A0A096NXY4_PAPAN Loading...

Folliculin interacting protein 1

AlphaFold DB , UniProt , Accession A0A096NXY4, Species PAPAN (Papio anubis, Olive baboon), Gene FNIP1, Length 1,166 aa.

						>A0A096NXY4_PAPAN|A0A096NXY4|FNIP1
MAPTLFQKLFSKRTGLGAPGRDARDPDCGFSWPLPEFDPSQIRLIVYQDCERRGRNVLFDSSVKRKNEDISVSKLCSDAQVKVFGKCCQLKPGGDSSSSLDSSVTSSSDIKDQCLKYQGSRCSSDANMLGEMMFGSVAMSYKGSTLKIHQIRSPPQLMLSKVFTARTGSSICGSLNTLQDSLEFINQDNNTLKADNNTVINGLLGNIGLSQFCSPRRAFSEQGPLRLIRSASFFAVHSNPMDMPGRELNEDRDSGIARSASLSSLLITPFPSPNSSLTRSCASSYQRRWRRSQTTSLENGVFPRWSIEESFNLSDESCGPNPGIVRKKKIAIGVIFSLSKDEDENNKFNEFFFSHFPLFESHMNKLKSAIEQAMKMSRRSADASQRSLAYNRIVDALNEFRTTICNLYTMPRIGEPVWLTMMSGTPEKNHLCYRFMKEFTFLMENASKNQFLPALITAVLTNHLAWVPTVMPNGQPPIKIFLEKHSSQSVDMLAKTHPYNPLWAQLGDLYGAIGSPVRLARTVVVGKRQDMVQRLLYFLTYFIRCSELQETHLLENGEDEAIVMPGTVITTTLEKGEIEESEYVLVTMHRNKSSLLFKESEEIRTPSCNCKYCSHPLLGQNVENISQQEREDAQNSSKELLGISDECRMISPSDCQEENAVDVKQYRDKLRTCLDAKLETVVCTGSVPVDKCALSESGLEPTEETWQSEKLLDSDSHTGKAMRSTGMVVEKKPPDKIVPASFSCEAAQTKVTFLIGDSMSPDSDTELRSQAVVDQITRHHTKPLKAERGAVDQHQETKQTTKDQSGESDIQNVVSEEPCELPCWNHSDPESMSLFDEYFNDDSIETRTIDDVPIKTSADSKDHCCMLEFSKILCAKNNKQNNEFCKCIETVPQDSCKTCFPQQDQRDTLSILVPHGDKESSDKKIAVGTEWDIPRNESSDSALGDSESEDTGHDMTRQVSSYYGGEQEDWAEEDEIPFPGSKLIEVSAVQPNIANFGRSLLGGYCSSYVPDFVLQGIGSDERFRQCLTSDLSHAVQHPVLDEPIAEAVCIIADMDKWTVQVASSQRRVTDNKLGKEVLVSSLVSNLLHSTLQLYKHNLSPNFCVMHLEDRLQELYFKSKMLSEYLRGQMRVHVKELGVVLGIESSDLPLLAAVASTHSPYVAQILL
					

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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	38.8	Very low	42	Very low	243 Å²	243	137.3 Å²	137.3	100%	1.197	73%	0.727	S	S	*	*				0	142	0	-73	170	166.6	0	0	108.3
2	A	34.4	Very low	41	Very low	91 Å²	91	144 Å²	144	75%	0.752	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-81.6	139.4	171.1	0	0	0	0	0	109.8
3	P	42.3	Very low	40.4	Very low	104 Å²	104	150.7 Å²	150.7	68%	0.675	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-64.4	135.8	170.5	-18.9	32.1	0	0	0	110.5
4	T	56.2	Low	39.5	Very low	96 Å²	96	150 Å²	150	59%	0.589	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-68.6	151	-179.7	49.8	0	0	0	0	112.1	F6 Q7	T4-F6 PolarHBondContact O-N 3.48Å; T4-Q7 WeakPolarHBondContact O-CB 3.43Å; T4-Q7 PolarHBondContact O-N 3.22Å
5	L	41.3	Very low	38.5	Very low	138 Å²	138	144.9 Å²	144.9	72%	0.723	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.5	-35.8	-177.9	-120.9	163.1	0	0	0	113.7	Q7 K8	L5-Q7 PolarHBondContact O-N 2.89Å; L5-K8 PolarHBondContact O-N 3.44Å; L5-K8 VanDerWaalsContact O-N 3.14Å
6	F	42.3	Very low	38	Very low	157 Å²	157	147.4 Å²	147.4	69%	0.689	78%	0.776	S	S	*	*	H	α-helix	trans	-56.8	-32	176.3	-134.2	-94.9	0	0	0	114	T4 K8 L9 F10	T4-F6 PolarHBondContact O-N 3.48Å; F6-K8 VanDerWaalsContact C-N 3.33Å; F6-K8 PolarHBondContact O-N 3.05Å; F6-L9 PolarHBondContact O-N 3.14Å; F6-F10 HydrophobicContact CD1-CD2 4.43Å; F6-F10 HydrophobicContact CE1-CD2 4.31Å; F6-F10 HydrophobicContact CE1-CE2 4.46Å
7	Q	43.9	Very low	37.3	Very low	128 Å²	128	143.1 Å²	143.1	60%	0.598	77%	0.774	S	S	*	*	H	α-helix	trans	-78.7	-15.2	-177.7	-127.1	175.4	7.6	0	0	113.3	T4 L5	T4-Q7 WeakPolarHBondContact O-CB 3.43Å; T4-Q7 PolarHBondContact O-N 3.22Å; L5-Q7 PolarHBondContact O-N 2.89Å
8	K	44.5	Very low	36.6	Very low	188 Å²	188	140.4 Å²	140.4	82%	0.817	78%	0.775	S	S	*	*	H	α-helix	trans	-82	-23.7	172.1	-79.6	-171.9	172.9	-176.7	0	113.5	L5 F6	L5-K8 PolarHBondContact O-N 3.44Å; L5-K8 VanDerWaalsContact O-N 3.14Å; F6-K8 VanDerWaalsContact C-N 3.33Å; F6-K8 PolarHBondContact O-N 3.05Å
9	L	38.4	Very low	36.2	Very low	117 Å²	117	139.6 Å²	139.6	61%	0.613	78%	0.777	S	S	*	*	H	α-helix	trans	-86.6	-25.2	-172	-71.7	167.7	0	0	0	114.1	F6	F6-L9 PolarHBondContact O-N 3.14Å
10	F	46	Very low	35.8	Very low	151 Å²	151	136.1 Å²	136.1	66%	0.662	77%	0.773	S	S	*	*	S	Bend	trans	-133.7	30.9	-164.8	-63.9	-70.1	0	0	0	115.6	F6	F6-F10 HydrophobicContact CD1-CD2 4.43Å; F6-F10 HydrophobicContact CE1-CD2 4.31Å; F6-F10 HydrophobicContact CE1-CE2 4.46Å
11	S	33.5	Very low	35.4	Very low	97 Å²	97	141.3 Å²	141.3	68%	0.678	78%	0.781	S	S	*	*			trans	-152.8	77.6	-179.9	-77.7	0	0	0	0	116.6
12	K	31	Very low	34.7	Very low	218 Å²	218	137.1 Å²	137.1	95%	0.948	76%	0.763	S	S	*	*			trans	-169.3	137.1	132.6	-114	178.3	-179.6	-176.3	0	113
13	R	32.1	Very low	34.6	Very low	231 Å²	231	137.7 Å²	137.7	87%	0.872	77%	0.768	S	S	*	*			trans	-149.1	123.5	166.1	-169.2	-175.5	-164.6	-169.4	6.2	109.1
14	T	28.5	Very low	34.2	Very low	141 Å²	141	143.8 Å²	143.8	87%	0.865	78%	0.777	S	S	*	*			trans	157.8	138.3	139.2	37.8	0	0	0	0	112.1
15	G	24.7	Very low	32.7	Very low	74 Å²	74	145.7 Å²	145.7	76%	0.763	78%	0.784	S	S	*	*			trans	80.2	134.6	170.6	0	0	0	0	0	115.7
16	L	30	Very low	32.1	Very low	185 Å²	185	144.9 Å²	144.9	97%	0.969	79%	0.787	S	S	*	*			cis	-151.5	130.6	-8.1	-111.4	166.1	0	0	0	108
17	G	25.6	Very low	31.5	Very low	73 Å²	73	143.3 Å²	143.3	75%	0.753	79%	0.786	S	S	*	*			trans	178.9	137.6	179.4	0	0	0	0	0	110.2
18	A	26.3	Very low	31	Very low	95 Å²	95	142 Å²	142	79%	0.785	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-74.4	147.9	-179	0	0	0	0	0	111.2	G20	A18-G20 PolarHBondContact O-N 3.36Å
19	P	29.1	Very low	30.5	Very low	126 Å²	126	134.7 Å²	134.7	82%	0.818	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.4	171.9	28.2	-33.2	0	0	0	109.7
20	G	27.6	Very low	30.7	Very low	68 Å²	68	134 Å²	134	70%	0.701	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-62.7	143.8	162	0	0	0	0	0	109.2	A18	A18-G20 PolarHBondContact O-N 3.36Å
21	R	27.3	Very low	30.8	Very low	246 Å²	246	129.6 Å²	129.6	93%	0.928	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-64.9	138.6	175.7	-76.6	-172.9	172.6	-154.2	-1.2	110.3	A23	R21-A23 PolarHBondContact O-N 3.31Å
22	D	24.3	Very low	31.9	Very low	155 Å²	155	127.4 Å²	127.4	83%	0.829	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-59.9	117.2	171.4	-62.8	-82.9	0	0	0	111	R24	D22-R24 VanDerWaalsContact C-N 3.33Å; D22-R24 PolarHBondContact O-N 2.65Å; D22-R24 VanDerWaalsContact O-N 3.17Å
23	A	32.5	Very low	32.8	Very low	103 Å²	103	121.3 Å²	121.3	85%	0.851	71%	0.708	S	S	*	*	S	Bend	trans	-85.1	75.9	170.1	0	0	0	0	0	109.6	R21	R21-A23 PolarHBondContact O-N 3.31Å
24	R	33	Very low	33.8	Very low	232 Å²	232	116.7 Å²	116.7	88%	0.875	70%	0.7	S	S	*	*			trans	-163.7	57.4	164.7	-118.2	-171.6	-57.9	-161.4	5.5	114	D22	D22-R24 VanDerWaalsContact C-N 3.33Å; D22-R24 PolarHBondContact O-N 2.65Å; D22-R24 VanDerWaalsContact O-N 3.17Å
25	D	24.1	Very low	35.2	Very low	137 Å²	137	110.8 Å²	110.8	73%	0.733	66%	0.664	S	S	*	*			trans	-77.1	135.7	153.7	-88.8	-44.4	0	0	0	109.1	D27	D25-D27 VanDerWaalsContact C-N 3.27Å; D25-D27 PolarHBondContact O-N 3.21Å
26	P	29.4	Very low	36.7	Very low	121 Å²	121	116.5 Å²	116.5	79%	0.786	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-2.2	179.6	32.3	-35.6	0	0	0	114.4
27	D	29.8	Very low	38.6	Very low	124 Å²	124	108.7 Å²	108.7	66%	0.663	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	3.8	-172.1	-85.7	-51.7	0	0	0	115.3	D25 G29	D25-D27 VanDerWaalsContact C-N 3.27Å; D25-D27 PolarHBondContact O-N 3.21Å; D27-G29 PolarHBondContact O-N 2.93Å; D27-G29 VanDerWaalsContact O-N 3.12Å
28	C	34.3	Very low	40.8	Very low	99 Å²	99	108.9 Å²	108.9	67%	0.669	61%	0.613	S	S	*	*			trans	-89.5	60	-172.7	-164	0	0	0	0	114.5	F30	C28-F30 VanDerWaalsContact C-N 3.26Å; C28-F30 PolarHBondContact O-N 2.99Å
29	G	33.7	Very low	43.1	Very low	36 Å²	36	107 Å²	107	37%	0.371	59%	0.592	S	S	.	*			trans	-74.4	54.2	-178.3	0	0	0	0	0	116.4	D27 G414	D27-G29 PolarHBondContact O-N 2.93Å; D27-G29 VanDerWaalsContact O-N 3.12Å; G29-G414 PolarHBondContact O-N 3.15Å
30	F	42.2	Very low	45.1	Very low	102 Å²	102	104.7 Å²	104.7	45%	0.447	58%	0.579	S	S	.	*			trans	-118.3	90	179.8	-63.5	-70.9	0	0	0	111.5	C28 W32	C28-F30 VanDerWaalsContact C-N 3.26Å; C28-F30 PolarHBondContact O-N 2.99Å; F30-W32 VanDerWaalsContact C-N 3.32Å; F30-W32 PolarHBondContact O-N 3.39Å
31	S	46.9	Very low	47.7	Very low	58 Å²	58	103.9 Å²	103.9	41%	0.406	56%	0.557	S	S	.	*			trans	-88	31.6	-171.5	54	0	0	0	0	115.4	G414	S31-G414 VanDerWaalsContact OG-CA 3.25Å; S31-G414 WeakPolarHBondContact OG-CA 3.3Å
32	W	56.8	Low	50.7	Low	52 Å²	52	92.1 Å²	92.1	20%	0.197	51%	0.513	C	S	.	.	S	Bend	trans	-130.3	113.5	166.5	-167.4	-119	0	0	0	109.5	F30 L34 P35 K347 Y408 R412 I993	F30-W32 VanDerWaalsContact C-N 3.32Å; F30-W32 PolarHBondContact O-N 3.39Å; W32-L34 PolarHBondContact O-N 3.22Å; W32-P35 HydrophobicContact CZ2-CG 4.27Å; W32-K347 HydrophobicContact CH2-CB 4.43Å; W32-Y408 HydrophobicContact CZ2-CD2 4.43Å; W32-Y408 AromaticContact CZ2-CE2 3.76Å; W32-Y408 HydrophobicContact CZ2-CE2 3.76Å; W32-Y408 PolarHBondContact NE1-O 2.88Å; W32-R412 VanDerWaalsContact CE2-NH1 3.31Å; W32-R412 VanDerWaalsContact CG-NH1 3.33Å; W32-R412 VanDerWaalsContact NE1-NH1 3.11Å; W32-I993 HydrophobicContact CB-CD1 3.86Å; W32-I993 HydrophobicContact CD2-CD1 3.82Å; W32-I993 HydrophobicContact CE3-CB 4.3Å; W32-I993 HydrophobicContact CE3-CD1 3.39Å; W32-I993 HydrophobicContact CE3-CG1 4.41Å; W32-I993 HydrophobicContact CE3-CG2 4.36Å; W32-I993 HydrophobicContact CG-CD1 4.07Å; W32-I993 HydrophobicContact CH2-CG2 4.33Å; W32-I993 HydrophobicContact CZ3-CB 4.15Å; W32-I993 HydrophobicContact CZ3-CD1 4.11Å; W32-I993 HydrophobicContact CZ3-CG2 4.17Å
33	P	51	Low	53.8	Low	90 Å²	90	85.9 Å²	85.9	58%	0.584	48%	0.478	S	S	*	.			trans	-64.6	132.5	169.2	29.2	-32.4	0	0	0	108.1	P35	P33-P35 WeakPolarHBondContact O-CD 3.33Å; P33-P35 WeakPolarHBondContact O-CG 3.41Å; P33-P35 VanDerWaalsContact O-N 3.14Å
34	L	52.8	Low	56.7	Low	134 Å²	134	81 Å²	81	70%	0.702	44%	0.437	S	S	*	.			trans	-63.3	107.2	178.2	-76.3	156.7	0	0	0	110	W32 T409	W32-L34 PolarHBondContact O-N 3.22Å; L34-T409 WeakPolarHBondContact CD2-O 3.45Å
35	P	57.4	Low	59.4	Low	17 Å²	17	70 Å²	70	11%	0.11	40%	0.396	C	S	.	.			trans	-80.5	139.3	179.6	-7.7	27.9	0	0	0	109	W32 P33 F37 Y408	W32-P35 HydrophobicContact CZ2-CG 4.27Å; P33-P35 WeakPolarHBondContact O-CD 3.33Å; P33-P35 WeakPolarHBondContact O-CG 3.41Å; P33-P35 VanDerWaalsContact O-N 3.14Å; P35-F37 PolarHBondContact O-N 3.17Å; P35-Y408 HydrophobicContact CB-CE1 3.73Å; P35-Y408 HydrophobicContact CG-CD1 4.36Å; P35-Y408 HydrophobicContact CG-CE1 3.7Å
36	E	57.3	Low	62.6	Low	194 Å²	194	63.5 Å²	63.5	91%	0.907	36%	0.361	S	S	*	.			trans	-77.1	64	179.5	-66.8	-163.6	165.9	0	0	112.3	D38	E36-D38 PolarHBondContact O-N 3.2Å
37	F	68.8	Low	65.4	Low	21 Å²	21	58 Å²	58	9%	0.092	32%	0.324	C	S	.	.			trans	-84.9	95.9	177.7	-171.9	-100.5	0	0	0	111	P35 Q41 I42 F336 F348 I404 C405 Y408 T409	P35-F37 PolarHBondContact O-N 3.17Å; F37-Q41 VanDerWaalsContact CD2-OE1 3.27Å; F37-I42 HydrophobicContact CE1-CD1 3.98Å; F37-I42 HydrophobicContact CE1-CG1 4.33Å; F37-I42 HydrophobicContact CZ-CD1 4.13Å; F37-I42 HydrophobicContact CZ-CG1 4.08Å; F37-F336 HydrophobicContact CZ-CD1 4.19Å; F37-F348 HydrophobicContact CD2-CD2 4.2Å; F37-F348 HydrophobicContact CD2-CE2 4.09Å; F37-F348 AromaticContact CE2-CD2 3.97Å; F37-F348 HydrophobicContact CE2-CD2 3.97Å; F37-F348 AromaticContact CE2-CE2 3.49Å; F37-F348 HydrophobicContact CE2-CE2 3.49Å; F37-F348 VanDerWaalsContact CE2-CE2 3.49Å; F37-F348 HydrophobicContact CE2-CZ 4.02Å; F37-F348 AromaticContact CZ-CE2 3.73Å; F37-F348 HydrophobicContact CZ-CE2 3.73Å; F37-F348 HydrophobicContact CZ-CZ 4.11Å; F37-I404 HydrophobicContact CE1-CG2 4.27Å; F37-C405 HydrophobicContact CD1-CB 4.21Å; F37-C405 VanDerWaalsContact CD1-SG 3.55Å; F37-C405 VanDerWaalsContact CE1-SG 3.55Å; F37-Y408 HydrophobicContact CB-CD1 3.7Å; F37-Y408 HydrophobicContact CB-CE1 3.99Å; F37-Y408 HydrophobicContact CD1-CD1 4.34Å; F37-Y408 HydrophobicContact CD2-CD1 4.37Å; F37-Y408 HydrophobicContact CD2-CE1 4.43Å; F37-Y408 AromaticContact CG-CD1 3.89Å; F37-Y408 HydrophobicContact CG-CD1 3.89Å; F37-Y408 HydrophobicContact CG-CE1 4.29Å; F37-T409 HydrophobicContact CB-CG2 4.16Å
38	D	71.6	Confident	68	Low	77 Å²	77	53.2 Å²	53.2	41%	0.412	30%	0.298	S	S	.	.			trans	-77.1	126.4	-178.1	171.9	12.2	0	0	0	112	E36 S40 Q41	E36-D38 PolarHBondContact O-N 3.2Å; D38-S40 VanDerWaalsContact CG-OG 3.27Å; D38-S40 PolarHBondContact O-N 3.26Å; D38-S40 WeakPolarHBondContact OD1-CB 3.42Å; D38-S40 PolarHBondContact OD1-N 3.11Å; D38-S40 VanDerWaalsContact OD2-CB 3.22Å; D38-S40 WeakPolarHBondContact OD2-CB 3.49Å; D38-S40 PolarHBondContact OD2-OG 2.79Å; D38-Q41 HydrophobicContact CB-CG 4.23Å; D38-Q41 VanDerWaalsContact O-CB 3.29Å; D38-Q41 WeakPolarHBondContact O-CB 3.18Å; D38-Q41 WeakPolarHBondContact O-CG 3.35Å; D38-Q41 PolarHBondContact O-N 2.85Å
39	P	74.1	Confident	70.2	Confident	54 Å²	54	49.6 Å²	49.6	35%	0.351	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-43.1	-26.8	168	-32	35	0	0	0	116.6	Q41 R401 C405	P39-Q41 VanDerWaalsContact C-N 3.3Å; P39-Q41 PolarHBondContact O-N 2.8Å; P39-R401 HydrophobicContact CB-CB 4.24Å; P39-R401 WeakPolarHBondContact O-CD 3.4Å; P39-R401 PolarHBondContact O-NE 3.01Å; P39-R401 VanDerWaalsContact O-NE 3.12Å; P39-C405 HydrophobicContact CG-CB 4.26Å
40	S	72.5	Confident	71.9	Confident	78 Å²	78	49 Å²	49	55%	0.545	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-68	-25.4	177.4	91.6	0	0	0	0	113.9	D38 I42	D38-S40 VanDerWaalsContact CG-OG 3.27Å; D38-S40 PolarHBondContact O-N 3.26Å; D38-S40 WeakPolarHBondContact OD1-CB 3.42Å; D38-S40 PolarHBondContact OD1-N 3.11Å; D38-S40 VanDerWaalsContact OD2-CB 3.22Å; D38-S40 WeakPolarHBondContact OD2-CB 3.49Å; D38-S40 PolarHBondContact OD2-OG 2.79Å; S40-I42 PolarHBondContact O-N 2.87Å
41	Q	82.5	Confident	72.9	Confident	51 Å²	51	50.1 Å²	50.1	24%	0.238	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-64.6	-26.1	-179.5	-64.7	172.7	8.7	0	0	112.7	F37 D38 P39 S337	F37-Q41 VanDerWaalsContact CD2-OE1 3.27Å; D38-Q41 HydrophobicContact CB-CG 4.23Å; D38-Q41 VanDerWaalsContact O-CB 3.29Å; D38-Q41 WeakPolarHBondContact O-CB 3.18Å; D38-Q41 WeakPolarHBondContact O-CG 3.35Å; D38-Q41 PolarHBondContact O-N 2.85Å; P39-Q41 VanDerWaalsContact C-N 3.3Å; P39-Q41 PolarHBondContact O-N 2.8Å; Q41-S337 VanDerWaalsContact O-CB 3.28Å; Q41-S337 WeakPolarHBondContact O-CB 3.39Å; Q41-S337 PolarHBondContact O-N 2.67Å; Q41-S337 PolarHBondContact O-OG 3.16Å
42	I	89.3	Confident	73.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.6	178.2	-57.1	175.5	0	0	0	109.9	F37 S40 V334 I335 F336 F400 R401 I404	F37-I42 HydrophobicContact CE1-CD1 3.98Å; F37-I42 HydrophobicContact CE1-CG1 4.33Å; F37-I42 HydrophobicContact CZ-CD1 4.13Å; F37-I42 HydrophobicContact CZ-CG1 4.08Å; S40-I42 PolarHBondContact O-N 2.87Å; I42-V334 HydrophobicContact CG2-CG1 3.86Å; I42-I335 WeakPolarHBondContact CA-O 3.33Å; I42-F336 HydrophobicContact CD1-CD1 4.24Å; I42-F336 HydrophobicContact CD1-CE1 3.97Å; I42-F336 HydrophobicContact CG1-CD1 3.81Å; I42-F336 HydrophobicContact CG1-CE1 3.99Å; I42-F400 HydrophobicContact CG2-CD1 4.3Å; I42-F400 HydrophobicContact CG2-CE1 4.09Å; I42-R401 HydrophobicContact CB-CG 3.95Å; I42-R401 HydrophobicContact CD1-CG 4.18Å; I42-R401 HydrophobicContact CG2-CG 4.21Å; I42-R401 PolarHBondContact O-NE 2.94Å; I42-R401 VanDerWaalsContact O-NE 3.07Å; I42-R401 PolarHBondContact O-NH2 3.32Å; I42-I404 HydrophobicContact CD1-CB 4.24Å; I42-I404 HydrophobicContact CD1-CG2 4.19Å
43	R	90.4	Very high	73.6	Confident	24 Å²	24	64.6 Å²	64.6	9%	0.091	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	143.6	172.1	177.2	-178	176.7	-162.8	-0.2	111	I45 D60 S61 S62 S123 D125 V334 I335	R43-I45 HydrophobicContact CG-CG1 4.25Å; R43-D60 IonicContact CZ-OD1 3.66Å; R43-D60 IonicContact CZ-OD2 2.73Å; R43-D60 IonicContact NE-OD1 2.75Å; R43-D60 PolarHBondContact NE-OD1 3.37Å; R43-D60 IonicContact NE-OD2 2.85Å; R43-D60 IonicContact NH2-OD1 2.63Å; R43-D60 IonicContact NH2-OD2 2.68Å; R43-D60 PolarHBondContact NH2-OD2 2.96Å; R43-S61 WeakPolarHBondContact CA-OG 3.28Å; R43-S62 PolarHBondContact NE-OG 3.42Å; R43-S62 PolarHBondContact NH2-OG 2.63Å; R43-S123 PolarHBondContact NH2-OG 2.85Å; R43-D125 IonicContact CZ-OD1 3.21Å; R43-D125 IonicContact CZ-OD2 2.77Å; R43-D125 IonicContact NH1-OD1 3.6Å; R43-D125 PolarHBondContact NH1-OD1 3.15Å; R43-D125 IonicContact NH1-OD2 3.49Å; R43-D125 PolarHBondContact NH1-OD2 3.49Å; R43-D125 IonicContact NH2-OD1 2.86Å; R43-D125 PolarHBondContact NH2-OD1 3.35Å; R43-D125 IonicContact NH2-OD2 2.86Å; R43-V334 CarbonylContact O-C 3.5Å; R43-V334 WeakPolarHBondContact O-CA 3.36Å; R43-I335 HydrophobicContact CB-CB 4.36Å; R43-I335 PolarHBondContact N-O 3.45Å; R43-I335 PolarHBondContact O-N 3.42Å
44	L	91.9	Very high	74.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.1	172	166.4	68.2	0	0	0	110	V46 F59 D60 S61 I332 G333 V334 L366 I370 I393 L397	L44-V46 HydrophobicContact CD1-CG2 3.98Å; L44-V46 HydrophobicContact CD2-CG2 4.43Å; L44-V46 HydrophobicContact CG-CG2 4.19Å; L44-F59 HydrophobicContact CB-CE1 4.36Å; L44-F59 HydrophobicContact CD2-CD1 4.05Å; L44-F59 HydrophobicContact CD2-CE1 3.82Å; L44-F59 HydrophobicContact CG-CD1 4.09Å; L44-F59 HydrophobicContact CG-CE1 4.07Å; L44-D60 WeakPolarHBondContact O-CA 3.3Å; L44-S61 PolarHBondContact N-OG 3.36Å; L44-S61 PolarHBondContact O-N 3.16Å; L44-I332 HydrophobicContact CD1-CG2 3.73Å; L44-G333 WeakPolarHBondContact CA-O 3.43Å; L44-V334 HydrophobicContact CD1-CG2 4.43Å; L44-L366 HydrophobicContact CD1-CD2 4.34Å; L44-L366 HydrophobicContact CD2-CD1 4.48Å; L44-I370 HydrophobicContact CD1-CD1 4.34Å; L44-I370 HydrophobicContact CD2-CD1 3.97Å; L44-I393 HydrophobicContact CD2-CG2 4.18Å; L44-L397 HydrophobicContact CB-CD1 3.54Å; L44-L397 HydrophobicContact CB-CD2 3.92Å; L44-L397 HydrophobicContact CB-CG 4.27Å; L44-L397 HydrophobicContact CD2-CB 4.08Å; L44-L397 HydrophobicContact CD2-CD1 4.15Å; L44-L397 HydrophobicContact CD2-CD2 4.35Å; L44-L397 HydrophobicContact CD2-CG 4.42Å; L44-L397 HydrophobicContact CG-CD1 4.46Å
45	I	91.3	Very high	75.9	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	138.2	170.3	-42.5	178.5	0	0	0	108.8	R43 Y47 V57 F59 D60 L129 G333 I335	R43-I45 HydrophobicContact CG-CG1 4.25Å; I45-Y47 HydrophobicContact CB-CE2 4.02Å; I45-Y47 HydrophobicContact CG2-CD2 4Å; I45-Y47 HydrophobicContact CG2-CE2 3.33Å; I45-V57 HydrophobicContact CG2-CG1 4.24Å; I45-F59 CarbonylContact C-O 3.53Å; I45-F59 WeakPolarHBondContact CA-O 3.45Å; I45-F59 WeakPolarHBondContact CG2-O 3.3Å; I45-D60 HydrophobicContact CG2-CB 4.28Å; I45-L129 HydrophobicContact CD1-CD1 3.54Å; I45-G333 PolarHBondContact N-O 3.5Å; I45-G333 PolarHBondContact O-N 2.97Å; I45-I335 HydrophobicContact CD1-CD1 3.79Å; I45-I335 HydrophobicContact CG1-CD1 4.34Å
46	V	90.1	Very high	77.1	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	122	176.5	-170.3	0	0	0	0	109.8	L44 L58 F59 I330 A331 I332 I370 M374	L44-V46 HydrophobicContact CD1-CG2 3.98Å; L44-V46 HydrophobicContact CD2-CG2 4.43Å; L44-V46 HydrophobicContact CG-CG2 4.19Å; V46-L58 PolarHBondContact O-N 2.68Å; V46-F59 HydrophobicContact CB-CB 4.11Å; V46-F59 HydrophobicContact CG2-CB 4.12Å; V46-F59 HydrophobicContact CG2-CD1 4.46Å; V46-F59 PolarHBondContact N-O 3.1Å; V46-F59 PolarHBondContact O-N 3.27Å; V46-I330 HydrophobicContact CG1-CG2 4.1Å; V46-A331 WeakPolarHBondContact CA-O 3.1Å; V46-I332 HydrophobicContact CG1-CG1 4.25Å; V46-I332 HydrophobicContact CG2-CG1 4.39Å; V46-I370 HydrophobicContact CG2-CD1 4.18Å; V46-M374 HydrophobicContact CG1-CE 3.57Å
47	Y	88.1	Confident	78.4	Confident	5 Å²	5	55.4 Å²	55.4	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	149.5	177.3	-67.3	-97.2	0	0	0	112	I45 N56 V57 A126 M133 F134 I330 A331	I45-Y47 HydrophobicContact CB-CE2 4.02Å; I45-Y47 HydrophobicContact CG2-CD2 4Å; I45-Y47 HydrophobicContact CG2-CE2 3.33Å; Y47-N56 WeakPolarHBondContact CA-O 3.4Å; Y47-V57 HydrophobicContact CD1-CG2 4.03Å; Y47-V57 HydrophobicContact CE1-CG2 3.56Å; Y47-A126 WeakPolarHBondContact CE1-O 3.48Å; Y47-A126 WeakPolarHBondContact OH-CA 3.48Å; Y47-A126 PolarHBondContact OH-O 3.36Å; Y47-M133 HydrophobicContact CD2-CE 4.03Å; Y47-M133 HydrophobicContact CD2-SD 3.69Å; Y47-M133 HydrophobicContact CE2-CE 4.46Å; Y47-M133 HydrophobicContact CE2-SD 3.6Å; Y47-F134 HydrophobicContact CG-CE2 4.19Å; Y47-I330 WeakPolarHBondContact O-CA 3.48Å; Y47-A331 PolarHBondContact N-O 3.44Å; Y47-A331 PolarHBondContact O-N 2.92Å
48	Q	85.4	Confident	79	Confident	25 Å²	25	58.1 Å²	58.1	12%	0.117	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	114.9	160.8	-168.7	-174	-95.2	0	0	108.8	C50 N56 L58 K328 K329	Q48-C50 PolarHBondContact NE2-SG 3.31Å; Q48-N56 PolarHBondContact N-O 2.97Å; Q48-N56 PolarHBondContact O-N 3.01Å; Q48-L58 HydrophobicContact CB-CD1 3.8Å; Q48-L58 HydrophobicContact CB-CD2 4.18Å; Q48-L58 HydrophobicContact CB-CG 3.9Å; Q48-K328 HydrophobicContact CG-CB 4.49Å; Q48-K329 WeakPolarHBondContact CA-O 3.27Å
49	D	81.1	Confident	79.7	Confident	22 Å²	22	54.9 Å²	54.9	12%	0.118	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	133	168.9	174.7	37	0	0	0	109.7	R55 F134 K329	D49-R55 HydrophobicContact CB-CG 4.25Å; D49-F134 HydrophobicContact CB-CD1 4.12Å; D49-F134 HydrophobicContact CB-CD2 4.48Å; D49-F134 HydrophobicContact CB-CE1 3.62Å; D49-F134 HydrophobicContact CB-CE2 4.02Å; D49-F134 HydrophobicContact CB-CZ 3.56Å; D49-K329 HydrophobicContact CB-CB 4.21Å; D49-K329 PolarHBondContact N-O 2.75Å; D49-K329 PolarHBondContact O-N 3.05Å
50	C	67.9	Low	80.2	Confident	23 Å²	23	52.7 Å²	52.7	16%	0.155	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	106.2	-179.3	-76.3	0	0	0	0	108	Q48 R52 R53 G54	Q48-C50 PolarHBondContact NE2-SG 3.31Å; C50-R52 PolarHBondContact O-N 2.84Å; C50-R53 HydrophobicContact CB-CB 4.19Å; C50-R53 CarbonylContact O-C 3.58Å; C50-R53 PolarHBondContact O-N 3.33Å; C50-G54 PolarHBondContact N-O 3.46Å; C50-G54 VanDerWaalsContact N-O 3.16Å; C50-G54 PolarHBondContact O-N 3.03Å
51	E	64.8	Low	80.7	Confident	126 Å²	126	50.6 Å²	50.6	59%	0.589	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-18.6	-174.7	-57	177.5	158.6	0	0	115.9	R326	E51-R326 VanDerWaalsContact OE2-CD 3.25Å; E51-R326 WeakPolarHBondContact OE2-CD 3.12Å; E51-R326 WeakPolarHBondContact OE2-CG 3.44Å; E51-R326 IonicContact OE2-NE 3.59Å
52	R	57.2	Low	80.3	Confident	199 Å²	199	50.7 Å²	50.7	75%	0.751	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-9.5	178	-68.6	-175.4	170.8	-167.4	-3.5	115.6	C50	C50-R52 PolarHBondContact O-N 2.84Å
53	R	61.3	Low	79.3	Confident	215 Å²	215	52.6 Å²	52.6	81%	0.811	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	8.6	-175.6	-67.3	-169.4	179.9	-175.6	1.2	113.4	C50 N56	C50-R53 HydrophobicContact CB-CB 4.19Å; C50-R53 CarbonylContact O-C 3.58Å; C50-R53 PolarHBondContact O-N 3.33Å; R53-N56 PolarHBondContact O-ND2 3.11Å; R53-N56 VanDerWaalsContact O-ND2 3.13Å
54	G	71.8	Confident	77.2	Confident	39 Å²	39	60.4 Å²	60.4	40%	0.402	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68.4	-168.9	-175.4	0	0	0	0	0	113.7	C50 N56	C50-G54 PolarHBondContact N-O 3.46Å; C50-G54 VanDerWaalsContact N-O 3.16Å; C50-G54 PolarHBondContact O-N 3.03Å; G54-N56 PolarHBondContact O-ND2 3.04Å
55	R	79.9	Confident	75.1	Confident	84 Å²	84	66.3 Å²	66.3	32%	0.317	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	129.2	176.9	-64.5	166.5	-175.3	150.8	-0.2	109.4	D49 F134 G135	D49-R55 HydrophobicContact CB-CG 4.25Å; R55-F134 HydrophobicContact CG-CD2 4.02Å; R55-F134 HydrophobicContact CG-CE2 4.22Å; R55-G135 PolarHBondContact NH2-O 3.37Å
56	N	82.2	Confident	72.3	Confident	72 Å²	72	76.2 Å²	76.2	39%	0.385	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.6	-179.3	-71.5	-103.6	0	0	0	109	Y47 Q48 R53 G54 L58	Y47-N56 WeakPolarHBondContact CA-O 3.4Å; Q48-N56 PolarHBondContact N-O 2.97Å; Q48-N56 PolarHBondContact O-N 3.01Å; R53-N56 PolarHBondContact O-ND2 3.11Å; R53-N56 VanDerWaalsContact O-ND2 3.13Å; G54-N56 PolarHBondContact O-ND2 3.04Å; N56-L58 PolarHBondContact O-N 2.82Å
57	V	84.8	Confident	69.5	Low	48 Å²	48	81.9 Å²	81.9	29%	0.291	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	125.7	171.1	-179.1	0	0	0	0	108.3	I45 Y47 F59 D60 A126	I45-V57 HydrophobicContact CG2-CG1 4.24Å; Y47-V57 HydrophobicContact CD1-CG2 4.03Å; Y47-V57 HydrophobicContact CE1-CG2 3.56Å; V57-F59 WeakPolarHBondContact CG1-O 3.45Å; V57-D60 HydrophobicContact CG1-CB 4.21Å; V57-A126 HydrophobicContact CG2-CB 4.28Å
58	L	82.2	Confident	66.6	Low	78 Å²	78	89.9 Å²	89.9	41%	0.408	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-32.1	172	-63.7	-173.4	0	0	0	112.2	V46 Q48 N56 M374	V46-L58 PolarHBondContact O-N 2.68Å; Q48-L58 HydrophobicContact CB-CD1 3.8Å; Q48-L58 HydrophobicContact CB-CD2 4.18Å; Q48-L58 HydrophobicContact CB-CG 3.9Å; N56-L58 PolarHBondContact O-N 2.82Å; L58-M374 HydrophobicContact CD1-CE 3.51Å; L58-M374 HydrophobicContact CD1-SD 4.11Å
59	F	84.4	Confident	63.8	Low	8 Å²	8	95.7 Å²	95.7	4%	0.035	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	143.1	-178	-178.2	-86.5	0	0	0	110.1	L44 I45 V46 V57 Y390 I393 V394 L397	L44-F59 HydrophobicContact CB-CE1 4.36Å; L44-F59 HydrophobicContact CD2-CD1 4.05Å; L44-F59 HydrophobicContact CD2-CE1 3.82Å; L44-F59 HydrophobicContact CG-CD1 4.09Å; L44-F59 HydrophobicContact CG-CE1 4.07Å; I45-F59 CarbonylContact C-O 3.53Å; I45-F59 WeakPolarHBondContact CA-O 3.45Å; I45-F59 WeakPolarHBondContact CG2-O 3.3Å; V46-F59 HydrophobicContact CB-CB 4.11Å; V46-F59 HydrophobicContact CG2-CB 4.12Å; V46-F59 HydrophobicContact CG2-CD1 4.46Å; V46-F59 PolarHBondContact N-O 3.1Å; V46-F59 PolarHBondContact O-N 3.27Å; V57-F59 WeakPolarHBondContact CG1-O 3.45Å; F59-Y390 AromaticContact CD2-CD2 3.84Å; F59-Y390 HydrophobicContact CD2-CD2 3.84Å; F59-Y390 AromaticContact CD2-CE2 3.47Å; F59-Y390 HydrophobicContact CD2-CE2 3.47Å; F59-Y390 VanDerWaalsContact CD2-CE2 3.47Å; F59-Y390 HydrophobicContact CE2-CD2 4.06Å; F59-Y390 HydrophobicContact CE2-CE1 4.09Å; F59-Y390 AromaticContact CE2-CE2 3.55Å; F59-Y390 HydrophobicContact CE2-CE2 3.55Å; F59-Y390 AromaticContact CE2-CZ 3.57Å; F59-I393 HydrophobicContact CD1-CG2 4Å; F59-I393 HydrophobicContact CD2-CB 4.25Å; F59-I393 HydrophobicContact CD2-CG2 3.63Å; F59-I393 HydrophobicContact CE1-CG2 4.01Å; F59-I393 HydrophobicContact CE2-CB 4.15Å; F59-I393 HydrophobicContact CE2-CG2 3.63Å; F59-I393 HydrophobicContact CG-CG2 3.82Å; F59-I393 HydrophobicContact CZ-CG2 3.83Å; F59-V394 HydrophobicContact CE2-CG2 3.79Å; F59-V394 HydrophobicContact CZ-CG2 3.91Å; F59-L397 HydrophobicContact CE1-CD2 4.23Å; F59-L397 HydrophobicContact CZ-CD2 4.42Å
60	D	85	Confident	61.4	Low	8 Å²	8	101.1 Å²	101.1	4%	0.043	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	124.1	169.6	-179.6	-13.7	0	0	0	108.2	R43 L44 I45 V57 S62 V63 S123	R43-D60 IonicContact CZ-OD1 3.66Å; R43-D60 IonicContact CZ-OD2 2.73Å; R43-D60 IonicContact NE-OD1 2.75Å; R43-D60 PolarHBondContact NE-OD1 3.37Å; R43-D60 IonicContact NE-OD2 2.85Å; R43-D60 IonicContact NH2-OD1 2.63Å; R43-D60 IonicContact NH2-OD2 2.68Å; R43-D60 PolarHBondContact NH2-OD2 2.96Å; L44-D60 WeakPolarHBondContact O-CA 3.3Å; I45-D60 HydrophobicContact CG2-CB 4.28Å; V57-D60 HydrophobicContact CG1-CB 4.21Å; D60-S62 VanDerWaalsContact C-N 3.31Å; D60-S62 PolarHBondContact O-N 3.4Å; D60-S62 WeakPolarHBondContact OD1-CB 3.29Å; D60-S62 PolarHBondContact OD1-N 3.39Å; D60-S62 PolarHBondContact OD1-OG 3.45Å; D60-S62 PolarHBondContact OD2-OG 2.79Å; D60-S62 VanDerWaalsContact OD2-OG 3.11Å; D60-V63 HydrophobicContact CB-CG2 3.85Å; D60-S123 PolarHBondContact OD2-OG 3.1Å
61	S	84.3	Confident	59.4	Low	34 Å²	34	105.5 Å²	105.5	24%	0.238	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-13.6	-178.7	62.2	0	0	0	0	114.7	R43 L44 V63 L397	R43-S61 WeakPolarHBondContact CA-OG 3.28Å; L44-S61 PolarHBondContact N-OG 3.36Å; L44-S61 PolarHBondContact O-N 3.16Å; S61-V63 VanDerWaalsContact C-N 3.28Å; S61-L397 VanDerWaalsContact CB-CD2 3.41Å
62	S	72.8	Confident	57.7	Low	53 Å²	53	105.9 Å²	105.9	37%	0.371	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-17.6	175.7	70.7	0	0	0	0	113.4	R43 D60 K64	R43-S62 PolarHBondContact NE-OG 3.42Å; R43-S62 PolarHBondContact NH2-OG 2.63Å; D60-S62 VanDerWaalsContact C-N 3.31Å; D60-S62 PolarHBondContact O-N 3.4Å; D60-S62 WeakPolarHBondContact OD1-CB 3.29Å; D60-S62 PolarHBondContact OD1-N 3.39Å; D60-S62 PolarHBondContact OD1-OG 3.45Å; D60-S62 PolarHBondContact OD2-OG 2.79Å; D60-S62 VanDerWaalsContact OD2-OG 3.11Å; S62-K64 VanDerWaalsContact C-N 3.34Å; S62-K64 PolarHBondContact O-N 2.81Å
63	V	68.3	Low	56.2	Low	41 Å²	41	101.4 Å²	101.4	25%	0.248	53%	0.525	C	S	.	.	S	Bend	trans	-75.5	85.1	-176.6	-177.5	0	0	0	0	109.7	D60 S61 R65	D60-V63 HydrophobicContact CB-CG2 3.85Å; S61-V63 VanDerWaalsContact C-N 3.28Å; V63-R65 PolarHBondContact O-N 2.81Å
64	K	47.5	Very low	54.5	Low	187 Å²	187	100.3 Å²	100.3	81%	0.813	53%	0.526	S	S	*	.			trans	-51.5	113.4	173.9	-70.2	-170.8	177.4	-174.5	0	110	S62	S62-K64 VanDerWaalsContact C-N 3.34Å; S62-K64 PolarHBondContact O-N 2.81Å
65	R	46.5	Very low	52.5	Low	124 Å²	124	105.6 Å²	105.6	47%	0.468	54%	0.544	S	S	.	.			trans	-62.2	136.9	162.3	-69.1	-176	176.5	-171.9	-1	108	V63 N67	V63-R65 PolarHBondContact O-N 2.81Å; R65-N67 VanDerWaalsContact C-N 3.33Å; R65-N67 PolarHBondContact O-N 3.02Å; R65-N67 VanDerWaalsContact O-N 3.08Å
66	K	32	Very low	49.8	Very low	209 Å²	209	107.7 Å²	107.7	91%	0.909	57%	0.57	S	S	*	*			trans	-69	98.6	153.9	-80.9	-170.7	171.1	-169.5	0	106.9
67	N	31.6	Very low	47	Very low	120 Å²	120	109 Å²	109	64%	0.642	59%	0.585	S	S	*	*			trans	-72.8	142.9	151.8	-71.8	-1.8	0	0	0	107	R65 D69	R65-N67 VanDerWaalsContact C-N 3.33Å; R65-N67 PolarHBondContact O-N 3.02Å; R65-N67 VanDerWaalsContact O-N 3.08Å; N67-D69 PolarHBondContact O-N 3.02Å
68	E	27.6	Very low	44.2	Very low	172 Å²	172	114.1 Å²	114.1	80%	0.804	61%	0.611	S	S	*	*			trans	-86.4	100.9	172.3	-66.1	-175.8	138.8	0	0	108.1	I70	E68-I70 HydrophobicContact CB-CG1 4.49Å; E68-I70 PolarHBondContact O-N 3.49Å
69	D	27.3	Very low	41.5	Very low	148 Å²	148	115.4 Å²	115.4	79%	0.791	63%	0.633	S	S	*	*			trans	-72.3	68	176.8	-67.6	-44.2	0	0	0	111.1	N67 S71	N67-D69 PolarHBondContact O-N 3.02Å; D69-S71 VanDerWaalsContact C-N 3.34Å; D69-S71 PolarHBondContact O-N 3.49Å
70	I	29.9	Very low	38.7	Very low	135 Å²	135	123.3 Å²	123.3	69%	0.692	67%	0.67	S	S	*	*			trans	-71.2	94.6	167.2	-60.5	-179	0	0	0	107.3	E68 V72	E68-I70 HydrophobicContact CB-CG1 4.49Å; E68-I70 PolarHBondContact O-N 3.49Å; I70-V72 HydrophobicContact CG2-CG2 4.44Å; I70-V72 PolarHBondContact O-N 3.46Å
71	S	26.4	Very low	35.9	Very low	116 Å²	116	128 Å²	128	81%	0.811	70%	0.699	S	S	*	*			trans	-73	92.7	-175.1	31.3	0	0	0	0	112	D69 S73	D69-S71 VanDerWaalsContact C-N 3.34Å; D69-S71 PolarHBondContact O-N 3.49Å; S71-S73 PolarHBondContact O-N 2.95Å; S71-S73 VanDerWaalsContact O-N 3.08Å
72	V	28.6	Very low	33.2	Very low	133 Å²	133	135.2 Å²	135.2	81%	0.806	73%	0.726	S	S	*	*			trans	-81.7	80.5	176.2	-174.2	0	0	0	0	111.1	I70	I70-V72 HydrophobicContact CG2-CG2 4.44Å; I70-V72 PolarHBondContact O-N 3.46Å
73	S	24.9	Very low	30.9	Very low	105 Å²	105	138.5 Å²	138.5	73%	0.734	74%	0.743	S	S	*	*			trans	-179.8	104.8	145.3	53.7	0	0	0	0	114.5	S71	S71-S73 PolarHBondContact O-N 2.95Å; S71-S73 VanDerWaalsContact O-N 3.08Å
74	K	27.6	Very low	28.8	Very low	193 Å²	193	146.6 Å²	146.6	84%	0.839	78%	0.775	S	S	*	*				-178.9	119.6	116.1	-101.7	177.1	178.9	177.6	0	113.8
75	L	27.8	Very low	27.8	Very low	149 Å²	149	141.4 Å²	141.4	78%	0.78	78%	0.775	S	S	*	*			trans	37.9	117.9	138.9	-65.9	163.7	0	0	0	120.2
76	C	24.6	Very low	26.8	Very low	129 Å²	129	145.4 Å²	145.4	87%	0.872	80%	0.796	S	S	*	*				-158.9	168.2	92.3	-103.1	0	0	0	0	112.7
77	S	23.9	Very low	26.3	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	79%	0.789	S	S	*	*			trans	-99.7	174.9	-173.4	-55.3	0	0	0	0	113.5
78	D	24.4	Very low	26.2	Very low	155 Å²	155	140.3 Å²	140.3	83%	0.829	79%	0.794	S	S	*	*			trans	60.8	99.4	162.3	-67.6	-29.3	0	0	0	119.7
79	A	27	Very low	26.1	Very low	105 Å²	105	141 Å²	141	87%	0.868	80%	0.797	S	S	*	*				-152.1	136.3	122.3	0	0	0	0	0	110.8
80	Q	24.6	Very low	26	Very low	173 Å²	173	141.4 Å²	141.4	81%	0.808	80%	0.798	S	S	*	*			trans	-91.3	174.9	178.6	-65.8	178.2	0.8	0	0	112.6
81	V	25.6	Very low	25.9	Very low	107 Å²	107	144 Å²	144	65%	0.648	80%	0.804	S	S	*	*			trans	100.9	119.3	148.1	-173	0	0	0	0	119.7
82	K	27.3	Very low	26.5	Very low	185 Å²	185	144.4 Å²	144.4	80%	0.804	81%	0.805	S	S	*	*			trans	68.8	130.9	160.4	-70.6	158.3	-163.2	168.5	0	118
83	V	26.3	Very low	26.3	Very low	122 Å²	122	142.1 Å²	142.1	74%	0.739	81%	0.808	S	S	*	*			cis	88.8	106.2	26.7	-177.1	0	0	0	0	114.4
84	F	23.9	Very low	26.4	Very low	211 Å²	211	140.8 Å²	140.8	93%	0.925	81%	0.81	S	S	*	*			trans	71.5	134.1	161.2	-82.2	-128.7	0	0	0	119.5
85	G	27.1	Very low	26.3	Very low	79 Å²	79	139 Å²	139	81%	0.814	81%	0.81	S	S	*	*			trans	-171.1	73.3	179.7	0	0	0	0	0	115.1
86	K	24.9	Very low	26.3	Very low	207 Å²	207	137 Å²	137	90%	0.9	81%	0.809	S	S	*	*			trans	-64.3	161.3	158.2	-89	-179	-179.8	179.5	0	109.8
87	C	21.7	Very low	26.4	Very low	114 Å²	114	136.2 Å²	136.2	77%	0.77	81%	0.805	S	S	*	*			cis	-167.9	178.7	-9	-180	0	0	0	0	107.8
88	C	29.2	Very low	26.6	Very low	108 Å²	108	136.5 Å²	136.5	73%	0.73	81%	0.807	S	S	*	*			trans	-55.1	148.4	-178.6	-45.6	0	0	0	0	116.6
89	Q	25.3	Very low	26.8	Very low	186 Å²	186	134.4 Å²	134.4	87%	0.869	80%	0.804	S	S	*	*			trans	-171.8	154.4	150.6	-105.2	157.4	54.8	0	0	109.4
90	L	25.4	Very low	27	Very low	157 Å²	157	137.6 Å²	137.6	82%	0.822	81%	0.806	S	S	*	*			cis	-160.6	-179.8	-44	-116.4	175.4	0	0	0	107.7
91	K	27.3	Very low	27	Very low	189 Å²	189	136.5 Å²	136.5	82%	0.822	81%	0.806	S	S	*	*			trans	-76.2	-174.7	-179.4	-57.9	-174.4	176.4	-176.7	0	112.3
92	P	38.8	Very low	27.1	Very low	126 Å²	126	136.9 Å²	136.9	82%	0.818	81%	0.813	S	S	*	*			cis	-148	176.9	6.5	44.5	-24.8	0	0	0	119.9
93	G	24.7	Very low	27.2	Very low	84 Å²	84	132.7 Å²	132.7	87%	0.866	81%	0.807	S	S	*	*			trans	105.3	141.3	140.1	0	0	0	0	0	118.9
94	G	27.3	Very low	27.8	Very low	77 Å²	77	133.4 Å²	133.4	79%	0.794	81%	0.811	S	S	*	*			trans	141.3	87.7	168.4	0	0	0	0	0	116
95	D	25	Very low	27.8	Very low	155 Å²	155	129.9 Å²	129.9	83%	0.829	81%	0.807	S	S	*	*			trans	-67.3	167.8	-167.9	-50.1	-49	0	0	0	118.7
96	S	28.1	Very low	27.7	Very low	109 Å²	109	131.2 Å²	131.2	76%	0.762	80%	0.804	S	S	*	*			trans	93.7	93.8	147.9	-57.7	0	0	0	0	122.7
97	S	27.4	Very low	27.8	Very low	111 Å²	111	126.3 Å²	126.3	78%	0.776	80%	0.796	S	S	*	*				102.4	146.5	113.4	79.5	0	0	0	0	122.7
98	S	27.8	Very low	28.2	Very low	106 Å²	106	126 Å²	126	74%	0.741	80%	0.795	S	S	*	*			trans	76.7	108.8	165.9	65.3	0	0	0	0	120.7
99	S	28.2	Very low	28	Very low	112 Å²	112	128.6 Å²	128.6	78%	0.783	80%	0.802	S	S	*	*			trans	45.1	115.5	143.9	59.1	0	0	0	0	121.4
100	L	30.8	Very low	28.5	Very low	171 Å²	171	127.3 Å²	127.3	90%	0.895	80%	0.799	S	S	*	*				-156.3	163.9	114.2	-107.5	167.9	0	0	0	110.3
101	D	25.7	Very low	28.6	Very low	151 Å²	151	128.3 Å²	128.3	81%	0.807	80%	0.797	S	S	*	*			trans	-75.9	169.1	-175.3	-88.1	-62.8	0	0	0	114.5
102	S	26.8	Very low	28.5	Very low	114 Å²	114	125.5 Å²	125.5	80%	0.797	79%	0.791	S	S	*	*			trans	79.2	139.7	-176.3	83.3	0	0	0	0	114.7
103	S	28.6	Very low	27.8	Very low	98 Å²	98	129 Å²	129	69%	0.685	80%	0.796	S	S	*	*			cis	-156.3	151.3	0.5	57.8	0	0	0	0	113
104	V	39.6	Very low	27.8	Very low	136 Å²	136	129.1 Å²	129.1	82%	0.824	78%	0.783	S	S	*	*			trans	36.2	126.2	141.5	-177	0	0	0	0	119.6
105	T	23.9	Very low	27.6	Very low	138 Å²	138	133 Å²	133	85%	0.847	78%	0.784	S	S	*	*			trans	-137	101.1	163.6	56.2	0	0	0	0	114.4
106	S	25.8	Very low	27.7	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	79%	0.785	S	S	*	*			trans	-165.6	106.5	137.2	41	0	0	0	0	112.3
107	S	27	Very low	27.9	Very low	105 Å²	105	137 Å²	137	73%	0.734	78%	0.778	S	S	*	*			trans	22	106.2	147.9	54.4	0	0	0	0	118.8
108	S	29.1	Very low	28.1	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	78%	0.782	S	S	*	*				77.1	110.5	62.4	75.6	0	0	0	0	115.2
109	D	25.5	Very low	28.7	Very low	163 Å²	163	138.7 Å²	138.7	87%	0.872	78%	0.78	S	S	*	*				-158	169	125.8	-119.7	-31.2	0	0	0	112.4
110	I	36.3	Very low	29.7	Very low	158 Å²	158	137 Å²	137	81%	0.81	77%	0.768	S	S	*	*			trans	-94.6	122.5	-157.4	-60	164	0	0	0	113.4
111	K	27.1	Very low	30.8	Very low	178 Å²	178	140 Å²	140	77%	0.774	77%	0.767	S	S	*	*			trans	-164.2	153.5	147.3	-119.1	178	177	-173.2	0	115.8
112	D	26	Very low	32.4	Very low	131 Å²	131	136.8 Å²	136.8	70%	0.701	76%	0.755	S	S	*	*			trans	47.4	75.7	154.1	-53.2	-31.7	0	0	0	117.6	C114	D112-C114 PolarHBondContact O-N 2.92Å
113	Q	23.7	Very low	34.3	Very low	198 Å²	198	132.8 Å²	132.8	93%	0.925	73%	0.727	S	S	*	*			trans	-68.4	76.3	162.3	-170.4	171.6	58.4	0	0	110.2	L115	Q113-L115 PolarHBondContact O-N 3.4Å; Q113-L115 VanDerWaalsContact O-N 3.14Å
114	C	23.3	Very low	36.6	Very low	88 Å²	88	134 Å²	134	60%	0.595	74%	0.736	S	S	*	*			trans	-54.3	118	177.5	180	0	0	0	0	110.4	D112 K116	D112-C114 PolarHBondContact O-N 2.92Å; C114-K116 VanDerWaalsContact C-N 3.32Å; C114-K116 PolarHBondContact O-N 3.38Å
115	L	25	Very low	38.8	Very low	157 Å²	157	129.5 Å²	129.5	82%	0.822	71%	0.707	S	S	*	*			trans	-59.5	97.5	167	-75.9	170.4	0	0	0	108	Q113 Y117	Q113-L115 PolarHBondContact O-N 3.4Å; Q113-L115 VanDerWaalsContact O-N 3.14Å; L115-Y117 PolarHBondContact O-N 3.09Å; L115-Y117 VanDerWaalsContact O-N 3.11Å
116	K	25.9	Very low	41.6	Very low	192 Å²	192	123 Å²	123	84%	0.835	67%	0.668	S	S	*	*			trans	-53.2	122.3	168.2	-72	179.1	179.2	174.4	0	106.7	C114 Q118	C114-K116 VanDerWaalsContact C-N 3.32Å; C114-K116 PolarHBondContact O-N 3.38Å; K116-Q118 PolarHBondContact O-N 3.1Å
117	Y	33.5	Very low	44.4	Very low	157 Å²	157	124.2 Å²	124.2	62%	0.616	67%	0.666	S	S	*	*			trans	-60.6	87.2	167.6	-82.5	-86.9	0	0	0	108.2	L115 G119 S387	L115-Y117 PolarHBondContact O-N 3.09Å; L115-Y117 VanDerWaalsContact O-N 3.11Å; Y117-G119 VanDerWaalsContact C-N 3.25Å; Y117-G119 PolarHBondContact O-N 3.09Å; Y117-S387 VanDerWaalsContact OH-CB 3.23Å; Y117-S387 WeakPolarHBondContact OH-CB 3.28Å
118	Q	31	Very low	47.3	Very low	186 Å²	186	123.7 Å²	123.7	87%	0.869	65%	0.653	S	S	*	*			trans	-74.7	89.2	178.6	-174.1	163.2	4.2	0	0	106.6	K116 S120	K116-Q118 PolarHBondContact O-N 3.1Å; Q118-S120 PolarHBondContact O-N 3.28Å
119	G	40.1	Very low	50.1	Low	67 Å²	67	118.6 Å²	118.6	69%	0.691	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-49.2	117.6	175.8	0	0	0	0	0	108.9	Y117	Y117-G119 VanDerWaalsContact C-N 3.25Å; Y117-G119 PolarHBondContact O-N 3.09Å
120	S	48.4	Very low	53	Low	77 Å²	77	110.9 Å²	110.9	54%	0.538	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-53.9	145.5	164.7	177	0	0	0	0	107.7	Q118 C122	Q118-S120 PolarHBondContact O-N 3.28Å; S120-C122 PolarHBondContact O-N 3.27Å
121	R	54.5	Low	55.4	Low	233 Å²	233	108.2 Å²	108.2	88%	0.879	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-50.3	130.4	-174.9	-68	-178.5	176.5	-175.9	-1.3	109.4
122	C	59.2	Low	58.4	Low	83 Å²	83	101.9 Å²	101.9	56%	0.561	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-51.9	147.2	170.9	-56.8	0	0	0	0	109.4	S120 A126	S120-C122 PolarHBondContact O-N 3.27Å; C122-A126 HydrophobicContact CB-CB 4.34Å
123	S	67	Low	61.3	Low	30 Å²	30	95.7 Å²	95.7	21%	0.21	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-56	152.8	176.1	59.9	0	0	0	0	111.7	R43 D60 D125 A126	R43-S123 PolarHBondContact NH2-OG 2.85Å; D60-S123 PolarHBondContact OD2-OG 3.1Å; S123-D125 WeakPolarHBondContact CB-OD1 3.44Å; S123-D125 PolarHBondContact O-N 3.15Å; S123-D125 PolarHBondContact OG-OD1 3.09Å; S123-A126 WeakPolarHBondContact O-CB 3.09Å; S123-A126 PolarHBondContact O-N 2.77Å
124	S	77.3	Confident	64.2	Low	125 Å²	125	86.5 Å²	86.5	87%	0.874	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-27.3	178.6	45	0	0	0	0	113.4
125	D	85.1	Confident	67.2	Low	40 Å²	40	83.2 Å²	83.2	21%	0.214	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-11.9	178.5	59.1	16.2	0	0	0	114.4	R43 S123 N127 M128 L129	R43-D125 IonicContact CZ-OD1 3.21Å; R43-D125 IonicContact CZ-OD2 2.77Å; R43-D125 IonicContact NH1-OD1 3.6Å; R43-D125 PolarHBondContact NH1-OD1 3.15Å; R43-D125 IonicContact NH1-OD2 3.49Å; R43-D125 PolarHBondContact NH1-OD2 3.49Å; R43-D125 IonicContact NH2-OD1 2.86Å; R43-D125 PolarHBondContact NH2-OD1 3.35Å; R43-D125 IonicContact NH2-OD2 2.86Å; S123-D125 WeakPolarHBondContact CB-OD1 3.44Å; S123-D125 PolarHBondContact O-N 3.15Å; S123-D125 PolarHBondContact OG-OD1 3.09Å; D125-N127 PolarHBondContact O-N 3.48Å; D125-N127 VanDerWaalsContact O-N 3.11Å; D125-M128 WeakPolarHBondContact O-CB 3.38Å; D125-M128 PolarHBondContact O-N 3.37Å; D125-M128 VanDerWaalsContact O-N 3.1Å; D125-L129 HydrophobicContact CB-CD1 3.9Å; D125-L129 HydrophobicContact CB-CG 4.39Å; D125-L129 WeakPolarHBondContact O-CG 3.45Å; D125-L129 PolarHBondContact O-N 2.95Å
126	A	82.4	Confident	69.8	Low	3 Å²	3	80.9 Å²	80.9	3%	0.025	44%	0.436	C	S	.	.	H	α-helix	trans	-60.8	-28.9	-171.8	0	0	0	0	0	113.7	Y47 V57 C122 S123 G130	Y47-A126 WeakPolarHBondContact CE1-O 3.48Å; Y47-A126 WeakPolarHBondContact OH-CA 3.48Å; Y47-A126 PolarHBondContact OH-O 3.36Å; V57-A126 HydrophobicContact CG2-CB 4.28Å; C122-A126 HydrophobicContact CB-CB 4.34Å; S123-A126 WeakPolarHBondContact O-CB 3.09Å; S123-A126 PolarHBondContact O-N 2.77Å; A126-G130 PolarHBondContact O-N 2.83Å
127	N	84.6	Confident	72.2	Confident	130 Å²	130	76.7 Å²	76.7	70%	0.695	43%	0.427	S	S	*	.	H	α-helix	trans	-73.8	-44.5	177.2	-67.1	-21.2	0	0	0	111.4	D125 G130 E131	D125-N127 PolarHBondContact O-N 3.48Å; D125-N127 VanDerWaalsContact O-N 3.11Å; N127-G130 PolarHBondContact O-N 3.49Å; N127-E131 PolarHBondContact O-N 3.07Å
128	M	88.6	Confident	74	Confident	95 Å²	95	73.1 Å²	73.1	47%	0.468	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-48.9	177.3	-178.8	-170.6	78.5	0	0	111.3	D125 G130 E131 M132 I151	D125-M128 WeakPolarHBondContact O-CB 3.38Å; D125-M128 PolarHBondContact O-N 3.37Å; D125-M128 VanDerWaalsContact O-N 3.1Å; M128-G130 VanDerWaalsContact C-N 3.33Å; M128-G130 PolarHBondContact O-N 3.46Å; M128-E131 WeakPolarHBondContact O-CA 3.42Å; M128-E131 WeakPolarHBondContact O-CB 3.36Å; M128-E131 PolarHBondContact O-N 3.34Å; M128-M132 HydrophobicContact CE-SD 4.26Å; M128-M132 HydrophobicContact CG-SD 4.19Å; M128-M132 WeakPolarHBondContact O-CG 3.41Å; M128-M132 PolarHBondContact O-N 3.48Å; M128-I151 HydrophobicContact CE-CD1 4.42Å
129	L	87.9	Confident	75.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-63.1	-40.9	179.9	-63.8	166.1	0	0	0	110.9	I45 D125 E131 M132 M133 I151 M158 I335	I45-L129 HydrophobicContact CD1-CD1 3.54Å; D125-L129 HydrophobicContact CB-CD1 3.9Å; D125-L129 HydrophobicContact CB-CG 4.39Å; D125-L129 WeakPolarHBondContact O-CG 3.45Å; D125-L129 PolarHBondContact O-N 2.95Å; L129-E131 VanDerWaalsContact C-N 3.29Å; L129-E131 PolarHBondContact O-N 3Å; L129-M132 HydrophobicContact CD2-SD 4.23Å; L129-M132 PolarHBondContact O-N 3.22Å; L129-M133 WeakPolarHBondContact O-CB 3.36Å; L129-M133 WeakPolarHBondContact O-CG 3.44Å; L129-M133 PolarHBondContact O-N 3.08Å; L129-I151 HydrophobicContact CD2-CD1 4.11Å; L129-M158 HydrophobicContact CD2-SD 3.91Å; L129-I335 HydrophobicContact CD1-CD1 3.74Å; L129-I335 HydrophobicContact CD2-CD1 3.95Å; L129-I335 HydrophobicContact CG-CD1 4.45Å
130	G	86	Confident	76.9	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.01	38%	0.377	C	S	.	.	H	α-helix	trans	-62.4	-30.9	172.3	0	0	0	0	0	114.1	A126 N127 M128 F134	A126-G130 PolarHBondContact O-N 2.83Å; N127-G130 PolarHBondContact O-N 3.49Å; M128-G130 VanDerWaalsContact C-N 3.33Å; M128-G130 PolarHBondContact O-N 3.46Å; G130-F134 WeakPolarHBondContact O-CD2 3.46Å; G130-F134 PolarHBondContact O-N 3.09Å
131	E	87.8	Confident	77.7	Confident	102 Å²	102	62.3 Å²	62.3	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-74.2	-41.4	173.2	-84	175.4	-156.4	0	0	113	N127 M128 L129 G135	N127-E131 PolarHBondContact O-N 3.07Å; M128-E131 WeakPolarHBondContact O-CA 3.42Å; M128-E131 WeakPolarHBondContact O-CB 3.36Å; M128-E131 PolarHBondContact O-N 3.34Å; L129-E131 VanDerWaalsContact C-N 3.29Å; L129-E131 PolarHBondContact O-N 3Å; E131-G135 CarbonylContact O-C 3.59Å; E131-G135 VanDerWaalsContact O-C 3.29Å; E131-G135 WeakPolarHBondContact O-CA 3.09Å; E131-G135 PolarHBondContact O-N 3.31Å
132	M	89.1	Confident	78	Confident	44 Å²	44	58.2 Å²	58.2	22%	0.217	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-50.2	174.7	-65.3	167.5	70.9	0	0	111.2	M128 L129 G135 K147 H149 I151 M158	M128-M132 HydrophobicContact CE-SD 4.26Å; M128-M132 HydrophobicContact CG-SD 4.19Å; M128-M132 WeakPolarHBondContact O-CG 3.41Å; M128-M132 PolarHBondContact O-N 3.48Å; L129-M132 HydrophobicContact CD2-SD 4.23Å; L129-M132 PolarHBondContact O-N 3.22Å; M132-G135 PolarHBondContact O-N 2.8Å; M132-K147 PolarHBondContact O-NZ 3.15Å; M132-K147 VanDerWaalsContact O-NZ 3.17Å; M132-H149 HydrophobicContact CE-CB 3.52Å; M132-I151 HydrophobicContact CE-CD1 3.99Å; M132-I151 HydrophobicContact CE-CG1 3.89Å; M132-I151 HydrophobicContact SD-CD1 4.38Å; M132-M158 HydrophobicContact CB-CE 3.81Å; M132-M158 HydrophobicContact CE-CE 4.08Å
133	M	87.3	Confident	78.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-50.3	-176.4	-66.8	173	73.9	0	0	112.6	Y47 L129 K147 M158 V162 A331 G333	Y47-M133 HydrophobicContact CD2-CE 4.03Å; Y47-M133 HydrophobicContact CD2-SD 3.69Å; Y47-M133 HydrophobicContact CE2-CE 4.46Å; Y47-M133 HydrophobicContact CE2-SD 3.6Å; L129-M133 WeakPolarHBondContact O-CB 3.36Å; L129-M133 WeakPolarHBondContact O-CG 3.44Å; L129-M133 PolarHBondContact O-N 3.08Å; M133-K147 PolarHBondContact O-NZ 3.12Å; M133-M158 HydrophobicContact CG-CE 3.72Å; M133-M158 HydrophobicContact CG-SD 3.95Å; M133-M158 HydrophobicContact SD-SD 4.3Å; M133-V162 WeakPolarHBondContact O-CG2 3.29Å; M133-A331 HydrophobicContact CE-CB 3.66Å; M133-G333 VanDerWaalsContact CE-CA 3.45Å
134	F	85.2	Confident	79.1	Confident	5 Å²	5	54.6 Å²	54.6	2%	0.022	32%	0.322	C	S	.	.	H	α-helix	trans	-88.2	-12.3	-179.7	-69.6	-74.3	0	0	0	114.5	Y47 D49 R55 G130 Y141 V162 K329 A331	Y47-F134 HydrophobicContact CG-CE2 4.19Å; D49-F134 HydrophobicContact CB-CD1 4.12Å; D49-F134 HydrophobicContact CB-CD2 4.48Å; D49-F134 HydrophobicContact CB-CE1 3.62Å; D49-F134 HydrophobicContact CB-CE2 4.02Å; D49-F134 HydrophobicContact CB-CZ 3.56Å; R55-F134 HydrophobicContact CG-CD2 4.02Å; R55-F134 HydrophobicContact CG-CE2 4.22Å; G130-F134 WeakPolarHBondContact O-CD2 3.46Å; G130-F134 PolarHBondContact O-N 3.09Å; F134-Y141 PolarHBondContact O-OH 3.48Å; F134-V162 HydrophobicContact CD1-CG1 3.94Å; F134-V162 HydrophobicContact CE1-CG1 3.77Å; F134-K329 HydrophobicContact CE1-CB 3.98Å; F134-A331 HydrophobicContact CE1-CB 3.85Å; F134-A331 HydrophobicContact CE2-CB 3.94Å; F134-A331 HydrophobicContact CZ-CB 3.46Å; F134-A331 VanDerWaalsContact CZ-CB 3.46Å
135	G	84.9	Confident	79.6	Confident	20 Å²	20	50.1 Å²	50.1	21%	0.206	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	156.2	-166.7	0	0	0	0	0	112.9	R55 E131 M132 V137	R55-G135 PolarHBondContact NH2-O 3.37Å; E131-G135 CarbonylContact O-C 3.59Å; E131-G135 VanDerWaalsContact O-C 3.29Å; E131-G135 WeakPolarHBondContact O-CA 3.09Å; E131-G135 PolarHBondContact O-N 3.31Å; M132-G135 PolarHBondContact O-N 2.8Å; G135-V137 PolarHBondContact O-N 2.89Å
136	S	80.9	Confident	79.7	Confident	107 Å²	107	50.5 Å²	50.5	75%	0.748	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.4	177.5	-43.1	0	0	0	0	112.9
137	V	76.4	Confident	80.2	Confident	105 Å²	105	53 Å²	53	64%	0.636	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	139.2	177.3	-178.8	0	0	0	0	110	G135 M139	G135-V137 PolarHBondContact O-N 2.89Å; V137-M139 PolarHBondContact O-N 2.93Å
138	A	70.3	Confident	80.6	Confident	81 Å²	81	49.9 Å²	49.9	67%	0.669	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	93.2	-177.6	0	0	0	0	0	112.6
139	M	67.4	Low	80.7	Confident	48 Å²	48	47.7 Å²	47.7	24%	0.236	27%	0.272	C	S	.	.			trans	-69.6	152	176.8	-62	-63.9	-80.1	0	0	113.3	V137 Y141 T295 L297 K329	V137-M139 PolarHBondContact O-N 2.93Å; M139-Y141 HydrophobicContact CB-CD2 4.37Å; M139-Y141 HydrophobicContact CB-CE1 4.49Å; M139-Y141 HydrophobicContact CB-CE2 3.87Å; M139-Y141 VanDerWaalsContact O-CD2 3.29Å; M139-Y141 WeakPolarHBondContact O-CD2 3.48Å; M139-Y141 PolarHBondContact O-N 2.87Å; M139-T295 VanDerWaalsContact CE-O 3.23Å; M139-T295 WeakPolarHBondContact CE-O 3.47Å; M139-L297 HydrophobicContact CE-CD1 4.33Å; M139-L297 HydrophobicContact CE-CD2 4Å; M139-L297 HydrophobicContact CE-CG 3.92Å; M139-K329 PolarHBondContact O-NZ 3.17Å
140	S	65.3	Low	80.9	Confident	32 Å²	32	54 Å²	54	22%	0.224	30%	0.302	C	S	.	.			trans	-88.7	94.4	170.4	44.5	0	0	0	0	111.1	S292 T295	S140-S292 WeakPolarHBondContact CB-OG 3.33Å; S140-S292 PolarHBondContact OG-O 2.83Å; S140-S292 PolarHBondContact OG-OG 2.84Å; S140-T295 PolarHBondContact OG-O 3.24Å
141	Y	65.3	Low	81	Confident	23 Å²	23	55 Å²	55	9%	0.09	31%	0.307	C	S	.	.			trans	-77	122.9	178.3	-61.5	-85.9	0	0	0	111.9	F134 M139 T145 V162 K329	F134-Y141 PolarHBondContact O-OH 3.48Å; M139-Y141 HydrophobicContact CB-CD2 4.37Å; M139-Y141 HydrophobicContact CB-CE1 4.49Å; M139-Y141 HydrophobicContact CB-CE2 3.87Å; M139-Y141 VanDerWaalsContact O-CD2 3.29Å; M139-Y141 WeakPolarHBondContact O-CD2 3.48Å; M139-Y141 PolarHBondContact O-N 2.87Å; Y141-T145 HydrophobicContact CD1-CG2 3.73Å; Y141-T145 VanDerWaalsContact CD1-OG1 3.3Å; Y141-T145 WeakPolarHBondContact CD1-OG1 3.38Å; Y141-T145 HydrophobicContact CE1-CG2 4.04Å; Y141-T145 WeakPolarHBondContact CE1-OG1 3.45Å; Y141-V162 HydrophobicContact CD1-CG1 4.45Å; Y141-V162 HydrophobicContact CE1-CB 4.31Å; Y141-V162 HydrophobicContact CE1-CG1 4.24Å; Y141-V162 HydrophobicContact CE2-CG1 4.36Å; Y141-K329 HydrophobicContact CD2-CD 3.96Å; Y141-K329 HydrophobicContact CE2-CD 4.27Å
142	K	59.1	Low	80.9	Confident	147 Å²	147	60.9 Å²	60.9	64%	0.639	33%	0.325	S	S	*	.	S	Bend	trans	-120.3	58	177.8	-175.6	146.3	158.9	-88.2	0	111.1	E298	K142-E298 HydrophobicContact CB-CG 4.49Å; K142-E298 WeakPolarHBondContact CD-OE1 3.11Å; K142-E298 WeakPolarHBondContact CD-OE2 3.44Å; K142-E298 WeakPolarHBondContact CE-OE1 3.19Å; K142-E298 WeakPolarHBondContact CG-OE1 3.44Å; K142-E298 IonicContact NZ-OE1 3.75Å; K142-E298 PolarHBondContact NZ-OE1 2.98Å; K142-E298 IonicContact NZ-OE2 2.76Å; K142-E298 PolarHBondContact NZ-OE2 3.36Å
143	G	71.6	Confident	80.5	Confident	12 Å²	12	63.9 Å²	63.9	12%	0.124	35%	0.35	C	S	.	.	S	Bend	trans	155	-157.5	-175.7	0	0	0	0	0	109.6
144	S	79.4	Confident	80.4	Confident	26 Å²	26	67.7 Å²	67.7	18%	0.182	38%	0.375	C	S	.	.			trans	-85.4	171.6	147.3	74.7	0	0	0	0	111.2	K161 V162 E309	S144-K161 WeakPolarHBondContact OG-CE 3.42Å; S144-V162 CarbonylContact C-O 3.17Å; S144-V162 WeakPolarHBondContact CA-O 3.48Å; S144-V162 WeakPolarHBondContact CB-O 3.24Å; S144-E309 WeakPolarHBondContact CB-OE1 3.4Å; S144-E309 WeakPolarHBondContact CB-OE2 3.24Å; S144-E309 PolarHBondContact N-OE2 2.7Å; S144-E309 VanDerWaalsContact OG-CD 3.26Å; S144-E309 PolarHBondContact OG-OE1 3.33Å; S144-E309 PolarHBondContact OG-OE2 2.68Å
145	T	86.6	Confident	80.4	Confident	30 Å²	30	69.8 Å²	69.8	18%	0.184	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	135.3	166.7	48	0	0	0	0	108.5	Y141 K161 V162 L297	Y141-T145 HydrophobicContact CD1-CG2 3.73Å; Y141-T145 VanDerWaalsContact CD1-OG1 3.3Å; Y141-T145 WeakPolarHBondContact CD1-OG1 3.38Å; Y141-T145 HydrophobicContact CE1-CG2 4.04Å; Y141-T145 WeakPolarHBondContact CE1-OG1 3.45Å; T145-K161 WeakPolarHBondContact O-CA 3.42Å; T145-V162 PolarHBondContact N-O 3.49Å; T145-V162 PolarHBondContact O-N 3.12Å; T145-L297 HydrophobicContact CG2-CD1 4.43Å
146	L	88.7	Confident	80.6	Confident	49 Å²	49	70.1 Å²	70.1	26%	0.257	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	142.1	176.6	-166.9	58.8	0	0	0	109.3	L159 S160 K161 F356 E360 M363	L146-L159 HydrophobicContact CD1-CD1 3.71Å; L146-L159 HydrophobicContact CD1-CG 4.17Å; L146-L159 HydrophobicContact CD2-CD1 4.46Å; L146-L159 HydrophobicContact CG-CD1 4.07Å; L146-S160 CarbonylContact C-O 3.6Å; L146-S160 WeakPolarHBondContact CA-O 3.5Å; L146-K161 HydrophobicContact CD1-CB 3.85Å; L146-K161 HydrophobicContact CD1-CD 4.15Å; L146-K161 HydrophobicContact CD1-CG 4.11Å; L146-F356 HydrophobicContact CD2-CE1 3.9Å; L146-F356 HydrophobicContact CD2-CZ 3.54Å; L146-F356 HydrophobicContact CG-CZ 4.32Å; L146-E360 HydrophobicContact CD2-CB 4.42Å; L146-E360 HydrophobicContact CD2-CG 4.31Å; L146-E360 WeakPolarHBondContact CD2-OE2 3.14Å; L146-M363 HydrophobicContact CD1-SD 3.65Å
147	K	91.8	Very high	81.1	Confident	55 Å²	55	65 Å²	65	24%	0.239	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	137.7	175.4	-57.8	174.6	176.8	175.2	0	110.4	M132 M133 S160	M132-K147 PolarHBondContact O-NZ 3.15Å; M132-K147 VanDerWaalsContact O-NZ 3.17Å; M133-K147 PolarHBondContact O-NZ 3.12Å; K147-S160 PolarHBondContact N-O 3.36Å; K147-S160 PolarHBondContact O-N 2.87Å; K147-S160 PolarHBondContact O-OG 3.12Å
148	I	93.2	Very high	81.9	Confident	65 Å²	65	60.1 Å²	60.1	33%	0.333	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	135.8	171.6	-46.5	171.4	0	0	0	107.3	L157 M158 L159 F352 F353 F356	I148-L157 HydrophobicContact CG2-CD1 3.77Å; I148-L157 HydrophobicContact CG2-CG 4.47Å; I148-M158 CarbonylContact C-O 3.52Å; I148-M158 WeakPolarHBondContact CA-O 3.31Å; I148-L159 HydrophobicContact CG1-CD1 3.94Å; I148-F352 HydrophobicContact CD1-CE1 4.33Å; I148-F352 HydrophobicContact CG2-CE1 4.27Å; I148-F353 HydrophobicContact CD1-CD1 4.43Å; I148-F353 HydrophobicContact CD1-CE1 3.87Å; I148-F353 HydrophobicContact CG2-CE1 4.17Å; I148-F353 HydrophobicContact CG2-CZ 4.36Å; I148-F356 HydrophobicContact CD1-CD2 4.07Å; I148-F356 HydrophobicContact CD1-CE2 3.43Å; I148-F356 VanDerWaalsContact CD1-CE2 3.43Å; I148-F356 HydrophobicContact CD1-CZ 3.82Å; I148-F356 HydrophobicContact CG1-CE2 3.97Å; I148-F356 HydrophobicContact CG1-CZ 4.24Å
149	H	91.4	Very high	83	Confident	48 Å²	48	56.2 Å²	56.2	22%	0.222	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	125.1	175.4	-60.3	-100.6	0	0	0	109.9	M132 M158	M132-H149 HydrophobicContact CE-CB 3.52Å; H149-M158 HydrophobicContact CB-CB 4.39Å; H149-M158 HydrophobicContact CB-CE 4.21Å; H149-M158 WeakPolarHBondContact CD2-CE 3.45Å; H149-M158 PolarHBondContact N-O 3.16Å; H149-M158 PolarHBondContact O-N 2.84Å
150	Q	90.8	Very high	84.1	Confident	134 Å²	134	54 Å²	54	63%	0.626	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	123.5	170.1	-167.1	179.3	10.2	0	0	109	L157	Q150-L157 HydrophobicContact CB-CD1 4.43Å
151	I	88.8	Confident	85.4	Confident	22 Å²	22	52.8 Å²	52.8	11%	0.113	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.3	176.1	-55.1	175.7	0	0	0	106.8	M128 L129 M132 P155 Q156	M128-I151 HydrophobicContact CE-CD1 4.42Å; L129-I151 HydrophobicContact CD2-CD1 4.11Å; M132-I151 HydrophobicContact CE-CD1 3.99Å; M132-I151 HydrophobicContact CE-CG1 3.89Å; M132-I151 HydrophobicContact SD-CD1 4.38Å; I151-P155 WeakPolarHBondContact O-CA 3.37Å; I151-Q156 HydrophobicContact CB-CB 4.17Å; I151-Q156 HydrophobicContact CD1-CB 4.35Å; I151-Q156 PolarHBondContact N-O 2.94Å; I151-Q156 PolarHBondContact O-N 2.9Å
152	R	86	Confident	86.5	Confident	224 Å²	224	51.7 Å²	51.7	85%	0.845	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-32.2	-176.4	-66.1	-177.4	176.2	125.4	-3.8	113.5
153	S	80.7	Confident	87.8	Confident	108 Å²	108	44.8 Å²	44.8	76%	0.755	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-145.7	110.5	-172.6	-56.3	0	0	0	0	112.1
154	P	84.7	Confident	88.1	Confident	81 Å²	81	44.6 Å²	44.6	53%	0.526	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	cis	-59.9	157.4	-13.1	29.6	-36.5	0	0	0	111.6	Q156	P154-Q156 HydrophobicContact CG-CG 4.21Å; P154-Q156 PolarHBondContact O-N 3.02Å; P154-Q156 VanDerWaalsContact O-N 3.14Å
155	P	85.3	Confident	87.5	Confident	48 Å²	48	43.3 Å²	43.3	31%	0.312	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	114.2	178.1	28.5	-35.3	0	0	0	110	I151 L338 S339	I151-P155 WeakPolarHBondContact O-CA 3.37Å; P155-L338 HydrophobicContact CB-CB 4.16Å; P155-L338 WeakPolarHBondContact O-CB 3.28Å; P155-L338 PolarHBondContact O-N 3.36Å; P155-S339 WeakPolarHBondContact CG-O 3.36Å
156	Q	89.3	Confident	85.9	Confident	27 Å²	27	46.6 Å²	46.6	13%	0.126	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	147	-179.9	-59.5	-179	-16.8	0	0	111	I151 P154 I335 F336	I151-Q156 HydrophobicContact CB-CB 4.17Å; I151-Q156 HydrophobicContact CD1-CB 4.35Å; I151-Q156 PolarHBondContact N-O 2.94Å; I151-Q156 PolarHBondContact O-N 2.9Å; P154-Q156 HydrophobicContact CG-CG 4.21Å; P154-Q156 PolarHBondContact O-N 3.02Å; P154-Q156 VanDerWaalsContact O-N 3.14Å; Q156-I335 HydrophobicContact CB-CG2 3.98Å; Q156-I335 HydrophobicContact CG-CG2 4.27Å; Q156-F336 VanDerWaalsContact CA-O 3.28Å; Q156-F336 WeakPolarHBondContact CA-O 3.19Å
157	L	91.6	Very high	83.8	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119	170.7	-172.7	66	0	0	0	109	I148 Q150 I335 F336 L338 F348 F352 F353	I148-L157 HydrophobicContact CG2-CD1 3.77Å; I148-L157 HydrophobicContact CG2-CG 4.47Å; Q150-L157 HydrophobicContact CB-CD1 4.43Å; L157-I335 WeakPolarHBondContact O-CA 3.24Å; L157-F336 HydrophobicContact CB-CB 4.33Å; L157-F336 HydrophobicContact CB-CD2 4.36Å; L157-F336 PolarHBondContact N-O 3.48Å; L157-F336 WeakPolarHBondContact O-CD2 3.46Å; L157-F336 PolarHBondContact O-N 2.99Å; L157-L338 HydrophobicContact CB-CD1 4.46Å; L157-F348 HydrophobicContact CD2-CE1 4.31Å; L157-F352 HydrophobicContact CD2-CB 4.38Å; L157-F352 HydrophobicContact CD2-CD1 3.58Å; L157-F352 HydrophobicContact CD2-CD2 4.06Å; L157-F352 HydrophobicContact CD2-CE1 3.78Å; L157-F352 HydrophobicContact CD2-CE2 4.24Å; L157-F352 HydrophobicContact CD2-CG 3.73Å; L157-F352 HydrophobicContact CD2-CZ 4.11Å; L157-F353 HydrophobicContact CD1-CZ 4.42Å
158	M	91.9	Very high	81.1	Confident	1 Å²	1	45 Å²	45	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	119.7	177.5	-177.4	-179.6	74.5	0	0	111.3	L129 M132 M133 I148 H149 V334 I335	L129-M158 HydrophobicContact CD2-SD 3.91Å; M132-M158 HydrophobicContact CB-CE 3.81Å; M132-M158 HydrophobicContact CE-CE 4.08Å; M133-M158 HydrophobicContact CG-CE 3.72Å; M133-M158 HydrophobicContact CG-SD 3.95Å; M133-M158 HydrophobicContact SD-SD 4.3Å; I148-M158 CarbonylContact C-O 3.52Å; I148-M158 WeakPolarHBondContact CA-O 3.31Å; H149-M158 HydrophobicContact CB-CB 4.39Å; H149-M158 HydrophobicContact CB-CE 4.21Å; H149-M158 WeakPolarHBondContact CD2-CE 3.45Å; H149-M158 PolarHBondContact N-O 3.16Å; H149-M158 PolarHBondContact O-N 2.84Å; M158-V334 CarbonylContact C-O 3.51Å; M158-V334 WeakPolarHBondContact CA-O 3.41Å; M158-I335 HydrophobicContact CB-CG1 4.08Å; M158-I335 HydrophobicContact CG-CG1 3.78Å; M158-I335 HydrophobicContact SD-CD1 4.48Å; M158-I335 HydrophobicContact SD-CG1 4.22Å
159	L	93.5	Very high	78.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.2	166.1	-175.8	64.1	0	0	0	109.1	L146 I148 G333 V334 F336 F352 F356 M363	L146-L159 HydrophobicContact CD1-CD1 3.71Å; L146-L159 HydrophobicContact CD1-CG 4.17Å; L146-L159 HydrophobicContact CD2-CD1 4.46Å; L146-L159 HydrophobicContact CG-CD1 4.07Å; I148-L159 HydrophobicContact CG1-CD1 3.94Å; L159-G333 WeakPolarHBondContact O-CA 3.3Å; L159-V334 PolarHBondContact N-O 2.89Å; L159-V334 PolarHBondContact O-N 3.05Å; L159-F336 HydrophobicContact CB-CE2 4.49Å; L159-F352 HydrophobicContact CB-CZ 4.5Å; L159-F352 HydrophobicContact CD1-CZ 4.43Å; L159-F352 HydrophobicContact CD2-CZ 4.42Å; L159-F356 HydrophobicContact CD1-CE2 3.8Å; L159-F356 HydrophobicContact CD1-CZ 4.06Å; L159-M363 HydrophobicContact CD2-CB 4.41Å; L159-M363 HydrophobicContact CD2-CE 4.42Å; L159-M363 HydrophobicContact CD2-CG 4.47Å; L159-M363 HydrophobicContact CD2-SD 3.68Å; L159-M363 HydrophobicContact CG-CE 4.03Å; L159-M363 HydrophobicContact CG-SD 3.69Å; L159-M363 WeakPolarHBondContact O-CE 3.49Å
160	S	92.4	Very high	75.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.8	-176.9	64.5	0	0	0	0	113.7	L146 K147 I332	L146-S160 CarbonylContact C-O 3.6Å; L146-S160 WeakPolarHBondContact CA-O 3.5Å; K147-S160 PolarHBondContact N-O 3.36Å; K147-S160 PolarHBondContact O-N 2.87Å; K147-S160 PolarHBondContact O-OG 3.12Å; S160-I332 CarbonylContact C-O 3.55Å; S160-I332 VanDerWaalsContact CA-O 3.28Å; S160-I332 WeakPolarHBondContact CA-O 3.45Å
161	K	91.3	Very high	72.5	Confident	8 Å²	8	51.5 Å²	51.5	4%	0.035	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.4	178.7	-160.3	162.6	-170.3	165.2	0	110.4	S144 T145 L146 A331 I332 E360 M363 N364	S144-K161 WeakPolarHBondContact OG-CE 3.42Å; T145-K161 WeakPolarHBondContact O-CA 3.42Å; L146-K161 HydrophobicContact CD1-CB 3.85Å; L146-K161 HydrophobicContact CD1-CD 4.15Å; L146-K161 HydrophobicContact CD1-CG 4.11Å; K161-A331 WeakPolarHBondContact O-CA 3.12Å; K161-I332 PolarHBondContact N-O 3.04Å; K161-I332 PolarHBondContact O-N 3.22Å; K161-E360 IonicContact NZ-OE1 3.89Å; K161-E360 PolarHBondContact NZ-OE1 3.23Å; K161-M363 HydrophobicContact CB-CE 3.79Å; K161-M363 HydrophobicContact CB-SD 3.73Å; K161-M363 HydrophobicContact CD-SD 4.42Å; K161-N364 PolarHBondContact NZ-OD1 2.93Å
162	V	88.5	Confident	69.7	Low	0 Å²	0	56.4 Å²	56.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.1	177.5	-171.8	0	0	0	0	108.8	M133 F134 Y141 S144 T145 I330 A331	M133-V162 WeakPolarHBondContact O-CG2 3.29Å; F134-V162 HydrophobicContact CD1-CG1 3.94Å; F134-V162 HydrophobicContact CE1-CG1 3.77Å; Y141-V162 HydrophobicContact CD1-CG1 4.45Å; Y141-V162 HydrophobicContact CE1-CB 4.31Å; Y141-V162 HydrophobicContact CE1-CG1 4.24Å; Y141-V162 HydrophobicContact CE2-CG1 4.36Å; S144-V162 CarbonylContact C-O 3.17Å; S144-V162 WeakPolarHBondContact CA-O 3.48Å; S144-V162 WeakPolarHBondContact CB-O 3.24Å; T145-V162 PolarHBondContact N-O 3.49Å; T145-V162 PolarHBondContact O-N 3.12Å; V162-I330 WeakPolarHBondContact CA-O 3.34Å; V162-A331 HydrophobicContact CB-CB 4.31Å; V162-A331 HydrophobicContact CG1-CB 4.29Å; V162-A331 HydrophobicContact CG2-CB 3.85Å
163	F	85.6	Confident	67.1	Low	1 Å²	1	49.5 Å²	49.5	0%	0.004	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	161.3	-178.8	57.4	-73.6	0	0	0	111.8	F311 I330 I332 K367 E371	F163-F311 HydrophobicContact CD2-CE1 4.3Å; F163-F311 AromaticContact CE2-CE1 3.93Å; F163-F311 HydrophobicContact CE2-CE1 3.93Å; F163-I330 WeakPolarHBondContact CD1-O 3.38Å; F163-I330 HydrophobicContact CE1-CB 4.2Å; F163-I330 HydrophobicContact CE1-CG2 3.9Å; F163-I330 HydrophobicContact CE2-CB 4.27Å; F163-I330 HydrophobicContact CE2-CG2 4.38Å; F163-I330 HydrophobicContact CZ-CB 4Å; F163-I330 HydrophobicContact CZ-CG2 3.68Å; F163-I330 PolarHBondContact N-O 2.98Å; F163-I330 PolarHBondContact O-N 3.02Å; F163-I332 HydrophobicContact CE1-CD1 3.67Å; F163-I332 HydrophobicContact CE1-CG1 3.96Å; F163-I332 HydrophobicContact CZ-CD1 3.86Å; F163-I332 HydrophobicContact CZ-CG1 4.42Å; F163-K367 HydrophobicContact CE1-CG 4.1Å; F163-K367 HydrophobicContact CE2-CG 4.26Å; F163-K367 HydrophobicContact CZ-CG 3.91Å; F163-E371 HydrophobicContact CE2-CG 3.94Å; F163-E371 WeakPolarHBondContact CE2-OE1 3.34Å; F163-E371 HydrophobicContact CZ-CG 4.43Å
164	T	78.5	Confident	64.5	Low	8 Å²	8	48.2 Å²	48.2	5%	0.049	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.3	-174.3	73.4	0	0	0	0	112.4	R166 S310	T164-R166 PolarHBondContact O-N 3.04Å; T164-S310 WeakPolarHBondContact O-CA 3.27Å; T164-S310 WeakPolarHBondContact O-CB 3.38Å
165	A	66.8	Low	61.9	Low	0 Å²	0	51.6 Å²	51.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	112.3	165.1	0	0	0	0	0	108.5	F311 L313 K327 K328 I330	A165-F311 CarbonylContact C-O 3.57Å; A165-F311 HydrophobicContact CB-CD1 4.32Å; A165-F311 HydrophobicContact CB-CE1 3.59Å; A165-F311 HydrophobicContact CB-CE2 3.97Å; A165-F311 HydrophobicContact CB-CZ 3.4Å; A165-F311 VanDerWaalsContact CB-CZ 3.4Å; A165-L313 HydrophobicContact CB-CD1 3.68Å; A165-K327 WeakPolarHBondContact O-CA 3.45Å; A165-K328 WeakPolarHBondContact CA-O 3.39Å; A165-K328 HydrophobicContact CB-CB 4.45Å; A165-K328 WeakPolarHBondContact CB-O 3.13Å; A165-K328 PolarHBondContact N-O 3.08Å; A165-K328 PolarHBondContact O-N 2.7Å; A165-K328 VanDerWaalsContact O-N 3.14Å; A165-I330 HydrophobicContact CB-CD1 4.15Å
166	R	53.5	Low	59.5	Low	99 Å²	99	56 Å²	56	37%	0.374	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	163.5	167	-63.9	-176.9	-164.8	-162.3	7.7	109.1	T164 I307 S310 F311 N312 L313	T164-R166 PolarHBondContact O-N 3.04Å; R166-I307 PolarHBondContact NH2-O 3.1Å; R166-S310 VanDerWaalsContact CD-O 3.24Å; R166-S310 WeakPolarHBondContact CD-O 3.3Å; R166-S310 WeakPolarHBondContact CG-O 3.34Å; R166-S310 VanDerWaalsContact CZ-OG 3.27Å; R166-S310 PolarHBondContact NE-O 3.16Å; R166-S310 PolarHBondContact NE-OG 3.48Å; R166-S310 PolarHBondContact NH2-OG 3.46Å; R166-F311 WeakPolarHBondContact CA-O 3.5Å; R166-F311 WeakPolarHBondContact CB-O 3.43Å; R166-F311 PolarHBondContact N-O 3.04Å; R166-N312 WeakPolarHBondContact CB-OD1 3.26Å; R166-L313 PolarHBondContact O-N 3.15Å
167	T	44.5	Very low	57.1	Low	33 Å²	33	58.9 Å²	58.9	20%	0.202	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	112.9	177.1	-62.7	0	0	0	0	106.7	L313 V325	T167-L313 CarbonylContact C-O 3.55Å; T167-L313 WeakPolarHBondContact CA-O 3.46Å; T167-L313 VanDerWaalsContact CG2-O 3.25Å; T167-L313 WeakPolarHBondContact CG2-O 3.22Å; T167-V325 HydrophobicContact CG2-CG1 3.56Å; T167-V325 VanDerWaalsContact O-CG1 3.28Å; T167-V325 WeakPolarHBondContact O-CG1 3.43Å
168	G	34.2	Very low	54.2	Low	37 Å²	37	65.3 Å²	65.3	38%	0.381	40%	0.402	S	S	.	.			trans	148.3	151.3	-170.6	0	0	0	0	0	113.5	N312 L313	G168-N312 WeakPolarHBondContact O-CB 3.47Å; G168-N312 PolarHBondContact O-OD1 3.24Å; G168-L313 PolarHBondContact N-O 3.46Å; G168-L313 VanDerWaalsContact N-O 3.15Å
169	S	32.8	Very low	51.5	Low	112 Å²	112	70.5 Å²	70.5	78%	0.783	43%	0.426	S	S	*	.			trans	-107.1	142.1	172	-177.9	0	0	0	0	109.6
170	S	29.8	Very low	48.4	Very low	99 Å²	99	76 Å²	76	69%	0.692	46%	0.456	S	S	*	.			trans	-151	115.1	165.9	59.1	0	0	0	0	109.7	C172	S170-C172 PolarHBondContact O-N 3.44Å
171	I	33.9	Very low	45.5	Very low	173 Å²	173	79.7 Å²	79.7	89%	0.887	48%	0.481	S	S	*	.			trans	-76.9	89.6	178.2	-59.8	165.7	0	0	0	108.5
172	C	29.9	Very low	42.7	Very low	124 Å²	124	84.8 Å²	84.8	84%	0.838	51%	0.508	S	S	*	.			trans	-165.9	130	162.2	-164.5	0	0	0	0	111.6	S170	S170-C172 PolarHBondContact O-N 3.44Å
173	G	30.8	Very low	39.9	Very low	80 Å²	80	89.3 Å²	89.3	83%	0.825	53%	0.529	S	S	*	.			trans	81.2	55.2	148.5	0	0	0	0	0	119.9
174	S	26.5	Very low	37.2	Very low	80 Å²	80	98.6 Å²	98.6	56%	0.559	57%	0.57	S	S	*	*			trans	-151.3	122.8	145.2	-174	0	0	0	0	109.6
175	L	30.1	Very low	35.2	Very low	152 Å²	152	104.5 Å²	104.5	80%	0.796	60%	0.6	S	S	*	*			trans	-102.5	11	-167	-134.2	168.7	0	0	0	113.1
176	N	33.8	Very low	33.6	Very low	141 Å²	141	110.9 Å²	110.9	75%	0.754	63%	0.634	S	S	*	*	S	Bend	trans	-107.4	1.1	-164.7	-66.4	4.7	0	0	0	115.1
177	T	38.5	Very low	32.6	Very low	88 Å²	88	114.4 Å²	114.4	54%	0.54	66%	0.655	S	S	.	*			trans	-116.2	9	-168.8	51.5	0	0	0	0	115.7	Q179 S181	T177-Q179 VanDerWaalsContact C-N 3.29Å; T177-Q179 PolarHBondContact O-N 3.19Å; T177-S181 PolarHBondContact O-OG 3.06Å
178	L	32.3	Very low	31.7	Very low	135 Å²	135	120.1 Å²	120.1	71%	0.707	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-14.9	175.2	-69.6	178.8	0	0	0	113.7
179	Q	34	Very low	31.4	Very low	110 Å²	110	126.2 Å²	126.2	51%	0.514	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	-49.5	-179.9	-166.6	62.1	54.4	0	0	112	T177 S181 L182	T177-Q179 VanDerWaalsContact C-N 3.29Å; T177-Q179 PolarHBondContact O-N 3.19Å; Q179-S181 PolarHBondContact O-N 3.27Å; Q179-L182 PolarHBondContact O-N 3.45Å
180	D	28.4	Very low	31	Very low	117 Å²	117	128.9 Å²	128.9	63%	0.626	71%	0.713	S	S	*	*	H	α-helix	trans	-64.3	-26.4	179.8	-58.4	-6.3	0	0	0	112.5	L182	D180-L182 PolarHBondContact O-N 3.38Å
181	S	31.7	Very low	31	Very low	76 Å²	76	130.5 Å²	130.5	53%	0.531	72%	0.719	S	S	.	*	H	α-helix	trans	-70.4	-15.6	-178	-61.2	0	0	0	0	113.5	T177 Q179	T177-S181 PolarHBondContact O-OG 3.06Å; Q179-S181 PolarHBondContact O-N 3.27Å
182	L	33.3	Very low	30.8	Very low	116 Å²	116	130.9 Å²	130.9	61%	0.607	72%	0.722	S	S	*	*	H	α-helix	trans	-95.4	-23.8	-178.7	-150.6	78.6	0	0	0	113.4	Q179 D180 F184	Q179-L182 PolarHBondContact O-N 3.45Å; D180-L182 PolarHBondContact O-N 3.38Å; L182-F184 VanDerWaalsContact C-N 3.32Å; L182-F184 PolarHBondContact O-N 3.01Å
183	E	30	Very low	30.7	Very low	95 Å²	95	134.3 Å²	134.3	44%	0.444	72%	0.723	S	S	.	*	H	α-helix	trans	-77	-22	-175.8	-62.5	-173.3	-166.3	0	0	112	I185 R1067	E183-I185 VanDerWaalsContact C-N 3.28Å; E183-I185 PolarHBondContact O-N 3.07Å; E183-R1067 IonicContact OE1-CZ 3.61Å; E183-R1067 IonicContact OE1-NH1 3.29Å; E183-R1067 PolarHBondContact OE1-NH1 2.97Å; E183-R1067 IonicContact OE1-NH2 2.77Å; E183-R1067 PolarHBondContact OE1-NH2 2.98Å
184	F	28.8	Very low	30.4	Very low	196 Å²	196	135.2 Å²	135.2	86%	0.86	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	1.5	178.5	-126.1	-83.6	0	0	0	115.5	L182	L182-F184 VanDerWaalsContact C-N 3.32Å; L182-F184 PolarHBondContact O-N 3.01Å
185	I	36	Very low	30.3	Very low	131 Å²	131	138.8 Å²	138.8	67%	0.672	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-15.6	-179.6	-63.9	178.1	0	0	0	112.2	E183	E183-I185 VanDerWaalsContact C-N 3.28Å; E183-I185 PolarHBondContact O-N 3.07Å
186	N	32.7	Very low	30.2	Very low	135 Å²	135	138.3 Å²	138.3	72%	0.722	73%	0.733	S	S	*	*	S	Bend	trans	-105.5	18	-174.1	-71.7	-56.4	0	0	0	114.7
187	Q	31.9	Very low	29.8	Very low	172 Å²	172	138.5 Å²	138.5	80%	0.804	73%	0.734	S	S	*	*	S	Bend	trans	-123.7	70.7	170.7	-69.3	-170.1	7.4	0	0	111.3
188	D	26.4	Very low	29.2	Very low	154 Å²	154	139.6 Å²	139.6	82%	0.824	74%	0.741	S	S	*	*	S	Bend	trans	-179.7	106.8	138.1	-98.3	-23.5	0	0	0	110.8
189	N	27.4	Very low	28.9	Very low	164 Å²	164	139.1 Å²	139.1	88%	0.877	74%	0.743	S	S	*	*			trans	171.6	92.8	149.7	-98.1	-56.7	0	0	0	109.8
190	N	24.7	Very low	28.6	Very low	169 Å²	169	140.6 Å²	140.6	90%	0.904	75%	0.754	S	S	*	*			trans	-148.2	40.8	173.6	-121.4	-27.4	0	0	0	114.4
191	T	29.2	Very low	28.6	Very low	132 Å²	132	142.4 Å²	142.4	81%	0.81	76%	0.763	S	S	*	*			trans	-141.8	90	162.8	49.3	0	0	0	0	111.7
192	L	29.9	Very low	28.3	Very low	182 Å²	182	142.1 Å²	142.1	95%	0.953	77%	0.772	S	S	*	*			trans	-171.5	160.9	140.3	-103.3	162.8	0	0	0	109.8
193	K	27.8	Very low	28.1	Very low	196 Å²	196	144.3 Å²	144.3	85%	0.852	78%	0.783	S	S	*	*			trans	-85.6	146.4	-174.6	-63.7	177	-179	176.5	0	111.2
194	A	25.6	Very low	28.2	Very low	98 Å²	98	147.9 Å²	147.9	81%	0.81	80%	0.804	S	S	*	*			trans	-85.8	138.4	164.6	0	0	0	0	0	110.5
195	D	23.9	Very low	28.1	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	79%	0.793	S	S	*	*			trans	-124.4	148	162.8	-96.1	-52.3	0	0	0	108.8
196	N	27.5	Very low	27.8	Very low	141 Å²	141	142.5 Å²	142.5	75%	0.754	80%	0.8	S	S	*	*			trans	-86.2	144.3	-171.3	-58.2	-72.7	0	0	0	112.1
197	N	25.7	Very low	27.7	Very low	146 Å²	146	143.8 Å²	143.8	78%	0.781	81%	0.805	S	S	*	*				169.1	119.2	114.4	-87.6	-45	0	0	0	115.2
198	T	26.2	Very low	27.4	Very low	111 Å²	111	138.8 Å²	138.8	68%	0.681	80%	0.8	S	S	*	*				67.7	92.8	116.4	-46.6	0	0	0	0	121
199	V	26.4	Very low	27.4	Very low	124 Å²	124	139.9 Å²	139.9	75%	0.752	80%	0.804	S	S	*	*				92.9	140.3	121.7	164.7	0	0	0	0	122.9
200	I	26.8	Very low	27.2	Very low	142 Å²	142	136.6 Å²	136.6	73%	0.728	80%	0.795	S	S	*	*			trans	103.6	127	152.7	-100.4	161.7	0	0	0	121.1
201	N	28.3	Very low	27.4	Very low	155 Å²	155	136.2 Å²	136.2	83%	0.829	79%	0.787	S	S	*	*			trans	57.1	131.7	165.6	-62.8	-5.2	0	0	0	120.8
202	G	25	Very low	27.2	Very low	69 Å²	69	139.1 Å²	139.1	71%	0.711	79%	0.789	S	S	*	*			cis	140.6	114.6	-17.3	0	0	0	0	0	116.2
203	L	29.5	Very low	26.9	Very low	163 Å²	163	136.2 Å²	136.2	85%	0.853	78%	0.783	S	S	*	*			trans	177	108.4	153.3	-94.5	149.7	0	0	0	105.8
204	L	32.6	Very low	26.8	Very low	169 Å²	169	132.6 Å²	132.6	89%	0.885	78%	0.782	S	S	*	*				53.2	119.3	92.9	-87	160.3	0	0	0	113.9
205	G	27.1	Very low	27.5	Very low	59 Å²	59	133.8 Å²	133.8	61%	0.608	78%	0.781	S	S	*	*			cis	-163.3	155.5	-2.9	0	0	0	0	0	109.8
206	N	28.5	Very low	27.6	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	79%	0.788	S	S	*	*				58.7	134.4	67	-70.7	10.5	0	0	0	112
207	I	31.8	Very low	27.6	Very low	163 Å²	163	140.8 Å²	140.8	84%	0.836	79%	0.786	S	S	*	*			cis	-132.2	153.6	11.9	-68.7	91.4	0	0	0	107.3
208	G	24.4	Very low	27.6	Very low	66 Å²	66	138.8 Å²	138.8	68%	0.68	79%	0.789	S	S	*	*			cis	127.9	147.9	7.3	0	0	0	0	0	110.8
209	L	26.7	Very low	27.5	Very low	177 Å²	177	140.1 Å²	140.1	93%	0.927	79%	0.786	S	S	*	*			trans	-150.5	119.7	-180	-136.9	157.5	0	0	0	110.7
210	S	24.6	Very low	27.5	Very low	96 Å²	96	140.1 Å²	140.1	67%	0.671	79%	0.791	S	S	*	*			trans	-141	131.5	-171.1	57.2	0	0	0	0	111.6
211	Q	28.5	Very low	27.5	Very low	160 Å²	160	140.8 Å²	140.8	75%	0.748	79%	0.791	S	S	*	*			trans	65.5	142.3	172.4	-58.7	166.5	-21.9	0	0	113
212	F	24.2	Very low	27.5	Very low	193 Å²	193	142.3 Å²	142.3	85%	0.846	79%	0.793	S	S	*	*			cis	-143.1	165.5	38.9	-90.2	-91.3	0	0	0	114.1
213	C	24.8	Very low	27.5	Very low	121 Å²	121	142.5 Å²	142.5	82%	0.818	80%	0.795	S	S	*	*			trans	-96.1	123.6	167	-54.9	0	0	0	0	111
214	S	25.6	Very low	27.6	Very low	121 Å²	121	140.4 Å²	140.4	85%	0.846	79%	0.791	S	S	*	*			trans	173.9	145.8	139.2	-82.7	0	0	0	0	112.3
215	P	40.4	Very low	27.4	Very low	122 Å²	122	140.5 Å²	140.5	79%	0.792	79%	0.792	S	S	*	*			trans	-93.8	143.5	-177.4	35.5	-33.7	0	0	0	113.6
216	R	25.4	Very low	27.4	Very low	255 Å²	255	149.2 Å²	149.2	96%	0.962	81%	0.807	S	S	*	*			trans	-155	166.9	156.5	-113.4	168.9	-160	-139.8	2.5	112.6
217	R	27.8	Very low	27.3	Very low	190 Å²	190	149.8 Å²	149.8	72%	0.717	81%	0.809	S	S	*	*			trans	-80.3	156.4	-166.1	-54.1	167.9	-175	156.9	-1.6	112.4
218	A	24.4	Very low	27.1	Very low	103 Å²	103	150.2 Å²	150.2	85%	0.851	81%	0.811	S	S	*	*			trans	-126	140.6	147.8	0	0	0	0	0	108.9
219	F	23.8	Very low	27.2	Very low	140 Å²	140	157.9 Å²	157.9	61%	0.614	82%	0.82	S	S	*	*			trans	-119.2	147	165.3	-91.8	-87.4	0	0	0	107.1
220	S	27.1	Very low	27.3	Very low	124 Å²	124	155.7 Å²	155.7	87%	0.867	82%	0.819	S	S	*	*			trans	-156.4	138.5	154.5	-168.6	0	0	0	0	107.5
221	E	26.4	Very low	27.3	Very low	156 Å²	156	154.6 Å²	154.6	73%	0.729	82%	0.816	S	S	*	*			trans	-103.8	-177.1	-176.4	-61.1	-167	124.9	0	0	112.8
222	Q	28	Very low	27.2	Very low	186 Å²	186	152.1 Å²	152.1	87%	0.869	82%	0.816	S	S	*	*			trans	75.5	107	158.6	-59.8	177.4	20.3	0	0	117.6
223	G	26.9	Very low	27.3	Very low	73 Å²	73	152 Å²	152	75%	0.753	82%	0.816	S	S	*	*			trans	168.7	115.2	171.1	0	0	0	0	0	111.1
224	P	29.8	Very low	27.4	Very low	119 Å²	119	155.8 Å²	155.8	77%	0.773	82%	0.818	S	S	*	*			trans	-85.3	150.3	-162.6	31.6	-36.2	0	0	0	115.9
225	L	29.2	Very low	27.5	Very low	172 Å²	172	154.8 Å²	154.8	90%	0.901	82%	0.818	S	S	*	*			trans	5.6	116.2	156.7	-59.7	174.1	0	0	0	117.7
226	R	27.2	Very low	26.7	Very low	242 Å²	242	154.7 Å²	154.7	91%	0.913	81%	0.814	S	S	*	*			trans	-122.2	107.3	155.5	-80.6	-171.8	170.6	166.5	0	111.7	I228	R226-I228 PolarHBondContact O-N 3.27Å
227	L	26.8	Very low	26.8	Very low	167 Å²	167	151.1 Å²	151.1	87%	0.874	81%	0.808	S	S	*	*			trans	-53.1	125.6	165.7	-71.6	156	0	0	0	110.1	R229	L227-R229 VanDerWaalsContact C-N 3.32Å; L227-R229 PolarHBondContact O-N 3.32Å
228	I	27.5	Very low	26.9	Very low	172 Å²	172	147.2 Å²	147.2	88%	0.882	81%	0.81	S	S	*	*			trans	-72.6	92.7	167.7	-60.7	179.1	0	0	0	107.3	R226 S230	R226-I228 PolarHBondContact O-N 3.27Å; I228-S230 PolarHBondContact O-N 2.84Å
229	R	25.4	Very low	27.1	Very low	227 Å²	227	149.6 Å²	149.6	86%	0.857	81%	0.808	S	S	*	*			trans	-66	114.8	174	-100.7	-178.3	168.4	156.9	-3.2	109.8	L227 A231	L227-R229 VanDerWaalsContact C-N 3.32Å; L227-R229 PolarHBondContact O-N 3.32Å; R229-A231 PolarHBondContact O-N 3.09Å; R229-A231 VanDerWaalsContact O-N 3.13Å
230	S	28.9	Very low	27.4	Very low	130 Å²	130	148.9 Å²	148.9	91%	0.909	82%	0.818	S	S	*	*			trans	-57.9	112	158	-55.6	0	0	0	0	108.9	I228	I228-S230 PolarHBondContact O-N 2.84Å
231	A	25.4	Very low	27.5	Very low	74 Å²	74	150.4 Å²	150.4	61%	0.612	81%	0.813	S	S	*	*			trans	-128.3	122.3	177.6	0	0	0	0	0	109.7	R229 F233	R229-A231 PolarHBondContact O-N 3.09Å; R229-A231 VanDerWaalsContact O-N 3.13Å; A231-F233 HydrophobicContact CB-CE2 4.32Å
232	S	27.1	Very low	27.8	Very low	107 Å²	107	149.3 Å²	149.3	75%	0.748	81%	0.812	S	S	*	*			trans	-76.4	140.7	169.8	46	0	0	0	0	110.3
233	F	24.8	Very low	27.8	Very low	192 Å²	192	149 Å²	149	84%	0.842	81%	0.813	S	S	*	*			trans	-134.4	118.5	165.4	-87.5	-81.1	0	0	0	110.2	A231	A231-F233 HydrophobicContact CB-CE2 4.32Å
234	F	28.6	Very low	28.5	Very low	199 Å²	199	151 Å²	151	87%	0.873	81%	0.813	S	S	*	*			trans	-77.6	133.3	162.8	-74.5	-97.3	0	0	0	108.6
235	A	26.3	Very low	28.4	Very low	101 Å²	101	148.8 Å²	148.8	84%	0.835	81%	0.812	S	S	*	*			trans	-122.3	111.7	166	0	0	0	0	0	108.7
236	V	23.9	Very low	28.5	Very low	119 Å²	119	151.9 Å²	151.9	72%	0.721	81%	0.811	S	S	*	*			trans	-90.5	176.9	167.6	174.7	0	0	0	0	108
237	H	28.2	Very low	28.6	Very low	180 Å²	180	147.8 Å²	147.8	83%	0.833	80%	0.803	S	S	*	*			trans	89.4	131.5	-174.8	-42.3	-57.1	0	0	0	113.8
238	S	29.4	Very low	28.9	Very low	108 Å²	108	148.2 Å²	148.2	76%	0.755	81%	0.805	S	S	*	*			cis	-159.6	149.1	-12.3	39.9	0	0	0	0	110.6
239	N	27.6	Very low	29.1	Very low	153 Å²	153	146.5 Å²	146.5	82%	0.818	80%	0.797	S	S	*	*			trans	-83.5	136.1	172.9	-70.2	-3.3	0	0	0	110.8
240	P	30.5	Very low	29.3	Very low	126 Å²	126	144.6 Å²	144.6	82%	0.818	80%	0.798	S	S	*	*			trans	-77.7	148.3	154	33.1	-31.4	0	0	0	110.5
241	M	29.8	Very low	29.5	Very low	155 Å²	155	145.5 Å²	145.5	76%	0.764	79%	0.793	S	S	*	*			trans	-108.1	145.6	178.2	-80.1	-75	-64.9	0	0	111.9
242	D	33.8	Very low	29.9	Very low	133 Å²	133	153.6 Å²	153.6	71%	0.711	81%	0.808	S	S	*	*			trans	19.2	138.3	158.5	-69.2	-32.9	0	0	0	123.2
243	M	26.1	Very low	30.1	Very low	180 Å²	180	156 Å²	156	89%	0.887	81%	0.812	S	S	*	*			trans	-151.6	119.3	130.5	-114.2	-64.8	-178.3	0	0	110.7
244	P	42.7	Very low	30.8	Very low	115 Å²	115	152.7 Å²	152.7	75%	0.747	81%	0.813	S	S	*	*			trans	-85.5	149	175.8	33.4	-34.2	0	0	0	112.5
245	G	27.7	Very low	30.8	Very low	72 Å²	72	146.2 Å²	146.2	74%	0.742	80%	0.802	S	S	*	*			trans	-152.5	78.8	-168.9	0	0	0	0	0	118.3
246	R	32.1	Very low	31	Very low	237 Å²	237	149.9 Å²	149.9	89%	0.894	81%	0.806	S	S	*	*			trans	67.3	145.7	152.9	-63.9	-176.6	173	-81.7	-2.6	120.3
247	E	29.3	Very low	31.3	Very low	157 Å²	157	147.2 Å²	147.2	73%	0.734	80%	0.796	S	S	*	*			trans	-88.4	164	-175	-46.5	104.3	145.1	0	0	114.6
248	L	32.5	Very low	31.4	Very low	175 Å²	175	149.8 Å²	149.8	92%	0.916	80%	0.798	S	S	*	*			trans	-142.8	143.4	133.7	-149.7	77.9	0	0	0	109.3
249	N	31.2	Very low	31.4	Very low	136 Å²	136	149.9 Å²	149.9	73%	0.727	80%	0.799	S	S	*	*			trans	-89.8	154.7	-172.4	-57.6	-52.1	0	0	0	112.7
250	E	30.6	Very low	31.4	Very low	188 Å²	188	147 Å²	147	88%	0.879	80%	0.796	S	S	*	*				-169	164.2	100.7	-102.7	-174.7	-164.3	0	0	112.3
251	D	32.4	Very low	31.3	Very low	148 Å²	148	146.3 Å²	146.3	79%	0.791	80%	0.795	S	S	*	*			trans	-84.8	157.3	-160.3	-53.8	-78.4	0	0	0	115.8
252	R	34.4	Very low	31.2	Very low	245 Å²	245	146 Å²	146	93%	0.925	80%	0.795	S	S	*	*				-167.9	130.8	110.9	-107.8	174.1	-179.1	-124.4	-4	115.3
253	D	30.5	Very low	30.9	Very low	156 Å²	156	144.9 Å²	144.9	83%	0.834	80%	0.798	S	S	*	*			trans	-72.2	139.6	168.5	-93.6	-51.1	0	0	0	113.3
254	S	39.1	Very low	30.9	Very low	124 Å²	124	141.8 Å²	141.8	87%	0.867	79%	0.794	S	S	*	*			trans	-173.6	118.7	148.3	-77.7	0	0	0	0	108.5
255	G	28.6	Very low	30.2	Very low	62 Å²	62	143.2 Å²	143.2	64%	0.639	79%	0.794	S	S	*	*			cis	124.4	120.1	2.3	0	0	0	0	0	110.8
256	I	31.5	Very low	30.4	Very low	178 Å²	178	148 Å²	148	91%	0.913	80%	0.802	S	S	*	*			trans	71.4	154.2	173	-50.6	159.6	0	0	0	114.8
257	A	29.6	Very low	30.4	Very low	63 Å²	63	143.1 Å²	143.1	52%	0.521	79%	0.792	S	S	.	*				174.5	136	-76.5	0	0	0	0	0	110.3
258	R	30.1	Very low	30.4	Very low	234 Å²	234	142.1 Å²	142.1	88%	0.883	80%	0.797	S	S	*	*			trans	67.7	153.3	166.6	-56.2	174.1	174.8	91.7	1	114.1
259	S	29.2	Very low	30.4	Very low	111 Å²	111	138.7 Å²	138.7	78%	0.776	79%	0.786	S	S	*	*			cis	-153.1	154.6	33.6	-57.7	0	0	0	0	115.3
260	A	28.5	Very low	30.1	Very low	91 Å²	91	142 Å²	142	75%	0.752	79%	0.794	S	S	*	*			trans	58.9	130.5	144.9	0	0	0	0	0	120.7
261	S	28.1	Very low	30.2	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	79%	0.789	S	S	*	*				76.7	139.8	55.2	-89.3	0	0	0	0	113.9
262	L	27.4	Very low	30.3	Very low	149 Å²	149	136.6 Å²	136.6	78%	0.78	79%	0.786	S	S	*	*			cis	-152.8	160.7	18.4	-116.7	-176.3	0	0	0	112.4
263	S	27.7	Very low	30.2	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	78%	0.779	S	S	*	*			trans	67.7	154.9	153.2	-65.7	0	0	0	0	119.6
264	S	25.7	Very low	29.9	Very low	115 Å²	115	130.8 Å²	130.8	80%	0.804	78%	0.78	S	S	*	*			cis	-122.2	166.8	14.1	59.8	0	0	0	0	115.4
265	L	28.8	Very low	29.3	Very low	145 Å²	145	131 Å²	131	76%	0.759	78%	0.781	S	S	*	*			trans	-133.8	135.7	179.3	-76	167.6	0	0	0	110.5	I267	L265-I267 HydrophobicContact CB-CD1 4.41Å; L265-I267 HydrophobicContact CB-CG1 4.28Å
266	L	31.7	Very low	29.7	Very low	174 Å²	174	133.6 Å²	133.6	91%	0.911	79%	0.789	S	S	*	*			trans	-142.1	101	154.3	-66.8	176	0	0	0	104.8
267	I	31	Very low	29.5	Very low	133 Å²	133	133.3 Å²	133.3	68%	0.682	79%	0.789	S	S	*	*				67.6	92.6	57.4	-51.5	177.2	0	0	0	112	L265	L265-I267 HydrophobicContact CB-CD1 4.41Å; L265-I267 HydrophobicContact CB-CG1 4.28Å
268	T	29.1	Very low	29.9	Very low	136 Å²	136	136.3 Å²	136.3	83%	0.834	80%	0.801	S	S	*	*			trans	-83.2	147.1	152.5	51.1	0	0	0	0	109.4
269	P	33	Very low	30.1	Very low	104 Å²	104	136.3 Å²	136.3	68%	0.675	80%	0.801	S	S	*	*			trans	-96.6	157.9	-159.4	37.5	-38.2	0	0	0	116.8
270	F	25.7	Very low	30.3	Very low	204 Å²	204	137 Å²	137	90%	0.895	81%	0.806	S	S	*	*			trans	73.3	140.1	163.6	-67.7	-66.7	0	0	0	122.1
271	P	32.1	Very low	30.8	Very low	119 Å²	119	137.6 Å²	137.6	77%	0.773	80%	0.803	S	S	*	*			trans	-110.4	-179.9	177.4	43.3	-34.5	0	0	0	114.5
272	S	33.4	Very low	31.1	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	78%	0.784	S	S	*	*			trans	-72.4	160.6	-177.4	56	0	0	0	0	117.6
273	P	33.5	Very low	32.2	Very low	122 Å²	122	130 Å²	130	79%	0.792	77%	0.765	S	S	*	*			trans	-98.4	113.8	153	34.7	-26.9	0	0	0	113.4
274	N	24.7	Very low	33.5	Very low	158 Å²	158	128 Å²	128	85%	0.845	75%	0.751	S	S	*	*			trans	27.7	110.1	146.6	-58.1	-12.9	0	0	0	121.2
275	S	26.5	Very low	34.3	Very low	127 Å²	127	130.9 Å²	130.9	89%	0.888	75%	0.746	S	S	*	*				-131.7	142.5	109.9	69.4	0	0	0	0	109.7
276	S	36.3	Very low	35.1	Very low	117 Å²	117	128.3 Å²	128.3	82%	0.818	73%	0.73	S	S	*	*			trans	-100	110.8	-163.8	55.8	0	0	0	0	113
277	L	28.2	Very low	36.3	Very low	172 Å²	172	127.7 Å²	127.7	90%	0.901	72%	0.715	S	S	*	*			trans	-153.3	146.2	157.4	-108.5	162.1	0	0	0	111
278	T	37.8	Very low	37.4	Very low	127 Å²	127	129.5 Å²	129.5	78%	0.779	71%	0.714	S	S	*	*			trans	-95.5	120.8	-162.4	43.9	0	0	0	0	113.5
279	R	33.1	Very low	38.3	Very low	234 Å²	234	129 Å²	129	88%	0.883	70%	0.696	S	S	*	*			trans	174.8	86.2	146.6	-96.8	152.5	-174.9	173.9	2.8	112.4	C281	R279-C281 PolarHBondContact O-N 3.44Å; R279-C281 VanDerWaalsContact O-N 3.17Å
280	S	34.8	Very low	39.1	Very low	126 Å²	126	132.1 Å²	132.1	88%	0.881	70%	0.695	S	S	*	*			trans	-82.6	89.5	166.5	-168.7	0	0	0	0	110.1
281	C	37.3	Very low	40.6	Very low	102 Å²	102	131.2 Å²	131.2	69%	0.689	69%	0.686	S	S	*	*			trans	-123.9	31.7	-175.7	-66.6	0	0	0	0	112.6	R279 S283	R279-C281 PolarHBondContact O-N 3.44Å; R279-C281 VanDerWaalsContact O-N 3.17Å; C281-S283 PolarHBondContact O-N 2.83Å
282	A	35.5	Very low	41.5	Very low	46 Å²	46	128 Å²	128	38%	0.38	67%	0.666	S	S	.	*			trans	-67.3	89.4	179.5	0	0	0	0	0	111.8	R287	A282-R287 PolarHBondContact O-NE 3.42Å; A282-R287 PolarHBondContact O-NH2 2.57Å
283	S	50.8	Low	42.3	Very low	56 Å²	56	127.5 Å²	127.5	39%	0.392	65%	0.652	S	S	.	*			trans	-56.2	158.3	-175.3	70.1	0	0	0	0	113.2	C281 Y285 Q286 R287	C281-S283 PolarHBondContact O-N 2.83Å; S283-Y285 PolarHBondContact O-N 3.48Å; S283-Y285 VanDerWaalsContact O-N 3.16Å; S283-Q286 PolarHBondContact O-N 3.2Å; S283-Q286 PolarHBondContact OG-N 3Å; S283-Q286 VanDerWaalsContact OG-N 3.08Å; S283-R287 PolarHBondContact O-N 3.26Å; S283-R287 VanDerWaalsContact O-N 3.09Å
284	S	54.6	Low	43.2	Very low	67 Å²	67	127.3 Å²	127.3	47%	0.469	65%	0.649	S	S	.	*	H	α-helix	trans	-64	-18.3	173.8	80.8	0	0	0	0	112.6	R288	S284-R288 WeakPolarHBondContact O-CB 3.42Å; S284-R288 WeakPolarHBondContact O-CG 3.31Å; S284-R288 PolarHBondContact O-N 2.96Å; S284-R288 VanDerWaalsContact O-N 3.13Å; S284-R288 PolarHBondContact O-NE 2.81Å; S284-R288 PolarHBondContact OG-NH2 2.84Å
285	Y	41.7	Very low	44.3	Very low	176 Å²	176	122.4 Å²	122.4	69%	0.69	63%	0.625	S	S	*	*	H	α-helix	trans	-70.8	-50	168.7	-179.4	-99	0	0	0	111.1	S283 R287 R288 W289	S283-Y285 PolarHBondContact O-N 3.48Å; S283-Y285 VanDerWaalsContact O-N 3.16Å; Y285-R287 VanDerWaalsContact C-N 3.32Å; Y285-R287 PolarHBondContact O-N 2.79Å; Y285-R288 CarbonylContact O-C 3.54Å; Y285-R288 PolarHBondContact O-N 2.93Å; Y285-W289 WeakPolarHBondContact O-CB 3.35Å; Y285-W289 PolarHBondContact O-N 3.44Å
286	Q	45.6	Very low	45.2	Very low	91 Å²	91	117.3 Å²	117.3	43%	0.425	59%	0.589	S	S	.	*	H	α-helix	trans	-65.4	-33.7	-179.1	-161.8	172.5	14.9	0	0	112.7	S283 R290	S283-Q286 PolarHBondContact O-N 3.2Å; S283-Q286 PolarHBondContact OG-N 3Å; S283-Q286 VanDerWaalsContact OG-N 3.08Å; Q286-R290 PolarHBondContact O-N 3.24Å
287	R	57.5	Low	45.9	Very low	160 Å²	160	117 Å²	117	60%	0.604	58%	0.578	S	S	*	*	H	α-helix	trans	-69.8	-36.4	169.7	-90.4	174.6	-76.1	159	-5.9	113.3	A282 S283 Y285 R291	A282-R287 PolarHBondContact O-NE 3.42Å; A282-R287 PolarHBondContact O-NH2 2.57Å; S283-R287 PolarHBondContact O-N 3.26Å; S283-R287 VanDerWaalsContact O-N 3.09Å; Y285-R287 VanDerWaalsContact C-N 3.32Å; Y285-R287 PolarHBondContact O-N 2.79Å; R287-R291 WeakPolarHBondContact O-CB 3.43Å; R287-R291 WeakPolarHBondContact O-CG 3.48Å; R287-R291 PolarHBondContact O-N 3.43Å
288	R	53.3	Low	46.7	Very low	172 Å²	172	112.7 Å²	112.7	65%	0.649	55%	0.553	S	S	*	*	H	α-helix	trans	-69.6	-36.5	171.9	-87.3	-178.2	-88.6	-157.3	-4.9	112.5	S284 Y285 R291 S292	S284-R288 WeakPolarHBondContact O-CB 3.42Å; S284-R288 WeakPolarHBondContact O-CG 3.31Å; S284-R288 PolarHBondContact O-N 2.96Å; S284-R288 VanDerWaalsContact O-N 3.13Å; S284-R288 PolarHBondContact O-NE 2.81Å; S284-R288 PolarHBondContact OG-NH2 2.84Å; Y285-R288 CarbonylContact O-C 3.54Å; Y285-R288 PolarHBondContact O-N 2.93Å; R288-R291 PolarHBondContact O-N 3.1Å; R288-S292 WeakPolarHBondContact O-CB 3.26Å; R288-S292 PolarHBondContact O-N 2.96Å
289	W	49.9	Very low	46.4	Very low	124 Å²	124	114.8 Å²	114.8	47%	0.47	56%	0.559	S	S	.	*	H	α-helix	trans	-64.9	-50.1	175.2	-178.6	83	0	0	0	111	Y285 R291 S292 Q293	Y285-W289 WeakPolarHBondContact O-CB 3.35Å; Y285-W289 PolarHBondContact O-N 3.44Å; W289-R291 VanDerWaalsContact C-N 3.32Å; W289-R291 PolarHBondContact O-N 2.91Å; W289-S292 WeakPolarHBondContact O-CB 3.46Å; W289-S292 PolarHBondContact O-N 3.34Å; W289-S292 VanDerWaalsContact O-N 3.1Å; W289-Q293 HydrophobicContact CD2-CG 4.27Å; W289-Q293 HydrophobicContact CE3-CG 4.38Å; W289-Q293 HydrophobicContact CH2-CG 4.33Å; W289-Q293 HydrophobicContact CZ2-CG 4.21Å; W289-Q293 HydrophobicContact CZ3-CG 4.4Å; W289-Q293 WeakPolarHBondContact O-CG 3.4Å; W289-Q293 PolarHBondContact O-N 3.44Å
290	R	49.7	Very low	46.5	Very low	170 Å²	170	105.7 Å²	105.7	64%	0.642	54%	0.538	S	S	*	.	H	α-helix	trans	-60.3	-38.4	173.4	-74.4	-163.7	178.2	-159.1	0	112.6	Q286 Q293 T294	Q286-R290 PolarHBondContact O-N 3.24Å; R290-Q293 PolarHBondContact O-N 2.79Å; R290-T294 PolarHBondContact O-N 3.36Å; R290-T294 PolarHBondContact O-OG1 2.98Å
291	R	56.4	Low	46.4	Very low	186 Å²	186	104.8 Å²	104.8	70%	0.702	53%	0.528	S	S	*	.	H	α-helix	trans	-64	-38	172.7	-78.3	178.8	176.5	-175.9	-2.7	113.2	R287 R288 W289 T294 T295	R287-R291 WeakPolarHBondContact O-CB 3.43Å; R287-R291 WeakPolarHBondContact O-CG 3.48Å; R287-R291 PolarHBondContact O-N 3.43Å; R288-R291 PolarHBondContact O-N 3.1Å; W289-R291 VanDerWaalsContact C-N 3.32Å; W289-R291 PolarHBondContact O-N 2.91Å; R291-T294 WeakPolarHBondContact CA-OG1 3.16Å; R291-T294 PolarHBondContact O-N 2.93Å; R291-T294 PolarHBondContact O-OG1 3.45Å; R291-T295 PolarHBondContact O-N 2.92Å; R291-T295 VanDerWaalsContact O-N 3.08Å; R291-T295 PolarHBondContact O-OG1 3.06Å
292	S	50.5	Low	46.2	Very low	52 Å²	52	107.3 Å²	107.3	36%	0.364	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-36.9	174.5	-166	0	0	0	0	111.6	S140 R288 W289 T295 S296	S140-S292 WeakPolarHBondContact CB-OG 3.33Å; S140-S292 PolarHBondContact OG-O 2.83Å; S140-S292 PolarHBondContact OG-OG 2.84Å; R288-S292 WeakPolarHBondContact O-CB 3.26Å; R288-S292 PolarHBondContact O-N 2.96Å; W289-S292 WeakPolarHBondContact O-CB 3.46Å; W289-S292 PolarHBondContact O-N 3.34Å; W289-S292 VanDerWaalsContact O-N 3.1Å; S292-T295 WeakPolarHBondContact CA-OG1 3.5Å; S292-T295 CarbonylContact O-C 3.4Å; S292-T295 PolarHBondContact O-N 2.91Å; S292-T295 PolarHBondContact O-OG1 3.48Å; S292-S296 PolarHBondContact O-N 3.22Å
293	Q	51.9	Low	46.1	Very low	92 Å²	92	107.7 Å²	107.7	43%	0.43	53%	0.526	S	S	.	.	H	α-helix	trans	-62.5	-47.9	172.5	-65.6	-75.4	38.2	0	0	110.8	W289 R290 T295 S296	W289-Q293 HydrophobicContact CD2-CG 4.27Å; W289-Q293 HydrophobicContact CE3-CG 4.38Å; W289-Q293 HydrophobicContact CH2-CG 4.33Å; W289-Q293 HydrophobicContact CZ2-CG 4.21Å; W289-Q293 HydrophobicContact CZ3-CG 4.4Å; W289-Q293 WeakPolarHBondContact O-CG 3.4Å; W289-Q293 PolarHBondContact O-N 3.44Å; R290-Q293 PolarHBondContact O-N 2.79Å; Q293-T295 PolarHBondContact O-N 3.29Å; Q293-T295 VanDerWaalsContact O-N 3.15Å; Q293-S296 VanDerWaalsContact O-CB 3.3Å; Q293-S296 WeakPolarHBondContact O-CB 3.49Å; Q293-S296 PolarHBondContact O-N 3.38Å
294	T	51.8	Low	45.6	Very low	119 Å²	119	116.3 Å²	116.3	73%	0.73	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-4.4	176.9	57.2	0	0	0	0	114.7	R290 R291	R290-T294 PolarHBondContact O-N 3.36Å; R290-T294 PolarHBondContact O-OG1 2.98Å; R291-T294 WeakPolarHBondContact CA-OG1 3.16Å; R291-T294 PolarHBondContact O-N 2.93Å; R291-T294 PolarHBondContact O-OG1 3.45Å
295	T	47.3	Very low	45	Very low	54 Å²	54	119 Å²	119	33%	0.331	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	17.7	171.6	51.9	0	0	0	0	111.8	M139 S140 R291 S292 Q293	M139-T295 VanDerWaalsContact CE-O 3.23Å; M139-T295 WeakPolarHBondContact CE-O 3.47Å; S140-T295 PolarHBondContact OG-O 3.24Å; R291-T295 PolarHBondContact O-N 2.92Å; R291-T295 VanDerWaalsContact O-N 3.08Å; R291-T295 PolarHBondContact O-OG1 3.06Å; S292-T295 WeakPolarHBondContact CA-OG1 3.5Å; S292-T295 CarbonylContact O-C 3.4Å; S292-T295 PolarHBondContact O-N 2.91Å; S292-T295 PolarHBondContact O-OG1 3.48Å; Q293-T295 PolarHBondContact O-N 3.29Å; Q293-T295 VanDerWaalsContact O-N 3.15Å
296	S	46.3	Very low	44.8	Very low	21 Å²	21	113 Å²	113	15%	0.147	53%	0.533	C	S	.	.			trans	-94.8	132.6	170.4	-150.6	0	0	0	0	108.9	S292 Q293 E298	S292-S296 PolarHBondContact O-N 3.22Å; Q293-S296 VanDerWaalsContact O-CB 3.3Å; Q293-S296 WeakPolarHBondContact O-CB 3.49Å; Q293-S296 PolarHBondContact O-N 3.38Å; S296-E298 PolarHBondContact O-N 2.79Å; S296-E298 VanDerWaalsContact O-N 3.07Å; S296-E298 WeakPolarHBondContact OG-CG 3.33Å; S296-E298 PolarHBondContact OG-OE2 2.91Å
297	L	50.3	Low	44.2	Very low	111 Å²	111	115 Å²	115	58%	0.581	55%	0.546	S	S	*	.			trans	-83.6	37.4	179.1	-65.8	170.1	0	0	0	112	M139 T145	M139-L297 HydrophobicContact CE-CD1 4.33Å; M139-L297 HydrophobicContact CE-CD2 4Å; M139-L297 HydrophobicContact CE-CG 3.92Å; T145-L297 HydrophobicContact CG2-CD1 4.43Å
298	E	44.5	Very low	43.4	Very low	80 Å²	80	115.2 Å²	115.2	37%	0.374	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.5	14.3	-165	-75	-160.6	110.3	0	0	115.7	K142 S296	K142-E298 HydrophobicContact CB-CG 4.49Å; K142-E298 WeakPolarHBondContact CD-OE1 3.11Å; K142-E298 WeakPolarHBondContact CD-OE2 3.44Å; K142-E298 WeakPolarHBondContact CE-OE1 3.19Å; K142-E298 WeakPolarHBondContact CG-OE1 3.44Å; K142-E298 IonicContact NZ-OE1 3.75Å; K142-E298 PolarHBondContact NZ-OE1 2.98Å; K142-E298 IonicContact NZ-OE2 2.76Å; K142-E298 PolarHBondContact NZ-OE2 3.36Å; S296-E298 PolarHBondContact O-N 2.79Å; S296-E298 VanDerWaalsContact O-N 3.07Å; S296-E298 WeakPolarHBondContact OG-CG 3.33Å; S296-E298 PolarHBondContact OG-OE2 2.91Å
299	N	32.6	Very low	43	Very low	171 Å²	171	108.9 Å²	108.9	91%	0.914	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	7.5	174	-80.7	67.4	0	0	0	113.6
300	G	33.6	Very low	42.5	Very low	43 Å²	43	103.8 Å²	103.8	44%	0.443	52%	0.515	S	S	.	.	S	Bend	trans	-94.7	138.4	166.8	0	0	0	0	0	111.6	F302	G300-F302 WeakPolarHBondContact O-CD2 3.3Å; G300-F302 PolarHBondContact O-N 2.82Å
301	V	33.3	Very low	42.1	Very low	108 Å²	108	96.9 Å²	96.9	66%	0.655	49%	0.489	S	S	*	.			trans	-76.5	88.7	176.1	-177.8	0	0	0	0	109.3
302	F	32.6	Very low	41.4	Very low	154 Å²	154	92.5 Å²	92.5	68%	0.675	48%	0.48	S	S	*	.			trans	-82.6	144.4	176	-78.4	-78.2	0	0	0	112.4	G300	G300-F302 WeakPolarHBondContact O-CD2 3.3Å; G300-F302 PolarHBondContact O-N 2.82Å
303	P	34.4	Very low	41	Very low	55 Å²	55	90.6 Å²	90.6	36%	0.357	47%	0.466	S	S	.	.			trans	-54.8	154	170.2	-27.1	35.6	0	0	0	113.4	W305	P303-W305 HydrophobicContact CB-CE3 4.48Å; P303-W305 PolarHBondContact O-N 3.18Å
304	R	39.2	Very low	40.4	Very low	237 Å²	237	91.5 Å²	91.5	89%	0.894	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	0.4	-165.5	-162.2	179.7	-83.9	-158.4	-1.9	115.4
305	W	42.3	Very low	39.8	Very low	123 Å²	123	91.4 Å²	91.4	47%	0.466	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-9.9	-169.6	-60.4	-46.3	0	0	0	116.5	P303 I307 P1038 D1041 P1043	P303-W305 HydrophobicContact CB-CE3 4.48Å; P303-W305 PolarHBondContact O-N 3.18Å; W305-I307 PolarHBondContact O-N 3.42Å; W305-P1038 HydrophobicContact CH2-CG 4.33Å; W305-P1038 HydrophobicContact CZ3-CG 4.41Å; W305-D1041 WeakPolarHBondContact CH2-O 3.44Å; W305-P1043 HydrophobicContact CZ2-CB 3.94Å
306	S	37.3	Very low	39.4	Very low	49 Å²	49	98.2 Å²	98.2	34%	0.343	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-64.3	-11.6	-176.7	68.8	0	0	0	0	115.2	E308	S306-E308 VanDerWaalsContact C-N 3.31Å; S306-E308 PolarHBondContact O-N 3.34Å
307	I	34.7	Very low	38.7	Very low	135 Å²	135	101.3 Å²	101.3	69%	0.692	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-72.2	-22.8	-172	-138.2	164.9	0	0	0	113.6	R166 W305	R166-I307 PolarHBondContact NH2-O 3.1Å; W305-I307 PolarHBondContact O-N 3.42Å
308	E	40.6	Very low	37.8	Very low	163 Å²	163	102.5 Å²	102.5	76%	0.762	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-99.4	-8.7	-173.5	-163.7	140.1	-142.5	0	0	113.7	S306 S310	S306-E308 VanDerWaalsContact C-N 3.31Å; S306-E308 PolarHBondContact O-N 3.34Å; E308-S310 PolarHBondContact O-N 2.96Å
309	E	43.1	Very low	37.2	Very low	39 Å²	39	101.4 Å²	101.4	18%	0.182	55%	0.553	C	S	.	*			trans	-69.9	28	-177.2	-69.4	-157	86.8	0	0	116.1	S144 K367	S144-E309 WeakPolarHBondContact CB-OE1 3.4Å; S144-E309 WeakPolarHBondContact CB-OE2 3.24Å; S144-E309 PolarHBondContact N-OE2 2.7Å; S144-E309 VanDerWaalsContact OG-CD 3.26Å; S144-E309 PolarHBondContact OG-OE1 3.33Å; S144-E309 PolarHBondContact OG-OE2 2.68Å; E309-K367 IonicContact OE1-NZ 3.57Å; E309-K367 PolarHBondContact OE1-NZ 3.32Å
310	S	39.8	Very low	37.5	Very low	18 Å²	18	99.4 Å²	99.4	13%	0.126	55%	0.55	C	S	.	.			trans	-143.1	79	-167	52.5	0	0	0	0	113.6	T164 R166 E308	T164-S310 WeakPolarHBondContact O-CA 3.27Å; T164-S310 WeakPolarHBondContact O-CB 3.38Å; R166-S310 VanDerWaalsContact CD-O 3.24Å; R166-S310 WeakPolarHBondContact CD-O 3.3Å; R166-S310 WeakPolarHBondContact CG-O 3.34Å; R166-S310 VanDerWaalsContact CZ-OG 3.27Å; R166-S310 PolarHBondContact NE-O 3.16Å; R166-S310 PolarHBondContact NE-OG 3.48Å; R166-S310 PolarHBondContact NH2-OG 3.46Å; E308-S310 PolarHBondContact O-N 2.96Å
311	F	42.6	Very low	37.2	Very low	25 Å²	25	104.2 Å²	104.2	11%	0.11	57%	0.565	C	S	.	*	P	Polyproline II helix	trans	-65	151.6	-176.8	73.5	-83.6	0	0	0	114.2	F163 A165 R166 L313 I330 E371	F163-F311 HydrophobicContact CD2-CE1 4.3Å; F163-F311 AromaticContact CE2-CE1 3.93Å; F163-F311 HydrophobicContact CE2-CE1 3.93Å; A165-F311 CarbonylContact C-O 3.57Å; A165-F311 HydrophobicContact CB-CD1 4.32Å; A165-F311 HydrophobicContact CB-CE1 3.59Å; A165-F311 HydrophobicContact CB-CE2 3.97Å; A165-F311 HydrophobicContact CB-CZ 3.4Å; A165-F311 VanDerWaalsContact CB-CZ 3.4Å; R166-F311 WeakPolarHBondContact CA-O 3.5Å; R166-F311 WeakPolarHBondContact CB-O 3.43Å; R166-F311 PolarHBondContact N-O 3.04Å; F311-L313 HydrophobicContact CD2-CG 4.25Å; F311-L313 HydrophobicContact CE2-CD1 4.08Å; F311-L313 HydrophobicContact CE2-CD2 3.79Å; F311-L313 HydrophobicContact CE2-CG 3.68Å; F311-L313 HydrophobicContact CZ-CD1 4.49Å; F311-I330 HydrophobicContact CE1-CD1 4.2Å; F311-I330 HydrophobicContact CZ-CD1 3.78Å; F311-E371 VanDerWaalsContact CD1-CD 3.45Å; F311-E371 HydrophobicContact CD1-CG 4.16Å; F311-E371 WeakPolarHBondContact CD1-OE2 3.41Å; F311-E371 HydrophobicContact CE1-CG 4.01Å
312	N	40	Very low	37.5	Very low	93 Å²	93	105.7 Å²	105.7	50%	0.497	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.4	132.2	178.9	-71.1	-49.5	0	0	0	112.8	R166 G168	R166-N312 WeakPolarHBondContact CB-OD1 3.26Å; G168-N312 WeakPolarHBondContact O-CB 3.47Å; G168-N312 PolarHBondContact O-OD1 3.24Å
313	L	43.6	Very low	37.5	Very low	13 Å²	13	100.7 Å²	100.7	7%	0.068	57%	0.568	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.6	129.3	164.9	-68.1	159.8	0	0	0	109.5	A165 R166 T167 G168 F311 K328	A165-L313 HydrophobicContact CB-CD1 3.68Å; R166-L313 PolarHBondContact O-N 3.15Å; T167-L313 CarbonylContact C-O 3.55Å; T167-L313 WeakPolarHBondContact CA-O 3.46Å; T167-L313 VanDerWaalsContact CG2-O 3.25Å; T167-L313 WeakPolarHBondContact CG2-O 3.22Å; G168-L313 PolarHBondContact N-O 3.46Å; G168-L313 VanDerWaalsContact N-O 3.15Å; F311-L313 HydrophobicContact CD2-CG 4.25Å; F311-L313 HydrophobicContact CE2-CD1 4.08Å; F311-L313 HydrophobicContact CE2-CD2 3.79Å; F311-L313 HydrophobicContact CE2-CG 3.68Å; F311-L313 HydrophobicContact CZ-CD1 4.49Å; L313-K328 HydrophobicContact CD1-CD 4.46Å
314	S	39.5	Very low	37.9	Very low	111 Å²	111	104.2 Å²	104.2	78%	0.776	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-96.3	158.1	165.5	47.8	0	0	0	0	111.2
315	D	37.7	Very low	38.2	Very low	116 Å²	116	97.9 Å²	97.9	62%	0.62	57%	0.571	S	S	*	*			trans	-143.3	111.3	172.5	-168.5	-31.6	0	0	0	105.7	S317	D315-S317 VanDerWaalsContact C-N 3.3Å; D315-S317 PolarHBondContact O-N 3.27Å; D315-S317 PolarHBondContact OD1-OG 3.4Å
316	E	38.8	Very low	38.7	Very low	198 Å²	198	96.7 Å²	96.7	93%	0.925	57%	0.566	S	S	*	*			trans	-94.8	60.5	-171.2	-164.8	158	-157.3	0	0	110.5
317	S	33.4	Very low	39.9	Very low	85 Å²	85	99.4 Å²	99.4	59%	0.594	57%	0.571	S	S	*	*			trans	-136.7	75	179.5	61.7	0	0	0	0	111.2	D315 G319	D315-S317 VanDerWaalsContact C-N 3.3Å; D315-S317 PolarHBondContact O-N 3.27Å; D315-S317 PolarHBondContact OD1-OG 3.4Å; S317-G319 PolarHBondContact O-N 3.24Å; S317-G319 VanDerWaalsContact O-N 3.12Å
318	C	30.7	Very low	41.8	Very low	136 Å²	136	95.9 Å²	95.9	92%	0.919	55%	0.551	S	S	*	*			trans	-68.5	107.7	-173.8	-69.7	0	0	0	0	113.9
319	G	31.9	Very low	43.8	Very low	58 Å²	58	89.2 Å²	89.2	60%	0.598	52%	0.52	S	S	*	.			trans	-100.1	136.5	152.5	0	0	0	0	0	110.5	S317 N321	S317-G319 PolarHBondContact O-N 3.24Å; S317-G319 VanDerWaalsContact O-N 3.12Å; G319-N321 PolarHBondContact O-N 3.46Å
320	P	37.8	Very low	45.9	Very low	129 Å²	129	87.4 Å²	87.4	84%	0.838	51%	0.511	S	S	*	.	S	Bend	trans	-77.8	82.4	-173	31.3	-35.7	0	0	0	112.2
321	N	28.7	Very low	48.2	Very low	144 Å²	144	86.6 Å²	86.6	77%	0.77	51%	0.505	S	S	*	.			trans	-154.2	110.5	170.2	-100.7	-65	0	0	0	111.3	G319 G323	G319-N321 PolarHBondContact O-N 3.46Å; N321-G323 PolarHBondContact O-N 3.44Å
322	P	38	Very low	50.6	Low	139 Å²	139	85.4 Å²	85.4	90%	0.903	50%	0.5	S	S	*	.			trans	-76.1	47.3	177.1	32.3	-35.4	0	0	0	112.8	I324	P322-I324 VanDerWaalsContact C-N 3.33Å; P322-I324 PolarHBondContact O-N 2.91Å
323	G	33.9	Very low	53.1	Low	48 Å²	48	81 Å²	81	50%	0.495	48%	0.477	S	S	.	.			trans	-83.2	52.6	-167.4	0	0	0	0	0	116.2	N321 R326	N321-G323 PolarHBondContact O-N 3.44Å; G323-R326 PolarHBondContact O-NH1 2.87Å
324	I	42.9	Very low	55.5	Low	129 Å²	129	80.4 Å²	80.4	66%	0.662	47%	0.474	S	S	*	.			trans	57.4	97.5	177.3	-57.2	158.5	0	0	0	111.7	P322 R326	P322-I324 VanDerWaalsContact C-N 3.33Å; P322-I324 PolarHBondContact O-N 2.91Å; I324-R326 PolarHBondContact O-N 3.23Å; I324-R326 PolarHBondContact O-NH1 2.82Å
325	V	44.4	Very low	58	Low	105 Å²	105	75.2 Å²	75.2	64%	0.636	44%	0.437	S	S	*	.			trans	-68.7	102.1	177.1	-168.3	0	0	0	0	109.2	T167 K327	T167-V325 HydrophobicContact CG2-CG1 3.56Å; T167-V325 VanDerWaalsContact O-CG1 3.28Å; T167-V325 WeakPolarHBondContact O-CG1 3.43Å; V325-K327 PolarHBondContact O-N 2.76Å
326	R	53.9	Low	60.5	Low	97 Å²	97	69.7 Å²	69.7	37%	0.366	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-72.7	122	-175.1	-72.1	160.8	-174.1	74.6	1.6	109.8	E51 G323 I324 K328	E51-R326 VanDerWaalsContact OE2-CD 3.25Å; E51-R326 WeakPolarHBondContact OE2-CD 3.12Å; E51-R326 WeakPolarHBondContact OE2-CG 3.44Å; E51-R326 IonicContact OE2-NE 3.59Å; G323-R326 PolarHBondContact O-NH1 2.87Å; I324-R326 PolarHBondContact O-N 3.23Å; I324-R326 PolarHBondContact O-NH1 2.82Å; R326-K328 PolarHBondContact O-N 2.88Å
327	K	62	Low	62.9	Low	106 Å²	106	62.2 Å²	62.2	46%	0.461	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-59	130.1	173.2	-61.3	-177.3	-178.7	-177.3	0	109	A165 V325	A165-K327 WeakPolarHBondContact O-CA 3.45Å; V325-K327 PolarHBondContact O-N 2.76Å
328	K	74.2	Confident	65.3	Low	61 Å²	61	59.4 Å²	59.4	27%	0.265	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	128.3	171	-72.3	166.8	-179.9	164	0	107	Q48 A165 L313 R326	Q48-K328 HydrophobicContact CG-CB 4.49Å; A165-K328 WeakPolarHBondContact CA-O 3.39Å; A165-K328 HydrophobicContact CB-CB 4.45Å; A165-K328 WeakPolarHBondContact CB-O 3.13Å; A165-K328 PolarHBondContact N-O 3.08Å; A165-K328 PolarHBondContact O-N 2.7Å; A165-K328 VanDerWaalsContact O-N 3.14Å; L313-K328 HydrophobicContact CD1-CD 4.46Å; R326-K328 PolarHBondContact O-N 2.88Å
329	K	82.5	Confident	67.6	Low	24 Å²	24	54.7 Å²	54.7	10%	0.104	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	135.5	175.5	-57.5	171.5	-176	174.4	0	108	Q48 D49 F134 M139 Y141	Q48-K329 WeakPolarHBondContact CA-O 3.27Å; D49-K329 HydrophobicContact CB-CB 4.21Å; D49-K329 PolarHBondContact N-O 2.75Å; D49-K329 PolarHBondContact O-N 3.05Å; F134-K329 HydrophobicContact CE1-CB 3.98Å; M139-K329 PolarHBondContact O-NZ 3.17Å; Y141-K329 HydrophobicContact CD2-CD 3.96Å; Y141-K329 HydrophobicContact CE2-CD 4.27Å
330	I	87	Confident	69.6	Low	1 Å²	1	61.2 Å²	61.2	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	141.6	176	-61.1	177	0	0	0	107.3	V46 Y47 V162 F163 A165 F311 M374	V46-I330 HydrophobicContact CG1-CG2 4.1Å; Y47-I330 WeakPolarHBondContact O-CA 3.48Å; V162-I330 WeakPolarHBondContact CA-O 3.34Å; F163-I330 WeakPolarHBondContact CD1-O 3.38Å; F163-I330 HydrophobicContact CE1-CB 4.2Å; F163-I330 HydrophobicContact CE1-CG2 3.9Å; F163-I330 HydrophobicContact CE2-CB 4.27Å; F163-I330 HydrophobicContact CE2-CG2 4.38Å; F163-I330 HydrophobicContact CZ-CB 4Å; F163-I330 HydrophobicContact CZ-CG2 3.68Å; F163-I330 PolarHBondContact N-O 2.98Å; F163-I330 PolarHBondContact O-N 3.02Å; A165-I330 HydrophobicContact CB-CD1 4.15Å; F311-I330 HydrophobicContact CE1-CD1 4.2Å; F311-I330 HydrophobicContact CZ-CD1 3.78Å; I330-M374 HydrophobicContact CD1-SD 3.84Å; I330-M374 HydrophobicContact CG2-CE 4.39Å
331	A	88.9	Confident	71.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	130.7	175.7	0	0	0	0	0	110.4	V46 Y47 M133 F134 K161 V162	V46-A331 WeakPolarHBondContact CA-O 3.1Å; Y47-A331 PolarHBondContact N-O 3.44Å; Y47-A331 PolarHBondContact O-N 2.92Å; M133-A331 HydrophobicContact CE-CB 3.66Å; F134-A331 HydrophobicContact CE1-CB 3.85Å; F134-A331 HydrophobicContact CE2-CB 3.94Å; F134-A331 HydrophobicContact CZ-CB 3.46Å; F134-A331 VanDerWaalsContact CZ-CB 3.46Å; K161-A331 WeakPolarHBondContact O-CA 3.12Å; V162-A331 HydrophobicContact CB-CB 4.31Å; V162-A331 HydrophobicContact CG1-CB 4.29Å; V162-A331 HydrophobicContact CG2-CB 3.85Å
332	I	92.9	Very high	74.1	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.1	176.6	-69	167.6	0	0	0	107.1	L44 V46 S160 K161 F163 M363 K367 I370	L44-I332 HydrophobicContact CD1-CG2 3.73Å; V46-I332 HydrophobicContact CG1-CG1 4.25Å; V46-I332 HydrophobicContact CG2-CG1 4.39Å; S160-I332 CarbonylContact C-O 3.55Å; S160-I332 VanDerWaalsContact CA-O 3.28Å; S160-I332 WeakPolarHBondContact CA-O 3.45Å; K161-I332 PolarHBondContact N-O 3.04Å; K161-I332 PolarHBondContact O-N 3.22Å; F163-I332 HydrophobicContact CE1-CD1 3.67Å; F163-I332 HydrophobicContact CE1-CG1 3.96Å; F163-I332 HydrophobicContact CZ-CD1 3.86Å; F163-I332 HydrophobicContact CZ-CG1 4.42Å; I332-M363 HydrophobicContact CG2-CE 4.08Å; I332-M363 WeakPolarHBondContact O-CE 2.99Å; I332-K367 HydrophobicContact CD1-CB 3.94Å; I332-K367 HydrophobicContact CD1-CG 4.08Å; I332-I370 HydrophobicContact CD1-CB 4.34Å; I332-I370 HydrophobicContact CD1-CD1 3.9Å; I332-I370 HydrophobicContact CD1-CG2 4.29Å; I332-I370 HydrophobicContact CG1-CD1 4.23Å; I332-I370 HydrophobicContact CG2-CD1 4.43Å
333	G	91.9	Very high	76.1	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118.1	178.7	0	0	0	0	0	109.9	L44 I45 M133 L159	L44-G333 WeakPolarHBondContact CA-O 3.43Å; I45-G333 PolarHBondContact N-O 3.5Å; I45-G333 PolarHBondContact O-N 2.97Å; M133-G333 VanDerWaalsContact CE-CA 3.45Å; L159-G333 WeakPolarHBondContact O-CA 3.3Å
334	V	93.7	Very high	78.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.4	171.7	178.4	0	0	0	0	107.1	I42 R43 L44 M158 L159 F336 M363 L366 F400	I42-V334 HydrophobicContact CG2-CG1 3.86Å; R43-V334 CarbonylContact O-C 3.5Å; R43-V334 WeakPolarHBondContact O-CA 3.36Å; L44-V334 HydrophobicContact CD1-CG2 4.43Å; M158-V334 CarbonylContact C-O 3.51Å; M158-V334 WeakPolarHBondContact CA-O 3.41Å; L159-V334 PolarHBondContact N-O 2.89Å; L159-V334 PolarHBondContact O-N 3.05Å; V334-F336 HydrophobicContact CG1-CE1 4.22Å; V334-F336 HydrophobicContact CG1-CE2 3.98Å; V334-F336 HydrophobicContact CG1-CZ 3.75Å; V334-M363 HydrophobicContact CG2-CE 4.3Å; V334-L366 HydrophobicContact CG2-CD2 3.99Å; V334-F400 HydrophobicContact CG1-CE1 3.65Å; V334-F400 HydrophobicContact CG1-CZ 3.94Å; V334-F400 HydrophobicContact CG2-CE1 4.37Å; V334-F400 HydrophobicContact CG2-CZ 4.28Å
335	I	91.9	Very high	80.2	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	118.6	-177.8	-57.4	166.3	0	0	0	107.9	I42 R43 I45 L129 Q156 L157 M158	I42-I335 WeakPolarHBondContact CA-O 3.33Å; R43-I335 HydrophobicContact CB-CB 4.36Å; R43-I335 PolarHBondContact N-O 3.45Å; R43-I335 PolarHBondContact O-N 3.42Å; I45-I335 HydrophobicContact CD1-CD1 3.79Å; I45-I335 HydrophobicContact CG1-CD1 4.34Å; L129-I335 HydrophobicContact CD1-CD1 3.74Å; L129-I335 HydrophobicContact CD2-CD1 3.95Å; L129-I335 HydrophobicContact CG-CD1 4.45Å; Q156-I335 HydrophobicContact CB-CG2 3.98Å; Q156-I335 HydrophobicContact CG-CG2 4.27Å; L157-I335 WeakPolarHBondContact O-CA 3.24Å; M158-I335 HydrophobicContact CB-CG1 4.08Å; M158-I335 HydrophobicContact CG-CG1 3.78Å; M158-I335 HydrophobicContact SD-CD1 4.48Å; M158-I335 HydrophobicContact SD-CG1 4.22Å
336	F	91.4	Very high	82.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	116.1	170.4	-54.8	-81.6	0	0	0	108	F37 I42 Q156 L157 L159 V334 L338 F348 F352 F359 F400 I404	F37-F336 HydrophobicContact CZ-CD1 4.19Å; I42-F336 HydrophobicContact CD1-CD1 4.24Å; I42-F336 HydrophobicContact CD1-CE1 3.97Å; I42-F336 HydrophobicContact CG1-CD1 3.81Å; I42-F336 HydrophobicContact CG1-CE1 3.99Å; Q156-F336 VanDerWaalsContact CA-O 3.28Å; Q156-F336 WeakPolarHBondContact CA-O 3.19Å; L157-F336 HydrophobicContact CB-CB 4.33Å; L157-F336 HydrophobicContact CB-CD2 4.36Å; L157-F336 PolarHBondContact N-O 3.48Å; L157-F336 WeakPolarHBondContact O-CD2 3.46Å; L157-F336 PolarHBondContact O-N 2.99Å; L159-F336 HydrophobicContact CB-CE2 4.49Å; V334-F336 HydrophobicContact CG1-CE1 4.22Å; V334-F336 HydrophobicContact CG1-CE2 3.98Å; V334-F336 HydrophobicContact CG1-CZ 3.75Å; F336-L338 HydrophobicContact CB-CD2 4.45Å; F336-L338 PolarHBondContact O-N 3.17Å; F336-F348 HydrophobicContact CB-CE1 4.2Å; F336-F348 HydrophobicContact CB-CZ 4.34Å; F336-F348 HydrophobicContact CD1-CE1 4.49Å; F336-F348 AromaticContact CD1-CZ 3.88Å; F336-F348 HydrophobicContact CD1-CZ 3.88Å; F336-F348 HydrophobicContact CE1-CZ 4.4Å; F336-F348 HydrophobicContact CG-CE1 4.21Å; F336-F348 HydrophobicContact CG-CZ 4.05Å; F336-F352 HydrophobicContact CD2-CE2 4.41Å; F336-F352 HydrophobicContact CE2-CD2 4.31Å; F336-F352 AromaticContact CE2-CE2 3.72Å; F336-F352 HydrophobicContact CE2-CE2 3.72Å; F336-F352 HydrophobicContact CZ-CE2 4.25Å; F336-F359 HydrophobicContact CE1-CE1 4.44Å; F336-F359 HydrophobicContact CZ-CD1 4.18Å; F336-F359 HydrophobicContact CZ-CE1 4.16Å; F336-F400 HydrophobicContact CZ-CE1 4.49Å; F336-F400 HydrophobicContact CZ-CZ 4.42Å; F336-I404 HydrophobicContact CE1-CG2 4.2Å
337	S	88	Confident	83.5	Confident	40 Å²	40	53.3 Å²	53.3	28%	0.28	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	106.9	173.8	-49.9	0	0	0	0	108.3	Q41	Q41-S337 VanDerWaalsContact O-CB 3.28Å; Q41-S337 WeakPolarHBondContact O-CB 3.39Å; Q41-S337 PolarHBondContact O-N 2.67Å; Q41-S337 PolarHBondContact O-OG 3.16Å
338	L	83.9	Confident	84.6	Confident	27 Å²	27	48.6 Å²	48.6	14%	0.141	24%	0.242	C	C	.	.			trans	-78.1	165.4	-175.4	-59.5	180	0	0	0	111	P155 L157 F336 F348	P155-L338 HydrophobicContact CB-CB 4.16Å; P155-L338 WeakPolarHBondContact O-CB 3.28Å; P155-L338 PolarHBondContact O-N 3.36Å; L157-L338 HydrophobicContact CB-CD1 4.46Å; F336-L338 HydrophobicContact CB-CD2 4.45Å; F336-L338 PolarHBondContact O-N 3.17Å; L338-F348 HydrophobicContact CD2-CD1 3.56Å; L338-F348 HydrophobicContact CD2-CE1 3.93Å; L338-F348 HydrophobicContact CD2-CG 4.33Å
339	S	78.5	Confident	85.3	Confident	37 Å²	37	46.5 Å²	46.5	26%	0.259	23%	0.234	S	C	.	.			trans	-73.8	-178.8	178.1	85.9	0	0	0	0	111.5	P155 D341 N345	P155-S339 WeakPolarHBondContact CG-O 3.36Å; S339-D341 PolarHBondContact OG-N 3.08Å; S339-D341 PolarHBondContact OG-O 2.54Å; S339-D341 VanDerWaalsContact OG-O 3.13Å; S339-N345 WeakPolarHBondContact CA-OD1 3.44Å; S339-N345 WeakPolarHBondContact CB-OD1 3.46Å; S339-N345 PolarHBondContact N-OD1 3.31Å; S339-N345 PolarHBondContact O-ND2 2.97Å; S339-N345 PolarHBondContact O-OD1 3.23Å; S339-N345 PolarHBondContact OG-OD1 2.62Å
340	K	74.4	Confident	85.6	Confident	194 Å²	194	49 Å²	49	84%	0.843	25%	0.246	S	C	*	.	S	Bend	trans	-88.6	-11.2	168.4	-71.1	-172.3	176.9	-175.9	0	113.4
341	D	81	Confident	85.7	Confident	110 Å²	110	49.2 Å²	49.2	59%	0.588	25%	0.247	S	C	*	.			trans	-96.9	116	-170.3	-52.6	-51.5	0	0	0	108.3	S339 D343 E344 N345	S339-D341 PolarHBondContact OG-N 3.08Å; S339-D341 PolarHBondContact OG-O 2.54Å; S339-D341 VanDerWaalsContact OG-O 3.13Å; D341-D343 VanDerWaalsContact C-N 3.32Å; D341-D343 PolarHBondContact O-N 2.92Å; D341-E344 PolarHBondContact O-N 3.12Å; D341-N345 VanDerWaalsContact O-CG 3.23Å; D341-N345 PolarHBondContact O-N 3.49Å; D341-N345 VanDerWaalsContact O-N 3.12Å; D341-N345 PolarHBondContact O-ND2 3.37Å
342	E	80	Confident	85.7	Confident	153 Å²	153	49.2 Å²	49.2	72%	0.715	25%	0.247	S	C	*	.	H	α-helix	trans	-67.2	-32.9	-166.9	-60.7	-167.1	148.9	0	0	112.4	N345 N346	E342-N345 PolarHBondContact O-N 2.9Å; E342-N346 WeakPolarHBondContact O-CB 3.22Å; E342-N346 PolarHBondContact O-N 3.06Å; E342-N346 PolarHBondContact O-ND2 2.88Å
343	D	80.6	Confident	85.6	Confident	117 Å²	117	53.9 Å²	53.9	63%	0.626	27%	0.267	S	S	*	.	H	α-helix	trans	-63	-43.9	176.8	-63.7	-40.1	0	0	0	113	D341 N346 K347	D341-D343 VanDerWaalsContact C-N 3.32Å; D341-D343 PolarHBondContact O-N 2.92Å; D343-N346 PolarHBondContact O-N 3.33Å; D343-K347 VanDerWaalsContact O-CG 3.26Å; D343-K347 WeakPolarHBondContact O-CG 3.47Å; D343-K347 PolarHBondContact O-N 2.79Å
344	E	80	Confident	85.5	Confident	64 Å²	64	54.6 Å²	54.6	30%	0.299	27%	0.272	S	S	.	.	H	α-helix	trans	-70.3	-36.2	176.9	-64.1	-54.4	123.3	0	0	111.2	D341 N346 K347 F348	D341-E344 PolarHBondContact O-N 3.12Å; E344-N346 VanDerWaalsContact C-N 3.34Å; E344-K347 IonicContact OE1-NZ 3.71Å; E344-K347 PolarHBondContact OE1-NZ 2.9Å; E344-F348 WeakPolarHBondContact O-CB 3.29Å; E344-F348 PolarHBondContact O-N 2.83Å
345	N	82.6	Confident	85.3	Confident	17 Å²	17	54.6 Å²	54.6	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-40.2	173.4	-66.6	-14.5	0	0	0	111.5	S339 D341 E342 F348 N349	S339-N345 WeakPolarHBondContact CA-OD1 3.44Å; S339-N345 WeakPolarHBondContact CB-OD1 3.46Å; S339-N345 PolarHBondContact N-OD1 3.31Å; S339-N345 PolarHBondContact O-ND2 2.97Å; S339-N345 PolarHBondContact O-OD1 3.23Å; S339-N345 PolarHBondContact OG-OD1 2.62Å; D341-N345 VanDerWaalsContact O-CG 3.23Å; D341-N345 PolarHBondContact O-N 3.49Å; D341-N345 VanDerWaalsContact O-N 3.12Å; D341-N345 PolarHBondContact O-ND2 3.37Å; E342-N345 PolarHBondContact O-N 2.9Å; N345-F348 PolarHBondContact O-N 3.31Å; N345-N349 WeakPolarHBondContact O-CB 3.4Å; N345-N349 PolarHBondContact O-N 3.06Å; N345-N349 PolarHBondContact O-ND2 3.43Å
346	N	83.8	Confident	85.3	Confident	95 Å²	95	56.6 Å²	56.6	51%	0.508	28%	0.281	S	S	.	.	H	α-helix	trans	-65.9	-48.5	177.2	-71.7	-23.5	0	0	0	111.3	E342 D343 E344 F348 N349 E350	E342-N346 WeakPolarHBondContact O-CB 3.22Å; E342-N346 PolarHBondContact O-N 3.06Å; E342-N346 PolarHBondContact O-ND2 2.88Å; D343-N346 PolarHBondContact O-N 3.33Å; E344-N346 VanDerWaalsContact C-N 3.34Å; N346-F348 VanDerWaalsContact C-N 3.29Å; N346-F348 PolarHBondContact O-N 3.07Å; N346-N349 PolarHBondContact O-N 3.12Å; N346-N349 VanDerWaalsContact O-N 3.16Å; N346-E350 WeakPolarHBondContact O-CB 3.24Å; N346-E350 PolarHBondContact O-N 2.63Å
347	K	84.2	Confident	85.2	Confident	69 Å²	69	57.2 Å²	57.2	30%	0.3	29%	0.285	S	S	.	.	H	α-helix	trans	-56.7	-40.2	173.4	-67.6	164.7	-162	171	0	112.5	W32 D343 E344 F351	W32-K347 HydrophobicContact CH2-CB 4.43Å; D343-K347 VanDerWaalsContact O-CG 3.26Å; D343-K347 WeakPolarHBondContact O-CG 3.47Å; D343-K347 PolarHBondContact O-N 2.79Å; E344-K347 IonicContact OE1-NZ 3.71Å; E344-K347 PolarHBondContact OE1-NZ 2.9Å; K347-F351 VanDerWaalsContact O-CB 3.27Å; K347-F351 WeakPolarHBondContact O-CB 3.33Å; K347-F351 PolarHBondContact O-N 3.18Å
348	F	86.2	Confident	85.3	Confident	8 Å²	8	55.3 Å²	55.3	4%	0.035	27%	0.272	C	S	.	.	H	α-helix	trans	-69.4	-42.4	176.3	-178.1	-91.1	0	0	0	112.3	F37 L157 F336 L338 E344 N345 N346 F351 F352 Y408	F37-F348 HydrophobicContact CD2-CD2 4.2Å; F37-F348 HydrophobicContact CD2-CE2 4.09Å; F37-F348 AromaticContact CE2-CD2 3.97Å; F37-F348 HydrophobicContact CE2-CD2 3.97Å; F37-F348 AromaticContact CE2-CE2 3.49Å; F37-F348 HydrophobicContact CE2-CE2 3.49Å; F37-F348 VanDerWaalsContact CE2-CE2 3.49Å; F37-F348 HydrophobicContact CE2-CZ 4.02Å; F37-F348 AromaticContact CZ-CE2 3.73Å; F37-F348 HydrophobicContact CZ-CE2 3.73Å; F37-F348 HydrophobicContact CZ-CZ 4.11Å; L157-F348 HydrophobicContact CD2-CE1 4.31Å; F336-F348 HydrophobicContact CB-CE1 4.2Å; F336-F348 HydrophobicContact CB-CZ 4.34Å; F336-F348 HydrophobicContact CD1-CE1 4.49Å; F336-F348 AromaticContact CD1-CZ 3.88Å; F336-F348 HydrophobicContact CD1-CZ 3.88Å; F336-F348 HydrophobicContact CE1-CZ 4.4Å; F336-F348 HydrophobicContact CG-CE1 4.21Å; F336-F348 HydrophobicContact CG-CZ 4.05Å; L338-F348 HydrophobicContact CD2-CD1 3.56Å; L338-F348 HydrophobicContact CD2-CE1 3.93Å; L338-F348 HydrophobicContact CD2-CG 4.33Å; E344-F348 WeakPolarHBondContact O-CB 3.29Å; E344-F348 PolarHBondContact O-N 2.83Å; N345-F348 PolarHBondContact O-N 3.31Å; N346-F348 VanDerWaalsContact C-N 3.29Å; N346-F348 PolarHBondContact O-N 3.07Å; F348-F351 PolarHBondContact O-N 3.27Å; F348-F352 HydrophobicContact CE1-CB 4.34Å; F348-F352 VanDerWaalsContact O-CB 3.23Å; F348-F352 WeakPolarHBondContact O-CB 3.43Å; F348-F352 PolarHBondContact O-N 3.05Å; F348-Y408 HydrophobicContact CD2-CD1 4.34Å; F348-Y408 HydrophobicContact CD2-CD2 4.44Å; F348-Y408 AromaticContact CD2-CE1 4Å; F348-Y408 HydrophobicContact CD2-CE1 4Å; F348-Y408 HydrophobicContact CD2-CE2 4.1Å; F348-Y408 AromaticContact CD2-CZ 3.88Å
349	N	88.1	Confident	85.7	Confident	17 Å²	17	54.1 Å²	54.1	9%	0.091	27%	0.265	C	S	.	.	H	α-helix	trans	-62.6	-49	177.3	-71.6	-34	0	0	0	111.2	N345 N346 F351 F352 F353	N345-N349 WeakPolarHBondContact O-CB 3.4Å; N345-N349 PolarHBondContact O-N 3.06Å; N345-N349 PolarHBondContact O-ND2 3.43Å; N346-N349 PolarHBondContact O-N 3.12Å; N346-N349 VanDerWaalsContact O-N 3.16Å; N349-F351 PolarHBondContact O-N 2.84Å; N349-F352 PolarHBondContact O-N 3.05Å; N349-F352 VanDerWaalsContact O-N 3.16Å; N349-F353 HydrophobicContact CB-CD2 4.38Å; N349-F353 HydrophobicContact CB-CE2 4.29Å; N349-F353 WeakPolarHBondContact O-CD2 3.4Å; N349-F353 PolarHBondContact O-N 3.04Å
350	E	88.1	Confident	86.2	Confident	77 Å²	77	55 Å²	55	36%	0.36	27%	0.265	S	S	.	.	H	α-helix	trans	-54.9	-49.5	175.5	178.3	-178.8	-153.4	0	0	111.5	N346 F352 S354 N992 A994	N346-E350 WeakPolarHBondContact O-CB 3.24Å; N346-E350 PolarHBondContact O-N 2.63Å; E350-F352 PolarHBondContact O-N 3.07Å; E350-S354 WeakPolarHBondContact O-CB 3.38Å; E350-S354 PolarHBondContact O-N 2.95Å; E350-S354 PolarHBondContact O-OG 3.47Å; E350-N992 PolarHBondContact OE1-ND2 2.9Å; E350-N992 PolarHBondContact OE1-OD1 3.08Å; E350-A994 HydrophobicContact CG-CB 4.11Å
351	F	88.6	Confident	87	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-45.1	174.4	-176.5	-92.7	0	0	0	112.3	K347 F348 N349 S354 H355 F359 L407 Y408 I993 S999	K347-F351 VanDerWaalsContact O-CB 3.27Å; K347-F351 WeakPolarHBondContact O-CB 3.33Å; K347-F351 PolarHBondContact O-N 3.18Å; F348-F351 PolarHBondContact O-N 3.27Å; N349-F351 PolarHBondContact O-N 2.84Å; F351-S354 WeakPolarHBondContact CA-OG 3.3Å; F351-S354 PolarHBondContact O-OG 2.8Å; F351-H355 AromaticContact CD2-ND1 3.8Å; F351-H355 HydrophobicContact CE1-CB 4.49Å; F351-H355 AromaticContact CE2-CE1 3.94Å; F351-H355 AromaticContact CE2-ND1 3.89Å; F351-H355 VanDerWaalsContact O-CB 3.23Å; F351-H355 WeakPolarHBondContact O-CB 3.2Å; F351-H355 PolarHBondContact O-N 2.58Å; F351-H355 PolarHBondContact O-ND1 3.29Å; F351-H355 VanDerWaalsContact O-ND1 3.12Å; F351-F359 HydrophobicContact CD1-CE2 4.14Å; F351-F359 HydrophobicContact CD1-CZ 4.19Å; F351-F359 HydrophobicContact CE1-CE2 4.01Å; F351-F359 HydrophobicContact CE1-CZ 4.08Å; F351-L407 HydrophobicContact CE1-CG 4.45Å; F351-L407 HydrophobicContact CZ-CG 4.13Å; F351-Y408 HydrophobicContact CB-CD2 4.29Å; F351-Y408 HydrophobicContact CB-CE2 3.98Å; F351-Y408 AromaticContact CD1-CD2 3.51Å; F351-Y408 HydrophobicContact CD1-CD2 3.51Å; F351-Y408 HydrophobicContact CD1-CE2 4.06Å; F351-Y408 HydrophobicContact CD2-CD2 4.17Å; F351-Y408 HydrophobicContact CD2-CE2 4.46Å; F351-Y408 AromaticContact CE1-CD2 3.79Å; F351-Y408 HydrophobicContact CE1-CD2 3.79Å; F351-Y408 HydrophobicContact CE2-CD2 4.4Å; F351-Y408 AromaticContact CG-CD2 3.72Å; F351-Y408 HydrophobicContact CG-CD2 3.72Å; F351-Y408 AromaticContact CG-CE2 3.9Å; F351-Y408 HydrophobicContact CG-CE2 3.9Å; F351-Y408 HydrophobicContact CZ-CD2 4.23Å; F351-I993 HydrophobicContact CD2-CG2 4.17Å; F351-I993 HydrophobicContact CE2-CG2 4.42Å; F351-S999 WeakPolarHBondContact CE2-OG 3.18Å
352	F	90.6	Very high	87.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.9	-44.1	-179.1	175.9	-88.3	0	0	0	112.7	I148 L157 L159 F336 F348 N349 E350 F356 F359	I148-F352 HydrophobicContact CD1-CE1 4.33Å; I148-F352 HydrophobicContact CG2-CE1 4.27Å; L157-F352 HydrophobicContact CD2-CB 4.38Å; L157-F352 HydrophobicContact CD2-CD1 3.58Å; L157-F352 HydrophobicContact CD2-CD2 4.06Å; L157-F352 HydrophobicContact CD2-CE1 3.78Å; L157-F352 HydrophobicContact CD2-CE2 4.24Å; L157-F352 HydrophobicContact CD2-CG 3.73Å; L157-F352 HydrophobicContact CD2-CZ 4.11Å; L159-F352 HydrophobicContact CB-CZ 4.5Å; L159-F352 HydrophobicContact CD1-CZ 4.43Å; L159-F352 HydrophobicContact CD2-CZ 4.42Å; F336-F352 HydrophobicContact CD2-CE2 4.41Å; F336-F352 HydrophobicContact CE2-CD2 4.31Å; F336-F352 AromaticContact CE2-CE2 3.72Å; F336-F352 HydrophobicContact CE2-CE2 3.72Å; F336-F352 HydrophobicContact CZ-CE2 4.25Å; F348-F352 HydrophobicContact CE1-CB 4.34Å; F348-F352 VanDerWaalsContact O-CB 3.23Å; F348-F352 WeakPolarHBondContact O-CB 3.43Å; F348-F352 PolarHBondContact O-N 3.05Å; N349-F352 PolarHBondContact O-N 3.05Å; N349-F352 VanDerWaalsContact O-N 3.16Å; E350-F352 PolarHBondContact O-N 3.07Å; F352-F356 AromaticContact CE1-CD2 3.83Å; F352-F356 HydrophobicContact CE1-CD2 3.83Å; F352-F356 HydrophobicContact CE1-CE2 4.05Å; F352-F356 AromaticContact CZ-CD2 3.98Å; F352-F356 HydrophobicContact CZ-CD2 3.98Å; F352-F356 AromaticContact CZ-CE2 3.98Å; F352-F356 HydrophobicContact CZ-CE2 3.98Å; F352-F356 WeakPolarHBondContact O-CA 3.32Å; F352-F356 PolarHBondContact O-N 3.05Å; F352-F356 VanDerWaalsContact O-N 3.13Å; F352-F359 HydrophobicContact CB-CE2 4.42Å; F352-F359 HydrophobicContact CB-CZ 4.49Å; F352-F359 AromaticContact CD2-CD1 3.67Å; F352-F359 HydrophobicContact CD2-CD1 3.67Å; F352-F359 HydrophobicContact CD2-CD2 4.01Å; F352-F359 AromaticContact CD2-CE1 3.63Å; F352-F359 HydrophobicContact CD2-CE1 3.63Å; F352-F359 AromaticContact CD2-CE2 4Å; F352-F359 HydrophobicContact CD2-CE2 4Å; F352-F359 AromaticContact CD2-CG 3.86Å; F352-F359 HydrophobicContact CD2-CG 3.86Å; F352-F359 AromaticContact CD2-CZ 3.81Å; F352-F359 HydrophobicContact CD2-CZ 3.81Å; F352-F359 HydrophobicContact CE2-CB 4.18Å; F352-F359 AromaticContact CE2-CD1 3.65Å; F352-F359 HydrophobicContact CE2-CD1 3.65Å; F352-F359 HydrophobicContact CE2-CD2 4.39Å; F352-F359 HydrophobicContact CE2-CE1 4.05Å; F352-F359 AromaticContact CE2-CG 3.83Å; F352-F359 HydrophobicContact CE2-CG 3.83Å
353	F	90.6	Very high	87.9	Confident	100 Å²	100	34 Å²	34	44%	0.439	17%	0.168	S	C	.	.	H	α-helix	trans	-76	-39.1	-178.3	-71	-62.6	0	0	0	112.6	I148 L157 N349 F356	I148-F353 HydrophobicContact CD1-CD1 4.43Å; I148-F353 HydrophobicContact CD1-CE1 3.87Å; I148-F353 HydrophobicContact CG2-CE1 4.17Å; I148-F353 HydrophobicContact CG2-CZ 4.36Å; L157-F353 HydrophobicContact CD1-CZ 4.42Å; N349-F353 HydrophobicContact CB-CD2 4.38Å; N349-F353 HydrophobicContact CB-CE2 4.29Å; N349-F353 WeakPolarHBondContact O-CD2 3.4Å; N349-F353 PolarHBondContact O-N 3.04Å; F353-F356 WeakPolarHBondContact O-CB 3.46Å
354	S	88.4	Confident	88.3	Confident	16 Å²	16	29.4 Å²	29.4	11%	0.112	14%	0.143	C	C	.	.	H	α-helix	trans	-62.8	-43.5	172.4	50.3	0	0	0	0	112	E350 F351 F356 A994 F996	E350-S354 WeakPolarHBondContact O-CB 3.38Å; E350-S354 PolarHBondContact O-N 2.95Å; E350-S354 PolarHBondContact O-OG 3.47Å; F351-S354 WeakPolarHBondContact CA-OG 3.3Å; F351-S354 PolarHBondContact O-OG 2.8Å; S354-F356 VanDerWaalsContact C-N 3.32Å; S354-F356 PolarHBondContact O-N 3.19Å; S354-A994 VanDerWaalsContact CB-O 3.28Å; S354-A994 WeakPolarHBondContact CB-O 3.38Å; S354-F996 WeakPolarHBondContact O-CZ 3.39Å
355	H	90.4	Very high	88.8	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	13.3	-176.1	-64.5	65.6	0	0	0	114.1	F351 P357 L358 F359 I993 F996 S999	F351-H355 AromaticContact CD2-ND1 3.8Å; F351-H355 HydrophobicContact CE1-CB 4.49Å; F351-H355 AromaticContact CE2-CE1 3.94Å; F351-H355 AromaticContact CE2-ND1 3.89Å; F351-H355 VanDerWaalsContact O-CB 3.23Å; F351-H355 WeakPolarHBondContact O-CB 3.2Å; F351-H355 PolarHBondContact O-N 2.58Å; F351-H355 PolarHBondContact O-ND1 3.29Å; F351-H355 VanDerWaalsContact O-ND1 3.12Å; H355-P357 VanDerWaalsContact O-N 3.14Å; H355-L358 HydrophobicContact CB-CD1 4.42Å; H355-L358 WeakPolarHBondContact O-CB 3.14Å; H355-L358 PolarHBondContact O-N 2.9Å; H355-F359 HydrophobicContact CB-CD2 4.29Å; H355-F359 HydrophobicContact CB-CE2 4.1Å; H355-F359 PolarHBondContact O-N 3.4Å; H355-I993 PolarHBondContact CE1-O 2.84Å; H355-F996 HydrophobicContact CB-CE1 4.26Å; H355-F996 AromaticContact CD2-CD1 3.57Å; H355-F996 AromaticContact CD2-CE1 3.56Å; H355-F996 AromaticContact CG-CE1 3.96Å; H355-F996 AromaticContact NE2-CD1 3.55Å; H355-F996 AromaticContact NE2-CE1 3.97Å; H355-S999 PolarHBondContact CE1-OG 3.12Å; H355-S999 WeakPolarHBondContact NE2-CB 3.46Å; H355-S999 PolarHBondContact NE2-OG 2.92Å
356	F	91.1	Very high	89.2	Confident	44 Å²	44	27.2 Å²	27.2	19%	0.193	13%	0.132	C	C	.	.	H	α-helix	trans	-50.9	-39.2	-170.9	-172.1	-100.1	0	0	0	115.9	L146 I148 L159 F352 F353 S354 L358 F359 E360	L146-F356 HydrophobicContact CD2-CE1 3.9Å; L146-F356 HydrophobicContact CD2-CZ 3.54Å; L146-F356 HydrophobicContact CG-CZ 4.32Å; I148-F356 HydrophobicContact CD1-CD2 4.07Å; I148-F356 HydrophobicContact CD1-CE2 3.43Å; I148-F356 VanDerWaalsContact CD1-CE2 3.43Å; I148-F356 HydrophobicContact CD1-CZ 3.82Å; I148-F356 HydrophobicContact CG1-CE2 3.97Å; I148-F356 HydrophobicContact CG1-CZ 4.24Å; L159-F356 HydrophobicContact CD1-CE2 3.8Å; L159-F356 HydrophobicContact CD1-CZ 4.06Å; F352-F356 AromaticContact CE1-CD2 3.83Å; F352-F356 HydrophobicContact CE1-CD2 3.83Å; F352-F356 HydrophobicContact CE1-CE2 4.05Å; F352-F356 AromaticContact CZ-CD2 3.98Å; F352-F356 HydrophobicContact CZ-CD2 3.98Å; F352-F356 AromaticContact CZ-CE2 3.98Å; F352-F356 HydrophobicContact CZ-CE2 3.98Å; F352-F356 WeakPolarHBondContact O-CA 3.32Å; F352-F356 PolarHBondContact O-N 3.05Å; F352-F356 VanDerWaalsContact O-N 3.13Å; F353-F356 WeakPolarHBondContact O-CB 3.46Å; S354-F356 VanDerWaalsContact C-N 3.32Å; S354-F356 PolarHBondContact O-N 3.19Å; F356-L358 PolarHBondContact O-N 3.43Å; F356-F359 PolarHBondContact O-N 2.82Å; F356-F359 VanDerWaalsContact O-N 3.08Å; F356-E360 PolarHBondContact O-N 2.97Å
357	P	89.6	Confident	89.5	Confident	13 Å²	13	23.2 Å²	23.2	8%	0.084	11%	0.11	C	C	.	.	H	α-helix	trans	-57.3	-32.6	176.3	-27.1	37	0	0	0	114	H355 S361 W503 V1039	H355-P357 VanDerWaalsContact O-N 3.14Å; P357-S361 PolarHBondContact O-N 3.43Å; P357-W503 HydrophobicContact CG-CZ2 3.88Å; P357-V1039 HydrophobicContact CB-CG1 3.52Å
358	L	91	Very high	89.6	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-72.5	-43.3	175.7	-55.3	177.1	0	0	0	110.9	H355 F356 E360 S361 H362 L407 F996 L1000 D1011 V1039	H355-L358 HydrophobicContact CB-CD1 4.42Å; H355-L358 WeakPolarHBondContact O-CB 3.14Å; H355-L358 PolarHBondContact O-N 2.9Å; F356-L358 PolarHBondContact O-N 3.43Å; L358-E360 VanDerWaalsContact C-N 3.33Å; L358-E360 PolarHBondContact O-N 2.84Å; L358-S361 PolarHBondContact O-N 3.43Å; L358-S361 VanDerWaalsContact O-N 3.15Å; L358-H362 PolarHBondContact O-CD2 3.12Å; L358-H362 PolarHBondContact O-N 3.31Å; L358-L407 HydrophobicContact CB-CD2 4.31Å; L358-L407 HydrophobicContact CD1-CD1 4.48Å; L358-L407 HydrophobicContact CD1-CD2 4.26Å; L358-F996 HydrophobicContact CD1-CE1 4.35Å; L358-L1000 HydrophobicContact CD1-CD1 4.49Å; L358-L1000 HydrophobicContact CD1-CD2 3.81Å; L358-D1011 HydrophobicContact CD1-CB 4.19Å; L358-D1011 HydrophobicContact CD2-CB 4.26Å; L358-V1039 HydrophobicContact CD2-CG1 3.97Å; L358-V1039 HydrophobicContact CD2-CG2 4.47Å
359	F	91.6	Very high	89.7	Confident	1 Å²	1	23.2 Å²	23.2	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-60.9	-39.5	175	-76.7	-89.3	0	0	0	112.2	F336 F351 F352 H355 F356 M363 I404	F336-F359 HydrophobicContact CE1-CE1 4.44Å; F336-F359 HydrophobicContact CZ-CD1 4.18Å; F336-F359 HydrophobicContact CZ-CE1 4.16Å; F351-F359 HydrophobicContact CD1-CE2 4.14Å; F351-F359 HydrophobicContact CD1-CZ 4.19Å; F351-F359 HydrophobicContact CE1-CE2 4.01Å; F351-F359 HydrophobicContact CE1-CZ 4.08Å; F352-F359 HydrophobicContact CB-CE2 4.42Å; F352-F359 HydrophobicContact CB-CZ 4.49Å; F352-F359 AromaticContact CD2-CD1 3.67Å; F352-F359 HydrophobicContact CD2-CD1 3.67Å; F352-F359 HydrophobicContact CD2-CD2 4.01Å; F352-F359 AromaticContact CD2-CE1 3.63Å; F352-F359 HydrophobicContact CD2-CE1 3.63Å; F352-F359 AromaticContact CD2-CE2 4Å; F352-F359 HydrophobicContact CD2-CE2 4Å; F352-F359 AromaticContact CD2-CG 3.86Å; F352-F359 HydrophobicContact CD2-CG 3.86Å; F352-F359 AromaticContact CD2-CZ 3.81Å; F352-F359 HydrophobicContact CD2-CZ 3.81Å; F352-F359 HydrophobicContact CE2-CB 4.18Å; F352-F359 AromaticContact CE2-CD1 3.65Å; F352-F359 HydrophobicContact CE2-CD1 3.65Å; F352-F359 HydrophobicContact CE2-CD2 4.39Å; F352-F359 HydrophobicContact CE2-CE1 4.05Å; F352-F359 AromaticContact CE2-CG 3.83Å; F352-F359 HydrophobicContact CE2-CG 3.83Å; H355-F359 HydrophobicContact CB-CD2 4.29Å; H355-F359 HydrophobicContact CB-CE2 4.1Å; H355-F359 PolarHBondContact O-N 3.4Å; F356-F359 PolarHBondContact O-N 2.82Å; F356-F359 VanDerWaalsContact O-N 3.08Å; F359-M363 WeakPolarHBondContact O-CB 3.35Å; F359-M363 PolarHBondContact O-N 2.85Å; F359-I404 HydrophobicContact CD1-CD1 3.73Å; F359-I404 HydrophobicContact CD1-CG1 4.46Å; F359-I404 HydrophobicContact CE1-CD1 3.76Å; F359-I404 HydrophobicContact CE1-CG1 4.3Å; F359-I404 HydrophobicContact CE1-CG2 3.67Å; F359-I404 HydrophobicContact CG-CD1 4.48Å; F359-I404 HydrophobicContact CZ-CG2 4.27Å
360	E	90.4	Very high	89.8	Confident	57 Å²	57	22.5 Å²	22.5	27%	0.266	12%	0.118	S	C	.	.	H	α-helix	trans	-65.5	-42.6	171.8	172.3	149.1	-149.6	0	0	111.9	L146 K161 F356 L358 H362 M363 N364	L146-E360 HydrophobicContact CD2-CB 4.42Å; L146-E360 HydrophobicContact CD2-CG 4.31Å; L146-E360 WeakPolarHBondContact CD2-OE2 3.14Å; K161-E360 IonicContact NZ-OE1 3.89Å; K161-E360 PolarHBondContact NZ-OE1 3.23Å; F356-E360 PolarHBondContact O-N 2.97Å; L358-E360 VanDerWaalsContact C-N 3.33Å; L358-E360 PolarHBondContact O-N 2.84Å; E360-H362 PolarHBondContact O-N 3.46Å; E360-M363 CarbonylContact O-C 3.27Å; E360-M363 WeakPolarHBondContact O-CB 3.21Å; E360-M363 PolarHBondContact O-N 2.89Å; E360-M363 VanDerWaalsContact O-N 3.11Å; E360-N364 WeakPolarHBondContact CG-ND2 3.25Å; E360-N364 VanDerWaalsContact O-CG 3.3Å; E360-N364 PolarHBondContact O-N 2.75Å; E360-N364 PolarHBondContact O-ND2 3.43Å
361	S	89.7	Confident	89.6	Confident	8 Å²	8	19.7 Å²	19.7	6%	0.056	11%	0.105	C	C	.	.	H	α-helix	trans	-60	-45.3	177.2	-168.4	0	0	0	0	112.5	P357 L358 M363 N364 K365 H1033	P357-S361 PolarHBondContact O-N 3.43Å; L358-S361 PolarHBondContact O-N 3.43Å; L358-S361 VanDerWaalsContact O-N 3.15Å; S361-M363 VanDerWaalsContact C-N 3.33Å; S361-M363 PolarHBondContact O-N 3.28Å; S361-N364 WeakPolarHBondContact O-CB 3.43Å; S361-N364 PolarHBondContact O-N 3.26Å; S361-N364 VanDerWaalsContact O-N 3.16Å; S361-K365 PolarHBondContact O-N 3.03Å; S361-H1033 PolarHBondContact O-CE1 3.12Å; S361-H1033 PolarHBondContact O-NE2 2.63Å; S361-H1033 PolarHBondContact OG-CE1 2.88Å
362	H	90.8	Very high	89.3	Confident	7 Å²	7	24.9 Å²	24.9	3%	0.032	13%	0.129	C	C	.	.	H	α-helix	trans	-62.5	-37.9	172.3	-75.9	-62.3	0	0	0	112.4	L358 E360 N364 K365 L366 F400 T403 I404 D1011	L358-H362 PolarHBondContact O-CD2 3.12Å; L358-H362 PolarHBondContact O-N 3.31Å; E360-H362 PolarHBondContact O-N 3.46Å; H362-N364 VanDerWaalsContact C-N 3.33Å; H362-N364 PolarHBondContact O-N 3.03Å; H362-K365 WeakPolarHBondContact O-CB 3.38Å; H362-K365 PolarHBondContact O-N 2.99Å; H362-L366 WeakPolarHBondContact O-CB 3.46Å; H362-L366 PolarHBondContact O-N 3.17Å; H362-F400 HydrophobicContact CB-CD2 3.88Å; H362-F400 HydrophobicContact CB-CE2 3.69Å; H362-T403 PolarHBondContact ND1-OG1 2.77Å; H362-I404 HydrophobicContact CB-CD1 4.17Å; H362-D1011 IonicContact CD2-OD1 2.68Å; H362-D1011 IonicContact CE1-OD1 2.71Å; H362-D1011 IonicContact CE1-OD2 3.2Å; H362-D1011 PolarHBondContact CE1-OD2 2.85Å; H362-D1011 IonicContact NE2-OD1 2.72Å; H362-D1011 PolarHBondContact NE2-OD1 3.18Å; H362-D1011 IonicContact NE2-OD2 2.73Å; H362-D1011 PolarHBondContact NE2-OD2 2.59Å
363	M	90.3	Very high	89.1	Confident	1 Å²	1	25 Å²	25	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-66	-35.2	174.3	-162.5	-174.5	-156.2	0	0	112.2	L146 L159 K161 I332 V334 F359 E360 S361 L366 K367	L146-M363 HydrophobicContact CD1-SD 3.65Å; L159-M363 HydrophobicContact CD2-CB 4.41Å; L159-M363 HydrophobicContact CD2-CE 4.42Å; L159-M363 HydrophobicContact CD2-CG 4.47Å; L159-M363 HydrophobicContact CD2-SD 3.68Å; L159-M363 HydrophobicContact CG-CE 4.03Å; L159-M363 HydrophobicContact CG-SD 3.69Å; L159-M363 WeakPolarHBondContact O-CE 3.49Å; K161-M363 HydrophobicContact CB-CE 3.79Å; K161-M363 HydrophobicContact CB-SD 3.73Å; K161-M363 HydrophobicContact CD-SD 4.42Å; I332-M363 HydrophobicContact CG2-CE 4.08Å; I332-M363 WeakPolarHBondContact O-CE 2.99Å; V334-M363 HydrophobicContact CG2-CE 4.3Å; F359-M363 WeakPolarHBondContact O-CB 3.35Å; F359-M363 PolarHBondContact O-N 2.85Å; E360-M363 CarbonylContact O-C 3.27Å; E360-M363 WeakPolarHBondContact O-CB 3.21Å; E360-M363 PolarHBondContact O-N 2.89Å; E360-M363 VanDerWaalsContact O-N 3.11Å; S361-M363 VanDerWaalsContact C-N 3.33Å; S361-M363 PolarHBondContact O-N 3.28Å; M363-L366 PolarHBondContact O-N 3.12Å; M363-K367 VanDerWaalsContact O-CB 3.29Å; M363-K367 WeakPolarHBondContact O-CB 3.48Å; M363-K367 PolarHBondContact O-N 3.19Å
364	N	89.3	Confident	88.6	Confident	19 Å²	19	21 Å²	21	10%	0.102	11%	0.113	C	C	.	.	H	α-helix	trans	-69	-38.8	173.8	-69.4	-35.3	0	0	0	111.4	K161 E360 S361 H362 K367 S368 H1037	K161-N364 PolarHBondContact NZ-OD1 2.93Å; E360-N364 WeakPolarHBondContact CG-ND2 3.25Å; E360-N364 VanDerWaalsContact O-CG 3.3Å; E360-N364 PolarHBondContact O-N 2.75Å; E360-N364 PolarHBondContact O-ND2 3.43Å; S361-N364 WeakPolarHBondContact O-CB 3.43Å; S361-N364 PolarHBondContact O-N 3.26Å; S361-N364 VanDerWaalsContact O-N 3.16Å; H362-N364 VanDerWaalsContact C-N 3.33Å; H362-N364 PolarHBondContact O-N 3.03Å; N364-K367 PolarHBondContact O-N 2.93Å; N364-S368 WeakPolarHBondContact O-CB 3.4Å; N364-S368 PolarHBondContact O-N 2.79Å; N364-S368 PolarHBondContact O-OG 2.83Å; N364-H1037 HydrophobicContact CB-CB 4.43Å
365	K	89.8	Confident	88.2	Confident	32 Å²	32	22.7 Å²	22.7	14%	0.139	12%	0.118	C	C	.	.	H	α-helix	trans	-58.5	-49.5	171	-160.8	175.2	175.8	-172	0	111.1	S361 H362 S368 A369 E399 D1030 H1033	S361-K365 PolarHBondContact O-N 3.03Å; H362-K365 WeakPolarHBondContact O-CB 3.38Å; H362-K365 PolarHBondContact O-N 2.99Å; K365-S368 PolarHBondContact O-N 2.8Å; K365-A369 PolarHBondContact O-N 2.82Å; K365-E399 WeakPolarHBondContact CE-OE1 3.39Å; K365-E399 IonicContact NZ-OE1 2.71Å; K365-E399 PolarHBondContact NZ-OE1 3.16Å; K365-D1030 IonicContact NZ-OD1 3.34Å; K365-D1030 PolarHBondContact NZ-OD1 3.21Å; K365-H1033 WeakPolarHBondContact CA-NE2 3.39Å; K365-H1033 VanDerWaalsContact CB-NE2 3.25Å; K365-H1033 WeakPolarHBondContact CB-NE2 3.28Å; K365-H1033 PolarHBondContact N-NE2 3.36Å
366	L	91.2	Very high	87.3	Confident	4 Å²	4	26.9 Å²	26.9	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-62.4	-42.7	177.2	-179.1	60.4	0	0	0	112.3	L44 V334 H362 M363 A369 I370 A396 F400	L44-L366 HydrophobicContact CD1-CD2 4.34Å; L44-L366 HydrophobicContact CD2-CD1 4.48Å; V334-L366 HydrophobicContact CG2-CD2 3.99Å; H362-L366 WeakPolarHBondContact O-CB 3.46Å; H362-L366 PolarHBondContact O-N 3.17Å; M363-L366 PolarHBondContact O-N 3.12Å; L366-A369 PolarHBondContact O-N 3.41Å; L366-I370 HydrophobicContact CD1-CD1 3.82Å; L366-I370 HydrophobicContact CD1-CG1 4.22Å; L366-I370 HydrophobicContact CG-CD1 3.8Å; L366-I370 WeakPolarHBondContact O-CB 3.39Å; L366-I370 VanDerWaalsContact O-CG1 3.25Å; L366-I370 WeakPolarHBondContact O-CG1 3.32Å; L366-I370 PolarHBondContact O-N 3.12Å; L366-A396 HydrophobicContact CD1-CB 3.97Å; L366-F400 HydrophobicContact CB-CD2 4.12Å; L366-F400 HydrophobicContact CD1-CB 4.45Å; L366-F400 HydrophobicContact CD2-CB 4.28Å; L366-F400 HydrophobicContact CD2-CD1 4.41Å; L366-F400 HydrophobicContact CD2-CD2 3.92Å; L366-F400 HydrophobicContact CD2-CE2 4.39Å; L366-F400 HydrophobicContact CD2-CG 3.94Å
367	K	89.8	Confident	86.4	Confident	10 Å²	10	26.4 Å²	26.4	4%	0.043	14%	0.141	C	C	.	.	H	α-helix	trans	-56	-51.4	173.3	177.8	-158.4	172	-162.2	0	111.1	F163 E309 I332 M363 N364 A369 I370 E371	F163-K367 HydrophobicContact CE1-CG 4.1Å; F163-K367 HydrophobicContact CE2-CG 4.26Å; F163-K367 HydrophobicContact CZ-CG 3.91Å; E309-K367 IonicContact OE1-NZ 3.57Å; E309-K367 PolarHBondContact OE1-NZ 3.32Å; I332-K367 HydrophobicContact CD1-CB 3.94Å; I332-K367 HydrophobicContact CD1-CG 4.08Å; M363-K367 VanDerWaalsContact O-CB 3.29Å; M363-K367 WeakPolarHBondContact O-CB 3.48Å; M363-K367 PolarHBondContact O-N 3.19Å; N364-K367 PolarHBondContact O-N 2.93Å; K367-A369 PolarHBondContact O-N 3.18Å; K367-I370 PolarHBondContact O-N 2.85Å; K367-E371 WeakPolarHBondContact CE-OE1 3.26Å; K367-E371 WeakPolarHBondContact O-CB 3.21Å; K367-E371 PolarHBondContact O-N 2.84Å
368	S	87.2	Confident	85.2	Confident	41 Å²	41	30.6 Å²	30.6	29%	0.287	16%	0.155	S	C	.	.	H	α-helix	trans	-63.7	-40.7	-179.1	-71.1	0	0	0	0	112	N364 K365 E371 Q372 H1037	N364-S368 WeakPolarHBondContact O-CB 3.4Å; N364-S368 PolarHBondContact O-N 2.79Å; N364-S368 PolarHBondContact O-OG 2.83Å; K365-S368 PolarHBondContact O-N 2.8Å; S368-E371 PolarHBondContact O-N 2.88Å; S368-Q372 WeakPolarHBondContact O-CG 3.06Å; S368-Q372 PolarHBondContact O-N 2.8Å; S368-H1037 PolarHBondContact OG-NE2 2.79Å
369	A	88.4	Confident	83.9	Confident	37 Å²	37	41.4 Å²	41.4	31%	0.306	20%	0.196	S	C	.	.	H	α-helix	trans	-62.5	-46.1	173.9	0	0	0	0	0	112.8	K365 L366 K367 E371 Q372 A373 A396	K365-A369 PolarHBondContact O-N 2.82Å; L366-A369 PolarHBondContact O-N 3.41Å; K367-A369 PolarHBondContact O-N 3.18Å; A369-E371 VanDerWaalsContact C-N 3.34Å; A369-E371 PolarHBondContact O-N 3.28Å; A369-Q372 PolarHBondContact O-N 3.23Å; A369-A373 PolarHBondContact O-N 3.07Å; A369-A396 HydrophobicContact CB-CB 3.67Å
370	I	88.6	Confident	82.2	Confident	1 Å²	1	42 Å²	42	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-41.2	176.2	-70.8	168.3	0	0	0	110.9	L44 V46 I332 L366 K367 Q372 A373 M374 I393	L44-I370 HydrophobicContact CD1-CD1 4.34Å; L44-I370 HydrophobicContact CD2-CD1 3.97Å; V46-I370 HydrophobicContact CG2-CD1 4.18Å; I332-I370 HydrophobicContact CD1-CB 4.34Å; I332-I370 HydrophobicContact CD1-CD1 3.9Å; I332-I370 HydrophobicContact CD1-CG2 4.29Å; I332-I370 HydrophobicContact CG1-CD1 4.23Å; I332-I370 HydrophobicContact CG2-CD1 4.43Å; L366-I370 HydrophobicContact CD1-CD1 3.82Å; L366-I370 HydrophobicContact CD1-CG1 4.22Å; L366-I370 HydrophobicContact CG-CD1 3.8Å; L366-I370 WeakPolarHBondContact O-CB 3.39Å; L366-I370 VanDerWaalsContact O-CG1 3.25Å; L366-I370 WeakPolarHBondContact O-CG1 3.32Å; L366-I370 PolarHBondContact O-N 3.12Å; K367-I370 PolarHBondContact O-N 2.85Å; I370-Q372 PolarHBondContact O-N 3.44Å; I370-A373 PolarHBondContact O-N 2.97Å; I370-M374 HydrophobicContact CG2-CE 3.77Å; I370-M374 HydrophobicContact CG2-CG 4.5Å; I370-M374 WeakPolarHBondContact O-CB 3.31Å; I370-M374 WeakPolarHBondContact O-CG 3.37Å; I370-M374 PolarHBondContact O-N 3.43Å; I370-I393 HydrophobicContact CG1-CG1 4.4Å; I370-I393 HydrophobicContact CG1-CG2 4.23Å
371	E	84.3	Confident	80.7	Confident	18 Å²	18	43.2 Å²	43.2	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-59.4	-44.8	174.8	-88.3	-162.3	-150.6	0	0	112.4	F163 F311 K367 S368 A369 M374 K375	F163-E371 HydrophobicContact CE2-CG 3.94Å; F163-E371 WeakPolarHBondContact CE2-OE1 3.34Å; F163-E371 HydrophobicContact CZ-CG 4.43Å; F311-E371 VanDerWaalsContact CD1-CD 3.45Å; F311-E371 HydrophobicContact CD1-CG 4.16Å; F311-E371 WeakPolarHBondContact CD1-OE2 3.41Å; F311-E371 HydrophobicContact CE1-CG 4.01Å; K367-E371 WeakPolarHBondContact CE-OE1 3.26Å; K367-E371 WeakPolarHBondContact O-CB 3.21Å; K367-E371 PolarHBondContact O-N 2.84Å; S368-E371 PolarHBondContact O-N 2.88Å; A369-E371 VanDerWaalsContact C-N 3.34Å; A369-E371 PolarHBondContact O-N 3.28Å; E371-M374 PolarHBondContact O-N 3.5Å; E371-K375 VanDerWaalsContact O-CD 3.32Å; E371-K375 WeakPolarHBondContact O-CD 3.43Å; E371-K375 WeakPolarHBondContact O-CG 3.32Å; E371-K375 PolarHBondContact O-N 3.15Å; E371-K375 WeakPolarHBondContact OE2-CE 3.44Å; E371-K375 IonicContact OE2-NZ 3.67Å; E371-K375 PolarHBondContact OE2-NZ 2.94Å
372	Q	83.4	Confident	79.9	Confident	114 Å²	114	47.1 Å²	47.1	53%	0.533	24%	0.24	S	C	.	.	H	α-helix	trans	-66.4	-42.9	177.9	-61.2	-60.3	2.9	0	0	111.7	S368 A369 I370 M374 K375 M376	S368-Q372 WeakPolarHBondContact O-CG 3.06Å; S368-Q372 PolarHBondContact O-N 2.8Å; A369-Q372 PolarHBondContact O-N 3.23Å; I370-Q372 PolarHBondContact O-N 3.44Å; Q372-M374 VanDerWaalsContact C-N 3.31Å; Q372-M374 PolarHBondContact O-N 3.01Å; Q372-K375 PolarHBondContact O-N 3.35Å; Q372-K375 VanDerWaalsContact O-N 3.14Å; Q372-M376 WeakPolarHBondContact O-CG 3.41Å; Q372-M376 PolarHBondContact O-N 3.49Å
373	A	85.6	Confident	79.1	Confident	3 Å²	3	48.8 Å²	48.8	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-58.5	-41.5	173.4	0	0	0	0	0	112.2	A369 I370 M376 S377 A389 R392 I393	A369-A373 PolarHBondContact O-N 3.07Å; I370-A373 PolarHBondContact O-N 2.97Å; A373-M376 PolarHBondContact O-N 2.96Å; A373-S377 WeakPolarHBondContact O-CB 3.41Å; A373-S377 PolarHBondContact O-N 3.43Å; A373-A389 WeakPolarHBondContact O-CB 3.45Å; A373-R392 HydrophobicContact CB-CB 4.13Å; A373-I393 HydrophobicContact CB-CD1 4.19Å; A373-I393 HydrophobicContact CB-CG1 3.69Å
374	M	80.7	Confident	78.3	Confident	14 Å²	14	52.1 Å²	52.1	7%	0.069	28%	0.279	C	S	.	.	H	α-helix	trans	-65.7	-38.6	174.6	-73.7	-164.6	-170.5	0	0	113	V46 L58 I330 I370 E371 Q372 S377 R378	V46-M374 HydrophobicContact CG1-CE 3.57Å; L58-M374 HydrophobicContact CD1-CE 3.51Å; L58-M374 HydrophobicContact CD1-SD 4.11Å; I330-M374 HydrophobicContact CD1-SD 3.84Å; I330-M374 HydrophobicContact CG2-CE 4.39Å; I370-M374 HydrophobicContact CG2-CE 3.77Å; I370-M374 HydrophobicContact CG2-CG 4.5Å; I370-M374 WeakPolarHBondContact O-CB 3.31Å; I370-M374 WeakPolarHBondContact O-CG 3.37Å; I370-M374 PolarHBondContact O-N 3.43Å; E371-M374 PolarHBondContact O-N 3.5Å; Q372-M374 VanDerWaalsContact C-N 3.31Å; Q372-M374 PolarHBondContact O-N 3.01Å; M374-S377 PolarHBondContact O-N 3.44Å; M374-S377 PolarHBondContact O-OG 2.76Å; M374-R378 PolarHBondContact O-N 3.44Å
375	K	78.4	Confident	77.5	Confident	53 Å²	53	55.8 Å²	55.8	23%	0.23	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-41.6	174.5	-69.5	156.5	-165.6	167.3	0	110.8	E371 Q372 R379	E371-K375 VanDerWaalsContact O-CD 3.32Å; E371-K375 WeakPolarHBondContact O-CD 3.43Å; E371-K375 WeakPolarHBondContact O-CG 3.32Å; E371-K375 PolarHBondContact O-N 3.15Å; E371-K375 WeakPolarHBondContact OE2-CE 3.44Å; E371-K375 IonicContact OE2-NZ 3.67Å; E371-K375 PolarHBondContact OE2-NZ 2.94Å; Q372-K375 PolarHBondContact O-N 3.35Å; Q372-K375 VanDerWaalsContact O-N 3.14Å; K375-R379 PolarHBondContact O-N 3.36Å
376	M	73.1	Confident	76.8	Confident	87 Å²	87	59.7 Å²	59.7	43%	0.429	31%	0.309	S	S	.	.	H	α-helix	trans	-64.6	-45.2	174.5	-66	172.6	75.4	0	0	112.8	Q372 A373 R378 R379 S380 L388	Q372-M376 WeakPolarHBondContact O-CG 3.41Å; Q372-M376 PolarHBondContact O-N 3.49Å; A373-M376 PolarHBondContact O-N 2.96Å; M376-R378 PolarHBondContact O-N 3.48Å; M376-R378 VanDerWaalsContact O-N 3.08Å; M376-R379 PolarHBondContact O-N 3.48Å; M376-S380 PolarHBondContact O-OG 2.8Å; M376-L388 HydrophobicContact CE-CD2 3.69Å
377	S	71.5	Confident	76.2	Confident	34 Å²	34	61 Å²	61	24%	0.238	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-13.9	-177.3	74.6	0	0	0	0	115.6	A373 M374 S380	A373-S377 WeakPolarHBondContact O-CB 3.41Å; A373-S377 PolarHBondContact O-N 3.43Å; M374-S377 PolarHBondContact O-N 3.44Å; M374-S377 PolarHBondContact O-OG 2.76Å; S377-S380 PolarHBondContact O-OG 3.47Å
378	R	63.9	Low	75.8	Confident	102 Å²	102	64.3 Å²	64.3	39%	0.385	34%	0.337	S	S	.	.	H	α-helix	trans	-107.8	-22.3	-178.6	-69.9	-169.3	-175.5	-162.4	11.5	114.7	M374 M376 S380	M374-R378 PolarHBondContact O-N 3.44Å; M376-R378 PolarHBondContact O-N 3.48Å; M376-R378 VanDerWaalsContact O-N 3.08Å; R378-S380 PolarHBondContact O-N 2.93Å
379	R	63.3	Low	75.5	Confident	227 Å²	227	62.5 Å²	62.5	86%	0.857	32%	0.324	S	S	*	.	S	Bend	trans	-74.5	8.3	171.3	-70.2	178.8	176.4	-179.4	-1.3	112.6	K375 M376	K375-R379 PolarHBondContact O-N 3.36Å; M376-R379 PolarHBondContact O-N 3.48Å
380	S	56.3	Low	75.3	Confident	12 Å²	12	63.9 Å²	63.9	8%	0.084	32%	0.322	C	S	.	.			trans	-137.8	126	-164.5	46.6	0	0	0	0	112.7	M376 S377 R378 R386	M376-S380 PolarHBondContact O-OG 2.8Å; S377-S380 PolarHBondContact O-OG 3.47Å; R378-S380 PolarHBondContact O-N 2.93Å; S380-R386 PolarHBondContact O-NH2 2.98Å
381	A	58.8	Low	75.2	Confident	84 Å²	84	67.3 Å²	67.3	69%	0.694	34%	0.34	S	S	*	.			trans	-81	-18.7	171	0	0	0	0	0	112.4	R386	A381-R386 VanDerWaalsContact O-CZ 3.22Å; A381-R386 PolarHBondContact O-NH1 3.42Å; A381-R386 PolarHBondContact O-NH2 3.45Å
382	D	74.4	Confident	75.3	Confident	89 Å²	89	73.4 Å²	73.4	48%	0.476	36%	0.362	S	S	.	.			trans	-82.8	141.5	-168.5	-63.3	-20.3	0	0	0	113.7	S384 Q385 R386	D382-S384 VanDerWaalsContact C-N 3.28Å; D382-S384 PolarHBondContact O-N 3.12Å; D382-Q385 PolarHBondContact O-N 2.65Å; D382-R386 PolarHBondContact O-N 3.47Å; D382-R386 PolarHBondContact O-NH1 3.09Å
383	A	72.4	Confident	75.6	Confident	43 Å²	43	68.7 Å²	68.7	36%	0.355	34%	0.34	S	S	.	.	H	α-helix	trans	-64.3	-33.7	175.9	0	0	0	0	0	112.5	R386 S387	A383-R386 PolarHBondContact O-N 2.64Å; A383-S387 PolarHBondContact O-N 3.16Å
384	S	75.1	Confident	75.8	Confident	71 Å²	71	70.5 Å²	70.5	50%	0.497	35%	0.351	S	S	.	.	H	α-helix	trans	-60.4	-48	176.7	51.9	0	0	0	0	112.2	D382 R386 S387 L388	D382-S384 VanDerWaalsContact C-N 3.28Å; D382-S384 PolarHBondContact O-N 3.12Å; S384-R386 PolarHBondContact O-N 2.96Å; S384-S387 WeakPolarHBondContact O-CB 3.43Å; S384-S387 PolarHBondContact O-N 2.84Å; S384-S387 VanDerWaalsContact O-N 3.11Å; S384-S387 PolarHBondContact O-OG 2.55Å; S384-L388 PolarHBondContact O-N 2.84Å
385	Q	72.3	Confident	76.2	Confident	95 Å²	95	73.9 Å²	73.9	44%	0.444	37%	0.37	S	S	.	.	H	α-helix	trans	-70.3	-30.3	-178.5	-70	178.1	-24.7	0	0	112.3	D382 A389	D382-Q385 PolarHBondContact O-N 2.65Å; Q385-A389 WeakPolarHBondContact O-CB 3.35Å; Q385-A389 PolarHBondContact O-N 3.15Å
386	R	74.6	Confident	76.8	Confident	115 Å²	115	71.8 Å²	71.8	43%	0.434	36%	0.362	S	S	.	.	H	α-helix	trans	-67.7	-38.9	167.2	-62.9	-175.3	-162	94.3	4.6	112.8	S380 A381 D382 A383 S384 A389 Y390	S380-R386 PolarHBondContact O-NH2 2.98Å; A381-R386 VanDerWaalsContact O-CZ 3.22Å; A381-R386 PolarHBondContact O-NH1 3.42Å; A381-R386 PolarHBondContact O-NH2 3.45Å; D382-R386 PolarHBondContact O-N 3.47Å; D382-R386 PolarHBondContact O-NH1 3.09Å; A383-R386 PolarHBondContact O-N 2.64Å; S384-R386 PolarHBondContact O-N 2.96Å; R386-A389 PolarHBondContact O-N 3.3Å; R386-Y390 PolarHBondContact O-N 3.5Å
387	S	77.5	Confident	77.7	Confident	32 Å²	32	67.7 Å²	67.7	22%	0.224	34%	0.342	C	S	.	.	H	α-helix	trans	-65.3	-39.9	176.5	82.2	0	0	0	0	111.6	Y117 A383 S384 Y390 N391	Y117-S387 VanDerWaalsContact OH-CB 3.23Å; Y117-S387 WeakPolarHBondContact OH-CB 3.28Å; A383-S387 PolarHBondContact O-N 3.16Å; S384-S387 WeakPolarHBondContact O-CB 3.43Å; S384-S387 PolarHBondContact O-N 2.84Å; S384-S387 VanDerWaalsContact O-N 3.11Å; S384-S387 PolarHBondContact O-OG 2.55Å; S387-Y390 PolarHBondContact O-N 2.88Å; S387-N391 VanDerWaalsContact O-CG 3.22Å; S387-N391 PolarHBondContact O-N 2.87Å; S387-N391 PolarHBondContact O-OD1 3.36Å
388	L	81.6	Confident	78.6	Confident	79 Å²	79	69.3 Å²	69.3	41%	0.414	35%	0.348	S	S	.	.	H	α-helix	trans	-63.6	-41.9	174	-173.9	152.6	0	0	0	111.3	M376 S384 N391 R392	M376-L388 HydrophobicContact CE-CD2 3.69Å; S384-L388 PolarHBondContact O-N 2.84Å; L388-N391 PolarHBondContact O-N 3.36Å; L388-R392 HydrophobicContact CD2-CG 4.18Å; L388-R392 WeakPolarHBondContact O-CG 3.36Å; L388-R392 PolarHBondContact O-N 3.29Å
389	A	81.5	Confident	79.8	Confident	3 Å²	3	68.3 Å²	68.3	3%	0.025	35%	0.348	C	S	.	.	H	α-helix	trans	-64.4	-38.4	174.6	0	0	0	0	0	113.1	A373 Q385 R386 R392 I393	A373-A389 WeakPolarHBondContact O-CB 3.45Å; Q385-A389 WeakPolarHBondContact O-CB 3.35Å; Q385-A389 PolarHBondContact O-N 3.15Å; R386-A389 PolarHBondContact O-N 3.3Å; A389-R392 PolarHBondContact O-N 3.16Å; A389-I393 WeakPolarHBondContact O-CG1 3.11Å; A389-I393 PolarHBondContact O-N 2.93Å
390	Y	84.7	Confident	81.2	Confident	66 Å²	66	57.8 Å²	57.8	26%	0.259	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-44.8	171.5	-179.8	-79.4	0	0	0	111.1	F59 R386 S387 R392 I393 V394	F59-Y390 AromaticContact CD2-CD2 3.84Å; F59-Y390 HydrophobicContact CD2-CD2 3.84Å; F59-Y390 AromaticContact CD2-CE2 3.47Å; F59-Y390 HydrophobicContact CD2-CE2 3.47Å; F59-Y390 VanDerWaalsContact CD2-CE2 3.47Å; F59-Y390 HydrophobicContact CE2-CD2 4.06Å; F59-Y390 HydrophobicContact CE2-CE1 4.09Å; F59-Y390 AromaticContact CE2-CE2 3.55Å; F59-Y390 HydrophobicContact CE2-CE2 3.55Å; F59-Y390 AromaticContact CE2-CZ 3.57Å; R386-Y390 PolarHBondContact O-N 3.5Å; S387-Y390 PolarHBondContact O-N 2.88Å; Y390-R392 VanDerWaalsContact C-N 3.34Å; Y390-R392 PolarHBondContact O-N 3.16Å; Y390-I393 WeakPolarHBondContact O-CB 3.48Å; Y390-I393 PolarHBondContact O-N 3.23Å; Y390-I393 VanDerWaalsContact O-N 3.08Å; Y390-V394 HydrophobicContact CD1-CG2 3.86Å; Y390-V394 HydrophobicContact CE1-CG2 3.44Å; Y390-V394 VanDerWaalsContact CE1-CG2 3.44Å; Y390-V394 PolarHBondContact O-N 3.14Å; Y390-V394 VanDerWaalsContact O-N 3.1Å
391	N	86	Confident	82.9	Confident	72 Å²	72	59.1 Å²	59.1	39%	0.385	31%	0.311	S	S	.	.	H	α-helix	trans	-59.3	-45.3	178.2	-65.9	-3.1	0	0	0	110.6	S387 L388 I393 V394 D395	S387-N391 VanDerWaalsContact O-CG 3.22Å; S387-N391 PolarHBondContact O-N 2.87Å; S387-N391 PolarHBondContact O-OD1 3.36Å; L388-N391 PolarHBondContact O-N 3.36Å; N391-I393 PolarHBondContact O-N 2.91Å; N391-I393 VanDerWaalsContact O-N 3.15Å; N391-V394 CarbonylContact O-C 3.59Å; N391-V394 WeakPolarHBondContact O-CA 3.22Å; N391-V394 WeakPolarHBondContact O-CB 3.48Å; N391-V394 PolarHBondContact O-N 3.39Å; N391-D395 PolarHBondContact O-N 3.38Å; N391-D395 VanDerWaalsContact O-OD2 3.13Å
392	R	86.6	Confident	84.3	Confident	146 Å²	146	58.5 Å²	58.5	55%	0.551	30%	0.299	S	S	*	.	H	α-helix	trans	-57.9	-29.1	175	-69.7	-62.9	-171.4	120.7	0.7	114.3	A373 L388 A389 Y390 A396	A373-R392 HydrophobicContact CB-CB 4.13Å; L388-R392 HydrophobicContact CD2-CG 4.18Å; L388-R392 WeakPolarHBondContact O-CG 3.36Å; L388-R392 PolarHBondContact O-N 3.29Å; A389-R392 PolarHBondContact O-N 3.16Å; Y390-R392 VanDerWaalsContact C-N 3.34Å; Y390-R392 PolarHBondContact O-N 3.16Å; R392-A396 WeakPolarHBondContact O-CB 3.38Å; R392-A396 PolarHBondContact O-N 3.06Å
393	I	89.1	Confident	85.1	Confident	15 Å²	15	54.9 Å²	54.9	8%	0.077	28%	0.28	C	S	.	.	H	α-helix	trans	-74.6	-37.2	173.1	-63.8	168.3	0	0	0	111.1	L44 F59 I370 A373 A389 Y390 N391 L397	L44-I393 HydrophobicContact CD2-CG2 4.18Å; F59-I393 HydrophobicContact CD1-CG2 4Å; F59-I393 HydrophobicContact CD2-CB 4.25Å; F59-I393 HydrophobicContact CD2-CG2 3.63Å; F59-I393 HydrophobicContact CE1-CG2 4.01Å; F59-I393 HydrophobicContact CE2-CB 4.15Å; F59-I393 HydrophobicContact CE2-CG2 3.63Å; F59-I393 HydrophobicContact CG-CG2 3.82Å; F59-I393 HydrophobicContact CZ-CG2 3.83Å; I370-I393 HydrophobicContact CG1-CG1 4.4Å; I370-I393 HydrophobicContact CG1-CG2 4.23Å; A373-I393 HydrophobicContact CB-CD1 4.19Å; A373-I393 HydrophobicContact CB-CG1 3.69Å; A389-I393 WeakPolarHBondContact O-CG1 3.11Å; A389-I393 PolarHBondContact O-N 2.93Å; Y390-I393 WeakPolarHBondContact O-CB 3.48Å; Y390-I393 PolarHBondContact O-N 3.23Å; Y390-I393 VanDerWaalsContact O-N 3.08Å; N391-I393 PolarHBondContact O-N 2.91Å; N391-I393 VanDerWaalsContact O-N 3.15Å; I393-L397 WeakPolarHBondContact O-CB 3.39Å; I393-L397 PolarHBondContact O-N 3.24Å
394	V	89.4	Confident	85.9	Confident	41 Å²	41	52.9 Å²	52.9	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-41.9	172.2	178.2	0	0	0	0	111.2	F59 Y390 N391 L397 N398	F59-V394 HydrophobicContact CE2-CG2 3.79Å; F59-V394 HydrophobicContact CZ-CG2 3.91Å; Y390-V394 HydrophobicContact CD1-CG2 3.86Å; Y390-V394 HydrophobicContact CE1-CG2 3.44Å; Y390-V394 VanDerWaalsContact CE1-CG2 3.44Å; Y390-V394 PolarHBondContact O-N 3.14Å; Y390-V394 VanDerWaalsContact O-N 3.1Å; N391-V394 CarbonylContact O-C 3.59Å; N391-V394 WeakPolarHBondContact O-CA 3.22Å; N391-V394 WeakPolarHBondContact O-CB 3.48Å; N391-V394 PolarHBondContact O-N 3.39Å; V394-L397 WeakPolarHBondContact O-CB 3.44Å; V394-L397 PolarHBondContact O-N 2.96Å; V394-N398 WeakPolarHBondContact O-CB 3.49Å; V394-N398 PolarHBondContact O-N 3.09Å; V394-N398 PolarHBondContact O-ND2 3.13Å
395	D	90.2	Very high	86.6	Confident	86 Å²	86	49.9 Å²	49.9	46%	0.46	24%	0.242	S	C	.	.	H	α-helix	trans	-62	-48.7	178.4	-57.5	-32.2	0	0	0	110.3	N391 L397 N398 E399	N391-D395 PolarHBondContact O-N 3.38Å; N391-D395 VanDerWaalsContact O-OD2 3.13Å; D395-L397 VanDerWaalsContact C-N 3.34Å; D395-L397 PolarHBondContact O-N 3.36Å; D395-N398 PolarHBondContact O-N 2.83Å; D395-N398 VanDerWaalsContact O-N 3.15Å; D395-E399 PolarHBondContact O-N 2.93Å
396	A	90.9	Very high	87.4	Confident	8 Å²	8	46.9 Å²	46.9	7%	0.066	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-34.1	176.5	0	0	0	0	0	113.3	L366 A369 R392 F400	L366-A396 HydrophobicContact CD1-CB 3.97Å; A369-A396 HydrophobicContact CB-CB 3.67Å; R392-A396 WeakPolarHBondContact O-CB 3.38Å; R392-A396 PolarHBondContact O-N 3.06Å; A396-F400 WeakPolarHBondContact O-CB 3.47Å; A396-F400 PolarHBondContact O-N 3.45Å
397	L	91.4	Very high	88.1	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-41.8	171.2	173.3	59.6	0	0	0	111.7	L44 F59 S61 I393 V394 D395 F400 R401	L44-L397 HydrophobicContact CB-CD1 3.54Å; L44-L397 HydrophobicContact CB-CD2 3.92Å; L44-L397 HydrophobicContact CB-CG 4.27Å; L44-L397 HydrophobicContact CD2-CB 4.08Å; L44-L397 HydrophobicContact CD2-CD1 4.15Å; L44-L397 HydrophobicContact CD2-CD2 4.35Å; L44-L397 HydrophobicContact CD2-CG 4.42Å; L44-L397 HydrophobicContact CG-CD1 4.46Å; F59-L397 HydrophobicContact CE1-CD2 4.23Å; F59-L397 HydrophobicContact CZ-CD2 4.42Å; S61-L397 VanDerWaalsContact CB-CD2 3.41Å; I393-L397 WeakPolarHBondContact O-CB 3.39Å; I393-L397 PolarHBondContact O-N 3.24Å; V394-L397 WeakPolarHBondContact O-CB 3.44Å; V394-L397 PolarHBondContact O-N 2.96Å; D395-L397 VanDerWaalsContact C-N 3.34Å; D395-L397 PolarHBondContact O-N 3.36Å; L397-F400 PolarHBondContact O-N 3.3Å; L397-R401 HydrophobicContact CD1-CG 4.29Å; L397-R401 WeakPolarHBondContact O-CB 3.25Å; L397-R401 VanDerWaalsContact O-CG 3.26Å; L397-R401 WeakPolarHBondContact O-CG 3.45Å; L397-R401 PolarHBondContact O-N 2.81Å
398	N	90.8	Very high	88.6	Confident	68 Å²	68	40.1 Å²	40.1	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-69.9	-35.9	178.7	-69	-23.2	0	0	0	111.2	V394 D395 R401 T402	V394-N398 WeakPolarHBondContact O-CB 3.49Å; V394-N398 PolarHBondContact O-N 3.09Å; V394-N398 PolarHBondContact O-ND2 3.13Å; D395-N398 PolarHBondContact O-N 2.83Å; D395-N398 VanDerWaalsContact O-N 3.15Å; N398-R401 WeakPolarHBondContact O-CB 3.35Å; N398-R401 PolarHBondContact O-N 3.17Å; N398-R401 PolarHBondContact OD1-NH1 2.88Å; N398-R401 VanDerWaalsContact OD1-NH1 3.07Å; N398-T402 WeakPolarHBondContact O-CG2 3.44Å; N398-T402 PolarHBondContact O-N 2.86Å; N398-T402 PolarHBondContact O-OG1 2.75Å; N398-T402 VanDerWaalsContact O-OG1 3.14Å
399	E	89.9	Confident	88.9	Confident	81 Å²	81	37.5 Å²	37.5	38%	0.379	19%	0.186	S	C	.	.	H	α-helix	trans	-58.4	-56.1	169	-171.5	-176.2	168.7	0	0	110.7	K365 D395 R401 T402 T403	K365-E399 WeakPolarHBondContact CE-OE1 3.39Å; K365-E399 IonicContact NZ-OE1 2.71Å; K365-E399 PolarHBondContact NZ-OE1 3.16Å; D395-E399 PolarHBondContact O-N 2.93Å; E399-R401 VanDerWaalsContact C-N 3.28Å; E399-R401 PolarHBondContact O-N 2.79Å; E399-T402 PolarHBondContact O-N 2.64Å; E399-T402 PolarHBondContact O-OG1 3.29Å; E399-T403 PolarHBondContact O-N 2.72Å
400	F	91.6	Very high	89.1	Confident	6 Å²	6	38.3 Å²	38.3	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-55.5	-41	177.3	177.5	-84.9	0	0	0	112.6	I42 V334 F336 H362 L366 A396 L397 T403 I404	I42-F400 HydrophobicContact CG2-CD1 4.3Å; I42-F400 HydrophobicContact CG2-CE1 4.09Å; V334-F400 HydrophobicContact CG1-CE1 3.65Å; V334-F400 HydrophobicContact CG1-CZ 3.94Å; V334-F400 HydrophobicContact CG2-CE1 4.37Å; V334-F400 HydrophobicContact CG2-CZ 4.28Å; F336-F400 HydrophobicContact CZ-CE1 4.49Å; F336-F400 HydrophobicContact CZ-CZ 4.42Å; H362-F400 HydrophobicContact CB-CD2 3.88Å; H362-F400 HydrophobicContact CB-CE2 3.69Å; L366-F400 HydrophobicContact CB-CD2 4.12Å; L366-F400 HydrophobicContact CD1-CB 4.45Å; L366-F400 HydrophobicContact CD2-CB 4.28Å; L366-F400 HydrophobicContact CD2-CD1 4.41Å; L366-F400 HydrophobicContact CD2-CD2 3.92Å; L366-F400 HydrophobicContact CD2-CE2 4.39Å; L366-F400 HydrophobicContact CD2-CG 3.94Å; A396-F400 WeakPolarHBondContact O-CB 3.47Å; A396-F400 PolarHBondContact O-N 3.45Å; L397-F400 PolarHBondContact O-N 3.3Å; F400-T403 PolarHBondContact O-N 2.94Å; F400-T403 PolarHBondContact O-OG1 2.81Å; F400-T403 VanDerWaalsContact O-OG1 3.1Å; F400-I404 HydrophobicContact CD1-CG1 4.29Å; F400-I404 HydrophobicContact CE1-CG1 3.86Å; F400-I404 HydrophobicContact CE2-CG1 4.19Å; F400-I404 HydrophobicContact CZ-CD1 4.42Å; F400-I404 HydrophobicContact CZ-CG1 3.8Å; F400-I404 WeakPolarHBondContact O-CG1 3.5Å; F400-I404 PolarHBondContact O-N 2.67Å; F400-I404 VanDerWaalsContact O-N 3.09Å
401	R	91.6	Very high	89.2	Confident	40 Å²	40	37.3 Å²	37.3	15%	0.151	19%	0.192	C	C	.	.	H	α-helix	trans	-58.8	-51.1	173	-80.9	164.8	166.8	176.5	-13.3	111.1	P39 I42 L397 N398 E399 T403 C405	P39-R401 HydrophobicContact CB-CB 4.24Å; P39-R401 WeakPolarHBondContact O-CD 3.4Å; P39-R401 PolarHBondContact O-NE 3.01Å; P39-R401 VanDerWaalsContact O-NE 3.12Å; I42-R401 HydrophobicContact CB-CG 3.95Å; I42-R401 HydrophobicContact CD1-CG 4.18Å; I42-R401 HydrophobicContact CG2-CG 4.21Å; I42-R401 PolarHBondContact O-NE 2.94Å; I42-R401 VanDerWaalsContact O-NE 3.07Å; I42-R401 PolarHBondContact O-NH2 3.32Å; L397-R401 HydrophobicContact CD1-CG 4.29Å; L397-R401 WeakPolarHBondContact O-CB 3.25Å; L397-R401 VanDerWaalsContact O-CG 3.26Å; L397-R401 WeakPolarHBondContact O-CG 3.45Å; L397-R401 PolarHBondContact O-N 2.81Å; N398-R401 WeakPolarHBondContact O-CB 3.35Å; N398-R401 PolarHBondContact O-N 3.17Å; N398-R401 PolarHBondContact OD1-NH1 2.88Å; N398-R401 VanDerWaalsContact OD1-NH1 3.07Å; E399-R401 VanDerWaalsContact C-N 3.28Å; E399-R401 PolarHBondContact O-N 2.79Å; R401-T403 PolarHBondContact O-N 3.05Å; R401-C405 WeakPolarHBondContact O-CB 3.45Å; R401-C405 PolarHBondContact O-N 3.41Å; R401-C405 PolarHBondContact O-SG 3.07Å
402	T	89.4	Confident	89.4	Confident	70 Å²	70	34.3 Å²	34.3	43%	0.429	18%	0.175	S	C	.	.	H	α-helix	trans	-65.5	-36.2	-179.5	53.4	0	0	0	0	113.2	N398 E399 N406	N398-T402 WeakPolarHBondContact O-CG2 3.44Å; N398-T402 PolarHBondContact O-N 2.86Å; N398-T402 PolarHBondContact O-OG1 2.75Å; N398-T402 VanDerWaalsContact O-OG1 3.14Å; E399-T402 PolarHBondContact O-N 2.64Å; E399-T402 PolarHBondContact O-OG1 3.29Å; T402-N406 WeakPolarHBondContact O-CB 3.31Å; T402-N406 PolarHBondContact O-N 2.75Å; T402-N406 PolarHBondContact O-ND2 3.19Å; T402-N406 PolarHBondContact O-OD1 2.86Å
403	T	89.4	Confident	89.4	Confident	14 Å²	14	28.3 Å²	28.3	9%	0.086	15%	0.153	C	C	.	.	H	α-helix	trans	-66.5	-48.8	176.7	57.6	0	0	0	0	111.4	H362 E399 F400 R401 N406 L407 P1010	H362-T403 PolarHBondContact ND1-OG1 2.77Å; E399-T403 PolarHBondContact O-N 2.72Å; F400-T403 PolarHBondContact O-N 2.94Å; F400-T403 PolarHBondContact O-OG1 2.81Å; F400-T403 VanDerWaalsContact O-OG1 3.1Å; R401-T403 PolarHBondContact O-N 3.05Å; T403-N406 PolarHBondContact O-N 3.39Å; T403-L407 VanDerWaalsContact O-CB 3.24Å; T403-L407 WeakPolarHBondContact O-CB 3.37Å; T403-L407 PolarHBondContact O-N 3.31Å; T403-P1010 HydrophobicContact CG2-CG 4.42Å
404	I	90.9	Very high	89	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-43.2	178.7	-62.3	-51.5	0	0	0	112.2	F37 I42 F336 F359 H362 F400 N406 L407 Y408	F37-I404 HydrophobicContact CE1-CG2 4.27Å; I42-I404 HydrophobicContact CD1-CB 4.24Å; I42-I404 HydrophobicContact CD1-CG2 4.19Å; F336-I404 HydrophobicContact CE1-CG2 4.2Å; F359-I404 HydrophobicContact CD1-CD1 3.73Å; F359-I404 HydrophobicContact CD1-CG1 4.46Å; F359-I404 HydrophobicContact CE1-CD1 3.76Å; F359-I404 HydrophobicContact CE1-CG1 4.3Å; F359-I404 HydrophobicContact CE1-CG2 3.67Å; F359-I404 HydrophobicContact CG-CD1 4.48Å; F359-I404 HydrophobicContact CZ-CG2 4.27Å; H362-I404 HydrophobicContact CB-CD1 4.17Å; F400-I404 HydrophobicContact CD1-CG1 4.29Å; F400-I404 HydrophobicContact CE1-CG1 3.86Å; F400-I404 HydrophobicContact CE2-CG1 4.19Å; F400-I404 HydrophobicContact CZ-CD1 4.42Å; F400-I404 HydrophobicContact CZ-CG1 3.8Å; F400-I404 WeakPolarHBondContact O-CG1 3.5Å; F400-I404 PolarHBondContact O-N 2.67Å; F400-I404 VanDerWaalsContact O-N 3.09Å; I404-N406 PolarHBondContact O-N 3.02Å; I404-L407 PolarHBondContact O-N 3.35Å; I404-Y408 PolarHBondContact O-N 3.24Å; I404-Y408 VanDerWaalsContact O-N 3.08Å
405	C	89.1	Confident	88.7	Confident	7 Å²	7	30.4 Å²	30.4	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-64.4	-42.6	178.3	-61.5	0	0	0	0	111.4	F37 P39 R401 Y408 T409	F37-C405 HydrophobicContact CD1-CB 4.21Å; F37-C405 VanDerWaalsContact CD1-SG 3.55Å; F37-C405 VanDerWaalsContact CE1-SG 3.55Å; P39-C405 HydrophobicContact CG-CB 4.26Å; R401-C405 WeakPolarHBondContact O-CB 3.45Å; R401-C405 PolarHBondContact O-N 3.41Å; R401-C405 PolarHBondContact O-SG 3.07Å; C405-Y408 PolarHBondContact O-N 3.11Å; C405-T409 WeakPolarHBondContact O-CB 3.26Å; C405-T409 WeakPolarHBondContact O-CG2 3.35Å; C405-T409 PolarHBondContact O-N 3.41Å; C405-T409 PolarHBondContact O-OG1 3.13Å
406	N	89.4	Confident	88.7	Confident	33 Å²	33	26.3 Å²	26.3	18%	0.176	14%	0.141	C	C	.	.	H	α-helix	trans	-64.7	-44.1	175.6	-72	-6.9	0	0	0	111.7	T402 T403 I404 Y408 T409 M410 S1007 V1009	T402-N406 WeakPolarHBondContact O-CB 3.31Å; T402-N406 PolarHBondContact O-N 2.75Å; T402-N406 PolarHBondContact O-ND2 3.19Å; T402-N406 PolarHBondContact O-OD1 2.86Å; T403-N406 PolarHBondContact O-N 3.39Å; I404-N406 PolarHBondContact O-N 3.02Å; N406-Y408 PolarHBondContact O-N 3.49Å; N406-T409 PolarHBondContact O-N 2.98Å; N406-M410 HydrophobicContact CB-CG 4.02Å; N406-M410 WeakPolarHBondContact O-CB 3.36Å; N406-M410 WeakPolarHBondContact O-CG 3.45Å; N406-M410 PolarHBondContact O-N 2.9Å; N406-S1007 PolarHBondContact ND2-OG 3.43Å; N406-S1007 VanDerWaalsContact ND2-OG 3.08Å; N406-V1009 HydrophobicContact CB-CG2 3.9Å
407	L	89.8	Confident	88.7	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.2	-35.7	179.4	178.5	59	0	0	0	112.4	F351 L358 T403 I404 R412 L1000 D1011 F1012	F351-L407 HydrophobicContact CE1-CG 4.45Å; F351-L407 HydrophobicContact CZ-CG 4.13Å; L358-L407 HydrophobicContact CB-CD2 4.31Å; L358-L407 HydrophobicContact CD1-CD1 4.48Å; L358-L407 HydrophobicContact CD1-CD2 4.26Å; T403-L407 VanDerWaalsContact O-CB 3.24Å; T403-L407 WeakPolarHBondContact O-CB 3.37Å; T403-L407 PolarHBondContact O-N 3.31Å; I404-L407 PolarHBondContact O-N 3.35Å; L407-R412 PolarHBondContact O-NH2 3.07Å; L407-L1000 HydrophobicContact CD1-CD2 4.39Å; L407-D1011 HydrophobicContact CD1-CB 4.1Å; L407-F1012 HydrophobicContact CD1-CD1 4.26Å; L407-F1012 HydrophobicContact CD1-CE1 3.9Å
408	Y	87.6	Confident	88.7	Confident	4 Å²	4	27 Å²	27	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-82.3	-37.8	178.6	-172.7	-123.1	0	0	0	113.7	W32 P35 F37 F348 F351 I404 C405 N406 R412	W32-Y408 HydrophobicContact CZ2-CD2 4.43Å; W32-Y408 AromaticContact CZ2-CE2 3.76Å; W32-Y408 HydrophobicContact CZ2-CE2 3.76Å; W32-Y408 PolarHBondContact NE1-O 2.88Å; P35-Y408 HydrophobicContact CB-CE1 3.73Å; P35-Y408 HydrophobicContact CG-CD1 4.36Å; P35-Y408 HydrophobicContact CG-CE1 3.7Å; F37-Y408 HydrophobicContact CB-CD1 3.7Å; F37-Y408 HydrophobicContact CB-CE1 3.99Å; F37-Y408 HydrophobicContact CD1-CD1 4.34Å; F37-Y408 HydrophobicContact CD2-CD1 4.37Å; F37-Y408 HydrophobicContact CD2-CE1 4.43Å; F37-Y408 AromaticContact CG-CD1 3.89Å; F37-Y408 HydrophobicContact CG-CD1 3.89Å; F37-Y408 HydrophobicContact CG-CE1 4.29Å; F348-Y408 HydrophobicContact CD2-CD1 4.34Å; F348-Y408 HydrophobicContact CD2-CD2 4.44Å; F348-Y408 AromaticContact CD2-CE1 4Å; F348-Y408 HydrophobicContact CD2-CE1 4Å; F348-Y408 HydrophobicContact CD2-CE2 4.1Å; F348-Y408 AromaticContact CD2-CZ 3.88Å; F351-Y408 HydrophobicContact CB-CD2 4.29Å; F351-Y408 HydrophobicContact CB-CE2 3.98Å; F351-Y408 AromaticContact CD1-CD2 3.51Å; F351-Y408 HydrophobicContact CD1-CD2 3.51Å; F351-Y408 HydrophobicContact CD1-CE2 4.06Å; F351-Y408 HydrophobicContact CD2-CD2 4.17Å; F351-Y408 HydrophobicContact CD2-CE2 4.46Å; F351-Y408 AromaticContact CE1-CD2 3.79Å; F351-Y408 HydrophobicContact CE1-CD2 3.79Å; F351-Y408 HydrophobicContact CE2-CD2 4.4Å; F351-Y408 AromaticContact CG-CD2 3.72Å; F351-Y408 HydrophobicContact CG-CD2 3.72Å; F351-Y408 AromaticContact CG-CE2 3.9Å; F351-Y408 HydrophobicContact CG-CE2 3.9Å; F351-Y408 HydrophobicContact CZ-CD2 4.23Å; I404-Y408 PolarHBondContact O-N 3.24Å; I404-Y408 VanDerWaalsContact O-N 3.08Å; C405-Y408 PolarHBondContact O-N 3.11Å; N406-Y408 PolarHBondContact O-N 3.49Å; Y408-R412 PolarHBondContact O-NH2 3.3Å; Y408-R412 VanDerWaalsContact O-NH2 3.09Å
409	T	86.6	Confident	88.5	Confident	24 Å²	24	23.8 Å²	23.8	15%	0.147	13%	0.125	C	C	.	.	H	α-helix	trans	-104.2	-17	-169.2	64.6	0	0	0	0	115.9	L34 F37 C405 N406	L34-T409 WeakPolarHBondContact CD2-O 3.45Å; F37-T409 HydrophobicContact CB-CG2 4.16Å; C405-T409 WeakPolarHBondContact O-CB 3.26Å; C405-T409 WeakPolarHBondContact O-CG2 3.35Å; C405-T409 PolarHBondContact O-N 3.41Å; C405-T409 PolarHBondContact O-OG1 3.13Å; N406-T409 PolarHBondContact O-N 2.98Å
410	M	87.1	Confident	88.4	Confident	20 Å²	20	20.9 Å²	20.9	10%	0.099	11%	0.112	C	C	.	.	S	Bend	trans	-64.7	147	-179	-77.6	-61.5	104	0	0	112.1	N406 C1005 V1009 F1012	N406-M410 HydrophobicContact CB-CG 4.02Å; N406-M410 WeakPolarHBondContact O-CB 3.36Å; N406-M410 WeakPolarHBondContact O-CG 3.45Å; N406-M410 PolarHBondContact O-N 2.9Å; M410-C1005 HydrophobicContact CG-CB 4.4Å; M410-C1005 HydrophobicContact SD-CB 3.92Å; M410-V1009 HydrophobicContact CG-CG2 3.88Å; M410-F1012 HydrophobicContact CB-CE2 3.69Å; M410-F1012 HydrophobicContact CB-CZ 3.96Å; M410-F1012 HydrophobicContact CG-CE2 4.44Å
411	P	86.9	Confident	88.1	Confident	46 Å²	46	22.1 Å²	22.1	30%	0.299	12%	0.119	S	C	.	.			trans	-65.6	138.7	-177.4	27.6	-35.2	0	0	0	111.5	G1003 Y1004	P411-G1003 PolarHBondContact O-N 3.29Å; P411-Y1004 WeakPolarHBondContact CG-O 2.78Å
412	R	88.6	Confident	87.6	Confident	9 Å²	9	25.3 Å²	25.3	3%	0.034	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-111	161.6	179.2	-62.3	173.4	-179.7	108.6	15.1	111	W32 L407 Y408 G414 S999	W32-R412 VanDerWaalsContact CE2-NH1 3.31Å; W32-R412 VanDerWaalsContact CG-NH1 3.33Å; W32-R412 VanDerWaalsContact NE1-NH1 3.11Å; L407-R412 PolarHBondContact O-NH2 3.07Å; Y408-R412 PolarHBondContact O-NH2 3.3Å; Y408-R412 VanDerWaalsContact O-NH2 3.09Å; R412-G414 PolarHBondContact O-N 2.94Å; R412-S999 WeakPolarHBondContact CD-O 3.37Å; R412-S999 PolarHBondContact NE-O 3.39Å; R412-S999 VanDerWaalsContact NE-O 3.13Å
413	I	88.5	Confident	86.8	Confident	20 Å²	20	23.7 Å²	23.7	10%	0.103	13%	0.128	C	C	.	.			trans	-81.4	111.3	173.4	-57.4	172.2	0	0	0	108.1	E415 L536 T540 L1001 L1014	I413-E415 PolarHBondContact O-N 2.73Å; I413-L536 HydrophobicContact CD1-CB 3.95Å; I413-T540 HydrophobicContact CD1-CG2 3.58Å; I413-T540 HydrophobicContact CG2-CG2 4.36Å; I413-L1001 HydrophobicContact CD1-CB 4.41Å; I413-L1001 PolarHBondContact N-O 2.85Å; I413-L1014 HydrophobicContact CD1-CD2 4.09Å
414	G	79.1	Confident	85.6	Confident	10 Å²	10	25.6 Å²	25.6	10%	0.103	15%	0.151	C	C	.	.	S	Bend	trans	-66.8	-35.3	-173.4	0	0	0	0	0	114.6	G29 S31 R412	G29-G414 PolarHBondContact O-N 3.15Å; S31-G414 VanDerWaalsContact OG-CA 3.25Å; S31-G414 WeakPolarHBondContact OG-CA 3.3Å; R412-G414 PolarHBondContact O-N 2.94Å
415	E	84.1	Confident	84.4	Confident	90 Å²	90	27.8 Å²	27.8	42%	0.421	16%	0.164	S	C	.	.	S	Bend	trans	-123.9	83	179.9	-64.6	176.3	158.2	0	0	110.9	I413 V417 R434 Y537	I413-E415 PolarHBondContact O-N 2.73Å; E415-V417 PolarHBondContact O-N 3.44Å; E415-R434 IonicContact OE2-NH1 3.02Å; E415-R434 PolarHBondContact OE2-NH1 3.1Å; E415-Y537 WeakPolarHBondContact O-CE2 3.47Å
416	P	89.8	Confident	82.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.202	C	C	.	.			trans	-62.6	131	170.4	-22	35.1	0	0	0	110.5	W418 L419 T420 T540 L1001	P416-W418 PolarHBondContact O-N 3.3Å; P416-L419 HydrophobicContact CB-CB 4.34Å; P416-L419 HydrophobicContact CB-CD1 4.36Å; P416-L419 HydrophobicContact CB-CG 4.46Å; P416-L419 HydrophobicContact CG-CD1 4.35Å; P416-L419 PolarHBondContact O-N 3.48Å; P416-T420 WeakPolarHBondContact O-CB 3.33Å; P416-T420 PolarHBondContact O-N 3.33Å; P416-T420 PolarHBondContact O-OG1 3.06Å; P416-T540 HydrophobicContact CB-CG2 4.32Å; P416-L1001 HydrophobicContact CB-CD1 3.72Å; P416-L1001 HydrophobicContact CG-CD1 3.83Å
417	V	91.2	Very high	82	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.5	-51.2	-172.1	176.2	0	0	0	0	111.2	E415 M421 L431 F435 Y537 T540 Y541	E415-V417 PolarHBondContact O-N 3.44Å; V417-M421 HydrophobicContact CG1-SD 3.95Å; V417-M421 VanDerWaalsContact O-CG 3.28Å; V417-M421 WeakPolarHBondContact O-CG 3.49Å; V417-M421 PolarHBondContact O-N 2.79Å; V417-M421 VanDerWaalsContact O-N 3.12Å; V417-L431 HydrophobicContact CG1-CD2 3.9Å; V417-F435 HydrophobicContact CG1-CB 4.46Å; V417-F435 HydrophobicContact CG1-CD2 3.86Å; V417-F435 HydrophobicContact CG1-CE2 4.42Å; V417-F435 HydrophobicContact CG1-CG 4.28Å; V417-F435 HydrophobicContact CG2-CD2 4.28Å; V417-Y537 HydrophobicContact CG2-CD1 4.16Å; V417-Y537 HydrophobicContact CG2-CD2 3.92Å; V417-Y537 HydrophobicContact CG2-CE1 3.8Å; V417-Y537 HydrophobicContact CG2-CE2 3.53Å; V417-Y537 HydrophobicContact CG2-CG 4.22Å; V417-Y537 VanDerWaalsContact CG2-CZ 3.46Å; V417-Y537 WeakPolarHBondContact CG2-O 3.27Å; V417-T540 WeakPolarHBondContact CG2-OG1 3.35Å; V417-T540 PolarHBondContact N-OG1 3.22Å; V417-Y541 HydrophobicContact CG1-CD2 4.07Å; V417-Y541 HydrophobicContact CG1-CG 4.32Å
418	W	91.4	Very high	81.6	Confident	23 Å²	23	42.4 Å²	42.4	9%	0.087	24%	0.241	C	C	.	.	H	α-helix	trans	-60.3	-52.4	-179.7	176.5	-105.1	0	0	0	112.3	P416 T420 M421 M422 T469 T540 Y541 R544 C545	P416-W418 PolarHBondContact O-N 3.3Å; W418-T420 PolarHBondContact O-N 3.12Å; W418-M421 PolarHBondContact O-N 2.84Å; W418-M422 HydrophobicContact CD2-CG 4.36Å; W418-M422 HydrophobicContact CH2-SD 4.22Å; W418-M422 HydrophobicContact CZ2-CG 4.05Å; W418-M422 HydrophobicContact CZ2-SD 4.05Å; W418-M422 WeakPolarHBondContact O-CG 3.41Å; W418-M422 PolarHBondContact O-N 3.48Å; W418-M422 VanDerWaalsContact O-N 3.12Å; W418-T469 HydrophobicContact CH2-CG2 4.13Å; W418-T469 HydrophobicContact CZ2-CG2 3.7Å; W418-T540 WeakPolarHBondContact CB-O 3.33Å; W418-T540 PolarHBondContact N-O 3.21Å; W418-Y541 HydrophobicContact CE3-CE2 4.48Å; W418-R544 HydrophobicContact CD2-CB 4.09Å; W418-R544 HydrophobicContact CD2-CG 3.64Å; W418-R544 HydrophobicContact CE3-CG 3.92Å; W418-R544 HydrophobicContact CG-CB 4.15Å; W418-R544 HydrophobicContact CG-CG 3.89Å; W418-R544 HydrophobicContact CZ2-CG 4.49Å; W418-R544 HydrophobicContact CZ3-CG 4.45Å; W418-C545 PolarHBondContact NE1-O 2.89Å
419	L	87.3	Confident	81.5	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-47.2	-177.5	-66.9	179	0	0	0	111.4	P416 M421 M422 S423 E547 G997 R998	P416-L419 HydrophobicContact CB-CB 4.34Å; P416-L419 HydrophobicContact CB-CD1 4.36Å; P416-L419 HydrophobicContact CB-CG 4.46Å; P416-L419 HydrophobicContact CG-CD1 4.35Å; P416-L419 PolarHBondContact O-N 3.48Å; L419-M421 VanDerWaalsContact C-N 3.27Å; L419-M421 PolarHBondContact O-N 2.87Å; L419-M422 CarbonylContact O-C 3.59Å; L419-M422 WeakPolarHBondContact O-CA 3.21Å; L419-M422 WeakPolarHBondContact O-CB 3.32Å; L419-M422 PolarHBondContact O-N 3.48Å; L419-S423 PolarHBondContact O-N 2.77Å; L419-S423 PolarHBondContact O-OG 2.95Å; L419-E547 HydrophobicContact CD2-CB 4.13Å; L419-G997 WeakPolarHBondContact CD1-O 3Å; L419-R998 HydrophobicContact CD1-CG 4.07Å
420	T	86.8	Confident	81.6	Confident	20 Å²	20	51.5 Å²	51.5	12%	0.123	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-28.4	-177.8	-46.7	0	0	0	0	112.6	P416 W418 T425 L431	P416-T420 WeakPolarHBondContact O-CB 3.33Å; P416-T420 PolarHBondContact O-N 3.33Å; P416-T420 PolarHBondContact O-OG1 3.06Å; W418-T420 PolarHBondContact O-N 3.12Å; T420-T425 PolarHBondContact O-OG1 3.14Å; T420-L431 HydrophobicContact CG2-CD1 3.53Å
421	M	84.8	Confident	81.6	Confident	31 Å²	31	51.2 Å²	51.2	15%	0.153	28%	0.284	C	S	.	.	H	α-helix	trans	-68.3	-34.7	168.3	-74.7	173.5	63.1	0	0	112.6	V417 W418 L419 K428 L431 Y541 V1104	V417-M421 HydrophobicContact CG1-SD 3.95Å; V417-M421 VanDerWaalsContact O-CG 3.28Å; V417-M421 WeakPolarHBondContact O-CG 3.49Å; V417-M421 PolarHBondContact O-N 2.79Å; V417-M421 VanDerWaalsContact O-N 3.12Å; W418-M421 PolarHBondContact O-N 2.84Å; L419-M421 VanDerWaalsContact C-N 3.27Å; L419-M421 PolarHBondContact O-N 2.87Å; M421-K428 VanDerWaalsContact O-CE 3.31Å; M421-K428 WeakPolarHBondContact O-CE 3.42Å; M421-K428 PolarHBondContact O-NZ 2.97Å; M421-L431 HydrophobicContact CG-CD1 4.38Å; M421-L431 HydrophobicContact CG-CD2 3.5Å; M421-L431 HydrophobicContact SD-CD2 3.89Å; M421-Y541 HydrophobicContact CE-CE2 4.45Å; M421-Y541 HydrophobicContact SD-CD2 4.29Å; M421-Y541 HydrophobicContact SD-CE2 4.39Å; M421-V1104 HydrophobicContact CE-CG1 4.06Å
422	M	81.5	Confident	81.8	Confident	107 Å²	107	49.3 Å²	49.3	53%	0.527	27%	0.272	S	S	.	.	H	α-helix	trans	-79.6	-34.5	179.1	-66.2	-59.5	-71	0	0	113.1	W418 L419 G424 E547	W418-M422 HydrophobicContact CD2-CG 4.36Å; W418-M422 HydrophobicContact CH2-SD 4.22Å; W418-M422 HydrophobicContact CZ2-CG 4.05Å; W418-M422 HydrophobicContact CZ2-SD 4.05Å; W418-M422 WeakPolarHBondContact O-CG 3.41Å; W418-M422 PolarHBondContact O-N 3.48Å; W418-M422 VanDerWaalsContact O-N 3.12Å; L419-M422 CarbonylContact O-C 3.59Å; L419-M422 WeakPolarHBondContact O-CA 3.21Å; L419-M422 WeakPolarHBondContact O-CB 3.32Å; L419-M422 PolarHBondContact O-N 3.48Å; M422-G424 PolarHBondContact O-N 3.29Å; M422-E547 HydrophobicContact CB-CB 4.35Å
423	S	72.9	Confident	81.9	Confident	37 Å²	37	54.4 Å²	54.4	26%	0.259	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	17.6	-178.8	-39	0	0	0	0	115.9	L419 T425 E547 R998	L419-S423 PolarHBondContact O-N 2.77Å; L419-S423 PolarHBondContact O-OG 2.95Å; S423-T425 PolarHBondContact O-N 3.01Å; S423-E547 PolarHBondContact OG-OE1 2.93Å; S423-R998 PolarHBondContact OG-NH2 3.03Å
424	G	63.8	Low	82.1	Confident	54 Å²	54	57 Å²	57	56%	0.557	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	0.4	171	0	0	0	0	0	117.1	M422	M422-G424 PolarHBondContact O-N 3.29Å
425	T	65.6	Low	82.8	Confident	47 Å²	47	56.7 Å²	56.7	29%	0.288	30%	0.296	S	S	.	.			trans	-54.7	143.8	-173.8	61.1	0	0	0	0	113.2	T420 S423 E427 K428	T420-T425 PolarHBondContact O-OG1 3.14Å; S423-T425 PolarHBondContact O-N 3.01Å; T425-E427 PolarHBondContact O-N 3.31Å; T425-K428 WeakPolarHBondContact O-CG 3.48Å
426	P	57	Low	83.2	Confident	131 Å²	131	52.4 Å²	52.4	85%	0.851	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-14	-176.6	28.1	-35.1	0	0	0	113.7	K428	P426-K428 PolarHBondContact O-N 3.44Å
427	E	72.7	Confident	83.4	Confident	131 Å²	131	57.7 Å²	57.7	61%	0.612	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	16.5	-172.5	-58	-163	173.6	0	0	114.6	T425 N429 H430 L431	T425-E427 PolarHBondContact O-N 3.31Å; E427-N429 PolarHBondContact O-N 2.76Å; E427-H430 HydrophobicContact CB-CB 4.45Å; E427-H430 WeakPolarHBondContact O-CA 3.1Å; E427-H430 WeakPolarHBondContact O-CB 3.43Å; E427-H430 PolarHBondContact O-N 3.27Å; E427-L431 PolarHBondContact O-N 3.18Å; E427-L431 VanDerWaalsContact O-N 3.09Å
428	K	81.1	Confident	83.5	Confident	84 Å²	84	58.9 Å²	58.9	37%	0.365	30%	0.304	S	S	.	.	H	α-helix	trans	-49.2	-38.4	-176.4	-49.8	-157.6	-175.9	-166.5	0	113.3	M421 T425 P426 H430 L431 C432	M421-K428 VanDerWaalsContact O-CE 3.31Å; M421-K428 WeakPolarHBondContact O-CE 3.42Å; M421-K428 PolarHBondContact O-NZ 2.97Å; T425-K428 WeakPolarHBondContact O-CG 3.48Å; P426-K428 PolarHBondContact O-N 3.44Å; K428-H430 PolarHBondContact O-N 2.82Å; K428-L431 PolarHBondContact O-N 3.43Å; K428-C432 WeakPolarHBondContact O-CB 3.45Å; K428-C432 PolarHBondContact O-N 3.45Å; K428-C432 PolarHBondContact O-SG 3.1Å
429	N	84.9	Confident	83.5	Confident	106 Å²	106	57.8 Å²	57.8	57%	0.567	30%	0.3	S	S	*	.	H	α-helix	trans	-61.5	-39.3	177	-62.7	-14.6	0	0	0	113.1	E427 Y433 N1101	E427-N429 PolarHBondContact O-N 2.76Å; N429-Y433 WeakPolarHBondContact O-CB 3.35Å; N429-Y433 PolarHBondContact O-N 2.86Å; N429-Y433 VanDerWaalsContact O-N 3.12Å; N429-N1101 PolarHBondContact OD1-ND2 2.89Å
430	H	87.8	Confident	83.8	Confident	113 Å²	113	58.6 Å²	58.6	52%	0.523	31%	0.305	S	S	.	.	H	α-helix	trans	-72.1	-41.1	177	-176.1	74.4	0	0	0	111	E427 K428 Y433 R434	E427-H430 HydrophobicContact CB-CB 4.45Å; E427-H430 WeakPolarHBondContact O-CA 3.1Å; E427-H430 WeakPolarHBondContact O-CB 3.43Å; E427-H430 PolarHBondContact O-N 3.27Å; K428-H430 PolarHBondContact O-N 2.82Å; H430-Y433 WeakPolarHBondContact O-CB 3.26Å; H430-Y433 PolarHBondContact O-N 3Å; H430-R434 PolarHBondContact O-N 3.15Å
431	L	88.4	Confident	84.1	Confident	14 Å²	14	60.8 Å²	60.8	7%	0.073	31%	0.313	C	S	.	.	H	α-helix	trans	-62.9	-46.6	175.6	-173.9	158.9	0	0	0	111.6	V417 T420 M421 E427 K428 Y433 R434 F435	V417-L431 HydrophobicContact CG1-CD2 3.9Å; T420-L431 HydrophobicContact CG2-CD1 3.53Å; M421-L431 HydrophobicContact CG-CD1 4.38Å; M421-L431 HydrophobicContact CG-CD2 3.5Å; M421-L431 HydrophobicContact SD-CD2 3.89Å; E427-L431 PolarHBondContact O-N 3.18Å; E427-L431 VanDerWaalsContact O-N 3.09Å; K428-L431 PolarHBondContact O-N 3.43Å; L431-Y433 VanDerWaalsContact C-N 3.29Å; L431-Y433 PolarHBondContact O-N 2.64Å; L431-R434 PolarHBondContact O-N 3.36Å; L431-R434 VanDerWaalsContact O-N 3.16Å; L431-F435 WeakPolarHBondContact O-CB 3.37Å; L431-F435 PolarHBondContact O-N 2.93Å
432	C	90.1	Very high	84.4	Confident	7 Å²	7	59.5 Å²	59.5	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-57.8	-40.4	172.9	-71	0	0	0	0	111.9	K428 M436 P1100 N1101	K428-C432 WeakPolarHBondContact O-CB 3.45Å; K428-C432 PolarHBondContact O-N 3.45Å; K428-C432 PolarHBondContact O-SG 3.1Å; C432-M436 WeakPolarHBondContact O-CB 3.2Å; C432-M436 VanDerWaalsContact O-CG 3.29Å; C432-M436 WeakPolarHBondContact O-CG 3.33Å; C432-M436 PolarHBondContact O-N 3.31Å; C432-P1100 HydrophobicContact CB-CB 3.97Å; C432-N1101 VanDerWaalsContact CB-OD1 3.26Å; C432-N1101 WeakPolarHBondContact CB-OD1 3.2Å; C432-N1101 PolarHBondContact SG-OD1 3.43Å
433	Y	91.1	Very high	84.8	Confident	116 Å²	116	54.8 Å²	54.8	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-45	174.3	179.1	-94.3	0	0	0	112.3	N429 H430 L431 M436 K437 P1100	N429-Y433 WeakPolarHBondContact O-CB 3.35Å; N429-Y433 PolarHBondContact O-N 2.86Å; N429-Y433 VanDerWaalsContact O-N 3.12Å; H430-Y433 WeakPolarHBondContact O-CB 3.26Å; H430-Y433 PolarHBondContact O-N 3Å; L431-Y433 VanDerWaalsContact C-N 3.29Å; L431-Y433 PolarHBondContact O-N 2.64Å; Y433-M436 PolarHBondContact O-N 3.21Å; Y433-K437 HydrophobicContact CE1-CD 4.42Å; Y433-K437 VanDerWaalsContact O-CB 3.29Å; Y433-K437 WeakPolarHBondContact O-CB 3.48Å; Y433-K437 PolarHBondContact O-N 3.48Å; Y433-P1100 HydrophobicContact CD2-CG 3.91Å; Y433-P1100 HydrophobicContact CG-CG 4.45Å
434	R	92.3	Very high	85.5	Confident	75 Å²	75	57.8 Å²	57.8	28%	0.283	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-46.3	176.8	-169.1	178.9	-171.4	-169.7	8	111.4	E415 H430 L431 K437 E438 Y537	E415-R434 IonicContact OE2-NH1 3.02Å; E415-R434 PolarHBondContact OE2-NH1 3.1Å; H430-R434 PolarHBondContact O-N 3.15Å; L431-R434 PolarHBondContact O-N 3.36Å; L431-R434 VanDerWaalsContact O-N 3.16Å; R434-K437 PolarHBondContact O-N 2.98Å; R434-E438 PolarHBondContact O-N 3.42Å; R434-E438 VanDerWaalsContact O-N 3.1Å; R434-Y537 HydrophobicContact CG-CE1 4.29Å
435	F	93.7	Very high	86.4	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.009	28%	0.284	C	S	.	.	H	α-helix	trans	-59.1	-51.3	174.8	173.8	-103.8	0	0	0	112.1	V417 L431 K437 E438 F439 F538 Y541 V1104 L1107	V417-F435 HydrophobicContact CG1-CB 4.46Å; V417-F435 HydrophobicContact CG1-CD2 3.86Å; V417-F435 HydrophobicContact CG1-CE2 4.42Å; V417-F435 HydrophobicContact CG1-CG 4.28Å; V417-F435 HydrophobicContact CG2-CD2 4.28Å; L431-F435 WeakPolarHBondContact O-CB 3.37Å; L431-F435 PolarHBondContact O-N 2.93Å; F435-K437 VanDerWaalsContact C-N 3.32Å; F435-K437 PolarHBondContact O-N 2.95Å; F435-E438 PolarHBondContact O-N 3.47Å; F435-F439 VanDerWaalsContact O-CB 3.31Å; F435-F439 WeakPolarHBondContact O-CB 3.49Å; F435-F439 PolarHBondContact O-N 3.47Å; F435-F538 HydrophobicContact CD2-CD2 4.15Å; F435-F538 AromaticContact CE2-CD2 3.44Å; F435-F538 HydrophobicContact CE2-CD2 3.44Å; F435-F538 VanDerWaalsContact CE2-CD2 3.44Å; F435-F538 AromaticContact CE2-CE2 3.74Å; F435-F538 HydrophobicContact CE2-CE2 3.74Å; F435-F538 HydrophobicContact CE2-CG 4.46Å; F435-F538 AromaticContact CZ-CD2 3.91Å; F435-F538 HydrophobicContact CZ-CD2 3.91Å; F435-F538 AromaticContact CZ-CE2 3.69Å; F435-F538 HydrophobicContact CZ-CE2 3.69Å; F435-Y541 HydrophobicContact CE1-CD1 4.33Å; F435-Y541 HydrophobicContact CE1-CE1 4.48Å; F435-Y541 AromaticContact CE2-CD1 3.95Å; F435-Y541 HydrophobicContact CE2-CD1 3.95Å; F435-Y541 AromaticContact CE2-CG 3.81Å; F435-Y541 HydrophobicContact CE2-CG 3.81Å; F435-Y541 AromaticContact CZ-CD1 3.48Å; F435-Y541 HydrophobicContact CZ-CD1 3.48Å; F435-Y541 VanDerWaalsContact CZ-CD1 3.48Å; F435-Y541 HydrophobicContact CZ-CD2 4.48Å; F435-Y541 HydrophobicContact CZ-CE1 4Å; F435-Y541 AromaticContact CZ-CG 3.74Å; F435-Y541 HydrophobicContact CZ-CG 3.74Å; F435-V1104 HydrophobicContact CD1-CG2 4.02Å; F435-V1104 HydrophobicContact CE1-CG2 4.21Å; F435-L1107 HydrophobicContact CE1-CD1 4.24Å; F435-L1107 HydrophobicContact CZ-CD1 4.4Å
436	M	94.1	Very high	86.9	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-32.5	-179	-74.7	-59.5	-56.7	0	0	113.5	C432 Y433 F439 T440 T1090 Y1094 P1100 C1103 V1104	C432-M436 WeakPolarHBondContact O-CB 3.2Å; C432-M436 VanDerWaalsContact O-CG 3.29Å; C432-M436 WeakPolarHBondContact O-CG 3.33Å; C432-M436 PolarHBondContact O-N 3.31Å; Y433-M436 PolarHBondContact O-N 3.21Å; M436-F439 HydrophobicContact CE-CD1 3.72Å; M436-F439 HydrophobicContact CE-CE1 4.08Å; M436-F439 HydrophobicContact SD-CD1 4.03Å; M436-T440 WeakPolarHBondContact O-CB 3.37Å; M436-T440 PolarHBondContact O-N 2.92Å; M436-T440 PolarHBondContact O-OG1 3.08Å; M436-T1090 HydrophobicContact CE-CG2 4.03Å; M436-T1090 HydrophobicContact SD-CG2 4.28Å; M436-Y1094 HydrophobicContact CB-CD2 3.98Å; M436-Y1094 HydrophobicContact CB-CE2 3.65Å; M436-Y1094 HydrophobicContact CE-CD1 4.37Å; M436-Y1094 HydrophobicContact CE-CD2 3.64Å; M436-Y1094 HydrophobicContact CE-CE2 4.42Å; M436-Y1094 HydrophobicContact CE-CG 3.59Å; M436-Y1094 HydrophobicContact CG-CD2 4.44Å; M436-Y1094 HydrophobicContact CG-CE2 4.47Å; M436-P1100 HydrophobicContact CB-CB 4.34Å; M436-P1100 HydrophobicContact CG-CB 4.01Å; M436-C1103 HydrophobicContact CE-CB 3.44Å; M436-C1103 VanDerWaalsContact CE-CB 3.44Å; M436-C1103 HydrophobicContact CG-CB 4.33Å; M436-C1103 HydrophobicContact SD-CB 3.76Å; M436-V1104 HydrophobicContact CG-CG2 4.35Å; M436-V1104 HydrophobicContact SD-CG2 4.32Å
437	K	92.8	Very high	87.2	Confident	111 Å²	111	53.3 Å²	53.3	48%	0.483	25%	0.254	S	S	.	.	H	α-helix	trans	-64.7	-49.3	172.8	-179.9	-174.7	174.7	-170.1	0	111.6	Y433 R434 F435 T440 F441	Y433-K437 HydrophobicContact CE1-CD 4.42Å; Y433-K437 VanDerWaalsContact O-CB 3.29Å; Y433-K437 WeakPolarHBondContact O-CB 3.48Å; Y433-K437 PolarHBondContact O-N 3.48Å; R434-K437 PolarHBondContact O-N 2.98Å; F435-K437 VanDerWaalsContact C-N 3.32Å; F435-K437 PolarHBondContact O-N 2.95Å; K437-T440 PolarHBondContact O-N 3.29Å; K437-F441 PolarHBondContact O-N 3.22Å
438	E	93.1	Very high	86.8	Confident	25 Å²	25	55.9 Å²	55.9	12%	0.117	26%	0.263	C	S	.	.	H	α-helix	trans	-70.8	-36.4	178.8	-67.3	-54.4	138.8	0	0	112.5	R434 F435 T440 F441 L442 R534	R434-E438 PolarHBondContact O-N 3.42Å; R434-E438 VanDerWaalsContact O-N 3.1Å; F435-E438 PolarHBondContact O-N 3.47Å; E438-T440 PolarHBondContact O-N 2.91Å; E438-F441 PolarHBondContact O-N 3.22Å; E438-L442 WeakPolarHBondContact O-CB 3.42Å; E438-L442 VanDerWaalsContact O-CG 3.24Å; E438-L442 WeakPolarHBondContact O-CG 3.47Å; E438-L442 PolarHBondContact O-N 3.45Å; E438-R534 IonicContact OE1-CZ 3.82Å; E438-R534 IonicContact OE1-NH1 2.82Å; E438-R534 PolarHBondContact OE1-NH1 2.96Å; E438-R534 VanDerWaalsContact OE2-CD 3.27Å; E438-R534 WeakPolarHBondContact OE2-CD 3.46Å; E438-R534 VanDerWaalsContact OE2-CG 3.24Å; E438-R534 WeakPolarHBondContact OE2-CG 3.47Å; E438-R534 IonicContact OE2-CZ 3.56Å; E438-R534 IonicContact OE2-NE 3.78Å; E438-R534 IonicContact OE2-NH1 2.68Å; E438-R534 PolarHBondContact OE2-NH1 2.87Å
439	F	93.1	Very high	86.2	Confident	1 Å²	1	56.5 Å²	56.5	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-55.2	-48.4	169.1	165.3	-120.7	0	0	0	112.1	F435 M436 L442 M443 F538 L1087 T1090 L1091	F435-F439 VanDerWaalsContact O-CB 3.31Å; F435-F439 WeakPolarHBondContact O-CB 3.49Å; F435-F439 PolarHBondContact O-N 3.47Å; M436-F439 HydrophobicContact CE-CD1 3.72Å; M436-F439 HydrophobicContact CE-CE1 4.08Å; M436-F439 HydrophobicContact SD-CD1 4.03Å; F439-L442 PolarHBondContact O-N 3.3Å; F439-M443 HydrophobicContact CD2-CG 3.83Å; F439-M443 HydrophobicContact CE2-CG 3.29Å; F439-M443 HydrophobicContact CE2-SD 4.07Å; F439-M443 HydrophobicContact CZ-CG 3.77Å; F439-M443 WeakPolarHBondContact O-CB 3.46Å; F439-M443 PolarHBondContact O-N 3.47Å; F439-F538 HydrophobicContact CB-CD2 3.96Å; F439-F538 HydrophobicContact CB-CE2 3.63Å; F439-F538 HydrophobicContact CD2-CD2 4.41Å; F439-F538 AromaticContact CD2-CE2 3.4Å; F439-F538 HydrophobicContact CD2-CE2 3.4Å; F439-F538 VanDerWaalsContact CD2-CE2 3.4Å; F439-F538 AromaticContact CD2-CZ 3.51Å; F439-F538 HydrophobicContact CD2-CZ 3.51Å; F439-F538 HydrophobicContact CE2-CE2 4.39Å; F439-F538 HydrophobicContact CE2-CZ 4.16Å; F439-F538 AromaticContact CG-CE2 3.84Å; F439-F538 HydrophobicContact CG-CE2 3.84Å; F439-F538 HydrophobicContact CG-CZ 4.39Å; F439-L1087 HydrophobicContact CE2-CB 4.42Å; F439-L1087 HydrophobicContact CE2-CD2 3.9Å; F439-L1087 HydrophobicContact CZ-CD2 4.44Å; F439-L1087 WeakPolarHBondContact CZ-O 3.23Å; F439-T1090 HydrophobicContact CE1-CG2 3.85Å; F439-T1090 HydrophobicContact CZ-CG2 4.35Å; F439-L1091 HydrophobicContact CE1-CB 4.18Å; F439-L1091 HydrophobicContact CE1-CD1 4.46Å; F439-L1091 HydrophobicContact CZ-CB 4.17Å
440	T	92.4	Very high	86.2	Confident	18 Å²	18	56.6 Å²	56.6	11%	0.11	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-46.9	178.2	-61.1	0	0	0	0	111.1	M436 K437 E438 L442 M443 E444 L1091 Y1094	M436-T440 WeakPolarHBondContact O-CB 3.37Å; M436-T440 PolarHBondContact O-N 2.92Å; M436-T440 PolarHBondContact O-OG1 3.08Å; K437-T440 PolarHBondContact O-N 3.29Å; E438-T440 PolarHBondContact O-N 2.91Å; T440-L442 PolarHBondContact O-N 3.18Å; T440-M443 PolarHBondContact O-N 3.03Å; T440-E444 WeakPolarHBondContact O-CG 3.46Å; T440-E444 PolarHBondContact O-N 3.18Å; T440-L1091 HydrophobicContact CG2-CD1 3.96Å; T440-Y1094 HydrophobicContact CG2-CD1 4.43Å; T440-Y1094 HydrophobicContact CG2-CE1 4.46Å; T440-Y1094 WeakPolarHBondContact OG1-CD1 3.13Å; T440-Y1094 VanDerWaalsContact OG1-CE1 3.28Å; T440-Y1094 WeakPolarHBondContact OG1-CE1 3.5Å
441	F	92.6	Very high	86.3	Confident	66 Å²	66	51.4 Å²	51.4	29%	0.289	24%	0.243	S	C	.	.	H	α-helix	trans	-59.8	-42.1	176.2	176	-94.5	0	0	0	112.5	K437 E438 N445 M531 R534	K437-F441 PolarHBondContact O-N 3.22Å; E438-F441 PolarHBondContact O-N 3.22Å; F441-N445 WeakPolarHBondContact CD2-ND2 3.29Å; F441-N445 VanDerWaalsContact CE2-ND2 3.33Å; F441-N445 WeakPolarHBondContact CE2-ND2 3.24Å; F441-N445 WeakPolarHBondContact CZ-ND2 3.46Å; F441-N445 WeakPolarHBondContact O-CB 3.36Å; F441-N445 PolarHBondContact O-N 2.94Å; F441-N445 VanDerWaalsContact O-N 3.15Å; F441-N445 PolarHBondContact O-ND2 3.27Å; F441-M531 HydrophobicContact CE1-CE 3.87Å; F441-M531 HydrophobicContact CE1-SD 3.68Å; F441-M531 HydrophobicContact CZ-CE 4.38Å; F441-M531 HydrophobicContact CZ-SD 3.8Å; F441-R534 VanDerWaalsContact CE1-CD 3.47Å
442	L	91.5	Very high	86.5	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-68.2	-44.3	177.1	-71.7	168.8	0	0	0	111.7	E438 F439 T440 E444 N445 A446 L452 R534 L535 F538	E438-L442 WeakPolarHBondContact O-CB 3.42Å; E438-L442 VanDerWaalsContact O-CG 3.24Å; E438-L442 WeakPolarHBondContact O-CG 3.47Å; E438-L442 PolarHBondContact O-N 3.45Å; F439-L442 PolarHBondContact O-N 3.3Å; T440-L442 PolarHBondContact O-N 3.18Å; L442-E444 PolarHBondContact O-N 2.91Å; L442-N445 PolarHBondContact O-N 3.21Å; L442-A446 WeakPolarHBondContact O-CB 3.2Å; L442-A446 PolarHBondContact O-N 2.39Å; L442-L452 HydrophobicContact CB-CD2 4.06Å; L442-R534 HydrophobicContact CD2-CB 4.41Å; L442-L535 HydrophobicContact CD1-CD1 4.1Å; L442-L535 HydrophobicContact CD2-CB 4.09Å; L442-L535 HydrophobicContact CD2-CD1 4.34Å; L442-F538 HydrophobicContact CD1-CB 3.43Å; L442-F538 VanDerWaalsContact CD1-CB 3.43Å; L442-F538 HydrophobicContact CD1-CD1 3.94Å; L442-F538 HydrophobicContact CD1-CD2 4.44Å; L442-F538 HydrophobicContact CD1-CG 3.7Å
443	M	90.2	Very high	86.7	Confident	7 Å²	7	50.8 Å²	50.8	3%	0.034	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-47.7	175.7	-83.2	-67.3	-76.7	0	0	111.7	F439 T440 N445 S447 L452 L1087 L1091	F439-M443 HydrophobicContact CD2-CG 3.83Å; F439-M443 HydrophobicContact CE2-CG 3.29Å; F439-M443 HydrophobicContact CE2-SD 4.07Å; F439-M443 HydrophobicContact CZ-CG 3.77Å; F439-M443 WeakPolarHBondContact O-CB 3.46Å; F439-M443 PolarHBondContact O-N 3.47Å; T440-M443 PolarHBondContact O-N 3.03Å; M443-N445 PolarHBondContact O-N 3.27Å; M443-S447 WeakPolarHBondContact O-CA 3.4Å; M443-S447 WeakPolarHBondContact O-CB 3.13Å; M443-S447 PolarHBondContact O-N 2.66Å; M443-L452 HydrophobicContact CG-CD2 3.93Å; M443-L452 HydrophobicContact SD-CB 4.4Å; M443-L452 HydrophobicContact SD-CD2 3.8Å; M443-L1087 HydrophobicContact CE-CB 3.98Å; M443-L1087 HydrophobicContact SD-CB 4Å; M443-L1087 HydrophobicContact SD-CD1 4.44Å; M443-L1091 HydrophobicContact CB-CD1 4.15Å; M443-L1091 HydrophobicContact CB-CD2 3.96Å; M443-L1091 HydrophobicContact CE-CB 4.49Å; M443-L1091 HydrophobicContact CE-CD2 3.86Å; M443-L1091 HydrophobicContact CG-CD2 4.36Å
444	E	86.9	Confident	86.8	Confident	100 Å²	100	45.8 Å²	45.8	47%	0.467	22%	0.223	S	C	.	.	H	α-helix	trans	-65	-42.5	-178.6	-70	-174.4	154.5	0	0	112.1	T440 L442 S447 K1095	T440-E444 WeakPolarHBondContact O-CG 3.46Å; T440-E444 PolarHBondContact O-N 3.18Å; L442-E444 PolarHBondContact O-N 2.91Å; E444-S447 PolarHBondContact O-OG 2.92Å; E444-K1095 VanDerWaalsContact OE1-CE 3.3Å; E444-K1095 WeakPolarHBondContact OE1-CE 3.3Å; E444-K1095 IonicContact OE1-NZ 2.65Å; E444-K1095 PolarHBondContact OE1-NZ 3.24Å
445	N	83.6	Confident	87	Confident	68 Å²	68	42.2 Å²	42.2	36%	0.364	21%	0.209	S	C	.	.	H	α-helix	trans	-72.7	-35.7	178.5	-76.8	-71.8	0	0	0	114	F441 L442 M443 M531	F441-N445 WeakPolarHBondContact CD2-ND2 3.29Å; F441-N445 VanDerWaalsContact CE2-ND2 3.33Å; F441-N445 WeakPolarHBondContact CE2-ND2 3.24Å; F441-N445 WeakPolarHBondContact CZ-ND2 3.46Å; F441-N445 WeakPolarHBondContact O-CB 3.36Å; F441-N445 PolarHBondContact O-N 2.94Å; F441-N445 VanDerWaalsContact O-N 3.15Å; F441-N445 PolarHBondContact O-ND2 3.27Å; L442-N445 PolarHBondContact O-N 3.21Å; M443-N445 PolarHBondContact O-N 3.27Å; N445-M531 HydrophobicContact CB-CE 4.18Å
446	A	75.6	Confident	87.1	Confident	6 Å²	6	42.1 Å²	42.1	5%	0.05	21%	0.209	C	C	.	.	H	α-helix	trans	-92.6	-11.6	-176.6	0	0	0	0	0	114.4	L442 K448 N449 F451 L452 W1057	L442-A446 WeakPolarHBondContact O-CB 3.2Å; L442-A446 PolarHBondContact O-N 2.39Å; A446-K448 PolarHBondContact O-N 2.95Å; A446-K448 VanDerWaalsContact O-N 3.11Å; A446-N449 PolarHBondContact O-N 3.18Å; A446-F451 HydrophobicContact CB-CB 4.37Å; A446-F451 HydrophobicContact CB-CD1 4.08Å; A446-L452 HydrophobicContact CB-CB 4.22Å; A446-W1057 HydrophobicContact CB-CE3 4.26Å; A446-W1057 HydrophobicContact CB-CZ3 3.74Å
447	S	64.3	Low	87.1	Confident	65 Å²	65	42.3 Å²	42.3	46%	0.455	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-43.9	-44.9	-176.9	52.8	0	0	0	0	114.4	M443 E444 N449 Q450	M443-S447 WeakPolarHBondContact O-CA 3.4Å; M443-S447 WeakPolarHBondContact O-CB 3.13Å; M443-S447 PolarHBondContact O-N 2.66Å; E444-S447 PolarHBondContact O-OG 2.92Å; S447-N449 PolarHBondContact O-N 3.43Å; S447-Q450 PolarHBondContact O-N 3.1Å
448	K	63.8	Low	87.2	Confident	184 Å²	184	37.1 Å²	37.1	80%	0.8	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-59.4	-22.6	-166.2	-63.3	179.6	-178.8	175.7	0	115.2	A446	A446-K448 PolarHBondContact O-N 2.95Å; A446-K448 VanDerWaalsContact O-N 3.11Å
449	N	67.4	Low	87.4	Confident	97 Å²	97	36 Å²	36	52%	0.519	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-126.8	15.9	-174.9	-66.4	-29.3	0	0	0	113.6	A446 S447 F451 W1057	A446-N449 PolarHBondContact O-N 3.18Å; S447-N449 PolarHBondContact O-N 3.43Å; N449-F451 PolarHBondContact O-N 2.75Å; N449-W1057 HydrophobicContact CB-CB 4.09Å; N449-W1057 WeakPolarHBondContact ND2-CB 3.41Å
450	Q	84.9	Confident	87.5	Confident	108 Å²	108	35.9 Å²	35.9	51%	0.505	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	21.4	-172.5	-61.9	-177	-23.5	0	0	114.7	S447 L452 P453 A454 V1079	S447-Q450 PolarHBondContact O-N 3.1Å; Q450-L452 PolarHBondContact O-N 3.23Å; Q450-P453 WeakPolarHBondContact O-CD 3.28Å; Q450-A454 WeakPolarHBondContact O-CB 3.04Å; Q450-A454 PolarHBondContact O-N 3.41Å; Q450-V1079 HydrophobicContact CB-CG2 4.33Å
451	F	91.6	Very high	87.5	Confident	4 Å²	4	36.2 Å²	36.2	2%	0.018	18%	0.184	C	C	.	.	H	α-helix	trans	-62.3	-42.7	-170.2	171.4	-96.8	0	0	0	113.3	A446 N449 A454 L455 L535 A1052 D1053 M1054 W1057 V1059	A446-F451 HydrophobicContact CB-CB 4.37Å; A446-F451 HydrophobicContact CB-CD1 4.08Å; N449-F451 PolarHBondContact O-N 2.75Å; F451-A454 WeakPolarHBondContact O-CB 3.45Å; F451-A454 PolarHBondContact O-N 3.39Å; F451-L455 HydrophobicContact CE1-CD2 4.07Å; F451-L455 HydrophobicContact CZ-CD2 4.2Å; F451-L455 WeakPolarHBondContact O-CB 3.36Å; F451-L455 PolarHBondContact O-N 3.14Å; F451-L535 HydrophobicContact CE1-CD2 3.89Å; F451-L535 HydrophobicContact CZ-CD2 4.3Å; F451-A1052 HydrophobicContact CE2-CB 4.47Å; F451-A1052 HydrophobicContact CZ-CB 4.09Å; F451-D1053 WeakPolarHBondContact CE2-O 3.41Å; F451-M1054 HydrophobicContact CE1-CG 4.37Å; F451-M1054 HydrophobicContact CZ-CG 4.03Å; F451-W1057 HydrophobicContact CB-CB 4.39Å; F451-W1057 HydrophobicContact CB-CE3 4.1Å; F451-W1057 AromaticContact CD1-CE3 3.79Å; F451-W1057 HydrophobicContact CD1-CE3 3.79Å; F451-W1057 HydrophobicContact CD1-CZ3 4.12Å; F451-W1057 VanDerWaalsContact CD2-C 3.41Å; F451-W1057 HydrophobicContact CD2-CB 4.28Å; F451-W1057 HydrophobicContact CD2-CE3 4.41Å; F451-W1057 HydrophobicContact CE1-CE3 4.27Å; F451-W1057 HydrophobicContact CE1-CZ3 4.46Å; F451-W1057 HydrophobicContact CG-CB 4.5Å; F451-W1057 AromaticContact CG-CE3 3.85Å; F451-W1057 HydrophobicContact CG-CE3 3.85Å; F451-V1059 HydrophobicContact CD2-CG2 3.76Å; F451-V1059 HydrophobicContact CE2-CG2 3.74Å
452	L	92.6	Very high	87.6	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-70	-44.8	-179	-159.2	68.1	0	0	0	112.2	L442 M443 A446 Q450 A454 L455 I456 L535 F538 L1087	L442-L452 HydrophobicContact CB-CD2 4.06Å; M443-L452 HydrophobicContact CG-CD2 3.93Å; M443-L452 HydrophobicContact SD-CB 4.4Å; M443-L452 HydrophobicContact SD-CD2 3.8Å; A446-L452 HydrophobicContact CB-CB 4.22Å; Q450-L452 PolarHBondContact O-N 3.23Å; L452-A454 PolarHBondContact O-N 3.2Å; L452-L455 PolarHBondContact O-N 3.2Å; L452-I456 WeakPolarHBondContact O-CG1 3.49Å; L452-I456 PolarHBondContact O-N 3.04Å; L452-L535 HydrophobicContact CD1-CD1 3.62Å; L452-F538 HydrophobicContact CD1-CD1 4.12Å; L452-F538 HydrophobicContact CD1-CE1 3.82Å; L452-F538 HydrophobicContact CD2-CE1 3.8Å; L452-F538 HydrophobicContact CD2-CZ 4.17Å; L452-F538 HydrophobicContact CG-CE1 4.01Å; L452-L1087 HydrophobicContact CG-CD1 4.48Å
453	P	93.4	Very high	87.7	Confident	6 Å²	6	34 Å²	34	4%	0.039	18%	0.175	C	C	.	.	H	α-helix	trans	-52.5	-45.5	165.4	-29.9	34.8	0	0	0	114.4	Q450 L455 T457 V1079 L1087	Q450-P453 WeakPolarHBondContact O-CD 3.28Å; P453-L455 VanDerWaalsContact C-N 3.33Å; P453-L455 PolarHBondContact O-N 2.89Å; P453-T457 WeakPolarHBondContact O-CB 3.44Å; P453-T457 PolarHBondContact O-N 3.49Å; P453-T457 PolarHBondContact O-OG1 3.46Å; P453-V1079 HydrophobicContact CB-CG1 3.66Å; P453-L1087 HydrophobicContact CB-CD1 4.45Å; P453-L1087 HydrophobicContact CG-CD1 4.1Å
454	A	93.6	Very high	87.8	Confident	11 Å²	11	34.2 Å²	34.2	9%	0.091	18%	0.176	C	C	.	.	H	α-helix	trans	-60.7	-42.4	177.2	0	0	0	0	0	112.2	Q450 F451 L452 A458 V1059 V1079	Q450-A454 WeakPolarHBondContact O-CB 3.04Å; Q450-A454 PolarHBondContact O-N 3.41Å; F451-A454 WeakPolarHBondContact O-CB 3.45Å; F451-A454 PolarHBondContact O-N 3.39Å; L452-A454 PolarHBondContact O-N 3.2Å; A454-A458 PolarHBondContact O-N 3.37Å; A454-V1059 HydrophobicContact CB-CB 4.31Å; A454-V1059 HydrophobicContact CB-CG2 3.96Å; A454-V1079 HydrophobicContact CB-CG2 3.93Å
455	L	95.1	Very high	88	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-70.6	-45.2	-178.7	-178.6	53.7	0	0	0	112.5	F451 L452 P453 T457 A458 V459 L535 L539 I1050 A1052 V1059	F451-L455 HydrophobicContact CE1-CD2 4.07Å; F451-L455 HydrophobicContact CZ-CD2 4.2Å; F451-L455 WeakPolarHBondContact O-CB 3.36Å; F451-L455 PolarHBondContact O-N 3.14Å; L452-L455 PolarHBondContact O-N 3.2Å; P453-L455 VanDerWaalsContact C-N 3.33Å; P453-L455 PolarHBondContact O-N 2.89Å; L455-T457 VanDerWaalsContact C-N 3.31Å; L455-T457 PolarHBondContact O-N 3.42Å; L455-A458 WeakPolarHBondContact O-CB 3.44Å; L455-A458 PolarHBondContact O-N 3.16Å; L455-A458 VanDerWaalsContact O-N 3.17Å; L455-V459 HydrophobicContact CD1-CG2 4.32Å; L455-V459 WeakPolarHBondContact O-CG2 3.22Å; L455-V459 PolarHBondContact O-N 3.33Å; L455-L535 HydrophobicContact CD2-CD1 3.99Å; L455-L535 HydrophobicContact CD2-CD2 3.78Å; L455-L535 HydrophobicContact CD2-CG 4.24Å; L455-L539 HydrophobicContact CD2-CD1 4.34Å; L455-L539 HydrophobicContact CD2-CD2 4.37Å; L455-L539 HydrophobicContact CG-CD2 4.31Å; L455-I1050 HydrophobicContact CD1-CG2 4.02Å; L455-A1052 HydrophobicContact CD1-CB 3.65Å; L455-A1052 HydrophobicContact CD2-CB 3.99Å; L455-A1052 HydrophobicContact CG-CB 4.46Å; L455-V1059 HydrophobicContact CB-CG2 3.95Å; L455-V1059 HydrophobicContact CD1-CG1 4.23Å; L455-V1059 HydrophobicContact CD1-CG2 4.49Å
456	I	95.6	Very high	88.5	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.6	-34.4	176.2	-62.3	-53.2	0	0	0	110.7	L452 A458 V459 L460 F538 L539 F542 V1083 L1087	L452-I456 WeakPolarHBondContact O-CG1 3.49Å; L452-I456 PolarHBondContact O-N 3.04Å; I456-A458 PolarHBondContact O-N 3.12Å; I456-V459 PolarHBondContact O-N 2.96Å; I456-L460 HydrophobicContact CG2-CD1 3.63Å; I456-L460 HydrophobicContact CG2-CG 3.96Å; I456-L460 WeakPolarHBondContact O-CB 3.49Å; I456-L460 VanDerWaalsContact O-CG 3.3Å; I456-L460 WeakPolarHBondContact O-CG 3.03Å; I456-L460 PolarHBondContact O-N 3.07Å; I456-F538 HydrophobicContact CD1-CE1 3.89Å; I456-F538 HydrophobicContact CG1-CE1 4.19Å; I456-L539 HydrophobicContact CD1-CD2 3.8Å; I456-F542 HydrophobicContact CD1-CD2 3.6Å; I456-F542 HydrophobicContact CD1-CE2 3.69Å; I456-F542 HydrophobicContact CD1-CG 4.09Å; I456-F542 HydrophobicContact CD1-CZ 4.23Å; I456-F542 HydrophobicContact CG1-CE2 4.4Å; I456-F542 HydrophobicContact CG2-CD1 4.31Å; I456-F542 HydrophobicContact CG2-CE1 4.09Å; I456-F542 HydrophobicContact CG2-CZ 4.36Å; I456-V1083 HydrophobicContact CB-CG1 3.9Å; I456-V1083 HydrophobicContact CG2-CG1 3.69Å; I456-L1087 HydrophobicContact CB-CD1 4.32Å; I456-L1087 HydrophobicContact CG1-CD1 4.18Å
457	T	95.2	Very high	89.2	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-59.1	-47.1	169.4	-52	0	0	0	0	110.7	P453 L455 V459 T461 L1078 S1080	P453-T457 WeakPolarHBondContact O-CB 3.44Å; P453-T457 PolarHBondContact O-N 3.49Å; P453-T457 PolarHBondContact O-OG1 3.46Å; L455-T457 VanDerWaalsContact C-N 3.31Å; L455-T457 PolarHBondContact O-N 3.42Å; T457-V459 PolarHBondContact O-N 2.79Å; T457-T461 VanDerWaalsContact O-CB 3.28Å; T457-T461 WeakPolarHBondContact O-CB 3.41Å; T457-T461 PolarHBondContact O-N 3.45Å; T457-T461 VanDerWaalsContact O-N 3.12Å; T457-T461 PolarHBondContact O-OG1 2.93Å; T457-L1078 WeakPolarHBondContact CG2-O 3.48Å; T457-S1080 WeakPolarHBondContact OG1-CB 3.22Å; T457-S1080 PolarHBondContact OG1-N 3.46Å; T457-S1080 VanDerWaalsContact OG1-N 3.16Å
458	A	95	Very high	90.4	Very high	2 Å²	2	26.1 Å²	26.1	2%	0.017	13%	0.134	C	C	.	.	H	α-helix	trans	-60.6	-45	178.3	0	0	0	0	0	112.4	A454 L455 I456 N462 I1050 V1059 V1061 V1077	A454-A458 PolarHBondContact O-N 3.37Å; L455-A458 WeakPolarHBondContact O-CB 3.44Å; L455-A458 PolarHBondContact O-N 3.16Å; L455-A458 VanDerWaalsContact O-N 3.17Å; I456-A458 PolarHBondContact O-N 3.12Å; A458-N462 PolarHBondContact O-N 3.1Å; A458-N462 PolarHBondContact O-ND2 3.13Å; A458-I1050 HydrophobicContact CB-CD1 4.23Å; A458-I1050 HydrophobicContact CB-CG1 4.25Å; A458-I1050 HydrophobicContact CB-CG2 3.76Å; A458-I1050 WeakPolarHBondContact O-CD1 3.06Å; A458-V1059 HydrophobicContact CB-CG1 3.94Å; A458-V1061 HydrophobicContact CB-CG2 4.49Å; A458-V1077 HydrophobicContact CB-CG1 4.09Å; A458-V1077 HydrophobicContact CB-CG2 4Å
459	V	96.3	Very high	91.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.4	-54.4	-179.2	169.7	0	0	0	0	110.8	L455 I456 T457 T461 N462 H463 T522 L539 F542 I543 I1050	L455-V459 HydrophobicContact CD1-CG2 4.32Å; L455-V459 WeakPolarHBondContact O-CG2 3.22Å; L455-V459 PolarHBondContact O-N 3.33Å; I456-V459 PolarHBondContact O-N 2.96Å; T457-V459 PolarHBondContact O-N 2.79Å; V459-T461 PolarHBondContact O-N 3.27Å; V459-T461 VanDerWaalsContact O-N 3.16Å; V459-N462 PolarHBondContact O-N 2.99Å; V459-N462 VanDerWaalsContact O-N 3.09Å; V459-H463 HydrophobicContact CG1-CB 4.31Å; V459-H463 WeakPolarHBondContact O-CB 3.27Å; V459-H463 PolarHBondContact O-N 2.8Å; V459-T522 HydrophobicContact CG2-CG2 4.44Å; V459-L539 HydrophobicContact CG2-CD2 4.11Å; V459-F542 HydrophobicContact CG1-CB 3.96Å; V459-I543 HydrophobicContact CG1-CG1 4.02Å; V459-I1050 HydrophobicContact CG2-CD1 4Å
460	L	95.4	Very high	92.4	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.5	-26.5	-178.7	-66	175.2	0	0	0	113.4	I456 W466 F542 V1083 L1111 L1114 L1149	I456-L460 HydrophobicContact CG2-CD1 3.63Å; I456-L460 HydrophobicContact CG2-CG 3.96Å; I456-L460 WeakPolarHBondContact O-CB 3.49Å; I456-L460 VanDerWaalsContact O-CG 3.3Å; I456-L460 WeakPolarHBondContact O-CG 3.03Å; I456-L460 PolarHBondContact O-N 3.07Å; L460-W466 HydrophobicContact CB-CZ2 4.25Å; L460-W466 HydrophobicContact CD2-CD2 3.91Å; L460-W466 HydrophobicContact CD2-CG 3.83Å; L460-W466 HydrophobicContact CD2-CZ2 4.31Å; L460-W466 PolarHBondContact O-NE1 2.93Å; L460-F542 HydrophobicContact CD2-CD1 4.02Å; L460-V1083 HydrophobicContact CD1-CG2 4.07Å; L460-L1111 HydrophobicContact CD1-CD2 3.89Å; L460-L1111 HydrophobicContact CD2-CD2 4.12Å; L460-L1114 HydrophobicContact CD1-CD1 4.47Å; L460-L1149 HydrophobicContact CB-CD1 3.67Å
461	T	93.4	Very high	92	Very high	25 Å²	25	12.2 Å²	12.2	15%	0.153	7%	0.074	C	C	.	.	H	α-helix	trans	-76.7	-23.7	178.2	-56.6	0	0	0	0	113.3	T457 V459 A1152	T457-T461 VanDerWaalsContact O-CB 3.28Å; T457-T461 WeakPolarHBondContact O-CB 3.41Å; T457-T461 PolarHBondContact O-N 3.45Å; T457-T461 VanDerWaalsContact O-N 3.12Å; T457-T461 PolarHBondContact O-OG1 2.93Å; V459-T461 PolarHBondContact O-N 3.27Å; V459-T461 VanDerWaalsContact O-N 3.16Å; T461-A1152 HydrophobicContact CG2-CB 3.94Å; T461-A1152 VanDerWaalsContact O-CB 3.23Å; T461-A1152 WeakPolarHBondContact O-CB 3.39Å
462	N	93.1	Very high	91	Very high	21 Å²	21	13.9 Å²	13.9	11%	0.112	9%	0.085	C	C	.	.	H	α-helix	trans	-119	-37.1	-172.9	-63.2	-86.4	0	0	0	113.3	A458 V459 L464 A520 I1050	A458-N462 PolarHBondContact O-N 3.1Å; A458-N462 PolarHBondContact O-ND2 3.13Å; V459-N462 PolarHBondContact O-N 2.99Å; V459-N462 VanDerWaalsContact O-N 3.09Å; N462-L464 PolarHBondContact O-N 2.78Å; N462-A520 HydrophobicContact CB-CB 3.75Å; N462-I1050 HydrophobicContact CB-CD1 4.31Å
463	H	94.8	Very high	88.9	Confident	4 Å²	4	21.6 Å²	21.6	2%	0.019	13%	0.127	C	C	.	.			trans	-86.7	75.3	175.6	-73.2	-71.3	0	0	0	110	V459 A465 L509 A520 T522	V459-H463 HydrophobicContact CG1-CB 4.31Å; V459-H463 WeakPolarHBondContact O-CB 3.27Å; V459-H463 PolarHBondContact O-N 2.8Å; H463-A465 PolarHBondContact O-N 3.48Å; H463-A465 VanDerWaalsContact O-N 3.14Å; H463-L509 PolarHBondContact ND1-O 2.88Å; H463-A520 PolarHBondContact CE1-O 3.26Å; H463-A520 VanDerWaalsContact CE1-O 3.27Å; H463-T522 PolarHBondContact NE2-OG1 3.08Å
464	L	92.1	Very high	86.6	Confident	10 Å²	10	25.1 Å²	25.1	5%	0.052	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-0.6	-166.8	-66.2	170.1	0	0	0	115.7	N462 W466 V467 A1152 T1156	N462-L464 PolarHBondContact O-N 2.78Å; L464-W466 PolarHBondContact O-N 3.44Å; L464-V467 HydrophobicContact CD2-CG2 4.47Å; L464-V467 WeakPolarHBondContact O-CB 3.42Å; L464-V467 WeakPolarHBondContact O-CG2 3.45Å; L464-V467 PolarHBondContact O-N 3.12Å; L464-A1152 HydrophobicContact CD2-CB 4.05Å; L464-T1156 HydrophobicContact CB-CG2 3.96Å; L464-T1156 HydrophobicContact CD1-CG2 3.93Å; L464-T1156 HydrophobicContact CD2-CG2 4.47Å; L464-T1156 HydrophobicContact CG-CG2 4.34Å
465	A	90.9	Very high	84	Confident	6 Å²	6	28.1 Å²	28.1	5%	0.05	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-9.6	-179.5	0	0	0	0	0	115.4	H463 V467 D508 I513 R544	H463-A465 PolarHBondContact O-N 3.48Å; H463-A465 VanDerWaalsContact O-N 3.14Å; A465-V467 VanDerWaalsContact C-N 3.29Å; A465-D508 HydrophobicContact CB-CB 3.87Å; A465-D508 VanDerWaalsContact CB-O 3.22Å; A465-D508 WeakPolarHBondContact CB-O 3.49Å; A465-I513 HydrophobicContact CB-CD1 3.75Å; A465-R544 VanDerWaalsContact CB-O 3.27Å; A465-R544 WeakPolarHBondContact CB-O 3.22Å
466	W	93.4	Very high	81.2	Confident	1 Å²	1	33.1 Å²	33.1	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-71.2	-25.5	167.7	69.7	-92	0	0	0	112.7	L460 L464 T469 V470 R544 L1111 L1114 L1149 V1153	L460-W466 HydrophobicContact CB-CZ2 4.25Å; L460-W466 HydrophobicContact CD2-CD2 3.91Å; L460-W466 HydrophobicContact CD2-CG 3.83Å; L460-W466 HydrophobicContact CD2-CZ2 4.31Å; L460-W466 PolarHBondContact O-NE1 2.93Å; L464-W466 PolarHBondContact O-N 3.44Å; W466-T469 PolarHBondContact O-N 3.31Å; W466-T469 VanDerWaalsContact O-N 3.16Å; W466-T469 PolarHBondContact O-OG1 3.35Å; W466-V470 HydrophobicContact CE3-CG1 4.45Å; W466-V470 HydrophobicContact CE3-CG2 3.79Å; W466-V470 HydrophobicContact CZ3-CG2 3.8Å; W466-V470 PolarHBondContact O-N 3.35Å; W466-R544 HydrophobicContact CB-CG 4.38Å; W466-L1111 HydrophobicContact CE3-CB 4.19Å; W466-L1111 HydrophobicContact CE3-CD2 4.4Å; W466-L1111 HydrophobicContact CZ3-CB 4.01Å; W466-L1111 HydrophobicContact CZ3-CD2 4.32Å; W466-L1111 WeakPolarHBondContact CZ3-O 3.42Å; W466-L1114 HydrophobicContact CH2-CB 4.09Å; W466-L1114 HydrophobicContact CH2-CD1 4.38Å; W466-L1149 HydrophobicContact CZ2-CD1 4.49Å; W466-V1153 HydrophobicContact CH2-CG1 4.42Å; W466-V1153 HydrophobicContact CH2-CG2 3.77Å; W466-V1153 HydrophobicContact CZ2-CG2 3.39Å
467	V	91.5	Very high	78.5	Confident	0 Å²	0	37 Å²	37	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-51.2	-173.3	-175.8	0	0	0	0	111.7	L464 A465 T469 V470 M471 Y1115 V1153	L464-V467 HydrophobicContact CD2-CG2 4.47Å; L464-V467 WeakPolarHBondContact O-CB 3.42Å; L464-V467 WeakPolarHBondContact O-CG2 3.45Å; L464-V467 PolarHBondContact O-N 3.12Å; A465-V467 VanDerWaalsContact C-N 3.29Å; V467-T469 PolarHBondContact O-N 3.01Å; V467-V470 WeakPolarHBondContact O-CG2 3.27Å; V467-V470 PolarHBondContact O-N 2.86Å; V467-M471 WeakPolarHBondContact O-CG 3.42Å; V467-M471 PolarHBondContact O-N 3.37Å; V467-Y1115 HydrophobicContact CG1-CD2 3.9Å; V467-Y1115 HydrophobicContact CG1-CE2 4.4Å; V467-V1153 HydrophobicContact CG1-CG1 3.83Å; V467-V1153 HydrophobicContact CG2-CB 4.37Å; V467-V1153 HydrophobicContact CG2-CG1 3.81Å; V467-V1153 HydrophobicContact CG2-CG2 4.07Å
468	P	88.2	Confident	76.2	Confident	62 Å²	62	38.9 Å²	38.9	40%	0.403	24%	0.243	S	C	.	.	H	α-helix	trans	-57.4	-32.8	175	-24.7	35.4	0	0	0	113.7	V470 M471 I513	P468-V470 VanDerWaalsContact C-N 3.27Å; P468-V470 PolarHBondContact O-N 2.81Å; P468-M471 PolarHBondContact O-N 3.36Å; P468-I513 HydrophobicContact CG-CD1 4.5Å
469	T	88.1	Confident	73.7	Confident	59 Å²	59	45.6 Å²	45.6	36%	0.362	27%	0.272	S	S	.	.	H	α-helix	trans	-72.6	-14	-177.5	68.8	0	0	0	0	114.7	W418 W466 V467 R544	W418-T469 HydrophobicContact CH2-CG2 4.13Å; W418-T469 HydrophobicContact CZ2-CG2 3.7Å; W466-T469 PolarHBondContact O-N 3.31Å; W466-T469 VanDerWaalsContact O-N 3.16Å; W466-T469 PolarHBondContact O-OG1 3.35Å; V467-T469 PolarHBondContact O-N 3.01Å; T469-R544 WeakPolarHBondContact OG1-CD 3.48Å; T469-R544 PolarHBondContact OG1-NH1 3.18Å
470	V	85.6	Confident	71.4	Confident	8 Å²	8	49.7 Å²	49.7	5%	0.048	29%	0.293	C	S	.	.	H	α-helix	trans	-114.2	2.6	177.9	-55.7	0	0	0	0	113.3	W466 V467 P468 L1111 Q1112	W466-V470 HydrophobicContact CE3-CG1 4.45Å; W466-V470 HydrophobicContact CE3-CG2 3.79Å; W466-V470 HydrophobicContact CZ3-CG2 3.8Å; W466-V470 PolarHBondContact O-N 3.35Å; V467-V470 WeakPolarHBondContact O-CG2 3.27Å; V467-V470 PolarHBondContact O-N 2.86Å; P468-V470 VanDerWaalsContact C-N 3.27Å; P468-V470 PolarHBondContact O-N 2.81Å; V470-L1111 HydrophobicContact CG1-CB 4.01Å; V470-Q1112 HydrophobicContact CB-CB 4.35Å; V470-Q1112 WeakPolarHBondContact O-CG 3.34Å; V470-Q1112 PolarHBondContact O-NE2 2.81Å
471	M	77.8	Confident	68.8	Low	31 Å²	31	55.4 Å²	55.4	15%	0.153	32%	0.318	C	S	.	.	S	Bend	trans	-71.1	135.5	177.6	-77.6	-175.4	58.6	0	0	111.2	V467 P468 I478 Y1115	V467-M471 WeakPolarHBondContact O-CG 3.42Å; V467-M471 PolarHBondContact O-N 3.37Å; P468-M471 PolarHBondContact O-N 3.36Å; M471-I478 HydrophobicContact CE-CD1 4.14Å; M471-I478 HydrophobicContact CE-CG1 3.62Å; M471-I478 HydrophobicContact SD-CD1 3.81Å; M471-I478 HydrophobicContact SD-CG1 3.95Å; M471-Y1115 HydrophobicContact CE-CE2 4.41Å; M471-Y1115 WeakPolarHBondContact CE-OH 3.15Å; M471-Y1115 HydrophobicContact CG-CD1 4.43Å; M471-Y1115 HydrophobicContact CG-CD2 4.21Å; M471-Y1115 HydrophobicContact CG-CE1 4.07Å; M471-Y1115 HydrophobicContact CG-CE2 3.83Å; M471-Y1115 HydrophobicContact SD-CE2 4.07Å
472	P	70.4	Confident	66.3	Low	38 Å²	38	57.8 Å²	57.8	25%	0.247	33%	0.329	C	S	.	.			trans	-72.2	134	-178.9	29.8	-35.9	0	0	0	111.9	G474 Q475 F1116	P472-G474 PolarHBondContact O-N 2.74Å; P472-Q475 PolarHBondContact O-N 3.01Å; P472-F1116 HydrophobicContact CG-CE1 4.01Å; P472-F1116 HydrophobicContact CG-CZ 3.93Å
473	N	48.3	Very low	63.7	Low	165 Å²	165	61.1 Å²	61.1	88%	0.882	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-12.9	-175.8	-58.7	-5.5	0	0	0	115.2	Q475	N473-Q475 VanDerWaalsContact C-N 3.33Å
474	G	44.2	Very low	61.1	Low	80 Å²	80	65.9 Å²	65.9	83%	0.825	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	1.3	179.7	0	0	0	0	0	115.5	P472	P472-G474 PolarHBondContact O-N 2.74Å
475	Q	40.3	Very low	58.6	Low	74 Å²	74	69.6 Å²	69.6	35%	0.346	38%	0.382	S	S	.	.	S	Bend	trans	-103.8	136.6	159.9	-64.2	-165	-113.4	0	0	108.4	P472 N473	P472-Q475 PolarHBondContact O-N 3.01Å; N473-Q475 VanDerWaalsContact C-N 3.33Å
476	P	36.3	Very low	56.1	Low	104 Å²	104	73.8 Å²	73.8	68%	0.675	41%	0.411	S	S	*	.			trans	-56.1	137.5	170.3	25	-33.6	0	0	0	108.7	I478	P476-I478 PolarHBondContact O-N 3.19Å
477	P	37.3	Very low	53.5	Low	83 Å²	83	75.6 Å²	75.6	54%	0.539	42%	0.424	S	S	.	.	S	Bend	trans	-44.7	128	179.9	-30.8	33.9	0	0	0	110.6	K479 L482	P477-K479 PolarHBondContact O-N 3.01Å; P477-L482 HydrophobicContact CB-CD1 3.86Å; P477-L482 HydrophobicContact CB-CG 4.25Å; P477-L482 HydrophobicContact CG-CD1 4Å
478	I	47.6	Very low	51.1	Low	43 Å²	43	84 Å²	84	22%	0.221	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-32.6	130.1	-160.3	-52.2	172.2	0	0	0	110.9	M471 P476 I480 F481 L482 H1157	M471-I478 HydrophobicContact CE-CD1 4.14Å; M471-I478 HydrophobicContact CE-CG1 3.62Å; M471-I478 HydrophobicContact SD-CD1 3.81Å; M471-I478 HydrophobicContact SD-CG1 3.95Å; P476-I478 PolarHBondContact O-N 3.19Å; I478-I480 HydrophobicContact CG2-CB 3.98Å; I478-I480 HydrophobicContact CG2-CD1 4.1Å; I478-I480 HydrophobicContact CG2-CG1 4.02Å; I478-I480 PolarHBondContact O-N 2.73Å; I478-F481 WeakPolarHBondContact O-CA 3.5Å; I478-F481 WeakPolarHBondContact O-CB 3.49Å; I478-F481 PolarHBondContact O-N 3.19Å; I478-L482 PolarHBondContact O-N 2.71Å; I478-H1157 HydrophobicContact CD1-CB 4.23Å
479	K	42.5	Very low	49.2	Very low	144 Å²	144	84.9 Å²	84.9	63%	0.626	47%	0.47	S	S	*	.	H	α-helix	trans	-45.9	-39.2	179.5	-111.3	-169.2	170	-141.4	0	112.8	P477 F481 L482 E483	P477-K479 PolarHBondContact O-N 3.01Å; K479-F481 PolarHBondContact O-N 2.98Å; K479-L482 PolarHBondContact O-N 3.4Å; K479-E483 WeakPolarHBondContact CE-OE1 3.28Å; K479-E483 IonicContact NZ-OE1 2.75Å; K479-E483 PolarHBondContact NZ-OE1 3.29Å; K479-E483 WeakPolarHBondContact O-CA 3.36Å; K479-E483 WeakPolarHBondContact O-CB 3.35Å; K479-E483 PolarHBondContact O-N 3.15Å
480	I	48.2	Very low	47	Very low	85 Å²	85	83.6 Å²	83.6	44%	0.436	46%	0.462	S	S	.	.	H	α-helix	trans	-52.4	-30	174.9	-56.9	170.5	0	0	0	113.8	I478 P1159	I478-I480 HydrophobicContact CG2-CB 3.98Å; I478-I480 HydrophobicContact CG2-CD1 4.1Å; I478-I480 HydrophobicContact CG2-CG1 4.02Å; I478-I480 PolarHBondContact O-N 2.73Å; I480-P1159 HydrophobicContact CD1-CG 3.98Å
481	F	41.8	Very low	45	Very low	120 Å²	120	86.4 Å²	86.4	53%	0.526	48%	0.477	S	S	.	.	H	α-helix	trans	-92.7	-44.1	176.5	-154.8	-88.9	0	0	0	112.9	I478 K479 K484 H485	I478-F481 WeakPolarHBondContact O-CA 3.5Å; I478-F481 WeakPolarHBondContact O-CB 3.49Å; I478-F481 PolarHBondContact O-N 3.19Å; K479-F481 PolarHBondContact O-N 2.98Å; F481-K484 VanDerWaalsContact O-CB 3.26Å; F481-K484 WeakPolarHBondContact O-CB 3.39Å; F481-H485 PolarHBondContact O-CD2 2.73Å; F481-H485 VanDerWaalsContact O-CD2 3.27Å
482	L	40.8	Very low	43.5	Very low	75 Å²	75	91.2 Å²	91.2	39%	0.393	50%	0.501	S	S	.	.	H	α-helix	trans	-83.7	-28.1	-179.2	-92.2	174.8	0	0	0	114.9	P477 I478 K479 K484 H485 S486	P477-L482 HydrophobicContact CB-CD1 3.86Å; P477-L482 HydrophobicContact CB-CG 4.25Å; P477-L482 HydrophobicContact CG-CD1 4Å; I478-L482 PolarHBondContact O-N 2.71Å; K479-L482 PolarHBondContact O-N 3.4Å; L482-K484 PolarHBondContact O-N 2.91Å; L482-H485 CarbonylContact O-C 3.49Å; L482-H485 WeakPolarHBondContact O-CA 3.33Å; L482-H485 PolarHBondContact O-N 2.91Å; L482-S486 WeakPolarHBondContact O-CB 3.32Å; L482-S486 PolarHBondContact O-N 3.08Å; L482-S486 PolarHBondContact O-OG 2.78Å; L482-S486 VanDerWaalsContact O-OG 3.09Å
483	E	37.4	Very low	42.3	Very low	92 Å²	92	93.6 Å²	93.6	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-72.5	-20.7	171.7	-155.7	158.5	-129.4	0	0	110.6	K479 H485	K479-E483 WeakPolarHBondContact CE-OE1 3.28Å; K479-E483 IonicContact NZ-OE1 2.75Å; K479-E483 PolarHBondContact NZ-OE1 3.29Å; K479-E483 WeakPolarHBondContact O-CA 3.36Å; K479-E483 WeakPolarHBondContact O-CB 3.35Å; K479-E483 PolarHBondContact O-N 3.15Å; E483-H485 PolarHBondContact O-N 3.47Å
484	K	41.1	Very low	42.3	Very low	103 Å²	103	87.5 Å²	87.5	45%	0.448	48%	0.484	S	S	.	.	H	α-helix	trans	-68.7	-1.2	159.8	-102	-175.2	177.1	-174.8	0	113.4	F481 L482 V490 E1042	F481-K484 VanDerWaalsContact O-CB 3.26Å; F481-K484 WeakPolarHBondContact O-CB 3.39Å; L482-K484 PolarHBondContact O-N 2.91Å; K484-V490 WeakPolarHBondContact O-CG1 3.38Å; K484-E1042 IonicContact NZ-OE1 2.69Å; K484-E1042 PolarHBondContact NZ-OE1 2.88Å
485	H	39.7	Very low	42.6	Very low	89 Å²	89	91 Å²	91	41%	0.412	48%	0.476	S	S	.	.	H	α-helix	trans	-140.5	-13.1	179	-68.8	-59.7	0	0	0	116.2	F481 L482 E483	F481-H485 PolarHBondContact O-CD2 2.73Å; F481-H485 VanDerWaalsContact O-CD2 3.27Å; L482-H485 CarbonylContact O-C 3.49Å; L482-H485 WeakPolarHBondContact O-CA 3.33Å; L482-H485 PolarHBondContact O-N 2.91Å; E483-H485 PolarHBondContact O-N 3.47Å
486	S	37.8	Very low	42.9	Very low	93 Å²	93	90.7 Å²	90.7	65%	0.65	48%	0.48	S	S	*	.	H	α-helix	trans	-102.1	-5.9	-172.9	63.7	0	0	0	0	116.4	L482	L482-S486 WeakPolarHBondContact O-CB 3.32Å; L482-S486 PolarHBondContact O-N 3.08Å; L482-S486 PolarHBondContact O-OG 2.78Å; L482-S486 VanDerWaalsContact O-OG 3.09Å
487	S	39.2	Very low	43.7	Very low	39 Å²	39	90.4 Å²	90.4	27%	0.273	47%	0.469	S	S	.	.	S	Bend	trans	-96.4	140	177.5	60.5	0	0	0	0	111.5	S489 V490 D491	S487-S489 PolarHBondContact O-N 3.06Å; S487-S489 VanDerWaalsContact O-N 3.09Å; S487-S489 PolarHBondContact OG-OG 3.17Å; S487-V490 CarbonylContact O-C 3.54Å; S487-V490 WeakPolarHBondContact O-CA 3.48Å; S487-V490 PolarHBondContact O-N 3.15Å; S487-V490 WeakPolarHBondContact OG-CG2 3.35Å; S487-D491 PolarHBondContact O-N 3.03Å
488	Q	41	Very low	45.3	Very low	176 Å²	176	91.8 Å²	91.8	82%	0.822	48%	0.478	S	S	*	.	H	α-helix	trans	-54.6	-31	178.4	-95	-180	-11.3	0	0	113.6	V490 M492	Q488-V490 VanDerWaalsContact C-N 3.33Å; Q488-M492 PolarHBondContact O-N 2.53Å
489	S	47	Very low	46.5	Very low	81 Å²	81	96.4 Å²	96.4	57%	0.566	49%	0.494	S	S	*	.	H	α-helix	trans	-67.4	-30.2	173.1	40.8	0	0	0	0	113.7	S487 L493	S487-S489 PolarHBondContact O-N 3.06Å; S487-S489 VanDerWaalsContact O-N 3.09Å; S487-S489 PolarHBondContact OG-OG 3.17Å; S489-L493 WeakPolarHBondContact O-CG 3.38Å; S489-L493 PolarHBondContact O-N 3.02Å
490	V	43.9	Very low	48.4	Very low	32 Å²	32	92.9 Å²	92.9	19%	0.194	48%	0.482	C	S	.	.	H	α-helix	trans	-99.3	-20.1	-178.4	-164.5	0	0	0	0	112.3	K484 S487 Q488 M492 L493 A494	K484-V490 WeakPolarHBondContact O-CG1 3.38Å; S487-V490 CarbonylContact O-C 3.54Å; S487-V490 WeakPolarHBondContact O-CA 3.48Å; S487-V490 PolarHBondContact O-N 3.15Å; S487-V490 WeakPolarHBondContact OG-CG2 3.35Å; Q488-V490 VanDerWaalsContact C-N 3.33Å; V490-M492 VanDerWaalsContact C-N 3.3Å; V490-L493 HydrophobicContact CB-CD1 4.49Å; V490-L493 HydrophobicContact CG1-CB 4.07Å; V490-L493 HydrophobicContact CG1-CD1 4.31Å; V490-L493 HydrophobicContact CG2-CD1 4.16Å; V490-L493 CarbonylContact O-C 3.29Å; V490-L493 WeakPolarHBondContact O-CA 3.47Å; V490-L493 PolarHBondContact O-N 3.48Å; V490-A494 WeakPolarHBondContact O-CB 3.5Å; V490-A494 PolarHBondContact O-N 3.44Å
491	D	43.6	Very low	50.1	Low	68 Å²	68	91.7 Å²	91.7	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-59.4	-43	158.8	166.9	57.8	0	0	0	110.7	S487 L493 A494 K495	S487-D491 PolarHBondContact O-N 3.03Å; D491-L493 VanDerWaalsContact C-N 3.29Å; D491-L493 PolarHBondContact O-N 3.41Å; D491-A494 PolarHBondContact O-N 3.32Å; D491-K495 WeakPolarHBondContact O-CD 3.12Å; D491-K495 WeakPolarHBondContact O-CG 3.4Å; D491-K495 PolarHBondContact O-N 2.97Å; D491-K495 VanDerWaalsContact O-N 3.1Å; D491-K495 WeakPolarHBondContact OD1-CE 3.4Å; D491-K495 IonicContact OD1-NZ 2.56Å; D491-K495 PolarHBondContact OD1-NZ 2.89Å; D491-K495 IonicContact OD2-NZ 2.94Å; D491-K495 PolarHBondContact OD2-NZ 2.68Å
492	M	46.3	Very low	52.1	Low	132 Å²	132	88.2 Å²	88.2	65%	0.65	47%	0.466	S	S	*	.	H	α-helix	trans	-62.7	-32.2	168.7	-71.5	-130.2	-58.8	0	0	113.4	Q488 V490 T496	Q488-M492 PolarHBondContact O-N 2.53Å; V490-M492 VanDerWaalsContact C-N 3.3Å; M492-T496 PolarHBondContact O-N 3.05Å
493	L	44.9	Very low	54.3	Low	88 Å²	88	89 Å²	89	46%	0.461	46%	0.464	S	S	.	.	H	α-helix	trans	-76.7	-33.8	175.7	-71.6	164	0	0	0	112.9	S489 V490 D491 K495 T496 H497	S489-L493 WeakPolarHBondContact O-CG 3.38Å; S489-L493 PolarHBondContact O-N 3.02Å; V490-L493 HydrophobicContact CB-CD1 4.49Å; V490-L493 HydrophobicContact CG1-CB 4.07Å; V490-L493 HydrophobicContact CG1-CD1 4.31Å; V490-L493 HydrophobicContact CG2-CD1 4.16Å; V490-L493 CarbonylContact O-C 3.29Å; V490-L493 WeakPolarHBondContact O-CA 3.47Å; V490-L493 PolarHBondContact O-N 3.48Å; D491-L493 VanDerWaalsContact C-N 3.29Å; D491-L493 PolarHBondContact O-N 3.41Å; L493-K495 PolarHBondContact O-N 3.03Å; L493-T496 WeakPolarHBondContact CA-OG1 3.27Å; L493-T496 CarbonylContact O-C 3.6Å; L493-T496 WeakPolarHBondContact O-CA 3.24Å; L493-T496 PolarHBondContact O-N 3.15Å; L493-T496 PolarHBondContact O-OG1 2.88Å; L493-H497 PolarHBondContact O-N 2.77Å
494	A	47.9	Very low	56.6	Low	37 Å²	37	86 Å²	86	31%	0.306	45%	0.454	S	S	.	.	H	α-helix	trans	-63.1	-33.6	172	0	0	0	0	0	111.1	V490 D491 T496 H497	V490-A494 WeakPolarHBondContact O-CB 3.5Å; V490-A494 PolarHBondContact O-N 3.44Å; D491-A494 PolarHBondContact O-N 3.32Å; A494-T496 PolarHBondContact O-N 3.01Å; A494-H497 CarbonylContact O-C 3.56Å; A494-H497 VanDerWaalsContact O-C 3.27Å; A494-H497 PolarHBondContact O-N 2.77Å
495	K	49.6	Very low	58.9	Low	152 Å²	152	81 Å²	81	66%	0.661	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-9.1	168.5	-70.3	160.1	-176.9	161.7	0	114.1	D491 L493	D491-K495 WeakPolarHBondContact O-CD 3.12Å; D491-K495 WeakPolarHBondContact O-CG 3.4Å; D491-K495 PolarHBondContact O-N 2.97Å; D491-K495 VanDerWaalsContact O-N 3.1Å; D491-K495 WeakPolarHBondContact OD1-CE 3.4Å; D491-K495 IonicContact OD1-NZ 2.56Å; D491-K495 PolarHBondContact OD1-NZ 2.89Å; D491-K495 IonicContact OD2-NZ 2.94Å; D491-K495 PolarHBondContact OD2-NZ 2.68Å; L493-K495 PolarHBondContact O-N 3.03Å
496	T	47.7	Very low	61.3	Low	69 Å²	69	76.8 Å²	76.8	42%	0.423	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-19.4	170.6	61.6	0	0	0	0	114.5	M492 L493 A494	M492-T496 PolarHBondContact O-N 3.05Å; L493-T496 WeakPolarHBondContact CA-OG1 3.27Å; L493-T496 CarbonylContact O-C 3.6Å; L493-T496 WeakPolarHBondContact O-CA 3.24Å; L493-T496 PolarHBondContact O-N 3.15Å; L493-T496 PolarHBondContact O-OG1 2.88Å; A494-T496 PolarHBondContact O-N 3.01Å
497	H	53	Low	63.7	Low	98 Å²	98	72.9 Å²	72.9	45%	0.454	39%	0.388	S	S	.	.	S	Bend	trans	-136.1	84	-179.1	-73	-80.4	0	0	0	108.1	L493 A494	L493-H497 PolarHBondContact O-N 2.77Å; A494-H497 CarbonylContact O-C 3.56Å; A494-H497 VanDerWaalsContact O-C 3.27Å; A494-H497 PolarHBondContact O-N 2.77Å
498	P	69.7	Low	66.2	Low	111 Å²	111	72.4 Å²	72.4	72%	0.721	38%	0.382	S	S	*	.			trans	-63.1	138.6	178.2	26.6	-34.3	0	0	0	110.4	N500	P498-N500 PolarHBondContact O-N 3.11Å
499	Y	72.7	Confident	68.6	Low	141 Å²	141	64 Å²	64	55%	0.553	34%	0.343	S	S	*	.			trans	-62.1	121.8	176.3	174.9	-95.7	0	0	0	110.3	P501 A504	Y499-P501 HydrophobicContact CE1-CB 4.05Å; Y499-A504 HydrophobicContact CE2-CB 4.02Å; Y499-A504 WeakPolarHBondContact OH-CB 3.44Å
500	N	83.2	Confident	70.7	Confident	70 Å²	70	60.8 Å²	60.8	37%	0.374	32%	0.318	S	S	.	.			trans	-107.6	111.2	179.3	-175.4	-37.2	0	0	0	109.9	P498 L502 W503 A504	P498-N500 PolarHBondContact O-N 3.11Å; N500-L502 VanDerWaalsContact C-N 3.35Å; N500-L502 PolarHBondContact O-N 2.98Å; N500-L502 WeakPolarHBondContact OD1-CB 3.5Å; N500-L502 PolarHBondContact OD1-N 3.04Å; N500-L502 VanDerWaalsContact OD1-N 3.08Å; N500-W503 HydrophobicContact CB-CB 4.05Å; N500-W503 HydrophobicContact CB-CG 4.12Å; N500-W503 VanDerWaalsContact ND2-CD1 3.32Å; N500-W503 PolarHBondContact O-N 3.34Å; N500-W503 PolarHBondContact OD1-N 3.34Å; N500-A504 PolarHBondContact O-N 3.42Å
501	P	83.5	Confident	72.9	Confident	59 Å²	59	59.3 Å²	59.3	38%	0.383	31%	0.31	S	S	.	.	H	α-helix	trans	-68.3	-30.4	-174.6	26.7	-34.3	0	0	0	113.4	Y499 A504 Q505 L548	Y499-P501 HydrophobicContact CE1-CB 4.05Å; P501-A504 PolarHBondContact O-N 2.88Å; P501-Q505 WeakPolarHBondContact O-CB 3.39Å; P501-Q505 PolarHBondContact O-N 3Å; P501-L548 HydrophobicContact CB-CD2 3.78Å
502	L	84.9	Confident	74.9	Confident	48 Å²	48	56.9 Å²	56.9	25%	0.251	30%	0.299	S	S	.	.	H	α-helix	trans	-67.2	-38.5	174.3	-73.9	165.8	0	0	0	111.1	N500 Q505 L506 L548 F996	N500-L502 VanDerWaalsContact C-N 3.35Å; N500-L502 PolarHBondContact O-N 2.98Å; N500-L502 WeakPolarHBondContact OD1-CB 3.5Å; N500-L502 PolarHBondContact OD1-N 3.04Å; N500-L502 VanDerWaalsContact OD1-N 3.08Å; L502-Q505 PolarHBondContact O-N 3.12Å; L502-L506 WeakPolarHBondContact O-CB 3.43Å; L502-L506 PolarHBondContact O-N 2.85Å; L502-L548 HydrophobicContact CD2-CD1 3.73Å; L502-L548 HydrophobicContact CG-CD1 4.21Å; L502-F996 HydrophobicContact CB-CD2 4.2Å; L502-F996 HydrophobicContact CB-CE2 3.98Å; L502-F996 HydrophobicContact CD2-CD2 4.23Å; L502-F996 VanDerWaalsContact O-CD2 3.27Å; L502-F996 WeakPolarHBondContact O-CD2 3.43Å; L502-F996 WeakPolarHBondContact O-CE2 3.46Å
503	W	85.9	Confident	76.7	Confident	92 Å²	92	53.2 Å²	53.2	35%	0.348	28%	0.281	S	S	.	.	H	α-helix	trans	-71.8	-34.9	177	-73.9	43.6	0	0	0	111.9	P357 N500 L506 G507 D1041	P357-W503 HydrophobicContact CG-CZ2 3.88Å; N500-W503 HydrophobicContact CB-CB 4.05Å; N500-W503 HydrophobicContact CB-CG 4.12Å; N500-W503 VanDerWaalsContact ND2-CD1 3.32Å; N500-W503 PolarHBondContact O-N 3.34Å; N500-W503 PolarHBondContact OD1-N 3.34Å; W503-L506 PolarHBondContact O-N 3.45Å; W503-G507 PolarHBondContact O-N 2.86Å; W503-D1041 HydrophobicContact CZ3-CB 4.5Å
504	A	85.7	Confident	78.5	Confident	27 Å²	27	49.2 Å²	49.2	22%	0.223	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-48.7	170	0	0	0	0	0	111.3	Y499 N500 P501 L506 G507 D508	Y499-A504 HydrophobicContact CE2-CB 4.02Å; Y499-A504 WeakPolarHBondContact OH-CB 3.44Å; N500-A504 PolarHBondContact O-N 3.42Å; P501-A504 PolarHBondContact O-N 2.88Å; A504-L506 VanDerWaalsContact C-N 3.28Å; A504-L506 PolarHBondContact O-N 3.09Å; A504-G507 WeakPolarHBondContact O-CA 3.31Å; A504-G507 PolarHBondContact O-N 2.86Å; A504-G507 VanDerWaalsContact O-N 3.09Å; A504-D508 PolarHBondContact O-N 2.78Å
505	Q	89.5	Confident	80.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-59.2	-37	175.4	-173	-176.5	77.3	0	0	112.3	P501 L502 D508 L509 C545 S546 L548	P501-Q505 WeakPolarHBondContact O-CB 3.39Å; P501-Q505 PolarHBondContact O-N 3Å; L502-Q505 PolarHBondContact O-N 3.12Å; Q505-D508 PolarHBondContact O-N 3.07Å; Q505-L509 HydrophobicContact CG-CD1 4.24Å; Q505-L509 WeakPolarHBondContact O-CB 3.36Å; Q505-L509 WeakPolarHBondContact O-CD1 3.39Å; Q505-L509 WeakPolarHBondContact O-CG 3.43Å; Q505-L509 PolarHBondContact O-N 3.49Å; Q505-C545 HydrophobicContact CG-CB 4.09Å; Q505-S546 PolarHBondContact NE2-O 2.97Å; Q505-L548 HydrophobicContact CB-CD1 4Å; Q505-L548 HydrophobicContact CG-CD1 4.42Å
506	L	90	Very high	81.7	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.1	-37.5	175.3	-169	62.6	0	0	0	112.5	L502 W503 A504 Y510 F996 L1000 V1039 L1040	L502-L506 WeakPolarHBondContact O-CB 3.43Å; L502-L506 PolarHBondContact O-N 2.85Å; W503-L506 PolarHBondContact O-N 3.45Å; A504-L506 VanDerWaalsContact C-N 3.28Å; A504-L506 PolarHBondContact O-N 3.09Å; L506-Y510 HydrophobicContact CD1-CD2 4.05Å; L506-Y510 HydrophobicContact CD1-CE2 3.51Å; L506-Y510 HydrophobicContact CD2-CE2 4.46Å; L506-Y510 HydrophobicContact CG-CD2 4.05Å; L506-Y510 HydrophobicContact CG-CE2 3.81Å; L506-Y510 VanDerWaalsContact O-CD2 3.26Å; L506-Y510 WeakPolarHBondContact O-CD2 3.24Å; L506-Y510 PolarHBondContact O-N 3.35Å; L506-F996 HydrophobicContact CB-CD2 3.95Å; L506-F996 HydrophobicContact CB-CE2 4.05Å; L506-F996 HydrophobicContact CB-CG 4.47Å; L506-F996 HydrophobicContact CD1-CB 4.49Å; L506-F996 HydrophobicContact CD1-CD1 3.98Å; L506-F996 HydrophobicContact CD1-CD2 4.29Å; L506-F996 HydrophobicContact CD1-CE1 4.16Å; L506-F996 HydrophobicContact CD1-CE2 4.47Å; L506-F996 HydrophobicContact CD1-CG 4.03Å; L506-F996 HydrophobicContact CD1-CZ 4.41Å; L506-F996 HydrophobicContact CD2-CE1 4.39Å; L506-F996 HydrophobicContact CD2-CE2 4.12Å; L506-F996 HydrophobicContact CD2-CZ 3.97Å; L506-F996 HydrophobicContact CG-CE2 4.45Å; L506-L1000 HydrophobicContact CD1-CD1 3.5Å; L506-L1000 VanDerWaalsContact CD1-CD1 3.5Å; L506-V1039 HydrophobicContact CD2-CG1 3.82Å; L506-L1040 HydrophobicContact CB-CD2 4.49Å; L506-L1040 HydrophobicContact CD2-CD2 4.2Å; L506-L1040 HydrophobicContact CG-CD2 4.26Å
507	G	89.1	Confident	83.6	Confident	11 Å²	11	42.7 Å²	42.7	11%	0.113	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-44.4	172.5	0	0	0	0	0	112.8	W503 A504 Y510 G511 A512	W503-G507 PolarHBondContact O-N 2.86Å; A504-G507 WeakPolarHBondContact O-CA 3.31Å; A504-G507 PolarHBondContact O-N 2.86Å; A504-G507 VanDerWaalsContact O-N 3.09Å; G507-Y510 PolarHBondContact O-N 3.03Å; G507-G511 PolarHBondContact O-N 3.37Å; G507-A512 WeakPolarHBondContact O-CB 3.16Å; G507-A512 PolarHBondContact O-N 3.14Å
508	D	91.3	Very high	85.4	Confident	28 Å²	28	40.7 Å²	40.7	15%	0.15	22%	0.222	C	C	.	.	H	α-helix	trans	-54.2	-54.5	173.2	-71.4	-16.1	0	0	0	110.4	A465 A504 Q505 Y510 G511 C545 S546	A465-D508 HydrophobicContact CB-CB 3.87Å; A465-D508 VanDerWaalsContact CB-O 3.22Å; A465-D508 WeakPolarHBondContact CB-O 3.49Å; A504-D508 PolarHBondContact O-N 2.78Å; Q505-D508 PolarHBondContact O-N 3.07Å; D508-Y510 VanDerWaalsContact C-N 3.32Å; D508-Y510 PolarHBondContact O-N 3.14Å; D508-G511 PolarHBondContact O-N 3.24Å; D508-C545 HydrophobicContact CB-CB 3.65Å; D508-S546 WeakPolarHBondContact OD2-CB 3.23Å; D508-S546 PolarHBondContact OD2-N 3.43Å; D508-S546 PolarHBondContact OD2-OG 3.32Å
509	L	92.1	Very high	86.4	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60	-36.3	-175.7	-76.5	166.9	0	0	0	113.7	H463 Q505 G511 I543 C545 F996 V1013	H463-L509 PolarHBondContact ND1-O 2.88Å; Q505-L509 HydrophobicContact CG-CD1 4.24Å; Q505-L509 WeakPolarHBondContact O-CB 3.36Å; Q505-L509 WeakPolarHBondContact O-CD1 3.39Å; Q505-L509 WeakPolarHBondContact O-CG 3.43Å; Q505-L509 PolarHBondContact O-N 3.49Å; L509-G511 VanDerWaalsContact C-N 3.32Å; L509-I543 HydrophobicContact CD2-CG2 4.39Å; L509-C545 HydrophobicContact CD2-CB 3.93Å; L509-C545 HydrophobicContact CG-CB 3.86Å; L509-F996 HydrophobicContact CD1-CB 3.76Å; L509-V1013 HydrophobicContact CB-CG1 4.29Å; L509-V1013 HydrophobicContact CB-CG2 3.98Å; L509-V1013 WeakPolarHBondContact O-CG1 3.42Å
510	Y	91.1	Very high	87.4	Confident	14 Å²	14	29.4 Å²	29.4	6%	0.055	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-0.2	174.9	-70.3	-54.4	0	0	0	113.8	L506 G507 D508 A512 L519 A520 D1011 V1013	L506-Y510 HydrophobicContact CD1-CD2 4.05Å; L506-Y510 HydrophobicContact CD1-CE2 3.51Å; L506-Y510 HydrophobicContact CD2-CE2 4.46Å; L506-Y510 HydrophobicContact CG-CD2 4.05Å; L506-Y510 HydrophobicContact CG-CE2 3.81Å; L506-Y510 VanDerWaalsContact O-CD2 3.26Å; L506-Y510 WeakPolarHBondContact O-CD2 3.24Å; L506-Y510 PolarHBondContact O-N 3.35Å; G507-Y510 PolarHBondContact O-N 3.03Å; D508-Y510 VanDerWaalsContact C-N 3.32Å; D508-Y510 PolarHBondContact O-N 3.14Å; Y510-A512 VanDerWaalsContact C-N 3.31Å; Y510-A512 PolarHBondContact O-N 2.89Å; Y510-L519 HydrophobicContact CD2-CD2 4.12Å; Y510-L519 HydrophobicContact CG-CD2 4.01Å; Y510-A520 WeakPolarHBondContact O-CB 3.4Å; Y510-A520 PolarHBondContact O-N 3.31Å; Y510-D1011 PolarHBondContact OH-O 3.24Å; Y510-V1013 HydrophobicContact CD1-CG2 3.91Å; Y510-V1013 HydrophobicContact CE1-CG2 3.66Å
511	G	88.6	Confident	87.9	Confident	1 Å²	1	27 Å²	27	1%	0.01	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	20.8	-178.1	0	0	0	0	0	114.7	G507 D508 L509 I513	G507-G511 PolarHBondContact O-N 3.37Å; D508-G511 PolarHBondContact O-N 3.24Å; L509-G511 VanDerWaalsContact C-N 3.32Å; G511-I513 PolarHBondContact O-N 3.03Å
512	A	86.7	Confident	88.5	Confident	16 Å²	16	24.2 Å²	24.2	13%	0.132	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	33.3	-168.3	0	0	0	0	0	114.9	G507 Y510 V517 R518 L519 L1040	G507-A512 WeakPolarHBondContact O-CB 3.16Å; G507-A512 PolarHBondContact O-N 3.14Å; Y510-A512 VanDerWaalsContact C-N 3.31Å; Y510-A512 PolarHBondContact O-N 2.89Å; A512-V517 HydrophobicContact CB-CG1 3.95Å; A512-R518 WeakPolarHBondContact CA-O 3.43Å; A512-L519 HydrophobicContact CB-CD2 4.3Å; A512-L1040 HydrophobicContact CB-CD1 3.55Å
513	I	84.4	Confident	89	Confident	55 Å²	55	21.9 Å²	21.9	28%	0.282	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-22.6	-172.6	-61.6	158	0	0	0	111.8	A465 P468 G511 T1156	A465-I513 HydrophobicContact CB-CD1 3.75Å; P468-I513 HydrophobicContact CG-CD1 4.5Å; G511-I513 PolarHBondContact O-N 3.03Å; I513-T1156 HydrophobicContact CG2-CG2 4.09Å
514	G	81.6	Confident	89.4	Confident	4 Å²	4	17.5 Å²	17.5	4%	0.041	10%	0.104	C	C	.	.	S	Bend	trans	-75.2	156.7	177.9	0	0	0	0	0	113.4	P516 V517	G514-P516 CarbonylContact O-C 3.4Å; G514-V517 WeakPolarHBondContact O-CA 3.16Å; G514-V517 PolarHBondContact O-N 3.16Å
515	S	81.8	Confident	89.7	Confident	48 Å²	48	16.7 Å²	16.7	34%	0.336	10%	0.096	S	C	.	.	S	Bend	trans	-104.8	126.5	170.4	-171.5	0	0	0	0	110.4	S1155 A1162	S515-S1155 PolarHBondContact N-O 3.06Å; S515-S1155 VanDerWaalsContact O-CB 3.31Å; S515-S1155 WeakPolarHBondContact O-CB 3.35Å; S515-A1162 WeakPolarHBondContact O-CB 3.32Å
516	P	84.2	Confident	89.8	Confident	53 Å²	53	16.7 Å²	16.7	34%	0.344	10%	0.096	S	C	.	.	S	Bend	cis	-71.2	156.8	-7.6	34.1	-37.3	0	0	0	112	G514 R518 A1045	G514-P516 CarbonylContact O-C 3.4Å; P516-R518 PolarHBondContact O-N 3.46Å; P516-A1045 HydrophobicContact CB-CB 3.72Å; P516-A1045 HydrophobicContact CG-CB 4.1Å
517	V	87.1	Confident	89.8	Confident	20 Å²	20	24 Å²	24	12%	0.121	13%	0.128	C	C	.	.			trans	-61.6	127.5	-177.5	-177.2	0	0	0	0	111	A512 G514 E1042 A1045	A512-V517 HydrophobicContact CB-CG1 3.95Å; G514-V517 WeakPolarHBondContact O-CA 3.16Å; G514-V517 PolarHBondContact O-N 3.16Å; V517-E1042 HydrophobicContact CG2-CB 4.49Å; V517-A1045 PolarHBondContact O-N 2.71Å
518	R	89.7	Confident	89.9	Confident	57 Å²	57	29.2 Å²	29.2	22%	0.215	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	152	175.6	-64.7	-171.6	158.7	110.3	0	110.6	A512 P516 E1046	A512-R518 WeakPolarHBondContact CA-O 3.43Å; P516-R518 PolarHBondContact O-N 3.46Å; R518-E1046 VanDerWaalsContact CA-O 3.24Å; R518-E1046 WeakPolarHBondContact CA-O 3.44Å; R518-E1046 HydrophobicContact CG-CB 4.22Å; R518-E1046 IonicContact CZ-OE2 3.63Å; R518-E1046 IonicContact NE-OE2 3.74Å; R518-E1046 PolarHBondContact NE-OE2 2.69Å; R518-E1046 IonicContact NH2-OE2 2.72Å; R518-E1046 PolarHBondContact NH2-OE2 2.74Å
519	L	91.4	Very high	89.9	Confident	12 Å²	12	32.2 Å²	32.2	6%	0.063	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127.7	161	-60.5	-171.4	0	0	0	109.7	Y510 A512 A1034 L1040 I1044 E1046 V1048	Y510-L519 HydrophobicContact CD2-CD2 4.12Å; Y510-L519 HydrophobicContact CG-CD2 4.01Å; A512-L519 HydrophobicContact CB-CD2 4.3Å; L519-A1034 HydrophobicContact CD1-CB 4.49Å; L519-L1040 HydrophobicContact CD2-CD1 3.85Å; L519-I1044 HydrophobicContact CD1-CD1 3.44Å; L519-I1044 VanDerWaalsContact CD1-CD1 3.44Å; L519-I1044 HydrophobicContact CD1-CG1 4.31Å; L519-I1044 HydrophobicContact CD2-CD1 4.13Å; L519-I1044 HydrophobicContact CD2-CG1 4.22Å; L519-I1044 HydrophobicContact CG-CD1 3.63Å; L519-I1044 HydrophobicContact CG-CG1 3.94Å; L519-I1044 HydrophobicContact CG-CG2 4.12Å; L519-E1046 PolarHBondContact N-O 2.82Å; L519-E1046 VanDerWaalsContact N-O 3.11Å; L519-V1048 PolarHBondContact O-N 3.1Å
520	A	92.8	Very high	90	Very high	2 Å²	2	37.4 Å²	37.4	2%	0.017	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137.8	176.9	0	0	0	0	0	111.5	N462 H463 Y510 V1048	N462-A520 HydrophobicContact CB-CB 3.75Å; H463-A520 PolarHBondContact CE1-O 3.26Å; H463-A520 VanDerWaalsContact CE1-O 3.27Å; Y510-A520 WeakPolarHBondContact O-CB 3.4Å; Y510-A520 PolarHBondContact O-N 3.31Å; A520-V1048 WeakPolarHBondContact CA-O 3.46Å
521	R	94.3	Very high	90	Very high	20 Å²	20	37.5 Å²	37.5	8%	0.075	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	146.9	168.1	60.6	179.6	175	-149	-7.8	112	Y1008 P1010 V1048 C1049 I1050	R521-Y1008 PolarHBondContact NE-OH 2.96Å; R521-Y1008 PolarHBondContact NH1-OH 3.35Å; R521-Y1008 PolarHBondContact NH2-OH 3.35Å; R521-P1010 PolarHBondContact NH1-O 3.41Å; R521-V1048 PolarHBondContact N-O 2.84Å; R521-C1049 HydrophobicContact CG-CB 4.02Å; R521-C1049 CarbonylContact O-C 3.53Å; R521-C1049 WeakPolarHBondContact O-CA 3.28Å; R521-I1050 PolarHBondContact O-N 3.31Å
522	T	95.9	Very high	90.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	116.2	-172.3	-54.6	0	0	0	0	111	V459 H463 L539 V1013 L1014 Q1015 I1050	V459-T522 HydrophobicContact CG2-CG2 4.44Å; H463-T522 PolarHBondContact NE2-OG1 3.08Å; T522-L539 HydrophobicContact CG2-CD1 4.2Å; T522-V1013 PolarHBondContact N-O 2.86Å; T522-L1014 HydrophobicContact CG2-CD1 3.85Å; T522-L1014 WeakPolarHBondContact O-CA 3.26Å; T522-Q1015 PolarHBondContact O-N 3.17Å; T522-Q1015 VanDerWaalsContact O-N 3.12Å; T522-I1050 HydrophobicContact CG2-CB 4.41Å; T522-I1050 HydrophobicContact CG2-CG2 4.44Å
523	V	95.1	Very high	90.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119	178.7	-178.2	0	0	0	0	109.5	V525 Y1008 Q1015 I1017 F1023 I1050 I1051 A1052	V523-V525 HydrophobicContact CG1-CG2 4.24Å; V523-Y1008 HydrophobicContact CG2-CD2 4.29Å; V523-Y1008 HydrophobicContact CG2-CE2 3.94Å; V523-Q1015 HydrophobicContact CG1-CG 4.29Å; V523-Q1015 HydrophobicContact CG2-CG 4.11Å; V523-I1017 HydrophobicContact CG1-CD1 3.69Å; V523-I1017 HydrophobicContact CG1-CG1 3.85Å; V523-F1023 HydrophobicContact CB-CE2 4.23Å; V523-F1023 HydrophobicContact CB-CZ 3.92Å; V523-F1023 HydrophobicContact CG1-CE1 4.2Å; V523-F1023 HydrophobicContact CG1-CE2 4.05Å; V523-F1023 HydrophobicContact CG1-CZ 3.84Å; V523-F1023 HydrophobicContact CG2-CE2 3.87Å; V523-F1023 HydrophobicContact CG2-CZ 4.02Å; V523-I1050 PolarHBondContact N-O 3Å; V523-I1051 WeakPolarHBondContact O-CA 3.34Å; V523-A1052 PolarHBondContact O-N 2.83Å
524	V	94.7	Very high	90.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	118.8	175	-174.9	0	0	0	0	109.1	V532 L535 L536 L539 Q1015 G1016 I1017 A1052 M1054	V524-V532 HydrophobicContact CB-CG1 4.06Å; V524-V532 HydrophobicContact CG1-CB 4.46Å; V524-V532 HydrophobicContact CG1-CG1 3.8Å; V524-V532 HydrophobicContact CG1-CG2 4.24Å; V524-L535 HydrophobicContact CG1-CD2 3.95Å; V524-L535 HydrophobicContact CG2-CD2 4.48Å; V524-L536 HydrophobicContact CB-CD2 4.11Å; V524-L536 HydrophobicContact CG2-CD2 3.67Å; V524-L539 HydrophobicContact CG2-CD1 4.02Å; V524-Q1015 PolarHBondContact N-O 2.95Å; V524-G1016 CarbonylContact O-C 3.58Å; V524-G1016 VanDerWaalsContact O-CA 3.3Å; V524-G1016 WeakPolarHBondContact O-CA 3.49Å; V524-I1017 PolarHBondContact O-N 3.14Å; V524-A1052 CarbonylContact C-O 3.59Å; V524-A1052 WeakPolarHBondContact CA-O 3.5Å; V524-A1052 HydrophobicContact CG2-CB 4.31Å; V524-M1054 HydrophobicContact CG1-CG 3.75Å; V524-M1054 HydrophobicContact CG1-SD 3.59Å; V524-M1054 VanDerWaalsContact CG1-SD 3.59Å
525	V	92.6	Very high	91.5	Very high	9 Å²	9	40.7 Å²	40.7	6%	0.055	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.6	-179.7	-171.2	0	0	0	0	109	V523 I1017 D1020 F1023 I1051 A1052 M1054	V523-V525 HydrophobicContact CG1-CG2 4.24Å; V525-I1017 WeakPolarHBondContact CA-O 3.36Å; V525-I1017 HydrophobicContact CB-CG1 4.46Å; V525-I1017 HydrophobicContact CG1-CG1 4.45Å; V525-I1017 HydrophobicContact CG2-CD1 4.13Å; V525-I1017 HydrophobicContact CG2-CG1 3.99Å; V525-D1020 HydrophobicContact CG1-CB 4.34Å; V525-F1023 HydrophobicContact CG2-CE1 4.39Å; V525-I1051 HydrophobicContact CG2-CG2 4.09Å; V525-A1052 PolarHBondContact N-O 3.48Å; V525-M1054 PolarHBondContact O-N 3.15Å
526	G	91.6	Very high	92.2	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.01	18%	0.176	C	C	.	.			trans	-176.7	142.4	176.6	0	0	0	0	0	114.6	R528 Y1004 I1017 D1055	G526-R528 VanDerWaalsContact C-N 3.34Å; G526-R528 PolarHBondContact O-N 2.92Å; G526-Y1004 WeakPolarHBondContact O-CE2 3.5Å; G526-Y1004 PolarHBondContact O-OH 3.43Å; G526-I1017 PolarHBondContact N-O 3.37Å; G526-D1055 WeakPolarHBondContact CA-OD1 3.26Å
527	K	90.4	Very high	92.7	Very high	153 Å²	153	37.1 Å²	37.1	67%	0.665	17%	0.165	S	C	*	.	S	Bend	trans	-76.4	-18.5	-178.4	-64.7	-177	-172.9	94.2	0	114.1	Q529 D1055	K527-Q529 PolarHBondContact O-N 2.95Å; K527-D1055 WeakPolarHBondContact CD-OD2 3.28Å; K527-D1055 WeakPolarHBondContact CE-OD2 3.28Å; K527-D1055 WeakPolarHBondContact CG-OD2 2.9Å; K527-D1055 PolarHBondContact N-OD1 3.21Å; K527-D1055 IonicContact NZ-OD2 2.63Å; K527-D1055 PolarHBondContact NZ-OD2 2.83Å
528	R	91.4	Very high	93	Very high	121 Å²	121	36.2 Å²	36.2	46%	0.457	16%	0.159	S	C	.	.			trans	-94	92.1	-179.1	-67.5	-174.4	-67.6	154.1	1.6	110.1	G526 D530 M531 V532	G526-R528 VanDerWaalsContact C-N 3.34Å; G526-R528 PolarHBondContact O-N 2.92Å; R528-D530 VanDerWaalsContact C-N 3.33Å; R528-D530 PolarHBondContact O-N 2.32Å; R528-M531 HydrophobicContact CB-CB 4.02Å; R528-M531 HydrophobicContact CB-CG 3.88Å; R528-M531 WeakPolarHBondContact O-CB 3.23Å; R528-M531 PolarHBondContact O-N 3.09Å; R528-M531 VanDerWaalsContact O-N 3.09Å; R528-V532 PolarHBondContact O-N 2.98Å; R528-V532 VanDerWaalsContact O-N 3.1Å
529	Q	91.6	Very high	93.3	Very high	90 Å²	90	33.5 Å²	33.5	42%	0.421	15%	0.149	S	C	.	.	H	α-helix	trans	-46.2	-52.1	-178.3	175.6	167.4	-10.2	0	0	112.9	K527 M531 V532 Q533 Y1004	K527-Q529 PolarHBondContact O-N 2.95Å; Q529-M531 VanDerWaalsContact C-N 3.29Å; Q529-M531 PolarHBondContact O-N 2.85Å; Q529-V532 PolarHBondContact O-N 2.99Å; Q529-V532 VanDerWaalsContact O-N 3.09Å; Q529-Q533 HydrophobicContact CG-CG 4.2Å; Q529-Q533 VanDerWaalsContact NE2-NE2 3.17Å; Q529-Q533 WeakPolarHBondContact O-CG 3.2Å; Q529-Q533 PolarHBondContact O-N 2.83Å; Q529-Y1004 HydrophobicContact CB-CD1 3.95Å; Q529-Y1004 HydrophobicContact CB-CE1 3.87Å; Q529-Y1004 HydrophobicContact CB-CG 4.3Å; Q529-Y1004 HydrophobicContact CG-CD1 3.59Å; Q529-Y1004 HydrophobicContact CG-CD2 4.46Å; Q529-Y1004 HydrophobicContact CG-CE1 4.05Å; Q529-Y1004 HydrophobicContact CG-CG 3.81Å
530	D	92.2	Very high	93.5	Very high	110 Å²	110	33 Å²	33	59%	0.588	15%	0.146	S	C	*	.	H	α-helix	trans	-59.2	-38.9	-177.3	-28.3	-33.8	0	0	0	112.6	R528 R534	R528-D530 VanDerWaalsContact C-N 3.33Å; R528-D530 PolarHBondContact O-N 2.32Å; D530-R534 WeakPolarHBondContact O-CD 3.5Å; D530-R534 WeakPolarHBondContact O-CG 3.4Å; D530-R534 PolarHBondContact O-N 3.09Å; D530-R534 VanDerWaalsContact O-N 3.09Å
531	M	91.4	Very high	93.6	Very high	15 Å²	15	32.9 Å²	32.9	7%	0.074	15%	0.145	C	C	.	.	H	α-helix	trans	-69.2	-39.9	178	-66.4	-67	-48.5	0	0	111.4	F441 N445 R528 Q529 L535 M1054	F441-M531 HydrophobicContact CE1-CE 3.87Å; F441-M531 HydrophobicContact CE1-SD 3.68Å; F441-M531 HydrophobicContact CZ-CE 4.38Å; F441-M531 HydrophobicContact CZ-SD 3.8Å; N445-M531 HydrophobicContact CB-CE 4.18Å; R528-M531 HydrophobicContact CB-CB 4.02Å; R528-M531 HydrophobicContact CB-CG 3.88Å; R528-M531 WeakPolarHBondContact O-CB 3.23Å; R528-M531 PolarHBondContact O-N 3.09Å; R528-M531 VanDerWaalsContact O-N 3.09Å; Q529-M531 VanDerWaalsContact C-N 3.29Å; Q529-M531 PolarHBondContact O-N 2.85Å; M531-L535 PolarHBondContact O-N 2.82Å; M531-L535 VanDerWaalsContact O-N 3.15Å; M531-M1054 HydrophobicContact CB-CE 3.97Å; M531-M1054 HydrophobicContact CE-CE 4.39Å
532	V	93.3	Very high	93.6	Very high	0 Å²	0	32 Å²	32	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.2	-48.9	176.3	176.9	0	0	0	0	109.6	V524 R528 Q529 R534 L535 L536 Y1004 M1054	V524-V532 HydrophobicContact CB-CG1 4.06Å; V524-V532 HydrophobicContact CG1-CB 4.46Å; V524-V532 HydrophobicContact CG1-CG1 3.8Å; V524-V532 HydrophobicContact CG1-CG2 4.24Å; R528-V532 PolarHBondContact O-N 2.98Å; R528-V532 VanDerWaalsContact O-N 3.1Å; Q529-V532 PolarHBondContact O-N 2.99Å; Q529-V532 VanDerWaalsContact O-N 3.09Å; V532-R534 PolarHBondContact O-N 2.95Å; V532-L535 PolarHBondContact O-N 3.06Å; V532-L536 HydrophobicContact CG1-CD1 4Å; V532-L536 HydrophobicContact CG1-CG 4.09Å; V532-L536 VanDerWaalsContact O-CG 3.3Å; V532-L536 WeakPolarHBondContact O-CG 3.08Å; V532-L536 PolarHBondContact O-N 3.4Å; V532-Y1004 HydrophobicContact CB-CD2 3.89Å; V532-Y1004 HydrophobicContact CB-CE2 4.09Å; V532-Y1004 HydrophobicContact CG1-CD2 3.71Å; V532-Y1004 HydrophobicContact CG1-CE2 4.16Å; V532-Y1004 HydrophobicContact CG2-CD2 4.4Å; V532-Y1004 HydrophobicContact CG2-CE2 4.09Å; V532-M1054 HydrophobicContact CB-SD 4.31Å; V532-M1054 HydrophobicContact CG2-SD 3.72Å
533	Q	92.9	Very high	93.6	Very high	55 Å²	55	32.1 Å²	32.1	26%	0.257	14%	0.143	S	C	.	.	H	α-helix	trans	-57.5	-43.7	179.1	-73.2	178.1	-31.5	0	0	112.8	Q529 L535 L536 Y537	Q529-Q533 HydrophobicContact CG-CG 4.2Å; Q529-Q533 VanDerWaalsContact NE2-NE2 3.17Å; Q529-Q533 WeakPolarHBondContact O-CG 3.2Å; Q529-Q533 PolarHBondContact O-N 2.83Å; Q533-L535 PolarHBondContact O-N 2.89Å; Q533-L536 PolarHBondContact O-N 3.41Å; Q533-Y537 PolarHBondContact O-N 3.13Å
534	R	93.6	Very high	93.5	Very high	88 Å²	88	32.2 Å²	32.2	33%	0.332	14%	0.143	S	C	.	.	H	α-helix	trans	-60.5	-42.4	173.8	-69.3	166.4	-176.6	-98.6	-1.7	112.3	E438 F441 L442 D530 V532 Y537 F538	E438-R534 IonicContact OE1-CZ 3.82Å; E438-R534 IonicContact OE1-NH1 2.82Å; E438-R534 PolarHBondContact OE1-NH1 2.96Å; E438-R534 VanDerWaalsContact OE2-CD 3.27Å; E438-R534 WeakPolarHBondContact OE2-CD 3.46Å; E438-R534 VanDerWaalsContact OE2-CG 3.24Å; E438-R534 WeakPolarHBondContact OE2-CG 3.47Å; E438-R534 IonicContact OE2-CZ 3.56Å; E438-R534 IonicContact OE2-NE 3.78Å; E438-R534 IonicContact OE2-NH1 2.68Å; E438-R534 PolarHBondContact OE2-NH1 2.87Å; F441-R534 VanDerWaalsContact CE1-CD 3.47Å; L442-R534 HydrophobicContact CD2-CB 4.41Å; D530-R534 WeakPolarHBondContact O-CD 3.5Å; D530-R534 WeakPolarHBondContact O-CG 3.4Å; D530-R534 PolarHBondContact O-N 3.09Å; D530-R534 VanDerWaalsContact O-N 3.09Å; V532-R534 PolarHBondContact O-N 2.95Å; R534-Y537 PolarHBondContact O-N 3.31Å; R534-F538 PolarHBondContact O-N 3.36Å; R534-F538 VanDerWaalsContact O-N 3.08Å
535	L	94.3	Very high	93.2	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-68.1	-41.1	177.5	-176.9	58.5	0	0	0	112.1	L442 F451 L452 L455 V524 M531 V532 Q533 F538 L539 M1054	L442-L535 HydrophobicContact CD1-CD1 4.1Å; L442-L535 HydrophobicContact CD2-CB 4.09Å; L442-L535 HydrophobicContact CD2-CD1 4.34Å; F451-L535 HydrophobicContact CE1-CD2 3.89Å; F451-L535 HydrophobicContact CZ-CD2 4.3Å; L452-L535 HydrophobicContact CD1-CD1 3.62Å; L455-L535 HydrophobicContact CD2-CD1 3.99Å; L455-L535 HydrophobicContact CD2-CD2 3.78Å; L455-L535 HydrophobicContact CD2-CG 4.24Å; V524-L535 HydrophobicContact CG1-CD2 3.95Å; V524-L535 HydrophobicContact CG2-CD2 4.48Å; M531-L535 PolarHBondContact O-N 2.82Å; M531-L535 VanDerWaalsContact O-N 3.15Å; V532-L535 PolarHBondContact O-N 3.06Å; Q533-L535 PolarHBondContact O-N 2.89Å; L535-F538 HydrophobicContact CD1-CD1 4.24Å; L535-F538 PolarHBondContact O-N 3.16Å; L535-L539 HydrophobicContact CD1-CG 4.37Å; L535-L539 HydrophobicContact CG-CD1 4.2Å; L535-L539 HydrophobicContact CG-CG 4.5Å; L535-L539 VanDerWaalsContact O-CG 3.26Å; L535-L539 WeakPolarHBondContact O-CG 3.49Å; L535-L539 PolarHBondContact O-N 2.84Å; L535-M1054 HydrophobicContact CB-CE 4.2Å; L535-M1054 HydrophobicContact CB-SD 4.17Å; L535-M1054 HydrophobicContact CD2-CE 3.81Å; L535-M1054 HydrophobicContact CD2-CG 4.04Å; L535-M1054 HydrophobicContact CD2-SD 3.54Å; L535-M1054 VanDerWaalsContact CD2-SD 3.54Å
536	L	95.1	Very high	92.8	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-48.2	174.2	-64.5	173.5	0	0	0	110.7	I413 V524 V532 Q533 F538 L539 T540 L1014	I413-L536 HydrophobicContact CD1-CB 3.95Å; V524-L536 HydrophobicContact CB-CD2 4.11Å; V524-L536 HydrophobicContact CG2-CD2 3.67Å; V532-L536 HydrophobicContact CG1-CD1 4Å; V532-L536 HydrophobicContact CG1-CG 4.09Å; V532-L536 VanDerWaalsContact O-CG 3.3Å; V532-L536 WeakPolarHBondContact O-CG 3.08Å; V532-L536 PolarHBondContact O-N 3.4Å; Q533-L536 PolarHBondContact O-N 3.41Å; L536-F538 PolarHBondContact O-N 2.9Å; L536-L539 WeakPolarHBondContact O-CB 3.23Å; L536-L539 PolarHBondContact O-N 3.49Å; L536-L539 VanDerWaalsContact O-N 3.1Å; L536-T540 WeakPolarHBondContact O-CG2 3.37Å; L536-T540 PolarHBondContact O-N 3.16Å; L536-L1014 HydrophobicContact CB-CD2 4.46Å; L536-L1014 HydrophobicContact CD2-CD1 3.71Å; L536-L1014 HydrophobicContact CD2-CD2 4.35Å; L536-L1014 HydrophobicContact CD2-CG 3.81Å
537	Y	95	Very high	92.4	Very high	25 Å²	25	36.9 Å²	36.9	10%	0.098	17%	0.171	C	C	.	.	H	α-helix	trans	-55.3	-49.7	176.1	-179.8	-107.7	0	0	0	111.8	E415 V417 R434 Q533 R534 L539 T540	E415-Y537 WeakPolarHBondContact O-CE2 3.47Å; V417-Y537 HydrophobicContact CG2-CD1 4.16Å; V417-Y537 HydrophobicContact CG2-CD2 3.92Å; V417-Y537 HydrophobicContact CG2-CE1 3.8Å; V417-Y537 HydrophobicContact CG2-CE2 3.53Å; V417-Y537 HydrophobicContact CG2-CG 4.22Å; V417-Y537 VanDerWaalsContact CG2-CZ 3.46Å; V417-Y537 WeakPolarHBondContact CG2-O 3.27Å; R434-Y537 HydrophobicContact CG-CE1 4.29Å; Q533-Y537 PolarHBondContact O-N 3.13Å; R534-Y537 PolarHBondContact O-N 3.31Å; Y537-L539 VanDerWaalsContact C-N 3.3Å; Y537-L539 PolarHBondContact O-N 3.43Å; Y537-T540 PolarHBondContact O-N 2.96Å; Y537-T540 VanDerWaalsContact O-N 3.16Å; Y537-T540 PolarHBondContact O-OG1 3.02Å
538	F	94.8	Very high	92	Very high	1 Å²	1	31.1 Å²	31.1	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-59.2	-36.4	175.7	177.3	-108.8	0	0	0	113.4	F435 F439 L442 L452 I456 R534 L535 L536 T540 Y541 F542	F435-F538 HydrophobicContact CD2-CD2 4.15Å; F435-F538 AromaticContact CE2-CD2 3.44Å; F435-F538 HydrophobicContact CE2-CD2 3.44Å; F435-F538 VanDerWaalsContact CE2-CD2 3.44Å; F435-F538 AromaticContact CE2-CE2 3.74Å; F435-F538 HydrophobicContact CE2-CE2 3.74Å; F435-F538 HydrophobicContact CE2-CG 4.46Å; F435-F538 AromaticContact CZ-CD2 3.91Å; F435-F538 HydrophobicContact CZ-CD2 3.91Å; F435-F538 AromaticContact CZ-CE2 3.69Å; F435-F538 HydrophobicContact CZ-CE2 3.69Å; F439-F538 HydrophobicContact CB-CD2 3.96Å; F439-F538 HydrophobicContact CB-CE2 3.63Å; F439-F538 HydrophobicContact CD2-CD2 4.41Å; F439-F538 AromaticContact CD2-CE2 3.4Å; F439-F538 HydrophobicContact CD2-CE2 3.4Å; F439-F538 VanDerWaalsContact CD2-CE2 3.4Å; F439-F538 AromaticContact CD2-CZ 3.51Å; F439-F538 HydrophobicContact CD2-CZ 3.51Å; F439-F538 HydrophobicContact CE2-CE2 4.39Å; F439-F538 HydrophobicContact CE2-CZ 4.16Å; F439-F538 AromaticContact CG-CE2 3.84Å; F439-F538 HydrophobicContact CG-CE2 3.84Å; F439-F538 HydrophobicContact CG-CZ 4.39Å; L442-F538 HydrophobicContact CD1-CB 3.43Å; L442-F538 VanDerWaalsContact CD1-CB 3.43Å; L442-F538 HydrophobicContact CD1-CD1 3.94Å; L442-F538 HydrophobicContact CD1-CD2 4.44Å; L442-F538 HydrophobicContact CD1-CG 3.7Å; L452-F538 HydrophobicContact CD1-CD1 4.12Å; L452-F538 HydrophobicContact CD1-CE1 3.82Å; L452-F538 HydrophobicContact CD2-CE1 3.8Å; L452-F538 HydrophobicContact CD2-CZ 4.17Å; L452-F538 HydrophobicContact CG-CE1 4.01Å; I456-F538 HydrophobicContact CD1-CE1 3.89Å; I456-F538 HydrophobicContact CG1-CE1 4.19Å; R534-F538 PolarHBondContact O-N 3.36Å; R534-F538 VanDerWaalsContact O-N 3.08Å; L535-F538 HydrophobicContact CD1-CD1 4.24Å; L535-F538 PolarHBondContact O-N 3.16Å; L536-F538 PolarHBondContact O-N 2.9Å; F538-T540 VanDerWaalsContact C-N 3.33Å; F538-T540 PolarHBondContact O-N 2.66Å; F538-Y541 PolarHBondContact O-N 3.01Å; F538-F542 HydrophobicContact CD1-CE2 4.4Å; F538-F542 AromaticContact CE1-CE2 3.79Å; F538-F542 HydrophobicContact CE1-CE2 3.79Å; F538-F542 AromaticContact CE2-CE2 3.92Å; F538-F542 HydrophobicContact CE2-CE2 3.92Å; F538-F542 AromaticContact CZ-CE2 3.52Å; F538-F542 HydrophobicContact CZ-CE2 3.52Å; F538-F542 HydrophobicContact CZ-CZ 4.07Å
539	L	95.7	Very high	91.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-69.5	-25.4	177.7	-71.4	173	0	0	0	113.7	L455 I456 V459 T522 V524 L535 L536 Y537 Y541 F542 I543 L1014	L455-L539 HydrophobicContact CD2-CD1 4.34Å; L455-L539 HydrophobicContact CD2-CD2 4.37Å; L455-L539 HydrophobicContact CG-CD2 4.31Å; I456-L539 HydrophobicContact CD1-CD2 3.8Å; V459-L539 HydrophobicContact CG2-CD2 4.11Å; T522-L539 HydrophobicContact CG2-CD1 4.2Å; V524-L539 HydrophobicContact CG2-CD1 4.02Å; L535-L539 HydrophobicContact CD1-CG 4.37Å; L535-L539 HydrophobicContact CG-CD1 4.2Å; L535-L539 HydrophobicContact CG-CG 4.5Å; L535-L539 VanDerWaalsContact O-CG 3.26Å; L535-L539 WeakPolarHBondContact O-CG 3.49Å; L535-L539 PolarHBondContact O-N 2.84Å; L536-L539 WeakPolarHBondContact O-CB 3.23Å; L536-L539 PolarHBondContact O-N 3.49Å; L536-L539 VanDerWaalsContact O-N 3.1Å; Y537-L539 VanDerWaalsContact C-N 3.3Å; Y537-L539 PolarHBondContact O-N 3.43Å; L539-Y541 PolarHBondContact O-N 2.95Å; L539-F542 PolarHBondContact O-N 3.44Å; L539-I543 PolarHBondContact O-N 3.03Å; L539-I543 VanDerWaalsContact O-N 3.07Å; L539-L1014 HydrophobicContact CB-CD1 4.2Å; L539-L1014 HydrophobicContact CB-CD2 4.06Å; L539-L1014 HydrophobicContact CD1-CD1 3.84Å
540	T	94.9	Very high	90.4	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-1.7	176.9	68	0	0	0	0	115.1	I413 P416 V417 W418 L536 Y537 F538 L1001 L1014	I413-T540 HydrophobicContact CD1-CG2 3.58Å; I413-T540 HydrophobicContact CG2-CG2 4.36Å; P416-T540 HydrophobicContact CB-CG2 4.32Å; V417-T540 WeakPolarHBondContact CG2-OG1 3.35Å; V417-T540 PolarHBondContact N-OG1 3.22Å; W418-T540 WeakPolarHBondContact CB-O 3.33Å; W418-T540 PolarHBondContact N-O 3.21Å; L536-T540 WeakPolarHBondContact O-CG2 3.37Å; L536-T540 PolarHBondContact O-N 3.16Å; Y537-T540 PolarHBondContact O-N 2.96Å; Y537-T540 VanDerWaalsContact O-N 3.16Å; Y537-T540 PolarHBondContact O-OG1 3.02Å; F538-T540 VanDerWaalsContact C-N 3.33Å; F538-T540 PolarHBondContact O-N 2.66Å; T540-L1001 HydrophobicContact CG2-CD1 4Å; T540-L1014 HydrophobicContact CG2-CD2 3.86Å
541	Y	94.8	Very high	89.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-27.5	169.9	173.3	-105.9	0	0	0	113.1	V417 W418 M421 F435 F538 L539 R544 V1104 L1107 E1108	V417-Y541 HydrophobicContact CG1-CD2 4.07Å; V417-Y541 HydrophobicContact CG1-CG 4.32Å; W418-Y541 HydrophobicContact CE3-CE2 4.48Å; M421-Y541 HydrophobicContact CE-CE2 4.45Å; M421-Y541 HydrophobicContact SD-CD2 4.29Å; M421-Y541 HydrophobicContact SD-CE2 4.39Å; F435-Y541 HydrophobicContact CE1-CD1 4.33Å; F435-Y541 HydrophobicContact CE1-CE1 4.48Å; F435-Y541 AromaticContact CE2-CD1 3.95Å; F435-Y541 HydrophobicContact CE2-CD1 3.95Å; F435-Y541 AromaticContact CE2-CG 3.81Å; F435-Y541 HydrophobicContact CE2-CG 3.81Å; F435-Y541 AromaticContact CZ-CD1 3.48Å; F435-Y541 HydrophobicContact CZ-CD1 3.48Å; F435-Y541 VanDerWaalsContact CZ-CD1 3.48Å; F435-Y541 HydrophobicContact CZ-CD2 4.48Å; F435-Y541 HydrophobicContact CZ-CE1 4Å; F435-Y541 AromaticContact CZ-CG 3.74Å; F435-Y541 HydrophobicContact CZ-CG 3.74Å; F538-Y541 PolarHBondContact O-N 3.01Å; L539-Y541 PolarHBondContact O-N 2.95Å; Y541-R544 VanDerWaalsContact CZ-NH2 3.33Å; Y541-R544 WeakPolarHBondContact O-CG 3.39Å; Y541-R544 PolarHBondContact O-NE 3.41Å; Y541-R544 VanDerWaalsContact O-NE 3.08Å; Y541-R544 PolarHBondContact OH-NH2 3.07Å; Y541-V1104 HydrophobicContact CE2-CG1 4.37Å; Y541-L1107 HydrophobicContact CE1-CD1 3.66Å; Y541-L1107 HydrophobicContact CE1-CD2 3.81Å; Y541-L1107 HydrophobicContact CE1-CG 4.33Å; Y541-E1108 PolarHBondContact OH-OE1 3.08Å
542	F	95.4	Very high	88.3	Confident	1 Å²	1	39.4 Å²	39.4	0%	0.004	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-29.9	-178.2	-63.2	-80.1	0	0	0	112.8	I456 V459 L460 F538 L539 R544 L1107	I456-F542 HydrophobicContact CD1-CD2 3.6Å; I456-F542 HydrophobicContact CD1-CE2 3.69Å; I456-F542 HydrophobicContact CD1-CG 4.09Å; I456-F542 HydrophobicContact CD1-CZ 4.23Å; I456-F542 HydrophobicContact CG1-CE2 4.4Å; I456-F542 HydrophobicContact CG2-CD1 4.31Å; I456-F542 HydrophobicContact CG2-CE1 4.09Å; I456-F542 HydrophobicContact CG2-CZ 4.36Å; V459-F542 HydrophobicContact CG1-CB 3.96Å; L460-F542 HydrophobicContact CD2-CD1 4.02Å; F538-F542 HydrophobicContact CD1-CE2 4.4Å; F538-F542 AromaticContact CE1-CE2 3.79Å; F538-F542 HydrophobicContact CE1-CE2 3.79Å; F538-F542 AromaticContact CE2-CE2 3.92Å; F538-F542 HydrophobicContact CE2-CE2 3.92Å; F538-F542 AromaticContact CZ-CE2 3.52Å; F538-F542 HydrophobicContact CZ-CE2 3.52Å; F538-F542 HydrophobicContact CZ-CZ 4.07Å; L539-F542 PolarHBondContact O-N 3.44Å; F542-R544 VanDerWaalsContact C-N 3.34Å; F542-R544 PolarHBondContact O-N 3.02Å; F542-R544 VanDerWaalsContact O-N 3.16Å; F542-L1107 HydrophobicContact CE1-CD2 4.08Å; F542-L1107 HydrophobicContact CZ-CD1 4.41Å; F542-L1107 HydrophobicContact CZ-CD2 4.46Å
543	I	94.7	Very high	86.9	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.015	23%	0.23	C	C	.	.	S	Bend	trans	-82.8	86.2	168.1	-56.9	178	0	0	0	106.9	V459 L509 L539 L1001 V1013 L1014	V459-I543 HydrophobicContact CG1-CG1 4.02Å; L509-I543 HydrophobicContact CD2-CG2 4.39Å; L539-I543 PolarHBondContact O-N 3.03Å; L539-I543 VanDerWaalsContact O-N 3.07Å; I543-L1001 HydrophobicContact CG2-CD2 4.41Å; I543-V1013 HydrophobicContact CG2-CG1 3.9Å; I543-L1014 HydrophobicContact CD1-CB 4.08Å; I543-L1014 HydrophobicContact CD1-CD1 4.04Å; I543-L1014 HydrophobicContact CD1-CD2 4.33Å; I543-L1014 HydrophobicContact CD1-CG 4.37Å
544	R	92.4	Very high	84.7	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.008	25%	0.252	C	S	.	.			trans	-90	151.4	-176.7	-59.9	-173.3	-176.7	175.8	-3.3	111.2	W418 A465 W466 T469 Y541 F542 E1108	W418-R544 HydrophobicContact CD2-CB 4.09Å; W418-R544 HydrophobicContact CD2-CG 3.64Å; W418-R544 HydrophobicContact CE3-CG 3.92Å; W418-R544 HydrophobicContact CG-CB 4.15Å; W418-R544 HydrophobicContact CG-CG 3.89Å; W418-R544 HydrophobicContact CZ2-CG 4.49Å; W418-R544 HydrophobicContact CZ3-CG 4.45Å; A465-R544 VanDerWaalsContact CB-O 3.27Å; A465-R544 WeakPolarHBondContact CB-O 3.22Å; W466-R544 HydrophobicContact CB-CG 4.38Å; T469-R544 WeakPolarHBondContact OG1-CD 3.48Å; T469-R544 PolarHBondContact OG1-NH1 3.18Å; Y541-R544 VanDerWaalsContact CZ-NH2 3.33Å; Y541-R544 WeakPolarHBondContact O-CG 3.39Å; Y541-R544 PolarHBondContact O-NE 3.41Å; Y541-R544 VanDerWaalsContact O-NE 3.08Å; Y541-R544 PolarHBondContact OH-NH2 3.07Å; F542-R544 VanDerWaalsContact C-N 3.34Å; F542-R544 PolarHBondContact O-N 3.02Å; F542-R544 VanDerWaalsContact O-N 3.16Å; R544-E1108 IonicContact CZ-OE1 3.58Å; R544-E1108 IonicContact CZ-OE2 3.75Å; R544-E1108 VanDerWaalsContact CZ-OE2 3.25Å; R544-E1108 IonicContact NH1-OE1 3.12Å; R544-E1108 IonicContact NH1-OE2 3.58Å; R544-E1108 PolarHBondContact NH1-OE2 3.04Å; R544-E1108 IonicContact NH2-OE1 3.51Å; R544-E1108 PolarHBondContact NH2-OE1 3.04Å; R544-E1108 IonicContact NH2-OE2 3.25Å; R544-E1108 PolarHBondContact NH2-OE2 2.98Å
545	C	88.9	Confident	82.3	Confident	6 Å²	6	54.4 Å²	54.4	4%	0.041	28%	0.276	C	S	.	.			trans	-154.3	165.8	168.4	65.5	0	0	0	0	110.2	W418 Q505 D508 L509	W418-C545 PolarHBondContact NE1-O 2.89Å; Q505-C545 HydrophobicContact CG-CB 4.09Å; D508-C545 HydrophobicContact CB-CB 3.65Å; L509-C545 HydrophobicContact CD2-CB 3.93Å; L509-C545 HydrophobicContact CG-CB 3.86Å
546	S	85.4	Confident	79.6	Confident	56 Å²	56	60.5 Å²	60.5	39%	0.392	31%	0.309	S	S	.	.			trans	-61.3	137.5	173.1	-55.5	0	0	0	0	111.3	Q505 D508	Q505-S546 PolarHBondContact NE2-O 2.97Å; D508-S546 WeakPolarHBondContact OD2-CB 3.23Å; D508-S546 PolarHBondContact OD2-N 3.43Å; D508-S546 PolarHBondContact OD2-OG 3.32Å
547	E	83.1	Confident	77.1	Confident	45 Å²	45	64 Å²	64	21%	0.21	35%	0.345	C	S	.	.			trans	-82.4	140.7	171.2	172.1	67.4	136.2	0	0	109.8	L419 M422 S423 R998	L419-E547 HydrophobicContact CD2-CB 4.13Å; M422-E547 HydrophobicContact CB-CB 4.35Å; S423-E547 PolarHBondContact OG-OE1 2.93Å; E547-R998 IonicContact OE1-CZ 2.79Å; E547-R998 IonicContact OE1-NH1 3.64Å; E547-R998 PolarHBondContact OE1-NH1 3.25Å; E547-R998 IonicContact OE1-NH2 2.75Å; E547-R998 PolarHBondContact OE1-NH2 3.24Å; E547-R998 IonicContact OE2-CZ 3.62Å; E547-R998 IonicContact OE2-NH1 2.64Å; E547-R998 PolarHBondContact OE2-NH1 3.19Å; E547-R998 IonicContact OE2-NH2 3.47Å
548	L	81.8	Confident	74.3	Confident	32 Å²	32	71.7 Å²	71.7	17%	0.168	38%	0.382	C	S	.	.			trans	-123.1	133.4	-176.5	-64.1	-178.7	0	0	0	111.1	P501 L502 Q505 N995	P501-L548 HydrophobicContact CB-CD2 3.78Å; L502-L548 HydrophobicContact CD2-CD1 3.73Å; L502-L548 HydrophobicContact CG-CD1 4.21Å; Q505-L548 HydrophobicContact CB-CD1 4Å; Q505-L548 HydrophobicContact CG-CD1 4.42Å; L548-N995 WeakPolarHBondContact CB-OD1 3.41Å; L548-N995 PolarHBondContact O-ND2 2.72Å
549	Q	75.4	Confident	71.9	Confident	141 Å²	141	78.3 Å²	78.3	66%	0.659	42%	0.417	S	S	*	.			trans	-121.2	136.3	-180	-61	-179.4	9.6	0	0	109.4
550	E	73.7	Confident	69.2	Low	116 Å²	116	86.5 Å²	86.5	54%	0.542	46%	0.456	S	S	.	.			trans	-93.9	108.2	175.9	-173.5	168.1	-172.3	0	0	109.6	H552	E550-H552 VanDerWaalsContact CD-CE1 3.41Å; E550-H552 PolarHBondContact O-N 3.26Å; E550-H552 IonicContact OE1-CE1 3.62Å; E550-H552 PolarHBondContact OE1-CE1 2.76Å; E550-H552 IonicContact OE1-ND1 2.78Å
551	T	72.6	Confident	66.4	Low	112 Å²	112	88.8 Å²	88.8	69%	0.687	48%	0.475	S	S	*	.			trans	-88.3	87.6	178.6	53.3	0	0	0	0	110.1	L553	T551-L553 PolarHBondContact O-N 3.38Å
552	H	66.6	Low	63.7	Low	141 Å²	141	96 Å²	96	65%	0.653	51%	0.512	S	S	*	.			trans	-64.7	105.2	165.6	-61	-55.2	0	0	0	109.2	E550 L554	E550-H552 VanDerWaalsContact CD-CE1 3.41Å; E550-H552 PolarHBondContact O-N 3.26Å; E550-H552 IonicContact OE1-CE1 3.62Å; E550-H552 PolarHBondContact OE1-CE1 2.76Å; E550-H552 IonicContact OE1-ND1 2.78Å; H552-L554 PolarHBondContact O-N 3.49Å
553	L	64.2	Low	60.7	Low	142 Å²	142	101.8 Å²	101.8	74%	0.743	55%	0.547	S	S	*	.			trans	-68.7	101	170.5	-63.5	178.7	0	0	0	108.4	T551 E555	T551-L553 PolarHBondContact O-N 3.38Å; L553-E555 PolarHBondContact O-N 3.3Å; L553-E555 VanDerWaalsContact O-N 3.07Å
554	L	45.4	Very low	57.8	Low	139 Å²	139	108 Å²	108	73%	0.728	58%	0.578	S	S	*	*			trans	-71.2	95.1	166.2	-75.1	169.2	0	0	0	108.2	H552 N556	H552-L554 PolarHBondContact O-N 3.49Å; L554-N556 PolarHBondContact O-N 3.47Å
555	E	45	Very low	55.1	Low	178 Å²	178	114.1 Å²	114.1	83%	0.832	62%	0.617	S	S	*	*			trans	-67.3	59.9	164.5	-76.8	-165.6	113.3	0	0	111	L553 G557	L553-E555 PolarHBondContact O-N 3.3Å; L553-E555 VanDerWaalsContact O-N 3.07Å; E555-G557 PolarHBondContact O-N 3.43Å
556	N	36.8	Very low	53.1	Low	128 Å²	128	116.7 Å²	116.7	68%	0.684	65%	0.645	S	S	*	*			trans	-78.4	57.5	172.5	-76.6	-17.2	0	0	0	110.6	L554 E558	L554-N556 PolarHBondContact O-N 3.47Å; N556-E558 PolarHBondContact O-N 3.46Å
557	G	43.3	Very low	51.1	Low	75 Å²	75	116.6 Å²	116.6	77%	0.773	64%	0.642	S	S	*	*	S	Bend	trans	76.4	14.6	154.4	0	0	0	0	0	119.4	E555	E555-G557 PolarHBondContact O-N 3.43Å
558	E	34.8	Very low	49.2	Very low	186 Å²	186	117.8 Å²	117.8	87%	0.869	65%	0.652	S	S	*	*	S	Bend	trans	-126	92	177.1	-70	-172.3	-161.5	0	0	113	N556 E560	N556-E558 PolarHBondContact O-N 3.46Å; E558-E560 PolarHBondContact O-N 2.92Å
559	D	43.9	Very low	47.6	Very low	140 Å²	140	120.7 Å²	120.7	75%	0.749	67%	0.667	S	S	*	*			trans	16.8	84.1	161.5	-70.1	-29.3	0	0	0	119.8	A561	D559-A561 HydrophobicContact CB-CB 4.46Å; D559-A561 PolarHBondContact O-N 3.11Å; D559-A561 VanDerWaalsContact O-N 3.11Å
560	E	39.1	Very low	46.2	Very low	172 Å²	172	116.6 Å²	116.6	80%	0.804	65%	0.652	S	S	*	*			trans	-79.8	66.4	144.3	-75.2	-146.2	168.4	0	0	110.2	E558 I562	E558-E560 PolarHBondContact O-N 2.92Å; E560-I562 PolarHBondContact O-N 2.69Å
561	A	37.2	Very low	45.2	Very low	49 Å²	49	115.3 Å²	115.3	41%	0.405	65%	0.652	S	S	.	*			trans	-66.6	105.4	177.5	0	0	0	0	0	110.8	D559 V563	D559-A561 HydrophobicContact CB-CB 4.46Å; D559-A561 PolarHBondContact O-N 3.11Å; D559-A561 VanDerWaalsContact O-N 3.11Å; A561-V563 VanDerWaalsContact O-CG2 3.26Å; A561-V563 WeakPolarHBondContact O-CG2 3.45Å; A561-V563 PolarHBondContact O-N 2.75Å
562	I	37.5	Very low	44	Very low	152 Å²	152	113.5 Å²	113.5	78%	0.779	64%	0.641	S	S	*	*			trans	-60.8	101.8	172	-58.7	176.2	0	0	0	108.8	E560 M564	E560-I562 PolarHBondContact O-N 2.69Å; I562-M564 PolarHBondContact O-N 2.94Å
563	V	32.4	Very low	42.9	Very low	123 Å²	123	112.4 Å²	112.4	75%	0.745	64%	0.639	S	S	*	*			trans	-74.1	84.6	-171.7	-172.8	0	0	0	0	111.5	A561	A561-V563 VanDerWaalsContact O-CG2 3.26Å; A561-V563 WeakPolarHBondContact O-CG2 3.45Å; A561-V563 PolarHBondContact O-N 2.75Å
564	M	34.5	Very low	41.9	Very low	134 Å²	134	111.6 Å²	111.6	66%	0.66	63%	0.631	S	S	*	*			trans	-93.4	131.8	157.2	-74.6	-70.1	101.9	0	0	109.7	I562 G566	I562-M564 PolarHBondContact O-N 2.94Å; M564-G566 PolarHBondContact O-N 3.28Å
565	P	34.5	Very low	41.6	Very low	129 Å²	129	111.9 Å²	111.9	84%	0.838	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	110.7	-174	-25.3	34.9	0	0	0	113.8
566	G	46.8	Very low	41.6	Very low	60 Å²	60	104.3 Å²	104.3	62%	0.619	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	104.5	2.3	160.9	0	0	0	0	0	117.9	M564	M564-G566 PolarHBondContact O-N 3.28Å
567	T	45.1	Very low	42.2	Very low	54 Å²	54	107.9 Å²	107.9	33%	0.331	61%	0.609	S	S	.	*			trans	-152.7	125.6	168.7	-65.6	0	0	0	0	110.3	I569 M588	T567-I569 HydrophobicContact CG2-CG1 4.2Å; T567-M588 HydrophobicContact CG2-CE 3.71Å
568	V	41.9	Very low	42.5	Very low	71 Å²	71	112.2 Å²	112.2	43%	0.43	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.7	132.9	173.3	178.5	0	0	0	0	108.5	H589	V568-H589 HydrophobicContact CB-CB 4.23Å; V568-H589 PolarHBondContact N-O 3.2Å; V568-H589 PolarHBondContact O-N 3.34Å
569	I	49	Very low	42.9	Very low	93 Å²	93	109.5 Å²	109.5	48%	0.477	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.1	111.1	177	-50.1	-176.5	0	0	0	107.1	T567 T571 V586 T587 M588	T567-I569 HydrophobicContact CG2-CG1 4.2Å; I569-T571 HydrophobicContact CG2-CG2 4.36Å; I569-V586 HydrophobicContact CG2-CG1 3.63Å; I569-T587 WeakPolarHBondContact CA-O 3.33Å; I569-M588 HydrophobicContact CB-SD 4.23Å; I569-M588 HydrophobicContact CD1-CE 3.82Å; I569-M588 HydrophobicContact CD1-SD 3.8Å; I569-M588 HydrophobicContact CG1-CE 3.85Å; I569-M588 HydrophobicContact CG1-SD 3.66Å; I569-M588 HydrophobicContact CG2-SD 3.78Å
570	T	46.6	Very low	42.8	Very low	55 Å²	55	112.2 Å²	112.2	34%	0.337	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	125.5	174.2	17.3	0	0	0	0	109.5	T587	T570-T587 PolarHBondContact N-O 3.27Å; T570-T587 PolarHBondContact O-N 3.01Å
571	T	51.1	Low	42.8	Very low	89 Å²	89	107 Å²	107	55%	0.546	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.7	109.6	177.8	54.6	0	0	0	0	109.7	I569 L585 V586	I569-T571 HydrophobicContact CG2-CG2 4.36Å; T571-L585 WeakPolarHBondContact CA-O 3.34Å; T571-V586 HydrophobicContact CG2-CG1 4.21Å; T571-V586 HydrophobicContact CG2-CG2 4.12Å
572	T	47.4	Very low	42.9	Very low	73 Å²	73	109.8 Å²	109.8	45%	0.448	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.4	144.9	177.9	47.9	0	0	0	0	110.6	L585	T572-L585 PolarHBondContact N-O 3.03Å; T572-L585 PolarHBondContact O-N 2.94Å
573	L	44.3	Very low	43.1	Very low	118 Å²	118	108.9 Å²	108.9	62%	0.618	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.3	113.8	172.8	-74.9	165.6	0	0	0	108.8	E582 Y583 V584	L573-E582 HydrophobicContact CD2-CB 4.13Å; L573-Y583 WeakPolarHBondContact CA-O 3.49Å; L573-V584 HydrophobicContact CD2-CG2 3.66Å
574	E	43.3	Very low	43.5	Very low	126 Å²	126	107.5 Å²	107.5	59%	0.589	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.9	133	179.3	-168	169.4	-150.3	0	0	110.3	Y583	E574-Y583 PolarHBondContact N-O 3.25Å; E574-Y583 PolarHBondContact O-N 3.06Å
575	K	39	Very low	43.8	Very low	145 Å²	145	105.3 Å²	105.3	63%	0.63	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.6	125.8	-178.6	-74.9	-174.6	175	-172.7	0	110.7	E582	K575-E582 HydrophobicContact CD-CG 4.4Å; K575-E582 WeakPolarHBondContact CE-OE1 3.47Å; K575-E582 HydrophobicContact CG-CG 3.72Å; K575-E582 IonicContact NZ-OE1 2.69Å; K575-E582 PolarHBondContact NZ-OE1 3.28Å; K575-E582 VanDerWaalsContact NZ-OE1 3.12Å
576	G	46.1	Very low	44.2	Very low	19 Å²	19	103.2 Å²	103.2	20%	0.196	55%	0.55	C	S	.	.			trans	-66.6	133	175.1	0	0	0	0	0	112.7	I578 E579 S581	G576-I578 PolarHBondContact O-N 3.1Å; G576-E579 CarbonylContact C-O 3.55Å; G576-E579 VanDerWaalsContact O-O 3.08Å; G576-S581 PolarHBondContact N-O 3.43Å; G576-S581 VanDerWaalsContact N-O 3.1Å
577	E	48.1	Very low	44.3	Very low	203 Å²	203	102.8 Å²	102.8	95%	0.949	54%	0.535	S	S	*	.	S	Bend	trans	-71.6	-12.4	177.6	-62.8	-170.6	131.7	0	0	114.2
578	I	49.9	Very low	44.1	Very low	165 Å²	165	105.7 Å²	105.7	85%	0.846	55%	0.547	S	S	*	.	S	Bend	trans	-114.9	-32.9	-170.1	-58.4	178.5	0	0	0	112.4	G576	G576-I578 PolarHBondContact O-N 3.1Å
579	E	42.2	Very low	44.3	Very low	130 Å²	130	107.4 Å²	107.4	61%	0.607	55%	0.55	S	S	*	.	S	Bend	trans	-132.7	130.2	166.8	-64.9	-173.6	163.7	0	0	106.4	G576 S581	G576-E579 CarbonylContact C-O 3.55Å; G576-E579 VanDerWaalsContact O-O 3.08Å; E579-S581 PolarHBondContact O-N 3.08Å
580	E	42.2	Very low	43.8	Very low	197 Å²	197	113.6 Å²	113.6	92%	0.921	57%	0.567	S	S	*	*			trans	-72.3	36.5	-172.7	-57.8	174.3	142.6	0	0	113.5
581	S	39.9	Very low	43.2	Very low	61 Å²	61	117.2 Å²	117.2	43%	0.427	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-92.7	141.2	174.7	-59.3	0	0	0	0	110	G576 E579	G576-S581 PolarHBondContact N-O 3.43Å; G576-S581 VanDerWaalsContact N-O 3.1Å; E579-S581 PolarHBondContact O-N 3.08Å
582	E	38.2	Very low	42.5	Very low	108 Å²	108	122.6 Å²	122.6	51%	0.505	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.1	120.7	173.8	-69.4	162.6	-179.4	0	0	109.2	L573 K575	L573-E582 HydrophobicContact CD2-CB 4.13Å; K575-E582 HydrophobicContact CD-CG 4.4Å; K575-E582 WeakPolarHBondContact CE-OE1 3.47Å; K575-E582 HydrophobicContact CG-CG 3.72Å; K575-E582 IonicContact NZ-OE1 2.69Å; K575-E582 PolarHBondContact NZ-OE1 3.28Å; K575-E582 VanDerWaalsContact NZ-OE1 3.12Å
583	Y	43.3	Very low	41.6	Very low	133 Å²	133	124 Å²	124	52%	0.522	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.8	131.6	176.2	-67.8	-85.4	0	0	0	109.9	L573 E574 L585	L573-Y583 WeakPolarHBondContact CA-O 3.49Å; E574-Y583 PolarHBondContact N-O 3.25Å; E574-Y583 PolarHBondContact O-N 3.06Å; Y583-L585 PolarHBondContact O-N 3.44Å
584	V	40.2	Very low	40.8	Very low	94 Å²	94	124 Å²	124	57%	0.57	62%	0.623	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.9	105.1	171.5	-177.7	0	0	0	0	109	L573 V586	L573-V584 HydrophobicContact CD2-CG2 3.66Å; V584-V586 HydrophobicContact CG1-CG2 3.95Å
585	L	41.7	Very low	40.2	Very low	89 Å²	89	126.4 Å²	126.4	47%	0.466	64%	0.639	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.5	110.6	174.7	-160.2	78.1	0	0	0	109.6	T571 T572 Y583	T571-L585 WeakPolarHBondContact CA-O 3.34Å; T572-L585 PolarHBondContact N-O 3.03Å; T572-L585 PolarHBondContact O-N 2.94Å; Y583-L585 PolarHBondContact O-N 3.44Å
586	V	42.3	Very low	39.6	Very low	84 Å²	84	126.7 Å²	126.7	51%	0.509	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.6	107.4	-177.4	-173	0	0	0	0	110.3	I569 T571 V584 M588	I569-V586 HydrophobicContact CG2-CG1 3.63Å; T571-V586 HydrophobicContact CG2-CG1 4.21Å; T571-V586 HydrophobicContact CG2-CG2 4.12Å; V584-V586 HydrophobicContact CG1-CG2 3.95Å; V586-M588 HydrophobicContact CG1-SD 4.33Å
587	T	49.4	Very low	38.6	Very low	52 Å²	52	133.7 Å²	133.7	32%	0.319	67%	0.672	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.2	121.6	-176	-44.6	0	0	0	0	111	I569 T570 H589	I569-T587 WeakPolarHBondContact CA-O 3.33Å; T570-T587 PolarHBondContact N-O 3.27Å; T570-T587 PolarHBondContact O-N 3.01Å; T587-H589 WeakPolarHBondContact CG2-NE2 3.25Å
588	M	40.3	Very low	37.5	Very low	115 Å²	115	131.2 Å²	131.2	57%	0.567	66%	0.658	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103	100.7	-171.6	-65.1	-65.6	-60.3	0	0	111.9	T567 I569 V586 R590	T567-M588 HydrophobicContact CG2-CE 3.71Å; I569-M588 HydrophobicContact CB-SD 4.23Å; I569-M588 HydrophobicContact CD1-CE 3.82Å; I569-M588 HydrophobicContact CD1-SD 3.8Å; I569-M588 HydrophobicContact CG1-CE 3.85Å; I569-M588 HydrophobicContact CG1-SD 3.66Å; I569-M588 HydrophobicContact CG2-SD 3.78Å; V586-M588 HydrophobicContact CG1-SD 4.33Å; M588-R590 PolarHBondContact O-N 3.48Å
589	H	46.6	Very low	36.3	Very low	107 Å²	107	130.7 Å²	130.7	50%	0.495	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.2	104.1	179.5	-73	-92.4	0	0	0	111.8	V568 T587 N591	V568-H589 HydrophobicContact CB-CB 4.23Å; V568-H589 PolarHBondContact N-O 3.2Å; V568-H589 PolarHBondContact O-N 3.34Å; T587-H589 WeakPolarHBondContact CG2-NE2 3.25Å; H589-N591 PolarHBondContact O-N 2.82Å
590	R	37.7	Very low	35.5	Very low	223 Å²	223	130.3 Å²	130.3	84%	0.842	66%	0.664	S	S	*	*			trans	-86.6	102.8	176.1	-116.8	-179.6	175.9	172.4	-0.6	110.8	M588	M588-R590 PolarHBondContact O-N 3.48Å
591	N	34.5	Very low	34.9	Very low	131 Å²	131	130 Å²	130	70%	0.701	66%	0.662	S	S	*	*			trans	-74.3	146.4	178.9	-155	-13.6	0	0	0	111.4	H589	H589-N591 PolarHBondContact O-N 2.82Å
592	K	36.6	Very low	34.3	Very low	201 Å²	201	135.6 Å²	135.6	87%	0.874	68%	0.681	S	S	*	*			trans	-138.4	29.9	-161.8	-132.5	-171.2	-174.6	-171.6	0	115.7
593	S	28.5	Very low	33.8	Very low	103 Å²	103	137 Å²	137	72%	0.72	69%	0.691	S	S	*	*			trans	-157.7	117.7	175.2	50.7	0	0	0	0	113.4
594	S	26.3	Very low	33	Very low	118 Å²	118	141.5 Å²	141.5	83%	0.825	71%	0.707	S	S	*	*			trans	-160.8	65.9	165.3	65.3	0	0	0	0	112.2
595	L	31.1	Very low	32.6	Very low	176 Å²	176	143.2 Å²	143.2	92%	0.921	72%	0.718	S	S	*	*			trans	-138	128.8	162	-75.3	179.3	0	0	0	109.5
596	L	27	Very low	32.2	Very low	151 Å²	151	144.4 Å²	144.4	79%	0.791	73%	0.731	S	S	*	*			trans	-80.3	167.6	168	-61.6	161.6	0	0	0	108.3
597	F	24.7	Very low	31.4	Very low	166 Å²	166	145.7 Å²	145.7	73%	0.728	74%	0.744	S	S	*	*			cis	-160.5	154.2	31.7	-133.9	-70.1	0	0	0	111.6
598	K	25.5	Very low	30.5	Very low	151 Å²	151	148.2 Å²	148.2	66%	0.657	76%	0.763	S	S	*	*			trans	62.9	119.7	153.2	-103.2	173.3	-178	-92.4	0	123.3
599	E	25	Very low	29.7	Very low	155 Å²	155	150 Å²	150	72%	0.724	78%	0.775	S	S	*	*				43.1	121.2	124.6	-65.2	171.6	165.5	0	0	122
600	S	25.6	Very low	28.9	Very low	122 Å²	122	150 Å²	150	85%	0.853	79%	0.785	S	S	*	*				-155.9	147.9	106	58.9	0	0	0	0	112.2
601	E	28	Very low	28.7	Very low	189 Å²	189	147.6 Å²	147.6	88%	0.883	78%	0.781	S	S	*	*			trans	-90.7	147.8	161.8	-63.3	-173.7	109.2	0	0	109.4
602	E	27.3	Very low	28.3	Very low	179 Å²	179	151.9 Å²	151.9	84%	0.836	79%	0.789	S	S	*	*			trans	-163.4	111.8	134.4	-116	-178.1	179	0	0	114.9
603	I	28.3	Very low	28	Very low	139 Å²	139	147.6 Å²	147.6	71%	0.713	78%	0.783	S	S	*	*				44.6	110.1	128.9	-57	178.5	0	0	0	120.1
604	R	27.4	Very low	27.9	Very low	226 Å²	226	147.5 Å²	147.5	85%	0.853	78%	0.782	S	S	*	*			trans	55.3	105.2	144.1	-66.5	178.4	174.2	165.2	-0.4	121
605	T	31.3	Very low	28.1	Very low	130 Å²	130	151.1 Å²	151.1	80%	0.798	79%	0.785	S	S	*	*				22.2	138.9	122.7	60.6	0	0	0	0	120.1
606	P	32	Very low	28.4	Very low	114 Å²	114	148.5 Å²	148.5	74%	0.74	78%	0.779	S	S	*	*				-136.8	161.2	112.6	39.3	-31.6	0	0	0	116.1
607	S	26.3	Very low	28.7	Very low	112 Å²	112	149.6 Å²	149.6	78%	0.783	79%	0.785	S	S	*	*			trans	54.3	121.1	152.6	56.8	0	0	0	0	120.9
608	C	29.8	Very low	28.9	Very low	105 Å²	105	150.2 Å²	150.2	71%	0.709	80%	0.795	S	S	*	*			trans	-62	155	165.4	55.9	0	0	0	0	114.5
609	N	24.7	Very low	29	Very low	153 Å²	153	146.1 Å²	146.1	82%	0.818	80%	0.796	S	S	*	*				-170.8	139.8	104.1	-100.1	-56.2	0	0	0	116
610	C	30	Very low	29.5	Very low	107 Å²	107	147.8 Å²	147.8	72%	0.723	80%	0.804	S	S	*	*			trans	-35.8	149.6	166.6	-151.3	0	0	0	0	114.3
611	K	32.5	Very low	29.5	Very low	172 Å²	172	150 Å²	150	75%	0.748	81%	0.806	S	S	*	*				-163.4	163.4	61.6	-76.4	163.6	-174.2	175.6	0	112.5
612	Y	27.1	Very low	29.3	Very low	221 Å²	221	147.1 Å²	147.1	87%	0.867	80%	0.801	S	S	*	*	S	Bend	trans	63.9	133.3	-169.6	-47.1	-82.8	0	0	0	112.7
613	C	29.8	Very low	29.2	Very low	111 Å²	111	146.8 Å²	146.8	75%	0.75	80%	0.799	S	S	*	*			cis	171.9	149.7	-8.6	-96.1	0	0	0	0	102.9
614	S	26.7	Very low	28.9	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	80%	0.798	S	S	*	*			cis	177.9	106.4	-29.7	39.9	0	0	0	0	105.9
615	H	30.8	Very low	28.7	Very low	194 Å²	194	142.2 Å²	142.2	90%	0.898	79%	0.792	S	S	*	*			trans	-71.3	154.7	167.4	-78	-93.4	0	0	0	110.4
616	P	36.8	Very low	28.4	Very low	121 Å²	121	140.7 Å²	140.7	79%	0.786	79%	0.786	S	S	*	*			trans	-121.6	143.9	140.5	34.9	-27.1	0	0	0	112.1
617	L	33.5	Very low	28.2	Very low	174 Å²	174	143 Å²	143	91%	0.911	79%	0.787	S	S	*	*			trans	-84.1	169.8	159.6	-67.7	161.7	0	0	0	109
618	L	29.4	Very low	28.2	Very low	179 Å²	179	143.9 Å²	143.9	94%	0.937	78%	0.779	S	S	*	*			trans	-115.7	134.4	166.3	-161.5	72.7	0	0	0	110.9
619	G	26.9	Very low	28.1	Very low	66 Å²	66	144.9 Å²	144.9	68%	0.68	77%	0.773	S	S	*	*			trans	-144.1	173.2	171.2	0	0	0	0	0	109.6
620	Q	35.2	Very low	28.4	Very low	190 Å²	190	146 Å²	146	89%	0.888	77%	0.766	S	S	*	*			trans	-66.9	142.1	-178.1	-63.6	172.5	-19.2	0	0	112.5
621	N	25.2	Very low	28.3	Very low	168 Å²	168	148.2 Å²	148.2	90%	0.898	77%	0.765	S	S	*	*			trans	-171.5	170.7	131.5	-104.9	-48.8	0	0	0	113.5
622	V	25.3	Very low	28	Very low	128 Å²	128	148 Å²	148	78%	0.776	77%	0.773	S	S	*	*			trans	-102	175.5	174.9	175.1	0	0	0	0	109.3
623	E	25.1	Very low	28.1	Very low	173 Å²	173	141.7 Å²	141.7	81%	0.808	77%	0.766	S	S	*	*			trans	81.9	148.3	176.7	-57.6	-159.5	143.4	0	0	116.3
624	N	22.2	Very low	28.1	Very low	128 Å²	128	145.7 Å²	145.7	68%	0.684	77%	0.774	S	S	*	*			cis	-172.3	165	-36.5	-120.7	-38.1	0	0	0	107.8
625	I	22.5	Very low	28	Very low	141 Å²	141	148.1 Å²	148.1	72%	0.723	78%	0.779	S	S	*	*			trans	64	102.4	158	-64.4	160.6	0	0	0	115.6
626	S	24.4	Very low	27.7	Very low	97 Å²	97	143.6 Å²	143.6	68%	0.678	77%	0.769	S	S	*	*				68.8	139.8	101	112	0	0	0	0	114.8
627	Q	28.5	Very low	27.4	Very low	162 Å²	162	143.7 Å²	143.7	76%	0.757	77%	0.773	S	S	*	*			cis	-162	175.1	32.7	-124.3	177.4	-4.4	0	0	107.9
628	Q	26.7	Very low	27.2	Very low	131 Å²	131	143.9 Å²	143.9	61%	0.612	77%	0.766	S	S	*	*			cis	-156.9	174.8	5.1	-154.6	171.2	-112.4	0	0	109.5
629	E	27.4	Very low	27.1	Very low	126 Å²	126	142.8 Å²	142.8	59%	0.589	76%	0.756	S	S	*	*			trans	78.7	133.1	151.7	-86.1	176.6	-119.3	0	0	120.6
630	R	29.8	Very low	27.2	Very low	176 Å²	176	146.6 Å²	146.6	66%	0.664	76%	0.76	S	S	*	*			cis	-157.4	130.3	0.1	-171	-178.3	-76	-111.9	7.1	111.7
631	E	28.8	Very low	26.9	Very low	154 Å²	154	143.8 Å²	143.8	72%	0.72	75%	0.751	S	S	*	*			trans	40.8	145.2	147.4	-55.4	166.2	133.5	0	0	119.2
632	D	25.7	Very low	26.9	Very low	168 Å²	168	139.5 Å²	139.5	90%	0.898	75%	0.747	S	S	*	*			cis	-112.6	167.7	36.6	-77.3	-50.7	0	0	0	116.3
633	A	30.6	Very low	27.2	Very low	89 Å²	89	139.5 Å²	139.5	74%	0.736	74%	0.741	S	S	*	*			trans	-147.3	157.5	-175	0	0	0	0	0	113
634	Q	29.1	Very low	27.4	Very low	195 Å²	195	135.4 Å²	135.4	91%	0.911	73%	0.731	S	S	*	*			trans	-160.9	142	138.7	-113.3	165.6	46.5	0	0	116
635	N	24.8	Very low	27.8	Very low	150 Å²	150	135.9 Å²	135.9	80%	0.802	73%	0.734	S	S	*	*			trans	-47.9	176.8	173.9	-71.2	-42.7	0	0	0	118.4
636	S	24.7	Very low	27.9	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	74%	0.743	S	S	*	*			cis	175.7	147.6	-36	66.6	0	0	0	0	109.6
637	S	29.2	Very low	28.1	Very low	123 Å²	123	138.7 Å²	138.7	86%	0.86	74%	0.743	S	S	*	*			trans	159.4	162.5	162.4	40.2	0	0	0	0	111.3
638	K	30.7	Very low	28	Very low	179 Å²	179	142.4 Å²	142.4	78%	0.778	75%	0.75	S	S	*	*			cis	-166.3	170.1	-44.7	-140.9	-175.5	-178.3	-170.1	0	108.9
639	E	25.8	Very low	27.9	Very low	155 Å²	155	143.7 Å²	143.7	72%	0.724	76%	0.758	S	S	*	*			trans	72.2	130.5	169.8	-73.5	151.4	-153.1	0	0	116.2
640	L	29.9	Very low	27.7	Very low	146 Å²	146	144.9 Å²	144.9	76%	0.764	77%	0.767	S	S	*	*			cis	79.3	141.6	40.2	-57.2	168.6	0	0	0	112.3
641	L	29.1	Very low	27.7	Very low	131 Å²	131	141.3 Å²	141.3	69%	0.686	77%	0.769	S	S	*	*			cis	-161.2	172.5	-4.3	-127.5	172.4	0	0	0	111.3	I643	L641-I643 HydrophobicContact CD1-CD1 4.01Å; L641-I643 HydrophobicContact CD2-CB 4.34Å; L641-I643 HydrophobicContact CD2-CD1 3.74Å; L641-I643 HydrophobicContact CD2-CG1 3.78Å
642	G	25.6	Very low	28.1	Very low	79 Å²	79	139.6 Å²	139.6	81%	0.814	77%	0.771	S	S	*	*			trans	-161.2	78	170.6	0	0	0	0	0	113.1
643	I	30.5	Very low	28.1	Very low	127 Å²	127	136.1 Å²	136.1	65%	0.651	76%	0.761	S	S	*	*			trans	-95.2	139.7	-178.7	-98.5	165.9	0	0	0	108.9	L641	L641-I643 HydrophobicContact CD1-CD1 4.01Å; L641-I643 HydrophobicContact CD2-CB 4.34Å; L641-I643 HydrophobicContact CD2-CD1 3.74Å; L641-I643 HydrophobicContact CD2-CG1 3.78Å
644	S	29.7	Very low	27.8	Very low	88 Å²	88	139.2 Å²	139.2	62%	0.615	77%	0.765	S	S	*	*			cis	104	144	36.7	90.7	0	0	0	0	113.6
645	D	29.3	Very low	27.4	Very low	137 Å²	137	135.1 Å²	135.1	73%	0.733	76%	0.756	S	S	*	*			trans	133.1	122.7	149.5	-71.5	11.3	0	0	0	115.3
646	E	25.4	Very low	27.4	Very low	194 Å²	194	135.6 Å²	135.6	91%	0.907	75%	0.754	S	S	*	*				-160.5	-178.6	104.4	-126.3	-169.9	150.3	0	0	110.9
647	C	28.4	Very low	27.3	Very low	103 Å²	103	138.4 Å²	138.4	70%	0.696	76%	0.756	S	S	*	*			trans	-139.2	178.7	-154.3	-56.6	0	0	0	0	116.1
648	R	26	Very low	27.1	Very low	240 Å²	240	140.2 Å²	140.2	91%	0.906	75%	0.751	S	S	*	*			trans	86.3	163	160.1	-60.8	176	179.7	179.2	0.8	117.9
649	M	24.7	Very low	26.9	Very low	158 Å²	158	138 Å²	138	78%	0.778	75%	0.747	S	S	*	*			cis	169.7	139.6	-45.9	-103.6	-71.8	-132.7	0	0	109.6
650	I	23.9	Very low	26.9	Very low	151 Å²	151	134.6 Å²	134.6	77%	0.774	75%	0.746	S	S	*	*			trans	74.8	147.7	154.5	-65.3	162.1	0	0	0	118.9
651	S	30.6	Very low	26.8	Very low	101 Å²	101	134.2 Å²	134.2	71%	0.706	75%	0.749	S	S	*	*			trans	-112.5	172.7	-176.3	53.7	0	0	0	0	113.6
652	P	36.2	Very low	26.8	Very low	118 Å²	118	135.2 Å²	135.2	77%	0.766	76%	0.756	S	S	*	*			trans	-139.4	-169.8	134.8	16.7	6.8	0	0	0	111.7
653	S	26.5	Very low	27	Very low	96 Å²	96	136.1 Å²	136.1	67%	0.671	75%	0.745	S	S	*	*				179.6	131.4	-55.8	59.8	0	0	0	0	109.8
654	D	23.6	Very low	26.9	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	75%	0.75	S	S	*	*			trans	63	160.8	156.7	-60.5	-33	0	0	0	123.2
655	C	21.5	Very low	27.1	Very low	109 Å²	109	139.6 Å²	139.6	74%	0.736	75%	0.746	S	S	*	*			trans	78.9	121	163.8	-63.3	0	0	0	0	120.9
656	Q	23.5	Very low	27	Very low	161 Å²	161	140.9 Å²	140.9	75%	0.752	74%	0.742	S	S	*	*			trans	49.2	122.3	134.1	-67.8	-173.5	-87.7	0	0	120
657	E	23.1	Very low	27.1	Very low	158 Å²	158	139.2 Å²	139.2	74%	0.738	73%	0.727	S	S	*	*				106.6	156	60.9	-167.7	165	-149.3	0	0	109.8
658	E	25.6	Very low	27.2	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	72%	0.721	S	S	*	*			trans	71.3	124.7	-179.4	-65.8	-139.3	112.3	0	0	120.4
659	N	25.3	Very low	27.3	Very low	133 Å²	133	135.7 Å²	135.7	71%	0.711	71%	0.711	S	S	*	*			trans	57.3	137.7	131.6	-55.1	-28	0	0	0	122.3
660	A	27.2	Very low	27.3	Very low	84 Å²	84	135.4 Å²	135.4	69%	0.694	71%	0.712	S	S	*	*			cis	-170.7	174.8	-9.5	0	0	0	0	0	112.1
661	V	27.4	Very low	27.5	Very low	138 Å²	138	138.9 Å²	138.9	84%	0.836	72%	0.716	S	S	*	*			trans	78.1	91.7	162.1	-162.4	0	0	0	0	118.7
662	D	29	Very low	27.3	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	72%	0.719	S	S	*	*			trans	-96.3	158.3	140.4	171.2	41	0	0	0	109.6
663	V	30.6	Very low	26.8	Very low	97 Å²	97	140 Å²	140	59%	0.588	72%	0.72	S	S	*	*			trans	173.3	129.9	166.5	135.1	0	0	0	0	107.8
664	K	26.6	Very low	26.9	Very low	174 Å²	174	143.3 Å²	143.3	76%	0.757	73%	0.729	S	S	*	*			cis	-153.2	124.5	48	-130.3	143.5	-173.2	173.7	0	108.4
665	Q	34.3	Very low	27.1	Very low	115 Å²	115	143.2 Å²	143.2	54%	0.537	73%	0.729	S	S	.	*			cis	81.7	122.7	48.8	-154.7	-177.4	38.7	0	0	112
666	Y	26.9	Very low	27.4	Very low	164 Å²	164	143.1 Å²	143.1	64%	0.643	74%	0.736	S	S	*	*				-169.4	154.8	76.5	-98.8	-109.6	0	0	0	110
667	R	29.2	Very low	27.6	Very low	159 Å²	159	144.9 Å²	144.9	60%	0.6	74%	0.741	S	S	*	*			cis	-175.9	151.5	-15	-131.4	-160.5	-166.9	163.2	7.1	113.3
668	D	29.3	Very low	27.9	Very low	104 Å²	104	145.1 Å²	145.1	56%	0.556	75%	0.746	S	S	*	*			trans	52.1	149.7	138.7	-71.9	7.2	0	0	0	123
669	K	28.2	Very low	27.9	Very low	164 Å²	164	145.4 Å²	145.4	71%	0.713	75%	0.748	S	S	*	*			cis	-167.5	174.6	8.4	-124.7	166.9	-176.2	127.8	0	115.3
670	L	25.3	Very low	27.8	Very low	152 Å²	152	144.9 Å²	144.9	80%	0.796	75%	0.749	S	S	*	*			trans	82.7	122.6	170.1	-62.7	143.3	0	0	0	115.5
671	R	27.8	Very low	27.7	Very low	224 Å²	224	147.5 Å²	147.5	85%	0.845	76%	0.756	S	S	*	*				78.8	133.8	63	-81.2	-163.7	177.1	-172.1	-0.7	113.4
672	T	25.8	Very low	27.5	Very low	127 Å²	127	146.8 Å²	146.8	78%	0.779	75%	0.752	S	S	*	*			cis	-155.1	170.7	13.9	-14.4	0	0	0	0	113.1
673	C	25.4	Very low	27.2	Very low	117 Å²	117	145 Å²	145	79%	0.791	75%	0.75	S	S	*	*			trans	-76.3	171.3	-178.9	-47.4	0	0	0	0	114.3
674	L	29.1	Very low	26.8	Very low	165 Å²	165	147.7 Å²	147.7	86%	0.864	77%	0.767	S	S	*	*				-162.4	171.6	59.3	-104.9	172.3	0	0	0	114.7
675	D	27.8	Very low	26.8	Very low	150 Å²	150	143.2 Å²	143.2	80%	0.802	77%	0.771	S	S	*	*			trans	-74.3	155.1	-176.7	-57.6	-87.4	0	0	0	117.4
676	A	27.6	Very low	26.4	Very low	107 Å²	107	142.9 Å²	142.9	88%	0.884	78%	0.781	S	S	*	*				-173.2	165.9	124	0	0	0	0	0	112
677	K	29.1	Very low	26.3	Very low	199 Å²	199	140.4 Å²	140.4	87%	0.865	78%	0.783	S	S	*	*			trans	-134.9	125.2	-175.6	173	-170.8	-178.7	-177.9	0	110.5
678	L	29.2	Very low	26.9	Very low	163 Å²	163	137.3 Å²	137.3	85%	0.853	78%	0.783	S	S	*	*			trans	-171.3	162.7	150.1	-107.2	168	0	0	0	113.9
679	E	24.7	Very low	26.7	Very low	166 Å²	166	139.6 Å²	139.6	78%	0.776	80%	0.8	S	S	*	*			trans	-44.8	162.6	176	-155	164.1	-129	0	0	119.1
680	T	23.6	Very low	26.6	Very low	121 Å²	121	137.2 Å²	137.2	74%	0.742	80%	0.795	S	S	*	*			trans	88.6	153.3	155.4	-18.6	0	0	0	0	120.4
681	V	26	Very low	26.7	Very low	139 Å²	139	139.7 Å²	139.7	84%	0.842	80%	0.8	S	S	*	*			trans	83.6	145.6	166	-170.7	0	0	0	0	117
682	V	22.1	Very low	26.5	Very low	123 Å²	123	134.6 Å²	134.6	75%	0.745	80%	0.797	S	S	*	*			trans	-124.2	139.4	-165.5	167.4	0	0	0	0	110.3
683	C	22.9	Very low	26.3	Very low	114 Å²	114	132.9 Å²	132.9	77%	0.77	80%	0.796	S	S	*	*			trans	48	133.7	162	-65.5	0	0	0	0	121.2
684	T	22.5	Very low	26.3	Very low	155 Å²	155	135.2 Å²	135.2	95%	0.951	80%	0.8	S	S	*	*				-175.6	160.7	127.7	17.3	0	0	0	0	109.6
685	G	26	Very low	26.2	Very low	80 Å²	80	132.3 Å²	132.3	83%	0.825	79%	0.793	S	S	*	*			trans	132.6	50.3	166.4	0	0	0	0	0	118.7
686	S	26.6	Very low	26.2	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	80%	0.795	S	S	*	*			trans	-102.3	-161	151.7	53.8	0	0	0	0	109.3
687	V	25.2	Very low	26.1	Very low	113 Å²	113	133.6 Å²	133.6	69%	0.685	79%	0.787	S	S	*	*			trans	75.5	151.8	167.3	178.2	0	0	0	0	114.3
688	P	41.3	Very low	25.8	Very low	93 Å²	93	127.5 Å²	127.5	60%	0.604	78%	0.781	S	S	*	*			cis	-122.2	155.3	-0.9	21.6	0.3	0	0	0	116.6	D690	P688-D690 WeakPolarHBondContact CB-OD2 3.41Å
689	V	25.2	Very low	25.6	Very low	153 Å²	153	127.2 Å²	127.2	93%	0.927	78%	0.779	S	S	*	*				-132.5	112.2	108.3	177.8	0	0	0	0	107.5
690	D	24.9	Very low	25.6	Very low	113 Å²	113	127.1 Å²	127.1	60%	0.604	78%	0.779	S	S	*	*			trans	-84.2	147.4	-179.2	-56.5	-75.8	0	0	0	112.9	P688	P688-D690 WeakPolarHBondContact CB-OD2 3.41Å
691	K	27.6	Very low	26.1	Very low	204 Å²	204	126.3 Å²	126.3	89%	0.887	78%	0.776	S	S	*	*				-168.2	150.8	110.2	-104.3	161.8	-174	173.9	0	115.6
692	C	23.6	Very low	26	Very low	117 Å²	117	125.3 Å²	125.3	79%	0.791	77%	0.77	S	S	*	*			trans	-44.4	141.3	179	-45.9	0	0	0	0	114
693	A	22	Very low	26	Very low	91 Å²	91	127.8 Å²	127.8	75%	0.752	77%	0.773	S	S	*	*			cis	75.6	116.8	40.1	0	0	0	0	0	115.2
694	L	25.3	Very low	26.1	Very low	167 Å²	167	130.7 Å²	130.7	87%	0.874	78%	0.776	S	S	*	*			trans	-164.3	158.8	149.8	-138.6	77.8	0	0	0	109.8
695	S	27	Very low	26.1	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	76%	0.763	S	S	*	*			trans	59.6	143.6	176.4	63.1	0	0	0	0	117.7
696	E	27.8	Very low	25.8	Very low	181 Å²	181	134.9 Å²	134.9	85%	0.846	76%	0.762	S	S	*	*			cis	-164.2	164.8	-32.6	-124.4	161.1	171.3	0	0	109.4
697	S	25.3	Very low	25.6	Very low	102 Å²	102	137.7 Å²	137.7	71%	0.713	76%	0.763	S	S	*	*			trans	-19.4	143.8	165.3	50.8	0	0	0	0	118.2
698	G	22.7	Very low	25.5	Very low	71 Å²	71	136.6 Å²	136.6	73%	0.732	76%	0.761	S	S	*	*			cis	89.1	97.2	13.2	0	0	0	0	0	113.8
699	L	25.2	Very low	24.8	Very low	157 Å²	157	139.1 Å²	139.1	82%	0.822	76%	0.764	S	S	*	*			trans	-166.8	161	-180	-84.2	179.2	0	0	0	108.1
700	E	25.5	Very low	24.9	Very low	165 Å²	165	138.9 Å²	138.9	77%	0.771	75%	0.751	S	S	*	*			cis	-164.6	-159.2	-30.8	-134.1	-158.8	179.9	0	0	110
701	P	34.5	Very low	25	Very low	104 Å²	104	139.5 Å²	139.5	68%	0.675	75%	0.753	S	S	*	*			trans	-135.1	-109.6	-135.1	44.3	-19.3	0	0	0	116.4
702	T	22.5	Very low	25	Very low	118 Å²	118	136 Å²	136	72%	0.724	74%	0.743	S	S	*	*			trans	-86.7	-170.9	-164.5	-37.6	0	0	0	0	113.6
703	E	23.4	Very low	25.2	Very low	174 Å²	174	136.3 Å²	136.3	81%	0.813	74%	0.738	S	S	*	*			trans	-44.2	146	173.1	-54.9	167.5	115.2	0	0	115.4
704	E	24.2	Very low	25.6	Very low	176 Å²	176	136.4 Å²	136.4	82%	0.822	73%	0.733	S	S	*	*				-174	161	108	-112.7	-158.9	-144.4	0	0	116.5
705	T	22.4	Very low	25.8	Very low	110 Å²	110	134.1 Å²	134.1	68%	0.675	72%	0.721	S	S	*	*			trans	62.1	134.3	144.2	-67.7	0	0	0	0	124
706	W	20.6	Very low	25.9	Very low	212 Å²	212	133.8 Å²	133.8	80%	0.803	72%	0.719	S	S	*	*			trans	-64.4	157.7	180	-68.5	36.7	0	0	0	116.9
707	Q	21.5	Very low	26.2	Very low	167 Å²	167	132.7 Å²	132.7	78%	0.78	71%	0.713	S	S	*	*			trans	64.5	159.1	145.6	-79.1	-169.7	17.6	0	0	117.8
708	S	22.9	Very low	26.6	Very low	90 Å²	90	134.2 Å²	134.2	63%	0.629	72%	0.719	S	S	*	*			cis	-170.9	173.4	-24.5	-167.9	0	0	0	0	107.1
709	E	26.6	Very low	26.9	Very low	145 Å²	145	134.1 Å²	134.1	68%	0.678	72%	0.718	S	S	*	*			trans	67.1	153	160.8	-67.1	-156.9	141.7	0	0	116.2
710	K	27.8	Very low	27.2	Very low	148 Å²	148	136.6 Å²	136.6	64%	0.643	72%	0.722	S	S	*	*			cis	-169.7	159.9	1.2	-110.7	174.3	176.9	139.8	0	105.8
711	L	27.2	Very low	27.3	Very low	126 Å²	126	133.3 Å²	133.3	66%	0.66	72%	0.723	S	S	*	*			cis	-158.7	145.6	4.9	-101.2	-177.9	0	0	0	109.2
712	L	28.1	Very low	26.9	Very low	130 Å²	130	135.4 Å²	135.4	68%	0.681	73%	0.725	S	S	*	*			trans	70.3	157.8	138.5	-60	172.4	0	0	0	121
713	D	27.7	Very low	27.2	Very low	125 Å²	125	140.5 Å²	140.5	67%	0.668	73%	0.731	S	S	*	*			cis	-152.6	165.2	2.5	-133.7	-31.4	0	0	0	115.4
714	S	29.9	Very low	27.5	Very low	93 Å²	93	137 Å²	137	65%	0.65	73%	0.726	S	S	*	*			trans	48.7	149.1	141.3	-159.8	0	0	0	0	122
715	D	29.2	Very low	27.7	Very low	119 Å²	119	135.4 Å²	135.4	64%	0.636	73%	0.729	S	S	*	*			cis	-166.9	156.2	-27.4	-99	-65.1	0	0	0	106.1
716	S	30	Very low	27.8	Very low	96 Å²	96	133.6 Å²	133.6	67%	0.671	73%	0.732	S	S	*	*				176.7	138.2	68.1	36.8	0	0	0	0	113.6
717	H	34.2	Very low	28.2	Very low	158 Å²	158	132.3 Å²	132.3	73%	0.731	74%	0.737	S	S	*	*			trans	44.1	144.9	135	-49.9	-28.8	0	0	0	123.6
718	T	32.6	Very low	28.4	Very low	134 Å²	134	130.3 Å²	130.3	82%	0.822	74%	0.736	S	S	*	*			cis	-168.2	167.1	-13.6	28.4	0	0	0	0	108
719	G	29.7	Very low	28.7	Very low	69 Å²	69	131.9 Å²	131.9	71%	0.711	74%	0.741	S	S	*	*			cis	123.2	98.5	-3.6	0	0	0	0	0	115.3
720	K	31.8	Very low	28.8	Very low	210 Å²	210	131.6 Å²	131.6	91%	0.913	74%	0.74	S	S	*	*			trans	-154.5	121.2	170.2	-112.7	177.8	-171.3	175.8	0	117.1
721	A	27.5	Very low	28.8	Very low	96 Å²	96	132.3 Å²	132.3	79%	0.793	74%	0.743	S	S	*	*			trans	64.1	149.5	145.8	0	0	0	0	0	122.7
722	M	25.7	Very low	28.6	Very low	148 Å²	148	136 Å²	136	73%	0.729	75%	0.754	S	S	*	*			cis	-176.3	130.1	-17.4	173.9	169.3	63.5	0	0	114.6
723	R	28.4	Very low	29.8	Very low	225 Å²	225	134.6 Å²	134.6	85%	0.849	75%	0.753	S	S	*	*			trans	64.9	158.5	156	-74.7	173.6	-178.4	172.5	-0	120.6
724	S	29.1	Very low	30.8	Very low	100 Å²	100	133.4 Å²	133.4	70%	0.699	75%	0.752	S	S	*	*			cis	-169.9	155.1	-12.5	48	0	0	0	0	115.5
725	T	27.9	Very low	30.6	Very low	143 Å²	143	134.4 Å²	134.4	88%	0.877	75%	0.75	S	S	*	*			trans	-5.3	161.4	157.3	51.5	0	0	0	0	124.1
726	G	25.3	Very low	30.6	Very low	72 Å²	72	136.2 Å²	136.2	74%	0.742	75%	0.752	S	S	*	*			cis	153.4	161.6	-7.5	0	0	0	0	0	118.1
727	M	29.4	Very low	30.3	Very low	185 Å²	185	138.3 Å²	138.3	91%	0.911	75%	0.754	S	S	*	*			trans	65	149	156.1	-72	-175.7	66.3	0	0	125.9
728	V	25.7	Very low	29.7	Very low	125 Å²	125	136.7 Å²	136.7	76%	0.758	76%	0.755	S	S	*	*				168.9	122.8	122	150.7	0	0	0	0	116.4
729	V	29	Very low	30.3	Very low	123 Å²	123	136 Å²	136	75%	0.745	75%	0.753	S	S	*	*			trans	63.4	145.4	143.7	166.9	0	0	0	0	120.7
730	E	28.4	Very low	29.9	Very low	139 Å²	139	137.5 Å²	137.5	65%	0.65	76%	0.759	S	S	*	*			cis	-168.3	-178.9	-10.4	-117.5	-163.6	111.4	0	0	115.1
731	K	28.3	Very low	29.5	Very low	163 Å²	163	131.7 Å²	131.7	71%	0.709	75%	0.745	S	S	*	*			trans	68.3	87	145.1	-80.1	169.3	175.5	104.3	0	125
732	K	23.1	Very low	29.2	Very low	202 Å²	202	136.6 Å²	136.6	88%	0.878	75%	0.748	S	S	*	*				46.8	167.1	95.1	-118.3	-164.2	177.4	179.5	0	122.4
733	P	53.2	Low	29.1	Very low	102 Å²	102	135 Å²	135	66%	0.662	75%	0.751	S	S	*	*				-119.9	-144.6	-111.8	46.1	-26.2	0	0	0	113.1
734	P	48.1	Very low	28.8	Very low	100 Å²	100	129.8 Å²	129.8	65%	0.649	75%	0.749	S	S	*	*			cis	-143.9	-171.6	-9.5	39	-15.7	0	0	0	118.9
735	D	25.3	Very low	28.4	Very low	114 Å²	114	134.4 Å²	134.4	61%	0.61	76%	0.759	S	S	*	*			trans	78.3	117	135.8	-83	-1.7	0	0	0	127.1
736	K	28.8	Very low	28.5	Very low	156 Å²	156	132.3 Å²	132.3	68%	0.678	76%	0.756	S	S	*	*				81.5	126.8	116.2	-72.3	173.8	-171.1	145.9	0	127.1
737	I	24.5	Very low	28.5	Very low	141 Å²	141	133.8 Å²	133.8	72%	0.723	76%	0.761	S	S	*	*				91.1	112.1	125.9	-69.1	171.2	0	0	0	123.7
738	V	22.2	Very low	28.5	Very low	124 Å²	124	133.5 Å²	133.5	75%	0.752	76%	0.758	S	S	*	*				29.2	152.1	120.6	-161	0	0	0	0	120.9
739	P	44.1	Very low	28.5	Very low	120 Å²	120	133.5 Å²	133.5	78%	0.779	76%	0.758	S	S	*	*			cis	-131.4	-151.9	-34.8	42	-23.6	0	0	0	113
740	A	21.6	Very low	28.5	Very low	100 Å²	100	137 Å²	137	83%	0.826	76%	0.764	S	S	*	*			trans	120.9	-179.5	147.5	0	0	0	0	0	117.8
741	S	22.9	Very low	28.4	Very low	88 Å²	88	136 Å²	136	62%	0.615	77%	0.766	S	S	*	*			trans	-141.2	178.7	-152.6	56.9	0	0	0	0	115.1
742	F	22.4	Very low	28.4	Very low	199 Å²	199	133.9 Å²	133.9	87%	0.873	77%	0.767	S	S	*	*			trans	71.9	156.8	-177.2	-45.3	-76.9	0	0	0	114.4
743	S	22.1	Very low	28.6	Very low	113 Å²	113	133 Å²	133	79%	0.79	76%	0.764	S	S	*	*			cis	-152.1	-169	0.1	-158.7	0	0	0	0	111.2
744	C	22.7	Very low	27.5	Very low	117 Å²	117	136.6 Å²	136.6	79%	0.791	78%	0.777	S	S	*	*			trans	-55.1	162.8	162	-63.8	0	0	0	0	111.5
745	E	22	Very low	26.7	Very low	197 Å²	197	139.1 Å²	139.1	92%	0.921	78%	0.783	S	S	*	*			cis	-160.3	-163.3	49	-152.4	171.4	-159.7	0	0	112.4
746	A	29.7	Very low	26.9	Very low	98 Å²	98	136.6 Å²	136.6	81%	0.81	78%	0.784	S	S	*	*			trans	-93.8	134.4	-162.4	0	0	0	0	0	116.2
747	A	24.5	Very low	26.9	Very low	104 Å²	104	136.6 Å²	136.6	86%	0.86	79%	0.791	S	S	*	*			trans	-154.9	157.1	150.1	0	0	0	0	0	112.1
748	Q	29.6	Very low	27.2	Very low	179 Å²	179	135.2 Å²	135.2	84%	0.836	79%	0.794	S	S	*	*			trans	-58.5	172.5	-169.6	-58.6	171.2	-5.5	0	0	117.1
749	T	24.9	Very low	27.6	Very low	125 Å²	125	137.2 Å²	137.2	77%	0.767	80%	0.797	S	S	*	*			trans	104.9	98.3	156.3	70.9	0	0	0	0	119.9
750	K	30.2	Very low	26.9	Very low	197 Å²	197	134.9 Å²	134.9	86%	0.857	78%	0.784	S	S	*	*				51.7	84.8	125.1	-162	-177.5	-175.7	-176.8	0	118.2
751	V	25.3	Very low	27.7	Very low	117 Å²	117	135.7 Å²	135.7	71%	0.709	78%	0.781	S	S	*	*			trans	-84.3	134.1	163.7	178.4	0	0	0	0	110.8	F753	V751-F753 HydrophobicContact CG1-CE2 4.28Å; V751-F753 HydrophobicContact CG1-CZ 4.29Å
752	T	28.4	Very low	28.5	Very low	119 Å²	119	138 Å²	138	73%	0.73	79%	0.786	S	S	*	*			trans	-104.2	124.4	164.9	46.6	0	0	0	0	109.7
753	F	27.2	Very low	29.4	Very low	183 Å²	183	132.5 Å²	132.5	80%	0.803	77%	0.772	S	S	*	*			trans	-82.5	125.2	173.6	-67.8	-85.6	0	0	0	110.8	V751	V751-F753 HydrophobicContact CG1-CE2 4.28Å; V751-F753 HydrophobicContact CG1-CZ 4.29Å
754	L	30.7	Very low	30.7	Very low	178 Å²	178	131.3 Å²	131.3	93%	0.932	76%	0.757	S	S	*	*			trans	-82.9	113.8	159.3	-84.7	154.1	0	0	0	107.3
755	I	31.4	Very low	31.9	Very low	152 Å²	152	130.9 Å²	130.9	78%	0.779	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-87.3	121.4	170.1	-62.8	175.1	0	0	0	106.7
756	G	28.6	Very low	33.4	Very low	61 Å²	61	129.1 Å²	129.1	63%	0.629	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-83.2	147.1	167.4	0	0	0	0	0	110.6	S758	G756-S758 PolarHBondContact O-N 3.3Å
757	D	29.3	Very low	34.5	Very low	157 Å²	157	130 Å²	130	84%	0.84	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-64.4	131.2	-174.2	-59.2	-67.9	0	0	0	112.5
758	S	30.6	Very low	35.9	Very low	111 Å²	111	134.7 Å²	134.7	78%	0.776	73%	0.729	S	S	*	*			trans	-99.5	99.3	171.6	25.3	0	0	0	0	109	G756 S760	G756-S758 PolarHBondContact O-N 3.3Å; S758-S760 PolarHBondContact O-N 2.94Å
759	M	32	Very low	37	Very low	166 Å²	166	129.2 Å²	129.2	82%	0.818	71%	0.71	S	S	*	*			trans	-66.7	98.1	177.1	-73	-65.9	-68.1	0	0	110.7
760	S	29.6	Very low	38.4	Very low	71 Å²	71	127.9 Å²	127.9	50%	0.497	70%	0.695	S	S	.	*			trans	-86	130.9	171.1	-163	0	0	0	0	110.1	S758 D762 S763	S758-S760 PolarHBondContact O-N 2.94Å; S760-D762 VanDerWaalsContact C-N 3.26Å; S760-D762 PolarHBondContact O-N 3.32Å; S760-D762 VanDerWaalsContact O-N 3.09Å; S760-S763 PolarHBondContact O-OG 3.39Å; S760-S763 VanDerWaalsContact O-OG 3.09Å
761	P	38.2	Very low	40.1	Very low	118 Å²	118	120.9 Å²	120.9	77%	0.766	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-25.5	-167.1	-27	35.7	0	0	0	116.4	S763	P761-S763 PolarHBondContact O-N 2.82Å
762	D	38.3	Very low	42.1	Very low	135 Å²	135	119 Å²	119	72%	0.722	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	6	-167.2	-56	-63.8	0	0	0	115.1	S760	S760-D762 VanDerWaalsContact C-N 3.26Å; S760-D762 PolarHBondContact O-N 3.32Å; S760-D762 VanDerWaalsContact O-N 3.09Å
763	S	41.3	Very low	44.1	Very low	84 Å²	84	116.8 Å²	116.8	59%	0.587	65%	0.649	S	S	*	*			trans	-75.5	-31.2	-171.8	-50.6	0	0	0	0	114	S760 P761 T765	S760-S763 PolarHBondContact O-OG 3.39Å; S760-S763 VanDerWaalsContact O-OG 3.09Å; P761-S763 PolarHBondContact O-N 2.82Å; S763-T765 VanDerWaalsContact C-N 3.33Å; S763-T765 PolarHBondContact O-N 3.39Å; S763-T765 VanDerWaalsContact O-N 3.15Å
764	D	49.2	Very low	45.4	Very low	88 Å²	88	111.4 Å²	111.4	47%	0.471	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	38	-165	-80	-20.4	0	0	0	115.1	E766 L767 R768	D764-E766 VanDerWaalsContact C-N 3.26Å; D764-E766 PolarHBondContact O-N 3.49Å; D764-L767 HydrophobicContact CB-CB 4.27Å; D764-L767 HydrophobicContact CB-CD1 4.48Å; D764-L767 PolarHBondContact O-N 3.47Å; D764-R768 PolarHBondContact O-N 3.32Å
765	T	49.7	Very low	46.8	Very low	108 Å²	108	107.8 Å²	107.8	66%	0.663	61%	0.606	S	S	*	*	H	α-helix	trans	-59.8	-36.2	174.7	56.1	0	0	0	0	112.6	S763 S769	S763-T765 VanDerWaalsContact C-N 3.33Å; S763-T765 PolarHBondContact O-N 3.39Å; S763-T765 VanDerWaalsContact O-N 3.15Å; T765-S769 WeakPolarHBondContact O-CB 3.25Å; T765-S769 PolarHBondContact O-N 2.99Å
766	E	52.6	Low	48.4	Very low	161 Å²	161	105 Å²	105	75%	0.752	59%	0.592	S	S	*	*	H	α-helix	trans	-70.9	-43.8	-179.8	-164.3	160.4	-161	0	0	111.5	D764 S769 Q770	D764-E766 VanDerWaalsContact C-N 3.26Å; D764-E766 PolarHBondContact O-N 3.49Å; E766-S769 PolarHBondContact O-N 3.09Å; E766-S769 VanDerWaalsContact O-N 3.15Å; E766-S769 PolarHBondContact O-OG 2.83Å; E766-Q770 PolarHBondContact O-N 3.08Å
767	L	52.8	Low	49.4	Very low	115 Å²	115	105.7 Å²	105.7	60%	0.602	58%	0.584	S	S	*	*	H	α-helix	trans	-63.8	-39.7	174	-82.1	171.5	0	0	0	112.7	D764 S769 Q770 A771	D764-L767 HydrophobicContact CB-CB 4.27Å; D764-L767 HydrophobicContact CB-CD1 4.48Å; D764-L767 PolarHBondContact O-N 3.47Å; L767-S769 VanDerWaalsContact C-N 3.35Å; L767-Q770 PolarHBondContact O-N 3.14Å; L767-A771 WeakPolarHBondContact O-CB 3.45Å; L767-A771 PolarHBondContact O-N 2.94Å
768	R	52.8	Low	50.1	Low	204 Å²	204	105.8 Å²	105.8	77%	0.77	57%	0.573	S	S	*	*	H	α-helix	trans	-61.7	-41.7	170.6	-93.6	-174.4	172.7	174.2	0.2	112	D764 A771 V772	D764-R768 PolarHBondContact O-N 3.32Å; R768-A771 PolarHBondContact O-N 3.29Å; R768-V772 WeakPolarHBondContact O-CG2 3.37Å; R768-V772 PolarHBondContact O-N 2.96Å; R768-V772 VanDerWaalsContact O-N 3.11Å
769	S	54.3	Low	51	Low	63 Å²	63	107.7 Å²	107.7	44%	0.441	57%	0.569	S	S	.	*	H	α-helix	trans	-63.5	-41.8	178.3	81	0	0	0	0	112	T765 E766 L767 V772 V773	T765-S769 WeakPolarHBondContact O-CB 3.25Å; T765-S769 PolarHBondContact O-N 2.99Å; E766-S769 PolarHBondContact O-N 3.09Å; E766-S769 VanDerWaalsContact O-N 3.15Å; E766-S769 PolarHBondContact O-OG 2.83Å; L767-S769 VanDerWaalsContact C-N 3.35Å; S769-V772 PolarHBondContact O-N 2.61Å; S769-V773 WeakPolarHBondContact O-CG2 2.94Å; S769-V773 PolarHBondContact O-N 3.19Å
770	Q	54.5	Low	51.7	Low	98 Å²	98	107.4 Å²	107.4	46%	0.458	57%	0.565	S	S	.	*	H	α-helix	trans	-66.4	-42.5	176.6	-168.9	61	51.8	0	0	111.4	E766 L767 V772 V773 D774	E766-Q770 PolarHBondContact O-N 3.08Å; L767-Q770 PolarHBondContact O-N 3.14Å; Q770-V772 VanDerWaalsContact C-N 3.29Å; Q770-V772 PolarHBondContact O-N 3.45Å; Q770-V773 PolarHBondContact O-N 3.36Å; Q770-D774 PolarHBondContact NE2-OD1 3.19Å; Q770-D774 WeakPolarHBondContact O-CB 3.48Å; Q770-D774 VanDerWaalsContact O-CG 3.24Å; Q770-D774 PolarHBondContact O-N 3.48Å
771	A	65.9	Low	52.4	Low	49 Å²	49	109 Å²	109	41%	0.405	57%	0.573	S	S	.	*	H	α-helix	trans	-59.5	-37.6	176.6	0	0	0	0	0	112.9	L767 R768 Q775	L767-A771 WeakPolarHBondContact O-CB 3.45Å; L767-A771 PolarHBondContact O-N 2.94Å; R768-A771 PolarHBondContact O-N 3.29Å; A771-Q775 WeakPolarHBondContact O-CB 3.04Å; A771-Q775 PolarHBondContact O-N 3.42Å
772	V	66.7	Low	52.1	Low	78 Å²	78	112.8 Å²	112.8	47%	0.473	58%	0.577	S	S	.	*	H	α-helix	trans	-69.3	-43.4	174.9	170.7	0	0	0	0	111.5	R768 S769 Q770 D774 Q775 I776	R768-V772 WeakPolarHBondContact O-CG2 3.37Å; R768-V772 PolarHBondContact O-N 2.96Å; R768-V772 VanDerWaalsContact O-N 3.11Å; S769-V772 PolarHBondContact O-N 2.61Å; Q770-V772 VanDerWaalsContact C-N 3.29Å; Q770-V772 PolarHBondContact O-N 3.45Å; V772-D774 VanDerWaalsContact C-N 3.35Å; V772-D774 PolarHBondContact O-N 2.88Å; V772-Q775 WeakPolarHBondContact O-CB 3.47Å; V772-Q775 PolarHBondContact O-N 3.11Å; V772-I776 HydrophobicContact CG1-CD1 3.94Å; V772-I776 WeakPolarHBondContact O-CG1 3.33Å; V772-I776 PolarHBondContact O-N 3.23Å
773	V	70.1	Confident	51.9	Low	73 Å²	73	112.2 Å²	112.2	44%	0.442	58%	0.58	S	S	.	*	H	α-helix	trans	-60	-46.1	174.1	170.1	0	0	0	0	110.8	S769 Q770 Q775 I776 T777	S769-V773 WeakPolarHBondContact O-CG2 2.94Å; S769-V773 PolarHBondContact O-N 3.19Å; Q770-V773 PolarHBondContact O-N 3.36Å; V773-Q775 PolarHBondContact O-N 3.03Å; V773-I776 PolarHBondContact O-N 3.31Å; V773-T777 PolarHBondContact O-N 3.07Å; V773-T777 PolarHBondContact O-OG1 2.85Å; V773-T777 VanDerWaalsContact O-OG1 3.13Å
774	D	54.2	Low	51.3	Low	69 Å²	69	116.1 Å²	116.1	37%	0.369	59%	0.594	S	S	.	*	H	α-helix	trans	-64.2	-29.2	177.5	-70.4	1.7	0	0	0	112	Q770 V772 T777 R778	Q770-D774 PolarHBondContact NE2-OD1 3.19Å; Q770-D774 WeakPolarHBondContact O-CB 3.48Å; Q770-D774 VanDerWaalsContact O-CG 3.24Å; Q770-D774 PolarHBondContact O-N 3.48Å; V772-D774 VanDerWaalsContact C-N 3.35Å; V772-D774 PolarHBondContact O-N 2.88Å; D774-T777 WeakPolarHBondContact CA-OG1 3.29Å; D774-T777 PolarHBondContact O-OG1 3.11Å; D774-T777 VanDerWaalsContact O-OG1 3.09Å; D774-R778 WeakPolarHBondContact O-CB 3.42Å; D774-R778 VanDerWaalsContact O-CG 3.31Å; D774-R778 WeakPolarHBondContact O-CG 3.47Å; D774-R778 PolarHBondContact O-N 2.96Å; D774-R778 PolarHBondContact O-NE 3.46Å
775	Q	60.4	Low	50.4	Low	102 Å²	102	121.9 Å²	121.9	48%	0.477	62%	0.615	S	S	.	*	H	α-helix	trans	-74	-45.2	174.8	-165.9	167.7	10.1	0	0	111.1	A771 V772 V773 T777 R778 H779	A771-Q775 WeakPolarHBondContact O-CB 3.04Å; A771-Q775 PolarHBondContact O-N 3.42Å; V772-Q775 WeakPolarHBondContact O-CB 3.47Å; V772-Q775 PolarHBondContact O-N 3.11Å; V773-Q775 PolarHBondContact O-N 3.03Å; Q775-T777 PolarHBondContact O-N 2.69Å; Q775-R778 WeakPolarHBondContact O-CB 3.45Å; Q775-R778 PolarHBondContact O-N 2.94Å; Q775-H779 PolarHBondContact O-CD2 2.89Å; Q775-H779 PolarHBondContact O-N 2.98Å
776	I	64.6	Low	49.5	Very low	94 Å²	94	121.4 Å²	121.4	48%	0.482	62%	0.622	S	S	.	*	H	α-helix	trans	-58.9	-45	174.7	-68.2	163.5	0	0	0	110.8	V772 V773 R778 H779 H780	V772-I776 HydrophobicContact CG1-CD1 3.94Å; V772-I776 WeakPolarHBondContact O-CG1 3.33Å; V772-I776 PolarHBondContact O-N 3.23Å; V773-I776 PolarHBondContact O-N 3.31Å; I776-R778 VanDerWaalsContact C-N 3.34Å; I776-R778 PolarHBondContact O-N 2.91Å; I776-H779 PolarHBondContact O-N 3.49Å; I776-H780 PolarHBondContact O-CD2 2.93Å; I776-H780 VanDerWaalsContact O-CD2 3.31Å; I776-H780 PolarHBondContact O-N 3.16Å
777	T	49.8	Very low	48.2	Very low	75 Å²	75	123.3 Å²	123.3	46%	0.46	63%	0.631	S	S	.	*	H	α-helix	trans	-66.1	-33.4	177.1	49.5	0	0	0	0	113.2	V773 D774 Q775 H780 T781	V773-T777 PolarHBondContact O-N 3.07Å; V773-T777 PolarHBondContact O-OG1 2.85Å; V773-T777 VanDerWaalsContact O-OG1 3.13Å; D774-T777 WeakPolarHBondContact CA-OG1 3.29Å; D774-T777 PolarHBondContact O-OG1 3.11Å; D774-T777 VanDerWaalsContact O-OG1 3.09Å; Q775-T777 PolarHBondContact O-N 2.69Å; T777-H780 PolarHBondContact O-N 2.81Å; T777-T781 PolarHBondContact O-OG1 3.45Å
778	R	45	Very low	46.9	Very low	160 Å²	160	129.3 Å²	129.3	60%	0.604	65%	0.645	S	S	*	*	H	α-helix	trans	-65.9	-35.3	172.8	-83.9	175	-75.7	164.4	-3.2	112.5	D774 Q775 I776	D774-R778 WeakPolarHBondContact O-CB 3.42Å; D774-R778 VanDerWaalsContact O-CG 3.31Å; D774-R778 WeakPolarHBondContact O-CG 3.47Å; D774-R778 PolarHBondContact O-N 2.96Å; D774-R778 PolarHBondContact O-NE 3.46Å; Q775-R778 WeakPolarHBondContact O-CB 3.45Å; Q775-R778 PolarHBondContact O-N 2.94Å; I776-R778 VanDerWaalsContact C-N 3.34Å; I776-R778 PolarHBondContact O-N 2.91Å
779	H	49.9	Very low	45.6	Very low	151 Å²	151	123.3 Å²	123.3	70%	0.699	65%	0.647	S	S	*	*	H	α-helix	trans	-73	-25.9	176.4	-79.3	-74.1	0	0	0	113.6	Q775 I776	Q775-H779 PolarHBondContact O-CD2 2.89Å; Q775-H779 PolarHBondContact O-N 2.98Å; I776-H779 PolarHBondContact O-N 3.49Å
780	H	45.3	Very low	44.2	Very low	159 Å²	159	124.9 Å²	124.9	74%	0.736	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	4.2	177.6	-75.1	-62.2	0	0	0	115.3	I776 T777	I776-H780 PolarHBondContact O-CD2 2.93Å; I776-H780 VanDerWaalsContact O-CD2 3.31Å; I776-H780 PolarHBondContact O-N 3.16Å; T777-H780 PolarHBondContact O-N 2.81Å
781	T	45.3	Very low	42.9	Very low	105 Å²	105	127.4 Å²	127.4	64%	0.644	69%	0.686	S	S	*	*			trans	-126.6	56.8	-172.6	46.1	0	0	0	0	115.1	T777	T777-T781 PolarHBondContact O-OG1 3.45Å
782	K	31.5	Very low	41.1	Very low	197 Å²	197	130.9 Å²	130.9	86%	0.857	70%	0.698	S	S	*	*			trans	-131.6	120.2	156.1	-77.2	-172.1	177.3	177.7	0	111
783	P	33.6	Very low	39.3	Very low	123 Å²	123	134.2 Å²	134.2	80%	0.799	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-83.7	150.6	-178.1	33.2	-34.9	0	0	0	112.7
784	L	29.5	Very low	37.2	Very low	167 Å²	167	138 Å²	138	87%	0.874	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-63.6	143.1	163.3	-82.7	69.9	0	0	0	109.8
785	K	29.4	Very low	35.9	Very low	208 Å²	208	141.4 Å²	141.4	90%	0.904	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-77.3	137.5	156.6	-78.3	-175	175.3	180	0	108.5
786	A	30.2	Very low	34.2	Very low	98 Å²	98	143.7 Å²	143.7	81%	0.81	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-88.1	151.9	179.6	0	0	0	0	0	111.8
787	E	26.1	Very low	32.4	Very low	202 Å²	202	144.5 Å²	144.5	94%	0.944	75%	0.754	S	S	*	*			trans	-120.2	152.4	145.7	-164.3	149.9	-124.1	0	0	109.5
788	R	26.2	Very low	31.3	Very low	240 Å²	240	149.1 Å²	149.1	91%	0.906	77%	0.768	S	S	*	*			trans	-114.6	138	-145.8	139.6	-144.5	-62.3	-113.9	1.7	111.3
789	G	24.1	Very low	30.4	Very low	78 Å²	78	149.2 Å²	149.2	80%	0.804	78%	0.775	S	S	*	*			trans	-162.5	118	164.8	0	0	0	0	0	110.2
790	A	25.4	Very low	29.2	Very low	96 Å²	96	148.8 Å²	148.8	79%	0.793	78%	0.783	S	S	*	*			trans	-147.3	121.2	-172.4	0	0	0	0	0	112.6
791	V	27.6	Very low	28.2	Very low	151 Å²	151	147 Å²	147	92%	0.915	78%	0.784	S	S	*	*			trans	-158	149.6	165.6	-176.7	0	0	0	0	106.5
792	D	27.5	Very low	27.4	Very low	123 Å²	123	150 Å²	150	66%	0.658	79%	0.788	S	S	*	*			cis	-166.3	166.6	-42.4	-170	16.7	0	0	0	107.6
793	Q	28.7	Very low	27.1	Very low	148 Å²	148	146 Å²	146	69%	0.692	78%	0.776	S	S	*	*			trans	74.4	112.3	157.5	-43.1	-157.9	3.5	0	0	124
794	H	25.9	Very low	26.8	Very low	152 Å²	152	148.6 Å²	148.6	70%	0.704	78%	0.778	S	S	*	*				72.5	120.5	120.5	-81.6	-105.7	0	0	0	125.6
795	Q	26.9	Very low	26.6	Very low	141 Å²	141	146.5 Å²	146.5	66%	0.659	78%	0.777	S	S	*	*			trans	78.7	131.8	130.3	-79.5	-180	-70.3	0	0	125.1
796	E	25.9	Very low	26.4	Very low	150 Å²	150	140.1 Å²	140.1	70%	0.701	77%	0.77	S	S	*	*				17	145.4	128.8	-52.2	179.1	107	0	0	118.9
797	T	25.5	Very low	26.1	Very low	111 Å²	111	144.7 Å²	144.7	68%	0.681	78%	0.775	S	S	*	*				-170.2	154.9	54.1	-36.6	0	0	0	0	113.9
798	K	27.1	Very low	26.1	Very low	171 Å²	171	139.6 Å²	139.6	74%	0.743	76%	0.762	S	S	*	*			trans	15.7	136.7	154.8	-68.2	166.6	-174.9	165.5	0	123.2
799	Q	27.2	Very low	25.9	Very low	162 Å²	162	135.2 Å²	135.2	76%	0.757	76%	0.756	S	S	*	*				33.4	129.5	126.8	-49.5	171.3	-70.4	0	0	120.4
800	T	23.8	Very low	26	Very low	142 Å²	142	137.9 Å²	137.9	87%	0.871	75%	0.751	S	S	*	*				-174.4	166	98.3	22.9	0	0	0	0	114.3
801	T	25.7	Very low	26	Very low	123 Å²	123	141 Å²	141	76%	0.755	75%	0.749	S	S	*	*			trans	-81.2	149.7	179.6	50	0	0	0	0	114.4
802	K	26.8	Very low	25.9	Very low	168 Å²	168	141 Å²	141	73%	0.73	74%	0.744	S	S	*	*				175.6	153.2	110.3	-102.3	-179.8	163.6	-89.3	0	115.4
803	D	25.3	Very low	25.7	Very low	111 Å²	111	140.8 Å²	140.8	59%	0.594	75%	0.747	S	S	*	*			trans	26.5	116.7	137.5	-44.2	-10.8	0	0	0	118.3
804	Q	28	Very low	25.5	Very low	179 Å²	179	140.1 Å²	140.1	84%	0.836	75%	0.752	S	S	*	*				72.1	115.8	72.5	-73.2	-166.6	5.5	0	0	116.3
805	S	25.3	Very low	25.5	Very low	123 Å²	123	138 Å²	138	86%	0.86	76%	0.755	S	S	*	*			trans	54.3	140.5	154.5	56.2	0	0	0	0	120.5
806	G	25.6	Very low	25.3	Very low	74 Å²	74	140.6 Å²	140.6	76%	0.763	77%	0.767	S	S	*	*			cis	147.6	126.3	-5.5	0	0	0	0	0	113.2
807	E	24.3	Very low	25.4	Very low	193 Å²	193	142 Å²	142	90%	0.902	77%	0.773	S	S	*	*			trans	-160	161.4	176.3	-86.8	179	151.3	0	0	107.3
808	S	24.5	Very low	25.6	Very low	96 Å²	96	142.8 Å²	142.8	67%	0.671	78%	0.78	S	S	*	*			cis	-171.8	127.4	-35.8	53.5	0	0	0	0	107.9
809	D	22.9	Very low	25.4	Very low	147 Å²	147	140 Å²	140	79%	0.786	78%	0.781	S	S	*	*			trans	48.7	124.6	154.1	-70.7	-16.7	0	0	0	124.1
810	I	26.9	Very low	25.1	Very low	135 Å²	135	141.4 Å²	141.4	69%	0.692	79%	0.788	S	S	*	*			trans	84.7	108.3	133.4	-64	169	0	0	0	120.7
811	Q	25	Very low	25.7	Very low	162 Å²	162	142.6 Å²	142.6	76%	0.757	79%	0.788	S	S	*	*			trans	44	129.5	137.1	-59	178.1	-43.4	0	0	122.7
812	N	24.8	Very low	25.8	Very low	151 Å²	151	142.3 Å²	142.3	81%	0.807	79%	0.788	S	S	*	*				-164.8	116.6	114	-92.6	-56.6	0	0	0	108
813	V	24.1	Very low	25.6	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.715	79%	0.787	S	S	*	*				86.1	147.1	76.4	166.6	0	0	0	0	112.4
814	V	24.5	Very low	25.5	Very low	134 Å²	134	144.6 Å²	144.6	81%	0.812	80%	0.799	S	S	*	*			trans	87.9	128.5	-166.2	179.7	0	0	0	0	112.9
815	S	24.4	Very low	25.2	Very low	108 Å²	108	141.3 Å²	141.3	76%	0.755	79%	0.787	S	S	*	*			cis	-158.7	179	-14.9	-101.8	0	0	0	0	111.1
816	E	23.1	Very low	25.2	Very low	195 Å²	195	143.3 Å²	143.3	91%	0.911	78%	0.782	S	S	*	*			trans	-75.7	173.3	-173.1	-65.9	160.7	117.9	0	0	116.3
817	E	28.1	Very low	25.1	Very low	178 Å²	178	144.6 Å²	144.6	83%	0.832	78%	0.78	S	S	*	*			trans	-60	163.3	179.3	-56.2	179.4	136.7	0	0	114.5
818	P	29.1	Very low	25.1	Very low	129 Å²	129	142.4 Å²	142.4	84%	0.838	77%	0.774	S	S	*	*				-144.5	177	88.3	38.6	-21.8	0	0	0	115.9
819	C	24.5	Very low	25.7	Very low	112 Å²	112	143 Å²	143	76%	0.757	78%	0.776	S	S	*	*			trans	-80.5	158	179.7	-46	0	0	0	0	114.2
820	E	21.1	Very low	26	Very low	191 Å²	191	144.5 Å²	144.5	89%	0.893	78%	0.778	S	S	*	*			trans	-167.2	162.4	137.7	-116.2	171.5	-158.1	0	0	113
821	L	34.8	Very low	26	Very low	167 Å²	167	143 Å²	143	87%	0.874	78%	0.78	S	S	*	*			trans	-130.5	136.9	171.2	-89.1	169.9	0	0	0	108.6
822	P	29.3	Very low	26.2	Very low	118 Å²	118	143.5 Å²	143.5	77%	0.766	78%	0.784	S	S	*	*			trans	-144.9	124.2	142.6	32.4	-14.6	0	0	0	116.5
823	C	21.9	Very low	26.4	Very low	104 Å²	104	141.6 Å²	141.6	70%	0.703	78%	0.783	S	S	*	*			trans	25	132.3	130.9	-63	0	0	0	0	125
824	W	23.1	Very low	26.5	Very low	222 Å²	222	142.4 Å²	142.4	84%	0.841	78%	0.782	S	S	*	*			trans	74.3	146.8	130.9	-61	23.6	0	0	0	117.3
825	N	22.4	Very low	26.5	Very low	111 Å²	111	145.1 Å²	145.1	59%	0.594	78%	0.784	S	S	*	*			cis	-167.8	154.4	48.5	-110.3	-38.5	0	0	0	113.7
826	H	24.5	Very low	26.6	Very low	164 Å²	164	147.2 Å²	147.2	76%	0.759	79%	0.786	S	S	*	*			trans	52.6	152.9	145.7	-66.9	-47.2	0	0	0	122.1
827	S	24.3	Very low	27	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	77%	0.773	S	S	*	*			cis	-163.3	161.2	-5.2	42.4	0	0	0	0	111.5
828	D	24.3	Very low	27	Very low	148 Å²	148	147.3 Å²	147.3	79%	0.791	78%	0.778	S	S	*	*			trans	-71.3	-177.8	174.2	-46.7	-90.1	0	0	0	113.5
829	P	37.7	Very low	27.1	Very low	109 Å²	109	147.8 Å²	147.8	71%	0.708	77%	0.767	S	S	*	*				-140.7	142.3	77.2	33	-14.3	0	0	0	117.2
830	E	27.3	Very low	27.3	Very low	178 Å²	178	148.9 Å²	148.9	83%	0.832	77%	0.766	S	S	*	*			trans	64.9	151	136.9	-65.8	173.7	-176.5	0	0	120.7
831	S	28.2	Very low	27.9	Very low	104 Å²	104	146.3 Å²	146.3	73%	0.727	76%	0.758	S	S	*	*			cis	-166.3	-177.2	-20.9	62	0	0	0	0	107.4
832	M	27.9	Very low	27.5	Very low	171 Å²	171	146.1 Å²	146.1	84%	0.842	76%	0.758	S	S	*	*			cis	-152.4	177.7	3.6	-144.2	-168	-161.1	0	0	108.6
833	S	29	Very low	27.7	Very low	112 Å²	112	145.1 Å²	145.1	78%	0.783	75%	0.754	S	S	*	*			trans	-140.1	153.1	168.3	56.2	0	0	0	0	111.6
834	L	26.4	Very low	28	Very low	135 Å²	135	148.4 Å²	148.4	71%	0.707	76%	0.762	S	S	*	*			trans	-141.3	134.3	175.5	-71.3	170.3	0	0	0	107.9
835	F	26.2	Very low	28.4	Very low	191 Å²	191	144.3 Å²	144.3	84%	0.838	75%	0.753	S	S	*	*			cis	-126.8	160.8	-0.2	-89.9	-90.4	0	0	0	111.2
836	D	26.3	Very low	28.7	Very low	152 Å²	152	145.1 Å²	145.1	81%	0.813	76%	0.762	S	S	*	*			trans	-140.9	-172.7	162.4	-162.4	-3.7	0	0	0	107.7
837	E	31.5	Very low	28.9	Very low	136 Å²	136	146.6 Å²	146.6	64%	0.636	76%	0.761	S	S	*	*			trans	79.5	116.7	173.9	-55.6	-174.7	-164.8	0	0	117.7	F839	E837-F839 HydrophobicContact CB-CD2 4.35Å; E837-F839 VanDerWaalsContact CD-CE2 3.49Å; E837-F839 HydrophobicContact CG-CD2 3.96Å; E837-F839 HydrophobicContact CG-CE2 3.79Å
838	Y	28	Very low	29.1	Very low	239 Å²	239	147.2 Å²	147.2	94%	0.937	76%	0.76	S	S	*	*				-137	129.3	103.4	-116.2	-84.9	0	0	0	110.8
839	F	31.2	Very low	29.4	Very low	139 Å²	139	147.1 Å²	147.1	61%	0.61	76%	0.759	S	S	*	*			trans	-75.6	-179.6	-178	-90.7	-82.7	0	0	0	112.5	E837	E837-F839 HydrophobicContact CB-CD2 4.35Å; E837-F839 VanDerWaalsContact CD-CE2 3.49Å; E837-F839 HydrophobicContact CG-CD2 3.96Å; E837-F839 HydrophobicContact CG-CE2 3.79Å
840	N	28.8	Very low	28.9	Very low	134 Å²	134	149.7 Å²	149.7	72%	0.717	77%	0.766	S	S	*	*			cis	-156.5	175.4	21.9	-139.1	-31.7	0	0	0	114.8
841	D	32	Very low	28.9	Very low	137 Å²	137	147.8 Å²	147.8	73%	0.733	76%	0.762	S	S	*	*			trans	-68	167.7	175.4	-74.1	-58.9	0	0	0	115.4
842	D	28.1	Very low	29	Very low	163 Å²	163	147.8 Å²	147.8	87%	0.872	76%	0.757	S	S	*	*				-151.7	154.8	124.2	-138.6	-20.7	0	0	0	112.5
843	S	32.4	Very low	29.5	Very low	98 Å²	98	145 Å²	145	69%	0.685	75%	0.751	S	S	*	*			trans	-138.3	162.1	-168.1	71.1	0	0	0	0	114
844	I	28.9	Very low	29.4	Very low	172 Å²	172	145.9 Å²	145.9	88%	0.882	75%	0.746	S	S	*	*			trans	-169.1	141.9	159.3	-102.8	145.7	0	0	0	112.3
845	E	30.8	Very low	29.5	Very low	137 Å²	137	148.7 Å²	148.7	64%	0.64	75%	0.753	S	S	*	*			trans	-95	160.2	173.7	-62.5	-167.9	137.5	0	0	114	R847	E845-R847 IonicContact OE2-CZ 2.84Å; E845-R847 IonicContact OE2-NE 3.81Å; E845-R847 IonicContact OE2-NH2 2.8Å; E845-R847 PolarHBondContact OE2-NH2 2.64Å; E845-R847 VanDerWaalsContact OE2-NH2 3.12Å
846	T	29.5	Very low	29.5	Very low	127 Å²	127	145.4 Å²	145.4	78%	0.779	75%	0.749	S	S	*	*			trans	-176.1	126.8	132.2	19.4	0	0	0	0	108.7
847	R	28.2	Very low	29.4	Very low	195 Å²	195	144.4 Å²	144.4	74%	0.736	75%	0.754	S	S	*	*				60.4	134.1	71.5	-59.3	-176.7	-161.1	-173.7	7.3	113.9	E845	E845-R847 IonicContact OE2-CZ 2.84Å; E845-R847 IonicContact OE2-NE 3.81Å; E845-R847 IonicContact OE2-NH2 2.8Å; E845-R847 PolarHBondContact OE2-NH2 2.64Å; E845-R847 VanDerWaalsContact OE2-NH2 3.12Å
848	T	28.9	Very low	29.3	Very low	114 Å²	114	142.4 Å²	142.4	70%	0.699	76%	0.76	S	S	*	*			cis	-171.5	153.7	-2.9	16.5	0	0	0	0	111.2
849	I	30.2	Very low	29.1	Very low	147 Å²	147	138.6 Å²	138.6	75%	0.754	76%	0.756	S	S	*	*			trans	63.4	127	144.8	-63.3	162	0	0	0	120.8
850	D	26.2	Very low	28.8	Very low	163 Å²	163	137.9 Å²	137.9	87%	0.872	77%	0.768	S	S	*	*				-163.3	163	120.2	-128.4	-22.3	0	0	0	112.2
851	D	28.8	Very low	28.6	Very low	137 Å²	137	140.1 Å²	140.1	73%	0.733	77%	0.772	S	S	*	*			trans	-145.1	152.6	-144.4	-143.1	3.9	0	0	0	119
852	V	29.1	Very low	28.3	Very low	105 Å²	105	140 Å²	140	64%	0.636	77%	0.771	S	S	*	*			trans	64	168.7	150.2	161.4	0	0	0	0	119.6	I854	V852-I854 HydrophobicContact CG1-CD1 4.4Å; V852-I854 HydrophobicContact CG2-CD1 4.29Å
853	P	38.6	Very low	28	Very low	111 Å²	111	141.2 Å²	141.2	72%	0.721	77%	0.771	S	S	*	*			cis	-110.5	158.5	-21.4	20.1	1.8	0	0	0	114.2
854	I	28	Very low	27.5	Very low	131 Å²	131	142.6 Å²	142.6	67%	0.672	78%	0.779	S	S	*	*				77.4	114.8	51	-50.3	159.6	0	0	0	116.3	V852	V852-I854 HydrophobicContact CG1-CD1 4.4Å; V852-I854 HydrophobicContact CG2-CD1 4.29Å
855	K	27	Very low	27.2	Very low	194 Å²	194	139 Å²	139	84%	0.843	77%	0.769	S	S	*	*				174.3	92.7	128.6	-94.8	174.8	-174.8	175	0	116.7
856	T	27	Very low	26.8	Very low	123 Å²	123	140 Å²	140	76%	0.755	78%	0.775	S	S	*	*				44.7	121.3	114	61.3	0	0	0	0	123.9
857	S	25.1	Very low	26.6	Very low	131 Å²	131	139.3 Å²	139.3	92%	0.916	77%	0.766	S	S	*	*				-165.5	172	124.9	44.6	0	0	0	0	110
858	A	27.9	Very low	26.4	Very low	93 Å²	93	135.9 Å²	135.9	77%	0.769	76%	0.758	S	S	*	*			trans	-128.5	172.4	-160.7	0	0	0	0	0	115.3
859	D	24	Very low	26.2	Very low	159 Å²	159	138.2 Å²	138.2	85%	0.85	76%	0.759	S	S	*	*			trans	55.3	116.2	168.2	-80.8	-27.6	0	0	0	120.1
860	S	24.3	Very low	25.8	Very low	125 Å²	125	135.7 Å²	135.7	87%	0.874	75%	0.754	S	S	*	*				-179.8	169.8	109	40.8	0	0	0	0	112.1
861	K	25.8	Very low	25.7	Very low	180 Å²	180	136 Å²	136	78%	0.783	75%	0.748	S	S	*	*			trans	-90.3	153.8	-172.9	-90.6	-176.8	172.2	-174.1	0	114.5
862	D	25	Very low	25.5	Very low	135 Å²	135	136.7 Å²	136.7	72%	0.722	75%	0.75	S	S	*	*			trans	46.8	91.8	142.4	-54.4	-32.9	0	0	0	118.6
863	H	22.9	Very low	25.3	Very low	188 Å²	188	139.3 Å²	139.3	87%	0.87	76%	0.76	S	S	*	*			trans	-150	122.2	146.9	-116.8	-10.5	0	0	0	114.6
864	C	22	Very low	24.5	Very low	127 Å²	127	139.7 Å²	139.7	86%	0.858	76%	0.764	S	S	*	*			trans	-149.9	112.3	148.5	-177.4	0	0	0	0	108.5
865	C	22.3	Very low	24.3	Very low	98 Å²	98	138.4 Å²	138.4	66%	0.662	77%	0.773	S	S	*	*			trans	-159.3	161	177.2	-91.9	0	0	0	0	109.9
866	M	23	Very low	24.2	Very low	156 Å²	156	138.5 Å²	138.5	77%	0.768	77%	0.773	S	S	*	*			trans	75.1	132.8	169.3	-48.6	-42.5	-92.3	0	0	116
867	L	24.6	Very low	24.1	Very low	113 Å²	113	140.9 Å²	140.9	59%	0.592	78%	0.781	S	S	*	*			cis	-143.8	148.5	-10.3	-86.2	139.4	0	0	0	107	F869	L867-F869 HydrophobicContact CD2-CE2 4.03Å
868	E	22.9	Very low	24	Very low	124 Å²	124	141.2 Å²	141.2	58%	0.579	77%	0.773	S	S	*	*			cis	88	168.9	48.5	-137.3	-150.1	168.7	0	0	114.8	K871	E868-K871 IonicContact OE1-NZ 3.2Å; E868-K871 PolarHBondContact OE1-NZ 2.47Å
869	F	25	Very low	23.9	Very low	163 Å²	163	145.8 Å²	145.8	72%	0.715	78%	0.775	S	S	*	*			trans	81.4	128.4	-175.2	-62.2	-73.6	0	0	0	117	L867	L867-F869 HydrophobicContact CD2-CE2 4.03Å
870	S	22.4	Very low	24.1	Very low	93 Å²	93	146 Å²	146	65%	0.65	77%	0.771	S	S	*	*			cis	-145.6	162.7	-5.6	-58.5	0	0	0	0	108.9
871	K	24.7	Very low	24	Very low	170 Å²	170	148.4 Å²	148.4	74%	0.739	77%	0.774	S	S	*	*			cis	58.1	145.8	43.2	-67.4	173.7	-178	148.6	0	111.5	E868	E868-K871 IonicContact OE1-NZ 3.2Å; E868-K871 PolarHBondContact OE1-NZ 2.47Å
872	I	24.3	Very low	24	Very low	152 Å²	152	146.3 Å²	146.3	78%	0.779	77%	0.771	S	S	*	*			cis	-143.8	150.1	23	-62.6	169.3	0	0	0	106.4
873	L	24.1	Very low	23.9	Very low	159 Å²	159	149.3 Å²	149.3	83%	0.832	78%	0.781	S	S	*	*				-176.7	160.6	87	-142.5	126.9	0	0	0	113.2
874	C	22.2	Very low	24	Very low	120 Å²	120	149 Å²	149	81%	0.811	78%	0.778	S	S	*	*			trans	-127.9	152	-176.3	-49.4	0	0	0	0	112.1
875	A	23.4	Very low	24.1	Very low	104 Å²	104	148.9 Å²	148.9	86%	0.86	78%	0.777	S	S	*	*			trans	-151.4	148	156.9	0	0	0	0	0	111.6
876	K	26.3	Very low	24.2	Very low	196 Å²	196	152.8 Å²	152.8	85%	0.852	78%	0.782	S	S	*	*			trans	-93.3	155.3	173.6	-59.3	170.1	-179.4	173.2	0	109.5
877	N	23.3	Very low	24.2	Very low	172 Å²	172	151.2 Å²	151.2	92%	0.92	79%	0.785	S	S	*	*				-158.6	165.8	119.7	-107.9	-26.9	0	0	0	113.2
878	N	24.3	Very low	24.1	Very low	138 Å²	138	151.9 Å²	151.9	74%	0.738	79%	0.788	S	S	*	*			trans	-146.7	121.7	-162.9	166.1	22.7	0	0	0	110
879	K	25.4	Very low	24	Very low	190 Å²	190	153.7 Å²	153.7	83%	0.826	80%	0.797	S	S	*	*			trans	-170.1	161.6	138.6	-112.4	172.4	-177.7	-175.4	0	113.5
880	Q	27.6	Very low	23.9	Very low	162 Å²	162	152.1 Å²	152.1	76%	0.757	80%	0.801	S	S	*	*			trans	-72.7	161.9	175.9	-56.7	136.4	-61.7	0	0	111.5
881	N	22.8	Very low	24.3	Very low	176 Å²	176	153.8 Å²	153.8	94%	0.941	81%	0.807	S	S	*	*				-144.5	144.4	119.9	-106.1	-3.7	0	0	0	109.4
882	N	24.9	Very low	24.3	Very low	136 Å²	136	151.2 Å²	151.2	73%	0.727	81%	0.807	S	S	*	*			trans	-143.8	113.3	-173.7	-177.6	53.8	0	0	0	107.4
883	E	24	Very low	24.4	Very low	198 Å²	198	151.4 Å²	151.4	93%	0.925	81%	0.805	S	S	*	*			trans	-153.8	151.2	176	-131.4	159.5	-137	0	0	112.5
884	F	24.6	Very low	24.4	Very low	183 Å²	183	149.6 Å²	149.6	80%	0.803	80%	0.796	S	S	*	*			trans	-105.9	141.2	-169.6	-79.3	-111.9	0	0	0	112.1
885	C	23.6	Very low	24.4	Very low	124 Å²	124	148.7 Å²	148.7	84%	0.838	79%	0.791	S	S	*	*			trans	-169.1	136.2	132.4	-92.8	0	0	0	0	108
886	K	24.4	Very low	24.3	Very low	179 Å²	179	148.5 Å²	148.5	78%	0.778	78%	0.783	S	S	*	*			cis	88.1	70.5	29.3	-158.8	-171.7	-178.4	-176.1	0	115.3
887	C	23	Very low	24.2	Very low	123 Å²	123	147.7 Å²	147.7	83%	0.831	78%	0.779	S	S	*	*			trans	-134.3	142	146.8	-74.8	0	0	0	0	107
888	I	22.4	Very low	24.3	Very low	127 Å²	127	145.1 Å²	145.1	65%	0.651	77%	0.77	S	S	*	*			cis	93.4	118.7	34.2	-67.7	178.6	0	0	0	113
889	E	21	Very low	24.3	Very low	163 Å²	163	144.7 Å²	144.7	76%	0.762	78%	0.776	S	S	*	*			trans	74	114.7	153.6	-74.9	168.9	162.4	0	0	124.5
890	T	22.4	Very low	24.4	Very low	129 Å²	129	144.6 Å²	144.6	79%	0.791	78%	0.776	S	S	*	*				82	155.1	126.5	60.7	0	0	0	0	123.2
891	V	31.9	Very low	24.4	Very low	129 Å²	129	143.3 Å²	143.3	78%	0.782	78%	0.781	S	S	*	*			trans	-100.7	138.3	177	176.5	0	0	0	0	109.6
892	P	25.6	Very low	24.5	Very low	115 Å²	115	143.1 Å²	143.1	75%	0.747	78%	0.775	S	S	*	*				-125.3	139.7	123.1	36.3	-30	0	0	0	109.1
893	Q	25.4	Very low	24.6	Very low	156 Å²	156	144.7 Å²	144.7	73%	0.729	78%	0.778	S	S	*	*				60.7	132.7	52.2	-105.7	-157.7	-82.3	0	0	116.9
894	D	23.4	Very low	24.7	Very low	122 Å²	122	140.2 Å²	140.2	65%	0.652	76%	0.76	S	S	*	*			trans	74.3	96.8	151.9	-65.7	8.8	0	0	0	123.1
895	S	22.9	Very low	25	Very low	101 Å²	101	137.1 Å²	137.1	71%	0.706	75%	0.749	S	S	*	*				99.8	150	110.9	83.7	0	0	0	0	121.1
896	C	22	Very low	25.2	Very low	100 Å²	100	140.7 Å²	140.7	68%	0.676	74%	0.744	S	S	*	*			trans	66.2	157.3	160.2	-64.4	0	0	0	0	117.9
897	K	23.9	Very low	25.2	Very low	178 Å²	178	138.2 Å²	138.2	77%	0.774	74%	0.739	S	S	*	*			cis	-161.6	155.2	-26.8	-112	169.8	-172.1	170	0	107.7
898	T	24.9	Very low	25.4	Very low	119 Å²	119	137.2 Å²	137.2	73%	0.73	73%	0.73	S	S	*	*			trans	14.5	129.3	154.3	56.3	0	0	0	0	120.6
899	C	23.5	Very low	25.6	Very low	128 Å²	128	138.9 Å²	138.9	87%	0.865	74%	0.739	S	S	*	*				-164.7	158.8	116.2	-101.7	0	0	0	0	113.9
900	F	27.6	Very low	25.7	Very low	188 Å²	188	135.1 Å²	135.1	83%	0.825	73%	0.731	S	S	*	*			trans	-86.7	174	174.5	-67	-99.6	0	0	0	111.4
901	P	27.8	Very low	25.8	Very low	135 Å²	135	136.1 Å²	136.1	88%	0.877	73%	0.73	S	S	*	*				-113.9	153.8	123.2	33.7	-33.9	0	0	0	112.7
902	Q	25	Very low	25.4	Very low	172 Å²	172	137.5 Å²	137.5	80%	0.804	73%	0.732	S	S	*	*			trans	-140.6	136	-177.3	166.7	-169	-9.2	0	0	108
903	Q	27.8	Very low	25.6	Very low	169 Å²	169	137.7 Å²	137.7	79%	0.79	73%	0.731	S	S	*	*			trans	179.2	120.8	153.2	-100.6	-162.2	-77.7	0	0	107.6
904	D	26	Very low	26.1	Very low	104 Å²	104	135.7 Å²	135.7	56%	0.556	73%	0.731	S	S	*	*				92.8	142.4	86.3	-85.6	-12	0	0	0	113
905	Q	30.8	Very low	26.3	Very low	119 Å²	119	138.6 Å²	138.6	56%	0.556	74%	0.741	S	S	*	*			cis	-168.9	153.3	-17.5	-136.1	178.1	85.2	0	0	109
906	R	27.5	Very low	26.3	Very low	198 Å²	198	137.5 Å²	137.5	75%	0.747	75%	0.746	S	S	*	*			trans	66.8	165.4	160.4	-63.4	-178	-150.7	-153.2	3.3	117.8
907	D	25.4	Very low	26.5	Very low	127 Å²	127	138.9 Å²	138.9	68%	0.679	75%	0.746	S	S	*	*			cis	-165.5	175.1	-21.2	-99.4	-27.8	0	0	0	108.3
908	T	26.4	Very low	26.8	Very low	103 Å²	103	138.7 Å²	138.7	63%	0.632	75%	0.745	S	S	*	*			cis	-179.3	128.1	-41.6	-84.8	0	0	0	0	109.5
909	L	25.8	Very low	26.8	Very low	162 Å²	162	142.2 Å²	142.2	85%	0.848	75%	0.753	S	S	*	*			trans	63.6	162	173.4	-63.6	168.5	0	0	0	117.7
910	S	24.8	Very low	27	Very low	84 Å²	84	141 Å²	141	59%	0.587	75%	0.747	S	S	*	*			cis	-172.5	166.8	-31.7	62.9	0	0	0	0	113
911	I	23.2	Very low	27	Very low	150 Å²	150	137.2 Å²	137.2	77%	0.769	74%	0.744	S	S	*	*			trans	72.1	118.1	159	-58.6	164.3	0	0	0	119.6
912	L	24.3	Very low	26.9	Very low	158 Å²	158	136.5 Å²	136.5	83%	0.827	73%	0.732	S	S	*	*				-166	157	111.1	-129.8	112.1	0	0	0	113.5
913	V	29.8	Very low	27.2	Very low	118 Å²	118	136.6 Å²	136.6	72%	0.715	73%	0.73	S	S	*	*			trans	-145.8	137.1	179.9	174.5	0	0	0	0	109.9
914	P	35.6	Very low	27.2	Very low	114 Å²	114	137.8 Å²	137.8	74%	0.74	73%	0.733	S	S	*	*				-134.3	130.1	125.8	12.5	9.3	0	0	0	111.6
915	H	27.1	Very low	27.1	Very low	183 Å²	183	140.2 Å²	140.2	85%	0.847	74%	0.744	S	S	*	*				78.8	123.2	73.1	-90.1	-65.6	0	0	0	116.4
916	G	23.8	Very low	26.9	Very low	79 Å²	79	138.9 Å²	138.9	81%	0.814	75%	0.753	S	S	*	*			trans	178.2	129.4	167.3	0	0	0	0	0	108.9
917	D	25.1	Very low	27	Very low	129 Å²	129	136.6 Å²	136.6	69%	0.69	76%	0.761	S	S	*	*			trans	-151.2	145.2	-165.8	-176.6	35	0	0	0	111.8
918	K	31.4	Very low	27.1	Very low	173 Å²	173	133.6 Å²	133.6	75%	0.752	76%	0.76	S	S	*	*			trans	61.2	137.3	175	-62	158.1	-170.9	160.3	0	118.6
919	E	25.3	Very low	27.2	Very low	193 Å²	193	134.7 Å²	134.7	90%	0.902	77%	0.767	S	S	*	*				-170.7	-173.5	90.6	-126.2	176.2	-161	0	0	112.3
920	S	26.3	Very low	27.3	Very low	104 Å²	104	133.5 Å²	133.5	73%	0.727	76%	0.757	S	S	*	*			trans	-150.6	159.3	-170.3	62.1	0	0	0	0	114.3
921	S	28.1	Very low	27.5	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	77%	0.769	S	S	*	*			trans	97.2	138.3	160.9	81.1	0	0	0	0	120.4
922	D	26.6	Very low	27.7	Very low	120 Å²	120	139.8 Å²	139.8	64%	0.642	77%	0.769	S	S	*	*			trans	70.7	123.5	135.2	-81.9	22	0	0	0	126.1
923	K	30.3	Very low	28.4	Very low	173 Å²	173	139.6 Å²	139.6	75%	0.752	77%	0.767	S	S	*	*			trans	84.7	98.8	133.4	-68.9	173.3	-179.6	112.3	0	122.5
924	K	27.9	Very low	28.7	Very low	194 Å²	194	139.5 Å²	139.5	84%	0.843	77%	0.769	S	S	*	*				75.7	155	105	-153.5	176.5	-175.6	-179.5	0	120.7
925	I	24.8	Very low	28.4	Very low	156 Å²	156	145.3 Å²	145.3	80%	0.8	78%	0.776	S	S	*	*			trans	85	123.4	171.7	-49.8	172.4	0	0	0	113.9
926	A	26.6	Very low	28.3	Very low	91 Å²	91	143 Å²	143	75%	0.752	77%	0.77	S	S	*	*			cis	116.1	122.9	-5.4	0	0	0	0	0	117.7
927	V	28.8	Very low	28.8	Very low	150 Å²	150	146.9 Å²	146.9	91%	0.909	77%	0.767	S	S	*	*			trans	-151.9	137.7	160.5	-176.8	0	0	0	0	103.5
928	G	27.1	Very low	29.2	Very low	64 Å²	64	146.3 Å²	146.3	66%	0.66	77%	0.773	S	S	*	*			cis	109.8	125.9	30.4	0	0	0	0	0	107.3
929	T	28.8	Very low	29.3	Very low	125 Å²	125	143.6 Å²	143.6	77%	0.767	78%	0.776	S	S	*	*			cis	-142.6	146.9	20.4	16.2	0	0	0	0	110.1
930	E	27.6	Very low	29.5	Very low	138 Å²	138	141.6 Å²	141.6	65%	0.645	77%	0.771	S	S	*	*				68.2	127.2	96.4	-142.6	172.8	-132.9	0	0	113
931	W	28.7	Very low	30	Very low	222 Å²	222	141.5 Å²	141.5	84%	0.841	77%	0.771	S	S	*	*				-150.8	171.1	60.9	-92	79.6	0	0	0	115.9
932	D	27.6	Very low	30.1	Very low	144 Å²	144	140.6 Å²	140.6	77%	0.77	77%	0.77	S	S	*	*			trans	-87.7	170.6	-170.7	-94.1	-55.8	0	0	0	117.5
933	I	38.3	Very low	30.4	Very low	153 Å²	153	143 Å²	143	79%	0.785	78%	0.782	S	S	*	*			trans	-82.2	149.6	179.3	-56.6	158.6	0	0	0	112.1
934	P	36.4	Very low	30.4	Very low	116 Å²	116	137.6 Å²	137.6	75%	0.753	78%	0.776	S	S	*	*			trans	-127.6	160	139.9	38.1	-30.3	0	0	0	114.9
935	R	29.1	Very low	30.4	Very low	236 Å²	236	135.2 Å²	135.2	89%	0.891	77%	0.772	S	S	*	*			trans	-72.1	175.8	162.5	-64.8	176.5	169	96.9	-5.5	109.1
936	N	26.8	Very low	30.6	Very low	135 Å²	135	132.4 Å²	132.4	72%	0.722	77%	0.766	S	S	*	*			cis	-158.5	-166.9	28.9	70.1	-54.4	0	0	0	113.7
937	E	33.3	Very low	30.6	Very low	160 Å²	160	136 Å²	136	75%	0.748	77%	0.768	S	S	*	*			trans	-76	155.9	175.1	-43.9	93.9	164	0	0	113.9
938	S	33.8	Very low	30.9	Very low	118 Å²	118	133.9 Å²	133.9	83%	0.825	76%	0.759	S	S	*	*			trans	-153.7	107.2	145.2	63.5	0	0	0	0	111.5
939	S	32.4	Very low	31.2	Very low	116 Å²	116	139.3 Å²	139.3	81%	0.811	77%	0.767	S	S	*	*			trans	-70	150.6	146.5	-49.5	0	0	0	0	108.4
940	D	30	Very low	31.3	Very low	150 Å²	150	140.1 Å²	140.1	80%	0.802	77%	0.767	S	S	*	*				-164.9	162.7	101.2	-148.8	-7.5	0	0	0	112.3
941	S	36.3	Very low	31.4	Very low	102 Å²	102	139.4 Å²	139.4	71%	0.713	77%	0.772	S	S	*	*			trans	-72.8	163.4	173.9	-24.3	0	0	0	0	112.2
942	A	31.5	Very low	31.4	Very low	89 Å²	89	131.7 Å²	131.7	74%	0.736	76%	0.762	S	S	*	*			trans	-156.5	106.5	146.5	0	0	0	0	0	112.1
943	L	32.1	Very low	31.5	Very low	171 Å²	171	132.7 Å²	132.7	90%	0.895	76%	0.762	S	S	*	*			trans	45.7	135.8	136.5	-47	175.2	0	0	0	119.9
944	G	30.6	Very low	30.8	Very low	60 Å²	60	131 Å²	131	62%	0.619	75%	0.754	S	S	*	*			cis	155.9	169.4	0.3	0	0	0	0	0	111.5
945	D	27.6	Very low	30.3	Very low	144 Å²	144	132.4 Å²	132.4	77%	0.77	75%	0.752	S	S	*	*			trans	62.1	123.1	151.1	-52.3	-17.3	0	0	0	117.6
946	S	28.9	Very low	30.1	Very low	97 Å²	97	126.5 Å²	126.5	68%	0.678	74%	0.743	S	S	*	*				65.6	142.6	73	-61	0	0	0	0	113
947	E	27.7	Very low	30	Very low	167 Å²	167	130.2 Å²	130.2	78%	0.78	75%	0.747	S	S	*	*			cis	-169.4	161.5	-9.1	56.3	-146.1	126.3	0	0	109.3
948	S	34.9	Very low	29.5	Very low	105 Å²	105	130 Å²	130	73%	0.734	75%	0.745	S	S	*	*			trans	176.8	112.7	155.3	18.7	0	0	0	0	108.2
949	E	32.2	Very low	28.9	Very low	177 Å²	177	130.5 Å²	130.5	83%	0.827	74%	0.743	S	S	*	*				69.9	115.6	71.7	-67.8	-171.6	142.8	0	0	112.3
950	D	31.7	Very low	28.5	Very low	142 Å²	142	130 Å²	130	76%	0.759	74%	0.74	S	S	*	*			cis	103.5	174.6	41.5	-172.9	41.9	0	0	0	111.5
951	T	30.5	Very low	28.2	Very low	124 Å²	124	128.1 Å²	128.1	76%	0.761	74%	0.738	S	S	*	*			trans	81.4	126.9	-167.5	72.5	0	0	0	0	114.1
952	G	27.4	Very low	27.7	Very low	60 Å²	60	132.2 Å²	132.2	62%	0.619	74%	0.739	S	S	*	*			cis	-169.8	-179	-7.8	0	0	0	0	0	108.4
953	H	29.3	Very low	27.3	Very low	165 Å²	165	138.3 Å²	138.3	76%	0.764	75%	0.745	S	S	*	*			cis	-165.8	160.9	19.8	-78.5	-87.9	0	0	0	107.2
954	D	25	Very low	27	Very low	118 Å²	118	133.9 Å²	133.9	63%	0.631	74%	0.741	S	S	*	*			cis	-159.6	157.8	-5.8	-131	-49.6	0	0	0	112.7
955	M	25.3	Very low	26.7	Very low	145 Å²	145	134.4 Å²	134.4	71%	0.714	75%	0.746	S	S	*	*			trans	63.9	133.4	143.4	-149.5	56.8	64.7	0	0	124.5
956	T	24.2	Very low	26.7	Very low	112 Å²	112	136.8 Å²	136.8	69%	0.687	75%	0.753	S	S	*	*			trans	78.3	95.5	151.8	32.8	0	0	0	0	124
957	R	24.7	Very low	26.5	Very low	213 Å²	213	141.1 Å²	141.1	80%	0.804	76%	0.762	S	S	*	*				57.4	122.2	113.2	-82.7	-172.9	173.5	-179.5	-0.7	123.1
958	Q	22.7	Very low	26.5	Very low	155 Å²	155	142.5 Å²	142.5	72%	0.724	77%	0.769	S	S	*	*				74.3	135.6	127	-78.9	-178.5	-61.5	0	0	122.7
959	V	22.8	Very low	26.2	Very low	129 Å²	129	144.8 Å²	144.8	78%	0.782	77%	0.773	S	S	*	*			trans	82	117.9	150.2	171.8	0	0	0	0	119.3
960	S	22.3	Very low	26.1	Very low	106 Å²	106	148.3 Å²	148.3	74%	0.741	78%	0.779	S	S	*	*			trans	56	112.9	147.9	178.8	0	0	0	0	120.9
961	S	25.6	Very low	26	Very low	109 Å²	109	146 Å²	146	76%	0.762	78%	0.779	S	S	*	*				-163.3	149.4	123.6	-174.7	0	0	0	0	113.5
962	Y	23.8	Very low	26	Very low	188 Å²	188	149.1 Å²	149.1	74%	0.737	79%	0.785	S	S	*	*			trans	-46.3	163.5	152.4	-59.9	-106.2	0	0	0	112.8
963	Y	24.8	Very low	26.1	Very low	217 Å²	217	155.7 Å²	155.7	85%	0.851	80%	0.8	S	S	*	*			cis	-162	141.9	25.8	-134.5	-63	0	0	0	112.1
964	G	24.4	Very low	26	Very low	79 Å²	79	155 Å²	155	81%	0.814	80%	0.802	S	S	*	*			trans	83.4	134.4	146	0	0	0	0	0	120.3
965	G	24.8	Very low	26.2	Very low	71 Å²	71	158.4 Å²	158.4	73%	0.732	81%	0.814	S	S	*	*			trans	144.2	116.4	166.8	0	0	0	0	0	113.7
966	E	27.4	Very low	26.6	Very low	193 Å²	193	158.8 Å²	158.8	90%	0.902	82%	0.817	S	S	*	*			trans	-36.7	127	174.1	-63.2	110.3	-143.5	0	0	113.7
967	Q	24.9	Very low	26.8	Very low	189 Å²	189	158.8 Å²	158.8	88%	0.883	82%	0.819	S	S	*	*				66	86.7	53.1	-166.1	-176.2	-8.7	0	0	114.8
968	E	28.6	Very low	26.9	Very low	195 Å²	195	157.9 Å²	157.9	91%	0.911	82%	0.821	S	S	*	*			trans	-155.5	117.9	141.6	-133.8	166.7	-152.7	0	0	108.8
969	D	27.6	Very low	27.2	Very low	153 Å²	153	156.3 Å²	156.3	82%	0.818	82%	0.824	S	S	*	*			trans	-147.7	149.4	173.6	-152.9	-8.3	0	0	0	108.6
970	W	30.4	Very low	27.4	Very low	252 Å²	252	153.5 Å²	153.5	96%	0.955	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-79.7	128.2	-156.4	-66.7	74.6	0	0	0	113
971	A	30	Very low	27.9	Very low	92 Å²	92	153.8 Å²	153.8	76%	0.76	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-101.5	142.6	171.2	0	0	0	0	0	110.7
972	E	30.1	Very low	28	Very low	191 Å²	191	157.7 Å²	157.7	89%	0.893	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-69.3	138.8	-179.4	-64.5	165.3	114.9	0	0	111.3	D974	E972-D974 PolarHBondContact O-N 3.16Å
973	E	28.7	Very low	28.4	Very low	198 Å²	198	156.7 Å²	156.7	93%	0.925	83%	0.833	S	S	*	*			trans	-81.8	96.4	174.7	-68.6	-169.4	144.7	0	0	110.6	E975	E973-E975 PolarHBondContact O-N 3.28Å
974	D	28.5	Very low	28.8	Very low	151 Å²	151	153 Å²	153	81%	0.807	83%	0.827	S	S	*	*			trans	-65.1	116.9	168	-91.8	-38.3	0	0	0	110.7	E972 I976	E972-D974 PolarHBondContact O-N 3.16Å; D974-I976 PolarHBondContact O-N 3.28Å
975	E	27.8	Very low	29.1	Very low	189 Å²	189	157.4 Å²	157.4	88%	0.883	83%	0.826	S	S	*	*			trans	-65.8	99.7	171.5	-77	-163.9	141.9	0	0	110.7	E973 P977	E973-E975 PolarHBondContact O-N 3.28Å; E975-P977 VanDerWaalsContact O-CD 3.22Å; E975-P977 WeakPolarHBondContact O-CD 3.32Å
976	I	33.6	Very low	29.8	Very low	153 Å²	153	158.5 Å²	158.5	79%	0.785	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-67.1	117.6	173.1	-56.5	176.8	0	0	0	109.1	D974 F978	D974-I976 PolarHBondContact O-N 3.28Å; I976-F978 PolarHBondContact O-N 2.95Å
977	P	28.7	Very low	29.9	Very low	112 Å²	112	154.7 Å²	154.7	73%	0.727	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-65.1	135.1	175.4	-19.5	33.4	0	0	0	110.5	E975	E975-P977 VanDerWaalsContact O-CD 3.22Å; E975-P977 WeakPolarHBondContact O-CD 3.32Å
978	F	26.4	Very low	30.4	Very low	194 Å²	194	149.9 Å²	149.9	85%	0.851	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-53.5	142.5	170.3	-81.4	-87.9	0	0	0	110.4	I976 G980	I976-F978 PolarHBondContact O-N 2.95Å; F978-G980 PolarHBondContact O-N 3.01Å
979	P	30.1	Very low	31.1	Very low	122 Å²	122	145.5 Å²	145.5	79%	0.792	79%	0.792	S	S	*	*			trans	-59.2	107.8	-179	24.3	-33.9	0	0	0	109.5	S981	P979-S981 PolarHBondContact O-N 3.43Å
980	G	27.6	Very low	31.9	Very low	70 Å²	70	146.1 Å²	146.1	72%	0.722	79%	0.79	S	S	*	*			trans	-64.4	106	-172.7	0	0	0	0	0	111	F978 K982	F978-G980 PolarHBondContact O-N 3.01Å; G980-K982 PolarHBondContact O-N 3.29Å
981	S	31.7	Very low	33	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	77%	0.765	S	S	*	*			trans	-54.1	110.6	159.1	54.5	0	0	0	0	107.2	P979 L983	P979-S981 PolarHBondContact O-N 3.43Å; S981-L983 PolarHBondContact O-N 3.4Å
982	K	27.5	Very low	34.3	Very low	190 Å²	190	135.3 Å²	135.3	83%	0.826	74%	0.742	S	S	*	*			trans	-48.6	129.8	171.3	-68.7	176.5	-177.6	170.8	0	106.8	G980 I984	G980-K982 PolarHBondContact O-N 3.29Å; K982-I984 PolarHBondContact O-N 2.89Å
983	L	31.9	Very low	35.8	Very low	168 Å²	168	126.7 Å²	126.7	88%	0.88	70%	0.702	S	S	*	*			trans	-67.2	87.4	178.9	-172.1	76.9	0	0	0	108.2	S981 E985	S981-L983 PolarHBondContact O-N 3.4Å; L983-E985 PolarHBondContact O-N 2.87Å
984	I	33.7	Very low	37.4	Very low	139 Å²	139	118 Å²	118	71%	0.713	66%	0.664	S	S	*	*			trans	-54.6	125.7	164.4	-62.9	176.4	0	0	0	105.1	K982 V986	K982-I984 PolarHBondContact O-N 2.89Å; I984-V986 VanDerWaalsContact C-N 3.28Å; I984-V986 WeakPolarHBondContact O-CG2 3.27Å; I984-V986 PolarHBondContact O-N 3.34Å
985	E	31.5	Very low	39.8	Very low	172 Å²	172	112 Å²	112	80%	0.804	63%	0.632	S	S	*	*			trans	-69.7	91.1	-179	-168.5	167.4	-148.4	0	0	108.2	L983 S987	L983-E985 PolarHBondContact O-N 2.87Å; E985-S987 VanDerWaalsContact C-N 3.29Å; E985-S987 PolarHBondContact O-N 2.71Å; E985-S987 PolarHBondContact O-OG 2.83Å; E985-S987 VanDerWaalsContact O-OG 3.05Å
986	V	38.3	Very low	42.6	Very low	94 Å²	94	103 Å²	103	57%	0.57	59%	0.59	S	S	*	*			trans	-64.1	90.8	-173.7	-176.6	0	0	0	0	108.7	I984 A988 V989	I984-V986 VanDerWaalsContact C-N 3.28Å; I984-V986 WeakPolarHBondContact O-CG2 3.27Å; I984-V986 PolarHBondContact O-N 3.34Å; V986-A988 VanDerWaalsContact C-N 3.26Å; V986-A988 PolarHBondContact O-N 2.92Å; V986-V989 HydrophobicContact CG1-CG2 3.63Å
987	S	29.4	Very low	45	Very low	112 Å²	112	95.8 Å²	95.8	78%	0.783	55%	0.553	S	S	*	*			trans	-78.1	77.1	-167.5	10.7	0	0	0	0	109.8	E985 V989	E985-S987 VanDerWaalsContact C-N 3.29Å; E985-S987 PolarHBondContact O-N 2.71Å; E985-S987 PolarHBondContact O-OG 2.83Å; E985-S987 VanDerWaalsContact O-OG 3.05Å; S987-V989 PolarHBondContact O-N 2.84Å
988	A	36.9	Very low	47.7	Very low	88 Å²	88	91.6 Å²	91.6	73%	0.727	52%	0.523	S	S	*	.			trans	46.5	62.7	172.9	0	0	0	0	0	113.9	V986 Q990	V986-A988 VanDerWaalsContact C-N 3.26Å; V986-A988 PolarHBondContact O-N 2.92Å; A988-Q990 PolarHBondContact O-N 3.04Å
989	V	42.9	Very low	50.6	Low	103 Å²	103	82.4 Å²	82.4	62%	0.624	48%	0.482	S	S	*	.			trans	-50.5	110.6	168.6	172.6	0	0	0	0	108.5	V986 S987	V986-V989 HydrophobicContact CG1-CG2 3.63Å; S987-V989 PolarHBondContact O-N 2.84Å
990	Q	44.9	Very low	53.5	Low	166 Å²	166	76.6 Å²	76.6	78%	0.776	44%	0.444	S	S	*	.			trans	-63.5	144	176.7	-68.4	-174.3	-6.1	0	0	108.8	A988 N992	A988-Q990 PolarHBondContact O-N 3.04Å; Q990-N992 VanDerWaalsContact C-N 3.32Å; Q990-N992 PolarHBondContact O-N 2.72Å
991	P	51.7	Low	56.6	Low	68 Å²	68	73.4 Å²	73.4	44%	0.442	41%	0.411	S	S	.	.			trans	-68.3	87.3	-174.6	27.3	-35.1	0	0	0	111.3
992	N	58.6	Low	59.3	Low	50 Å²	50	68 Å²	68	27%	0.267	37%	0.373	S	S	.	.			trans	-68.3	136.7	-176	-165.8	-8.1	0	0	0	111.3	E350 Q990 A994	E350-N992 PolarHBondContact OE1-ND2 2.9Å; E350-N992 PolarHBondContact OE1-OD1 3.08Å; Q990-N992 VanDerWaalsContact C-N 3.32Å; Q990-N992 PolarHBondContact O-N 2.72Å; N992-A994 PolarHBondContact OD1-N 3.05Å
993	I	61.6	Low	62.3	Low	9 Å²	9	59.1 Å²	59.1	5%	0.046	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-3.2	179.3	-85.2	161.7	0	0	0	112.4	W32 F351 H355 N995	W32-I993 HydrophobicContact CB-CD1 3.86Å; W32-I993 HydrophobicContact CD2-CD1 3.82Å; W32-I993 HydrophobicContact CE3-CB 4.3Å; W32-I993 HydrophobicContact CE3-CD1 3.39Å; W32-I993 HydrophobicContact CE3-CG1 4.41Å; W32-I993 HydrophobicContact CE3-CG2 4.36Å; W32-I993 HydrophobicContact CG-CD1 4.07Å; W32-I993 HydrophobicContact CH2-CG2 4.33Å; W32-I993 HydrophobicContact CZ3-CB 4.15Å; W32-I993 HydrophobicContact CZ3-CD1 4.11Å; W32-I993 HydrophobicContact CZ3-CG2 4.17Å; F351-I993 HydrophobicContact CD2-CG2 4.17Å; F351-I993 HydrophobicContact CE2-CG2 4.42Å; H355-I993 PolarHBondContact CE1-O 2.84Å; I993-N995 PolarHBondContact O-N 2.83Å; I993-N995 VanDerWaalsContact O-N 3.16Å
994	A	61.1	Low	65.1	Low	17 Å²	17	53.1 Å²	53.1	14%	0.14	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-26.1	161.7	0	0	0	0	0	113.2	E350 S354 N992	E350-A994 HydrophobicContact CG-CB 4.11Å; S354-A994 VanDerWaalsContact CB-O 3.28Å; S354-A994 WeakPolarHBondContact CB-O 3.38Å; N992-A994 PolarHBondContact OD1-N 3.05Å
995	N	80.6	Confident	67.8	Low	25 Å²	25	46.5 Å²	46.5	13%	0.134	27%	0.267	C	S	.	.	S	Bend	trans	-81.4	121.4	175.6	-75	-29.1	0	0	0	112.3	L548 I993 G997 R998 S999	L548-N995 WeakPolarHBondContact CB-OD1 3.41Å; L548-N995 PolarHBondContact O-ND2 2.72Å; I993-N995 PolarHBondContact O-N 2.83Å; I993-N995 VanDerWaalsContact O-N 3.16Å; N995-G997 PolarHBondContact O-N 2.96Å; N995-G997 VanDerWaalsContact O-N 3.1Å; N995-R998 PolarHBondContact O-N 2.81Å; N995-S999 PolarHBondContact O-N 3.21Å
996	F	86	Confident	70.4	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-50.4	-37.6	175.3	-70.8	-63.4	0	0	0	113	S354 H355 L358 L502 L506 L509 R998 S999 L1000	S354-F996 WeakPolarHBondContact O-CZ 3.39Å; H355-F996 HydrophobicContact CB-CE1 4.26Å; H355-F996 AromaticContact CD2-CD1 3.57Å; H355-F996 AromaticContact CD2-CE1 3.56Å; H355-F996 AromaticContact CG-CE1 3.96Å; H355-F996 AromaticContact NE2-CD1 3.55Å; H355-F996 AromaticContact NE2-CE1 3.97Å; L358-F996 HydrophobicContact CD1-CE1 4.35Å; L502-F996 HydrophobicContact CB-CD2 4.2Å; L502-F996 HydrophobicContact CB-CE2 3.98Å; L502-F996 HydrophobicContact CD2-CD2 4.23Å; L502-F996 VanDerWaalsContact O-CD2 3.27Å; L502-F996 WeakPolarHBondContact O-CD2 3.43Å; L502-F996 WeakPolarHBondContact O-CE2 3.46Å; L506-F996 HydrophobicContact CB-CD2 3.95Å; L506-F996 HydrophobicContact CB-CE2 4.05Å; L506-F996 HydrophobicContact CB-CG 4.47Å; L506-F996 HydrophobicContact CD1-CB 4.49Å; L506-F996 HydrophobicContact CD1-CD1 3.98Å; L506-F996 HydrophobicContact CD1-CD2 4.29Å; L506-F996 HydrophobicContact CD1-CE1 4.16Å; L506-F996 HydrophobicContact CD1-CE2 4.47Å; L506-F996 HydrophobicContact CD1-CG 4.03Å; L506-F996 HydrophobicContact CD1-CZ 4.41Å; L506-F996 HydrophobicContact CD2-CE1 4.39Å; L506-F996 HydrophobicContact CD2-CE2 4.12Å; L506-F996 HydrophobicContact CD2-CZ 3.97Å; L506-F996 HydrophobicContact CG-CE2 4.45Å; L509-F996 HydrophobicContact CD1-CB 3.76Å; F996-R998 PolarHBondContact O-N 2.95Å; F996-S999 PolarHBondContact O-N 3.14Å; F996-S999 VanDerWaalsContact O-N 3.14Å; F996-L1000 HydrophobicContact CB-CD1 4.13Å; F996-L1000 HydrophobicContact CB-CG 4.35Å; F996-L1000 HydrophobicContact CD1-CD1 3.73Å; F996-L1000 HydrophobicContact CD1-CG 4.08Å; F996-L1000 HydrophobicContact CG-CD1 4.29Å; F996-L1000 WeakPolarHBondContact O-CB 3.43Å; F996-L1000 PolarHBondContact O-N 3.38Å
997	G	83.6	Confident	72.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-24.8	179.9	0	0	0	0	0	115	L419 N995 L1001	L419-G997 WeakPolarHBondContact CD1-O 3Å; N995-G997 PolarHBondContact O-N 2.96Å; N995-G997 VanDerWaalsContact O-N 3.1Å; G997-L1001 VanDerWaalsContact O-CD1 3.25Å; G997-L1001 WeakPolarHBondContact O-CD1 3.42Å; G997-L1001 WeakPolarHBondContact O-CG 3.4Å
998	R	85.1	Confident	75.6	Confident	25 Å²	25	36.5 Å²	36.5	9%	0.094	22%	0.217	C	C	.	.	H	α-helix	trans	-100.8	-23.4	172.4	-69.8	179.4	175.9	76.6	-0.6	112.5	L419 S423 E547 N995 F996	L419-R998 HydrophobicContact CD1-CG 4.07Å; S423-R998 PolarHBondContact OG-NH2 3.03Å; E547-R998 IonicContact OE1-CZ 2.79Å; E547-R998 IonicContact OE1-NH1 3.64Å; E547-R998 PolarHBondContact OE1-NH1 3.25Å; E547-R998 IonicContact OE1-NH2 2.75Å; E547-R998 PolarHBondContact OE1-NH2 3.24Å; E547-R998 IonicContact OE2-CZ 3.62Å; E547-R998 IonicContact OE2-NH1 2.64Å; E547-R998 PolarHBondContact OE2-NH1 3.19Å; E547-R998 IonicContact OE2-NH2 3.47Å; N995-R998 PolarHBondContact O-N 2.81Å; F996-R998 PolarHBondContact O-N 2.95Å
999	S	88.6	Confident	78.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-82.4	-40.9	-177.2	-174.8	0	0	0	0	114.7	F351 H355 R412 N995 F996	F351-S999 WeakPolarHBondContact CE2-OG 3.18Å; H355-S999 PolarHBondContact CE1-OG 3.12Å; H355-S999 WeakPolarHBondContact NE2-CB 3.46Å; H355-S999 PolarHBondContact NE2-OG 2.92Å; R412-S999 WeakPolarHBondContact CD-O 3.37Å; R412-S999 PolarHBondContact NE-O 3.39Å; R412-S999 VanDerWaalsContact NE-O 3.13Å; N995-S999 PolarHBondContact O-N 3.21Å; F996-S999 PolarHBondContact O-N 3.14Å; F996-S999 VanDerWaalsContact O-N 3.14Å
1000	L	91.2	Very high	80.2	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.157	C	C	.	.	S	Bend	trans	-93.3	-1.7	-171.5	-56.7	-174.6	0	0	0	114.6	L358 L407 L506 F996 G1002 F1012 V1013	L358-L1000 HydrophobicContact CD1-CD1 4.49Å; L358-L1000 HydrophobicContact CD1-CD2 3.81Å; L407-L1000 HydrophobicContact CD1-CD2 4.39Å; L506-L1000 HydrophobicContact CD1-CD1 3.5Å; L506-L1000 VanDerWaalsContact CD1-CD1 3.5Å; F996-L1000 HydrophobicContact CB-CD1 4.13Å; F996-L1000 HydrophobicContact CB-CG 4.35Å; F996-L1000 HydrophobicContact CD1-CD1 3.73Å; F996-L1000 HydrophobicContact CD1-CG 4.08Å; F996-L1000 HydrophobicContact CG-CD1 4.29Å; F996-L1000 WeakPolarHBondContact O-CB 3.43Å; F996-L1000 PolarHBondContact O-N 3.38Å; L1000-G1002 PolarHBondContact O-N 2.8Å; L1000-F1012 HydrophobicContact CD2-CD1 4.36Å; L1000-V1013 HydrophobicContact CB-CB 4.44Å; L1000-V1013 HydrophobicContact CB-CG2 3.96Å; L1000-V1013 HydrophobicContact CD1-CG2 4.16Å; L1000-V1013 PolarHBondContact O-N 2.71Å; L1000-V1013 VanDerWaalsContact O-N 3.15Å
1001	L	91.8	Very high	82.3	Confident	3 Å²	3	20.8 Å²	20.8	2%	0.016	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	81.3	170.7	-62.2	-176.9	0	0	0	109.3	I413 P416 T540 I543 G997 L1014	I413-L1001 HydrophobicContact CD1-CB 4.41Å; I413-L1001 PolarHBondContact N-O 2.85Å; P416-L1001 HydrophobicContact CB-CD1 3.72Å; P416-L1001 HydrophobicContact CG-CD1 3.83Å; T540-L1001 HydrophobicContact CG2-CD1 4Å; I543-L1001 HydrophobicContact CG2-CD2 4.41Å; G997-L1001 VanDerWaalsContact O-CD1 3.25Å; G997-L1001 WeakPolarHBondContact O-CD1 3.42Å; G997-L1001 WeakPolarHBondContact O-CG 3.4Å; L1001-L1014 HydrophobicContact CD2-CB 3.73Å; L1001-L1014 HydrophobicContact CD2-CD2 4.29Å
1002	G	89.2	Confident	84.3	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	144.7	179	0	0	0	0	0	113.2	L1000 L1014	L1000-G1002 PolarHBondContact O-N 2.8Å; G1002-L1014 WeakPolarHBondContact CA-O 3.42Å; G1002-L1014 PolarHBondContact N-O 2.97Å
1003	G	89.7	Confident	86	Confident	3 Å²	3	15.2 Å²	15.2	3%	0.031	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-146	171.7	0	0	0	0	0	112.4	P411 C1005 G1016	P411-G1003 PolarHBondContact O-N 3.29Å; G1003-C1005 PolarHBondContact O-N 3.29Å; G1003-G1016 PolarHBondContact O-N 2.94Å
1004	Y	91.8	Very high	87.6	Confident	41 Å²	41	14.8 Å²	14.8	16%	0.161	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	105.9	175.6	-168.2	-105.8	0	0	0	110.5	P411 G526 Q529 V532 G1018	P411-Y1004 WeakPolarHBondContact CG-O 2.78Å; G526-Y1004 WeakPolarHBondContact O-CE2 3.5Å; G526-Y1004 PolarHBondContact O-OH 3.43Å; Q529-Y1004 HydrophobicContact CB-CD1 3.95Å; Q529-Y1004 HydrophobicContact CB-CE1 3.87Å; Q529-Y1004 HydrophobicContact CB-CG 4.3Å; Q529-Y1004 HydrophobicContact CG-CD1 3.59Å; Q529-Y1004 HydrophobicContact CG-CD2 4.46Å; Q529-Y1004 HydrophobicContact CG-CE1 4.05Å; Q529-Y1004 HydrophobicContact CG-CG 3.81Å; V532-Y1004 HydrophobicContact CB-CD2 3.89Å; V532-Y1004 HydrophobicContact CB-CE2 4.09Å; V532-Y1004 HydrophobicContact CG1-CD2 3.71Å; V532-Y1004 HydrophobicContact CG1-CE2 4.16Å; V532-Y1004 HydrophobicContact CG2-CD2 4.4Å; V532-Y1004 HydrophobicContact CG2-CE2 4.09Å; Y1004-G1018 WeakPolarHBondContact OH-CA 3.36Å
1005	C	89	Confident	89.2	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	144.5	-173.6	-58.7	0	0	0	0	111.3	M410 G1003 S1007 G1016	M410-C1005 HydrophobicContact CG-CB 4.4Å; M410-C1005 HydrophobicContact SD-CB 3.92Å; G1003-C1005 PolarHBondContact O-N 3.29Å; C1005-S1007 VanDerWaalsContact C-N 3.27Å; C1005-S1007 WeakPolarHBondContact CB-O 3.49Å; C1005-S1007 PolarHBondContact O-N 2.85Å; C1005-G1016 PolarHBondContact N-O 3.14Å
1006	S	86.1	Confident	89.8	Confident	99 Å²	99	12.8 Å²	12.8	69%	0.692	7%	0.074	S	C	*	.	S	Bend	trans	-71.3	-22.7	176.8	54.2	0	0	0	0	113.2
1007	S	87.4	Confident	90.2	Very high	41 Å²	41	12.9 Å²	12.9	29%	0.287	8%	0.075	S	C	.	.	S	Bend	trans	-146.2	152.9	175.7	53.7	0	0	0	0	110.5	N406 C1005	N406-S1007 PolarHBondContact ND2-OG 3.43Å; N406-S1007 VanDerWaalsContact ND2-OG 3.08Å; C1005-S1007 VanDerWaalsContact C-N 3.27Å; C1005-S1007 WeakPolarHBondContact CB-O 3.49Å; C1005-S1007 PolarHBondContact O-N 2.85Å
1008	Y	90.6	Very high	90.3	Very high	29 Å²	29	14.1 Å²	14.1	11%	0.114	9%	0.087	C	C	.	.			trans	-61.1	136.8	175.1	168.7	-110.7	0	0	0	112.4	R521 V523 P1010 F1023 C1026	R521-Y1008 PolarHBondContact NE-OH 2.96Å; R521-Y1008 PolarHBondContact NH1-OH 3.35Å; R521-Y1008 PolarHBondContact NH2-OH 3.35Å; V523-Y1008 HydrophobicContact CG2-CD2 4.29Å; V523-Y1008 HydrophobicContact CG2-CE2 3.94Å; Y1008-P1010 HydrophobicContact CE1-CB 4.31Å; Y1008-F1023 AromaticContact CD1-CD2 3.93Å; Y1008-F1023 HydrophobicContact CD1-CD2 3.93Å; Y1008-F1023 AromaticContact CD2-CD2 3.41Å; Y1008-F1023 HydrophobicContact CD2-CD2 3.41Å; Y1008-F1023 VanDerWaalsContact CD2-CD2 3.41Å; Y1008-F1023 AromaticContact CD2-CE2 3.79Å; Y1008-F1023 HydrophobicContact CD2-CE2 3.79Å; Y1008-F1023 HydrophobicContact CD2-CG 4.42Å; Y1008-F1023 HydrophobicContact CE1-CD2 4.08Å; Y1008-F1023 AromaticContact CE2-CD2 3.6Å; Y1008-F1023 HydrophobicContact CE2-CD2 3.6Å; Y1008-F1023 AromaticContact CE2-CE2 3.56Å; Y1008-F1023 HydrophobicContact CE2-CE2 3.56Å; Y1008-F1023 HydrophobicContact CG-CB 4.3Å; Y1008-F1023 AromaticContact CG-CD2 3.58Å; Y1008-F1023 HydrophobicContact CG-CD2 3.58Å; Y1008-F1023 HydrophobicContact CG-CE2 4.38Å; Y1008-F1023 HydrophobicContact CG-CG 4.37Å; Y1008-F1023 AromaticContact CZ-CD2 3.92Å; Y1008-F1023 AromaticContact CZ-CE2 3.98Å; Y1008-C1026 HydrophobicContact CD1-CB 4.36Å; Y1008-C1026 HydrophobicContact CE1-CB 4.31Å
1009	V	90.1	Very high	90	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	11%	0.107	C	C	.	.			trans	-117.2	125.4	174.4	-175	0	0	0	0	108.2	N406 M410 D1011 F1012 Q1015	N406-V1009 HydrophobicContact CB-CG2 3.9Å; M410-V1009 HydrophobicContact CG-CG2 3.88Å; V1009-D1011 VanDerWaalsContact C-N 3.32Å; V1009-D1011 PolarHBondContact O-N 2.83Å; V1009-F1012 HydrophobicContact CB-CD2 3.76Å; V1009-F1012 HydrophobicContact CB-CE2 4.18Å; V1009-F1012 HydrophobicContact CB-CG 4.12Å; V1009-F1012 HydrophobicContact CG1-CD1 4.41Å; V1009-F1012 HydrophobicContact CG1-CD2 4.16Å; V1009-F1012 HydrophobicContact CG1-CE2 4.4Å; V1009-F1012 HydrophobicContact CG1-CG 4.18Å; V1009-F1012 HydrophobicContact CG2-CD2 4Å; V1009-F1012 HydrophobicContact CG2-CE2 3.98Å; V1009-Q1015 PolarHBondContact O-NE2 3.4Å; V1009-Q1015 PolarHBondContact O-OE1 3.35Å
1010	P	86.3	Confident	89.3	Confident	15 Å²	15	17.8 Å²	17.8	10%	0.097	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-26.7	-171.3	27.7	-34.3	0	0	0	113.9	T403 R521 Y1008 D1030	T403-P1010 HydrophobicContact CG2-CG 4.42Å; R521-P1010 PolarHBondContact NH1-O 3.41Å; Y1008-P1010 HydrophobicContact CE1-CB 4.31Å; P1010-D1030 HydrophobicContact CB-CB 4.31Å
1011	D	89.1	Confident	88.6	Confident	12 Å²	12	25.2 Å²	25.2	6%	0.064	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-18.6	-172.4	-42.4	-81.7	0	0	0	114	L358 H362 L407 Y510 V1009 V1013	L358-D1011 HydrophobicContact CD1-CB 4.19Å; L358-D1011 HydrophobicContact CD2-CB 4.26Å; H362-D1011 IonicContact CD2-OD1 2.68Å; H362-D1011 IonicContact CE1-OD1 2.71Å; H362-D1011 IonicContact CE1-OD2 3.2Å; H362-D1011 PolarHBondContact CE1-OD2 2.85Å; H362-D1011 IonicContact NE2-OD1 2.72Å; H362-D1011 PolarHBondContact NE2-OD1 3.18Å; H362-D1011 IonicContact NE2-OD2 2.73Å; H362-D1011 PolarHBondContact NE2-OD2 2.59Å; L407-D1011 HydrophobicContact CD1-CB 4.1Å; Y510-D1011 PolarHBondContact OH-O 3.24Å; V1009-D1011 VanDerWaalsContact C-N 3.32Å; V1009-D1011 PolarHBondContact O-N 2.83Å; D1011-V1013 PolarHBondContact O-N 3.11Å
1012	F	93.2	Very high	87.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.			trans	-71.4	121.4	-179	-75.8	-16.2	0	0	0	111.3	L407 M410 L1000 V1009 L1014 Q1015	L407-F1012 HydrophobicContact CD1-CD1 4.26Å; L407-F1012 HydrophobicContact CD1-CE1 3.9Å; M410-F1012 HydrophobicContact CB-CE2 3.69Å; M410-F1012 HydrophobicContact CB-CZ 3.96Å; M410-F1012 HydrophobicContact CG-CE2 4.44Å; L1000-F1012 HydrophobicContact CD2-CD1 4.36Å; V1009-F1012 HydrophobicContact CB-CD2 3.76Å; V1009-F1012 HydrophobicContact CB-CE2 4.18Å; V1009-F1012 HydrophobicContact CB-CG 4.12Å; V1009-F1012 HydrophobicContact CG1-CD1 4.41Å; V1009-F1012 HydrophobicContact CG1-CD2 4.16Å; V1009-F1012 HydrophobicContact CG1-CE2 4.4Å; V1009-F1012 HydrophobicContact CG1-CG 4.18Å; V1009-F1012 HydrophobicContact CG2-CD2 4Å; V1009-F1012 HydrophobicContact CG2-CE2 3.98Å; F1012-L1014 VanDerWaalsContact C-N 3.29Å; F1012-L1014 PolarHBondContact O-N 3.47Å; F1012-Q1015 HydrophobicContact CB-CB 4.14Å; F1012-Q1015 HydrophobicContact CD2-CB 4.19Å; F1012-Q1015 PolarHBondContact O-NE2 3.08Å
1013	V	94.2	Very high	87.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	S	Bend	trans	-63.9	-37.3	178.6	173.2	0	0	0	0	110.8	L509 Y510 T522 I543 L1000 D1011	L509-V1013 HydrophobicContact CB-CG1 4.29Å; L509-V1013 HydrophobicContact CB-CG2 3.98Å; L509-V1013 WeakPolarHBondContact O-CG1 3.42Å; Y510-V1013 HydrophobicContact CD1-CG2 3.91Å; Y510-V1013 HydrophobicContact CE1-CG2 3.66Å; T522-V1013 PolarHBondContact N-O 2.86Å; I543-V1013 HydrophobicContact CG2-CG1 3.9Å; L1000-V1013 HydrophobicContact CB-CB 4.44Å; L1000-V1013 HydrophobicContact CB-CG2 3.96Å; L1000-V1013 HydrophobicContact CD1-CG2 4.16Å; L1000-V1013 PolarHBondContact O-N 2.71Å; L1000-V1013 VanDerWaalsContact O-N 3.15Å; D1011-V1013 PolarHBondContact O-N 3.11Å
1014	L	95.5	Very high	87.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	133.1	174.1	-179.3	64.2	0	0	0	108.7	I413 T522 L536 L539 T540 I543 L1001 G1002 F1012	I413-L1014 HydrophobicContact CD1-CD2 4.09Å; T522-L1014 HydrophobicContact CG2-CD1 3.85Å; T522-L1014 WeakPolarHBondContact O-CA 3.26Å; L536-L1014 HydrophobicContact CB-CD2 4.46Å; L536-L1014 HydrophobicContact CD2-CD1 3.71Å; L536-L1014 HydrophobicContact CD2-CD2 4.35Å; L536-L1014 HydrophobicContact CD2-CG 3.81Å; L539-L1014 HydrophobicContact CB-CD1 4.2Å; L539-L1014 HydrophobicContact CB-CD2 4.06Å; L539-L1014 HydrophobicContact CD1-CD1 3.84Å; T540-L1014 HydrophobicContact CG2-CD2 3.86Å; I543-L1014 HydrophobicContact CD1-CB 4.08Å; I543-L1014 HydrophobicContact CD1-CD1 4.04Å; I543-L1014 HydrophobicContact CD1-CD2 4.33Å; I543-L1014 HydrophobicContact CD1-CG 4.37Å; L1001-L1014 HydrophobicContact CD2-CB 3.73Å; L1001-L1014 HydrophobicContact CD2-CD2 4.29Å; G1002-L1014 WeakPolarHBondContact CA-O 3.42Å; G1002-L1014 PolarHBondContact N-O 2.97Å; F1012-L1014 VanDerWaalsContact C-N 3.29Å; F1012-L1014 PolarHBondContact O-N 3.47Å
1015	Q	94.6	Very high	86.7	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	154.5	173.5	70.4	-165.8	-82.1	0	0	112.4	T522 V523 V524 V1009 F1012	T522-Q1015 PolarHBondContact O-N 3.17Å; T522-Q1015 VanDerWaalsContact O-N 3.12Å; V523-Q1015 HydrophobicContact CG1-CG 4.29Å; V523-Q1015 HydrophobicContact CG2-CG 4.11Å; V524-Q1015 PolarHBondContact N-O 2.95Å; V1009-Q1015 PolarHBondContact O-NE2 3.4Å; V1009-Q1015 PolarHBondContact O-OE1 3.35Å; F1012-Q1015 HydrophobicContact CB-CB 4.14Å; F1012-Q1015 HydrophobicContact CD2-CB 4.19Å; F1012-Q1015 PolarHBondContact O-NE2 3.08Å
1016	G	93.3	Very high	86.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	141.6	167.5	0	0	0	0	0	112.1	V524 G1003 C1005	V524-G1016 CarbonylContact O-C 3.58Å; V524-G1016 VanDerWaalsContact O-CA 3.3Å; V524-G1016 WeakPolarHBondContact O-CA 3.49Å; G1003-G1016 PolarHBondContact O-N 2.94Å; C1005-G1016 PolarHBondContact N-O 3.14Å
1017	I	93	Very high	86.7	Confident	3 Å²	3	42 Å²	42	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	147.1	175.1	61.2	173.6	0	0	0	112.4	V523 V524 V525 G526 F1023	V523-I1017 HydrophobicContact CG1-CD1 3.69Å; V523-I1017 HydrophobicContact CG1-CG1 3.85Å; V524-I1017 PolarHBondContact O-N 3.14Å; V525-I1017 WeakPolarHBondContact CA-O 3.36Å; V525-I1017 HydrophobicContact CB-CG1 4.46Å; V525-I1017 HydrophobicContact CG1-CG1 4.45Å; V525-I1017 HydrophobicContact CG2-CD1 4.13Å; V525-I1017 HydrophobicContact CG2-CG1 3.99Å; G526-I1017 PolarHBondContact N-O 3.37Å; I1017-F1023 HydrophobicContact CD1-CB 3.7Å; I1017-F1023 HydrophobicContact CD1-CD1 3.86Å; I1017-F1023 HydrophobicContact CD1-CD2 4.33Å; I1017-F1023 HydrophobicContact CD1-CG 3.72Å
1018	G	86.3	Confident	86.6	Confident	25 Å²	25	43.7 Å²	43.7	26%	0.258	22%	0.22	S	C	.	.	S	Bend	trans	-85.3	-19.9	-178.7	0	0	0	0	0	116.3	Y1004	Y1004-G1018 WeakPolarHBondContact OH-CA 3.36Å
1019	S	78.2	Confident	86.4	Confident	72 Å²	72	45.4 Å²	45.4	50%	0.503	24%	0.235	S	C	.	.			trans	-139.4	129.3	-173.2	65.1	0	0	0	0	113
1020	D	74.7	Confident	86.4	Confident	30 Å²	30	45.9 Å²	45.9	16%	0.16	24%	0.238	C	C	.	.	S	Bend	trans	-71.7	-43.7	-177.9	-167.4	19	0	0	0	112.7	V525 R1022 F1023 R1024	V525-D1020 HydrophobicContact CG1-CB 4.34Å; D1020-R1022 PolarHBondContact O-N 3.34Å; D1020-F1023 WeakPolarHBondContact O-CA 3.32Å; D1020-F1023 VanDerWaalsContact O-CB 3.3Å; D1020-F1023 WeakPolarHBondContact O-CB 3.47Å; D1020-F1023 PolarHBondContact O-N 3.04Å; D1020-R1024 HydrophobicContact CB-CG 4.45Å; D1020-R1024 WeakPolarHBondContact O-CG 3.41Å; D1020-R1024 PolarHBondContact O-N 2.89Å; D1020-R1024 WeakPolarHBondContact OD1-CG 3.47Å; D1020-R1024 WeakPolarHBondContact OD2-CD 3.47Å; D1020-R1024 IonicContact OD2-CZ 3.72Å; D1020-R1024 IonicContact OD2-NE 3.93Å; D1020-R1024 IonicContact OD2-NH1 2.75Å; D1020-R1024 PolarHBondContact OD2-NH1 3.37Å
1021	E	76.6	Confident	86.5	Confident	157 Å²	157	45.4 Å²	45.4	73%	0.734	24%	0.235	S	C	*	.	H	α-helix	trans	-49.4	-51.4	-159.3	-63.8	-179	-179.8	0	0	116.8
1022	R	76.5	Confident	86.5	Confident	200 Å²	200	47.1 Å²	47.1	76%	0.755	25%	0.248	S	C	*	.	H	α-helix	trans	-71.3	-38.3	179.3	-66.3	-172.1	-174.9	-176.4	3.2	112.1	D1020 R1024 Q1025 C1026	D1020-R1022 PolarHBondContact O-N 3.34Å; R1022-R1024 VanDerWaalsContact C-N 3.3Å; R1022-R1024 PolarHBondContact O-N 2.9Å; R1022-Q1025 PolarHBondContact O-N 3.39Å; R1022-Q1025 VanDerWaalsContact O-N 3.12Å; R1022-C1026 PolarHBondContact O-N 3.49Å
1023	F	84.1	Confident	86.2	Confident	3 Å²	3	48.2 Å²	48.2	1%	0.013	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-42.3	176.9	159.3	-113.5	0	0	0	111.2	V523 V525 Y1008 I1017 D1020 Q1025 C1026 L1027 I1051 L1073	V523-F1023 HydrophobicContact CB-CE2 4.23Å; V523-F1023 HydrophobicContact CB-CZ 3.92Å; V523-F1023 HydrophobicContact CG1-CE1 4.2Å; V523-F1023 HydrophobicContact CG1-CE2 4.05Å; V523-F1023 HydrophobicContact CG1-CZ 3.84Å; V523-F1023 HydrophobicContact CG2-CE2 3.87Å; V523-F1023 HydrophobicContact CG2-CZ 4.02Å; V525-F1023 HydrophobicContact CG2-CE1 4.39Å; Y1008-F1023 AromaticContact CD1-CD2 3.93Å; Y1008-F1023 HydrophobicContact CD1-CD2 3.93Å; Y1008-F1023 AromaticContact CD2-CD2 3.41Å; Y1008-F1023 HydrophobicContact CD2-CD2 3.41Å; Y1008-F1023 VanDerWaalsContact CD2-CD2 3.41Å; Y1008-F1023 AromaticContact CD2-CE2 3.79Å; Y1008-F1023 HydrophobicContact CD2-CE2 3.79Å; Y1008-F1023 HydrophobicContact CD2-CG 4.42Å; Y1008-F1023 HydrophobicContact CE1-CD2 4.08Å; Y1008-F1023 AromaticContact CE2-CD2 3.6Å; Y1008-F1023 HydrophobicContact CE2-CD2 3.6Å; Y1008-F1023 AromaticContact CE2-CE2 3.56Å; Y1008-F1023 HydrophobicContact CE2-CE2 3.56Å; Y1008-F1023 HydrophobicContact CG-CB 4.3Å; Y1008-F1023 AromaticContact CG-CD2 3.58Å; Y1008-F1023 HydrophobicContact CG-CD2 3.58Å; Y1008-F1023 HydrophobicContact CG-CE2 4.38Å; Y1008-F1023 HydrophobicContact CG-CG 4.37Å; Y1008-F1023 AromaticContact CZ-CD2 3.92Å; Y1008-F1023 AromaticContact CZ-CE2 3.98Å; I1017-F1023 HydrophobicContact CD1-CB 3.7Å; I1017-F1023 HydrophobicContact CD1-CD1 3.86Å; I1017-F1023 HydrophobicContact CD1-CD2 4.33Å; I1017-F1023 HydrophobicContact CD1-CG 3.72Å; D1020-F1023 WeakPolarHBondContact O-CA 3.32Å; D1020-F1023 VanDerWaalsContact O-CB 3.3Å; D1020-F1023 WeakPolarHBondContact O-CB 3.47Å; D1020-F1023 PolarHBondContact O-N 3.04Å; F1023-Q1025 PolarHBondContact O-N 2.85Å; F1023-C1026 PolarHBondContact O-N 3.06Å; F1023-L1027 HydrophobicContact CD2-CB 4.29Å; F1023-L1027 HydrophobicContact CE1-CD2 4.43Å; F1023-L1027 HydrophobicContact CE2-CB 4.09Å; F1023-L1027 HydrophobicContact CE2-CD1 3.95Å; F1023-L1027 HydrophobicContact CE2-CD2 3.99Å; F1023-L1027 HydrophobicContact CE2-CG 4.22Å; F1023-L1027 HydrophobicContact CZ-CD1 4.42Å; F1023-L1027 HydrophobicContact CZ-CD2 3.77Å; F1023-L1027 HydrophobicContact CZ-CG 4.49Å; F1023-L1027 VanDerWaalsContact O-CB 3.26Å; F1023-L1027 WeakPolarHBondContact O-CB 3.49Å; F1023-L1027 PolarHBondContact O-N 3.38Å; F1023-I1051 HydrophobicContact CE1-CD1 4.08Å; F1023-I1051 HydrophobicContact CE1-CG1 4.35Å; F1023-I1051 HydrophobicContact CE1-CG2 3.91Å; F1023-I1051 HydrophobicContact CZ-CD1 3.99Å; F1023-I1051 HydrophobicContact CZ-CG1 4.06Å; F1023-I1051 HydrophobicContact CZ-CG2 4.34Å; F1023-L1073 HydrophobicContact CE1-CD1 4.25Å
1024	R	81.2	Confident	86	Confident	80 Å²	80	49 Å²	49	30%	0.302	26%	0.259	S	S	.	.	H	α-helix	trans	-54.2	-36.4	174.8	-56.5	-169.6	74.2	109.7	-8.6	113.8	D1020 R1022 N1071 L1073	D1020-R1024 HydrophobicContact CB-CG 4.45Å; D1020-R1024 WeakPolarHBondContact O-CG 3.41Å; D1020-R1024 PolarHBondContact O-N 2.89Å; D1020-R1024 WeakPolarHBondContact OD1-CG 3.47Å; D1020-R1024 WeakPolarHBondContact OD2-CD 3.47Å; D1020-R1024 IonicContact OD2-CZ 3.72Å; D1020-R1024 IonicContact OD2-NE 3.93Å; D1020-R1024 IonicContact OD2-NH1 2.75Å; D1020-R1024 PolarHBondContact OD2-NH1 3.37Å; R1022-R1024 VanDerWaalsContact C-N 3.3Å; R1022-R1024 PolarHBondContact O-N 2.9Å; R1024-N1071 PolarHBondContact NH2-O 3.2Å; R1024-L1073 HydrophobicContact CB-CD2 3.86Å; R1024-L1073 HydrophobicContact CG-CD1 4.04Å; R1024-L1073 HydrophobicContact CG-CD2 3.85Å; R1024-L1073 HydrophobicContact CG-CG 4.34Å
1025	Q	81.4	Confident	85.6	Confident	157 Å²	157	51.1 Å²	51.1	73%	0.734	27%	0.272	S	S	*	.	H	α-helix	trans	-81.9	-38	-175.3	-64	177.6	1.1	0	0	111.9	R1022 F1023	R1022-Q1025 PolarHBondContact O-N 3.39Å; R1022-Q1025 VanDerWaalsContact O-N 3.12Å; F1023-Q1025 PolarHBondContact O-N 2.85Å
1026	C	85.1	Confident	85.1	Confident	56 Å²	56	57.4 Å²	57.4	38%	0.378	30%	0.301	S	S	.	.	H	α-helix	trans	-76.7	-39.5	178.5	-61.9	0	0	0	0	112.9	Y1008 R1022 F1023 T1028 S1029 D1030	Y1008-C1026 HydrophobicContact CD1-CB 4.36Å; Y1008-C1026 HydrophobicContact CE1-CB 4.31Å; R1022-C1026 PolarHBondContact O-N 3.49Å; F1023-C1026 PolarHBondContact O-N 3.06Å; C1026-T1028 PolarHBondContact O-N 3.43Å; C1026-S1029 WeakPolarHBondContact O-CB 3.38Å; C1026-S1029 PolarHBondContact O-N 2.78Å; C1026-D1030 PolarHBondContact O-N 3.23Å
1027	L	88.6	Confident	84.5	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-51.9	-48.5	-166.5	175.5	62.9	0	0	0	114.1	F1023 S1029 D1030 L1031 C1049 I1051 A1062	F1023-L1027 HydrophobicContact CD2-CB 4.29Å; F1023-L1027 HydrophobicContact CE1-CD2 4.43Å; F1023-L1027 HydrophobicContact CE2-CB 4.09Å; F1023-L1027 HydrophobicContact CE2-CD1 3.95Å; F1023-L1027 HydrophobicContact CE2-CD2 3.99Å; F1023-L1027 HydrophobicContact CE2-CG 4.22Å; F1023-L1027 HydrophobicContact CZ-CD1 4.42Å; F1023-L1027 HydrophobicContact CZ-CD2 3.77Å; F1023-L1027 HydrophobicContact CZ-CG 4.49Å; F1023-L1027 VanDerWaalsContact O-CB 3.26Å; F1023-L1027 WeakPolarHBondContact O-CB 3.49Å; F1023-L1027 PolarHBondContact O-N 3.38Å; L1027-S1029 VanDerWaalsContact C-N 3.35Å; L1027-S1029 PolarHBondContact O-N 2.87Å; L1027-D1030 PolarHBondContact O-N 3.49Å; L1027-L1031 HydrophobicContact CD1-CD1 3.96Å; L1027-L1031 HydrophobicContact CD1-CD2 4.44Å; L1027-L1031 HydrophobicContact CD1-CG 3.9Å; L1027-L1031 HydrophobicContact CG-CD1 4.04Å; L1027-L1031 HydrophobicContact CG-CG 4.35Å; L1027-L1031 WeakPolarHBondContact O-CB 3.41Å; L1027-L1031 WeakPolarHBondContact O-CG 3.43Å; L1027-L1031 PolarHBondContact O-N 3.11Å; L1027-C1049 HydrophobicContact CD1-CB 3.7Å; L1027-C1049 HydrophobicContact CD2-CB 4.43Å; L1027-I1051 HydrophobicContact CD2-CD1 3.64Å; L1027-A1062 HydrophobicContact CD2-CB 3.86Å
1028	T	87	Confident	83.9	Confident	78 Å²	78	61.4 Å²	61.4	48%	0.479	32%	0.323	S	S	.	.	H	α-helix	trans	-66	-38.3	-178	-51.6	0	0	0	0	111.8	C1026 S1032	C1026-T1028 PolarHBondContact O-N 3.43Å; T1028-S1032 PolarHBondContact O-N 2.52Å
1029	S	86.6	Confident	83.7	Confident	64 Å²	64	61 Å²	61	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-62.3	-48.4	173.9	-176.2	0	0	0	0	110.4	C1026 L1027 L1031 S1032 H1033	C1026-S1029 WeakPolarHBondContact O-CB 3.38Å; C1026-S1029 PolarHBondContact O-N 2.78Å; L1027-S1029 VanDerWaalsContact C-N 3.35Å; L1027-S1029 PolarHBondContact O-N 2.87Å; S1029-L1031 PolarHBondContact O-N 2.86Å; S1029-S1032 PolarHBondContact O-N 2.78Å; S1029-S1032 PolarHBondContact O-OG 3.22Å; S1029-H1033 WeakPolarHBondContact O-CB 3.15Å; S1029-H1033 PolarHBondContact O-N 3.28Å
1030	D	88.5	Confident	83.8	Confident	11 Å²	11	58.5 Å²	58.5	6%	0.059	30%	0.297	C	S	.	.	H	α-helix	trans	-69.3	-32.8	-177.7	-61.3	-33.4	0	0	0	112.8	K365 P1010 C1026 L1027 A1034	K365-D1030 IonicContact NZ-OD1 3.34Å; K365-D1030 PolarHBondContact NZ-OD1 3.21Å; P1010-D1030 HydrophobicContact CB-CB 4.31Å; C1026-D1030 PolarHBondContact O-N 3.23Å; L1027-D1030 PolarHBondContact O-N 3.49Å; D1030-A1034 WeakPolarHBondContact O-CB 3.38Å; D1030-A1034 PolarHBondContact O-N 2.75Å
1031	L	89.9	Confident	83.7	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-66.4	-38.3	170.9	-73.7	177.9	0	0	0	111.7	L1027 S1029 A1047 C1049 A1062	L1027-L1031 HydrophobicContact CD1-CD1 3.96Å; L1027-L1031 HydrophobicContact CD1-CD2 4.44Å; L1027-L1031 HydrophobicContact CD1-CG 3.9Å; L1027-L1031 HydrophobicContact CG-CD1 4.04Å; L1027-L1031 HydrophobicContact CG-CG 4.35Å; L1027-L1031 WeakPolarHBondContact O-CB 3.41Å; L1027-L1031 WeakPolarHBondContact O-CG 3.43Å; L1027-L1031 PolarHBondContact O-N 3.11Å; S1029-L1031 PolarHBondContact O-N 2.86Å; L1031-A1047 HydrophobicContact CD2-CB 3.8Å; L1031-C1049 HydrophobicContact CD1-CB 4.39Å; L1031-C1049 HydrophobicContact CD2-CB 4.21Å; L1031-A1062 HydrophobicContact CD1-CB 4.04Å
1032	S	88.4	Confident	83.6	Confident	48 Å²	48	57.6 Å²	57.6	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-69.8	-38.3	176	76	0	0	0	0	112.2	T1028 S1029 V1035 Q1036	T1028-S1032 PolarHBondContact O-N 2.52Å; S1029-S1032 PolarHBondContact O-N 2.78Å; S1029-S1032 PolarHBondContact O-OG 3.22Å; S1032-V1035 PolarHBondContact O-N 3.1Å; S1032-Q1036 WeakPolarHBondContact O-CG 3.12Å; S1032-Q1036 PolarHBondContact O-N 2.83Å; S1032-Q1036 VanDerWaalsContact O-N 3.14Å
1033	H	87.2	Confident	83.6	Confident	24 Å²	24	52.3 Å²	52.3	11%	0.111	29%	0.286	C	S	.	.	H	α-helix	trans	-66.2	-43.9	178.2	176.2	-97.4	0	0	0	111.9	S361 K365 S1029 V1035 Q1036 H1037	S361-H1033 PolarHBondContact O-CE1 3.12Å; S361-H1033 PolarHBondContact O-NE2 2.63Å; S361-H1033 PolarHBondContact OG-CE1 2.88Å; K365-H1033 WeakPolarHBondContact CA-NE2 3.39Å; K365-H1033 VanDerWaalsContact CB-NE2 3.25Å; K365-H1033 WeakPolarHBondContact CB-NE2 3.28Å; K365-H1033 PolarHBondContact N-NE2 3.36Å; S1029-H1033 WeakPolarHBondContact O-CB 3.15Å; S1029-H1033 PolarHBondContact O-N 3.28Å; H1033-V1035 PolarHBondContact O-N 3Å; H1033-Q1036 PolarHBondContact O-N 2.85Å; H1033-Q1036 VanDerWaalsContact O-N 3.08Å; H1033-H1037 AromaticContact CD2-CD2 3.71Å; H1033-H1037 AromaticContact NE2-CD2 3.09Å; H1033-H1037 PolarHBondContact NE2-CD2 3.27Å; H1033-H1037 AromaticContact NE2-CG 3.79Å; H1033-H1037 PolarHBondContact O-N 3.31Å
1034	A	88.5	Confident	83.7	Confident	15 Å²	15	52.8 Å²	52.8	12%	0.124	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-26.1	178.5	0	0	0	0	0	114.2	L519 D1030 I1044 A1047	L519-A1034 HydrophobicContact CD1-CB 4.49Å; D1030-A1034 WeakPolarHBondContact O-CB 3.38Å; D1030-A1034 PolarHBondContact O-N 2.75Å; A1034-I1044 VanDerWaalsContact O-CD1 3.27Å; A1034-I1044 WeakPolarHBondContact O-CD1 3.36Å; A1034-A1047 HydrophobicContact CB-CB 4.13Å
1035	V	87.9	Confident	84	Confident	45 Å²	45	50.8 Å²	50.8	27%	0.273	29%	0.288	S	S	.	.	H	α-helix	trans	-85	-35.7	173.3	178.4	0	0	0	0	112	S1032 H1033 I1044 A1047 S1064	S1032-V1035 PolarHBondContact O-N 3.1Å; H1033-V1035 PolarHBondContact O-N 3Å; V1035-I1044 HydrophobicContact CG2-CG2 4.21Å; V1035-A1047 HydrophobicContact CG2-CB 3.69Å; V1035-S1064 WeakPolarHBondContact CG2-OG 3.38Å
1036	Q	84.1	Confident	84.4	Confident	133 Å²	133	44 Å²	44	62%	0.621	26%	0.257	S	S	*	.	H	α-helix	trans	-72.5	-31.3	177.6	-71.1	173.1	14.1	0	0	113	S1032 H1033	S1032-Q1036 WeakPolarHBondContact O-CG 3.12Å; S1032-Q1036 PolarHBondContact O-N 2.83Å; S1032-Q1036 VanDerWaalsContact O-N 3.14Å; H1033-Q1036 PolarHBondContact O-N 2.85Å; H1033-Q1036 VanDerWaalsContact O-N 3.08Å
1037	H	81.4	Confident	84.7	Confident	49 Å²	49	41.4 Å²	41.4	23%	0.227	24%	0.24	C	C	.	.	S	Bend	trans	-132.9	82.2	179.9	-65.8	-42.7	0	0	0	109.7	N364 S368 H1033	N364-H1037 HydrophobicContact CB-CB 4.43Å; S368-H1037 PolarHBondContact OG-NE2 2.79Å; H1033-H1037 AromaticContact CD2-CD2 3.71Å; H1033-H1037 AromaticContact NE2-CD2 3.09Å; H1033-H1037 PolarHBondContact NE2-CD2 3.27Å; H1033-H1037 AromaticContact NE2-CG 3.79Å; H1033-H1037 PolarHBondContact O-N 3.31Å
1038	P	80.6	Confident	84.8	Confident	37 Å²	37	41.5 Å²	41.5	24%	0.24	24%	0.24	C	C	.	.			trans	-53.5	144.8	174	-27.5	36	0	0	0	113.2	W305 L1040 I1044	W305-P1038 HydrophobicContact CH2-CG 4.33Å; W305-P1038 HydrophobicContact CZ3-CG 4.41Å; P1038-L1040 VanDerWaalsContact CB-O 3.32Å; P1038-L1040 WeakPolarHBondContact CB-O 3.5Å; P1038-I1044 HydrophobicContact CB-CD1 3.6Å; P1038-I1044 HydrophobicContact CB-CG1 4.27Å; P1038-I1044 HydrophobicContact CG-CD1 4Å; P1038-I1044 HydrophobicContact CG-CG1 4.48Å
1039	V	81.2	Confident	85.2	Confident	18 Å²	18	37.8 Å²	37.8	11%	0.109	22%	0.217	C	C	.	.	S	Bend	trans	-87.5	-18	168.5	-173.2	0	0	0	0	111.1	P357 L358 L506	P357-V1039 HydrophobicContact CB-CG1 3.52Å; L358-V1039 HydrophobicContact CD2-CG1 3.97Å; L358-V1039 HydrophobicContact CD2-CG2 4.47Å; L506-V1039 HydrophobicContact CD2-CG1 3.82Å
1040	L	79.2	Confident	85.6	Confident	19 Å²	19	34.8 Å²	34.8	10%	0.099	20%	0.196	C	C	.	.	S	Bend	trans	-108.2	155.5	179.6	-54.2	177.4	0	0	0	110.4	L506 A512 L519 P1038 E1042	L506-L1040 HydrophobicContact CB-CD2 4.49Å; L506-L1040 HydrophobicContact CD2-CD2 4.2Å; L506-L1040 HydrophobicContact CG-CD2 4.26Å; A512-L1040 HydrophobicContact CB-CD1 3.55Å; L519-L1040 HydrophobicContact CD2-CD1 3.85Å; P1038-L1040 VanDerWaalsContact CB-O 3.32Å; P1038-L1040 WeakPolarHBondContact CB-O 3.5Å; L1040-E1042 VanDerWaalsContact C-N 3.27Å; L1040-E1042 PolarHBondContact O-N 3.35Å
1041	D	73.6	Confident	85.8	Confident	79 Å²	79	34.6 Å²	34.6	42%	0.422	20%	0.195	S	C	.	.	S	Bend	trans	-68.6	-18.9	177.4	-85	-31.6	0	0	0	114.4	W305 W503	W305-D1041 WeakPolarHBondContact CH2-O 3.44Å; W503-D1041 HydrophobicContact CZ3-CB 4.5Å
1042	E	74.1	Confident	85.9	Confident	88 Å²	88	34.4 Å²	34.4	41%	0.411	19%	0.194	S	C	.	.	S	Bend	trans	-91	139.8	180	-64	-163.3	174	0	0	111.8	K484 V517 L1040 I1044	K484-E1042 IonicContact NZ-OE1 2.69Å; K484-E1042 PolarHBondContact NZ-OE1 2.88Å; V517-E1042 HydrophobicContact CG2-CB 4.49Å; L1040-E1042 VanDerWaalsContact C-N 3.27Å; L1040-E1042 PolarHBondContact O-N 3.35Å; E1042-I1044 PolarHBondContact O-N 3.48Å; E1042-I1044 VanDerWaalsContact O-N 3.16Å
1043	P	77.5	Confident	86.1	Confident	90 Å²	90	32.7 Å²	32.7	58%	0.584	18%	0.181	S	C	*	.			trans	-65.3	113.3	-176.6	23	-32.1	0	0	0	112.6	W305 A1045	W305-P1043 HydrophobicContact CZ2-CB 3.94Å; P1043-A1045 PolarHBondContact O-N 3.09Å
1044	I	86.1	Confident	86.2	Confident	12 Å²	12	31.8 Å²	31.8	6%	0.062	18%	0.177	C	C	.	.			trans	-70.4	124.6	173.6	-56.9	156.5	0	0	0	109.5	L519 A1034 V1035 P1038 E1042	L519-I1044 HydrophobicContact CD1-CD1 3.44Å; L519-I1044 VanDerWaalsContact CD1-CD1 3.44Å; L519-I1044 HydrophobicContact CD1-CG1 4.31Å; L519-I1044 HydrophobicContact CD2-CD1 4.13Å; L519-I1044 HydrophobicContact CD2-CG1 4.22Å; L519-I1044 HydrophobicContact CG-CD1 3.63Å; L519-I1044 HydrophobicContact CG-CG1 3.94Å; L519-I1044 HydrophobicContact CG-CG2 4.12Å; A1034-I1044 VanDerWaalsContact O-CD1 3.27Å; A1034-I1044 WeakPolarHBondContact O-CD1 3.36Å; V1035-I1044 HydrophobicContact CG2-CG2 4.21Å; P1038-I1044 HydrophobicContact CB-CD1 3.6Å; P1038-I1044 HydrophobicContact CB-CG1 4.27Å; P1038-I1044 HydrophobicContact CG-CD1 4Å; P1038-I1044 HydrophobicContact CG-CG1 4.48Å; E1042-I1044 PolarHBondContact O-N 3.48Å; E1042-I1044 VanDerWaalsContact O-N 3.16Å
1045	A	86.4	Confident	86.2	Confident	38 Å²	38	34.1 Å²	34.1	31%	0.314	19%	0.188	S	C	.	.	S	Bend	trans	-85.5	-34.3	174.2	0	0	0	0	0	112.6	P516 V517 P1043 Q1065	P516-A1045 HydrophobicContact CB-CB 3.72Å; P516-A1045 HydrophobicContact CG-CB 4.1Å; V517-A1045 PolarHBondContact O-N 2.71Å; P1043-A1045 PolarHBondContact O-N 3.09Å; A1045-Q1065 PolarHBondContact O-NE2 2.86Å
1046	E	89.8	Confident	86.2	Confident	15 Å²	15	38 Å²	38	7%	0.07	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	128	-175.4	-168.4	178	-167.6	0	0	110.7	R518 L519 V1048 S1063 Q1065	R518-E1046 VanDerWaalsContact CA-O 3.24Å; R518-E1046 WeakPolarHBondContact CA-O 3.44Å; R518-E1046 HydrophobicContact CG-CB 4.22Å; R518-E1046 IonicContact CZ-OE2 3.63Å; R518-E1046 IonicContact NE-OE2 3.74Å; R518-E1046 PolarHBondContact NE-OE2 2.69Å; R518-E1046 IonicContact NH2-OE2 2.72Å; R518-E1046 PolarHBondContact NH2-OE2 2.74Å; L519-E1046 PolarHBondContact N-O 2.82Å; L519-E1046 VanDerWaalsContact N-O 3.11Å; E1046-V1048 HydrophobicContact CB-CG2 4.47Å; E1046-V1048 HydrophobicContact CG-CG2 3.78Å; E1046-S1063 WeakPolarHBondContact OE1-CB 3.39Å; E1046-S1063 PolarHBondContact OE1-OG 2.93Å; E1046-Q1065 HydrophobicContact CB-CG 4.43Å; E1046-Q1065 HydrophobicContact CG-CG 4.09Å
1047	A	91.2	Very high	86.4	Confident	2 Å²	2	34.5 Å²	34.5	2%	0.017	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	135	165.7	0	0	0	0	0	108.8	L1031 A1034 V1035 S1063 S1064	L1031-A1047 HydrophobicContact CD2-CB 3.8Å; A1034-A1047 HydrophobicContact CB-CB 4.13Å; V1035-A1047 HydrophobicContact CG2-CB 3.69Å; A1047-S1063 WeakPolarHBondContact O-CA 3.46Å; A1047-S1064 PolarHBondContact N-OG 3.49Å; A1047-S1064 PolarHBondContact O-N 2.73Å; A1047-S1064 PolarHBondContact O-OG 2.8Å
1048	V	92.6	Very high	86.8	Confident	3 Å²	3	34 Å²	34	2%	0.018	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.1	-169.2	-175.4	0	0	0	0	110	L519 A520 R521 E1046 V1061 A1062	L519-V1048 PolarHBondContact O-N 3.1Å; A520-V1048 WeakPolarHBondContact CA-O 3.46Å; R521-V1048 PolarHBondContact N-O 2.84Å; E1046-V1048 HydrophobicContact CB-CG2 4.47Å; E1046-V1048 HydrophobicContact CG-CG2 3.78Å; V1048-V1061 HydrophobicContact CG1-CG1 3.39Å; V1048-A1062 WeakPolarHBondContact CA-O 3.2Å
1049	C	94.1	Very high	87.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120.6	173.7	-177.2	0	0	0	0	111.1	R521 L1027 L1031 V1061 A1062	R521-C1049 HydrophobicContact CG-CB 4.02Å; R521-C1049 CarbonylContact O-C 3.53Å; R521-C1049 WeakPolarHBondContact O-CA 3.28Å; L1027-C1049 HydrophobicContact CD1-CB 3.7Å; L1027-C1049 HydrophobicContact CD2-CB 4.43Å; L1031-C1049 HydrophobicContact CD1-CB 4.39Å; L1031-C1049 HydrophobicContact CD2-CB 4.21Å; C1049-V1061 WeakPolarHBondContact O-CA 3.26Å; C1049-A1062 HydrophobicContact CB-CB 4.47Å; C1049-A1062 PolarHBondContact N-O 3.47Å; C1049-A1062 PolarHBondContact O-N 3.26Å
1050	I	94.7	Very high	87.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	127.5	169.8	-56.5	163.1	0	0	0	107.6	L455 A458 V459 N462 R521 T522 V523 V1059 V1061	L455-I1050 HydrophobicContact CD1-CG2 4.02Å; A458-I1050 HydrophobicContact CB-CD1 4.23Å; A458-I1050 HydrophobicContact CB-CG1 4.25Å; A458-I1050 HydrophobicContact CB-CG2 3.76Å; A458-I1050 WeakPolarHBondContact O-CD1 3.06Å; V459-I1050 HydrophobicContact CG2-CD1 4Å; N462-I1050 HydrophobicContact CB-CD1 4.31Å; R521-I1050 PolarHBondContact O-N 3.31Å; T522-I1050 HydrophobicContact CG2-CB 4.41Å; T522-I1050 HydrophobicContact CG2-CG2 4.44Å; V523-I1050 PolarHBondContact N-O 3Å; I1050-V1059 HydrophobicContact CG2-CG1 4.09Å; I1050-V1061 HydrophobicContact CG1-CG2 4.18Å
1051	I	93.4	Very high	88.5	Confident	7 Å²	7	33.3 Å²	33.3	4%	0.036	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	111	-177.1	-47.2	179.2	0	0	0	107.8	V523 V525 F1023 L1027 V1059 Q1060 A1062 L1073	V523-I1051 WeakPolarHBondContact O-CA 3.34Å; V525-I1051 HydrophobicContact CG2-CG2 4.09Å; F1023-I1051 HydrophobicContact CE1-CD1 4.08Å; F1023-I1051 HydrophobicContact CE1-CG1 4.35Å; F1023-I1051 HydrophobicContact CE1-CG2 3.91Å; F1023-I1051 HydrophobicContact CZ-CD1 3.99Å; F1023-I1051 HydrophobicContact CZ-CG1 4.06Å; F1023-I1051 HydrophobicContact CZ-CG2 4.34Å; L1027-I1051 HydrophobicContact CD2-CD1 3.64Å; I1051-V1059 WeakPolarHBondContact O-CA 3.38Å; I1051-Q1060 PolarHBondContact N-O 3.45Å; I1051-Q1060 PolarHBondContact O-N 3.37Å; I1051-A1062 HydrophobicContact CD1-CB 4.13Å; I1051-L1073 HydrophobicContact CD1-CB 3.54Å; I1051-L1073 HydrophobicContact CD1-CD1 3.75Å; I1051-L1073 HydrophobicContact CD1-CG 4.18Å; I1051-L1073 HydrophobicContact CG2-CD1 4.4Å
1052	A	92.8	Very high	89.3	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	96.4	-175.7	0	0	0	0	0	110.1	F451 L455 V523 V524 V525 M1054	F451-A1052 HydrophobicContact CE2-CB 4.47Å; F451-A1052 HydrophobicContact CZ-CB 4.09Å; L455-A1052 HydrophobicContact CD1-CB 3.65Å; L455-A1052 HydrophobicContact CD2-CB 3.99Å; L455-A1052 HydrophobicContact CG-CB 4.46Å; V523-A1052 PolarHBondContact O-N 2.83Å; V524-A1052 CarbonylContact C-O 3.59Å; V524-A1052 WeakPolarHBondContact CA-O 3.5Å; V524-A1052 HydrophobicContact CG2-CB 4.31Å; V525-A1052 PolarHBondContact N-O 3.48Å; A1052-M1054 PolarHBondContact O-N 3.04Å
1053	D	91.2	Very high	90	Very high	13 Å²	13	26.3 Å²	26.3	7%	0.07	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	107.4	-178.3	-171.2	-34.1	0	0	0	110.4	F451 D1055 K1056 W1057 T1058	F451-D1053 WeakPolarHBondContact CE2-O 3.41Å; D1053-D1055 WeakPolarHBondContact OD1-CA 3.41Å; D1053-D1055 WeakPolarHBondContact OD1-CB 2.97Å; D1053-D1055 PolarHBondContact OD1-N 3.04Å; D1053-K1056 HydrophobicContact CB-CB 4.36Å; D1053-K1056 PolarHBondContact OD1-N 2.9Å; D1053-K1056 WeakPolarHBondContact OD2-CD 3.36Å; D1053-K1056 WeakPolarHBondContact OD2-CG 3.37Å; D1053-K1056 IonicContact OD2-NZ 2.57Å; D1053-K1056 PolarHBondContact OD2-NZ 3.11Å; D1053-W1057 CarbonylContact O-C 3.42Å; D1053-W1057 WeakPolarHBondContact O-CA 3.38Å; D1053-W1057 PolarHBondContact O-N 2.74Å; D1053-T1058 PolarHBondContact N-O 2.95Å; D1053-T1058 PolarHBondContact O-N 3.42Å; D1053-T1058 VanDerWaalsContact O-N 3.1Å
1054	M	89.6	Confident	90.5	Very high	5 Å²	5	23.9 Å²	23.9	3%	0.025	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-8.9	179.1	-61.3	-168	76.9	0	0	114.1	F451 V524 V525 M531 V532 L535 A1052	F451-M1054 HydrophobicContact CE1-CG 4.37Å; F451-M1054 HydrophobicContact CZ-CG 4.03Å; V524-M1054 HydrophobicContact CG1-CG 3.75Å; V524-M1054 HydrophobicContact CG1-SD 3.59Å; V524-M1054 VanDerWaalsContact CG1-SD 3.59Å; V525-M1054 PolarHBondContact O-N 3.15Å; M531-M1054 HydrophobicContact CB-CE 3.97Å; M531-M1054 HydrophobicContact CE-CE 4.39Å; V532-M1054 HydrophobicContact CB-SD 4.31Å; V532-M1054 HydrophobicContact CG2-SD 3.72Å; L535-M1054 HydrophobicContact CB-CE 4.2Å; L535-M1054 HydrophobicContact CB-SD 4.17Å; L535-M1054 HydrophobicContact CD2-CE 3.81Å; L535-M1054 HydrophobicContact CD2-CG 4.04Å; L535-M1054 HydrophobicContact CD2-SD 3.54Å; L535-M1054 VanDerWaalsContact CD2-SD 3.54Å; A1052-M1054 PolarHBondContact O-N 3.04Å
1055	D	88.6	Confident	90.2	Very high	64 Å²	64	29.3 Å²	29.3	34%	0.342	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-39.8	172.9	-87.6	34.4	0	0	0	110.1	G526 K527 D1053	G526-D1055 WeakPolarHBondContact CA-OD1 3.26Å; K527-D1055 WeakPolarHBondContact CD-OD2 3.28Å; K527-D1055 WeakPolarHBondContact CE-OD2 3.28Å; K527-D1055 WeakPolarHBondContact CG-OD2 2.9Å; K527-D1055 PolarHBondContact N-OD1 3.21Å; K527-D1055 IonicContact NZ-OD2 2.63Å; K527-D1055 PolarHBondContact NZ-OD2 2.83Å; D1053-D1055 WeakPolarHBondContact OD1-CA 3.41Å; D1053-D1055 WeakPolarHBondContact OD1-CB 2.97Å; D1053-D1055 PolarHBondContact OD1-N 3.04Å
1056	K	87.7	Confident	89.4	Confident	126 Å²	126	35.6 Å²	35.6	55%	0.548	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-16.6	177.2	-58	-174.9	-165.1	70.4	0	114	D1053 T1058	D1053-K1056 HydrophobicContact CB-CB 4.36Å; D1053-K1056 PolarHBondContact OD1-N 2.9Å; D1053-K1056 WeakPolarHBondContact OD2-CD 3.36Å; D1053-K1056 WeakPolarHBondContact OD2-CG 3.37Å; D1053-K1056 IonicContact OD2-NZ 2.57Å; D1053-K1056 PolarHBondContact OD2-NZ 3.11Å; K1056-T1058 HydrophobicContact CB-CG2 4.16Å
1057	W	89.4	Confident	87.8	Confident	59 Å²	59	42.3 Å²	42.3	22%	0.223	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	43.5	-170.2	-54.5	93.9	0	0	0	113.7	A446 N449 F451 D1053	A446-W1057 HydrophobicContact CB-CE3 4.26Å; A446-W1057 HydrophobicContact CB-CZ3 3.74Å; N449-W1057 HydrophobicContact CB-CB 4.09Å; N449-W1057 WeakPolarHBondContact ND2-CB 3.41Å; F451-W1057 HydrophobicContact CB-CB 4.39Å; F451-W1057 HydrophobicContact CB-CE3 4.1Å; F451-W1057 AromaticContact CD1-CE3 3.79Å; F451-W1057 HydrophobicContact CD1-CE3 3.79Å; F451-W1057 HydrophobicContact CD1-CZ3 4.12Å; F451-W1057 VanDerWaalsContact CD2-C 3.41Å; F451-W1057 HydrophobicContact CD2-CB 4.28Å; F451-W1057 HydrophobicContact CD2-CE3 4.41Å; F451-W1057 HydrophobicContact CE1-CE3 4.27Å; F451-W1057 HydrophobicContact CE1-CZ3 4.46Å; F451-W1057 HydrophobicContact CG-CB 4.5Å; F451-W1057 AromaticContact CG-CE3 3.85Å; F451-W1057 HydrophobicContact CG-CE3 3.85Å; D1053-W1057 CarbonylContact O-C 3.42Å; D1053-W1057 WeakPolarHBondContact O-CA 3.38Å; D1053-W1057 PolarHBondContact O-N 2.74Å
1058	T	89.3	Confident	86.2	Confident	40 Å²	40	46 Å²	46	25%	0.245	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.5	-179.4	56.8	0	0	0	0	111.8	D1053 K1056	D1053-T1058 PolarHBondContact N-O 2.95Å; D1053-T1058 PolarHBondContact O-N 3.42Å; D1053-T1058 VanDerWaalsContact O-N 3.1Å; K1056-T1058 HydrophobicContact CB-CG2 4.16Å
1059	V	92.3	Very high	84.1	Confident	8 Å²	8	51.2 Å²	51.2	5%	0.048	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.4	174.2	-171.5	0	0	0	0	109.6	F451 A454 L455 A458 I1050 I1051 V1077	F451-V1059 HydrophobicContact CD2-CG2 3.76Å; F451-V1059 HydrophobicContact CE2-CG2 3.74Å; A454-V1059 HydrophobicContact CB-CB 4.31Å; A454-V1059 HydrophobicContact CB-CG2 3.96Å; L455-V1059 HydrophobicContact CB-CG2 3.95Å; L455-V1059 HydrophobicContact CD1-CG1 4.23Å; L455-V1059 HydrophobicContact CD1-CG2 4.49Å; A458-V1059 HydrophobicContact CB-CG1 3.94Å; I1050-V1059 HydrophobicContact CG2-CG1 4.09Å; I1051-V1059 WeakPolarHBondContact O-CA 3.38Å; V1059-V1077 HydrophobicContact CB-CB 4.48Å; V1059-V1077 HydrophobicContact CB-CG2 4.38Å; V1059-V1077 HydrophobicContact CG1-CB 4.35Å; V1059-V1077 HydrophobicContact CG1-CG2 3.85Å; V1059-V1077 PolarHBondContact O-N 3.18Å
1060	Q	91.8	Very high	81.9	Confident	23 Å²	23	58 Å²	58	11%	0.107	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	151	177.7	-65.5	-175.8	2.8	0	0	110.4	I1051 K1075 E1076	I1051-Q1060 PolarHBondContact N-O 3.45Å; I1051-Q1060 PolarHBondContact O-N 3.37Å; Q1060-K1075 CarbonylContact C-O 3.5Å; Q1060-K1075 WeakPolarHBondContact CA-O 3.47Å; Q1060-E1076 HydrophobicContact CG-CG 3.93Å
1061	V	91.8	Very high	80.2	Confident	28 Å²	28	65.5 Å²	65.5	17%	0.17	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	113.2	174.2	171.2	0	0	0	0	109.5	A458 V1048 C1049 I1050 G1074 K1075 V1077	A458-V1061 HydrophobicContact CB-CG2 4.49Å; V1048-V1061 HydrophobicContact CG1-CG1 3.39Å; C1049-V1061 WeakPolarHBondContact O-CA 3.26Å; I1050-V1061 HydrophobicContact CG1-CG2 4.18Å; V1061-G1074 CarbonylContact O-C 3.41Å; V1061-G1074 WeakPolarHBondContact O-CA 3.36Å; V1061-K1075 PolarHBondContact N-O 3.11Å; V1061-K1075 PolarHBondContact O-N 2.89Å; V1061-V1077 HydrophobicContact CB-CG2 4.38Å; V1061-V1077 HydrophobicContact CG2-CG2 3.52Å
1062	A	90.9	Very high	79	Confident	6 Å²	6	69.8 Å²	69.8	5%	0.05	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	146.6	171.5	0	0	0	0	0	110.1	L1027 L1031 V1048 C1049 I1051 L1073	L1027-A1062 HydrophobicContact CD2-CB 3.86Å; L1031-A1062 HydrophobicContact CD1-CB 4.04Å; V1048-A1062 WeakPolarHBondContact CA-O 3.2Å; C1049-A1062 HydrophobicContact CB-CB 4.47Å; C1049-A1062 PolarHBondContact N-O 3.47Å; C1049-A1062 PolarHBondContact O-N 3.26Å; I1051-A1062 HydrophobicContact CD1-CB 4.13Å; A1062-L1073 WeakPolarHBondContact CB-O 3.4Å
1063	S	89.8	Confident	77.9	Confident	14 Å²	14	70.6 Å²	70.6	10%	0.098	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	142	-174	152.1	0	0	0	0	110.4	E1046 A1047 Q1065 R1066	E1046-S1063 WeakPolarHBondContact OE1-CB 3.39Å; E1046-S1063 PolarHBondContact OE1-OG 2.93Å; A1047-S1063 WeakPolarHBondContact O-CA 3.46Å; S1063-Q1065 PolarHBondContact O-N 2.84Å; S1063-Q1065 PolarHBondContact OG-N 2.78Å; S1063-Q1065 VanDerWaalsContact OG-N 3.15Å; S1063-R1066 PolarHBondContact O-N 2.88Å
1064	S	86.9	Confident	77.3	Confident	39 Å²	39	71 Å²	71	27%	0.273	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-27	175.5	62.1	0	0	0	0	113.7	V1035 A1047	V1035-S1064 WeakPolarHBondContact CG2-OG 3.38Å; A1047-S1064 PolarHBondContact N-OG 3.49Å; A1047-S1064 PolarHBondContact O-N 2.73Å; A1047-S1064 PolarHBondContact O-OG 2.8Å
1065	Q	79.8	Confident	77.1	Confident	126 Å²	126	76.5 Å²	76.5	59%	0.589	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-20.6	-177.9	-65.9	-176	7.9	0	0	113.1	A1045 E1046 S1063	A1045-Q1065 PolarHBondContact O-NE2 2.86Å; E1046-Q1065 HydrophobicContact CB-CG 4.43Å; E1046-Q1065 HydrophobicContact CG-CG 4.09Å; S1063-Q1065 PolarHBondContact O-N 2.84Å; S1063-Q1065 PolarHBondContact OG-N 2.78Å; S1063-Q1065 VanDerWaalsContact OG-N 3.15Å
1066	R	69	Low	77	Confident	170 Å²	170	77.4 Å²	77.4	64%	0.642	38%	0.381	S	S	*	.	S	Bend	trans	-101	115.3	-173.7	-65.1	-178.3	-176.9	-110.9	-5.8	110.7	S1063 V1068	S1063-R1066 PolarHBondContact O-N 2.88Å; R1066-V1068 PolarHBondContact O-N 2.87Å
1067	R	57.7	Low	77	Confident	156 Å²	156	73 Å²	73	59%	0.589	36%	0.364	S	S	*	.			trans	-56.7	133.6	168.7	-70.9	-179	172.7	-117.1	-4.4	109.6	E183 T1069	E183-R1067 IonicContact OE1-CZ 3.61Å; E183-R1067 IonicContact OE1-NH1 3.29Å; E183-R1067 PolarHBondContact OE1-NH1 2.97Å; E183-R1067 IonicContact OE1-NH2 2.77Å; E183-R1067 PolarHBondContact OE1-NH2 2.98Å; R1067-T1069 PolarHBondContact O-N 2.68Å; R1067-T1069 VanDerWaalsContact O-N 3.11Å
1068	V	57	Low	76.8	Confident	79 Å²	79	74.3 Å²	74.3	48%	0.479	38%	0.375	S	S	.	.			trans	-68.8	106.6	176.5	-179.9	0	0	0	0	108.7	R1066 K1072	R1066-V1068 PolarHBondContact O-N 2.87Å; V1068-K1072 WeakPolarHBondContact CG1-O 3.42Å
1069	T	48	Very low	76.8	Confident	112 Å²	112	74.2 Å²	74.2	69%	0.687	37%	0.374	S	S	*	.			trans	-102.9	129.5	172.8	53.8	0	0	0	0	109.4	R1067	R1067-T1069 PolarHBondContact O-N 2.68Å; R1067-T1069 VanDerWaalsContact O-N 3.11Å
1070	D	48	Very low	76.8	Confident	144 Å²	144	73.8 Å²	73.8	77%	0.77	37%	0.372	S	S	*	.	S	Bend	trans	63.4	176.3	-174.5	-54.2	-41.1	0	0	0	115.4	K1072	D1070-K1072 PolarHBondContact O-N 3.2Å
1071	N	58.8	Low	76.7	Confident	157 Å²	157	73.9 Å²	73.9	84%	0.84	38%	0.375	S	S	*	.	S	Bend	trans	-71	19.1	-171.8	-71.5	-30.8	0	0	0	115.3	R1024	R1024-N1071 PolarHBondContact NH2-O 3.2Å
1072	K	67.7	Low	76.7	Confident	97 Å²	97	74 Å²	74	42%	0.422	38%	0.375	S	S	.	.			trans	-103.9	145.2	175.3	-60.5	-169.3	-175.2	-167.2	0	109.5	V1068 D1070 G1074 E1076	V1068-K1072 WeakPolarHBondContact CG1-O 3.42Å; D1070-K1072 PolarHBondContact O-N 3.2Å; K1072-G1074 VanDerWaalsContact C-N 3.32Å; K1072-E1076 WeakPolarHBondContact CE-OE1 3.43Å; K1072-E1076 IonicContact NZ-OE1 2.7Å; K1072-E1076 PolarHBondContact NZ-OE1 2.58Å; K1072-E1076 IonicContact NZ-OE2 2.76Å; K1072-E1076 PolarHBondContact NZ-OE2 3Å
1073	L	70.9	Confident	76.8	Confident	16 Å²	16	73.8 Å²	73.8	8%	0.084	37%	0.373	C	S	.	.	S	Bend	trans	-75.7	-24.8	-177.5	-76.1	159.8	0	0	0	112.9	F1023 R1024 I1051 A1062	F1023-L1073 HydrophobicContact CE1-CD1 4.25Å; R1024-L1073 HydrophobicContact CB-CD2 3.86Å; R1024-L1073 HydrophobicContact CG-CD1 4.04Å; R1024-L1073 HydrophobicContact CG-CD2 3.85Å; R1024-L1073 HydrophobicContact CG-CG 4.34Å; I1051-L1073 HydrophobicContact CD1-CB 3.54Å; I1051-L1073 HydrophobicContact CD1-CD1 3.75Å; I1051-L1073 HydrophobicContact CD1-CG 4.18Å; I1051-L1073 HydrophobicContact CG2-CD1 4.4Å; A1062-L1073 WeakPolarHBondContact CB-O 3.4Å
1074	G	79	Confident	77	Confident	21 Å²	21	73.8 Å²	73.8	22%	0.216	37%	0.373	C	S	.	.	S	Bend	trans	-165.2	-176.1	-175.8	0	0	0	0	0	112	V1061 K1072	V1061-G1074 CarbonylContact O-C 3.41Å; V1061-G1074 WeakPolarHBondContact O-CA 3.36Å; K1072-G1074 VanDerWaalsContact C-N 3.32Å
1075	K	85.4	Confident	77.2	Confident	121 Å²	121	76.8 Å²	76.8	53%	0.526	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	135.7	177.1	-169.5	-161	169.4	-167.3	0	109.4	Q1060 V1061	Q1060-K1075 CarbonylContact C-O 3.5Å; Q1060-K1075 WeakPolarHBondContact CA-O 3.47Å; V1061-K1075 PolarHBondContact N-O 3.11Å; V1061-K1075 PolarHBondContact O-N 2.89Å
1076	E	85.8	Confident	77.9	Confident	84 Å²	84	71.2 Å²	71.2	39%	0.393	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	139.8	169.7	-77.2	158.7	173.2	0	0	110.9	Q1060 K1072	Q1060-E1076 HydrophobicContact CG-CG 3.93Å; K1072-E1076 WeakPolarHBondContact CE-OE1 3.43Å; K1072-E1076 IonicContact NZ-OE1 2.7Å; K1072-E1076 PolarHBondContact NZ-OE1 2.58Å; K1072-E1076 IonicContact NZ-OE2 2.76Å; K1072-E1076 PolarHBondContact NZ-OE2 3Å
1077	V	87.3	Confident	79.1	Confident	33 Å²	33	63.1 Å²	63.1	20%	0.2	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-80.8	138.4	-173.7	178.4	0	0	0	0	110.5	A458 V1059 V1061	A458-V1077 HydrophobicContact CB-CG1 4.09Å; A458-V1077 HydrophobicContact CB-CG2 4Å; V1059-V1077 HydrophobicContact CB-CB 4.48Å; V1059-V1077 HydrophobicContact CB-CG2 4.38Å; V1059-V1077 HydrophobicContact CG1-CB 4.35Å; V1059-V1077 HydrophobicContact CG1-CG2 3.85Å; V1059-V1077 PolarHBondContact O-N 3.18Å; V1061-V1077 HydrophobicContact CB-CG2 4.38Å; V1061-V1077 HydrophobicContact CG2-CG2 3.52Å
1078	L	85.6	Confident	80.7	Confident	86 Å²	86	59.5 Å²	59.5	45%	0.45	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-76.7	132.6	170.4	-59.7	179.9	0	0	0	108.9	T457 S1080	T457-L1078 WeakPolarHBondContact CG2-O 3.48Å; L1078-S1080 PolarHBondContact O-N 3.17Å
1079	V	89.3	Confident	82.5	Confident	38 Å²	38	57 Å²	57	23%	0.23	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-76.4	118.9	176	-173.2	0	0	0	0	108.7	Q450 P453 A454 S1145	Q450-V1079 HydrophobicContact CB-CG2 4.33Å; P453-V1079 HydrophobicContact CB-CG1 3.66Å; A454-V1079 HydrophobicContact CB-CG2 3.93Å; V1079-S1145 WeakPolarHBondContact O-CB 3.36Å
1080	S	91.5	Very high	84.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-69.6	129.6	169	163.4	0	0	0	0	109.3	T457 L1078 L1082 V1083 S1084 D1146	T457-S1080 WeakPolarHBondContact OG1-CB 3.22Å; T457-S1080 PolarHBondContact OG1-N 3.46Å; T457-S1080 VanDerWaalsContact OG1-N 3.16Å; L1078-S1080 PolarHBondContact O-N 3.17Å; S1080-L1082 PolarHBondContact OG-N 3.42Å; S1080-V1083 PolarHBondContact OG-N 2.84Å; S1080-S1084 WeakPolarHBondContact O-CB 3.17Å; S1080-S1084 PolarHBondContact O-N 2.59Å; S1080-D1146 VanDerWaalsContact CA-OD1 3.24Å; S1080-D1146 WeakPolarHBondContact CA-OD1 3.46Å; S1080-D1146 VanDerWaalsContact CB-OD1 3.22Å; S1080-D1146 WeakPolarHBondContact CB-OD1 3.44Å; S1080-D1146 PolarHBondContact OG-OD1 3.19Å
1081	S	90.7	Very high	86.8	Confident	25 Å²	25	45.8 Å²	45.8	18%	0.175	24%	0.241	C	C	.	.	H	α-helix	trans	-74.6	-32	175.2	56.4	0	0	0	0	110.7	S1084 N1085 E1143 D1146	S1081-S1084 PolarHBondContact O-N 3.01Å; S1081-N1085 VanDerWaalsContact O-CB 3.27Å; S1081-N1085 WeakPolarHBondContact O-CB 3.46Å; S1081-N1085 PolarHBondContact O-N 3.04Å; S1081-N1085 PolarHBondContact O-ND2 2.77Å; S1081-E1143 WeakPolarHBondContact CB-OE2 3.41Å; S1081-E1143 PolarHBondContact OG-OE2 2.96Å; S1081-D1146 PolarHBondContact N-OD1 3.49Å; S1081-D1146 PolarHBondContact OG-OD2 2.94Å
1082	L	91.7	Very high	88.4	Confident	31 Å²	31	44.1 Å²	44.1	16%	0.162	23%	0.228	C	C	.	.	H	α-helix	trans	-58.6	-47.4	169.9	-61.4	171.9	0	0	0	111.5	S1080 N1085 L1086 L1114 K1117 D1146 L1150	S1080-L1082 PolarHBondContact OG-N 3.42Å; L1082-N1085 PolarHBondContact O-N 3Å; L1082-L1086 WeakPolarHBondContact O-CB 3.1Å; L1082-L1086 PolarHBondContact O-N 3.37Å; L1082-L1114 HydrophobicContact CB-CD2 3.69Å; L1082-L1114 HydrophobicContact CD1-CD2 3.74Å; L1082-L1114 HydrophobicContact CG-CD2 4.32Å; L1082-K1117 HydrophobicContact CD1-CD 4.21Å; L1082-K1117 HydrophobicContact CD2-CD 4.44Å; L1082-D1146 HydrophobicContact CD1-CB 3.92Å; L1082-D1146 HydrophobicContact CG-CB 4.43Å; L1082-D1146 PolarHBondContact N-OD1 3.18Å; L1082-L1150 HydrophobicContact CD1-CD1 4.11Å
1083	V	93.5	Very high	89.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-39.8	175.4	175.1	0	0	0	0	111.7	I456 L460 S1080 L1086 L1087 L1149	I456-V1083 HydrophobicContact CB-CG1 3.9Å; I456-V1083 HydrophobicContact CG2-CG1 3.69Å; L460-V1083 HydrophobicContact CD1-CG2 4.07Å; S1080-V1083 PolarHBondContact OG-N 2.84Å; V1083-L1086 PolarHBondContact O-N 2.9Å; V1083-L1087 HydrophobicContact CG1-CD1 4.31Å; V1083-L1087 WeakPolarHBondContact O-CG 3.5Å; V1083-L1087 PolarHBondContact O-N 2.84Å; V1083-L1149 HydrophobicContact CG2-CD2 3.54Å
1084	S	92.4	Very high	90.7	Very high	14 Å²	14	42.5 Å²	42.5	10%	0.098	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-46.3	174.5	-175	0	0	0	0	111.6	S1080 S1081 L1087 H1088	S1080-S1084 WeakPolarHBondContact O-CB 3.17Å; S1080-S1084 PolarHBondContact O-N 2.59Å; S1081-S1084 PolarHBondContact O-N 3.01Å; S1084-L1087 PolarHBondContact O-N 3.3Å; S1084-H1088 PolarHBondContact O-N 2.95Å; S1084-H1088 PolarHBondContact O-ND1 2.75Å; S1084-H1088 PolarHBondContact OG-ND1 3.36Å
1085	N	92.8	Very high	91.3	Very high	103 Å²	103	46.7 Å²	46.7	55%	0.551	23%	0.233	S	C	*	.	H	α-helix	trans	-68	-38.5	-179.1	-68.5	-19.6	0	0	0	111.7	S1081 L1082 H1088 S1089	S1081-N1085 VanDerWaalsContact O-CB 3.27Å; S1081-N1085 WeakPolarHBondContact O-CB 3.46Å; S1081-N1085 PolarHBondContact O-N 3.04Å; S1081-N1085 PolarHBondContact O-ND2 2.77Å; L1082-N1085 PolarHBondContact O-N 3Å; N1085-H1088 PolarHBondContact O-N 2.73Å; N1085-S1089 VanDerWaalsContact O-CB 3.28Å; N1085-S1089 WeakPolarHBondContact O-CB 3.37Å; N1085-S1089 PolarHBondContact O-N 3.4Å; N1085-S1089 PolarHBondContact O-OG 2.87Å; N1085-S1089 VanDerWaalsContact O-OG 3.12Å
1086	L	94.3	Very high	91.7	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-52.2	-61.3	168.4	166.6	48.6	0	0	0	110.5	L1082 V1083 H1088 S1089 T1090 L1107 R1110 L1111	L1082-L1086 WeakPolarHBondContact O-CB 3.1Å; L1082-L1086 PolarHBondContact O-N 3.37Å; V1083-L1086 PolarHBondContact O-N 2.9Å; L1086-H1088 VanDerWaalsContact C-N 3.33Å; L1086-H1088 PolarHBondContact O-N 3.36Å; L1086-S1089 PolarHBondContact O-N 3.48Å; L1086-S1089 VanDerWaalsContact O-N 3.15Å; L1086-S1089 PolarHBondContact O-OG 3.17Å; L1086-T1090 PolarHBondContact O-N 3.38Å; L1086-T1090 PolarHBondContact O-OG1 3.41Å; L1086-L1107 HydrophobicContact CD1-CD2 4.41Å; L1086-L1107 HydrophobicContact CD1-CG 4.15Å; L1086-L1107 HydrophobicContact CD2-CD2 4.43Å; L1086-R1110 HydrophobicContact CD1-CB 3.57Å; L1086-R1110 HydrophobicContact CD1-CG 4.07Å; L1086-R1110 HydrophobicContact CD2-CB 4.3Å; L1086-R1110 HydrophobicContact CG-CB 4.37Å; L1086-L1111 HydrophobicContact CD2-CD2 4Å; L1086-L1111 HydrophobicContact CD2-CG 4.44Å
1087	L	93.1	Very high	91.9	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-37.7	-176.8	-61.4	176.8	0	0	0	112.7	F439 M443 L452 P453 I456 V1083 S1084 L1091	F439-L1087 HydrophobicContact CE2-CB 4.42Å; F439-L1087 HydrophobicContact CE2-CD2 3.9Å; F439-L1087 HydrophobicContact CZ-CD2 4.44Å; F439-L1087 WeakPolarHBondContact CZ-O 3.23Å; M443-L1087 HydrophobicContact CE-CB 3.98Å; M443-L1087 HydrophobicContact SD-CB 4Å; M443-L1087 HydrophobicContact SD-CD1 4.44Å; L452-L1087 HydrophobicContact CG-CD1 4.48Å; P453-L1087 HydrophobicContact CB-CD1 4.45Å; P453-L1087 HydrophobicContact CG-CD1 4.1Å; I456-L1087 HydrophobicContact CB-CD1 4.32Å; I456-L1087 HydrophobicContact CG1-CD1 4.18Å; V1083-L1087 HydrophobicContact CG1-CD1 4.31Å; V1083-L1087 WeakPolarHBondContact O-CG 3.5Å; V1083-L1087 PolarHBondContact O-N 2.84Å; S1084-L1087 PolarHBondContact O-N 3.3Å; L1087-L1091 VanDerWaalsContact O-CB 3.3Å; L1087-L1091 WeakPolarHBondContact O-CB 3.38Å; L1087-L1091 PolarHBondContact O-N 3.1Å; L1087-L1091 VanDerWaalsContact O-N 3.09Å
1088	H	92.8	Very high	92.2	Very high	79 Å²	79	52.7 Å²	52.7	37%	0.366	27%	0.268	S	S	.	.	H	α-helix	trans	-69	-38.1	176.2	-74	87.4	0	0	0	112.7	S1084 N1085 L1086 L1091 Q1092	S1084-H1088 PolarHBondContact O-N 2.95Å; S1084-H1088 PolarHBondContact O-ND1 2.75Å; S1084-H1088 PolarHBondContact OG-ND1 3.36Å; N1085-H1088 PolarHBondContact O-N 2.73Å; L1086-H1088 VanDerWaalsContact C-N 3.33Å; L1086-H1088 PolarHBondContact O-N 3.36Å; H1088-L1091 PolarHBondContact O-N 2.89Å; H1088-Q1092 VanDerWaalsContact O-CG 3.3Å; H1088-Q1092 WeakPolarHBondContact O-CG 3.46Å; H1088-Q1092 PolarHBondContact O-N 2.85Å
1089	S	94.8	Very high	92.5	Very high	28 Å²	28	51.7 Å²	51.7	20%	0.196	27%	0.268	C	S	.	.	H	α-helix	trans	-66.9	-46.5	177.1	69.3	0	0	0	0	112	N1085 L1086 L1091 Q1092 L1093 H1106	N1085-S1089 VanDerWaalsContact O-CB 3.28Å; N1085-S1089 WeakPolarHBondContact O-CB 3.37Å; N1085-S1089 PolarHBondContact O-N 3.4Å; N1085-S1089 PolarHBondContact O-OG 2.87Å; N1085-S1089 VanDerWaalsContact O-OG 3.12Å; L1086-S1089 PolarHBondContact O-N 3.48Å; L1086-S1089 VanDerWaalsContact O-N 3.15Å; L1086-S1089 PolarHBondContact O-OG 3.17Å; S1089-L1091 VanDerWaalsContact C-N 3.28Å; S1089-L1091 PolarHBondContact O-N 2.85Å; S1089-Q1092 PolarHBondContact O-N 2.83Å; S1089-Q1092 VanDerWaalsContact O-N 3.11Å; S1089-L1093 WeakPolarHBondContact O-CG 3.15Å; S1089-L1093 PolarHBondContact O-N 2.75Å; S1089-H1106 PolarHBondContact OG-NE2 3.06Å
1090	T	93.7	Very high	92.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.5	-37.1	176.2	-54.1	0	0	0	0	111.8	M436 F439 L1086 Y1094 C1103 H1106	M436-T1090 HydrophobicContact CE-CG2 4.03Å; M436-T1090 HydrophobicContact SD-CG2 4.28Å; F439-T1090 HydrophobicContact CE1-CG2 3.85Å; F439-T1090 HydrophobicContact CZ-CG2 4.35Å; L1086-T1090 PolarHBondContact O-N 3.38Å; L1086-T1090 PolarHBondContact O-OG1 3.41Å; T1090-Y1094 PolarHBondContact O-N 2.95Å; T1090-Y1094 VanDerWaalsContact O-N 3.16Å; T1090-C1103 HydrophobicContact CG2-CB 4.22Å; T1090-C1103 WeakPolarHBondContact CG2-O 3.39Å; T1090-H1106 PolarHBondContact OG1-CD2 3.3Å
1091	L	92.4	Very high	92.5	Very high	20 Å²	20	53.7 Å²	53.7	11%	0.105	28%	0.279	C	S	.	.	H	α-helix	trans	-66.4	-40.1	173.8	-176.3	68.4	0	0	0	112.4	F439 T440 M443 L1087 H1088 S1089 K1095	F439-L1091 HydrophobicContact CE1-CB 4.18Å; F439-L1091 HydrophobicContact CE1-CD1 4.46Å; F439-L1091 HydrophobicContact CZ-CB 4.17Å; T440-L1091 HydrophobicContact CG2-CD1 3.96Å; M443-L1091 HydrophobicContact CB-CD1 4.15Å; M443-L1091 HydrophobicContact CB-CD2 3.96Å; M443-L1091 HydrophobicContact CE-CB 4.49Å; M443-L1091 HydrophobicContact CE-CD2 3.86Å; M443-L1091 HydrophobicContact CG-CD2 4.36Å; L1087-L1091 VanDerWaalsContact O-CB 3.3Å; L1087-L1091 WeakPolarHBondContact O-CB 3.38Å; L1087-L1091 PolarHBondContact O-N 3.1Å; L1087-L1091 VanDerWaalsContact O-N 3.09Å; H1088-L1091 PolarHBondContact O-N 2.89Å; S1089-L1091 VanDerWaalsContact C-N 3.28Å; S1089-L1091 PolarHBondContact O-N 2.85Å; L1091-K1095 HydrophobicContact CG-CD 4.36Å; L1091-K1095 WeakPolarHBondContact O-CB 3.41Å; L1091-K1095 WeakPolarHBondContact O-CG 3.48Å; L1091-K1095 PolarHBondContact O-N 3.36Å
1092	Q	92.4	Very high	92.6	Very high	122 Å²	122	56.7 Å²	56.7	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-65.2	-46.9	176.4	-76	170.8	-6.7	0	0	111.4	H1088 S1089 Y1094 K1095 H1096	H1088-Q1092 VanDerWaalsContact O-CG 3.3Å; H1088-Q1092 WeakPolarHBondContact O-CG 3.46Å; H1088-Q1092 PolarHBondContact O-N 2.85Å; S1089-Q1092 PolarHBondContact O-N 2.83Å; S1089-Q1092 VanDerWaalsContact O-N 3.11Å; Q1092-Y1094 VanDerWaalsContact C-N 3.31Å; Q1092-Y1094 PolarHBondContact O-N 2.78Å; Q1092-K1095 CarbonylContact O-C 3.55Å; Q1092-K1095 PolarHBondContact O-N 2.96Å; Q1092-K1095 VanDerWaalsContact O-N 3.1Å; Q1092-H1096 PolarHBondContact O-CD2 2.87Å; Q1092-H1096 PolarHBondContact O-N 2.86Å
1093	L	93	Very high	92.7	Very high	40 Å²	40	55.2 Å²	55.2	21%	0.209	28%	0.281	C	S	.	.	H	α-helix	trans	-56.3	-44.8	177.1	-68.3	173.8	0	0	0	111.8	S1089 H1096 L1098 F1102 H1106	S1089-L1093 WeakPolarHBondContact O-CG 3.15Å; S1089-L1093 PolarHBondContact O-N 2.75Å; L1093-H1096 PolarHBondContact O-N 3.39Å; L1093-L1098 HydrophobicContact CB-CD1 3.96Å; L1093-L1098 HydrophobicContact CD2-CD1 3.53Å; L1093-L1098 HydrophobicContact CG-CD1 4.31Å; L1093-L1098 WeakPolarHBondContact O-CB 3.49Å; L1093-L1098 PolarHBondContact O-N 3.06Å; L1093-F1102 HydrophobicContact CD1-CE1 4.42Å; L1093-H1106 HydrophobicContact CD1-CB 3.96Å; L1093-H1106 VanDerWaalsContact CD1-CD2 3.5Å; L1093-H1106 WeakPolarHBondContact CD1-CD2 3.42Å; L1093-H1106 VanDerWaalsContact CD1-CG 3.43Å
1094	Y	93.3	Very high	92.6	Very high	39 Å²	39	55.7 Å²	55.7	15%	0.153	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-39.3	176	-170.4	-112.1	0	0	0	112.8	M436 T440 T1090 Q1092 H1096 N1097 P1100	M436-Y1094 HydrophobicContact CB-CD2 3.98Å; M436-Y1094 HydrophobicContact CB-CE2 3.65Å; M436-Y1094 HydrophobicContact CE-CD1 4.37Å; M436-Y1094 HydrophobicContact CE-CD2 3.64Å; M436-Y1094 HydrophobicContact CE-CE2 4.42Å; M436-Y1094 HydrophobicContact CE-CG 3.59Å; M436-Y1094 HydrophobicContact CG-CD2 4.44Å; M436-Y1094 HydrophobicContact CG-CE2 4.47Å; T440-Y1094 HydrophobicContact CG2-CD1 4.43Å; T440-Y1094 HydrophobicContact CG2-CE1 4.46Å; T440-Y1094 WeakPolarHBondContact OG1-CD1 3.13Å; T440-Y1094 VanDerWaalsContact OG1-CE1 3.28Å; T440-Y1094 WeakPolarHBondContact OG1-CE1 3.5Å; T1090-Y1094 PolarHBondContact O-N 2.95Å; T1090-Y1094 VanDerWaalsContact O-N 3.16Å; Q1092-Y1094 VanDerWaalsContact C-N 3.31Å; Q1092-Y1094 PolarHBondContact O-N 2.78Å; Y1094-H1096 PolarHBondContact O-N 3.32Å; Y1094-N1097 WeakPolarHBondContact O-CA 3.36Å; Y1094-N1097 PolarHBondContact O-N 3.13Å; Y1094-P1100 HydrophobicContact CE2-CG 4.42Å
1095	K	92	Very high	92.6	Very high	108 Å²	108	60.1 Å²	60.1	47%	0.47	30%	0.304	S	S	.	.	H	α-helix	trans	-68.9	-17.1	175.2	-74.5	-176.3	175.4	-163.9	0	114.2	E444 L1091 Q1092	E444-K1095 VanDerWaalsContact OE1-CE 3.3Å; E444-K1095 WeakPolarHBondContact OE1-CE 3.3Å; E444-K1095 IonicContact OE1-NZ 2.65Å; E444-K1095 PolarHBondContact OE1-NZ 3.24Å; L1091-K1095 HydrophobicContact CG-CD 4.36Å; L1091-K1095 WeakPolarHBondContact O-CB 3.41Å; L1091-K1095 WeakPolarHBondContact O-CG 3.48Å; L1091-K1095 PolarHBondContact O-N 3.36Å; Q1092-K1095 CarbonylContact O-C 3.55Å; Q1092-K1095 PolarHBondContact O-N 2.96Å; Q1092-K1095 VanDerWaalsContact O-N 3.1Å
1096	H	93.8	Very high	92.6	Very high	143 Å²	143	56.3 Å²	56.3	66%	0.662	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	10.5	166.8	-73.8	-67.2	0	0	0	113.6	Q1092 L1093 Y1094 L1098	Q1092-H1096 PolarHBondContact O-CD2 2.87Å; Q1092-H1096 PolarHBondContact O-N 2.86Å; L1093-H1096 PolarHBondContact O-N 3.39Å; Y1094-H1096 PolarHBondContact O-N 3.32Å; H1096-L1098 VanDerWaalsContact C-N 3.28Å; H1096-L1098 PolarHBondContact O-N 2.87Å
1097	N	90.6	Very high	92.6	Very high	151 Å²	151	56 Å²	56	81%	0.807	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	27.7	179.7	-52.4	-69.9	0	0	0	114.5	Y1094	Y1094-N1097 WeakPolarHBondContact O-CA 3.36Å; Y1094-N1097 PolarHBondContact O-N 3.13Å
1098	L	92.6	Very high	92.6	Very high	71 Å²	71	57.9 Å²	57.9	37%	0.372	29%	0.29	S	S	.	.			trans	-68.8	156.9	169.1	-64.8	172.1	0	0	0	110.6	L1093 H1096 F1102	L1093-L1098 HydrophobicContact CB-CD1 3.96Å; L1093-L1098 HydrophobicContact CD2-CD1 3.53Å; L1093-L1098 HydrophobicContact CG-CD1 4.31Å; L1093-L1098 WeakPolarHBondContact O-CB 3.49Å; L1093-L1098 PolarHBondContact O-N 3.06Å; H1096-L1098 VanDerWaalsContact C-N 3.28Å; H1096-L1098 PolarHBondContact O-N 2.87Å; L1098-F1102 HydrophobicContact CB-CD1 4.22Å; L1098-F1102 HydrophobicContact CD1-CD1 4.06Å; L1098-F1102 HydrophobicContact CD1-CE1 3.97Å
1099	S	92.7	Very high	92.7	Very high	65 Å²	65	58.8 Å²	58.8	46%	0.455	30%	0.298	S	S	.	.			trans	-64.1	146.1	-173.8	76.3	0	0	0	0	111.6	N1101 F1102 C1103	S1099-N1101 PolarHBondContact O-N 3.38Å; S1099-F1102 PolarHBondContact O-N 3.47Å; S1099-F1102 VanDerWaalsContact OG-CB 3.31Å; S1099-F1102 WeakPolarHBondContact OG-CB 3.48Å; S1099-F1102 PolarHBondContact OG-N 3.31Å; S1099-C1103 PolarHBondContact O-N 2.82Å; S1099-C1103 PolarHBondContact O-SG 3.4Å
1100	P	90.6	Very high	92.7	Very high	26 Å²	26	62.4 Å²	62.4	17%	0.169	31%	0.307	C	S	.	.	H	α-helix	trans	-56.9	-39.4	178.5	-24.9	33.2	0	0	0	112.5	C432 Y433 M436 Y1094 F1102 C1103 V1104	C432-P1100 HydrophobicContact CB-CB 3.97Å; Y433-P1100 HydrophobicContact CD2-CG 3.91Å; Y433-P1100 HydrophobicContact CG-CG 4.45Å; M436-P1100 HydrophobicContact CB-CB 4.34Å; M436-P1100 HydrophobicContact CG-CB 4.01Å; Y1094-P1100 HydrophobicContact CE2-CG 4.42Å; P1100-F1102 PolarHBondContact O-N 2.94Å; P1100-C1103 WeakPolarHBondContact O-CB 3.41Å; P1100-C1103 PolarHBondContact O-N 3.16Å; P1100-V1104 WeakPolarHBondContact O-CG2 3.44Å; P1100-V1104 PolarHBondContact O-N 2.94Å
1101	N	90.3	Very high	92.7	Very high	54 Å²	54	62.4 Å²	62.4	29%	0.289	31%	0.307	S	S	.	.	H	α-helix	trans	-60.7	-44.1	175.8	-63.4	4.5	0	0	0	111.7	N429 C432 S1099 C1103 V1104 M1105	N429-N1101 PolarHBondContact OD1-ND2 2.89Å; C432-N1101 VanDerWaalsContact CB-OD1 3.26Å; C432-N1101 WeakPolarHBondContact CB-OD1 3.2Å; C432-N1101 PolarHBondContact SG-OD1 3.43Å; S1099-N1101 PolarHBondContact O-N 3.38Å; N1101-C1103 VanDerWaalsContact C-N 3.31Å; N1101-C1103 PolarHBondContact O-N 3.37Å; N1101-V1104 PolarHBondContact O-N 3.32Å; N1101-M1105 WeakPolarHBondContact O-CG 3.49Å; N1101-M1105 PolarHBondContact O-N 3.09Å
1102	F	92.6	Very high	92.8	Very high	88 Å²	88	64.3 Å²	64.3	39%	0.386	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-37.9	176.9	-176.4	-91.8	0	0	0	112.1	L1093 L1098 S1099 P1100 V1104 M1105 H1106	L1093-F1102 HydrophobicContact CD1-CE1 4.42Å; L1098-F1102 HydrophobicContact CB-CD1 4.22Å; L1098-F1102 HydrophobicContact CD1-CD1 4.06Å; L1098-F1102 HydrophobicContact CD1-CE1 3.97Å; S1099-F1102 PolarHBondContact O-N 3.47Å; S1099-F1102 VanDerWaalsContact OG-CB 3.31Å; S1099-F1102 WeakPolarHBondContact OG-CB 3.48Å; S1099-F1102 PolarHBondContact OG-N 3.31Å; P1100-F1102 PolarHBondContact O-N 2.94Å; F1102-V1104 VanDerWaalsContact C-N 3.3Å; F1102-V1104 PolarHBondContact O-N 2.81Å; F1102-M1105 HydrophobicContact CB-CE 4.3Å; F1102-M1105 HydrophobicContact CD2-CE 4.11Å; F1102-M1105 PolarHBondContact O-N 2.72Å; F1102-H1106 PolarHBondContact O-N 2.98Å
1103	C	93	Very high	92.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.1	-33.8	175.3	-58.9	0	0	0	0	112.6	M436 T1090 S1099 P1100 N1101 L1107	M436-C1103 HydrophobicContact CE-CB 3.44Å; M436-C1103 VanDerWaalsContact CE-CB 3.44Å; M436-C1103 HydrophobicContact CG-CB 4.33Å; M436-C1103 HydrophobicContact SD-CB 3.76Å; T1090-C1103 HydrophobicContact CG2-CB 4.22Å; T1090-C1103 WeakPolarHBondContact CG2-O 3.39Å; S1099-C1103 PolarHBondContact O-N 2.82Å; S1099-C1103 PolarHBondContact O-SG 3.4Å; P1100-C1103 WeakPolarHBondContact O-CB 3.41Å; P1100-C1103 PolarHBondContact O-N 3.16Å; N1101-C1103 VanDerWaalsContact C-N 3.31Å; N1101-C1103 PolarHBondContact O-N 3.37Å; C1103-L1107 PolarHBondContact O-N 3.03Å
1104	V	91.7	Very high	92.8	Very high	9 Å²	9	59.7 Å²	59.7	6%	0.055	29%	0.293	C	S	.	.	H	α-helix	trans	-75.9	-39.4	174.8	174.9	0	0	0	0	111.6	M421 F435 M436 Y541 P1100 N1101 F1102 L1107 E1108	M421-V1104 HydrophobicContact CE-CG1 4.06Å; F435-V1104 HydrophobicContact CD1-CG2 4.02Å; F435-V1104 HydrophobicContact CE1-CG2 4.21Å; M436-V1104 HydrophobicContact CG-CG2 4.35Å; M436-V1104 HydrophobicContact SD-CG2 4.32Å; Y541-V1104 HydrophobicContact CE2-CG1 4.37Å; P1100-V1104 WeakPolarHBondContact O-CG2 3.44Å; P1100-V1104 PolarHBondContact O-N 2.94Å; N1101-V1104 PolarHBondContact O-N 3.32Å; F1102-V1104 VanDerWaalsContact C-N 3.3Å; F1102-V1104 PolarHBondContact O-N 2.81Å; V1104-L1107 WeakPolarHBondContact O-CA 3.39Å; V1104-L1107 WeakPolarHBondContact O-CB 3.43Å; V1104-L1107 PolarHBondContact O-N 2.69Å; V1104-E1108 PolarHBondContact O-N 3.48Å
1105	M	91.6	Very high	92.7	Very high	107 Å²	107	58 Å²	58	53%	0.527	29%	0.287	S	S	.	.	H	α-helix	trans	-59.7	-49.9	173.9	-69.9	-173.8	-58.6	0	0	111.4	N1101 F1102 L1107 E1108 D1109	N1101-M1105 WeakPolarHBondContact O-CG 3.49Å; N1101-M1105 PolarHBondContact O-N 3.09Å; F1102-M1105 HydrophobicContact CB-CE 4.3Å; F1102-M1105 HydrophobicContact CD2-CE 4.11Å; F1102-M1105 PolarHBondContact O-N 2.72Å; M1105-L1107 PolarHBondContact O-N 2.88Å; M1105-L1107 VanDerWaalsContact O-N 3.15Å; M1105-E1108 PolarHBondContact O-N 3.47Å; M1105-D1109 VanDerWaalsContact O-CG 3.24Å; M1105-D1109 PolarHBondContact O-N 3.44Å
1106	H	94	Very high	92.7	Very high	24 Å²	24	57 Å²	57	11%	0.111	28%	0.282	C	S	.	.	H	α-helix	trans	-59.5	-26.6	173.2	167.6	100.6	0	0	0	112.6	S1089 T1090 L1093 F1102 R1110	S1089-H1106 PolarHBondContact OG-NE2 3.06Å; T1090-H1106 PolarHBondContact OG1-CD2 3.3Å; L1093-H1106 HydrophobicContact CD1-CB 3.96Å; L1093-H1106 VanDerWaalsContact CD1-CD2 3.5Å; L1093-H1106 WeakPolarHBondContact CD1-CD2 3.42Å; L1093-H1106 VanDerWaalsContact CD1-CG 3.43Å; F1102-H1106 PolarHBondContact O-N 2.98Å; H1106-R1110 PolarHBondContact CE1-NE 3.14Å; H1106-R1110 WeakPolarHBondContact O-CG 3.33Å; H1106-R1110 PolarHBondContact O-N 3.27Å
1107	L	94.1	Very high	92.6	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-68.5	-49	173.9	-155.4	173.1	0	0	0	110.5	F435 Y541 F542 L1086 C1103 V1104 M1105 R1110 L1111	F435-L1107 HydrophobicContact CE1-CD1 4.24Å; F435-L1107 HydrophobicContact CZ-CD1 4.4Å; Y541-L1107 HydrophobicContact CE1-CD1 3.66Å; Y541-L1107 HydrophobicContact CE1-CD2 3.81Å; Y541-L1107 HydrophobicContact CE1-CG 4.33Å; F542-L1107 HydrophobicContact CE1-CD2 4.08Å; F542-L1107 HydrophobicContact CZ-CD1 4.41Å; F542-L1107 HydrophobicContact CZ-CD2 4.46Å; L1086-L1107 HydrophobicContact CD1-CD2 4.41Å; L1086-L1107 HydrophobicContact CD1-CG 4.15Å; L1086-L1107 HydrophobicContact CD2-CD2 4.43Å; C1103-L1107 PolarHBondContact O-N 3.03Å; V1104-L1107 WeakPolarHBondContact O-CA 3.39Å; V1104-L1107 WeakPolarHBondContact O-CB 3.43Å; V1104-L1107 PolarHBondContact O-N 2.69Å; M1105-L1107 PolarHBondContact O-N 2.88Å; M1105-L1107 VanDerWaalsContact O-N 3.15Å; L1107-R1110 PolarHBondContact O-N 3.24Å; L1107-L1111 HydrophobicContact CD2-CD1 3.75Å; L1107-L1111 HydrophobicContact CD2-CG 3.97Å; L1107-L1111 WeakPolarHBondContact O-CG 3.24Å; L1107-L1111 PolarHBondContact O-N 3.03Å
1108	E	93.2	Very high	92.6	Very high	41 Å²	41	45.9 Å²	45.9	19%	0.192	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-44.6	175.1	-58.5	-63.9	173.3	0	0	112	Y541 R544 V1104 M1105 R1110 L1111 Q1112	Y541-E1108 PolarHBondContact OH-OE1 3.08Å; R544-E1108 IonicContact CZ-OE1 3.58Å; R544-E1108 IonicContact CZ-OE2 3.75Å; R544-E1108 VanDerWaalsContact CZ-OE2 3.25Å; R544-E1108 IonicContact NH1-OE1 3.12Å; R544-E1108 IonicContact NH1-OE2 3.58Å; R544-E1108 PolarHBondContact NH1-OE2 3.04Å; R544-E1108 IonicContact NH2-OE1 3.51Å; R544-E1108 PolarHBondContact NH2-OE1 3.04Å; R544-E1108 IonicContact NH2-OE2 3.25Å; R544-E1108 PolarHBondContact NH2-OE2 2.98Å; V1104-E1108 PolarHBondContact O-N 3.48Å; M1105-E1108 PolarHBondContact O-N 3.47Å; E1108-R1110 PolarHBondContact O-N 3.31Å; E1108-L1111 CarbonylContact O-C 3.54Å; E1108-L1111 WeakPolarHBondContact O-CB 3.47Å; E1108-L1111 PolarHBondContact O-N 2.93Å; E1108-Q1112 PolarHBondContact O-N 2.69Å
1109	D	94	Very high	92.5	Very high	97 Å²	97	45.5 Å²	45.5	52%	0.519	22%	0.22	S	C	.	.	H	α-helix	trans	-55	-38.1	177.9	-64.5	-28.8	0	0	0	111.6	M1105 Q1112 E1113	M1105-D1109 VanDerWaalsContact O-CG 3.24Å; M1105-D1109 PolarHBondContact O-N 3.44Å; D1109-Q1112 PolarHBondContact O-N 3.21Å; D1109-E1113 PolarHBondContact O-N 3.15Å
1110	R	94.4	Very high	92.3	Very high	104 Å²	104	48 Å²	48	39%	0.392	23%	0.226	S	C	.	.	H	α-helix	trans	-81	-27.1	179	-63.8	-66.4	172.2	176.9	-2.6	113.3	L1086 H1106 L1107 E1108 Q1112 E1113 L1114	L1086-R1110 HydrophobicContact CD1-CB 3.57Å; L1086-R1110 HydrophobicContact CD1-CG 4.07Å; L1086-R1110 HydrophobicContact CD2-CB 4.3Å; L1086-R1110 HydrophobicContact CG-CB 4.37Å; H1106-R1110 PolarHBondContact CE1-NE 3.14Å; H1106-R1110 WeakPolarHBondContact O-CG 3.33Å; H1106-R1110 PolarHBondContact O-N 3.27Å; L1107-R1110 PolarHBondContact O-N 3.24Å; E1108-R1110 PolarHBondContact O-N 3.31Å; R1110-Q1112 VanDerWaalsContact C-N 3.34Å; R1110-E1113 WeakPolarHBondContact CD-OE2 3.33Å; R1110-E1113 IonicContact CZ-OE2 3.67Å; R1110-E1113 IonicContact NE-OE2 2.89Å; R1110-E1113 IonicContact NH1-OE2 2.7Å; R1110-E1113 PolarHBondContact NH1-OE2 3.41Å; R1110-E1113 WeakPolarHBondContact O-CB 3.4Å; R1110-E1113 PolarHBondContact O-N 3.05Å; R1110-L1114 PolarHBondContact O-N 3.41Å; R1110-L1114 VanDerWaalsContact O-N 3.12Å
1111	L	94.6	Very high	92.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-37.8	165.9	-67.5	176.4	0	0	0	110.5	L460 W466 V470 L1086 L1107 E1108 L1114 Y1115	L460-L1111 HydrophobicContact CD1-CD2 3.89Å; L460-L1111 HydrophobicContact CD2-CD2 4.12Å; W466-L1111 HydrophobicContact CE3-CB 4.19Å; W466-L1111 HydrophobicContact CE3-CD2 4.4Å; W466-L1111 HydrophobicContact CZ3-CB 4.01Å; W466-L1111 HydrophobicContact CZ3-CD2 4.32Å; W466-L1111 WeakPolarHBondContact CZ3-O 3.42Å; V470-L1111 HydrophobicContact CG1-CB 4.01Å; L1086-L1111 HydrophobicContact CD2-CD2 4Å; L1086-L1111 HydrophobicContact CD2-CG 4.44Å; L1107-L1111 HydrophobicContact CD2-CD1 3.75Å; L1107-L1111 HydrophobicContact CD2-CG 3.97Å; L1107-L1111 WeakPolarHBondContact O-CG 3.24Å; L1107-L1111 PolarHBondContact O-N 3.03Å; E1108-L1111 CarbonylContact O-C 3.54Å; E1108-L1111 WeakPolarHBondContact O-CB 3.47Å; E1108-L1111 PolarHBondContact O-N 2.93Å; L1111-L1114 HydrophobicContact CD2-CD1 4.09Å; L1111-L1114 WeakPolarHBondContact O-CB 3.43Å; L1111-L1114 PolarHBondContact O-N 2.76Å; L1111-Y1115 PolarHBondContact O-N 3.01Å
1112	Q	93.8	Very high	92.1	Very high	60 Å²	60	44.2 Å²	44.2	28%	0.28	20%	0.204	S	C	.	.	H	α-helix	trans	-66.6	-35.6	172.2	-170.7	174.8	90.6	0	0	112	V470 E1108 D1109 R1110 L1114 Y1115 F1116	V470-Q1112 HydrophobicContact CB-CB 4.35Å; V470-Q1112 WeakPolarHBondContact O-CG 3.34Å; V470-Q1112 PolarHBondContact O-NE2 2.81Å; E1108-Q1112 PolarHBondContact O-N 2.69Å; D1109-Q1112 PolarHBondContact O-N 3.21Å; R1110-Q1112 VanDerWaalsContact C-N 3.34Å; Q1112-L1114 VanDerWaalsContact C-N 3.34Å; Q1112-L1114 PolarHBondContact O-N 2.94Å; Q1112-Y1115 WeakPolarHBondContact O-CB 3.38Å; Q1112-Y1115 PolarHBondContact O-N 3.07Å; Q1112-Y1115 VanDerWaalsContact O-N 3.16Å; Q1112-F1116 HydrophobicContact CG-CD2 3.99Å; Q1112-F1116 HydrophobicContact CG-CE2 3.53Å; Q1112-F1116 HydrophobicContact CG-CZ 4.11Å; Q1112-F1116 VanDerWaalsContact O-CD2 3.31Å; Q1112-F1116 WeakPolarHBondContact O-CD2 3.4Å; Q1112-F1116 PolarHBondContact O-N 2.95Å
1113	E	92.1	Very high	91.9	Very high	60 Å²	60	44.2 Å²	44.2	28%	0.28	21%	0.205	S	C	.	.	H	α-helix	trans	-59.6	-40.8	170.3	-164.2	-162.8	136.4	0	0	112.2	D1109 R1110 F1116 K1117	D1109-E1113 PolarHBondContact O-N 3.15Å; R1110-E1113 WeakPolarHBondContact CD-OE2 3.33Å; R1110-E1113 IonicContact CZ-OE2 3.67Å; R1110-E1113 IonicContact NE-OE2 2.89Å; R1110-E1113 IonicContact NH1-OE2 2.7Å; R1110-E1113 PolarHBondContact NH1-OE2 3.41Å; R1110-E1113 WeakPolarHBondContact O-CB 3.4Å; R1110-E1113 PolarHBondContact O-N 3.05Å; E1113-F1116 PolarHBondContact O-N 3.24Å; E1113-K1117 HydrophobicContact CG-CD 4.5Å; E1113-K1117 WeakPolarHBondContact O-CB 3.3Å; E1113-K1117 WeakPolarHBondContact O-CG 3.09Å; E1113-K1117 PolarHBondContact O-N 3.38Å; E1113-K1117 WeakPolarHBondContact OE1-CE 3.49Å; E1113-K1117 IonicContact OE1-NZ 2.63Å; E1113-K1117 PolarHBondContact OE1-NZ 3.19Å
1114	L	92.9	Very high	91.5	Very high	6 Å²	6	47 Å²	47	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-42.4	172.6	-69.3	175	0	0	0	111.8	L460 W466 L1082 R1110 L1111 Q1112 K1117 S1118 L1149 L1150	L460-L1114 HydrophobicContact CD1-CD1 4.47Å; W466-L1114 HydrophobicContact CH2-CB 4.09Å; W466-L1114 HydrophobicContact CH2-CD1 4.38Å; L1082-L1114 HydrophobicContact CB-CD2 3.69Å; L1082-L1114 HydrophobicContact CD1-CD2 3.74Å; L1082-L1114 HydrophobicContact CG-CD2 4.32Å; R1110-L1114 PolarHBondContact O-N 3.41Å; R1110-L1114 VanDerWaalsContact O-N 3.12Å; L1111-L1114 HydrophobicContact CD2-CD1 4.09Å; L1111-L1114 WeakPolarHBondContact O-CB 3.43Å; L1111-L1114 PolarHBondContact O-N 2.76Å; Q1112-L1114 VanDerWaalsContact C-N 3.34Å; Q1112-L1114 PolarHBondContact O-N 2.94Å; L1114-K1117 PolarHBondContact O-N 3.45Å; L1114-S1118 PolarHBondContact O-N 2.56Å; L1114-L1149 HydrophobicContact CD1-CD2 4.36Å; L1114-L1150 HydrophobicContact CD2-CD2 4.24Å; L1114-L1150 WeakPolarHBondContact O-CD2 3.42Å
1115	Y	92.7	Very high	91.2	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-60	-49.5	174.6	169	-106	0	0	0	111.2	V467 M471 L1111 Q1112 K1117 S1118 K1119 V1153 H1157	V467-Y1115 HydrophobicContact CG1-CD2 3.9Å; V467-Y1115 HydrophobicContact CG1-CE2 4.4Å; M471-Y1115 HydrophobicContact CE-CE2 4.41Å; M471-Y1115 WeakPolarHBondContact CE-OH 3.15Å; M471-Y1115 HydrophobicContact CG-CD1 4.43Å; M471-Y1115 HydrophobicContact CG-CD2 4.21Å; M471-Y1115 HydrophobicContact CG-CE1 4.07Å; M471-Y1115 HydrophobicContact CG-CE2 3.83Å; M471-Y1115 HydrophobicContact SD-CE2 4.07Å; L1111-Y1115 PolarHBondContact O-N 3.01Å; Q1112-Y1115 WeakPolarHBondContact O-CB 3.38Å; Q1112-Y1115 PolarHBondContact O-N 3.07Å; Q1112-Y1115 VanDerWaalsContact O-N 3.16Å; Y1115-K1117 VanDerWaalsContact C-N 3.33Å; Y1115-K1117 PolarHBondContact O-N 3.23Å; Y1115-S1118 PolarHBondContact O-N 2.76Å; Y1115-S1118 VanDerWaalsContact O-N 3.1Å; Y1115-S1118 PolarHBondContact O-OG 3.15Å; Y1115-K1119 PolarHBondContact O-N 3.12Å; Y1115-V1153 HydrophobicContact CD2-CG1 4.31Å; Y1115-H1157 AromaticContact CE2-ND1 3.66Å
1116	F	91.8	Very high	90.7	Very high	87 Å²	87	49.1 Å²	49.1	38%	0.382	22%	0.218	S	C	.	.	H	α-helix	trans	-61.3	-38.5	177.5	-69.9	-51.6	0	0	0	113	P472 Q1112 E1113 K1119 M1120	P472-F1116 HydrophobicContact CG-CE1 4.01Å; P472-F1116 HydrophobicContact CG-CZ 3.93Å; Q1112-F1116 HydrophobicContact CG-CD2 3.99Å; Q1112-F1116 HydrophobicContact CG-CE2 3.53Å; Q1112-F1116 HydrophobicContact CG-CZ 4.11Å; Q1112-F1116 VanDerWaalsContact O-CD2 3.31Å; Q1112-F1116 WeakPolarHBondContact O-CD2 3.4Å; Q1112-F1116 PolarHBondContact O-N 2.95Å; E1113-F1116 PolarHBondContact O-N 3.24Å; F1116-K1119 WeakPolarHBondContact O-CB 3.14Å; F1116-K1119 PolarHBondContact O-N 3.26Å; F1116-M1120 PolarHBondContact O-N 3.09Å
1117	K	90.4	Very high	89.7	Confident	60 Å²	60	51.8 Å²	51.8	26%	0.261	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-39.4	172.9	-77.9	172.7	169.3	172.2	0	112.6	L1082 E1113 L1114 Y1115 K1119 M1120 L1121 L1150	L1082-K1117 HydrophobicContact CD1-CD 4.21Å; L1082-K1117 HydrophobicContact CD2-CD 4.44Å; E1113-K1117 HydrophobicContact CG-CD 4.5Å; E1113-K1117 WeakPolarHBondContact O-CB 3.3Å; E1113-K1117 WeakPolarHBondContact O-CG 3.09Å; E1113-K1117 PolarHBondContact O-N 3.38Å; E1113-K1117 WeakPolarHBondContact OE1-CE 3.49Å; E1113-K1117 IonicContact OE1-NZ 2.63Å; E1113-K1117 PolarHBondContact OE1-NZ 3.19Å; L1114-K1117 PolarHBondContact O-N 3.45Å; Y1115-K1117 VanDerWaalsContact C-N 3.33Å; Y1115-K1117 PolarHBondContact O-N 3.23Å; K1117-K1119 VanDerWaalsContact C-N 3.3Å; K1117-K1119 PolarHBondContact O-N 3.24Å; K1117-M1120 PolarHBondContact O-N 3.04Å; K1117-L1121 WeakPolarHBondContact O-CB 3.28Å; K1117-L1121 PolarHBondContact O-N 2.82Å; K1117-L1150 HydrophobicContact CB-CD1 4.4Å; K1117-L1150 HydrophobicContact CB-CD2 4.16Å
1118	S	91	Very high	88.8	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-29	173.7	78	0	0	0	0	113	L1114 Y1115 L1121 S1122 L1150 V1153 H1157	L1114-S1118 PolarHBondContact O-N 2.56Å; Y1115-S1118 PolarHBondContact O-N 2.76Å; Y1115-S1118 VanDerWaalsContact O-N 3.1Å; Y1115-S1118 PolarHBondContact O-OG 3.15Å; S1118-L1121 WeakPolarHBondContact O-CB 3.37Å; S1118-L1121 PolarHBondContact O-N 2.76Å; S1118-S1122 PolarHBondContact O-N 3.38Å; S1118-S1122 PolarHBondContact O-OG 3.06Å; S1118-L1150 WeakPolarHBondContact CB-O 3.41Å; S1118-V1153 WeakPolarHBondContact OG-CG1 3.38Å; S1118-H1157 WeakPolarHBondContact CB-CE1 3.48Å; S1118-H1157 PolarHBondContact O-NE2 3.06Å; S1118-H1157 VanDerWaalsContact O-NE2 3.1Å; S1118-H1157 PolarHBondContact OG-CE1 3.3Å
1119	K	90.1	Very high	87.4	Confident	63 Å²	63	60.1 Å²	60.1	27%	0.274	29%	0.292	S	S	.	.	H	α-helix	trans	-72.2	-41.2	173.9	-172.3	178.5	175.3	-176.5	0	112.1	Y1115 F1116 K1117 L1121 S1122 E1123 H1157	Y1115-K1119 PolarHBondContact O-N 3.12Å; F1116-K1119 WeakPolarHBondContact O-CB 3.14Å; F1116-K1119 PolarHBondContact O-N 3.26Å; K1117-K1119 VanDerWaalsContact C-N 3.3Å; K1117-K1119 PolarHBondContact O-N 3.24Å; K1119-L1121 VanDerWaalsContact C-N 3.32Å; K1119-S1122 WeakPolarHBondContact CA-OG 3.43Å; K1119-S1122 PolarHBondContact O-N 2.91Å; K1119-S1122 PolarHBondContact O-OG 3.13Å; K1119-E1123 PolarHBondContact O-N 2.83Å; K1119-H1157 WeakPolarHBondContact CA-NE2 3.25Å; K1119-H1157 PolarHBondContact N-NE2 3.08Å
1120	M	88.9	Confident	86.2	Confident	118 Å²	118	63.2 Å²	63.2	58%	0.581	30%	0.297	S	S	*	.	H	α-helix	trans	-60.9	-42.4	169.7	-71.7	-174.2	70.5	0	0	111.5	F1116 K1117 Y1124 L1140	F1116-M1120 PolarHBondContact O-N 3.09Å; K1117-M1120 PolarHBondContact O-N 3.04Å; M1120-Y1124 VanDerWaalsContact O-CB 3.3Å; M1120-Y1124 WeakPolarHBondContact O-CB 3.37Å; M1120-Y1124 PolarHBondContact O-N 2.91Å; M1120-L1140 HydrophobicContact CE-CD2 4.37Å
1121	L	88.5	Confident	85.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-44.9	173.9	173.5	61.6	0	0	0	112.2	K1117 S1118 K1119 L1125 L1136 L1140 L1147 L1150 L1165	K1117-L1121 WeakPolarHBondContact O-CB 3.28Å; K1117-L1121 PolarHBondContact O-N 2.82Å; S1118-L1121 WeakPolarHBondContact O-CB 3.37Å; S1118-L1121 PolarHBondContact O-N 2.76Å; K1119-L1121 VanDerWaalsContact C-N 3.32Å; L1121-L1125 HydrophobicContact CD1-CD1 3.63Å; L1121-L1125 HydrophobicContact CD1-CG 4.16Å; L1121-L1125 HydrophobicContact CG-CD1 4.04Å; L1121-L1125 WeakPolarHBondContact O-CB 3.29Å; L1121-L1125 VanDerWaalsContact O-CG 3.27Å; L1121-L1125 WeakPolarHBondContact O-CG 3.48Å; L1121-L1125 PolarHBondContact O-N 3.37Å; L1121-L1125 VanDerWaalsContact O-N 3.14Å; L1121-L1136 HydrophobicContact CD1-CD1 3.71Å; L1121-L1136 HydrophobicContact CD1-CD2 3.7Å; L1121-L1136 HydrophobicContact CD1-CG 4.14Å; L1121-L1140 HydrophobicContact CB-CD1 4.35Å; L1121-L1140 HydrophobicContact CD1-CD1 4.16Å; L1121-L1147 HydrophobicContact CD1-CD1 4.32Å; L1121-L1147 HydrophobicContact CD2-CD1 3.99Å; L1121-L1150 HydrophobicContact CD2-CB 3.65Å; L1121-L1165 HydrophobicContact CD2-CD1 4.44Å
1122	S	88.6	Confident	84.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.2	-47.3	179.1	53.7	0	0	0	0	112.7	S1118 K1119 Y1124 L1125 R1126 H1157 Y1160	S1118-S1122 PolarHBondContact O-N 3.38Å; S1118-S1122 PolarHBondContact O-OG 3.06Å; K1119-S1122 WeakPolarHBondContact CA-OG 3.43Å; K1119-S1122 PolarHBondContact O-N 2.91Å; K1119-S1122 PolarHBondContact O-OG 3.13Å; S1122-Y1124 VanDerWaalsContact C-N 3.35Å; S1122-Y1124 PolarHBondContact O-N 2.96Å; S1122-L1125 PolarHBondContact O-N 2.98Å; S1122-R1126 PolarHBondContact O-N 2.96Å; S1122-R1126 VanDerWaalsContact O-N 3.16Å; S1122-H1157 WeakPolarHBondContact CB-NE2 3.06Å; S1122-H1157 PolarHBondContact OG-NE2 2.83Å; S1122-Y1160 PolarHBondContact O-OH 3Å; S1122-Y1160 VanDerWaalsContact O-OH 3.06Å
1123	E	87.6	Confident	83.7	Confident	87 Å²	87	65.9 Å²	65.9	41%	0.407	32%	0.32	S	S	.	.	H	α-helix	trans	-67.8	-33.1	179.9	-66.9	-65.8	168	0	0	112.3	K1119 R1126	K1119-E1123 PolarHBondContact O-N 2.83Å; E1123-R1126 VanDerWaalsContact CD-NH1 3.31Å; E1123-R1126 WeakPolarHBondContact O-CB 3.46Å; E1123-R1126 PolarHBondContact O-N 3.38Å; E1123-R1126 IonicContact OE1-NH1 3.12Å; E1123-R1126 PolarHBondContact OE1-NH1 2.89Å; E1123-R1126 VanDerWaalsContact OE1-NH1 3.09Å; E1123-R1126 WeakPolarHBondContact OE2-CD 3.37Å; E1123-R1126 IonicContact OE2-CZ 3.09Å; E1123-R1126 IonicContact OE2-NE 3.78Å; E1123-R1126 IonicContact OE2-NH1 3.18Å; E1123-R1126 PolarHBondContact OE2-NH1 3.3Å
1124	Y	86.1	Confident	83	Confident	59 Å²	59	70.7 Å²	70.7	23%	0.231	34%	0.34	C	S	.	.	H	α-helix	trans	-66.3	-36.8	173.2	-177.2	-95.4	0	0	0	112.8	M1120 S1122 R1126 Q1128 V1131 L1136 V1139 L1140	M1120-Y1124 VanDerWaalsContact O-CB 3.3Å; M1120-Y1124 WeakPolarHBondContact O-CB 3.37Å; M1120-Y1124 PolarHBondContact O-N 2.91Å; S1122-Y1124 VanDerWaalsContact C-N 3.35Å; S1122-Y1124 PolarHBondContact O-N 2.96Å; Y1124-R1126 PolarHBondContact O-N 3.1Å; Y1124-Q1128 VanDerWaalsContact O-CD 3.27Å; Y1124-Q1128 PolarHBondContact O-NE2 3.04Å; Y1124-V1131 HydrophobicContact CE1-CG1 4.13Å; Y1124-V1131 HydrophobicContact CE1-CG2 4.36Å; Y1124-L1136 HydrophobicContact CD1-CD1 3.63Å; Y1124-L1136 HydrophobicContact CE1-CD1 3.88Å; Y1124-V1139 HydrophobicContact CD2-CG1 4.21Å; Y1124-V1139 HydrophobicContact CE2-CG1 3.67Å; Y1124-L1140 HydrophobicContact CD1-CD1 4.42Å; Y1124-L1140 HydrophobicContact CG-CD1 4.33Å; Y1124-L1140 HydrophobicContact CG-CD2 4.42Å
1125	L	83.9	Confident	82.3	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-77.4	-7.5	176.4	-67.9	171.1	0	0	0	113.4	L1121 S1122 G1127 Q1128 V1131 V1161 I1164 L1165	L1121-L1125 HydrophobicContact CD1-CD1 3.63Å; L1121-L1125 HydrophobicContact CD1-CG 4.16Å; L1121-L1125 HydrophobicContact CG-CD1 4.04Å; L1121-L1125 WeakPolarHBondContact O-CB 3.29Å; L1121-L1125 VanDerWaalsContact O-CG 3.27Å; L1121-L1125 WeakPolarHBondContact O-CG 3.48Å; L1121-L1125 PolarHBondContact O-N 3.37Å; L1121-L1125 VanDerWaalsContact O-N 3.14Å; S1122-L1125 PolarHBondContact O-N 2.98Å; L1125-G1127 PolarHBondContact O-N 3.43Å; L1125-Q1128 PolarHBondContact O-N 3Å; L1125-V1131 HydrophobicContact CD2-CB 4.06Å; L1125-V1131 HydrophobicContact CD2-CG2 3.46Å; L1125-V1131 VanDerWaalsContact CD2-CG2 3.46Å; L1125-V1161 HydrophobicContact CD1-CG1 3.83Å; L1125-I1164 HydrophobicContact CD2-CG2 4.32Å; L1125-L1165 HydrophobicContact CD1-CD1 3.65Å; L1125-L1165 HydrophobicContact CD1-CD2 4.08Å; L1125-L1165 HydrophobicContact CD1-CG 3.9Å
1126	R	82.7	Confident	81.7	Confident	161 Å²	161	75.3 Å²	75.3	61%	0.608	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	106.9	-177.1	-166.4	172.7	178.6	173.8	-0.2	110.7	S1122 E1123 Y1124 Y1160	S1122-R1126 PolarHBondContact O-N 2.96Å; S1122-R1126 VanDerWaalsContact O-N 3.16Å; E1123-R1126 VanDerWaalsContact CD-NH1 3.31Å; E1123-R1126 WeakPolarHBondContact O-CB 3.46Å; E1123-R1126 PolarHBondContact O-N 3.38Å; E1123-R1126 IonicContact OE1-NH1 3.12Å; E1123-R1126 PolarHBondContact OE1-NH1 2.89Å; E1123-R1126 VanDerWaalsContact OE1-NH1 3.09Å; E1123-R1126 WeakPolarHBondContact OE2-CD 3.37Å; E1123-R1126 IonicContact OE2-CZ 3.09Å; E1123-R1126 IonicContact OE2-NE 3.78Å; E1123-R1126 IonicContact OE2-NH1 3.18Å; E1123-R1126 PolarHBondContact OE2-NH1 3.3Å; Y1124-R1126 PolarHBondContact O-N 3.1Å; R1126-Y1160 HydrophobicContact CB-CE2 4.11Å; R1126-Y1160 HydrophobicContact CG-CE2 4.32Å
1127	G	72	Confident	81.2	Confident	80 Å²	80	72.2 Å²	72.2	83%	0.825	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	-7.4	-175.2	0	0	0	0	0	114.8	L1125	L1125-G1127 PolarHBondContact O-N 3.43Å
1128	Q	76	Confident	80.7	Confident	69 Å²	69	75.4 Å²	75.4	32%	0.322	38%	0.378	S	S	.	.			trans	-94.1	105.3	177.7	-59.7	-167.7	8	0	0	111	Y1124 L1125 R1130 V1131	Y1124-Q1128 VanDerWaalsContact O-CD 3.27Å; Y1124-Q1128 PolarHBondContact O-NE2 3.04Å; L1125-Q1128 PolarHBondContact O-N 3Å; Q1128-R1130 VanDerWaalsContact C-N 3.31Å; Q1128-R1130 PolarHBondContact O-N 3.23Å; Q1128-V1131 HydrophobicContact CB-CG2 3.91Å
1129	M	64.3	Low	80.1	Confident	148 Å²	148	79.2 Å²	79.2	73%	0.729	40%	0.402	S	S	*	.	S	Bend	trans	-65.8	-27.8	-175.7	-66	-168.5	79.8	0	0	114.7
1130	R	68.9	Low	79.7	Confident	162 Å²	162	78 Å²	78	61%	0.611	40%	0.398	S	S	*	.			trans	-156.1	123.6	178.8	-68.1	-169.9	173.3	118.3	1.5	110.6	Q1128	Q1128-R1130 VanDerWaalsContact C-N 3.31Å; Q1128-R1130 PolarHBondContact O-N 3.23Å
1131	V	73.3	Confident	79.3	Confident	34 Å²	34	75.5 Å²	75.5	21%	0.206	40%	0.403	C	S	.	.			trans	-114	149.6	174.6	-176.3	0	0	0	0	110.1	Y1124 L1125 Q1128 L1136	Y1124-V1131 HydrophobicContact CE1-CG1 4.13Å; Y1124-V1131 HydrophobicContact CE1-CG2 4.36Å; L1125-V1131 HydrophobicContact CD2-CB 4.06Å; L1125-V1131 HydrophobicContact CD2-CG2 3.46Å; L1125-V1131 VanDerWaalsContact CD2-CG2 3.46Å; Q1128-V1131 HydrophobicContact CB-CG2 3.91Å; V1131-L1136 HydrophobicContact CG1-CB 4.09Å; V1131-L1136 HydrophobicContact CG1-CD1 4.3Å
1132	H	77	Confident	79.1	Confident	117 Å²	117	76.1 Å²	76.1	54%	0.542	41%	0.406	S	S	.	.			trans	-86.8	132.1	172.8	-169.7	-110.2	0	0	0	111.4	K1134 E1135 L1136	H1132-K1134 PolarHBondContact O-N 3.09Å; H1132-E1135 HydrophobicContact CB-CB 4.27Å; H1132-E1135 PolarHBondContact N-OE2 2.98Å; H1132-E1135 WeakPolarHBondContact O-CB 3.38Å; H1132-E1135 PolarHBondContact O-N 3.15Å; H1132-L1136 PolarHBondContact O-N 3.47Å; H1132-L1136 VanDerWaalsContact O-N 3.13Å
1133	V	78.2	Confident	78.9	Confident	68 Å²	68	81 Å²	81	41%	0.412	43%	0.429	S	S	.	.	H	α-helix	trans	-55.5	-32	-174.4	178.5	0	0	0	0	113.4	G1137 L1147	V1133-G1137 PolarHBondContact O-N 3.46Å; V1133-L1147 HydrophobicContact CB-CD2 4.42Å; V1133-L1147 HydrophobicContact CG1-CD2 3.88Å; V1133-L1147 HydrophobicContact CG2-CD2 3.82Å
1134	K	78.4	Confident	78.7	Confident	162 Å²	162	80.8 Å²	80.8	70%	0.704	44%	0.437	S	S	*	.	H	α-helix	trans	-72.5	-32	176	-61	-171.5	-178.9	-174.4	0	113.9	H1132 V1138	H1132-K1134 PolarHBondContact O-N 3.09Å; K1134-V1138 WeakPolarHBondContact O-CG2 3.25Å; K1134-V1138 PolarHBondContact O-N 3.2Å
1135	E	79.1	Confident	78.7	Confident	100 Å²	100	79.3 Å²	79.3	47%	0.467	44%	0.435	S	S	.	.	H	α-helix	trans	-71.4	-47.7	178.7	172.7	179.4	-145.8	0	0	109.3	H1132 G1137 V1138 V1139	H1132-E1135 HydrophobicContact CB-CB 4.27Å; H1132-E1135 PolarHBondContact N-OE2 2.98Å; H1132-E1135 WeakPolarHBondContact O-CB 3.38Å; H1132-E1135 PolarHBondContact O-N 3.15Å; E1135-G1137 VanDerWaalsContact C-N 3.28Å; E1135-G1137 PolarHBondContact O-N 2.93Å; E1135-V1138 PolarHBondContact O-N 3.13Å; E1135-V1138 VanDerWaalsContact O-N 3.07Å; E1135-V1139 WeakPolarHBondContact O-CG2 3.33Å; E1135-V1139 PolarHBondContact O-N 2.98Å
1136	L	79.7	Confident	79	Confident	6 Å²	6	79.3 Å²	79.3	3%	0.031	44%	0.435	C	S	.	.	H	α-helix	trans	-53	-43.3	172.4	-167.9	72.8	0	0	0	112.7	L1121 Y1124 V1131 H1132 V1139 L1140 L1147	L1121-L1136 HydrophobicContact CD1-CD1 3.71Å; L1121-L1136 HydrophobicContact CD1-CD2 3.7Å; L1121-L1136 HydrophobicContact CD1-CG 4.14Å; Y1124-L1136 HydrophobicContact CD1-CD1 3.63Å; Y1124-L1136 HydrophobicContact CE1-CD1 3.88Å; V1131-L1136 HydrophobicContact CG1-CB 4.09Å; V1131-L1136 HydrophobicContact CG1-CD1 4.3Å; H1132-L1136 PolarHBondContact O-N 3.47Å; H1132-L1136 VanDerWaalsContact O-N 3.13Å; L1136-V1139 PolarHBondContact O-N 3.06Å; L1136-L1140 HydrophobicContact CD1-CD1 3.59Å; L1136-L1140 HydrophobicContact CD1-CG 4.36Å; L1136-L1140 HydrophobicContact CG-CD1 4.2Å; L1136-L1140 WeakPolarHBondContact O-CB 3.36Å; L1136-L1140 PolarHBondContact O-N 2.74Å; L1136-L1147 HydrophobicContact CD2-CD1 3.58Å; L1136-L1147 HydrophobicContact CD2-CD2 4.17Å
1137	G	79.9	Confident	79.3	Confident	22 Å²	22	72.7 Å²	72.7	23%	0.227	41%	0.412	C	S	.	.	H	α-helix	trans	-70.3	-28.5	178.5	0	0	0	0	0	114.8	V1133 E1135 G1141 I1142	V1133-G1137 PolarHBondContact O-N 3.46Å; E1135-G1137 VanDerWaalsContact C-N 3.28Å; E1135-G1137 PolarHBondContact O-N 2.93Å; G1137-G1141 VanDerWaalsContact O-CA 3.29Å; G1137-G1141 WeakPolarHBondContact O-CA 3.48Å; G1137-G1141 PolarHBondContact O-N 3.08Å; G1137-G1141 VanDerWaalsContact O-N 3.15Å; G1137-I1142 WeakPolarHBondContact CA-O 3.23Å; G1137-I1142 PolarHBondContact O-N 3.07Å
1138	V	80.6	Confident	80.1	Confident	127 Å²	127	71.8 Å²	71.8	77%	0.77	39%	0.391	S	S	*	.	H	α-helix	trans	-76.6	-40.9	173.3	170.3	0	0	0	0	111.3	K1134 E1135	K1134-V1138 WeakPolarHBondContact O-CG2 3.25Å; K1134-V1138 PolarHBondContact O-N 3.2Å; E1135-V1138 PolarHBondContact O-N 3.13Å; E1135-V1138 VanDerWaalsContact O-N 3.07Å
1139	V	79	Confident	80.9	Confident	80 Å²	80	68.5 Å²	68.5	49%	0.485	38%	0.376	S	S	.	.	H	α-helix	trans	-77.6	-37.8	-175.9	176.9	0	0	0	0	112.7	Y1124 E1135 L1136	Y1124-V1139 HydrophobicContact CD2-CG1 4.21Å; Y1124-V1139 HydrophobicContact CE2-CG1 3.67Å; E1135-V1139 WeakPolarHBondContact O-CG2 3.33Å; E1135-V1139 PolarHBondContact O-N 2.98Å; L1136-V1139 PolarHBondContact O-N 3.06Å
1140	L	80.5	Confident	82.2	Confident	37 Å²	37	61.5 Å²	61.5	19%	0.194	34%	0.342	C	S	.	.	H	α-helix	trans	-106.4	-4.2	-176	-58	-179.2	0	0	0	114.2	M1120 L1121 Y1124 L1136 I1142	M1120-L1140 HydrophobicContact CE-CD2 4.37Å; L1121-L1140 HydrophobicContact CB-CD1 4.35Å; L1121-L1140 HydrophobicContact CD1-CD1 4.16Å; Y1124-L1140 HydrophobicContact CD1-CD1 4.42Å; Y1124-L1140 HydrophobicContact CG-CD1 4.33Å; Y1124-L1140 HydrophobicContact CG-CD2 4.42Å; L1136-L1140 HydrophobicContact CD1-CD1 3.59Å; L1136-L1140 HydrophobicContact CD1-CG 4.36Å; L1136-L1140 HydrophobicContact CG-CD1 4.2Å; L1136-L1140 WeakPolarHBondContact O-CB 3.36Å; L1136-L1140 PolarHBondContact O-N 2.74Å; L1140-I1142 VanDerWaalsContact C-N 3.3Å; L1140-I1142 HydrophobicContact CB-CD1 3.6Å; L1140-I1142 HydrophobicContact CB-CG1 3.87Å; L1140-I1142 HydrophobicContact CD1-CD1 3.84Å; L1140-I1142 HydrophobicContact CG-CD1 4.39Å; L1140-I1142 PolarHBondContact O-N 3.35Å
1141	G	81.2	Confident	83.1	Confident	67 Å²	67	54 Å²	54	69%	0.691	31%	0.314	S	S	*	.			trans	66.1	29	-176.5	0	0	0	0	0	114.2	G1137	G1137-G1141 VanDerWaalsContact O-CA 3.29Å; G1137-G1141 WeakPolarHBondContact O-CA 3.48Å; G1137-G1141 PolarHBondContact O-N 3.08Å; G1137-G1141 VanDerWaalsContact O-N 3.15Å
1142	I	83.7	Confident	83.9	Confident	13 Å²	13	52.5 Å²	52.5	7%	0.067	31%	0.306	C	S	.	.			trans	-102.5	131	-175.4	-66.2	171	0	0	0	109.9	G1137 L1140 D1146 L1150	G1137-I1142 WeakPolarHBondContact CA-O 3.23Å; G1137-I1142 PolarHBondContact O-N 3.07Å; L1140-I1142 VanDerWaalsContact C-N 3.3Å; L1140-I1142 HydrophobicContact CB-CD1 3.6Å; L1140-I1142 HydrophobicContact CB-CG1 3.87Å; L1140-I1142 HydrophobicContact CD1-CD1 3.84Å; L1140-I1142 HydrophobicContact CG-CD1 4.39Å; L1140-I1142 PolarHBondContact O-N 3.35Å; I1142-D1146 HydrophobicContact CG2-CB 4.14Å; I1142-L1150 HydrophobicContact CD1-CD1 3.74Å; I1142-L1150 HydrophobicContact CG1-CD1 3.96Å; I1142-L1150 HydrophobicContact CG2-CD1 3.77Å
1143	E	85.2	Confident	84.6	Confident	101 Å²	101	47 Å²	47	47%	0.472	28%	0.28	S	S	.	.			trans	-78.9	152.5	173.4	-61.5	-172.1	159.2	0	0	112.1	S1081 S1145 D1146 L1147	S1081-E1143 WeakPolarHBondContact CB-OE2 3.41Å; S1081-E1143 PolarHBondContact OG-OE2 2.96Å; E1143-S1145 VanDerWaalsContact CB-OG 3.24Å; E1143-S1145 WeakPolarHBondContact CB-OG 3.42Å; E1143-S1145 PolarHBondContact O-N 3.31Å; E1143-S1145 PolarHBondContact OE2-OG 2.71Å; E1143-D1146 WeakPolarHBondContact CB-OD2 3.46Å; E1143-D1146 PolarHBondContact N-OD2 3.43Å; E1143-D1146 PolarHBondContact O-N 3.37Å; E1143-L1147 PolarHBondContact O-N 3.22Å
1144	S	83.6	Confident	85.1	Confident	84 Å²	84	43.7 Å²	43.7	59%	0.587	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.6	176.1	55.7	0	0	0	0	114
1145	S	86.6	Confident	85.6	Confident	27 Å²	27	36.1 Å²	36.1	19%	0.189	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-39.6	171.4	0.7	0	0	0	0	112.3	V1079 E1143 P1148	V1079-S1145 WeakPolarHBondContact O-CB 3.36Å; E1143-S1145 VanDerWaalsContact CB-OG 3.24Å; E1143-S1145 WeakPolarHBondContact CB-OG 3.42Å; E1143-S1145 PolarHBondContact O-N 3.31Å; E1143-S1145 PolarHBondContact OE2-OG 2.71Å; S1145-P1148 WeakPolarHBondContact O-CD 3.4Å
1146	D	89.3	Confident	86	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-24	-174.9	-52.8	-51	0	0	0	112.6	S1080 S1081 L1082 I1142 E1143 P1148 L1149 L1150	S1080-D1146 VanDerWaalsContact CA-OD1 3.24Å; S1080-D1146 WeakPolarHBondContact CA-OD1 3.46Å; S1080-D1146 VanDerWaalsContact CB-OD1 3.22Å; S1080-D1146 WeakPolarHBondContact CB-OD1 3.44Å; S1080-D1146 PolarHBondContact OG-OD1 3.19Å; S1081-D1146 PolarHBondContact N-OD1 3.49Å; S1081-D1146 PolarHBondContact OG-OD2 2.94Å; L1082-D1146 HydrophobicContact CD1-CB 3.92Å; L1082-D1146 HydrophobicContact CG-CB 4.43Å; L1082-D1146 PolarHBondContact N-OD1 3.18Å; I1142-D1146 HydrophobicContact CG2-CB 4.14Å; E1143-D1146 WeakPolarHBondContact CB-OD2 3.46Å; E1143-D1146 PolarHBondContact N-OD2 3.43Å; E1143-D1146 PolarHBondContact O-N 3.37Å; D1146-P1148 VanDerWaalsContact C-CD 3.44Å; D1146-L1149 WeakPolarHBondContact O-CB 3.3Å; D1146-L1149 PolarHBondContact O-N 3.44Å; D1146-L1150 HydrophobicContact CB-CD1 4.22Å; D1146-L1150 PolarHBondContact O-N 3.05Å
1147	L	88.2	Confident	86.2	Confident	21 Å²	21	32.8 Å²	32.8	11%	0.11	21%	0.213	C	C	.	.	H	α-helix	trans	-51.6	-41.7	-175.5	-177.9	59.1	0	0	0	114.3	L1121 V1133 L1136 E1143 L1149 L1150 A1151 L1165	L1121-L1147 HydrophobicContact CD1-CD1 4.32Å; L1121-L1147 HydrophobicContact CD2-CD1 3.99Å; V1133-L1147 HydrophobicContact CB-CD2 4.42Å; V1133-L1147 HydrophobicContact CG1-CD2 3.88Å; V1133-L1147 HydrophobicContact CG2-CD2 3.82Å; L1136-L1147 HydrophobicContact CD2-CD1 3.58Å; L1136-L1147 HydrophobicContact CD2-CD2 4.17Å; E1143-L1147 PolarHBondContact O-N 3.22Å; L1147-L1149 VanDerWaalsContact C-N 3.34Å; L1147-L1149 PolarHBondContact O-N 3.21Å; L1147-L1150 PolarHBondContact O-N 3.21Å; L1147-A1151 WeakPolarHBondContact O-CB 3.44Å; L1147-A1151 PolarHBondContact O-N 3.23Å; L1147-L1165 HydrophobicContact CD1-CD1 4.14Å
1148	P	89.5	Confident	86.4	Confident	61 Å²	61	32.2 Å²	32.2	40%	0.396	21%	0.205	S	C	.	.	H	α-helix	trans	-63.4	-37.5	177.1	-21.9	34.5	0	0	0	113.4	S1145 D1146 A1152	S1145-P1148 WeakPolarHBondContact O-CD 3.4Å; D1146-P1148 VanDerWaalsContact C-CD 3.44Å; P1148-A1152 WeakPolarHBondContact O-CB 3.48Å; P1148-A1152 PolarHBondContact O-N 3.18Å; P1148-A1152 VanDerWaalsContact O-N 3.12Å
1149	L	92.2	Very high	86.3	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-68	-52.4	176.7	170.5	61.6	0	0	0	110.1	L460 W466 V1083 L1114 D1146 L1147 A1151 A1152 V1153	L460-L1149 HydrophobicContact CB-CD1 3.67Å; W466-L1149 HydrophobicContact CZ2-CD1 4.49Å; V1083-L1149 HydrophobicContact CG2-CD2 3.54Å; L1114-L1149 HydrophobicContact CD1-CD2 4.36Å; D1146-L1149 WeakPolarHBondContact O-CB 3.3Å; D1146-L1149 PolarHBondContact O-N 3.44Å; L1147-L1149 VanDerWaalsContact C-N 3.34Å; L1147-L1149 PolarHBondContact O-N 3.21Å; L1149-A1151 VanDerWaalsContact C-N 3.3Å; L1149-A1151 PolarHBondContact O-N 3.05Å; L1149-A1152 PolarHBondContact O-N 3.42Å; L1149-A1152 VanDerWaalsContact O-N 3.15Å; L1149-V1153 HydrophobicContact CD1-CG2 4.33Å; L1149-V1153 WeakPolarHBondContact O-CG2 3.33Å; L1149-V1153 PolarHBondContact O-N 2.94Å
1150	L	91.6	Very high	86.2	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.3	-31	-178.9	-63.2	177.6	0	0	0	112.5	L1082 L1114 K1117 S1118 L1121 I1142 D1146 L1147 A1154	L1082-L1150 HydrophobicContact CD1-CD1 4.11Å; L1114-L1150 HydrophobicContact CD2-CD2 4.24Å; L1114-L1150 WeakPolarHBondContact O-CD2 3.42Å; K1117-L1150 HydrophobicContact CB-CD1 4.4Å; K1117-L1150 HydrophobicContact CB-CD2 4.16Å; S1118-L1150 WeakPolarHBondContact CB-O 3.41Å; L1121-L1150 HydrophobicContact CD2-CB 3.65Å; I1142-L1150 HydrophobicContact CD1-CD1 3.74Å; I1142-L1150 HydrophobicContact CG1-CD1 3.96Å; I1142-L1150 HydrophobicContact CG2-CD1 3.77Å; D1146-L1150 HydrophobicContact CB-CD1 4.22Å; D1146-L1150 PolarHBondContact O-N 3.05Å; L1147-L1150 PolarHBondContact O-N 3.21Å; L1150-A1154 WeakPolarHBondContact O-CB 3.38Å; L1150-A1154 PolarHBondContact O-N 2.94Å
1151	A	89.4	Confident	85.9	Confident	4 Å²	4	26.2 Å²	26.2	3%	0.033	16%	0.164	C	C	.	.	H	α-helix	trans	-67.7	-39.5	172.1	0	0	0	0	0	112.5	L1147 L1149 A1154 S1155 L1165	L1147-A1151 WeakPolarHBondContact O-CB 3.44Å; L1147-A1151 PolarHBondContact O-N 3.23Å; L1149-A1151 VanDerWaalsContact C-N 3.3Å; L1149-A1151 PolarHBondContact O-N 3.05Å; A1151-A1154 PolarHBondContact O-N 3.32Å; A1151-S1155 PolarHBondContact O-N 2.86Å; A1151-L1165 HydrophobicContact CB-CB 4.26Å; A1151-L1165 HydrophobicContact CB-CD1 3.54Å
1152	A	89.6	Confident	85.2	Confident	4 Å²	4	23.4 Å²	23.4	3%	0.033	13%	0.134	C	C	.	.	H	α-helix	trans	-67.6	-41.8	176.5	0	0	0	0	0	111.7	T461 L464 P1148 L1149 S1155	T461-A1152 HydrophobicContact CG2-CB 3.94Å; T461-A1152 VanDerWaalsContact O-CB 3.23Å; T461-A1152 WeakPolarHBondContact O-CB 3.39Å; L464-A1152 HydrophobicContact CD2-CB 4.05Å; P1148-A1152 WeakPolarHBondContact O-CB 3.48Å; P1148-A1152 PolarHBondContact O-N 3.18Å; P1148-A1152 VanDerWaalsContact O-N 3.12Å; L1149-A1152 PolarHBondContact O-N 3.42Å; L1149-A1152 VanDerWaalsContact O-N 3.15Å; A1152-S1155 WeakPolarHBondContact O-CB 3.34Å; A1152-S1155 PolarHBondContact O-N 3.35Å; A1152-S1155 PolarHBondContact O-OG 3.42Å
1153	V	91.4	Very high	84.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-43	172.3	-177	0	0	0	0	111	W466 V467 Y1115 S1118 L1149 S1155 T1156 H1157	W466-V1153 HydrophobicContact CH2-CG1 4.42Å; W466-V1153 HydrophobicContact CH2-CG2 3.77Å; W466-V1153 HydrophobicContact CZ2-CG2 3.39Å; V467-V1153 HydrophobicContact CG1-CG1 3.83Å; V467-V1153 HydrophobicContact CG2-CB 4.37Å; V467-V1153 HydrophobicContact CG2-CG1 3.81Å; V467-V1153 HydrophobicContact CG2-CG2 4.07Å; Y1115-V1153 HydrophobicContact CD2-CG1 4.31Å; S1118-V1153 WeakPolarHBondContact OG-CG1 3.38Å; L1149-V1153 HydrophobicContact CD1-CG2 4.33Å; L1149-V1153 WeakPolarHBondContact O-CG2 3.33Å; L1149-V1153 PolarHBondContact O-N 2.94Å; V1153-S1155 PolarHBondContact O-N 2.83Å; V1153-S1155 VanDerWaalsContact O-N 3.14Å; V1153-T1156 PolarHBondContact O-N 3.15Å; V1153-T1156 PolarHBondContact O-OG1 3.11Å; V1153-H1157 VanDerWaalsContact C-CE1 3.47Å; V1153-H1157 PolarHBondContact O-CE1 3.03Å; V1153-H1157 VanDerWaalsContact O-CE1 3.27Å; V1153-H1157 PolarHBondContact O-ND1 3.37Å
1154	A	89.4	Confident	83.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-58.1	-29	174.3	0	0	0	0	0	113.1	L1150 A1151 T1156 H1157 S1158 V1161	L1150-A1154 WeakPolarHBondContact O-CB 3.38Å; L1150-A1154 PolarHBondContact O-N 2.94Å; A1151-A1154 PolarHBondContact O-N 3.32Å; A1154-T1156 VanDerWaalsContact C-N 3.3Å; A1154-T1156 PolarHBondContact O-N 3.16Å; A1154-H1157 WeakPolarHBondContact CA-CE1 3.43Å; A1154-H1157 PolarHBondContact N-CE1 2.98Å; A1154-S1158 CarbonylContact O-C 3.52Å; A1154-S1158 WeakPolarHBondContact O-CA 3.48Å; A1154-S1158 WeakPolarHBondContact O-CB 3.48Å; A1154-S1158 PolarHBondContact O-N 3.09Å; A1154-V1161 HydrophobicContact CB-CB 4.24Å; A1154-V1161 HydrophobicContact CB-CG1 3.82Å; A1154-V1161 HydrophobicContact CB-CG2 4.37Å
1155	S	88.5	Confident	82.1	Confident	3 Å²	3	27 Å²	27	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-70.3	-19	-178.8	84.6	0	0	0	0	115	S515 A1151 A1152 V1153	S515-S1155 PolarHBondContact N-O 3.06Å; S515-S1155 VanDerWaalsContact O-CB 3.31Å; S515-S1155 WeakPolarHBondContact O-CB 3.35Å; A1151-S1155 PolarHBondContact O-N 2.86Å; A1152-S1155 WeakPolarHBondContact O-CB 3.34Å; A1152-S1155 PolarHBondContact O-N 3.35Å; A1152-S1155 PolarHBondContact O-OG 3.42Å; V1153-S1155 PolarHBondContact O-N 2.83Å; V1153-S1155 VanDerWaalsContact O-N 3.14Å
1156	T	86.2	Confident	80.5	Confident	9 Å²	9	31.6 Å²	31.6	6%	0.055	17%	0.166	C	C	.	.	H	α-helix	trans	-80.8	-35.6	180	62.9	0	0	0	0	112.3	L464 I513 V1153 A1154	L464-T1156 HydrophobicContact CB-CG2 3.96Å; L464-T1156 HydrophobicContact CD1-CG2 3.93Å; L464-T1156 HydrophobicContact CD2-CG2 4.47Å; L464-T1156 HydrophobicContact CG-CG2 4.34Å; I513-T1156 HydrophobicContact CG2-CG2 4.09Å; V1153-T1156 PolarHBondContact O-N 3.15Å; V1153-T1156 PolarHBondContact O-OG1 3.11Å; A1154-T1156 VanDerWaalsContact C-N 3.3Å; A1154-T1156 PolarHBondContact O-N 3.16Å
1157	H	84.5	Confident	80.1	Confident	27 Å²	27	33.1 Å²	33.1	13%	0.125	17%	0.174	C	C	.	.	H	α-helix	trans	-107.8	-14.4	-179.1	63.1	-92.9	0	0	0	114.4	I478 Y1115 S1118 K1119 S1122 V1153 A1154	I478-H1157 HydrophobicContact CD1-CB 4.23Å; Y1115-H1157 AromaticContact CE2-ND1 3.66Å; S1118-H1157 WeakPolarHBondContact CB-CE1 3.48Å; S1118-H1157 PolarHBondContact O-NE2 3.06Å; S1118-H1157 VanDerWaalsContact O-NE2 3.1Å; S1118-H1157 PolarHBondContact OG-CE1 3.3Å; K1119-H1157 WeakPolarHBondContact CA-NE2 3.25Å; K1119-H1157 PolarHBondContact N-NE2 3.08Å; S1122-H1157 WeakPolarHBondContact CB-NE2 3.06Å; S1122-H1157 PolarHBondContact OG-NE2 2.83Å; V1153-H1157 VanDerWaalsContact C-CE1 3.47Å; V1153-H1157 PolarHBondContact O-CE1 3.03Å; V1153-H1157 VanDerWaalsContact O-CE1 3.27Å; V1153-H1157 PolarHBondContact O-ND1 3.37Å; A1154-H1157 WeakPolarHBondContact CA-CE1 3.43Å; A1154-H1157 PolarHBondContact N-CE1 2.98Å
1158	S	83.9	Confident	79.7	Confident	10 Å²	10	33.7 Å²	33.7	7%	0.07	18%	0.177	C	C	.	.			trans	-139.1	77.6	-178.5	-81.2	0	0	0	0	111.6	A1154 Y1160 V1161	A1154-S1158 CarbonylContact O-C 3.52Å; A1154-S1158 WeakPolarHBondContact O-CA 3.48Å; A1154-S1158 WeakPolarHBondContact O-CB 3.48Å; A1154-S1158 PolarHBondContact O-N 3.09Å; S1158-Y1160 VanDerWaalsContact CB-CE1 3.46Å; S1158-Y1160 PolarHBondContact O-N 2.83Å; S1158-Y1160 WeakPolarHBondContact OG-CE1 3.4Å; S1158-Y1160 PolarHBondContact OG-OH 3.31Å; S1158-V1161 WeakPolarHBondContact O-CB 3.34Å; S1158-V1161 WeakPolarHBondContact O-CG2 3.39Å; S1158-V1161 PolarHBondContact O-N 3.13Å
1159	P	77.9	Confident	79.1	Confident	50 Å²	50	32.2 Å²	32.2	33%	0.325	17%	0.165	S	C	.	.	H	α-helix	trans	-65.2	-11.5	-171.8	25.9	-36	0	0	0	114.9	I480 V1161	I480-P1159 HydrophobicContact CD1-CG 3.98Å; P1159-V1161 VanDerWaalsContact C-N 3.34Å
1160	Y	77	Confident	78.4	Confident	67 Å²	67	34.1 Å²	34.1	26%	0.263	18%	0.175	S	C	.	.	H	α-helix	trans	-70.7	-29.1	170.6	61.9	-89.7	0	0	0	112.5	S1122 R1126 S1158 A1162 Q1163 I1164	S1122-Y1160 PolarHBondContact O-OH 3Å; S1122-Y1160 VanDerWaalsContact O-OH 3.06Å; R1126-Y1160 HydrophobicContact CB-CE2 4.11Å; R1126-Y1160 HydrophobicContact CG-CE2 4.32Å; S1158-Y1160 VanDerWaalsContact CB-CE1 3.46Å; S1158-Y1160 PolarHBondContact O-N 2.83Å; S1158-Y1160 WeakPolarHBondContact OG-CE1 3.4Å; S1158-Y1160 PolarHBondContact OG-OH 3.31Å; Y1160-A1162 VanDerWaalsContact C-N 3.26Å; Y1160-A1162 PolarHBondContact O-N 3.09Å; Y1160-Q1163 WeakPolarHBondContact O-CB 3.31Å; Y1160-Q1163 PolarHBondContact O-N 3.39Å; Y1160-Q1163 VanDerWaalsContact O-N 3.11Å; Y1160-I1164 HydrophobicContact CD2-CD1 4.3Å
1161	V	74.6	Confident	77.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.5	-35.2	178.9	177.6	0	0	0	0	111.1	L1125 A1154 S1158 P1159 Q1163 I1164 L1165	L1125-V1161 HydrophobicContact CD1-CG1 3.83Å; A1154-V1161 HydrophobicContact CB-CB 4.24Å; A1154-V1161 HydrophobicContact CB-CG1 3.82Å; A1154-V1161 HydrophobicContact CB-CG2 4.37Å; S1158-V1161 WeakPolarHBondContact O-CB 3.34Å; S1158-V1161 WeakPolarHBondContact O-CG2 3.39Å; S1158-V1161 PolarHBondContact O-N 3.13Å; P1159-V1161 VanDerWaalsContact C-N 3.34Å; V1161-Q1163 VanDerWaalsContact C-N 3.26Å; V1161-Q1163 PolarHBondContact O-N 2.96Å; V1161-I1164 PolarHBondContact O-N 3.2Å; V1161-L1165 HydrophobicContact CG1-CD1 3.67Å; V1161-L1165 HydrophobicContact CG1-CG 4.06Å; V1161-L1165 PolarHBondContact O-N 2.81Å
1162	A	66.3	Low	76.7	Confident	8 Å²	8	38.3 Å²	38.3	7%	0.066	20%	0.196	C	C	.	.	H	α-helix	trans	-56.9	-40.1	174.2	0	0	0	0	0	112.2	S515 Y1160 I1164 L1166	S515-A1162 WeakPolarHBondContact O-CB 3.32Å; Y1160-A1162 VanDerWaalsContact C-N 3.26Å; Y1160-A1162 PolarHBondContact O-N 3.09Å; A1162-I1164 PolarHBondContact O-N 2.79Å; A1162-L1166 HydrophobicContact CB-CD1 4.1Å; A1162-L1166 WeakPolarHBondContact O-CB 3.45Å; A1162-L1166 PolarHBondContact O-N 3.17Å
1163	Q	63.6	Low	75.8	Confident	169 Å²	169	40.8 Å²	40.8	79%	0.79	21%	0.207	S	C	*	.	H	α-helix	trans	-71.3	-11.4	179.2	-54.7	-178.9	8.2	0	0	113.6	Y1160 V1161	Y1160-Q1163 WeakPolarHBondContact O-CB 3.31Å; Y1160-Q1163 PolarHBondContact O-N 3.39Å; Y1160-Q1163 VanDerWaalsContact O-N 3.11Å; V1161-Q1163 VanDerWaalsContact C-N 3.26Å; V1161-Q1163 PolarHBondContact O-N 2.96Å
1164	I	62.4	Low	74.6	Confident	49 Å²	49	43.9 Å²	43.9	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-105.9	-31	-176.9	-59.9	165.5	0	0	0	111.1	L1125 Y1160 V1161 A1162	L1125-I1164 HydrophobicContact CD2-CG2 4.32Å; Y1160-I1164 HydrophobicContact CD2-CD1 4.3Å; V1161-I1164 PolarHBondContact O-N 3.2Å; A1162-I1164 PolarHBondContact O-N 2.79Å
1165	L	61.2	Low	73.4	Confident	57 Å²	57	47.6 Å²	47.6	30%	0.298	24%	0.242	S	C	.	.	H	α-helix	trans	-115.6	-16.4	-172.4	-62.4	-171.9	0	0	0	116.4	L1121 L1125 L1147 A1151 V1161	L1121-L1165 HydrophobicContact CD2-CD1 4.44Å; L1125-L1165 HydrophobicContact CD1-CD1 3.65Å; L1125-L1165 HydrophobicContact CD1-CD2 4.08Å; L1125-L1165 HydrophobicContact CD1-CG 3.9Å; L1147-L1165 HydrophobicContact CD1-CD1 4.14Å; A1151-L1165 HydrophobicContact CB-CB 4.26Å; A1151-L1165 HydrophobicContact CB-CD1 3.54Å; V1161-L1165 HydrophobicContact CG1-CD1 3.67Å; V1161-L1165 HydrophobicContact CG1-CG 4.06Å; V1161-L1165 PolarHBondContact O-N 2.81Å
1166	L	54.5	Low	72	Confident	122 Å²	122	51.6 Å²	51.6	64%	0.639	26%	0.262	S	S	*	.			trans	-113.5	0	-174.8	-60.8	177.4	0	0	0	113	A1162	A1162-L1166 HydrophobicContact CB-CD1 4.1Å; A1162-L1166 WeakPolarHBondContact O-CB 3.45Å; A1162-L1166 PolarHBondContact O-N 3.17Å

Retrieved 1,166 of 1,166 residues in 249.1 ms (Link to these results)

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