 WeakPolarHBondContact CD1-OH 3.5Å; L747-Y757 HydrophobicContact CG-CE1 4.45Å; Q755-Y757 VanDerWaalsContact O-CD2 3.29Å; Q755-Y757 WeakPolarHBondContact O-CD2 3.26Å; Q755-Y757 PolarHBondContact O-N 2.67Å; Y757-S762 WeakPolarHBondContact O-CB 3.23Å; Y757-L787 HydrophobicContact CD1-CD2 3.61Å; Y757-L787 HydrophobicContact CE1-CD2 3.38Å; Y757-L787 HydrophobicContact CE2-CD2 4.33Å; Y757-L787 HydrophobicContact CG-CD2 4.19Å; Y757-N788 PolarHBondContact OH-N 3Å; Y757-N788 VanDerWaalsContact OH-N 3.15Å; Y757-N788 PolarHBondContact OH-O 3.23Å
758	Q	74.4	Confident	82.1	Confident	124 Å²	124	39.4 Å²	39.4	58%	0.579	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.5	8.4	-178.3	-56.4	-174.1	17.2	0	0	112.9	D756 L763 L808	D756-Q758 PolarHBondContact O-N 3.44Å; D756-Q758 VanDerWaalsContact O-N 3.09Å; Q758-L763 WeakPolarHBondContact O-CD1 3.38Å; Q758-L808 HydrophobicContact CG-CD2 4.26Å
759	D	85.6	Confident	82.3	Confident	64 Å²	64	38.8 Å²	38.8	34%	0.342	22%	0.215	S	C	.	.	S	Bend	trans	-62.1	154	174.4	-177.1	34	0	0	0	111.7	D756 C761 S762 L763	D756-D759 PolarHBondContact O-N 3.12Å; D759-C761 PolarHBondContact O-N 3.25Å; D759-S762 PolarHBondContact O-N 3.4Å; D759-S762 VanDerWaalsContact O-N 3.08Å; D759-L763 PolarHBondContact O-N 3.35Å
760	V	88	Confident	82.6	Confident	50 Å²	50	38.9 Å²	38.9	30%	0.303	22%	0.217	S	C	.	.	H	α-helix	trans	-52	-40.6	177.3	177.6	0	0	0	0	110.8	F764	V760-F764 WeakPolarHBondContact O-CB 3.38Å; V760-F764 PolarHBondContact O-N 2.92Å
761	C	89.7	Confident	82.9	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.007	22%	0.215	C	C	.	.	H	α-helix	trans	-69.7	-41.8	-179.9	-176.4	0	0	0	0	112.2	D759 F764 L765 Y870 I901 G903	D759-C761 PolarHBondContact O-N 3.25Å; C761-F764 WeakPolarHBondContact O-CB 3.42Å; C761-F764 PolarHBondContact O-N 2.88Å; C761-L765 VanDerWaalsContact O-CB 3.28Å; C761-L765 WeakPolarHBondContact O-CB 3.35Å; C761-L765 PolarHBondContact O-N 3.31Å; C761-Y870 HydrophobicContact CB-CD2 4.34Å; C761-Y870 HydrophobicContact CB-CE2 3.48Å; C761-Y870 VanDerWaalsContact CB-CE2 3.48Å; C761-Y870 WeakPolarHBondContact SG-CE2 3.36Å; C761-I901 PolarHBondContact SG-O 2.92Å; C761-G903 PolarHBondContact SG-N 3.39Å
762	S	88.8	Confident	83.4	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-63.4	-44.5	176.9	-54.7	0	0	0	0	111.7	P746 Y757 D759 L765 L766	P746-S762 PolarHBondContact O-OG 3.4Å; Y757-S762 WeakPolarHBondContact O-CB 3.23Å; D759-S762 PolarHBondContact O-N 3.4Å; D759-S762 VanDerWaalsContact O-N 3.08Å; S762-L765 PolarHBondContact O-N 2.88Å; S762-L766 WeakPolarHBondContact O-CG 3.27Å; S762-L766 PolarHBondContact O-N 3.35Å
763	L	89.8	Confident	84.5	Confident	21 Å²	21	35.1 Å²	35.1	11%	0.11	20%	0.2	C	C	.	.	H	α-helix	trans	-64.6	-39.4	175.3	-68.2	169.9	0	0	0	112	Q758 D759 L766 Q767 L808 L812	Q758-L763 WeakPolarHBondContact O-CD1 3.38Å; D759-L763 PolarHBondContact O-N 3.35Å; L763-L766 PolarHBondContact O-N 2.91Å; L763-Q767 WeakPolarHBondContact O-CB 3.25Å; L763-Q767 PolarHBondContact O-N 2.68Å; L763-L808 HydrophobicContact CD2-CD2 4.2Å; L763-L812 HydrophobicContact CD2-CD1 4.21Å
764	F	91.1	Very high	85.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.6	-44.6	174.2	-177.2	-96.9	0	0	0	112.2	W543 N716 V760 C761 Q767 M768 I901 V907	W543-F764 AromaticContact CH2-CE2 3.78Å; W543-F764 HydrophobicContact CH2-CE2 3.78Å; W543-F764 HydrophobicContact CH2-CZ 4.39Å; W543-F764 HydrophobicContact CZ2-CD2 4.37Å; W543-F764 AromaticContact CZ2-CE2 3.45Å; W543-F764 HydrophobicContact CZ2-CE2 3.45Å; W543-F764 VanDerWaalsContact CZ2-CE2 3.45Å; W543-F764 HydrophobicContact CZ2-CZ 4.19Å; N716-F764 HydrophobicContact CB-CE1 3.87Å; N716-F764 HydrophobicContact CB-CE2 4.09Å; N716-F764 HydrophobicContact CB-CZ 3.53Å; N716-F764 VanDerWaalsContact ND2-CE2 3.26Å; N716-F764 WeakPolarHBondContact ND2-CE2 3.48Å; N716-F764 WeakPolarHBondContact ND2-CZ 3.3Å; V760-F764 WeakPolarHBondContact O-CB 3.38Å; V760-F764 PolarHBondContact O-N 2.92Å; C761-F764 WeakPolarHBondContact O-CB 3.42Å; C761-F764 PolarHBondContact O-N 2.88Å; F764-Q767 WeakPolarHBondContact O-CB 3.39Å; F764-Q767 PolarHBondContact O-N 2.83Å; F764-M768 HydrophobicContact CD1-CG 4.13Å; F764-M768 HydrophobicContact CE1-CG 3.69Å; F764-M768 HydrophobicContact CE1-SD 4.4Å; F764-M768 HydrophobicContact CE2-CG 4.48Å; F764-M768 HydrophobicContact CZ-CG 3.88Å; F764-M768 HydrophobicContact CZ-SD 4.01Å; F764-M768 WeakPolarHBondContact O-CG 3.39Å; F764-M768 PolarHBondContact O-N 3.28Å; F764-I901 HydrophobicContact CD1-CG2 3.42Å; F764-I901 VanDerWaalsContact CD1-CG2 3.42Å; F764-I901 HydrophobicContact CE1-CG2 3.45Å; F764-I901 VanDerWaalsContact CE1-CG2 3.45Å; F764-V907 HydrophobicContact CB-CG2 4.37Å; F764-V907 HydrophobicContact CD2-CG1 3.64Å; F764-V907 HydrophobicContact CD2-CG2 4.4Å; F764-V907 HydrophobicContact CE2-CG1 4.16Å
765	L	92.5	Very high	86.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.9	-44.8	178.8	-169.9	161.5	0	0	0	110.8	V744 C761 S762 Q767 M768 A769 F868 I901	V744-L765 HydrophobicContact CB-CD2 4.45Å; V744-L765 HydrophobicContact CG1-CD2 3.18Å; C761-L765 VanDerWaalsContact O-CB 3.28Å; C761-L765 WeakPolarHBondContact O-CB 3.35Å; C761-L765 PolarHBondContact O-N 3.31Å; S762-L765 PolarHBondContact O-N 2.88Å; L765-Q767 VanDerWaalsContact C-N 3.34Å; L765-Q767 PolarHBondContact O-N 3.47Å; L765-M768 PolarHBondContact O-N 3.34Å; L765-A769 PolarHBondContact O-N 3.31Å; L765-F868 HydrophobicContact CD2-CB 3.7Å; L765-F868 HydrophobicContact CG-CB 4.2Å; L765-I901 HydrophobicContact CD1-CB 4.42Å; L765-I901 HydrophobicContact CG-CB 4.43Å
766	L	92	Very high	87.5	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-58.8	-43.7	172.5	-73	168.5	0	0	0	112	V744 S762 L763 A769 C770 I785 F805 L809 I814	V744-L766 HydrophobicContact CG1-CD2 4.06Å; S762-L766 WeakPolarHBondContact O-CG 3.27Å; S762-L766 PolarHBondContact O-N 3.35Å; L763-L766 PolarHBondContact O-N 2.91Å; L766-A769 PolarHBondContact O-N 3.05Å; L766-C770 VanDerWaalsContact O-CB 3.32Å; L766-C770 WeakPolarHBondContact O-CB 3.29Å; L766-C770 PolarHBondContact O-N 3.23Å; L766-I785 HydrophobicContact CD2-CD1 3.62Å; L766-I785 HydrophobicContact CD2-CG1 4.14Å; L766-I785 HydrophobicContact CD2-CG2 4.49Å; L766-F805 HydrophobicContact CD1-CE2 4.2Å; L766-F805 HydrophobicContact CD1-CZ 4.03Å; L766-F805 HydrophobicContact CD2-CZ 4.46Å; L766-L809 HydrophobicContact CD1-CD2 4.43Å; L766-L809 HydrophobicContact CD2-CD2 4.36Å; L766-I814 HydrophobicContact CB-CD1 4.34Å
767	Q	90.6	Very high	88.1	Confident	54 Å²	54	34.5 Å²	34.5	25%	0.252	18%	0.183	S	C	.	.	H	α-helix	trans	-62.6	-43.3	177.9	-176.3	65.3	10.9	0	0	111.5	W543 L763 F764 L765 C770 V771 V907	W543-Q767 HydrophobicContact CE3-CG 4.49Å; W543-Q767 HydrophobicContact CZ3-CG 3.95Å; L763-Q767 WeakPolarHBondContact O-CB 3.25Å; L763-Q767 PolarHBondContact O-N 2.68Å; F764-Q767 WeakPolarHBondContact O-CB 3.39Å; F764-Q767 PolarHBondContact O-N 2.83Å; L765-Q767 VanDerWaalsContact C-N 3.34Å; L765-Q767 PolarHBondContact O-N 3.47Å; Q767-C770 WeakPolarHBondContact O-CB 3.19Å; Q767-C770 PolarHBondContact O-N 3.29Å; Q767-V771 HydrophobicContact CG-CG2 4.5Å; Q767-V771 VanDerWaalsContact O-CG2 3.26Å; Q767-V771 WeakPolarHBondContact O-CG2 3.4Å; Q767-V771 PolarHBondContact O-N 3.37Å; Q767-V907 HydrophobicContact CB-CB 4.42Å; Q767-V907 HydrophobicContact CB-CG2 3.74Å; Q767-V907 HydrophobicContact CG-CB 4.18Å; Q767-V907 HydrophobicContact CG-CG2 4.05Å
768	M	92	Very high	88.8	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.9	-42.6	178.3	-70.8	-59.4	-70.3	0	0	112.2	W543 P545 L567 F764 L765 C770 V771 L772 F868 I901	W543-M768 HydrophobicContact CH2-SD 3.93Å; P545-M768 HydrophobicContact CB-CE 4.39Å; P545-M768 HydrophobicContact CB-SD 4.19Å; L567-M768 HydrophobicContact CD1-CE 3.81Å; L567-M768 HydrophobicContact CD2-CE 3.46Å; L567-M768 VanDerWaalsContact CD2-CE 3.46Å; L567-M768 HydrophobicContact CG-CE 3.49Å; L567-M768 VanDerWaalsContact CG-CE 3.49Å; F764-M768 HydrophobicContact CD1-CG 4.13Å; F764-M768 HydrophobicContact CE1-CG 3.69Å; F764-M768 HydrophobicContact CE1-SD 4.4Å; F764-M768 HydrophobicContact CE2-CG 4.48Å; F764-M768 HydrophobicContact CZ-CG 3.88Å; F764-M768 HydrophobicContact CZ-SD 4.01Å; F764-M768 WeakPolarHBondContact O-CG 3.39Å; F764-M768 PolarHBondContact O-N 3.28Å; L765-M768 PolarHBondContact O-N 3.34Å; M768-C770 VanDerWaalsContact C-N 3.31Å; M768-C770 PolarHBondContact O-N 2.83Å; M768-V771 PolarHBondContact O-N 3.45Å; M768-L772 PolarHBondContact O-N 3.34Å; M768-F868 HydrophobicContact CB-CD1 4.4Å; M768-F868 HydrophobicContact CB-CE1 3.96Å; M768-I901 HydrophobicContact CB-CD1 3.98Å; M768-I901 HydrophobicContact CG-CD1 4.22Å
769	A	93.1	Very high	89.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-40	173.8	0	0	0	0	0	111.5	I742 V744 L765 L766 L772 N773 M783 F868	I742-A769 HydrophobicContact CG2-CB 4.42Å; V744-A769 HydrophobicContact CG2-CB 3.65Å; L765-A769 PolarHBondContact O-N 3.31Å; L766-A769 PolarHBondContact O-N 3.05Å; A769-L772 PolarHBondContact O-N 3.36Å; A769-N773 WeakPolarHBondContact O-CB 3.34Å; A769-N773 PolarHBondContact O-N 2.88Å; A769-M783 HydrophobicContact CB-CE 3.82Å; A769-M783 HydrophobicContact CB-SD 4.48Å; A769-M783 WeakPolarHBondContact O-CE 3.41Å; A769-F868 HydrophobicContact CB-CD1 4.32Å; A769-F868 HydrophobicContact CB-CD2 4.19Å; A769-F868 HydrophobicContact CB-CE1 4.45Å; A769-F868 HydrophobicContact CB-CE2 4.31Å; A769-F868 HydrophobicContact CB-CG 4.21Å; A769-F868 HydrophobicContact CB-CZ 4.45Å
770	C	91.5	Very high	89.3	Confident	16 Å²	16	41.7 Å²	41.7	11%	0.108	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-43.6	176.2	-166.6	0	0	0	0	112	L766 Q767 M768 L772 N773 M774	L766-C770 VanDerWaalsContact O-CB 3.32Å; L766-C770 WeakPolarHBondContact O-CB 3.29Å; L766-C770 PolarHBondContact O-N 3.23Å; Q767-C770 WeakPolarHBondContact O-CB 3.19Å; Q767-C770 PolarHBondContact O-N 3.29Å; M768-C770 VanDerWaalsContact C-N 3.31Å; M768-C770 PolarHBondContact O-N 2.83Å; C770-L772 VanDerWaalsContact C-N 3.32Å; C770-L772 PolarHBondContact O-N 3.46Å; C770-N773 PolarHBondContact O-N 3.21Å; C770-M774 VanDerWaalsContact O-CG 3.26Å; C770-M774 WeakPolarHBondContact O-CG 3.16Å; C770-M774 PolarHBondContact O-N 3.32Å; C770-M774 WeakPolarHBondContact SG-CE 3.33Å
771	V	91.8	Very high	89.3	Confident	9 Å²	9	39.7 Å²	39.7	6%	0.055	20%	0.195	C	C	.	.	H	α-helix	trans	-60	-43.5	176.4	172.8	0	0	0	0	110.8	P545 L567 K569 Q767 M768 M774 S775	P545-V771 HydrophobicContact CG-CG1 4.25Å; L567-V771 WeakPolarHBondContact O-CG1 3.2Å; K569-V771 HydrophobicContact CB-CG1 3.49Å; K569-V771 VanDerWaalsContact CB-CG1 3.49Å; K569-V771 HydrophobicContact CD-CG1 4Å; K569-V771 HydrophobicContact CG-CG1 4.35Å; Q767-V771 HydrophobicContact CG-CG2 4.5Å; Q767-V771 VanDerWaalsContact O-CG2 3.26Å; Q767-V771 WeakPolarHBondContact O-CG2 3.4Å; Q767-V771 PolarHBondContact O-N 3.37Å; M768-V771 PolarHBondContact O-N 3.45Å; V771-M774 PolarHBondContact O-N 3.35Å; V771-S775 PolarHBondContact O-N 3.4Å
772	L	92.5	Very high	89.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-50.9	174.4	-175.5	66.4	0	0	0	110.9	F563 Q566 L567 I742 M768 A769 C770 M774 S775 W778 F868	F563-L772 HydrophobicContact CE2-CD1 3.9Å; F563-L772 HydrophobicContact CE2-CD2 3.84Å; F563-L772 HydrophobicContact CZ-CD1 4.34Å; F563-L772 HydrophobicContact CZ-CD2 4.04Å; Q566-L772 HydrophobicContact CB-CD1 4.44Å; L567-L772 HydrophobicContact CD1-CB 3.97Å; L567-L772 HydrophobicContact CD1-CD1 4.42Å; I742-L772 HydrophobicContact CD1-CD2 4.11Å; I742-L772 HydrophobicContact CD1-CG 4.36Å; I742-L772 HydrophobicContact CG1-CD2 4.49Å; M768-L772 PolarHBondContact O-N 3.34Å; A769-L772 PolarHBondContact O-N 3.36Å; C770-L772 VanDerWaalsContact C-N 3.32Å; C770-L772 PolarHBondContact O-N 3.46Å; L772-M774 PolarHBondContact O-N 3.31Å; L772-M774 VanDerWaalsContact O-N 3.1Å; L772-S775 VanDerWaalsContact O-CB 3.24Å; L772-S775 WeakPolarHBondContact O-CB 3.35Å; L772-S775 PolarHBondContact O-N 2.83Å; L772-S775 PolarHBondContact O-OG 2.91Å; L772-W778 HydrophobicContact CD1-CD2 4.16Å; L772-W778 HydrophobicContact CD1-CG 3.9Å; L772-W778 HydrophobicContact CD2-CD2 4.08Å; L772-W778 HydrophobicContact CD2-CE3 4.22Å; L772-W778 HydrophobicContact CD2-CG 4.46Å; L772-W778 HydrophobicContact CG-CB 4.27Å; L772-W778 HydrophobicContact CG-CD2 4Å; L772-W778 HydrophobicContact CG-CG 3.86Å; L772-W778 WeakPolarHBondContact O-CB 3.16Å; L772-F868 HydrophobicContact CB-CZ 4.37Å; L772-F868 HydrophobicContact CD2-CE2 3.77Å; L772-F868 HydrophobicContact CD2-CZ 3.83Å
773	N	91.6	Very high	89.6	Confident	32 Å²	32	45.6 Å²	45.6	17%	0.171	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-15.3	179.5	-164.4	9.4	0	0	0	113.5	I742 A769 C770 W778 R779 A781 M783	I742-N773 HydrophobicContact CD1-CB 4.02Å; A769-N773 WeakPolarHBondContact O-CB 3.34Å; A769-N773 PolarHBondContact O-N 2.88Å; C770-N773 PolarHBondContact O-N 3.21Å; N773-W778 PolarHBondContact OD1-O 3.39Å; N773-R779 VanDerWaalsContact O-CA 3.3Å; N773-R779 WeakPolarHBondContact O-CA 3.46Å; N773-A781 PolarHBondContact OD1-O 3.15Å; N773-M783 HydrophobicContact CB-CE 3.67Å
774	M	88.7	Confident	89.8	Confident	102 Å²	102	46.6 Å²	46.6	50%	0.502	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-6.4	172.7	-66.2	171.7	173	0	0	113.7	K569 C770 V771 L772	K569-M774 HydrophobicContact CD-CB 3.88Å; K569-M774 PolarHBondContact NZ-SD 2.81Å; C770-M774 VanDerWaalsContact O-CG 3.26Å; C770-M774 WeakPolarHBondContact O-CG 3.16Å; C770-M774 PolarHBondContact O-N 3.32Å; C770-M774 WeakPolarHBondContact SG-CE 3.33Å; V771-M774 PolarHBondContact O-N 3.35Å; L772-M774 PolarHBondContact O-N 3.31Å; L772-M774 VanDerWaalsContact O-N 3.1Å
775	S	87.6	Confident	90	Very high	11 Å²	11	46.6 Å²	46.6	8%	0.077	22%	0.219	C	C	.	.	S	Bend	trans	-70.5	150.6	174.2	75.9	0	0	0	0	110.5	V771 L772 K777 W778 R779	V771-S775 PolarHBondContact O-N 3.4Å; L772-S775 VanDerWaalsContact O-CB 3.24Å; L772-S775 WeakPolarHBondContact O-CB 3.35Å; L772-S775 PolarHBondContact O-N 2.83Å; L772-S775 PolarHBondContact O-OG 2.91Å; S775-K777 PolarHBondContact O-N 2.85Å; S775-K777 VanDerWaalsContact O-N 3.13Å; S775-W778 PolarHBondContact O-N 2.71Å; S775-W778 VanDerWaalsContact OG-CD1 3.25Å; S775-W778 PolarHBondContact OG-N 3.19Å; S775-R779 PolarHBondContact O-N 2.9Å
776	S	83.9	Confident	90	Very high	106 Å²	106	46.9 Å²	46.9	74%	0.741	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-34.3	-175.6	50.8	0	0	0	0	113.3
777	K	82.8	Confident	89.8	Confident	108 Å²	108	47.1 Å²	47.1	47%	0.47	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-25.7	-176.4	-58.5	-162.5	-176.9	178.2	0	114.2	E729 S775	E729-K777 WeakPolarHBondContact OE2-CD 3.35Å; E729-K777 WeakPolarHBondContact OE2-CE 3.4Å; E729-K777 IonicContact OE2-NZ 2.76Å; E729-K777 PolarHBondContact OE2-NZ 3.49Å; S775-K777 PolarHBondContact O-N 2.85Å; S775-K777 VanDerWaalsContact O-N 3.13Å
778	W	87.1	Confident	89.6	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.011	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	0.9	-178.3	-65.2	81.4	0	0	0	113.6	F563 L726 I742 L772 N773 S775 H780 A781 A865 V866	F563-W778 HydrophobicContact CD2-CZ2 4.43Å; F563-W778 HydrophobicContact CE2-CZ2 4.31Å; L726-W778 HydrophobicContact CD1-CH2 4.28Å; L726-W778 HydrophobicContact CD1-CZ2 4.47Å; I742-W778 HydrophobicContact CD1-CB 4.48Å; I742-W778 HydrophobicContact CD1-CE3 3.88Å; I742-W778 HydrophobicContact CG1-CE3 3.79Å; I742-W778 HydrophobicContact CG1-CZ3 4.09Å; L772-W778 HydrophobicContact CD1-CD2 4.16Å; L772-W778 HydrophobicContact CD1-CG 3.9Å; L772-W778 HydrophobicContact CD2-CD2 4.08Å; L772-W778 HydrophobicContact CD2-CE3 4.22Å; L772-W778 HydrophobicContact CD2-CG 4.46Å; L772-W778 HydrophobicContact CG-CB 4.27Å; L772-W778 HydrophobicContact CG-CD2 4Å; L772-W778 HydrophobicContact CG-CG 3.86Å; L772-W778 WeakPolarHBondContact O-CB 3.16Å; N773-W778 PolarHBondContact OD1-O 3.39Å; S775-W778 PolarHBondContact O-N 2.71Å; S775-W778 VanDerWaalsContact OG-CD1 3.25Å; S775-W778 PolarHBondContact OG-N 3.19Å; W778-H780 PolarHBondContact O-N 2.79Å; W778-H780 VanDerWaalsContact O-N 3.11Å; W778-A781 HydrophobicContact CB-CB 4.49Å; W778-A781 HydrophobicContact CE3-CB 4.03Å; W778-A781 WeakPolarHBondContact O-CB 3.49Å; W778-A781 PolarHBondContact O-N 2.92Å; W778-A865 HydrophobicContact CH2-CB 3.97Å; W778-A865 HydrophobicContact CZ3-CB 3.83Å; W778-V866 HydrophobicContact CH2-CB 4.2Å; W778-V866 HydrophobicContact CH2-CG2 3.47Å; W778-V866 VanDerWaalsContact CH2-CG2 3.47Å; W778-V866 HydrophobicContact CZ2-CG2 4.08Å; W778-V866 HydrophobicContact CZ3-CB 4.41Å; W778-V866 HydrophobicContact CZ3-CG2 4.15Å
779	R	85.7	Confident	89.2	Confident	189 Å²	189	45.3 Å²	45.3	71%	0.713	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-27	-177.1	-172.2	178.1	176.8	-165.3	-1.5	115	N773 S775	N773-R779 VanDerWaalsContact O-CA 3.3Å; N773-R779 WeakPolarHBondContact O-CA 3.46Å; S775-R779 PolarHBondContact O-N 2.9Å
780	H	85.5	Confident	88.5	Confident	168 Å²	168	48.2 Å²	48.2	78%	0.778	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-1.6	177.6	-56.2	99.4	0	0	0	112.7	W778	W778-H780 PolarHBondContact O-N 2.79Å; W778-H780 VanDerWaalsContact O-N 3.11Å
781	A	87.9	Confident	87.5	Confident	8 Å²	8	51.6 Å²	51.6	7%	0.066	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-74.5	136.9	179.7	0	0	0	0	0	110.4	R740 I742 N773 W778	R740-A781 HydrophobicContact CB-CB 4.13Å; R740-A781 CarbonylContact O-C 3.31Å; R740-A781 WeakPolarHBondContact O-CA 3.38Å; R740-A781 VanDerWaalsContact O-CB 3.3Å; R740-A781 WeakPolarHBondContact O-CB 3.3Å; I742-A781 HydrophobicContact CD1-CB 3.91Å; I742-A781 HydrophobicContact CG1-CB 4Å; N773-A781 PolarHBondContact OD1-O 3.15Å; W778-A781 HydrophobicContact CB-CB 4.49Å; W778-A781 HydrophobicContact CE3-CB 4.03Å; W778-A781 WeakPolarHBondContact O-CB 3.49Å; W778-A781 PolarHBondContact O-N 2.92Å
782	R	90.8	Very high	86	Confident	124 Å²	124	54.6 Å²	54.6	47%	0.468	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.8	178	-177.2	176.3	178.5	162.9	1.9	110	R740 T741 I742	R740-R782 PolarHBondContact O-N 3.3Å; T741-R782 VanDerWaalsContact CA-O 3.31Å; T741-R782 WeakPolarHBondContact CA-O 3.46Å; T741-R782 HydrophobicContact CG2-CB 4.29Å; I742-R782 PolarHBondContact N-O 3.04Å
783	M	92.7	Very high	84.4	Confident	5 Å²	5	58 Å²	58	3%	0.025	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	127.6	176.5	-173.7	177.7	-72	0	0	111.3	I742 V744 A769 N773 I814 A816 S817	I742-M783 CarbonylContact O-C 3.52Å; I742-M783 WeakPolarHBondContact O-CA 3.22Å; V744-M783 HydrophobicContact CG2-CG 4.23Å; A769-M783 HydrophobicContact CB-CE 3.82Å; A769-M783 HydrophobicContact CB-SD 4.48Å; A769-M783 WeakPolarHBondContact O-CE 3.41Å; N773-M783 HydrophobicContact CB-CE 3.67Å; M783-I814 HydrophobicContact SD-CG2 4.03Å; M783-A816 HydrophobicContact CB-CB 4.01Å; M783-A816 HydrophobicContact CG-CB 3.78Å; M783-A816 WeakPolarHBondContact O-CA 3.32Å; M783-A816 HydrophobicContact SD-CB 3.97Å; M783-S817 PolarHBondContact O-N 3.29Å; M783-S817 PolarHBondContact O-OG 3.15Å
784	R	94.7	Very high	82.6	Confident	41 Å²	41	62.3 Å²	62.3	16%	0.155	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.9	176.5	-49.7	-171.6	-65.6	177.7	8.1	109.2	I742 D743 V744 F786 S817 H860	I742-R784 PolarHBondContact O-N 3.31Å; D743-R784 WeakPolarHBondContact CA-O 3.43Å; D743-R784 IonicContact OD1-CZ 2.93Å; D743-R784 VanDerWaalsContact OD1-CZ 3.28Å; D743-R784 IonicContact OD1-NE 3.7Å; D743-R784 PolarHBondContact OD1-NE 3.37Å; D743-R784 IonicContact OD1-NH2 3.94Å; D743-R784 PolarHBondContact OD1-NH2 3.16Å; D743-R784 IonicContact OD2-CZ 3.56Å; D743-R784 IonicContact OD2-NE 3.39Å; D743-R784 IonicContact OD2-NH2 2.82Å; D743-R784 PolarHBondContact OD2-NH2 3.17Å; V744-R784 PolarHBondContact N-O 3.4Å; R784-F786 HydrophobicContact CB-CE2 3.94Å; R784-F786 HydrophobicContact CB-CZ 4.24Å; R784-S817 WeakPolarHBondContact CA-O 3.5Å; R784-H860 PolarHBondContact NH2-O 2.79Å
785	I	94.4	Very high	81.1	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.8	177.5	-58.5	165.9	0	0	0	108	V744 P746 L766 F805 L809 A816 S817 I818 K819	V744-I785 HydrophobicContact CB-CG1 4.09Å; V744-I785 HydrophobicContact CG2-CG1 4.49Å; V744-I785 WeakPolarHBondContact O-CA 3.01Å; P746-I785 HydrophobicContact CG-CG2 4.12Å; L766-I785 HydrophobicContact CD2-CD1 3.62Å; L766-I785 HydrophobicContact CD2-CG1 4.14Å; L766-I785 HydrophobicContact CD2-CG2 4.49Å; I785-F805 HydrophobicContact CD1-CE1 4.46Å; I785-F805 HydrophobicContact CG2-CE1 3.8Å; I785-F805 HydrophobicContact CG2-CZ 4.06Å; I785-L809 HydrophobicContact CD1-CD1 3.66Å; I785-L809 HydrophobicContact CD1-CD2 3.79Å; I785-L809 HydrophobicContact CD1-CG 4.4Å; I785-A816 HydrophobicContact CD1-CB 3.43Å; I785-A816 VanDerWaalsContact CD1-CB 3.43Å; I785-A816 HydrophobicContact CG1-CB 3.79Å; I785-S817 PolarHBondContact N-O 3.47Å; I785-I818 CarbonylContact O-C 3.45Å; I785-I818 WeakPolarHBondContact O-CA 3.22Å; I785-K819 PolarHBondContact O-N 2.83Å
786	F	92.4	Very high	80.1	Confident	7 Å²	7	70.3 Å²	70.3	3%	0.031	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.8	-177.4	-64	-93.4	0	0	0	110.7	D743 V744 W745 P746 R784 K819 V821 H860	D743-F786 HydrophobicContact CB-CD2 4.49Å; D743-F786 HydrophobicContact CB-CE2 3.78Å; D743-F786 VanDerWaalsContact CG-CE2 3.48Å; V744-F786 PolarHBondContact O-N 2.98Å; W745-F786 HydrophobicContact CD2-CB 3.67Å; W745-F786 HydrophobicContact CD2-CD2 4.22Å; W745-F786 HydrophobicContact CD2-CG 4.08Å; W745-F786 AromaticContact CE2-CD2 3.63Å; W745-F786 AromaticContact CE2-CG 3.6Å; W745-F786 HydrophobicContact CE3-CB 3.59Å; W745-F786 HydrophobicContact CE3-CG 4.36Å; W745-F786 HydrophobicContact CG-CB 4.42Å; W745-F786 HydrophobicContact CH2-CB 3.76Å; W745-F786 AromaticContact CH2-CD1 3.91Å; W745-F786 HydrophobicContact CH2-CD1 3.91Å; W745-F786 AromaticContact CH2-CG 3.86Å; W745-F786 HydrophobicContact CH2-CG 3.86Å; W745-F786 HydrophobicContact CZ2-CB 3.79Å; W745-F786 AromaticContact CZ2-CD1 3.68Å; W745-F786 HydrophobicContact CZ2-CD1 3.68Å; W745-F786 AromaticContact CZ2-CD2 3.88Å; W745-F786 HydrophobicContact CZ2-CD2 3.88Å; W745-F786 HydrophobicContact CZ2-CE1 4.21Å; W745-F786 HydrophobicContact CZ2-CE2 4.4Å; W745-F786 AromaticContact CZ2-CG 3.49Å; W745-F786 HydrophobicContact CZ2-CG 3.49Å; W745-F786 VanDerWaalsContact CZ2-CG 3.49Å; W745-F786 HydrophobicContact CZ3-CB 3.63Å; W745-F786 HydrophobicContact CZ3-CG 4.26Å; W745-F786 AromaticContact NE1-CD2 3.59Å; P746-F786 WeakPolarHBondContact CD-O 3.29Å; R784-F786 HydrophobicContact CB-CE2 3.94Å; R784-F786 HydrophobicContact CB-CZ 4.24Å; F786-K819 CarbonylContact C-O 3.51Å; F786-K819 VanDerWaalsContact CA-O 3.3Å; F786-K819 WeakPolarHBondContact CA-O 3.44Å; F786-K819 HydrophobicContact CD1-CB 3.51Å; F786-K819 HydrophobicContact CD1-CG 4.29Å; F786-K819 HydrophobicContact CE1-CB 3.65Å; F786-K819 HydrophobicContact CE1-CG 3.95Å; F786-K819 HydrophobicContact CG-CB 4.24Å; F786-K819 HydrophobicContact CZ-CB 4.46Å; F786-K819 HydrophobicContact CZ-CG 4.4Å; F786-V821 HydrophobicContact CB-CG2 4.32Å; F786-V821 HydrophobicContact CD1-CG2 3.76Å; F786-H860 HydrophobicContact CD1-CB 4.45Å; F786-H860 HydrophobicContact CE1-CB 3.92Å
787	L	89	Confident	79.5	Confident	7 Å²	7	66.9 Å²	66.9	4%	0.037	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	115.3	175.5	-65	179	0	0	0	109	Y757 E802 F805 I818 K819 V821	Y757-L787 HydrophobicContact CD1-CD2 3.61Å; Y757-L787 HydrophobicContact CE1-CD2 3.38Å; Y757-L787 HydrophobicContact CE2-CD2 4.33Å; Y757-L787 HydrophobicContact CG-CD2 4.19Å; L787-E802 HydrophobicContact CD1-CG 4.23Å; L787-F805 HydrophobicContact CD1-CB 4.46Å; L787-F805 HydrophobicContact CD1-CD1 3.89Å; L787-F805 HydrophobicContact CD1-CG 4.39Å; L787-F805 HydrophobicContact CD2-CD1 3.88Å; L787-F805 HydrophobicContact CD2-CE1 3.92Å; L787-F805 HydrophobicContact CD2-CG 4.26Å; L787-F805 HydrophobicContact CD2-CZ 4.34Å; L787-F805 HydrophobicContact CG-CD1 4.32Å; L787-I818 HydrophobicContact CD1-CG2 3.5Å; L787-I818 HydrophobicContact CG-CG2 3.93Å; L787-K819 PolarHBondContact N-O 3.16Å; L787-V821 PolarHBondContact O-N 3.38Å
788	N	86.8	Confident	79.1	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.011	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	126.6	174.3	-64.5	78.6	0	0	0	110.5	Y757 V821 W823 M856	Y757-N788 PolarHBondContact OH-N 3Å; Y757-N788 VanDerWaalsContact OH-N 3.15Å; Y757-N788 PolarHBondContact OH-O 3.23Å; N788-V821 WeakPolarHBondContact CA-O 3.34Å; N788-W823 HydrophobicContact CB-CD2 3.74Å; N788-W823 HydrophobicContact CB-CE3 4.14Å; N788-W823 HydrophobicContact CB-CG 4.01Å; N788-W823 HydrophobicContact CB-CZ2 4.29Å; N788-M856 WeakPolarHBondContact ND2-CE 3.42Å
789	V	83.5	Confident	78.8	Confident	14 Å²	14	67.6 Å²	67.6	9%	0.085	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	137.8	-176.4	170.7	0	0	0	0	110.3	W798 I820 V821 P822 W823	V789-W798 HydrophobicContact CB-CB 4.29Å; V789-W798 HydrophobicContact CG1-CB 3.32Å; V789-W798 HydrophobicContact CG1-CD2 3.71Å; V789-W798 HydrophobicContact CG1-CE3 4.25Å; V789-W798 HydrophobicContact CG1-CG 3.3Å; V789-W798 HydrophobicContact CG2-CB 4.01Å; V789-W798 HydrophobicContact CG2-CD2 4.47Å; V789-W798 HydrophobicContact CG2-CE3 4.23Å; V789-W798 HydrophobicContact CG2-CG 4.44Å; V789-I820 HydrophobicContact CB-CG2 4.18Å; V789-I820 HydrophobicContact CG2-CG2 3.77Å; V789-V821 PolarHBondContact N-O 3.41Å; V789-P822 WeakPolarHBondContact O-CA 3.41Å; V789-W823 VanDerWaalsContact O-CD1 3.31Å; V789-W823 PolarHBondContact O-N 3.1Å; V789-W823 VanDerWaalsContact O-N 3.13Å
790	E	77.3	Confident	78.5	Confident	61 Å²	61	63 Å²	63	29%	0.285	36%	0.355	S	S	.	.			trans	-92.5	117.3	169.2	-67.1	173.5	-162	0	0	109.4	Q755 D824 V827	Q755-E790 VanDerWaalsContact NE2-CD 3.33Å; Q755-E790 PolarHBondContact NE2-OE1 3.29Å; Q755-E790 VanDerWaalsContact NE2-OE1 3.13Å; E790-D824 WeakPolarHBondContact CA-OD1 3.48Å; E790-V827 HydrophobicContact CG-CG2 4.47Å
791	T	70.4	Confident	78.2	Confident	86 Å²	86	58.5 Å²	58.5	53%	0.528	34%	0.337	S	S	.	.			trans	-88.6	-8.7	-179.9	65.4	0	0	0	0	113.2	S793 P822 D824	T791-S793 PolarHBondContact O-N 2.91Å; T791-P822 HydrophobicContact CG2-CB 3.98Å; T791-D824 VanDerWaalsContact CB-OD2 3.32Å; T791-D824 WeakPolarHBondContact CB-OD2 3.45Å; T791-D824 PolarHBondContact N-OD1 3.41Å; T791-D824 PolarHBondContact N-OD2 2.72Å; T791-D824 VanDerWaalsContact OG1-CG 3.31Å; T791-D824 PolarHBondContact OG1-OD2 3.38Å
792	G	60.9	Low	78.1	Confident	72 Å²	72	59.4 Å²	59.4	74%	0.742	34%	0.339	S	S	*	.			trans	-74.8	-12.8	-176.5	0	0	0	0	0	116.4	D824	G792-D824 PolarHBondContact N-OD1 2.69Å
793	S	59.1	Low	77.9	Confident	72 Å²	72	59.3 Å²	59.3	50%	0.503	34%	0.344	S	S	.	.	S	Bend	trans	-86.2	130.5	173.6	62.4	0	0	0	0	109.9	T791 D795	T791-S793 PolarHBondContact O-N 2.91Å; S793-D795 PolarHBondContact O-N 3.29Å
794	S	53.4	Low	77.5	Confident	122 Å²	122	61.4 Å²	61.4	85%	0.853	36%	0.359	S	S	*	.	S	Bend	trans	-64.2	-10.5	-176.9	48.5	0	0	0	0	114.5
795	D	57.8	Low	77.1	Confident	126 Å²	126	59.6 Å²	59.6	67%	0.674	35%	0.353	S	S	*	.	S	Bend	trans	-94.1	130	176.8	-72.2	-19.1	0	0	0	110.1	S793 G797	S793-D795 PolarHBondContact O-N 3.29Å; D795-G797 PolarHBondContact O-N 3.42Å
796	Q	66.3	Low	76.9	Confident	155 Å²	155	64.7 Å²	64.7	72%	0.724	37%	0.372	S	S	*	.			trans	-67.7	31.4	173.7	-65.1	179.6	-9.7	0	0	113.4	W798 V799	Q796-W798 PolarHBondContact O-N 3.03Å; Q796-W798 VanDerWaalsContact O-N 3.1Å; Q796-V799 HydrophobicContact CB-CG2 4.26Å; Q796-V799 WeakPolarHBondContact O-CB 3.32Å; Q796-V799 PolarHBondContact O-N 3.44Å
797	G	70.8	Confident	76.7	Confident	34 Å²	34	68.8 Å²	68.8	35%	0.351	39%	0.391	S	S	.	.	H	α-helix	trans	-59.3	-25.2	-174.6	0	0	0	0	0	113.9	D795 V799 V800 N801	D795-G797 PolarHBondContact O-N 3.42Å; G797-V799 VanDerWaalsContact C-N 3.27Å; G797-V799 PolarHBondContact O-N 2.93Å; G797-V800 PolarHBondContact O-N 3.28Å; G797-N801 PolarHBondContact O-N 3.19Å
798	W	74.5	Confident	76.7	Confident	83 Å²	83	69.4 Å²	69.4	31%	0.314	39%	0.394	S	S	.	.	H	α-helix	trans	-65.8	-26.7	176.3	68.8	-97.9	0	0	0	113.9	V789 Q796 V800 N801 E802 I820	V789-W798 HydrophobicContact CB-CB 4.29Å; V789-W798 HydrophobicContact CG1-CB 3.32Å; V789-W798 HydrophobicContact CG1-CD2 3.71Å; V789-W798 HydrophobicContact CG1-CE3 4.25Å; V789-W798 HydrophobicContact CG1-CG 3.3Å; V789-W798 HydrophobicContact CG2-CB 4.01Å; V789-W798 HydrophobicContact CG2-CD2 4.47Å; V789-W798 HydrophobicContact CG2-CE3 4.23Å; V789-W798 HydrophobicContact CG2-CG 4.44Å; Q796-W798 PolarHBondContact O-N 3.03Å; Q796-W798 VanDerWaalsContact O-N 3.1Å; W798-V800 VanDerWaalsContact C-N 3.35Å; W798-N801 PolarHBondContact O-N 3.34Å; W798-E802 PolarHBondContact O-N 3.47Å; W798-I820 HydrophobicContact CH2-CD1 4.45Å; W798-I820 HydrophobicContact CZ3-CD1 3.82Å; W798-I820 HydrophobicContact CZ3-CG1 4.46Å; W798-I820 HydrophobicContact CZ3-CG2 4.28Å
799	V	80.8	Confident	76.8	Confident	43 Å²	43	69.6 Å²	69.6	26%	0.261	40%	0.395	S	S	.	.	H	α-helix	trans	-66.8	-40.4	176.2	-179.3	0	0	0	0	110.1	Q796 G797 N801 E802 E803	Q796-V799 HydrophobicContact CB-CG2 4.26Å; Q796-V799 WeakPolarHBondContact O-CB 3.32Å; Q796-V799 PolarHBondContact O-N 3.44Å; G797-V799 VanDerWaalsContact C-N 3.27Å; G797-V799 PolarHBondContact O-N 2.93Å; V799-N801 VanDerWaalsContact C-N 3.33Å; V799-E802 PolarHBondContact O-N 3.47Å; V799-E803 WeakPolarHBondContact O-CG 3.5Å; V799-E803 PolarHBondContact O-N 3.26Å
800	V	80.4	Confident	77.1	Confident	94 Å²	94	76.9 Å²	76.9	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-65.1	-39.3	175.2	-177.3	0	0	0	0	110.8	G797 W798 E803 S804	G797-V800 PolarHBondContact O-N 3.28Å; W798-V800 VanDerWaalsContact C-N 3.35Å; V800-E803 PolarHBondContact O-N 3.48Å; V800-S804 WeakPolarHBondContact O-CB 3.41Å; V800-S804 PolarHBondContact O-N 2.92Å; V800-S804 PolarHBondContact O-OG 3.04Å
801	N	78.8	Confident	77.6	Confident	73 Å²	73	78.8 Å²	78.8	39%	0.39	43%	0.429	S	S	.	.	H	α-helix	trans	-65.9	-37.4	175	-68.2	-10.4	0	0	0	112	G797 W798 V799 S804 F805	G797-N801 PolarHBondContact O-N 3.19Å; W798-N801 PolarHBondContact O-N 3.34Å; V799-N801 VanDerWaalsContact C-N 3.33Å; N801-S804 WeakPolarHBondContact CA-OG 3.38Å; N801-S804 PolarHBondContact O-OG 2.89Å; N801-F805 VanDerWaalsContact O-CB 3.25Å; N801-F805 WeakPolarHBondContact O-CB 3.41Å; N801-F805 PolarHBondContact O-N 3.08Å
802	E	85.1	Confident	78.3	Confident	26 Å²	26	76.9 Å²	76.9	12%	0.121	42%	0.415	C	S	.	.	H	α-helix	trans	-66	-46.1	173.8	-170.2	-160.4	157.3	0	0	111.8	L787 W798 V799 F805 R806 I818 I820	L787-E802 HydrophobicContact CD1-CG 4.23Å; W798-E802 PolarHBondContact O-N 3.47Å; V799-E802 PolarHBondContact O-N 3.47Å; E802-F805 PolarHBondContact O-N 3.42Å; E802-R806 VanDerWaalsContact O-CB 3.29Å; E802-R806 WeakPolarHBondContact O-CB 3.4Å; E802-R806 PolarHBondContact O-N 3.19Å; E802-R806 IonicContact OE1-CZ 3.96Å; E802-R806 IonicContact OE1-NH1 2.71Å; E802-R806 PolarHBondContact OE1-NH1 3.09Å; E802-R806 IonicContact OE1-NH2 3.21Å; E802-R806 PolarHBondContact OE1-NH2 3.07Å; E802-I818 HydrophobicContact CG-CG2 4.4Å; E802-I820 WeakPolarHBondContact OE2-CD1 3.29Å
803	E	85.9	Confident	79.7	Confident	123 Å²	123	84 Å²	84	58%	0.575	42%	0.419	S	S	*	.	H	α-helix	trans	-63.3	-46.4	179.8	-75.6	-173.3	172	0	0	111.9	V799 V800 F805 R806 E807	V799-E803 WeakPolarHBondContact O-CG 3.5Å; V799-E803 PolarHBondContact O-N 3.26Å; V800-E803 PolarHBondContact O-N 3.48Å; E803-F805 VanDerWaalsContact C-N 3.35Å; E803-F805 PolarHBondContact O-N 3.45Å; E803-R806 PolarHBondContact O-N 3.43Å; E803-E807 WeakPolarHBondContact O-CB 3.49Å; E803-E807 PolarHBondContact O-N 2.86Å
804	S	85.1	Confident	81.1	Confident	48 Å²	48	81.4 Å²	81.4	34%	0.336	40%	0.4	S	S	.	.	H	α-helix	trans	-62.1	-41.1	176.1	59.3	0	0	0	0	111.8	V800 N801 E807 L808	V800-S804 WeakPolarHBondContact O-CB 3.41Å; V800-S804 PolarHBondContact O-N 2.92Å; V800-S804 PolarHBondContact O-OG 3.04Å; N801-S804 WeakPolarHBondContact CA-OG 3.38Å; N801-S804 PolarHBondContact O-OG 2.89Å; S804-E807 PolarHBondContact O-N 3.42Å; S804-L808 PolarHBondContact O-N 3.26Å
805	F	86.8	Confident	82.7	Confident	4 Å²	4	86.5 Å²	86.5	2%	0.018	40%	0.4	C	S	.	.	H	α-helix	trans	-67.7	-38.9	175.1	-170.6	-104	0	0	0	112.4	L766 I785 L787 N801 E802 E803 E807 L808 L809 I818	L766-F805 HydrophobicContact CD1-CE2 4.2Å; L766-F805 HydrophobicContact CD1-CZ 4.03Å; L766-F805 HydrophobicContact CD2-CZ 4.46Å; I785-F805 HydrophobicContact CD1-CE1 4.46Å; I785-F805 HydrophobicContact CG2-CE1 3.8Å; I785-F805 HydrophobicContact CG2-CZ 4.06Å; L787-F805 HydrophobicContact CD1-CB 4.46Å; L787-F805 HydrophobicContact CD1-CD1 3.89Å; L787-F805 HydrophobicContact CD1-CG 4.39Å; L787-F805 HydrophobicContact CD2-CD1 3.88Å; L787-F805 HydrophobicContact CD2-CE1 3.92Å; L787-F805 HydrophobicContact CD2-CG 4.26Å; L787-F805 HydrophobicContact CD2-CZ 4.34Å; L787-F805 HydrophobicContact CG-CD1 4.32Å; N801-F805 VanDerWaalsContact O-CB 3.25Å; N801-F805 WeakPolarHBondContact O-CB 3.41Å; N801-F805 PolarHBondContact O-N 3.08Å; E802-F805 PolarHBondContact O-N 3.42Å; E803-F805 VanDerWaalsContact C-N 3.35Å; E803-F805 PolarHBondContact O-N 3.45Å; F805-E807 VanDerWaalsContact C-N 3.3Å; F805-E807 PolarHBondContact O-N 3.28Å; F805-L808 HydrophobicContact CD2-CD2 4.12Å; F805-L808 HydrophobicContact CE2-CD2 4.26Å; F805-L808 WeakPolarHBondContact O-CB 3.41Å; F805-L808 PolarHBondContact O-N 3.11Å; F805-L809 HydrophobicContact CD1-CD1 4.02Å; F805-L809 HydrophobicContact CD1-CG 4.25Å; F805-L809 HydrophobicContact CE1-CD1 3.71Å; F805-L809 HydrophobicContact CE1-CD2 4.23Å; F805-L809 HydrophobicContact CE1-CG 3.99Å; F805-L809 HydrophobicContact CZ-CD2 4.22Å; F805-L809 HydrophobicContact CZ-CG 4.4Å; F805-L809 WeakPolarHBondContact O-CG 3.43Å; F805-L809 PolarHBondContact O-N 3.48Å; F805-I818 HydrophobicContact CD1-CD1 4.3Å
806	R	89.9	Confident	84.3	Confident	107 Å²	107	81.9 Å²	81.9	40%	0.404	38%	0.38	S	S	.	.	H	α-helix	trans	-63.3	-38.2	173.7	-178.1	175.1	-80.4	134.7	5.2	111.1	E802 E803 R810 I818	E802-R806 VanDerWaalsContact O-CB 3.29Å; E802-R806 WeakPolarHBondContact O-CB 3.4Å; E802-R806 PolarHBondContact O-N 3.19Å; E802-R806 IonicContact OE1-CZ 3.96Å; E802-R806 IonicContact OE1-NH1 2.71Å; E802-R806 PolarHBondContact OE1-NH1 3.09Å; E802-R806 IonicContact OE1-NH2 3.21Å; E802-R806 PolarHBondContact OE1-NH2 3.07Å; E803-R806 PolarHBondContact O-N 3.43Å; R806-R810 WeakPolarHBondContact O-CB 3.19Å; R806-R810 PolarHBondContact O-N 3.02Å; R806-I818 HydrophobicContact CB-CD1 3.78Å; R806-I818 HydrophobicContact CG-CD1 4.2Å
807	E	89.1	Confident	85.5	Confident	93 Å²	93	75.7 Å²	75.7	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-65.2	-44.1	173.3	-167	179.5	163.6	0	0	111.4	E803 S804 F805 L809 R810 K811	E803-E807 WeakPolarHBondContact O-CB 3.49Å; E803-E807 PolarHBondContact O-N 2.86Å; S804-E807 PolarHBondContact O-N 3.42Å; F805-E807 VanDerWaalsContact C-N 3.3Å; F805-E807 PolarHBondContact O-N 3.28Å; E807-L809 PolarHBondContact O-N 2.92Å; E807-R810 CarbonylContact O-C 3.43Å; E807-R810 WeakPolarHBondContact O-CA 3.49Å; E807-R810 WeakPolarHBondContact O-CB 3.5Å; E807-R810 PolarHBondContact O-N 3.1Å; E807-R810 VanDerWaalsContact O-N 3.09Å; E807-K811 WeakPolarHBondContact O-CG 3.34Å; E807-K811 PolarHBondContact O-N 3.34Å; E807-K811 VanDerWaalsContact OE1-CE 3.31Å; E807-K811 WeakPolarHBondContact OE1-CE 3.38Å; E807-K811 IonicContact OE1-NZ 3.76Å
808	L	87.8	Confident	86.5	Confident	19 Å²	19	75.4 Å²	75.4	10%	0.099	34%	0.344	C	S	.	.	H	α-helix	trans	-55.7	-49.4	173.9	178.4	68.8	0	0	0	111.5	Q758 L763 S804 F805 R810 K811 L812 L912	Q758-L808 HydrophobicContact CG-CD2 4.26Å; L763-L808 HydrophobicContact CD2-CD2 4.2Å; S804-L808 PolarHBondContact O-N 3.26Å; F805-L808 HydrophobicContact CD2-CD2 4.12Å; F805-L808 HydrophobicContact CE2-CD2 4.26Å; F805-L808 WeakPolarHBondContact O-CB 3.41Å; F805-L808 PolarHBondContact O-N 3.11Å; L808-R810 VanDerWaalsContact C-N 3.27Å; L808-R810 PolarHBondContact O-N 2.95Å; L808-K811 PolarHBondContact O-N 2.95Å; L808-L812 HydrophobicContact CD1-CD1 4.12Å; L808-L812 HydrophobicContact CD1-CG 4.33Å; L808-L812 HydrophobicContact CG-CD1 4.04Å; L808-L812 WeakPolarHBondContact O-CB 3.29Å; L808-L812 WeakPolarHBondContact O-CG 3.24Å; L808-L812 PolarHBondContact O-N 3.48Å; L808-L912 HydrophobicContact CD1-CD1 4.33Å
809	L	89.6	Confident	87.3	Confident	7 Å²	7	76.1 Å²	76.1	4%	0.037	35%	0.349	C	S	.	.	H	α-helix	trans	-60.5	-37.1	176.7	-66.9	178.9	0	0	0	112.1	L766 I785 F805 E807 L812 R813 I814 I818	L766-L809 HydrophobicContact CD1-CD2 4.43Å; L766-L809 HydrophobicContact CD2-CD2 4.36Å; I785-L809 HydrophobicContact CD1-CD1 3.66Å; I785-L809 HydrophobicContact CD1-CD2 3.79Å; I785-L809 HydrophobicContact CD1-CG 4.4Å; F805-L809 HydrophobicContact CD1-CD1 4.02Å; F805-L809 HydrophobicContact CD1-CG 4.25Å; F805-L809 HydrophobicContact CE1-CD1 3.71Å; F805-L809 HydrophobicContact CE1-CD2 4.23Å; F805-L809 HydrophobicContact CE1-CG 3.99Å; F805-L809 HydrophobicContact CZ-CD2 4.22Å; F805-L809 HydrophobicContact CZ-CG 4.4Å; F805-L809 WeakPolarHBondContact O-CG 3.43Å; F805-L809 PolarHBondContact O-N 3.48Å; E807-L809 PolarHBondContact O-N 2.92Å; L809-L812 CarbonylContact O-C 3.6Å; L809-L812 PolarHBondContact O-N 2.76Å; L809-R813 PolarHBondContact O-N 3.3Å; L809-I814 HydrophobicContact CD2-CB 4.02Å; L809-I814 HydrophobicContact CD2-CD1 4.1Å; L809-I814 HydrophobicContact CD2-CG2 4.14Å; L809-I814 PolarHBondContact O-N 3.45Å; L809-I818 HydrophobicContact CD1-CD1 4.04Å; L809-I818 HydrophobicContact CD1-CG1 4.05Å
810	R	89.7	Confident	87.6	Confident	166 Å²	166	77.6 Å²	77.6	63%	0.626	35%	0.354	S	S	*	.	H	α-helix	trans	-65	-45.6	175	-168.5	-169.8	-63.1	127.8	-2.5	111.2	R806 E807 L808 L812 R813	R806-R810 WeakPolarHBondContact O-CB 3.19Å; R806-R810 PolarHBondContact O-N 3.02Å; E807-R810 CarbonylContact O-C 3.43Å; E807-R810 WeakPolarHBondContact O-CA 3.49Å; E807-R810 WeakPolarHBondContact O-CB 3.5Å; E807-R810 PolarHBondContact O-N 3.1Å; E807-R810 VanDerWaalsContact O-N 3.09Å; L808-R810 VanDerWaalsContact C-N 3.27Å; L808-R810 PolarHBondContact O-N 2.95Å; R810-L812 VanDerWaalsContact C-N 3.32Å; R810-L812 PolarHBondContact O-N 3.45Å; R810-R813 PolarHBondContact O-N 3.28Å; R810-R813 VanDerWaalsContact O-N 3.08Å
811	K	87.9	Confident	88	Confident	101 Å²	101	73.2 Å²	73.2	44%	0.439	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-41.1	175.8	-67.8	-173.1	-170.9	174.6	0	111	E807 L808 R813 L912	E807-K811 WeakPolarHBondContact O-CG 3.34Å; E807-K811 PolarHBondContact O-N 3.34Å; E807-K811 VanDerWaalsContact OE1-CE 3.31Å; E807-K811 WeakPolarHBondContact OE1-CE 3.38Å; E807-K811 IonicContact OE1-NZ 3.76Å; L808-K811 PolarHBondContact O-N 2.95Å; K811-R813 VanDerWaalsContact C-N 3.27Å; K811-R813 PolarHBondContact O-N 3.04Å; K811-L912 HydrophobicContact CB-CD2 4.33Å; K811-L912 HydrophobicContact CD-CD2 3.3Å; K811-L912 HydrophobicContact CG-CD2 4.39Å; K811-L912 PolarHBondContact NZ-OXT 3.04Å
812	L	85.5	Confident	88.4	Confident	46 Å²	46	73.6 Å²	73.6	24%	0.241	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-6.2	176	-63.6	178.3	0	0	0	114	L763 L808 L809 R810 I814 T908 L912	L763-L812 HydrophobicContact CD2-CD1 4.21Å; L808-L812 HydrophobicContact CD1-CD1 4.12Å; L808-L812 HydrophobicContact CD1-CG 4.33Å; L808-L812 HydrophobicContact CG-CD1 4.04Å; L808-L812 WeakPolarHBondContact O-CB 3.29Å; L808-L812 WeakPolarHBondContact O-CG 3.24Å; L808-L812 PolarHBondContact O-N 3.48Å; L809-L812 CarbonylContact O-C 3.6Å; L809-L812 PolarHBondContact O-N 2.76Å; R810-L812 VanDerWaalsContact C-N 3.32Å; R810-L812 PolarHBondContact O-N 3.45Å; L812-I814 HydrophobicContact CB-CD1 3.91Å; L812-I814 HydrophobicContact CB-CG1 3.94Å; L812-I814 HydrophobicContact CD1-CD1 4.09Å; L812-I814 PolarHBondContact O-N 2.98Å; L812-T908 HydrophobicContact CD1-CG2 4.4Å; L812-T908 HydrophobicContact CD2-CG2 3.69Å; L812-L912 HydrophobicContact CD2-CD1 4.34Å
813	R	88.8	Confident	88.4	Confident	221 Å²	221	72.3 Å²	72.3	83%	0.834	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	31.3	-177.1	-54.6	179.5	175.2	-176.7	-2.4	113.9	L809 R810 K811	L809-R813 PolarHBondContact O-N 3.3Å; R810-R813 PolarHBondContact O-N 3.28Å; R810-R813 VanDerWaalsContact O-N 3.08Å; K811-R813 VanDerWaalsContact C-N 3.27Å; K811-R813 PolarHBondContact O-N 3.04Å
814	I	88.9	Confident	88.3	Confident	18 Å²	18	68 Å²	68	9%	0.092	31%	0.309	C	S	.	.			trans	-86.2	118	177.1	-60.9	174.4	0	0	0	108.7	L766 M783 L809 L812 A816	L766-I814 HydrophobicContact CB-CD1 4.34Å; M783-I814 HydrophobicContact SD-CG2 4.03Å; L809-I814 HydrophobicContact CD2-CB 4.02Å; L809-I814 HydrophobicContact CD2-CD1 4.1Å; L809-I814 HydrophobicContact CD2-CG2 4.14Å; L809-I814 PolarHBondContact O-N 3.45Å; L812-I814 HydrophobicContact CB-CD1 3.91Å; L812-I814 HydrophobicContact CB-CG1 3.94Å; L812-I814 HydrophobicContact CD1-CD1 4.09Å; L812-I814 PolarHBondContact O-N 2.98Å; I814-A816 HydrophobicContact CG2-CB 4.29Å; I814-A816 PolarHBondContact O-N 3.34Å
815	R	88.1	Confident	88	Confident	230 Å²	230	69.1 Å²	69.1	87%	0.868	32%	0.317	S	S	*	.			trans	-90.6	99.4	175.4	-64.8	-177.9	-176.7	-177.6	-0.7	109.5
816	A	90.7	Very high	87.8	Confident	29 Å²	29	69.2 Å²	69.2	24%	0.24	32%	0.318	C	S	.	.			trans	-141.9	151.3	177.4	0	0	0	0	0	110.9	M783 I785 I814	M783-A816 HydrophobicContact CB-CB 4.01Å; M783-A816 HydrophobicContact CG-CB 3.78Å; M783-A816 WeakPolarHBondContact O-CA 3.32Å; M783-A816 HydrophobicContact SD-CB 3.97Å; I785-A816 HydrophobicContact CD1-CB 3.43Å; I785-A816 VanDerWaalsContact CD1-CB 3.43Å; I785-A816 HydrophobicContact CG1-CB 3.79Å; I814-A816 HydrophobicContact CG2-CB 4.29Å; I814-A816 PolarHBondContact O-N 3.34Å
817	S	90.9	Very high	87.4	Confident	25 Å²	25	65.6 Å²	65.6	18%	0.175	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	124.7	169.7	57.8	0	0	0	0	110.1	M783 R784 I785	M783-S817 PolarHBondContact O-N 3.29Å; M783-S817 PolarHBondContact O-OG 3.15Å; R784-S817 WeakPolarHBondContact CA-O 3.5Å; I785-S817 PolarHBondContact N-O 3.47Å
818	I	91.6	Very high	86.8	Confident	28 Å²	28	67.9 Å²	67.9	14%	0.144	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	134.6	175.2	-56.9	173.6	0	0	0	108.7	I785 L787 E802 F805 R806 L809	I785-I818 CarbonylContact O-C 3.45Å; I785-I818 WeakPolarHBondContact O-CA 3.22Å; L787-I818 HydrophobicContact CD1-CG2 3.5Å; L787-I818 HydrophobicContact CG-CG2 3.93Å; E802-I818 HydrophobicContact CG-CG2 4.4Å; F805-I818 HydrophobicContact CD1-CD1 4.3Å; R806-I818 HydrophobicContact CB-CD1 3.78Å; R806-I818 HydrophobicContact CG-CD1 4.2Å; L809-I818 HydrophobicContact CD1-CD1 4.04Å; L809-I818 HydrophobicContact CD1-CG1 4.05Å
819	K	91.3	Very high	86.2	Confident	98 Å²	98	71.1 Å²	71.1	43%	0.426	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	119.5	175.7	-69.9	-64.4	-172.9	175.8	0	108.7	I785 F786 L787	I785-K819 PolarHBondContact O-N 2.83Å; F786-K819 CarbonylContact C-O 3.51Å; F786-K819 VanDerWaalsContact CA-O 3.3Å; F786-K819 WeakPolarHBondContact CA-O 3.44Å; F786-K819 HydrophobicContact CD1-CB 3.51Å; F786-K819 HydrophobicContact CD1-CG 4.29Å; F786-K819 HydrophobicContact CE1-CB 3.65Å; F786-K819 HydrophobicContact CE1-CG 3.95Å; F786-K819 HydrophobicContact CG-CB 4.24Å; F786-K819 HydrophobicContact CZ-CB 4.46Å; F786-K819 HydrophobicContact CZ-CG 4.4Å; L787-K819 PolarHBondContact N-O 3.16Å
820	I	88.3	Confident	85.4	Confident	73 Å²	73	75.9 Å²	75.9	37%	0.374	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	133.2	178.8	-57.3	149.4	0	0	0	108	V789 W798 E802	V789-I820 HydrophobicContact CB-CG2 4.18Å; V789-I820 HydrophobicContact CG2-CG2 3.77Å; W798-I820 HydrophobicContact CH2-CD1 4.45Å; W798-I820 HydrophobicContact CZ3-CD1 3.82Å; W798-I820 HydrophobicContact CZ3-CG1 4.46Å; W798-I820 HydrophobicContact CZ3-CG2 4.28Å; E802-I820 WeakPolarHBondContact OE2-CD1 3.29Å
821	V	88.7	Confident	84	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.012	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	105.8	-177.1	-178.8	0	0	0	0	108.3	W745 F786 L787 N788 V789 W823 M856 H860	W745-V821 HydrophobicContact CH2-CG1 4.42Å; W745-V821 HydrophobicContact CH2-CG2 3.96Å; W745-V821 HydrophobicContact CZ3-CG2 4.28Å; F786-V821 HydrophobicContact CB-CG2 4.32Å; F786-V821 HydrophobicContact CD1-CG2 3.76Å; L787-V821 PolarHBondContact O-N 3.38Å; N788-V821 WeakPolarHBondContact CA-O 3.34Å; V789-V821 PolarHBondContact N-O 3.41Å; V821-W823 PolarHBondContact O-N 3.03Å; V821-M856 HydrophobicContact CG1-CG 3.89Å; V821-M856 HydrophobicContact CG1-SD 4.04Å; V821-H860 VanDerWaalsContact CG2-CD2 3.43Å; V821-H860 WeakPolarHBondContact CG2-CD2 3.27Å
822	P	86.3	Confident	82.4	Confident	81 Å²	81	72.9 Å²	72.9	53%	0.526	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	127.1	171.4	28.9	-31.6	0	0	0	108.7	V789 T791	V789-P822 WeakPolarHBondContact O-CA 3.41Å; T791-P822 HydrophobicContact CG2-CB 3.98Å
823	W	86.3	Confident	80.3	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	39%	0.387	C	S	.	.			trans	-126.4	17.4	-175.8	78.2	-24.3	0	0	0	114.1	L747 L749 P752 N788 V789 V821 S825 V826 V827 M856	L747-W823 HydrophobicContact CD2-CH2 3.5Å; L747-W823 VanDerWaalsContact CD2-CH2 3.5Å; L747-W823 HydrophobicContact CD2-CZ2 4.08Å; L747-W823 HydrophobicContact CD2-CZ3 4.2Å; L749-W823 HydrophobicContact CB-CZ3 4.41Å; L749-W823 HydrophobicContact CD2-CE3 4.19Å; L749-W823 HydrophobicContact CD2-CH2 4.46Å; L749-W823 HydrophobicContact CD2-CZ3 3.7Å; P752-W823 HydrophobicContact CB-CH2 3.84Å; P752-W823 HydrophobicContact CB-CZ2 3.87Å; N788-W823 HydrophobicContact CB-CD2 3.74Å; N788-W823 HydrophobicContact CB-CE3 4.14Å; N788-W823 HydrophobicContact CB-CG 4.01Å; N788-W823 HydrophobicContact CB-CZ2 4.29Å; V789-W823 VanDerWaalsContact O-CD1 3.31Å; V789-W823 PolarHBondContact O-N 3.1Å; V789-W823 VanDerWaalsContact O-N 3.13Å; V821-W823 PolarHBondContact O-N 3.03Å; W823-S825 PolarHBondContact O-N 3.36Å; W823-V826 HydrophobicContact CB-CB 4.38Å; W823-V826 HydrophobicContact CB-CG2 4.38Å; W823-V826 WeakPolarHBondContact O-CA 3.33Å; W823-V826 VanDerWaalsContact O-CB 3.31Å; W823-V826 WeakPolarHBondContact O-CB 3.48Å; W823-V826 PolarHBondContact O-N 3.36Å; W823-V827 HydrophobicContact CD2-CG2 3.92Å; W823-V827 HydrophobicContact CG-CG2 4.09Å; W823-V827 HydrophobicContact CZ2-CG2 4.17Å; W823-V827 PolarHBondContact O-N 2.88Å; W823-M856 HydrophobicContact CB-CE 4.13Å; W823-M856 HydrophobicContact CE3-CE 3.82Å
824	D	82.4	Confident	77.9	Confident	32 Å²	32	75.8 Å²	75.8	17%	0.171	39%	0.394	C	S	.	.	H	α-helix	trans	-54.4	-38.7	179.3	-57	-79.6	0	0	0	112.6	E790 T791 G792 V826 V827 Q828	E790-D824 WeakPolarHBondContact CA-OD1 3.48Å; T791-D824 VanDerWaalsContact CB-OD2 3.32Å; T791-D824 WeakPolarHBondContact CB-OD2 3.45Å; T791-D824 PolarHBondContact N-OD1 3.41Å; T791-D824 PolarHBondContact N-OD2 2.72Å; T791-D824 VanDerWaalsContact OG1-CG 3.31Å; T791-D824 PolarHBondContact OG1-OD2 3.38Å; G792-D824 PolarHBondContact N-OD1 2.69Å; D824-V826 PolarHBondContact O-N 3.02Å; D824-V827 PolarHBondContact O-N 3Å; D824-Q828 VanDerWaalsContact O-CG 3.32Å; D824-Q828 WeakPolarHBondContact O-CG 3.35Å; D824-Q828 PolarHBondContact O-N 2.91Å
825	S	79.9	Confident	75.5	Confident	71 Å²	71	78.3 Å²	78.3	50%	0.497	43%	0.425	S	S	.	.	H	α-helix	trans	-62.3	-28.7	175.6	57.1	0	0	0	0	113	W823 H829	W823-S825 PolarHBondContact O-N 3.36Å; S825-H829 PolarHBondContact O-CD2 3.09Å
826	V	82.6	Confident	73.1	Confident	6 Å²	6	75.9 Å²	75.9	4%	0.036	42%	0.423	C	S	.	.	H	α-helix	trans	-80.7	-43.1	176	-175	0	0	0	0	110	W823 D824 Q828 H829 F849 V853 M856	W823-V826 HydrophobicContact CB-CB 4.38Å; W823-V826 HydrophobicContact CB-CG2 4.38Å; W823-V826 WeakPolarHBondContact O-CA 3.33Å; W823-V826 VanDerWaalsContact O-CB 3.31Å; W823-V826 WeakPolarHBondContact O-CB 3.48Å; W823-V826 PolarHBondContact O-N 3.36Å; D824-V826 PolarHBondContact O-N 3.02Å; V826-Q828 VanDerWaalsContact C-N 3.28Å; V826-Q828 PolarHBondContact O-N 3.02Å; V826-H829 PolarHBondContact O-N 2.66Å; V826-H829 VanDerWaalsContact O-N 3.16Å; V826-F849 HydrophobicContact CG1-CD2 4.14Å; V826-F849 HydrophobicContact CG1-CE2 3.87Å; V826-F849 VanDerWaalsContact O-CD2 3.3Å; V826-F849 WeakPolarHBondContact O-CD2 3.46Å; V826-V853 HydrophobicContact CG1-CB 4.42Å; V826-V853 HydrophobicContact CG1-CG2 3.49Å; V826-V853 VanDerWaalsContact CG1-CG2 3.49Å; V826-M856 HydrophobicContact CG2-CB 4.44Å; V826-M856 HydrophobicContact CG2-CE 4.17Å
827	V	80.8	Confident	70.5	Confident	31 Å²	31	86.9 Å²	86.9	19%	0.188	46%	0.459	C	S	.	.	H	α-helix	trans	-64.6	-31.4	178.8	-179.6	0	0	0	0	111.9	P752 E790 W823 D824 H829 Y830 A831	P752-V827 HydrophobicContact CB-CG1 4.31Å; P752-V827 HydrophobicContact CB-CG2 3.97Å; E790-V827 HydrophobicContact CG-CG2 4.47Å; W823-V827 HydrophobicContact CD2-CG2 3.92Å; W823-V827 HydrophobicContact CG-CG2 4.09Å; W823-V827 HydrophobicContact CZ2-CG2 4.17Å; W823-V827 PolarHBondContact O-N 2.88Å; D824-V827 PolarHBondContact O-N 3Å; V827-H829 PolarHBondContact O-N 3.05Å; V827-Y830 WeakPolarHBondContact O-CA 3.32Å; V827-Y830 WeakPolarHBondContact O-CB 3.5Å; V827-Y830 PolarHBondContact O-N 3.46Å; V827-A831 PolarHBondContact O-N 2.98Å
828	Q	77.6	Confident	67.6	Low	142 Å²	142	90.8 Å²	90.8	66%	0.664	49%	0.485	S	S	*	.	H	α-helix	trans	-57.6	-36.2	173.5	-78.1	173.1	4.9	0	0	113.1	D824 V826 Y830 A831	D824-Q828 VanDerWaalsContact O-CG 3.32Å; D824-Q828 WeakPolarHBondContact O-CG 3.35Å; D824-Q828 PolarHBondContact O-N 2.91Å; V826-Q828 VanDerWaalsContact C-N 3.28Å; V826-Q828 PolarHBondContact O-N 3.02Å; Q828-Y830 PolarHBondContact O-N 3.33Å; Q828-A831 PolarHBondContact O-N 3.17Å
829	H	75.6	Confident	65	Low	87 Å²	87	99 Å²	99	40%	0.403	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.1	176.4	-66.7	-64.7	0	0	0	113.5	S825 V826 V827 F849 S852	S825-H829 PolarHBondContact O-CD2 3.09Å; V826-H829 PolarHBondContact O-N 2.66Å; V826-H829 VanDerWaalsContact O-N 3.16Å; V827-H829 PolarHBondContact O-N 3.05Å; H829-F849 HydrophobicContact CB-CB 4.09Å; H829-F849 HydrophobicContact CB-CD2 4.38Å; H829-S852 PolarHBondContact CD2-OG 3.15Å; H829-S852 VanDerWaalsContact CD2-OG 3.28Å
830	Y	72.5	Confident	62.1	Low	106 Å²	106	102.5 Å²	102.5	42%	0.416	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-30.7	175.1	-173.9	-95.7	0	0	0	112.8	P752 V827 Q828 L832 L845 F849	P752-Y830 HydrophobicContact CG-CD1 3.54Å; P752-Y830 HydrophobicContact CG-CD2 3.6Å; P752-Y830 HydrophobicContact CG-CE1 3.81Å; P752-Y830 HydrophobicContact CG-CE2 3.85Å; P752-Y830 HydrophobicContact CG-CG 3.44Å; P752-Y830 VanDerWaalsContact CG-CG 3.44Å; V827-Y830 WeakPolarHBondContact O-CA 3.32Å; V827-Y830 WeakPolarHBondContact O-CB 3.5Å; V827-Y830 PolarHBondContact O-N 3.46Å; Q828-Y830 PolarHBondContact O-N 3.33Å; Y830-L832 PolarHBondContact O-N 3.36Å; Y830-L845 HydrophobicContact CD2-CD2 3.89Å; Y830-L845 HydrophobicContact CE2-CD2 3.48Å; Y830-L845 VanDerWaalsContact CE2-CD2 3.48Å; Y830-F849 HydrophobicContact CD2-CD1 4.48Å; Y830-F849 HydrophobicContact CD2-CD2 4.35Å; Y830-F849 HydrophobicContact CD2-CE1 4.21Å; Y830-F849 HydrophobicContact CD2-CE2 4.09Å; Y830-F849 HydrophobicContact CD2-CZ 4.02Å; Y830-F849 HydrophobicContact CG-CE2 4.38Å
831	A	59.6	Low	59.8	Low	74 Å²	74	104.5 Å²	104.5	61%	0.612	56%	0.558	S	S	*	*	S	Bend	trans	-69.1	114.3	-178.2	0	0	0	0	0	110.6	V827 Q828	V827-A831 PolarHBondContact O-N 2.98Å; Q828-A831 PolarHBondContact O-N 3.17Å
832	L	54.1	Low	57.5	Low	131 Å²	131	109.7 Å²	109.7	69%	0.686	59%	0.59	S	S	*	*			trans	-61.4	143.2	170.9	-72.8	163	0	0	0	109.7	Y830 E834 P843	Y830-L832 PolarHBondContact O-N 3.36Å; L832-E834 PolarHBondContact O-N 3.22Å; L832-P843 HydrophobicContact CD1-CG 4.22Å
833	P	42.4	Very low	55.7	Low	118 Å²	118	110.5 Å²	110.5	77%	0.766	60%	0.595	S	S	*	*			trans	-57.6	129.4	173.3	21.8	-29.7	0	0	0	109.9	G835	P833-G835 PolarHBondContact O-N 3.33Å
834	E	36.7	Very low	54.5	Low	209 Å²	209	112.8 Å²	112.8	98%	0.977	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	101.8	176.3	-68.5	-175.5	148.5	0	0	109.6	L832	L832-E834 PolarHBondContact O-N 3.22Å
835	G	39.9	Very low	54	Low	72 Å²	72	113 Å²	113	74%	0.742	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.4	-25.7	179.6	0	0	0	0	0	119.5	P833	P833-G835 PolarHBondContact O-N 3.33Å
836	E	36.6	Very low	54.1	Low	178 Å²	178	112.4 Å²	112.4	83%	0.832	62%	0.616	S	S	*	*			trans	-133.7	98.7	-175.8	-72.2	-175.7	166.6	0	0	112.4	C838	E836-C838 PolarHBondContact O-N 3.2Å
837	R	37.3	Very low	54	Low	261 Å²	261	118 Å²	118	99%	0.985	65%	0.645	S	S	*	*			trans	-82.2	95.5	157.6	-76.8	-177.1	179.5	177.9	0.5	107.7
838	C	29.7	Very low	54.2	Low	107 Å²	107	121.4 Å²	121.4	72%	0.723	66%	0.662	S	S	*	*			trans	-107.6	130.4	163.3	-77.7	0	0	0	0	109.7	E836 E840	E836-C838 PolarHBondContact O-N 3.2Å; C838-E840 PolarHBondContact O-N 2.92Å
839	E	36.5	Very low	54.7	Low	200 Å²	200	114.7 Å²	114.7	94%	0.935	63%	0.631	S	S	*	*			trans	-72.8	80.1	176.1	-67.9	-178.4	149	0	0	110.8
840	E	31.2	Very low	55.3	Low	172 Å²	172	110.7 Å²	110.7	80%	0.804	61%	0.613	S	S	*	*	S	Bend	trans	-143.3	149.7	161.4	-81.3	-157.5	170.4	0	0	110.9	C838 T842	C838-E840 PolarHBondContact O-N 2.92Å; E840-T842 PolarHBondContact O-N 2.76Å
841	P	38.9	Very low	56.1	Low	114 Å²	114	108.7 Å²	108.7	74%	0.74	61%	0.614	S	S	*	*	S	Bend	trans	-76.3	113.7	-166.3	29	-31.3	0	0	0	112.5
842	T	41.1	Very low	57.5	Low	111 Å²	111	105.6 Å²	105.6	68%	0.681	59%	0.588	S	S	*	*			trans	56.7	99.5	166.7	46.9	0	0	0	0	116.7	E840	E840-T842 PolarHBondContact O-N 2.76Å
843	P	49.1	Very low	59.2	Low	98 Å²	98	99.3 Å²	99.3	64%	0.636	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-65.2	137.9	165.9	27.7	-30.7	0	0	0	109.7	L832	L832-P843 HydrophobicContact CD1-CG 4.22Å
844	G	59.6	Low	61.6	Low	49 Å²	49	94.7 Å²	94.7	51%	0.505	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-59.3	147.4	176.5	0	0	0	0	0	112	S846	G844-S846 PolarHBondContact O-N 2.77Å
845	L	72.4	Confident	64.2	Low	37 Å²	37	92.6 Å²	92.6	19%	0.194	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-56.9	135.1	173.6	-64.7	168.8	0	0	0	110	L750 Y830 F849 L850	L750-L845 HydrophobicContact CB-CD1 4.1Å; L750-L845 HydrophobicContact CD1-CD1 4.45Å; L750-L845 HydrophobicContact CD2-CD1 4.26Å; Y830-L845 HydrophobicContact CD2-CD2 3.89Å; Y830-L845 HydrophobicContact CE2-CD2 3.48Å; Y830-L845 VanDerWaalsContact CE2-CD2 3.48Å; L845-F849 HydrophobicContact CB-CD1 4.48Å; L845-F849 HydrophobicContact CD2-CD1 4.26Å; L845-F849 HydrophobicContact CD2-CE1 4.27Å; L845-L850 HydrophobicContact CB-CD2 4.45Å; L845-L850 HydrophobicContact CD1-CD2 4.21Å
846	S	80.9	Confident	66.7	Low	58 Å²	58	89.8 Å²	89.8	41%	0.406	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-62.5	141.1	176.5	177.3	0	0	0	0	111.9	G844 D848 F849 L850	G844-S846 PolarHBondContact O-N 2.77Å; S846-D848 PolarHBondContact O-N 2.94Å; S846-D848 PolarHBondContact OG-N 2.73Å; S846-F849 WeakPolarHBondContact O-CB 3.36Å; S846-F849 PolarHBondContact O-N 2.94Å; S846-F849 VanDerWaalsContact O-N 3.09Å; S846-L850 PolarHBondContact O-N 3.49Å
847	D	81.6	Confident	69.4	Low	123 Å²	123	81.4 Å²	81.4	66%	0.658	44%	0.435	S	S	*	.	H	α-helix	trans	-61.3	-29.9	174.7	-74.9	-24.2	0	0	0	112.2	F849 L850 S851	D847-F849 VanDerWaalsContact C-N 3.3Å; D847-F849 PolarHBondContact O-N 3.35Å; D847-L850 PolarHBondContact O-N 3.09Å; D847-S851 WeakPolarHBondContact O-CB 3.45Å; D847-S851 PolarHBondContact O-N 3.01Å; D847-S851 PolarHBondContact O-OG 2.82Å
848	D	83.9	Confident	72	Confident	102 Å²	102	72 Å²	72	55%	0.545	40%	0.404	S	S	.	.	H	α-helix	trans	-65.9	-34.6	175.6	-69	-22	0	0	0	111.8	S846 S851 S852	S846-D848 PolarHBondContact O-N 2.94Å; S846-D848 PolarHBondContact OG-N 2.73Å; D848-S851 WeakPolarHBondContact CA-OG 3.25Å; D848-S851 PolarHBondContact O-OG 2.71Å; D848-S852 VanDerWaalsContact O-CB 3.28Å; D848-S852 WeakPolarHBondContact O-CB 3.31Å; D848-S852 PolarHBondContact O-N 3Å; D848-S852 VanDerWaalsContact O-N 3.1Å; D848-S852 PolarHBondContact O-OG 2.91Å
849	F	88.4	Confident	75	Confident	1 Å²	1	73.8 Å²	73.8	0%	0.004	40%	0.401	C	S	.	.	H	α-helix	trans	-68.7	-49	174.1	173	-103	0	0	0	110.9	L749 L750 P752 V826 H829 Y830 L845 S846 D847 S851 S852 V853	L749-F849 WeakPolarHBondContact O-CZ 3.32Å; L750-F849 HydrophobicContact CD2-CE1 4.31Å; P752-F849 HydrophobicContact CG-CZ 4.38Å; V826-F849 HydrophobicContact CG1-CD2 4.14Å; V826-F849 HydrophobicContact CG1-CE2 3.87Å; V826-F849 VanDerWaalsContact O-CD2 3.3Å; V826-F849 WeakPolarHBondContact O-CD2 3.46Å; H829-F849 HydrophobicContact CB-CB 4.09Å; H829-F849 HydrophobicContact CB-CD2 4.38Å; Y830-F849 HydrophobicContact CD2-CD1 4.48Å; Y830-F849 HydrophobicContact CD2-CD2 4.35Å; Y830-F849 HydrophobicContact CD2-CE1 4.21Å; Y830-F849 HydrophobicContact CD2-CE2 4.09Å; Y830-F849 HydrophobicContact CD2-CZ 4.02Å; Y830-F849 HydrophobicContact CG-CE2 4.38Å; L845-F849 HydrophobicContact CB-CD1 4.48Å; L845-F849 HydrophobicContact CD2-CD1 4.26Å; L845-F849 HydrophobicContact CD2-CE1 4.27Å; S846-F849 WeakPolarHBondContact O-CB 3.36Å; S846-F849 PolarHBondContact O-N 2.94Å; S846-F849 VanDerWaalsContact O-N 3.09Å; D847-F849 VanDerWaalsContact C-N 3.3Å; D847-F849 PolarHBondContact O-N 3.35Å; F849-S851 VanDerWaalsContact C-N 3.35Å; F849-S851 PolarHBondContact O-N 3.41Å; F849-S852 WeakPolarHBondContact O-CB 3.45Å; F849-S852 PolarHBondContact O-N 2.86Å; F849-V853 HydrophobicContact CD1-CG2 4.43Å; F849-V853 HydrophobicContact CE1-CG2 4.01Å; F849-V853 HydrophobicContact CE2-CG2 4.12Å; F849-V853 HydrophobicContact CZ-CG2 3.84Å; F849-V853 WeakPolarHBondContact O-CG2 3.49Å; F849-V853 PolarHBondContact O-N 2.76Å
850	L	88.6	Confident	77.5	Confident	4 Å²	4	67 Å²	67	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-62.9	-40.6	-178.9	-62.4	170.3	0	0	0	112.2	L750 L845 S846 D847 V853 N854 Q887 A890 V891	L750-L850 HydrophobicContact CD2-CD2 3.7Å; L845-L850 HydrophobicContact CB-CD2 4.45Å; L845-L850 HydrophobicContact CD1-CD2 4.21Å; S846-L850 PolarHBondContact O-N 3.49Å; D847-L850 PolarHBondContact O-N 3.09Å; L850-V853 PolarHBondContact O-N 3.03Å; L850-N854 PolarHBondContact O-N 3.22Å; L850-Q887 HydrophobicContact CD1-CB 4.39Å; L850-Q887 HydrophobicContact CD1-CG 3.93Å; L850-Q887 HydrophobicContact CD2-CB 4.49Å; L850-Q887 HydrophobicContact CD2-CG 4.48Å; L850-A890 HydrophobicContact CB-CB 4.08Å; L850-A890 HydrophobicContact CD1-CB 4.32Å; L850-V891 HydrophobicContact CD2-CG2 3.91Å
851	S	88.6	Confident	80.3	Confident	63 Å²	63	58.8 Å²	58.8	44%	0.441	33%	0.331	S	S	.	.	H	α-helix	trans	-67	-36.8	175.8	62.1	0	0	0	0	112.1	D847 D848 F849 N854 R855	D847-S851 WeakPolarHBondContact O-CB 3.45Å; D847-S851 PolarHBondContact O-N 3.01Å; D847-S851 PolarHBondContact O-OG 2.82Å; D848-S851 WeakPolarHBondContact CA-OG 3.25Å; D848-S851 PolarHBondContact O-OG 2.71Å; F849-S851 VanDerWaalsContact C-N 3.35Å; F849-S851 PolarHBondContact O-N 3.41Å; S851-N854 PolarHBondContact O-N 2.89Å; S851-R855 WeakPolarHBondContact O-CB 3.4Å; S851-R855 PolarHBondContact O-N 2.93Å
852	S	89.3	Confident	82.5	Confident	9 Å²	9	56.5 Å²	56.5	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-65.2	-41.9	173.7	-65.9	0	0	0	0	112.4	H829 D848 F849 R855 M856	H829-S852 PolarHBondContact CD2-OG 3.15Å; H829-S852 VanDerWaalsContact CD2-OG 3.28Å; D848-S852 VanDerWaalsContact O-CB 3.28Å; D848-S852 WeakPolarHBondContact O-CB 3.31Å; D848-S852 PolarHBondContact O-N 3Å; D848-S852 VanDerWaalsContact O-N 3.1Å; D848-S852 PolarHBondContact O-OG 2.91Å; F849-S852 WeakPolarHBondContact O-CB 3.45Å; F849-S852 PolarHBondContact O-N 2.86Å; S852-R855 PolarHBondContact O-N 3.13Å; S852-M856 PolarHBondContact O-N 3.24Å; S852-M856 VanDerWaalsContact O-N 3.08Å
853	V	90.4	Very high	84.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-47.7	173.2	174.5	0	0	0	0	110.8	L749 V826 F849 L850 R855 M856 L857 V891	L749-V853 HydrophobicContact CB-CG1 4.03Å; L749-V853 HydrophobicContact CD1-CG1 4.07Å; V826-V853 HydrophobicContact CG1-CB 4.42Å; V826-V853 HydrophobicContact CG1-CG2 3.49Å; V826-V853 VanDerWaalsContact CG1-CG2 3.49Å; F849-V853 HydrophobicContact CD1-CG2 4.43Å; F849-V853 HydrophobicContact CE1-CG2 4.01Å; F849-V853 HydrophobicContact CE2-CG2 4.12Å; F849-V853 HydrophobicContact CZ-CG2 3.84Å; F849-V853 WeakPolarHBondContact O-CG2 3.49Å; F849-V853 PolarHBondContact O-N 2.76Å; L850-V853 PolarHBondContact O-N 3.03Å; V853-R855 PolarHBondContact O-N 3.17Å; V853-M856 WeakPolarHBondContact O-CB 3.45Å; V853-M856 PolarHBondContact O-N 3.46Å; V853-L857 HydrophobicContact CG1-CD1 4.23Å; V853-L857 WeakPolarHBondContact O-CG 3.45Å; V853-L857 PolarHBondContact O-N 3.3Å; V853-V891 HydrophobicContact CG1-CG1 4.13Å
854	N	93.1	Very high	86.5	Confident	21 Å²	21	55 Å²	55	11%	0.112	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-43.3	178.7	-173.7	6	0	0	0	111.7	L850 S851 M856 L857 M858 A890 V891 R893	L850-N854 PolarHBondContact O-N 3.22Å; S851-N854 PolarHBondContact O-N 2.89Å; N854-M856 VanDerWaalsContact C-N 3.28Å; N854-M856 PolarHBondContact O-N 2.87Å; N854-L857 PolarHBondContact O-N 3.37Å; N854-L857 VanDerWaalsContact O-N 3.11Å; N854-M858 WeakPolarHBondContact O-CB 3.46Å; N854-M858 WeakPolarHBondContact O-CG 3.33Å; N854-M858 PolarHBondContact O-N 3.33Å; N854-M858 WeakPolarHBondContact OD1-CG 3.44Å; N854-A890 WeakPolarHBondContact CB-O 3.34Å; N854-A890 PolarHBondContact ND2-O 3.03Å; N854-V891 PolarHBondContact OD1-O 3.1Å; N854-R893 PolarHBondContact ND2-O 3Å; N854-R893 PolarHBondContact OD1-O 3.24Å
855	R	91.8	Very high	87.9	Confident	165 Å²	165	53.8 Å²	53.8	62%	0.623	28%	0.281	S	S	*	.	H	α-helix	trans	-57.2	-43.3	177	-174.8	172.1	63	175.8	-3.4	111.7	S851 S852 V853 M858 E859	S851-R855 WeakPolarHBondContact O-CB 3.4Å; S851-R855 PolarHBondContact O-N 2.93Å; S852-R855 PolarHBondContact O-N 3.13Å; V853-R855 PolarHBondContact O-N 3.17Å; R855-M858 PolarHBondContact O-N 3.31Å; R855-E859 WeakPolarHBondContact O-CB 3.4Å; R855-E859 PolarHBondContact O-N 3.12Å
856	M	92.3	Very high	88.9	Confident	13 Å²	13	52 Å²	52	6%	0.064	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-44.4	175	176	-114.5	-66.6	0	0	112.1	W745 N788 V821 W823 V826 S852 V853 N854 M858 E859 H860	W745-M856 HydrophobicContact CH2-SD 3.62Å; W745-M856 HydrophobicContact CZ3-SD 3.55Å; W745-M856 VanDerWaalsContact CZ3-SD 3.55Å; N788-M856 WeakPolarHBondContact ND2-CE 3.42Å; V821-M856 HydrophobicContact CG1-CG 3.89Å; V821-M856 HydrophobicContact CG1-SD 4.04Å; W823-M856 HydrophobicContact CB-CE 4.13Å; W823-M856 HydrophobicContact CE3-CE 3.82Å; V826-M856 HydrophobicContact CG2-CB 4.44Å; V826-M856 HydrophobicContact CG2-CE 4.17Å; S852-M856 PolarHBondContact O-N 3.24Å; S852-M856 VanDerWaalsContact O-N 3.08Å; V853-M856 WeakPolarHBondContact O-CB 3.45Å; V853-M856 PolarHBondContact O-N 3.46Å; N854-M856 VanDerWaalsContact C-N 3.28Å; N854-M856 PolarHBondContact O-N 2.87Å; M856-M858 PolarHBondContact O-N 3.05Å; M856-E859 PolarHBondContact O-N 3.39Å; M856-H860 PolarHBondContact O-N 2.78Å
857	L	92.6	Very high	89.6	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-42	175.9	-70.4	174.9	0	0	0	112.2	W745 L749 V853 N854 H860 S861 L869 V891 L895	W745-L857 HydrophobicContact CD2-CD2 3.57Å; W745-L857 VanDerWaalsContact CE2-CD2 3.43Å; W745-L857 HydrophobicContact CE3-CD2 3.99Å; W745-L857 HydrophobicContact CG-CD2 4.02Å; W745-L857 HydrophobicContact CH2-CD2 4.1Å; W745-L857 HydrophobicContact CZ2-CD2 3.73Å; W745-L857 HydrophobicContact CZ3-CD2 4.24Å; L749-L857 HydrophobicContact CD1-CD1 4.09Å; L749-L857 HydrophobicContact CD1-CD2 3.82Å; L749-L857 HydrophobicContact CD1-CG 4.21Å; V853-L857 HydrophobicContact CG1-CD1 4.23Å; V853-L857 WeakPolarHBondContact O-CG 3.45Å; V853-L857 PolarHBondContact O-N 3.3Å; N854-L857 PolarHBondContact O-N 3.37Å; N854-L857 VanDerWaalsContact O-N 3.11Å; L857-H860 PolarHBondContact O-N 2.77Å; L857-S861 WeakPolarHBondContact O-CA 3.37Å; L857-S861 WeakPolarHBondContact O-CB 3.46Å; L857-S861 PolarHBondContact O-N 3.47Å; L857-L869 HydrophobicContact CD1-CD1 4.27Å; L857-L869 HydrophobicContact CD2-CD2 4.09Å; L857-V891 HydrophobicContact CD1-CG1 3.78Å; L857-L895 HydrophobicContact CB-CD1 4.02Å; L857-L895 HydrophobicContact CB-CD2 3.58Å; L857-L895 HydrophobicContact CB-CG 4.45Å; L857-L895 HydrophobicContact CD1-CD1 3.85Å
858	M	92	Very high	90.3	Very high	65 Å²	65	43.7 Å²	43.7	32%	0.32	22%	0.222	S	C	.	.	H	α-helix	trans	-65	-43.2	177.8	-75.9	-68.6	-71	0	0	111.9	N854 R855 M856 H860 S862 L895	N854-M858 WeakPolarHBondContact O-CB 3.46Å; N854-M858 WeakPolarHBondContact O-CG 3.33Å; N854-M858 PolarHBondContact O-N 3.33Å; N854-M858 WeakPolarHBondContact OD1-CG 3.44Å; R855-M858 PolarHBondContact O-N 3.31Å; M856-M858 PolarHBondContact O-N 3.05Å; M858-H860 VanDerWaalsContact C-N 3.28Å; M858-H860 PolarHBondContact O-N 2.91Å; M858-S862 WeakPolarHBondContact O-CB 3.41Å; M858-S862 PolarHBondContact O-N 3.16Å; M858-S862 VanDerWaalsContact O-N 3.13Å; M858-S862 PolarHBondContact O-OG 3.35Å; M858-L895 HydrophobicContact CB-CD2 4.47Å; M858-L895 HydrophobicContact CG-CD2 3.79Å; M858-L895 HydrophobicContact SD-CD2 3.57Å; M858-L895 VanDerWaalsContact SD-CD2 3.57Å; M858-L895 HydrophobicContact SD-CG 4.19Å
859	E	91.9	Very high	90.8	Very high	143 Å²	143	39.1 Å²	39.1	67%	0.668	20%	0.198	S	C	*	.	H	α-helix	trans	-60.6	-39.1	-180	-171.2	178.8	166.3	0	0	111.9	R855 M856	R855-E859 WeakPolarHBondContact O-CB 3.4Å; R855-E859 PolarHBondContact O-N 3.12Å; M856-E859 PolarHBondContact O-N 3.39Å
860	H	90.4	Very high	91	Very high	57 Å²	57	40.7 Å²	40.7	26%	0.264	20%	0.204	S	C	.	.	H	α-helix	trans	-100.4	-27.2	-172.7	-66.9	-3.6	0	0	0	114.4	W745 R784 F786 V821 M856 L857 M858	W745-H860 HydrophobicContact CH2-CB 4.39Å; W745-H860 HydrophobicContact CZ2-CB 4.11Å; R784-H860 PolarHBondContact NH2-O 2.79Å; F786-H860 HydrophobicContact CD1-CB 4.45Å; F786-H860 HydrophobicContact CE1-CB 3.92Å; V821-H860 VanDerWaalsContact CG2-CD2 3.43Å; V821-H860 WeakPolarHBondContact CG2-CD2 3.27Å; M856-H860 PolarHBondContact O-N 2.78Å; L857-H860 PolarHBondContact O-N 2.77Å; M858-H860 VanDerWaalsContact C-N 3.28Å; M858-H860 PolarHBondContact O-N 2.91Å
861	S	90.3	Very high	91.3	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-118.4	3.9	-172.2	-49.5	0	0	0	0	114.2	D743 W745 L857 Q863 A864 R867	D743-S861 WeakPolarHBondContact OD2-CA 3.44Å; D743-S861 WeakPolarHBondContact OD2-CB 3.48Å; D743-S861 PolarHBondContact OD2-OG 3.19Å; W745-S861 WeakPolarHBondContact CZ2-OG 3.43Å; W745-S861 PolarHBondContact NE1-OG 3.34Å; L857-S861 WeakPolarHBondContact O-CA 3.37Å; L857-S861 WeakPolarHBondContact O-CB 3.46Å; L857-S861 PolarHBondContact O-N 3.47Å; S861-Q863 VanDerWaalsContact C-N 3.26Å; S861-Q863 PolarHBondContact O-N 3.29Å; S861-A864 WeakPolarHBondContact O-CB 3.37Å; S861-A864 PolarHBondContact O-N 3.41Å; S861-A864 VanDerWaalsContact O-N 3.12Å; S861-R867 PolarHBondContact O-NE 2.95Å; S861-R867 PolarHBondContact O-NH2 2.98Å
862	S	84.3	Confident	91.4	Very high	65 Å²	65	38.1 Å²	38.1	46%	0.455	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.1	-177.8	48.2	0	0	0	0	114.7	M858 R867	M858-S862 WeakPolarHBondContact O-CB 3.41Å; M858-S862 PolarHBondContact O-N 3.16Å; M858-S862 VanDerWaalsContact O-N 3.13Å; M858-S862 PolarHBondContact O-OG 3.35Å; S862-R867 VanDerWaalsContact C-NH2 3.33Å; S862-R867 PolarHBondContact O-NH2 2.88Å
863	Q	85	Confident	91.4	Very high	171 Å²	171	46.1 Å²	46.1	80%	0.799	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-1.4	-179.6	-64.4	-176.3	-13.6	0	0	114.7	S861	S861-Q863 VanDerWaalsContact C-N 3.26Å; S861-Q863 PolarHBondContact O-N 3.29Å
864	A	88.8	Confident	91.3	Very high	8 Å²	8	47.1 Å²	47.1	7%	0.066	22%	0.221	C	C	.	.			trans	-69.6	146.4	-177	0	0	0	0	0	112.8	T741 D743 S861 R867	T741-A864 WeakPolarHBondContact OG1-CA 3.34Å; D743-A864 HydrophobicContact CB-CB 3.98Å; D743-A864 VanDerWaalsContact CG-CB 3.47Å; D743-A864 VanDerWaalsContact OD2-CB 3.27Å; D743-A864 WeakPolarHBondContact OD2-CB 3.29Å; S861-A864 WeakPolarHBondContact O-CB 3.37Å; S861-A864 PolarHBondContact O-N 3.41Å; S861-A864 VanDerWaalsContact O-N 3.12Å; A864-R867 HydrophobicContact CB-CG 3.99Å; A864-R867 VanDerWaalsContact N-NH2 3.16Å; A864-R867 PolarHBondContact O-NH1 3.47Å; A864-R867 PolarHBondContact O-NH2 3.19Å
865	A	90.1	Very high	91	Very high	23 Å²	23	47.9 Å²	47.9	19%	0.19	23%	0.227	C	C	.	.	S	Bend	trans	-73.4	-44.8	174.3	0	0	0	0	0	110.5	R740 T741 W778	R740-A865 HydrophobicContact CB-CB 4.3Å; T741-A865 WeakPolarHBondContact O-CB 3.33Å; T741-A865 PolarHBondContact O-N 2.92Å; W778-A865 HydrophobicContact CH2-CB 3.97Å; W778-A865 HydrophobicContact CZ3-CB 3.83Å
866	V	93.4	Very high	90.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	141.2	175.9	172.2	0	0	0	0	110.1	F563 L726 D743 W778 F868 P897	F563-V866 HydrophobicContact CE2-CG1 4.22Å; F563-V866 HydrophobicContact CE2-CG2 3.91Å; F563-V866 HydrophobicContact CZ-CG1 4.02Å; F563-V866 HydrophobicContact CZ-CG2 4.48Å; L726-V866 HydrophobicContact CD1-CG2 4.02Å; D743-V866 PolarHBondContact N-O 2.69Å; W778-V866 HydrophobicContact CH2-CB 4.2Å; W778-V866 HydrophobicContact CH2-CG2 3.47Å; W778-V866 VanDerWaalsContact CH2-CG2 3.47Å; W778-V866 HydrophobicContact CZ2-CG2 4.08Å; W778-V866 HydrophobicContact CZ3-CB 4.41Å; W778-V866 HydrophobicContact CZ3-CG2 4.15Å; V866-F868 HydrophobicContact CG1-CD2 4.13Å; V866-F868 HydrophobicContact CG1-CE2 3.71Å; V866-F868 HydrophobicContact CG1-CZ 4.48Å; V866-P897 HydrophobicContact CG2-CB 4.32Å
867	R	94.4	Very high	89.7	Confident	5 Å²	5	46.7 Å²	46.7	2%	0.019	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135	178.1	-62.2	146.3	-164.8	82.1	-2.8	110.8	D743 S861 S862 A864 L895 P897 T898 L899	D743-R867 HydrophobicContact CB-CG 4.12Å; D743-R867 CarbonylContact O-C 3.53Å; D743-R867 WeakPolarHBondContact O-CA 3.5Å; S861-R867 PolarHBondContact O-NE 2.95Å; S861-R867 PolarHBondContact O-NH2 2.98Å; S862-R867 VanDerWaalsContact C-NH2 3.33Å; S862-R867 PolarHBondContact O-NH2 2.88Å; A864-R867 HydrophobicContact CB-CG 3.99Å; A864-R867 VanDerWaalsContact N-NH2 3.16Å; A864-R867 PolarHBondContact O-NH1 3.47Å; A864-R867 PolarHBondContact O-NH2 3.19Å; R867-L895 WeakPolarHBondContact CD-O 3.31Å; R867-L895 PolarHBondContact NE-O 3.39Å; R867-L895 PolarHBondContact NH1-O 3.05Å; R867-L895 VanDerWaalsContact NH1-O 3.12Å; R867-L895 PolarHBondContact NH2-O 2.89Å; R867-L895 VanDerWaalsContact NH2-O 3.13Å; R867-P897 PolarHBondContact N-O 3.31Å; R867-P897 VanDerWaalsContact N-O 3.09Å; R867-P897 PolarHBondContact NH1-O 3.19Å; R867-T898 HydrophobicContact CB-CG2 4.29Å; R867-T898 WeakPolarHBondContact O-CA 3.46Å; R867-L899 PolarHBondContact O-N 3.46Å
868	F	95.9	Very high	88.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.4	172.5	-73.1	-105.9	0	0	0	108.2	L567 I742 D743 V744 W745 L765 M768 A769 L772 V866 L899 I901	L567-F868 HydrophobicContact CD1-CE1 4.46Å; L567-F868 HydrophobicContact CD1-CZ 4.3Å; I742-F868 HydrophobicContact CG2-CD2 3.86Å; I742-F868 HydrophobicContact CG2-CE2 3.81Å; D743-F868 PolarHBondContact O-N 2.75Å; V744-F868 HydrophobicContact CG1-CB 4.5Å; V744-F868 HydrophobicContact CG2-CB 4.49Å; W745-F868 PolarHBondContact N-O 2.88Å; L765-F868 HydrophobicContact CD2-CB 3.7Å; L765-F868 HydrophobicContact CG-CB 4.2Å; M768-F868 HydrophobicContact CB-CD1 4.4Å; M768-F868 HydrophobicContact CB-CE1 3.96Å; A769-F868 HydrophobicContact CB-CD1 4.32Å; A769-F868 HydrophobicContact CB-CD2 4.19Å; A769-F868 HydrophobicContact CB-CE1 4.45Å; A769-F868 HydrophobicContact CB-CE2 4.31Å; A769-F868 HydrophobicContact CB-CG 4.21Å; A769-F868 HydrophobicContact CB-CZ 4.45Å; L772-F868 HydrophobicContact CB-CZ 4.37Å; L772-F868 HydrophobicContact CD2-CE2 3.77Å; L772-F868 HydrophobicContact CD2-CZ 3.83Å; V866-F868 HydrophobicContact CG1-CD2 4.13Å; V866-F868 HydrophobicContact CG1-CE2 3.71Å; V866-F868 HydrophobicContact CG1-CZ 4.48Å; F868-L899 WeakPolarHBondContact CA-O 3.25Å; F868-L899 HydrophobicContact CD1-CD2 4.34Å; F868-L899 HydrophobicContact CE1-CD2 3.83Å; F868-L899 HydrophobicContact CZ-CD2 4.4Å; F868-I901 HydrophobicContact CD1-CD1 3.46Å; F868-I901 VanDerWaalsContact CD1-CD1 3.46Å; F868-I901 HydrophobicContact CD1-CG1 4.5Å; F868-I901 HydrophobicContact CE1-CD1 3.84Å
869	L	95.1	Very high	88.3	Confident	6 Å²	6	58.7 Å²	58.7	3%	0.031	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	148.3	-178.1	-63.6	-175.9	0	0	0	110.6	W745 L857 L871 T892 L895 T898 L899 L900 I901	W745-L869 HydrophobicContact CB-CD2 3.6Å; W745-L869 VanDerWaalsContact CD1-CD2 3.41Å; W745-L869 HydrophobicContact CG-CD2 3.6Å; L857-L869 HydrophobicContact CD1-CD1 4.27Å; L857-L869 HydrophobicContact CD2-CD2 4.09Å; L869-L871 PolarHBondContact O-N 2.96Å; L869-T892 HydrophobicContact CD1-CG2 3.82Å; L869-L895 HydrophobicContact CD1-CD1 4.07Å; L869-T898 HydrophobicContact CB-CG2 4.46Å; L869-T898 HydrophobicContact CD1-CG2 3.48Å; L869-T898 VanDerWaalsContact CD1-CG2 3.48Å; L869-T898 HydrophobicContact CG-CG2 3.8Å; L869-L899 PolarHBondContact N-O 3.42Å; L869-L900 HydrophobicContact CB-CD2 3.71Å; L869-L900 HydrophobicContact CD1-CD2 4.23Å; L869-L900 CarbonylContact O-C 3.5Å; L869-L900 WeakPolarHBondContact O-CA 3.42Å; L869-I901 PolarHBondContact O-N 3.4Å
870	Y	93.6	Very high	88	Confident	34 Å²	34	55.4 Å²	55.4	13%	0.133	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	129.1	173.7	-168.2	-76.6	0	0	0	110.9	W745 L747 N748 C761 P872	W745-Y870 PolarHBondContact O-N 3.11Å; L747-Y870 WeakPolarHBondContact O-CB 3.45Å; N748-Y870 HydrophobicContact CB-CD1 3.61Å; N748-Y870 HydrophobicContact CB-CD2 4.45Å; N748-Y870 HydrophobicContact CB-CE1 3.67Å; N748-Y870 HydrophobicContact CB-CE2 4.47Å; N748-Y870 HydrophobicContact CB-CG 4.05Å; C761-Y870 HydrophobicContact CB-CD2 4.34Å; C761-Y870 HydrophobicContact CB-CE2 3.48Å; C761-Y870 VanDerWaalsContact CB-CE2 3.48Å; C761-Y870 WeakPolarHBondContact SG-CE2 3.36Å; Y870-P872 WeakPolarHBondContact O-CD 3.26Å
871	L	93.6	Very high	87.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.281	C	S	.	.			trans	-92.9	114.2	172.7	-178.5	66.7	0	0	0	109.6	V717 L719 L869 Y884 L888 L900 I901 H902	V717-L871 HydrophobicContact CG1-CD2 4.21Å; L719-L871 HydrophobicContact CD1-CD1 3.66Å; L719-L871 HydrophobicContact CD1-CD2 4.1Å; L719-L871 HydrophobicContact CG-CD1 4.3Å; L719-L871 HydrophobicContact CG-CD2 3.98Å; L869-L871 PolarHBondContact O-N 2.96Å; L871-Y884 WeakPolarHBondContact CD1-OH 3.45Å; L871-L888 HydrophobicContact CD1-CD1 3.9Å; L871-L888 HydrophobicContact CD1-CD2 4.05Å; L871-L900 HydrophobicContact CB-CB 4.1Å; L871-L900 HydrophobicContact CD1-CB 3.98Å; L871-L900 HydrophobicContact CD1-CD1 4.43Å; L871-I901 VanDerWaalsContact CB-C 3.41Å; L871-I901 WeakPolarHBondContact CB-O 3.39Å; L871-I901 PolarHBondContact N-O 2.66Å; L871-H902 HydrophobicContact CB-CB 4.03Å; L871-H902 HydrophobicContact CD2-CB 4.04Å; L871-H902 HydrophobicContact CG-CB 4.32Å; L871-H902 PolarHBondContact O-ND1 3.28Å
872	P	90.9	Very high	87.8	Confident	13 Å²	13	59.7 Å²	59.7	8%	0.084	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-60.1	158	173.8	28.5	-39.9	0	0	0	111.6	L750 Y870 Y884 L888	L750-P872 HydrophobicContact CD1-CB 4.28Å; L750-P872 HydrophobicContact CD1-CG 3.79Å; Y870-P872 WeakPolarHBondContact O-CD 3.26Å; P872-Y884 HydrophobicContact CB-CE2 4.49Å; P872-Y884 HydrophobicContact CG-CE2 3.93Å; P872-Y884 PolarHBondContact O-OH 3.45Å; P872-L888 HydrophobicContact CG-CD2 3.81Å
873	R	88.7	Confident	88	Confident	178 Å²	178	60.5 Å²	60.5	67%	0.672	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-70.8	139.7	174.4	-72.6	-174.5	177.5	164.7	6	110.2	H902	R873-H902 WeakPolarHBondContact CG-CE1 3.28Å; R873-H902 PolarHBondContact NE-NE2 2.97Å
874	P	89.8	Confident	88.3	Confident	21 Å²	21	52.6 Å²	52.6	14%	0.136	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-66.9	150.9	175.3	29.1	-35.1	0	0	0	111	V704 I707 I711 Y884	V704-P874 HydrophobicContact CG1-CB 3.75Å; I707-P874 HydrophobicContact CG2-CG 4.11Å; I711-P874 HydrophobicContact CD1-CG 4.26Å; P874-Y884 HydrophobicContact CB-CE1 4.28Å; P874-Y884 HydrophobicContact CB-CE2 4.46Å
875	P	86.1	Confident	88.4	Confident	36 Å²	36	52.8 Å²	52.8	23%	0.234	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-64.4	154.1	177.2	26.6	-33.7	0	0	0	112	Q880	P875-Q880 HydrophobicContact CB-CB 3.95Å; P875-Q880 VanDerWaalsContact CB-OE1 3.27Å; P875-Q880 HydrophobicContact CG-CB 3.73Å
876	A	76.8	Confident	88.4	Confident	112 Å²	112	54.4 Å²	54.4	93%	0.926	28%	0.281	S	S	*	.	S	Bend	trans	-74.2	-30.1	178.7	0	0	0	0	0	112.9
877	A	79.4	Confident	88.3	Confident	42 Å²	42	55.5 Å²	55.5	35%	0.347	29%	0.286	S	S	.	.	S	Bend	trans	-89.9	132.1	-176.6	0	0	0	0	0	111.6	N879 Q880	A877-N879 VanDerWaalsContact C-N 3.33Å; A877-N879 WeakPolarHBondContact CB-OD1 3.44Å; A877-N879 PolarHBondContact O-N 3.18Å; A877-Q880 PolarHBondContact O-N 3.37Å
878	R	76.4	Confident	88.1	Confident	181 Å²	181	55.4 Å²	55.4	68%	0.683	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-66.3	-32.1	-175.4	-66.4	-174.5	-176.5	-172.7	1.2	113.3	Q880 S881	R878-Q880 PolarHBondContact O-N 2.85Å; R878-Q880 VanDerWaalsContact O-N 3.11Å; R878-S881 PolarHBondContact O-N 3.46Å; R878-S881 PolarHBondContact O-OG 2.99Å
879	N	80.2	Confident	87.9	Confident	136 Å²	136	58.6 Å²	58.6	73%	0.727	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-63.8	-13.8	178.2	59.8	-17.4	0	0	0	113.9	A877	A877-N879 VanDerWaalsContact C-N 3.33Å; A877-N879 WeakPolarHBondContact CB-OD1 3.44Å; A877-N879 PolarHBondContact O-N 3.18Å
880	Q	85.1	Confident	87.7	Confident	75 Å²	75	59.8 Å²	59.8	35%	0.35	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-97.7	2.1	179.3	-65.4	176.3	-8.8	0	0	113.5	P875 A877 R878 Q882 H883 Y884	P875-Q880 HydrophobicContact CB-CB 3.95Å; P875-Q880 VanDerWaalsContact CB-OE1 3.27Å; P875-Q880 HydrophobicContact CG-CB 3.73Å; A877-Q880 PolarHBondContact O-N 3.37Å; R878-Q880 PolarHBondContact O-N 2.85Å; R878-Q880 VanDerWaalsContact O-N 3.11Å; Q880-Q882 VanDerWaalsContact C-N 3.34Å; Q880-Q882 PolarHBondContact O-N 3.36Å; Q880-H883 PolarHBondContact O-N 2.85Å; Q880-Y884 WeakPolarHBondContact O-CB 3.37Å; Q880-Y884 PolarHBondContact O-N 2.94Å
881	S	87.8	Confident	87.6	Confident	5 Å²	5	58.8 Å²	58.8	4%	0.035	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-41.7	-177.7	-51.2	0	0	0	0	112.6	D701 R878 Y884 L885	D701-S881 WeakPolarHBondContact OD1-CB 3.45Å; D701-S881 PolarHBondContact OD1-OG 3.05Å; R878-S881 PolarHBondContact O-N 3.46Å; R878-S881 PolarHBondContact O-OG 2.99Å; S881-Y884 PolarHBondContact O-N 2.85Å; S881-L885 WeakPolarHBondContact O-CG 3.34Å; S881-L885 PolarHBondContact O-N 3.38Å; S881-L885 VanDerWaalsContact O-N 3.08Å
882	Q	88.7	Confident	87.5	Confident	143 Å²	143	58.9 Å²	58.9	67%	0.668	31%	0.31	S	S	*	.	H	α-helix	trans	-68.2	-40	-179.6	-171.2	167.7	2	0	0	111.8	Q880 L885 S886	Q880-Q882 VanDerWaalsContact C-N 3.34Å; Q880-Q882 PolarHBondContact O-N 3.36Å; Q882-L885 PolarHBondContact O-N 3.5Å; Q882-S886 PolarHBondContact O-N 3.47Å
883	H	88.3	Confident	87.6	Confident	81 Å²	81	66.6 Å²	66.6	38%	0.375	34%	0.337	S	S	.	.	H	α-helix	trans	-65	-40	174.9	-175.9	-95.6	0	0	0	111.8	Q880 L885 S886 Q887	Q880-H883 PolarHBondContact O-N 2.85Å; H883-L885 VanDerWaalsContact C-N 3.33Å; H883-L885 PolarHBondContact O-N 3.43Å; H883-S886 WeakPolarHBondContact CA-OG 3.42Å; H883-S886 PolarHBondContact O-N 3.28Å; H883-S886 PolarHBondContact O-OG 3.34Å; H883-Q887 PolarHBondContact CE1-NE2 3.11Å; H883-Q887 PolarHBondContact ND1-NE2 3.38Å; H883-Q887 VanDerWaalsContact O-CG 3.26Å; H883-Q887 WeakPolarHBondContact O-CG 3.49Å; H883-Q887 PolarHBondContact O-N 3.15Å
884	Y	90.6	Very high	87.5	Confident	5 Å²	5	60.3 Å²	60.3	2%	0.02	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-41.6	174.3	175.3	-101.3	0	0	0	112.3	V704 L871 P872 P874 Q880 S881 Q887 L888	V704-Y884 HydrophobicContact CG1-CD1 4.13Å; V704-Y884 HydrophobicContact CG2-CD1 3.9Å; L871-Y884 WeakPolarHBondContact CD1-OH 3.45Å; P872-Y884 HydrophobicContact CB-CE2 4.49Å; P872-Y884 HydrophobicContact CG-CE2 3.93Å; P872-Y884 PolarHBondContact O-OH 3.45Å; P874-Y884 HydrophobicContact CB-CE1 4.28Å; P874-Y884 HydrophobicContact CB-CE2 4.46Å; Q880-Y884 WeakPolarHBondContact O-CB 3.37Å; Q880-Y884 PolarHBondContact O-N 2.94Å; S881-Y884 PolarHBondContact O-N 2.85Å; Y884-Q887 PolarHBondContact O-N 2.85Å; Y884-L888 HydrophobicContact CD1-CD1 4.15Å; Y884-L888 HydrophobicContact CE1-CD1 3.5Å; Y884-L888 HydrophobicContact CE1-CG 4.33Å; Y884-L888 HydrophobicContact CE2-CD1 4.46Å; Y884-L888 WeakPolarHBondContact O-CG 3.22Å; Y884-L888 PolarHBondContact O-N 2.96Å; Y884-L888 VanDerWaalsContact O-N 3.13Å
885	L	91.1	Very high	87.4	Confident	13 Å²	13	59.5 Å²	59.5	7%	0.068	32%	0.322	C	S	.	.	H	α-helix	trans	-68.8	-39.5	176.1	-70.1	176.3	0	0	0	112.6	Y645 P700 Y703 V704 S881 Q882 H883 Q887 L888 E889	Y645-L885 HydrophobicContact CD1-CD1 3.86Å; Y645-L885 HydrophobicContact CE1-CD1 4.38Å; Y645-L885 HydrophobicContact CG-CD1 4.4Å; P700-L885 HydrophobicContact CB-CD1 3.91Å; Y703-L885 HydrophobicContact CD1-CD1 4.42Å; Y703-L885 HydrophobicContact CD1-CD2 3.85Å; Y703-L885 HydrophobicContact CE1-CD2 3.88Å; V704-L885 HydrophobicContact CG2-CD1 4.05Å; V704-L885 HydrophobicContact CG2-CD2 4.06Å; V704-L885 HydrophobicContact CG2-CG 3.81Å; S881-L885 WeakPolarHBondContact O-CG 3.34Å; S881-L885 PolarHBondContact O-N 3.38Å; S881-L885 VanDerWaalsContact O-N 3.08Å; Q882-L885 PolarHBondContact O-N 3.5Å; H883-L885 VanDerWaalsContact C-N 3.33Å; H883-L885 PolarHBondContact O-N 3.43Å; L885-Q887 VanDerWaalsContact C-N 3.3Å; L885-Q887 PolarHBondContact O-N 2.89Å; L885-L888 PolarHBondContact O-N 3.49Å; L885-E889 VanDerWaalsContact O-CB 3.3Å; L885-E889 WeakPolarHBondContact O-CB 3.43Å; L885-E889 PolarHBondContact O-N 3.19Å
886	S	90.1	Very high	87.6	Confident	56 Å²	56	58 Å²	58	39%	0.392	31%	0.314	S	S	.	.	H	α-helix	trans	-64.1	-36.8	176.4	65.5	0	0	0	0	111.6	Q882 H883 E889 A890	Q882-S886 PolarHBondContact O-N 3.47Å; H883-S886 WeakPolarHBondContact CA-OG 3.42Å; H883-S886 PolarHBondContact O-N 3.28Å; H883-S886 PolarHBondContact O-OG 3.34Å; S886-E889 PolarHBondContact O-N 3.37Å; S886-A890 VanDerWaalsContact O-CB 3.31Å; S886-A890 WeakPolarHBondContact O-CB 3.44Å; S886-A890 PolarHBondContact O-N 3.22Å
887	Q	90.7	Very high	88.4	Confident	23 Å²	23	53.3 Å²	53.3	11%	0.107	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-51	172.6	-73.2	177.6	-20.5	0	0	112	L850 H883 Y884 L885 E889 A890 V891	L850-Q887 HydrophobicContact CD1-CB 4.39Å; L850-Q887 HydrophobicContact CD1-CG 3.93Å; L850-Q887 HydrophobicContact CD2-CB 4.49Å; L850-Q887 HydrophobicContact CD2-CG 4.48Å; H883-Q887 PolarHBondContact CE1-NE2 3.11Å; H883-Q887 PolarHBondContact ND1-NE2 3.38Å; H883-Q887 VanDerWaalsContact O-CG 3.26Å; H883-Q887 WeakPolarHBondContact O-CG 3.49Å; H883-Q887 PolarHBondContact O-N 3.15Å; Y884-Q887 PolarHBondContact O-N 2.85Å; L885-Q887 VanDerWaalsContact C-N 3.3Å; L885-Q887 PolarHBondContact O-N 2.89Å; Q887-E889 VanDerWaalsContact C-N 3.28Å; Q887-E889 PolarHBondContact O-N 3.48Å; Q887-A890 PolarHBondContact O-N 3.24Å; Q887-V891 VanDerWaalsContact O-CG2 3.24Å; Q887-V891 WeakPolarHBondContact O-CG2 3.4Å; Q887-V891 PolarHBondContact O-N 2.99Å; Q887-V891 VanDerWaalsContact O-N 3.13Å
888	L	91.9	Very high	89.1	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-38.6	177.5	-68.1	-178.8	0	0	0	111.8	F644 L719 L871 P872 Y884 L885 T892	F644-L888 HydrophobicContact CE2-CB 4.04Å; F644-L888 HydrophobicContact CZ-CB 4.01Å; L719-L888 HydrophobicContact CD1-CD1 4.19Å; L871-L888 HydrophobicContact CD1-CD1 3.9Å; L871-L888 HydrophobicContact CD1-CD2 4.05Å; P872-L888 HydrophobicContact CG-CD2 3.81Å; Y884-L888 HydrophobicContact CD1-CD1 4.15Å; Y884-L888 HydrophobicContact CE1-CD1 3.5Å; Y884-L888 HydrophobicContact CE1-CG 4.33Å; Y884-L888 HydrophobicContact CE2-CD1 4.46Å; Y884-L888 WeakPolarHBondContact O-CG 3.22Å; Y884-L888 PolarHBondContact O-N 2.96Å; Y884-L888 VanDerWaalsContact O-N 3.13Å; L885-L888 PolarHBondContact O-N 3.49Å; L888-T892 PolarHBondContact O-N 3.33Å; L888-T892 VanDerWaalsContact O-N 3.15Å; L888-T892 PolarHBondContact O-OG1 3.35Å
889	E	91.8	Very high	90	Very high	66 Å²	66	42.7 Å²	42.7	31%	0.308	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-47.5	177.3	173.9	159.3	-148.1	0	0	111.5	R721 L885 S886 Q887 V891 T892 R893	R721-E889 PolarHBondContact NH1-O 3.4Å; R721-E889 IonicContact NH2-OE1 2.71Å; R721-E889 PolarHBondContact NH2-OE1 3.36Å; L885-E889 VanDerWaalsContact O-CB 3.3Å; L885-E889 WeakPolarHBondContact O-CB 3.43Å; L885-E889 PolarHBondContact O-N 3.19Å; S886-E889 PolarHBondContact O-N 3.37Å; Q887-E889 VanDerWaalsContact C-N 3.28Å; Q887-E889 PolarHBondContact O-N 3.48Å; E889-V891 VanDerWaalsContact C-N 3.33Å; E889-V891 PolarHBondContact O-N 2.94Å; E889-T892 PolarHBondContact O-N 3.17Å; E889-R893 WeakPolarHBondContact O-CB 3.5Å; E889-R893 PolarHBondContact O-N 3.47Å
890	A	90.8	Very high	90.8	Very high	32 Å²	32	36.4 Å²	36.4	26%	0.264	19%	0.191	S	C	.	.	H	α-helix	trans	-59.4	-42.8	179.9	0	0	0	0	0	112	L850 N854 S886 Q887	L850-A890 HydrophobicContact CB-CB 4.08Å; L850-A890 HydrophobicContact CD1-CB 4.32Å; N854-A890 WeakPolarHBondContact CB-O 3.34Å; N854-A890 PolarHBondContact ND2-O 3.03Å; S886-A890 VanDerWaalsContact O-CB 3.31Å; S886-A890 WeakPolarHBondContact O-CB 3.44Å; S886-A890 PolarHBondContact O-N 3.22Å; Q887-A890 PolarHBondContact O-N 3.24Å
891	V	90.9	Very high	91.3	Very high	13 Å²	13	32.9 Å²	32.9	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-69.4	-36.8	-179.6	174.2	0	0	0	0	112.2	L750 L850 V853 N854 L857 Q887 E889	L750-V891 HydrophobicContact CD2-CG2 3.83Å; L850-V891 HydrophobicContact CD2-CG2 3.91Å; V853-V891 HydrophobicContact CG1-CG1 4.13Å; N854-V891 PolarHBondContact OD1-O 3.1Å; L857-V891 HydrophobicContact CD1-CG1 3.78Å; Q887-V891 VanDerWaalsContact O-CG2 3.24Å; Q887-V891 WeakPolarHBondContact O-CG2 3.4Å; Q887-V891 PolarHBondContact O-N 2.99Å; Q887-V891 VanDerWaalsContact O-N 3.13Å; E889-V891 VanDerWaalsContact C-N 3.33Å; E889-V891 PolarHBondContact O-N 2.94Å
892	T	92.2	Very high	91.6	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-101.2	2.8	-171.9	57.6	0	0	0	0	114.6	R721 Y722 L869 L888 E889 G894 L895 T898 L900	R721-T892 WeakPolarHBondContact CD-OG1 3.1Å; R721-T892 PolarHBondContact NH1-OG1 3.06Å; Y722-T892 WeakPolarHBondContact CE2-O 3.44Å; L869-T892 HydrophobicContact CD1-CG2 3.82Å; L888-T892 PolarHBondContact O-N 3.33Å; L888-T892 VanDerWaalsContact O-N 3.15Å; L888-T892 PolarHBondContact O-OG1 3.35Å; E889-T892 PolarHBondContact O-N 3.17Å; T892-G894 PolarHBondContact O-N 3.48Å; T892-L895 HydrophobicContact CG2-CD1 4.45Å; T892-L895 PolarHBondContact O-N 3.48Å; T892-T898 HydrophobicContact CG2-CG2 4.37Å; T892-L900 HydrophobicContact CG2-CD1 4.2Å; T892-L900 HydrophobicContact CG2-CD2 4.09Å; T892-L900 HydrophobicContact CG2-CG 4.39Å
893	R	91.3	Very high	91.7	Very high	175 Å²	175	26.1 Å²	26.1	66%	0.66	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	122.2	-177	-174.5	177.2	-174.4	172.4	2	111	N854 E889 L895	N854-R893 PolarHBondContact ND2-O 3Å; N854-R893 PolarHBondContact OD1-O 3.24Å; E889-R893 WeakPolarHBondContact O-CB 3.5Å; E889-R893 PolarHBondContact O-N 3.47Å; R893-L895 VanDerWaalsContact C-N 3.32Å; R893-L895 PolarHBondContact O-N 2.79Å
894	G	87.2	Confident	91.8	Very high	47 Å²	47	24.4 Å²	24.4	49%	0.485	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	-1.9	174.7	0	0	0	0	0	115.8	T892 G896	T892-G894 PolarHBondContact O-N 3.48Å; G894-G896 VanDerWaalsContact C-N 3.28Å; G894-G896 PolarHBondContact O-N 3.42Å
895	L	87.8	Confident	91.5	Very high	3 Å²	3	26 Å²	26	2%	0.016	15%	0.15	C	C	.	.			trans	-72.8	-12.3	-177.6	-68.8	175.9	0	0	0	114.5	L857 M858 R867 L869 T892 R893	L857-L895 HydrophobicContact CB-CD1 4.02Å; L857-L895 HydrophobicContact CB-CD2 3.58Å; L857-L895 HydrophobicContact CB-CG 4.45Å; L857-L895 HydrophobicContact CD1-CD1 3.85Å; M858-L895 HydrophobicContact CB-CD2 4.47Å; M858-L895 HydrophobicContact CG-CD2 3.79Å; M858-L895 HydrophobicContact SD-CD2 3.57Å; M858-L895 VanDerWaalsContact SD-CD2 3.57Å; M858-L895 HydrophobicContact SD-CG 4.19Å; R867-L895 WeakPolarHBondContact CD-O 3.31Å; R867-L895 PolarHBondContact NE-O 3.39Å; R867-L895 PolarHBondContact NH1-O 3.05Å; R867-L895 VanDerWaalsContact NH1-O 3.12Å; R867-L895 PolarHBondContact NH2-O 2.89Å; R867-L895 VanDerWaalsContact NH2-O 3.13Å; L869-L895 HydrophobicContact CD1-CD1 4.07Å; T892-L895 HydrophobicContact CG2-CD1 4.45Å; T892-L895 PolarHBondContact O-N 3.48Å; R893-L895 VanDerWaalsContact C-N 3.32Å; R893-L895 PolarHBondContact O-N 2.79Å
896	G	89.9	Confident	91.1	Very high	6 Å²	6	28.3 Å²	28.3	6%	0.062	17%	0.165	C	C	.	.			trans	72.6	-160.9	-171.2	0	0	0	0	0	113.1	Y722 G894 T898	Y722-G896 WeakPolarHBondContact CD2-O 3.15Å; G894-G896 VanDerWaalsContact C-N 3.28Å; G894-G896 PolarHBondContact O-N 3.42Å; G896-T898 PolarHBondContact O-N 3.19Å; G896-T898 PolarHBondContact O-OG1 2.9Å
897	P	93.6	Very high	90.6	Very high	12 Å²	12	26.3 Å²	26.3	8%	0.078	15%	0.151	C	C	.	.	S	Bend	trans	-55.3	115.3	-171.2	-25.1	32.6	0	0	0	112.7	Q725 L726 V866 R867	Q725-P897 HydrophobicContact CB-CG 4.36Å; L726-P897 HydrophobicContact CB-CG 4.16Å; L726-P897 HydrophobicContact CD1-CB 4.43Å; L726-P897 HydrophobicContact CD1-CG 4.24Å; V866-P897 HydrophobicContact CG2-CB 4.32Å; R867-P897 PolarHBondContact N-O 3.31Å; R867-P897 VanDerWaalsContact N-O 3.09Å; R867-P897 PolarHBondContact NH1-O 3.19Å
898	T	94.9	Very high	89.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	130.1	-170.4	-59.4	0	0	0	0	110.6	R721 F723 R867 L869 T892 G896	R721-T898 PolarHBondContact N-O 3.38Å; R721-T898 PolarHBondContact O-N 2.89Å; F723-T898 WeakPolarHBondContact CE2-O 3.49Å; R867-T898 HydrophobicContact CB-CG2 4.29Å; R867-T898 WeakPolarHBondContact O-CA 3.46Å; L869-T898 HydrophobicContact CB-CG2 4.46Å; L869-T898 HydrophobicContact CD1-CG2 3.48Å; L869-T898 VanDerWaalsContact CD1-CG2 3.48Å; L869-T898 HydrophobicContact CG-CG2 3.8Å; T892-T898 HydrophobicContact CG2-CG2 4.37Å; G896-T898 PolarHBondContact O-N 3.19Å; G896-T898 PolarHBondContact O-OG1 2.9Å
899	L	96.1	Very high	88.3	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	109.3	175.3	-166.7	69.7	0	0	0	109.3	F563 L567 C718 L719 F723 R867 F868 L869 I901	F563-L899 HydrophobicContact CE1-CD2 4.26Å; L567-L899 HydrophobicContact CD2-CD2 3.94Å; C718-L899 HydrophobicContact CB-CD1 3.82Å; C718-L899 HydrophobicContact CB-CD2 4.41Å; C718-L899 HydrophobicContact CB-CG 4.08Å; L719-L899 WeakPolarHBondContact O-CA 3.49Å; F723-L899 HydrophobicContact CE2-CB 4.46Å; F723-L899 HydrophobicContact CE2-CD1 4.29Å; F723-L899 HydrophobicContact CZ-CB 4.26Å; F723-L899 HydrophobicContact CZ-CD1 4.43Å; R867-L899 PolarHBondContact O-N 3.46Å; F868-L899 WeakPolarHBondContact CA-O 3.25Å; F868-L899 HydrophobicContact CD1-CD2 4.34Å; F868-L899 HydrophobicContact CE1-CD2 3.83Å; F868-L899 HydrophobicContact CZ-CD2 4.4Å; L869-L899 PolarHBondContact N-O 3.42Å; L899-I901 HydrophobicContact CD2-CD1 3.81Å; L899-I901 HydrophobicContact CD2-CG1 4.14Å; L899-I901 HydrophobicContact CG-CD1 4.2Å; L899-I901 HydrophobicContact CG-CG1 3.98Å
900	L	96.2	Very high	86.4	Confident	5 Å²	5	33.5 Å²	33.5	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	130.2	172.6	-68.2	155.1	0	0	0	108.8	F644 C718 L719 L869 L871 T892	F644-L900 HydrophobicContact CD2-CD1 4Å; F644-L900 HydrophobicContact CE2-CD1 3.74Å; C718-L900 CarbonylContact C-O 3.2Å; C718-L900 WeakPolarHBondContact CA-O 3.35Å; L719-L900 HydrophobicContact CB-CB 4.17Å; L719-L900 HydrophobicContact CB-CD1 4.31Å; L719-L900 HydrophobicContact CD1-CD1 4.37Å; L719-L900 PolarHBondContact N-O 2.84Å; L719-L900 PolarHBondContact O-N 3.38Å; L869-L900 HydrophobicContact CB-CD2 3.71Å; L869-L900 HydrophobicContact CD1-CD2 4.23Å; L869-L900 CarbonylContact O-C 3.5Å; L869-L900 WeakPolarHBondContact O-CA 3.42Å; L871-L900 HydrophobicContact CB-CB 4.1Å; L871-L900 HydrophobicContact CD1-CB 3.98Å; L871-L900 HydrophobicContact CD1-CD1 4.43Å; T892-L900 HydrophobicContact CG2-CD1 4.2Å; T892-L900 HydrophobicContact CG2-CD2 4.09Å; T892-L900 HydrophobicContact CG2-CG 4.39Å
901	I	95.5	Very high	84.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.9	-172.4	-57.2	-169.6	0	0	0	112.2	C718 C761 F764 L765 M768 F868 L869 L871 L899	C718-I901 HydrophobicContact CB-CG1 4.28Å; C761-I901 PolarHBondContact SG-O 2.92Å; F764-I901 HydrophobicContact CD1-CG2 3.42Å; F764-I901 VanDerWaalsContact CD1-CG2 3.42Å; F764-I901 HydrophobicContact CE1-CG2 3.45Å; F764-I901 VanDerWaalsContact CE1-CG2 3.45Å; L765-I901 HydrophobicContact CD1-CB 4.42Å; L765-I901 HydrophobicContact CG-CB 4.43Å; M768-I901 HydrophobicContact CB-CD1 3.98Å; M768-I901 HydrophobicContact CG-CD1 4.22Å; F868-I901 HydrophobicContact CD1-CD1 3.46Å; F868-I901 VanDerWaalsContact CD1-CD1 3.46Å; F868-I901 HydrophobicContact CD1-CG1 4.5Å; F868-I901 HydrophobicContact CE1-CD1 3.84Å; L869-I901 PolarHBondContact O-N 3.4Å; L871-I901 VanDerWaalsContact CB-C 3.41Å; L871-I901 WeakPolarHBondContact CB-O 3.39Å; L871-I901 PolarHBondContact N-O 2.66Å; L899-I901 HydrophobicContact CD2-CD1 3.81Å; L899-I901 HydrophobicContact CD2-CG1 4.14Å; L899-I901 HydrophobicContact CG-CD1 4.2Å; L899-I901 HydrophobicContact CG-CG1 3.98Å
902	H	94.4	Very high	82.1	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	109.4	166.5	-162.3	76.8	0	0	0	110.3	N716 V717 L871 R873	N716-H902 WeakPolarHBondContact CA-O 3.48Å; V717-H902 PolarHBondContact N-O 2.98Å; V717-H902 PolarHBondContact O-N 2.96Å; L871-H902 HydrophobicContact CB-CB 4.03Å; L871-H902 HydrophobicContact CD2-CB 4.04Å; L871-H902 HydrophobicContact CG-CB 4.32Å; L871-H902 PolarHBondContact O-ND1 3.28Å; R873-H902 WeakPolarHBondContact CG-CE1 3.28Å; R873-H902 PolarHBondContact NE-NE2 2.97Å
903	G	91.5	Very high	81.6	Confident	5 Å²	5	45.9 Å²	45.9	5%	0.052	25%	0.25	C	C	.	.			trans	-92.6	131.4	176.4	0	0	0	0	0	112.2	C761	C761-G903 PolarHBondContact SG-N 3.39Å
904	V	89.3	Confident	81.1	Confident	46 Å²	46	39.1 Å²	39.1	28%	0.279	23%	0.228	S	C	.	.			trans	-114.5	-20.9	175.1	-171.2	0	0	0	0	111.2	I711 N716	I711-V904 HydrophobicContact CG2-CG2 4.32Å; N716-V904 PolarHBondContact OD1-N 3.12Å
905	T	83.5	Confident	80.8	Confident	38 Å²	38	38.7 Å²	38.7	23%	0.233	21%	0.214	C	C	.	.	S	Bend	trans	-96.2	130.5	-176.2	-46.2	0	0	0	0	111	N716 V907	N716-T905 PolarHBondContact ND2-OG1 2.93Å; N716-T905 PolarHBondContact OD1-N 3.23Å; N716-T905 PolarHBondContact OD1-OG1 2.83Å; T905-V907 PolarHBondContact O-N 3.5Å
906	P	83.3	Confident	80.4	Confident	62 Å²	62	40.8 Å²	40.8	40%	0.403	23%	0.226	S	C	.	.			trans	-68.2	126.1	171.6	28.1	-33.1	0	0	0	110.4
907	V	79.9	Confident	79.8	Confident	13 Å²	13	42.9 Å²	42.9	8%	0.079	24%	0.236	C	C	.	.			trans	-112.9	-7.2	-176.8	-68.2	0	0	0	0	114.1	V540 W543 F764 Q767 T905	V540-V907 WeakPolarHBondContact CG1-O 3.33Å; W543-V907 HydrophobicContact CD2-CB 4.43Å; W543-V907 HydrophobicContact CD2-CG1 3.53Å; W543-V907 HydrophobicContact CE3-CB 4.35Å; W543-V907 HydrophobicContact CE3-CG1 3.77Å; W543-V907 HydrophobicContact CG-CG1 4Å; W543-V907 HydrophobicContact CH2-CG1 4.26Å; W543-V907 HydrophobicContact CZ2-CG1 4.08Å; W543-V907 HydrophobicContact CZ3-CG1 4.1Å; F764-V907 HydrophobicContact CB-CG2 4.37Å; F764-V907 HydrophobicContact CD2-CG1 3.64Å; F764-V907 HydrophobicContact CD2-CG2 4.4Å; F764-V907 HydrophobicContact CE2-CG1 4.16Å; Q767-V907 HydrophobicContact CB-CB 4.42Å; Q767-V907 HydrophobicContact CB-CG2 3.74Å; Q767-V907 HydrophobicContact CG-CB 4.18Å; Q767-V907 HydrophobicContact CG-CG2 4.05Å; T905-V907 PolarHBondContact O-N 3.5Å
908	T	72.6	Confident	78.9	Confident	19 Å²	19	45 Å²	45	12%	0.117	25%	0.246	C	C	.	.	S	Bend	trans	-124.9	153.2	176.4	48.9	0	0	0	0	109.8	L812 T910	L812-T908 HydrophobicContact CD1-CG2 4.4Å; L812-T908 HydrophobicContact CD2-CG2 3.69Å; T908-T910 PolarHBondContact O-N 3.34Å
909	Y	61.9	Low	77.7	Confident	117 Å²	117	48.2 Å²	48.2	46%	0.459	26%	0.264	S	S	.	.			trans	-66.9	127.5	175.3	-122.9	-111.7	0	0	0	109.1	H539 D911	H539-Y909 AromaticContact CE1-CE2 3.3Å; H539-Y909 WeakPolarHBondContact CE1-CE2 3.44Å; H539-Y909 AromaticContact CE1-CZ 3.97Å; H539-Y909 AromaticContact NE2-CE2 3.37Å; H539-Y909 WeakPolarHBondContact NE2-CE2 3.5Å; H539-Y909 AromaticContact NE2-CZ 3.65Å; H539-Y909 PolarHBondContact NE2-OH 3.44Å; Y909-D911 HydrophobicContact CD1-CB 4.46Å
910	T	50.7	Low	76.3	Confident	109 Å²	109	51.9 Å²	51.9	67%	0.669	28%	0.284	S	S	*	.	S	Bend	trans	-95.3	21.6	-176.1	50.6	0	0	0	0	113.7	T908 L912	T908-T910 PolarHBondContact O-N 3.34Å; T910-L912 VanDerWaalsContact C-N 3.26Å; T910-L912 PolarHBondContact O-N 3Å
911	D	48.7	Very low	74.6	Confident	140 Å²	140	55.8 Å²	55.8	75%	0.749	31%	0.306	S	S	*	.			trans	-94.1	33.1	169.7	-67.2	-24.3	0	0	0	111.3	Y909	Y909-D911 HydrophobicContact CD1-CB 4.46Å
912	L	44.4	Very low	72.7	Confident	120 Å²	120	60.9 Å²	60.9	63%	0.628	33%	0.334	S	S	*	.			trans	-102.6	0	-168.7	-100.7	178.4	0	0	0	115	L808 K811 L812 T910	L808-L912 HydrophobicContact CD1-CD1 4.33Å; K811-L912 HydrophobicContact CB-CD2 4.33Å; K811-L912 HydrophobicContact CD-CD2 3.3Å; K811-L912 HydrophobicContact CG-CD2 4.39Å; K811-L912 PolarHBondContact NZ-OXT 3.04Å; L812-L912 HydrophobicContact CD2-CD1 4.34Å; T910-L912 VanDerWaalsContact C-N 3.26Å; T910-L912 PolarHBondContact O-N 3Å

Retrieved 912 of 912 residues in 369.1 ms (Link to these results)

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